USER MOD reduce.3.24.130724 H: found=0, std=0, add=329, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 330 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 Single : A 421 SER OG : rot 180:sc= 0 USER MOD Single : A 423 MET CE :methyl -167:sc= -0.0387 (180deg=-0.285) USER MOD Single : A 433 MET CE :methyl -164:sc= -0.0988 (180deg=-0.501) USER MOD Single : A 434 THR OG1 : rot 63:sc= 1.28 USER MOD Single : A 436 GLN : amide:sc=-0.00819 X(o=-0.0082,f=0) USER MOD Single : A 464 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 467 GLN : amide:sc= -0.0125 X(o=-0.012,f=-0.36) USER MOD Single : A 473 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 477 HIS : no HD1:sc= -0.111 X(o=-0.11,f=0) USER MOD Single : A 482 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 483 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 GLN : amide:sc= 0.21 X(o=0.21,f=0) USER MOD ----------------------------------------------------------------- ATOM 113 N GLU A 419 -26.241 -74.318 -21.159 1.00 25.00 N ATOM 114 CA GLU A 419 -26.462 -73.041 -20.479 1.00 25.00 C ATOM 115 C GLU A 419 -26.002 -71.923 -21.401 1.00 25.00 C ATOM 116 O GLU A 419 -26.648 -70.899 -21.530 1.00 25.00 O ATOM 117 CB GLU A 419 -25.657 -72.981 -19.171 1.00 25.00 C ATOM 118 CG GLU A 419 -26.036 -74.049 -18.149 1.00 25.00 C ATOM 119 CD GLU A 419 -25.062 -74.089 -16.972 1.00 25.00 C ATOM 120 OE1 GLU A 419 -24.172 -74.980 -16.961 1.00 25.00 O ATOM 121 OE2 GLU A 419 -25.172 -73.239 -16.073 1.00 25.00 O ATOM 0 HA GLU A 419 -27.520 -72.935 -20.241 1.00 25.00 H new ATOM 0 HB2 GLU A 419 -24.597 -73.080 -19.406 1.00 25.00 H new ATOM 0 HB3 GLU A 419 -25.793 -71.998 -18.719 1.00 25.00 H new ATOM 0 HG2 GLU A 419 -27.043 -73.855 -17.779 1.00 25.00 H new ATOM 0 HG3 GLU A 419 -26.057 -75.024 -18.635 1.00 25.00 H new ATOM 128 N VAL A 420 -24.872 -72.141 -22.055 1.00 25.00 N ATOM 129 CA VAL A 420 -24.298 -71.150 -22.964 1.00 25.00 C ATOM 130 C VAL A 420 -25.125 -71.050 -24.251 1.00 25.00 C ATOM 131 O VAL A 420 -25.161 -70.013 -24.902 1.00 25.00 O ATOM 132 CB VAL A 420 -22.810 -71.489 -23.260 1.00 25.00 C ATOM 133 CG1 VAL A 420 -22.158 -70.435 -24.170 1.00 25.00 C ATOM 134 CG2 VAL A 420 -22.037 -71.552 -21.935 1.00 25.00 C ATOM 0 H VAL A 420 -24.328 -73.000 -21.975 1.00 25.00 H new ATOM 0 HA VAL A 420 -24.328 -70.172 -22.483 1.00 25.00 H new ATOM 0 HB VAL A 420 -22.777 -72.450 -23.774 1.00 25.00 H new ATOM 0 HG11 VAL A 420 -21.119 -70.706 -24.354 1.00 25.00 H new ATOM 0 HG12 VAL A 420 -22.695 -70.390 -25.118 1.00 25.00 H new ATOM 0 HG13 VAL A 420 -22.198 -69.460 -23.684 1.00 25.00 H new ATOM 0 HG21 VAL A 420 -20.992 -71.789 -22.134 1.00 25.00 H new ATOM 0 HG22 VAL A 420 -22.100 -70.588 -21.431 1.00 25.00 H new ATOM 0 HG23 VAL A 420 -22.469 -72.324 -21.298 1.00 25.00 H new ATOM 144 N SER A 421 -25.816 -72.119 -24.612 1.00 25.00 N ATOM 145 CA SER A 421 -26.670 -72.087 -25.797 1.00 25.00 C ATOM 146 C SER A 421 -27.845 -71.144 -25.554 1.00 25.00 C ATOM 147 O SER A 421 -28.244 -70.398 -26.441 1.00 25.00 O ATOM 148 CB SER A 421 -27.190 -73.485 -26.124 1.00 25.00 C ATOM 149 OG SER A 421 -26.114 -74.378 -26.374 1.00 25.00 O ATOM 0 H SER A 421 -25.806 -73.009 -24.113 1.00 25.00 H new ATOM 0 HA SER A 421 -26.082 -71.730 -26.642 1.00 25.00 H new ATOM 0 HB2 SER A 421 -27.792 -73.857 -25.295 1.00 25.00 H new ATOM 0 HB3 SER A 421 -27.842 -73.441 -26.997 1.00 25.00 H new ATOM 0 HG SER A 421 -26.469 -75.268 -26.580 1.00 25.00 H new ATOM 155 N ASP A 422 -28.383 -71.173 -24.343 1.00 25.00 N ATOM 156 CA ASP A 422 -29.489 -70.285 -23.975 1.00 25.00 C ATOM 157 C ASP A 422 -28.946 -68.880 -23.743 1.00 25.00 C ATOM 158 O ASP A 422 -29.606 -67.886 -24.014 1.00 25.00 O ATOM 159 CB ASP A 422 -30.179 -70.808 -22.714 1.00 25.00 C ATOM 160 CG ASP A 422 -31.575 -70.237 -22.533 1.00 25.00 C ATOM 161 OD1 ASP A 422 -32.254 -69.977 -23.552 1.00 25.00 O ATOM 162 OD2 ASP A 422 -32.002 -70.066 -21.373 1.00 25.00 O ATOM 0 H ASP A 422 -28.077 -71.798 -23.597 1.00 25.00 H new ATOM 0 HA ASP A 422 -30.222 -70.256 -24.781 1.00 25.00 H new ATOM 0 HB2 ASP A 422 -30.238 -71.895 -22.761 1.00 25.00 H new ATOM 0 HB3 ASP A 422 -29.573 -70.559 -21.843 1.00 25.00 H new ATOM 167 N MET A 423 -27.713 -68.811 -23.263 1.00 25.00 N ATOM 168 CA MET A 423 -27.035 -67.535 -23.039 1.00 25.00 C ATOM 169 C MET A 423 -26.910 -66.785 -24.365 1.00 25.00 C ATOM 170 O MET A 423 -27.084 -65.581 -24.422 1.00 25.00 O ATOM 171 CB MET A 423 -25.651 -67.780 -22.441 1.00 25.00 C ATOM 172 CG MET A 423 -25.008 -66.578 -21.785 1.00 25.00 C ATOM 173 SD MET A 423 -23.312 -66.976 -21.246 1.00 25.00 S ATOM 174 CE MET A 423 -23.581 -68.245 -19.945 1.00 25.00 C ATOM 0 H MET A 423 -27.155 -69.629 -23.018 1.00 25.00 H new ATOM 0 HA MET A 423 -27.617 -66.933 -22.341 1.00 25.00 H new ATOM 0 HB2 MET A 423 -25.728 -68.578 -21.703 1.00 25.00 H new ATOM 0 HB3 MET A 423 -24.991 -68.139 -23.230 1.00 25.00 H new ATOM 0 HG2 MET A 423 -24.987 -65.742 -22.485 1.00 25.00 H new ATOM 0 HG3 MET A 423 -25.603 -66.262 -20.928 1.00 25.00 H new ATOM 0 HE1 MET A 423 -22.657 -68.395 -19.387 1.00 25.00 H new ATOM 0 HE2 MET A 423 -24.365 -67.909 -19.266 1.00 25.00 H new ATOM 0 HE3 MET A 423 -23.881 -69.184 -20.409 1.00 25.00 H new ATOM 184 N ALA A 424 -26.624 -67.509 -25.437 1.00 25.00 N ATOM 185 CA ALA A 424 -26.510 -66.903 -26.759 1.00 25.00 C ATOM 186 C ALA A 424 -27.875 -66.404 -27.258 1.00 25.00 C ATOM 187 O ALA A 424 -27.958 -65.416 -27.988 1.00 25.00 O ATOM 188 CB ALA A 424 -25.923 -67.923 -27.743 1.00 25.00 C ATOM 0 H ALA A 424 -26.466 -68.517 -25.419 1.00 25.00 H new ATOM 0 HA ALA A 424 -25.845 -66.042 -26.691 1.00 25.00 H new ATOM 0 HB1 ALA A 424 -25.838 -67.469 -28.730 1.00 25.00 H new ATOM 0 HB2 ALA A 424 -24.936 -68.233 -27.400 1.00 25.00 H new ATOM 0 HB3 ALA A 424 -26.577 -68.793 -27.799 1.00 25.00 H new ATOM 194 N ALA A 425 -28.939 -67.095 -26.873 1.00 25.00 N ATOM 195 CA ALA A 425 -30.283 -66.714 -27.290 1.00 25.00 C ATOM 196 C ALA A 425 -30.726 -65.432 -26.577 1.00 25.00 C ATOM 197 O ALA A 425 -31.260 -64.515 -27.203 1.00 25.00 O ATOM 198 CB ALA A 425 -31.268 -67.857 -26.996 1.00 25.00 C ATOM 0 H ALA A 425 -28.899 -67.920 -26.274 1.00 25.00 H new ATOM 0 HA ALA A 425 -30.274 -66.522 -28.363 1.00 25.00 H new ATOM 0 HB1 ALA A 425 -32.270 -67.564 -27.311 1.00 25.00 H new ATOM 0 HB2 ALA A 425 -30.963 -68.750 -27.542 1.00 25.00 H new ATOM 0 HB3 ALA A 425 -31.271 -68.069 -25.927 1.00 25.00 H new ATOM 204 N VAL A 426 -30.514 -65.374 -25.270 1.00 25.00 N ATOM 205 CA VAL A 426 -30.909 -64.203 -24.493 1.00 25.00 C ATOM 206 C VAL A 426 -30.037 -63.008 -24.852 1.00 25.00 C ATOM 207 O VAL A 426 -30.505 -61.886 -24.865 1.00 25.00 O ATOM 208 CB VAL A 426 -30.900 -64.509 -22.970 1.00 25.00 C ATOM 209 CG1 VAL A 426 -29.508 -64.760 -22.428 1.00 25.00 C ATOM 210 CG2 VAL A 426 -31.582 -63.395 -22.192 1.00 25.00 C ATOM 0 H VAL A 426 -30.074 -66.117 -24.727 1.00 25.00 H new ATOM 0 HA VAL A 426 -31.936 -63.944 -24.750 1.00 25.00 H new ATOM 0 HB VAL A 426 -31.462 -65.433 -22.836 1.00 25.00 H new ATOM 0 HG11 VAL A 426 -29.566 -64.968 -21.360 1.00 25.00 H new ATOM 0 HG12 VAL A 426 -29.066 -65.614 -22.941 1.00 25.00 H new ATOM 0 HG13 VAL A 426 -28.889 -63.878 -22.593 1.00 25.00 H new ATOM 0 HG21 VAL A 426 -31.564 -63.631 -21.128 1.00 25.00 H new ATOM 0 HG22 VAL A 426 -31.056 -62.456 -22.365 1.00 25.00 H new ATOM 0 HG23 VAL A 426 -32.615 -63.299 -22.525 1.00 25.00 H new ATOM 220 N GLU A 427 -28.782 -63.256 -25.179 1.00 25.00 N ATOM 221 CA GLU A 427 -27.873 -62.190 -25.636 1.00 25.00 C ATOM 222 C GLU A 427 -28.469 -61.480 -26.852 1.00 25.00 C ATOM 223 O GLU A 427 -28.451 -60.256 -26.940 1.00 25.00 O ATOM 224 CB GLU A 427 -26.509 -62.767 -26.031 1.00 25.00 C ATOM 225 CG GLU A 427 -25.463 -62.745 -24.920 1.00 25.00 C ATOM 226 CD GLU A 427 -24.666 -61.444 -24.891 1.00 25.00 C ATOM 227 OE1 GLU A 427 -24.709 -60.738 -23.863 1.00 25.00 O ATOM 228 OE2 GLU A 427 -23.984 -61.134 -25.898 1.00 25.00 O ATOM 0 H GLU A 427 -28.357 -64.183 -25.141 1.00 25.00 H new ATOM 0 HA GLU A 427 -27.744 -61.486 -24.814 1.00 25.00 H new ATOM 0 HB2 GLU A 427 -26.647 -63.796 -26.362 1.00 25.00 H new ATOM 0 HB3 GLU A 427 -26.126 -62.207 -26.884 1.00 25.00 H new ATOM 0 HG2 GLU A 427 -25.956 -62.886 -23.958 1.00 25.00 H new ATOM 0 HG3 GLU A 427 -24.779 -63.583 -25.053 1.00 25.00 H new ATOM 235 N ALA A 428 -29.014 -62.246 -27.788 1.00 25.00 N ATOM 236 CA ALA A 428 -29.618 -61.659 -28.980 1.00 25.00 C ATOM 237 C ALA A 428 -30.850 -60.821 -28.605 1.00 25.00 C ATOM 238 O ALA A 428 -31.095 -59.760 -29.187 1.00 25.00 O ATOM 239 CB ALA A 428 -30.000 -62.765 -29.972 1.00 25.00 C ATOM 0 H ALA A 428 -29.051 -63.265 -27.748 1.00 25.00 H new ATOM 0 HA ALA A 428 -28.891 -60.999 -29.453 1.00 25.00 H new ATOM 0 HB1 ALA A 428 -30.450 -62.319 -30.859 1.00 25.00 H new ATOM 0 HB2 ALA A 428 -29.107 -63.321 -30.259 1.00 25.00 H new ATOM 0 HB3 ALA A 428 -30.714 -63.442 -29.504 1.00 25.00 H new ATOM 245 N ALA A 429 -31.610 -61.297 -27.628 1.00 25.00 N ATOM 246 CA ALA A 429 -32.793 -60.581 -27.165 1.00 25.00 C ATOM 247 C ALA A 429 -32.386 -59.278 -26.466 1.00 25.00 C ATOM 248 O ALA A 429 -32.998 -58.241 -26.678 1.00 25.00 O ATOM 249 CB ALA A 429 -33.611 -61.469 -26.215 1.00 25.00 C ATOM 0 H ALA A 429 -31.430 -62.175 -27.141 1.00 25.00 H new ATOM 0 HA ALA A 429 -33.412 -60.331 -28.026 1.00 25.00 H new ATOM 0 HB1 ALA A 429 -34.492 -60.924 -25.876 1.00 25.00 H new ATOM 0 HB2 ALA A 429 -33.923 -62.372 -26.739 1.00 25.00 H new ATOM 0 HB3 ALA A 429 -32.999 -61.742 -25.355 1.00 25.00 H new ATOM 255 N GLU A 430 -31.347 -59.335 -25.647 1.00 25.00 N ATOM 256 CA GLU A 430 -30.858 -58.153 -24.934 1.00 25.00 C ATOM 257 C GLU A 430 -30.403 -57.118 -25.925 1.00 25.00 C ATOM 258 O GLU A 430 -30.692 -55.939 -25.785 1.00 25.00 O ATOM 259 CB GLU A 430 -29.670 -58.507 -24.047 1.00 25.00 C ATOM 260 CG GLU A 430 -30.029 -59.323 -22.847 1.00 25.00 C ATOM 261 CD GLU A 430 -30.392 -58.456 -21.644 1.00 25.00 C ATOM 262 OE1 GLU A 430 -31.404 -57.721 -21.720 1.00 25.00 O ATOM 263 OE2 GLU A 430 -29.675 -58.511 -20.621 1.00 25.00 O ATOM 0 H GLU A 430 -30.821 -60.188 -25.456 1.00 25.00 H new ATOM 0 HA GLU A 430 -31.673 -57.771 -24.319 1.00 25.00 H new ATOM 0 HB2 GLU A 430 -28.937 -59.054 -24.640 1.00 25.00 H new ATOM 0 HB3 GLU A 430 -29.189 -57.586 -23.717 1.00 25.00 H new ATOM 0 HG2 GLU A 430 -30.870 -59.973 -23.091 1.00 25.00 H new ATOM 0 HG3 GLU A 430 -29.191 -59.970 -22.586 1.00 25.00 H new ATOM 270 N LEU A 431 -29.694 -57.562 -26.944 1.00 25.00 N ATOM 271 CA LEU A 431 -29.218 -56.652 -27.985 1.00 25.00 C ATOM 272 C LEU A 431 -30.368 -55.896 -28.660 1.00 25.00 C ATOM 273 O LEU A 431 -30.280 -54.674 -28.844 1.00 25.00 O ATOM 274 CB LEU A 431 -28.401 -57.411 -29.037 1.00 25.00 C ATOM 275 CG LEU A 431 -26.971 -57.794 -28.615 1.00 25.00 C ATOM 276 CD1 LEU A 431 -26.393 -58.801 -29.609 1.00 25.00 C ATOM 277 CD2 LEU A 431 -26.058 -56.561 -28.543 1.00 25.00 C ATOM 0 H LEU A 431 -29.433 -58.539 -27.080 1.00 25.00 H new ATOM 0 HA LEU A 431 -28.579 -55.917 -27.497 1.00 25.00 H new ATOM 0 HB2 LEU A 431 -28.939 -58.321 -29.302 1.00 25.00 H new ATOM 0 HB3 LEU A 431 -28.344 -56.800 -29.938 1.00 25.00 H new ATOM 0 HG LEU A 431 -27.020 -58.239 -27.621 1.00 25.00 H new ATOM 0 HD11 LEU A 431 -25.381 -59.070 -29.307 1.00 25.00 H new ATOM 0 HD12 LEU A 431 -27.016 -59.695 -29.625 1.00 25.00 H new ATOM 0 HD13 LEU A 431 -26.369 -58.357 -30.604 1.00 25.00 H new ATOM 0 HD21 LEU A 431 -25.056 -56.867 -28.242 1.00 25.00 H new ATOM 0 HD22 LEU A 431 -26.013 -56.084 -29.522 1.00 25.00 H new ATOM 0 HD23 LEU A 431 -26.456 -55.856 -27.814 1.00 25.00 H new ATOM 289 N GLU A 432 -31.448 -56.575 -29.027 1.00 25.00 N ATOM 290 CA GLU A 432 -32.572 -55.861 -29.639 1.00 25.00 C ATOM 291 C GLU A 432 -33.358 -55.038 -28.608 1.00 25.00 C ATOM 292 O GLU A 432 -33.851 -53.954 -28.931 1.00 25.00 O ATOM 293 CB GLU A 432 -33.486 -56.781 -30.465 1.00 25.00 C ATOM 294 CG GLU A 432 -34.341 -57.769 -29.695 1.00 25.00 C ATOM 295 CD GLU A 432 -35.355 -58.447 -30.608 1.00 25.00 C ATOM 296 OE1 GLU A 432 -36.554 -58.463 -30.253 1.00 25.00 O ATOM 297 OE2 GLU A 432 -34.960 -58.945 -31.686 1.00 25.00 O ATOM 0 H GLU A 432 -31.573 -57.582 -28.919 1.00 25.00 H new ATOM 0 HA GLU A 432 -32.137 -55.156 -30.347 1.00 25.00 H new ATOM 0 HB2 GLU A 432 -34.147 -56.154 -31.063 1.00 25.00 H new ATOM 0 HB3 GLU A 432 -32.863 -57.342 -31.161 1.00 25.00 H new ATOM 0 HG2 GLU A 432 -33.704 -58.522 -29.232 1.00 25.00 H new ATOM 0 HG3 GLU A 432 -34.862 -57.253 -28.889 1.00 25.00 H new ATOM 304 N MET A 433 -33.459 -55.512 -27.372 1.00 25.00 N ATOM 305 CA MET A 433 -34.147 -54.747 -26.328 1.00 25.00 C ATOM 306 C MET A 433 -33.356 -53.487 -26.017 1.00 25.00 C ATOM 307 O MET A 433 -33.936 -52.448 -25.743 1.00 25.00 O ATOM 308 CB MET A 433 -34.332 -55.564 -25.049 1.00 25.00 C ATOM 309 CG MET A 433 -35.463 -56.575 -25.149 1.00 25.00 C ATOM 310 SD MET A 433 -35.835 -57.370 -23.561 1.00 25.00 S ATOM 311 CE MET A 433 -34.369 -58.398 -23.299 1.00 25.00 C ATOM 0 H MET A 433 -33.081 -56.409 -27.066 1.00 25.00 H new ATOM 0 HA MET A 433 -35.137 -54.488 -26.703 1.00 25.00 H new ATOM 0 HB2 MET A 433 -33.403 -56.087 -24.821 1.00 25.00 H new ATOM 0 HB3 MET A 433 -34.529 -54.887 -24.217 1.00 25.00 H new ATOM 0 HG2 MET A 433 -36.359 -56.076 -25.520 1.00 25.00 H new ATOM 0 HG3 MET A 433 -35.198 -57.339 -25.880 1.00 25.00 H new ATOM 0 HE1 MET A 433 -34.578 -59.141 -22.530 1.00 25.00 H new ATOM 0 HE2 MET A 433 -34.107 -58.903 -24.229 1.00 25.00 H new ATOM 0 HE3 MET A 433 -33.537 -57.770 -22.980 1.00 25.00 H new ATOM 321 N THR A 434 -32.037 -53.565 -26.085 1.00 25.00 N ATOM 322 CA THR A 434 -31.186 -52.396 -25.873 1.00 25.00 C ATOM 323 C THR A 434 -31.513 -51.361 -26.944 1.00 25.00 C ATOM 324 O THR A 434 -31.567 -50.162 -26.677 1.00 25.00 O ATOM 325 CB THR A 434 -29.681 -52.756 -25.932 1.00 25.00 C ATOM 326 OG1 THR A 434 -29.386 -53.739 -24.940 1.00 25.00 O ATOM 327 CG2 THR A 434 -28.814 -51.547 -25.637 1.00 25.00 C ATOM 0 H THR A 434 -31.528 -54.426 -26.286 1.00 25.00 H new ATOM 0 HA THR A 434 -31.383 -51.998 -24.877 1.00 25.00 H new ATOM 0 HB THR A 434 -29.472 -53.125 -26.936 1.00 25.00 H new ATOM 0 HG1 THR A 434 -29.880 -54.562 -25.138 1.00 25.00 H new ATOM 0 HG21 THR A 434 -27.763 -51.832 -25.686 1.00 25.00 H new ATOM 0 HG22 THR A 434 -29.013 -50.768 -26.373 1.00 25.00 H new ATOM 0 HG23 THR A 434 -29.042 -51.171 -24.640 1.00 25.00 H new ATOM 335 N ARG A 435 -31.762 -51.816 -28.162 1.00 25.00 N ATOM 336 CA ARG A 435 -32.125 -50.890 -29.235 1.00 25.00 C ATOM 337 C ARG A 435 -33.477 -50.273 -28.933 1.00 25.00 C ATOM 338 O ARG A 435 -33.680 -49.097 -29.181 1.00 25.00 O ATOM 339 CB ARG A 435 -32.169 -51.597 -30.593 1.00 25.00 C ATOM 340 CG ARG A 435 -30.816 -52.127 -31.043 1.00 25.00 C ATOM 341 CD ARG A 435 -30.345 -51.445 -32.318 1.00 25.00 C ATOM 342 NE ARG A 435 -30.235 -49.983 -32.152 1.00 25.00 N ATOM 343 CZ ARG A 435 -29.383 -49.197 -32.798 1.00 25.00 C ATOM 344 NH1 ARG A 435 -28.516 -49.664 -33.664 1.00 25.00 N ATOM 345 NH2 ARG A 435 -29.406 -47.914 -32.572 1.00 25.00 N ATOM 0 H ARG A 435 -31.722 -52.798 -28.434 1.00 25.00 H new ATOM 0 HA ARG A 435 -31.364 -50.111 -29.287 1.00 25.00 H new ATOM 0 HB2 ARG A 435 -32.876 -52.425 -30.540 1.00 25.00 H new ATOM 0 HB3 ARG A 435 -32.547 -50.903 -31.344 1.00 25.00 H new ATOM 0 HG2 ARG A 435 -30.082 -51.970 -30.253 1.00 25.00 H new ATOM 0 HG3 ARG A 435 -30.882 -53.202 -31.208 1.00 25.00 H new ATOM 0 HD2 ARG A 435 -29.377 -51.851 -32.610 1.00 25.00 H new ATOM 0 HD3 ARG A 435 -31.041 -51.667 -33.127 1.00 25.00 H new ATOM 0 HE ARG A 435 -30.867 -49.539 -31.485 1.00 25.00 H new ATOM 0 HH11 ARG A 435 -28.480 -50.664 -33.861 1.00 25.00 H new ATOM 0 HH12 ARG A 435 -27.877 -49.027 -34.140 1.00 25.00 H new ATOM 0 HH21 ARG A 435 -30.073 -47.525 -31.905 1.00 25.00 H new ATOM 0 HH22 ARG A 435 -28.757 -47.298 -33.062 1.00 25.00 H new ATOM 359 N GLN A 436 -34.393 -51.057 -28.388 1.00 25.00 N ATOM 360 CA GLN A 436 -35.718 -50.546 -28.052 1.00 25.00 C ATOM 361 C GLN A 436 -35.667 -49.489 -26.945 1.00 25.00 C ATOM 362 O GLN A 436 -36.270 -48.428 -27.071 1.00 25.00 O ATOM 363 CB GLN A 436 -36.637 -51.676 -27.624 1.00 25.00 C ATOM 364 CG GLN A 436 -37.222 -52.395 -28.804 1.00 25.00 C ATOM 365 CD GLN A 436 -37.344 -53.857 -28.558 1.00 25.00 C ATOM 366 OE1 GLN A 436 -37.936 -54.289 -27.586 1.00 25.00 O ATOM 367 NE2 GLN A 436 -36.779 -54.629 -29.426 1.00 25.00 N ATOM 0 H GLN A 436 -34.248 -52.043 -28.169 1.00 25.00 H new ATOM 0 HA GLN A 436 -36.109 -50.075 -28.954 1.00 25.00 H new ATOM 0 HB2 GLN A 436 -36.082 -52.382 -27.007 1.00 25.00 H new ATOM 0 HB3 GLN A 436 -37.441 -51.276 -27.006 1.00 25.00 H new ATOM 0 HG2 GLN A 436 -38.205 -51.982 -29.030 1.00 25.00 H new ATOM 0 HG3 GLN A 436 -36.596 -52.225 -29.680 1.00 25.00 H new ATOM 0 HE21 GLN A 436 -36.293 -54.226 -30.227 1.00 25.00 H new ATOM 0 HE22 GLN A 436 -36.819 -55.642 -29.310 1.00 25.00 H new ATOM 376 N VAL A 437 -34.960 -49.778 -25.859 1.00 25.00 N ATOM 377 CA VAL A 437 -34.919 -48.865 -24.709 1.00 25.00 C ATOM 378 C VAL A 437 -34.162 -47.571 -24.977 1.00 25.00 C ATOM 379 O VAL A 437 -34.558 -46.517 -24.503 1.00 25.00 O ATOM 380 CB VAL A 437 -34.331 -49.548 -23.431 1.00 25.00 C ATOM 381 CG1 VAL A 437 -35.229 -50.725 -22.997 1.00 25.00 C ATOM 382 CG2 VAL A 437 -32.903 -50.030 -23.624 1.00 25.00 C ATOM 0 H VAL A 437 -34.409 -50.629 -25.745 1.00 25.00 H new ATOM 0 HA VAL A 437 -35.964 -48.607 -24.534 1.00 25.00 H new ATOM 0 HB VAL A 437 -34.309 -48.789 -22.649 1.00 25.00 H new ATOM 0 HG11 VAL A 437 -34.810 -51.193 -22.106 1.00 25.00 H new ATOM 0 HG12 VAL A 437 -36.231 -50.356 -22.776 1.00 25.00 H new ATOM 0 HG13 VAL A 437 -35.282 -51.458 -23.802 1.00 25.00 H new ATOM 0 HG21 VAL A 437 -32.549 -50.495 -22.704 1.00 25.00 H new ATOM 0 HG22 VAL A 437 -32.871 -50.758 -24.434 1.00 25.00 H new ATOM 0 HG23 VAL A 437 -32.263 -49.183 -23.872 1.00 25.00 H new ATOM 392 N LEU A 438 -33.086 -47.639 -25.743 1.00 25.00 N ATOM 393 CA LEU A 438 -32.309 -46.438 -26.071 1.00 25.00 C ATOM 394 C LEU A 438 -33.073 -45.514 -27.013 1.00 25.00 C ATOM 395 O LEU A 438 -32.748 -44.337 -27.131 1.00 25.00 O ATOM 396 CB LEU A 438 -30.969 -46.813 -26.715 1.00 25.00 C ATOM 397 CG LEU A 438 -29.914 -47.457 -25.797 1.00 25.00 C ATOM 398 CD1 LEU A 438 -28.709 -47.871 -26.644 1.00 25.00 C ATOM 399 CD2 LEU A 438 -29.456 -46.502 -24.689 1.00 25.00 C ATOM 0 H LEU A 438 -32.726 -48.502 -26.150 1.00 25.00 H new ATOM 0 HA LEU A 438 -32.129 -45.912 -25.134 1.00 25.00 H new ATOM 0 HB2 LEU A 438 -31.168 -47.500 -27.538 1.00 25.00 H new ATOM 0 HB3 LEU A 438 -30.537 -45.912 -27.149 1.00 25.00 H new ATOM 0 HG LEU A 438 -30.366 -48.325 -25.316 1.00 25.00 H new ATOM 0 HD11 LEU A 438 -27.955 -48.329 -26.004 1.00 25.00 H new ATOM 0 HD12 LEU A 438 -29.026 -48.588 -27.401 1.00 25.00 H new ATOM 0 HD13 LEU A 438 -28.287 -46.992 -27.131 1.00 25.00 H new ATOM 0 HD21 LEU A 438 -28.712 -46.998 -24.066 1.00 25.00 H new ATOM 0 HD22 LEU A 438 -29.018 -45.609 -25.136 1.00 25.00 H new ATOM 0 HD23 LEU A 438 -30.312 -46.218 -24.076 1.00 25.00 H new ATOM 720 N ALA A 462 -17.565 -32.543 -45.120 1.00 25.00 N ATOM 721 CA ALA A 462 -16.561 -32.821 -44.107 1.00 25.00 C ATOM 722 C ALA A 462 -17.222 -33.420 -42.863 1.00 25.00 C ATOM 723 O ALA A 462 -16.721 -34.386 -42.302 1.00 25.00 O ATOM 724 CB ALA A 462 -15.811 -31.539 -43.749 1.00 25.00 C ATOM 0 HA ALA A 462 -15.847 -33.543 -44.502 1.00 25.00 H new ATOM 0 HB1 ALA A 462 -15.060 -31.757 -42.989 1.00 25.00 H new ATOM 0 HB2 ALA A 462 -15.322 -31.143 -44.639 1.00 25.00 H new ATOM 0 HB3 ALA A 462 -16.515 -30.801 -43.363 1.00 25.00 H new ATOM 730 N LEU A 463 -18.348 -32.857 -42.439 1.00 25.00 N ATOM 731 CA LEU A 463 -19.037 -33.365 -41.259 1.00 25.00 C ATOM 732 C LEU A 463 -19.582 -34.764 -41.516 1.00 25.00 C ATOM 733 O LEU A 463 -19.552 -35.593 -40.628 1.00 25.00 O ATOM 734 CB LEU A 463 -20.123 -32.383 -40.783 1.00 25.00 C ATOM 735 CG LEU A 463 -21.607 -32.591 -41.140 1.00 25.00 C ATOM 736 CD1 LEU A 463 -22.310 -33.572 -40.198 1.00 25.00 C ATOM 737 CD2 LEU A 463 -22.306 -31.252 -41.065 1.00 25.00 C ATOM 0 H LEU A 463 -18.798 -32.059 -42.888 1.00 25.00 H new ATOM 0 HA LEU A 463 -18.318 -33.448 -40.444 1.00 25.00 H new ATOM 0 HB2 LEU A 463 -20.061 -32.345 -39.695 1.00 25.00 H new ATOM 0 HB3 LEU A 463 -19.843 -31.397 -41.153 1.00 25.00 H new ATOM 0 HG LEU A 463 -21.654 -33.016 -42.143 1.00 25.00 H new ATOM 0 HD11 LEU A 463 -23.353 -33.680 -40.497 1.00 25.00 H new ATOM 0 HD12 LEU A 463 -21.816 -34.542 -40.248 1.00 25.00 H new ATOM 0 HD13 LEU A 463 -22.263 -33.193 -39.177 1.00 25.00 H new ATOM 0 HD21 LEU A 463 -23.360 -31.377 -41.315 1.00 25.00 H new ATOM 0 HD22 LEU A 463 -22.217 -30.851 -40.055 1.00 25.00 H new ATOM 0 HD23 LEU A 463 -21.845 -30.561 -41.771 1.00 25.00 H new ATOM 749 N GLN A 464 -20.054 -35.056 -42.723 1.00 25.00 N ATOM 750 CA GLN A 464 -20.526 -36.408 -43.021 1.00 25.00 C ATOM 751 C GLN A 464 -19.394 -37.415 -42.841 1.00 25.00 C ATOM 752 O GLN A 464 -19.606 -38.528 -42.361 1.00 25.00 O ATOM 753 CB GLN A 464 -21.091 -36.483 -44.436 1.00 25.00 C ATOM 754 CG GLN A 464 -22.394 -35.722 -44.594 1.00 25.00 C ATOM 755 CD GLN A 464 -22.975 -35.868 -45.972 1.00 25.00 C ATOM 756 OE1 GLN A 464 -22.598 -35.176 -46.912 1.00 25.00 O ATOM 757 NE2 GLN A 464 -23.889 -36.778 -46.105 1.00 25.00 N ATOM 0 H GLN A 464 -20.121 -34.394 -43.496 1.00 25.00 H new ATOM 0 HA GLN A 464 -21.326 -36.656 -42.323 1.00 25.00 H new ATOM 0 HB2 GLN A 464 -20.357 -36.085 -45.136 1.00 25.00 H new ATOM 0 HB3 GLN A 464 -21.252 -37.528 -44.702 1.00 25.00 H new ATOM 0 HG2 GLN A 464 -23.114 -36.081 -43.859 1.00 25.00 H new ATOM 0 HG3 GLN A 464 -22.224 -34.666 -44.384 1.00 25.00 H new ATOM 0 HE21 GLN A 464 -24.176 -37.334 -45.299 1.00 25.00 H new ATOM 0 HE22 GLN A 464 -24.321 -36.938 -47.015 1.00 25.00 H new ATOM 766 N GLY A 465 -18.189 -37.006 -43.198 1.00 25.00 N ATOM 767 CA GLY A 465 -17.027 -37.849 -42.993 1.00 25.00 C ATOM 768 C GLY A 465 -16.750 -37.962 -41.511 1.00 25.00 C ATOM 769 O GLY A 465 -16.511 -39.050 -41.011 1.00 25.00 O ATOM 0 H GLY A 465 -17.992 -36.102 -43.628 1.00 25.00 H new ATOM 0 HA2 GLY A 465 -17.200 -38.837 -43.419 1.00 25.00 H new ATOM 0 HA3 GLY A 465 -16.162 -37.428 -43.506 1.00 25.00 H new ATOM 773 N ALA A 466 -16.807 -36.838 -40.806 1.00 25.00 N ATOM 774 CA ALA A 466 -16.560 -36.792 -39.363 1.00 25.00 C ATOM 775 C ALA A 466 -17.437 -37.788 -38.598 1.00 25.00 C ATOM 776 O ALA A 466 -16.979 -38.431 -37.667 1.00 25.00 O ATOM 777 CB ALA A 466 -16.800 -35.375 -38.836 1.00 25.00 C ATOM 0 H ALA A 466 -17.026 -35.930 -41.216 1.00 25.00 H new ATOM 0 HA ALA A 466 -15.520 -37.075 -39.199 1.00 25.00 H new ATOM 0 HB1 ALA A 466 -16.614 -35.350 -37.762 1.00 25.00 H new ATOM 0 HB2 ALA A 466 -16.125 -34.681 -39.337 1.00 25.00 H new ATOM 0 HB3 ALA A 466 -17.832 -35.084 -39.032 1.00 25.00 H new ATOM 783 N GLN A 467 -18.689 -37.918 -39.001 1.00 25.00 N ATOM 784 CA GLN A 467 -19.604 -38.849 -38.346 1.00 25.00 C ATOM 785 C GLN A 467 -19.160 -40.299 -38.541 1.00 25.00 C ATOM 786 O GLN A 467 -19.179 -41.098 -37.610 1.00 25.00 O ATOM 787 CB GLN A 467 -20.996 -38.698 -38.945 1.00 25.00 C ATOM 788 CG GLN A 467 -21.641 -37.324 -38.736 1.00 25.00 C ATOM 789 CD GLN A 467 -21.916 -36.988 -37.288 1.00 25.00 C ATOM 790 OE1 GLN A 467 -22.209 -37.847 -36.478 1.00 25.00 O ATOM 791 NE2 GLN A 467 -21.828 -35.723 -36.965 1.00 25.00 N ATOM 0 H GLN A 467 -19.098 -37.395 -39.775 1.00 25.00 H new ATOM 0 HA GLN A 467 -19.607 -38.616 -37.281 1.00 25.00 H new ATOM 0 HB2 GLN A 467 -20.939 -38.898 -40.015 1.00 25.00 H new ATOM 0 HB3 GLN A 467 -21.646 -39.458 -38.513 1.00 25.00 H new ATOM 0 HG2 GLN A 467 -20.989 -36.560 -39.158 1.00 25.00 H new ATOM 0 HG3 GLN A 467 -22.578 -37.286 -39.292 1.00 25.00 H new ATOM 0 HE21 GLN A 467 -21.580 -35.032 -37.673 1.00 25.00 H new ATOM 0 HE22 GLN A 467 -22.008 -35.428 -36.005 1.00 25.00 H new ATOM 800 N ALA A 468 -18.769 -40.638 -39.762 1.00 25.00 N ATOM 801 CA ALA A 468 -18.366 -42.005 -40.075 1.00 25.00 C ATOM 802 C ALA A 468 -17.055 -42.362 -39.372 1.00 25.00 C ATOM 803 O ALA A 468 -16.913 -43.444 -38.798 1.00 25.00 O ATOM 804 CB ALA A 468 -18.220 -42.167 -41.596 1.00 25.00 C ATOM 0 H ALA A 468 -18.722 -39.991 -40.549 1.00 25.00 H new ATOM 0 HA ALA A 468 -19.136 -42.687 -39.715 1.00 25.00 H new ATOM 0 HB1 ALA A 468 -17.919 -43.189 -41.826 1.00 25.00 H new ATOM 0 HB2 ALA A 468 -19.174 -41.953 -42.078 1.00 25.00 H new ATOM 0 HB3 ALA A 468 -17.463 -41.474 -41.965 1.00 25.00 H new ATOM 810 N VAL A 469 -16.094 -41.452 -39.414 1.00 25.00 N ATOM 811 CA VAL A 469 -14.792 -41.704 -38.799 1.00 25.00 C ATOM 812 C VAL A 469 -14.902 -41.723 -37.286 1.00 25.00 C ATOM 813 O VAL A 469 -14.100 -42.357 -36.633 1.00 25.00 O ATOM 814 CB VAL A 469 -13.694 -40.691 -39.245 1.00 25.00 C ATOM 815 CG1 VAL A 469 -13.580 -40.679 -40.768 1.00 25.00 C ATOM 816 CG2 VAL A 469 -13.989 -39.294 -38.740 1.00 25.00 C ATOM 0 H VAL A 469 -16.185 -40.540 -39.862 1.00 25.00 H new ATOM 0 HA VAL A 469 -14.478 -42.686 -39.152 1.00 25.00 H new ATOM 0 HB VAL A 469 -12.747 -41.013 -38.811 1.00 25.00 H new ATOM 0 HG11 VAL A 469 -12.811 -39.968 -41.070 1.00 25.00 H new ATOM 0 HG12 VAL A 469 -13.312 -41.675 -41.121 1.00 25.00 H new ATOM 0 HG13 VAL A 469 -14.536 -40.385 -41.202 1.00 25.00 H new ATOM 0 HG21 VAL A 469 -13.203 -38.614 -39.070 1.00 25.00 H new ATOM 0 HG22 VAL A 469 -14.948 -38.959 -39.136 1.00 25.00 H new ATOM 0 HG23 VAL A 469 -14.029 -39.302 -37.651 1.00 25.00 H new ATOM 826 N ALA A 470 -15.880 -41.025 -36.723 1.00 25.00 N ATOM 827 CA ALA A 470 -16.050 -40.978 -35.267 1.00 25.00 C ATOM 828 C ALA A 470 -16.190 -42.383 -34.677 1.00 25.00 C ATOM 829 O ALA A 470 -15.718 -42.642 -33.570 1.00 25.00 O ATOM 830 CB ALA A 470 -17.265 -40.122 -34.893 1.00 25.00 C ATOM 0 H ALA A 470 -16.568 -40.484 -37.246 1.00 25.00 H new ATOM 0 HA ALA A 470 -15.155 -40.522 -34.844 1.00 25.00 H new ATOM 0 HB1 ALA A 470 -17.374 -40.099 -33.809 1.00 25.00 H new ATOM 0 HB2 ALA A 470 -17.123 -39.107 -35.265 1.00 25.00 H new ATOM 0 HB3 ALA A 470 -18.163 -40.550 -35.339 1.00 25.00 H new ATOM 836 N ALA A 471 -16.818 -43.291 -35.413 1.00 25.00 N ATOM 837 CA ALA A 471 -16.956 -44.669 -34.956 1.00 25.00 C ATOM 838 C ALA A 471 -15.573 -45.331 -34.855 1.00 25.00 C ATOM 839 O ALA A 471 -15.308 -46.090 -33.934 1.00 25.00 O ATOM 840 CB ALA A 471 -17.863 -45.452 -35.913 1.00 25.00 C ATOM 0 H ALA A 471 -17.238 -43.101 -36.323 1.00 25.00 H new ATOM 0 HA ALA A 471 -17.414 -44.673 -33.967 1.00 25.00 H new ATOM 0 HB1 ALA A 471 -17.960 -46.480 -35.563 1.00 25.00 H new ATOM 0 HB2 ALA A 471 -18.847 -44.985 -35.945 1.00 25.00 H new ATOM 0 HB3 ALA A 471 -17.427 -45.448 -36.912 1.00 25.00 H new ATOM 846 N ALA A 472 -14.695 -45.023 -35.799 1.00 25.00 N ATOM 847 CA ALA A 472 -13.333 -45.550 -35.781 1.00 25.00 C ATOM 848 C ALA A 472 -12.509 -44.872 -34.680 1.00 25.00 C ATOM 849 O ALA A 472 -11.663 -45.499 -34.062 1.00 25.00 O ATOM 850 CB ALA A 472 -12.670 -45.350 -37.152 1.00 25.00 C ATOM 0 H ALA A 472 -14.899 -44.411 -36.589 1.00 25.00 H new ATOM 0 HA ALA A 472 -13.375 -46.618 -35.567 1.00 25.00 H new ATOM 0 HB1 ALA A 472 -11.655 -45.747 -37.127 1.00 25.00 H new ATOM 0 HB2 ALA A 472 -13.246 -45.875 -37.915 1.00 25.00 H new ATOM 0 HB3 ALA A 472 -12.638 -44.287 -37.389 1.00 25.00 H new ATOM 856 N GLN A 473 -12.753 -43.594 -34.436 1.00 25.00 N ATOM 857 CA GLN A 473 -12.016 -42.864 -33.407 1.00 25.00 C ATOM 858 C GLN A 473 -12.344 -43.364 -32.009 1.00 25.00 C ATOM 859 O GLN A 473 -11.455 -43.603 -31.201 1.00 25.00 O ATOM 860 CB GLN A 473 -12.328 -41.363 -33.456 1.00 25.00 C ATOM 861 CG GLN A 473 -11.963 -40.661 -34.758 1.00 25.00 C ATOM 862 CD GLN A 473 -10.473 -40.529 -34.988 1.00 25.00 C ATOM 863 OE1 GLN A 473 -9.669 -40.689 -34.089 1.00 25.00 O ATOM 864 NE2 GLN A 473 -10.105 -40.235 -36.208 1.00 25.00 N ATOM 0 H GLN A 473 -13.451 -43.040 -34.932 1.00 25.00 H new ATOM 0 HA GLN A 473 -10.960 -43.036 -33.616 1.00 25.00 H new ATOM 0 HB2 GLN A 473 -13.394 -41.225 -33.275 1.00 25.00 H new ATOM 0 HB3 GLN A 473 -11.800 -40.873 -32.638 1.00 25.00 H new ATOM 0 HG2 GLN A 473 -12.402 -41.211 -35.591 1.00 25.00 H new ATOM 0 HG3 GLN A 473 -12.410 -39.667 -34.761 1.00 25.00 H new ATOM 0 HE21 GLN A 473 -10.808 -40.108 -36.936 1.00 25.00 H new ATOM 0 HE22 GLN A 473 -9.115 -40.133 -36.431 1.00 25.00 H new ATOM 873 N ARG A 474 -13.625 -43.536 -31.714 1.00 25.00 N ATOM 874 CA ARG A 474 -14.013 -44.044 -30.392 1.00 25.00 C ATOM 875 C ARG A 474 -13.478 -45.462 -30.215 1.00 25.00 C ATOM 876 O ARG A 474 -13.197 -45.896 -29.106 1.00 25.00 O ATOM 877 CB ARG A 474 -15.535 -43.979 -30.177 1.00 25.00 C ATOM 878 CG ARG A 474 -16.375 -44.872 -31.078 1.00 25.00 C ATOM 879 CD ARG A 474 -17.864 -44.575 -30.920 1.00 25.00 C ATOM 880 NE ARG A 474 -18.356 -44.885 -29.564 1.00 25.00 N ATOM 881 CZ ARG A 474 -19.579 -44.621 -29.113 1.00 25.00 C ATOM 882 NH1 ARG A 474 -20.488 -44.033 -29.853 1.00 25.00 N ATOM 883 NH2 ARG A 474 -19.893 -44.957 -27.892 1.00 25.00 N ATOM 0 H ARG A 474 -14.400 -43.340 -32.348 1.00 25.00 H new ATOM 0 HA ARG A 474 -13.570 -43.404 -29.629 1.00 25.00 H new ATOM 0 HB2 ARG A 474 -15.747 -44.241 -29.140 1.00 25.00 H new ATOM 0 HB3 ARG A 474 -15.858 -42.948 -30.318 1.00 25.00 H new ATOM 0 HG2 ARG A 474 -16.081 -44.724 -32.117 1.00 25.00 H new ATOM 0 HG3 ARG A 474 -16.183 -45.918 -30.838 1.00 25.00 H new ATOM 0 HD2 ARG A 474 -18.048 -43.523 -31.139 1.00 25.00 H new ATOM 0 HD3 ARG A 474 -18.428 -45.156 -31.650 1.00 25.00 H new ATOM 0 HE ARG A 474 -17.706 -45.338 -28.921 1.00 25.00 H new ATOM 0 HH11 ARG A 474 -20.268 -43.761 -30.811 1.00 25.00 H new ATOM 0 HH12 ARG A 474 -21.415 -43.848 -29.470 1.00 25.00 H new ATOM 0 HH21 ARG A 474 -19.204 -45.416 -27.296 1.00 25.00 H new ATOM 0 HH22 ARG A 474 -20.827 -44.760 -27.533 1.00 25.00 H new ATOM 897 N LEU A 475 -13.321 -46.163 -31.326 1.00 25.00 N ATOM 898 CA LEU A 475 -12.756 -47.503 -31.326 1.00 25.00 C ATOM 899 C LEU A 475 -11.250 -47.462 -31.031 1.00 25.00 C ATOM 900 O LEU A 475 -10.786 -48.172 -30.151 1.00 25.00 O ATOM 901 CB LEU A 475 -13.038 -48.173 -32.684 1.00 25.00 C ATOM 902 CG LEU A 475 -11.974 -49.100 -33.291 1.00 25.00 C ATOM 903 CD1 LEU A 475 -11.814 -50.383 -32.462 1.00 25.00 C ATOM 904 CD2 LEU A 475 -12.348 -49.462 -34.716 1.00 25.00 C ATOM 0 H LEU A 475 -13.581 -45.821 -32.251 1.00 25.00 H new ATOM 0 HA LEU A 475 -13.225 -48.091 -30.537 1.00 25.00 H new ATOM 0 HB2 LEU A 475 -13.958 -48.749 -32.582 1.00 25.00 H new ATOM 0 HB3 LEU A 475 -13.236 -47.382 -33.407 1.00 25.00 H new ATOM 0 HG LEU A 475 -11.024 -48.565 -33.286 1.00 25.00 H new ATOM 0 HD11 LEU A 475 -11.054 -51.018 -32.917 1.00 25.00 H new ATOM 0 HD12 LEU A 475 -11.511 -50.125 -31.447 1.00 25.00 H new ATOM 0 HD13 LEU A 475 -12.763 -50.918 -32.432 1.00 25.00 H new ATOM 0 HD21 LEU A 475 -11.587 -50.119 -35.136 1.00 25.00 H new ATOM 0 HD22 LEU A 475 -13.311 -49.972 -34.721 1.00 25.00 H new ATOM 0 HD23 LEU A 475 -12.415 -48.555 -35.316 1.00 25.00 H new ATOM 916 N VAL A 476 -10.480 -46.657 -31.757 1.00 25.00 N ATOM 917 CA VAL A 476 -9.024 -46.649 -31.570 1.00 25.00 C ATOM 918 C VAL A 476 -8.688 -46.184 -30.161 1.00 25.00 C ATOM 919 O VAL A 476 -7.756 -46.682 -29.526 1.00 25.00 O ATOM 920 CB VAL A 476 -8.282 -45.817 -32.668 1.00 25.00 C ATOM 921 CG1 VAL A 476 -8.641 -44.351 -32.632 1.00 25.00 C ATOM 922 CG2 VAL A 476 -6.767 -45.991 -32.544 1.00 25.00 C ATOM 0 H VAL A 476 -10.826 -46.012 -32.468 1.00 25.00 H new ATOM 0 HA VAL A 476 -8.660 -47.669 -31.689 1.00 25.00 H new ATOM 0 HB VAL A 476 -8.614 -46.206 -33.631 1.00 25.00 H new ATOM 0 HG11 VAL A 476 -8.097 -43.824 -33.415 1.00 25.00 H new ATOM 0 HG12 VAL A 476 -9.713 -44.235 -32.794 1.00 25.00 H new ATOM 0 HG13 VAL A 476 -8.373 -43.935 -31.661 1.00 25.00 H new ATOM 0 HG21 VAL A 476 -6.269 -45.405 -33.316 1.00 25.00 H new ATOM 0 HG22 VAL A 476 -6.441 -45.649 -31.562 1.00 25.00 H new ATOM 0 HG23 VAL A 476 -6.510 -47.043 -32.666 1.00 25.00 H new ATOM 932 N HIS A 477 -9.473 -45.248 -29.659 1.00 25.00 N ATOM 933 CA HIS A 477 -9.292 -44.743 -28.320 1.00 25.00 C ATOM 934 C HIS A 477 -9.521 -45.851 -27.301 1.00 25.00 C ATOM 935 O HIS A 477 -8.846 -45.896 -26.287 1.00 25.00 O ATOM 936 CB HIS A 477 -10.253 -43.584 -28.079 1.00 25.00 C ATOM 937 CG HIS A 477 -9.913 -42.775 -26.868 1.00 25.00 C ATOM 938 ND1 HIS A 477 -10.761 -41.884 -26.260 1.00 25.00 N ATOM 939 CD2 HIS A 477 -8.765 -42.720 -26.141 1.00 25.00 C ATOM 940 CE1 HIS A 477 -10.122 -41.342 -25.225 1.00 25.00 C ATOM 941 NE2 HIS A 477 -8.898 -41.817 -25.106 1.00 25.00 N ATOM 0 H HIS A 477 -10.248 -44.822 -30.168 1.00 25.00 H new ATOM 0 HA HIS A 477 -8.269 -44.384 -28.206 1.00 25.00 H new ATOM 0 HB2 HIS A 477 -10.253 -42.933 -28.954 1.00 25.00 H new ATOM 0 HB3 HIS A 477 -11.265 -43.976 -27.973 1.00 25.00 H new ATOM 0 HD2 HIS A 477 -7.877 -43.300 -26.344 1.00 25.00 H new ATOM 0 HE1 HIS A 477 -10.553 -40.604 -24.565 1.00 25.00 H new ATOM 0 HE2 HIS A 477 -8.202 -41.571 -24.403 1.00 25.00 H new ATOM 949 N ALA A 478 -10.453 -46.758 -27.569 1.00 25.00 N ATOM 950 CA ALA A 478 -10.721 -47.843 -26.635 1.00 25.00 C ATOM 951 C ALA A 478 -9.460 -48.686 -26.428 1.00 25.00 C ATOM 952 O ALA A 478 -9.114 -49.022 -25.303 1.00 25.00 O ATOM 953 CB ALA A 478 -11.875 -48.714 -27.145 1.00 25.00 C ATOM 0 H ALA A 478 -11.027 -46.765 -28.412 1.00 25.00 H new ATOM 0 HA ALA A 478 -11.013 -47.415 -25.676 1.00 25.00 H new ATOM 0 HB1 ALA A 478 -12.063 -49.520 -26.436 1.00 25.00 H new ATOM 0 HB2 ALA A 478 -12.773 -48.105 -27.248 1.00 25.00 H new ATOM 0 HB3 ALA A 478 -11.611 -49.137 -28.114 1.00 25.00 H new ATOM 959 N ILE A 479 -8.766 -49.018 -27.507 1.00 25.00 N ATOM 960 CA ILE A 479 -7.556 -49.836 -27.395 1.00 25.00 C ATOM 961 C ILE A 479 -6.451 -49.028 -26.740 1.00 25.00 C ATOM 962 O ILE A 479 -5.659 -49.563 -25.987 1.00 25.00 O ATOM 963 CB ILE A 479 -7.051 -50.339 -28.763 1.00 25.00 C ATOM 964 CG1 ILE A 479 -8.175 -51.055 -29.515 1.00 25.00 C ATOM 965 CG2 ILE A 479 -5.861 -51.314 -28.598 1.00 25.00 C ATOM 966 CD1 ILE A 479 -8.438 -50.417 -30.812 1.00 25.00 C ATOM 0 H ILE A 479 -9.010 -48.741 -28.458 1.00 25.00 H new ATOM 0 HA ILE A 479 -7.817 -50.705 -26.791 1.00 25.00 H new ATOM 0 HB ILE A 479 -6.721 -49.468 -29.329 1.00 25.00 H new ATOM 0 HG12 ILE A 479 -7.905 -52.100 -29.669 1.00 25.00 H new ATOM 0 HG13 ILE A 479 -9.083 -51.046 -28.912 1.00 25.00 H new ATOM 0 HG21 ILE A 479 -5.528 -51.651 -29.580 1.00 25.00 H new ATOM 0 HG22 ILE A 479 -5.041 -50.805 -28.091 1.00 25.00 H new ATOM 0 HG23 ILE A 479 -6.175 -52.174 -28.006 1.00 25.00 H new ATOM 0 HD11 ILE A 479 -9.241 -50.948 -31.323 1.00 25.00 H new ATOM 0 HD12 ILE A 479 -8.732 -49.379 -30.654 1.00 25.00 H new ATOM 0 HD13 ILE A 479 -7.536 -50.449 -31.423 1.00 25.00 H new ATOM 978 N ALA A 480 -6.411 -47.733 -27.009 1.00 25.00 N ATOM 979 CA ALA A 480 -5.400 -46.861 -26.419 1.00 25.00 C ATOM 980 C ALA A 480 -5.496 -46.914 -24.883 1.00 25.00 C ATOM 981 O ALA A 480 -4.512 -46.701 -24.172 1.00 25.00 O ATOM 982 CB ALA A 480 -5.581 -45.424 -26.939 1.00 25.00 C ATOM 0 H ALA A 480 -7.066 -47.259 -27.632 1.00 25.00 H new ATOM 0 HA ALA A 480 -4.407 -47.205 -26.710 1.00 25.00 H new ATOM 0 HB1 ALA A 480 -4.823 -44.778 -26.495 1.00 25.00 H new ATOM 0 HB2 ALA A 480 -5.476 -45.414 -28.024 1.00 25.00 H new ATOM 0 HB3 ALA A 480 -6.572 -45.061 -26.667 1.00 25.00 H new ATOM 988 N LEU A 481 -6.681 -47.210 -24.373 1.00 25.00 N ATOM 989 CA LEU A 481 -6.871 -47.359 -22.925 1.00 25.00 C ATOM 990 C LEU A 481 -6.418 -48.731 -22.485 1.00 25.00 C ATOM 991 O LEU A 481 -5.763 -48.886 -21.466 1.00 25.00 O ATOM 992 CB LEU A 481 -8.327 -47.152 -22.539 1.00 25.00 C ATOM 993 CG LEU A 481 -8.795 -45.772 -22.979 1.00 25.00 C ATOM 994 CD1 LEU A 481 -10.301 -45.781 -23.149 1.00 25.00 C ATOM 995 CD2 LEU A 481 -8.370 -44.676 -22.009 1.00 25.00 C ATOM 0 H LEU A 481 -7.524 -47.352 -24.929 1.00 25.00 H new ATOM 0 HA LEU A 481 -6.272 -46.598 -22.425 1.00 25.00 H new ATOM 0 HB2 LEU A 481 -8.947 -47.919 -23.003 1.00 25.00 H new ATOM 0 HB3 LEU A 481 -8.444 -47.257 -21.460 1.00 25.00 H new ATOM 0 HG LEU A 481 -8.318 -45.545 -23.932 1.00 25.00 H new ATOM 0 HD11 LEU A 481 -10.637 -44.793 -23.464 1.00 25.00 H new ATOM 0 HD12 LEU A 481 -10.578 -46.517 -23.904 1.00 25.00 H new ATOM 0 HD13 LEU A 481 -10.773 -46.040 -22.201 1.00 25.00 H new ATOM 0 HD21 LEU A 481 -8.729 -43.712 -22.369 1.00 25.00 H new ATOM 0 HD22 LEU A 481 -8.794 -44.876 -21.025 1.00 25.00 H new ATOM 0 HD23 LEU A 481 -7.283 -44.655 -21.938 1.00 25.00 H new ATOM 1007 N MET A 482 -6.761 -49.738 -23.268 1.00 25.00 N ATOM 1008 CA MET A 482 -6.383 -51.109 -22.942 1.00 25.00 C ATOM 1009 C MET A 482 -4.891 -51.277 -22.908 1.00 25.00 C ATOM 1010 O MET A 482 -4.378 -52.137 -22.209 1.00 25.00 O ATOM 1011 CB MET A 482 -6.950 -52.084 -23.966 1.00 25.00 C ATOM 1012 CG MET A 482 -8.418 -52.006 -24.003 1.00 25.00 C ATOM 1013 SD MET A 482 -9.219 -53.493 -24.628 1.00 25.00 S ATOM 1014 CE MET A 482 -9.016 -53.283 -26.394 1.00 25.00 C ATOM 0 H MET A 482 -7.297 -49.638 -24.130 1.00 25.00 H new ATOM 0 HA MET A 482 -6.793 -51.321 -21.955 1.00 25.00 H new ATOM 0 HB2 MET A 482 -6.544 -51.859 -24.952 1.00 25.00 H new ATOM 0 HB3 MET A 482 -6.641 -53.100 -23.718 1.00 25.00 H new ATOM 0 HG2 MET A 482 -8.786 -51.804 -22.997 1.00 25.00 H new ATOM 0 HG3 MET A 482 -8.710 -51.160 -24.625 1.00 25.00 H new ATOM 0 HE1 MET A 482 -9.464 -54.129 -26.915 1.00 25.00 H new ATOM 0 HE2 MET A 482 -9.506 -52.362 -26.710 1.00 25.00 H new ATOM 0 HE3 MET A 482 -7.954 -53.230 -26.634 1.00 25.00 H new ATOM 1024 N THR A 483 -4.181 -50.464 -23.664 1.00 25.00 N ATOM 1025 CA THR A 483 -2.734 -50.632 -23.736 1.00 25.00 C ATOM 1026 C THR A 483 -2.066 -50.057 -22.498 1.00 25.00 C ATOM 1027 O THR A 483 -1.070 -50.591 -22.021 1.00 25.00 O ATOM 1028 CB THR A 483 -2.171 -50.014 -25.013 1.00 25.00 C ATOM 1029 OG1 THR A 483 -2.620 -48.666 -25.127 1.00 25.00 O ATOM 1030 CG2 THR A 483 -2.662 -50.797 -26.230 1.00 25.00 C ATOM 0 H THR A 483 -4.562 -49.701 -24.223 1.00 25.00 H new ATOM 0 HA THR A 483 -2.516 -51.699 -23.768 1.00 25.00 H new ATOM 0 HB THR A 483 -1.082 -50.045 -24.970 1.00 25.00 H new ATOM 0 HG1 THR A 483 -2.257 -48.269 -25.946 1.00 25.00 H new ATOM 0 HG21 THR A 483 -2.256 -50.350 -27.138 1.00 25.00 H new ATOM 0 HG22 THR A 483 -2.329 -51.832 -26.155 1.00 25.00 H new ATOM 0 HG23 THR A 483 -3.751 -50.768 -26.266 1.00 25.00 H new ATOM 1038 N GLN A 484 -2.618 -48.983 -21.952 1.00 25.00 N ATOM 1039 CA GLN A 484 -2.072 -48.417 -20.722 1.00 25.00 C ATOM 1040 C GLN A 484 -2.586 -49.166 -19.488 1.00 25.00 C ATOM 1041 O GLN A 484 -1.896 -49.218 -18.475 1.00 25.00 O ATOM 1042 CB GLN A 484 -2.343 -46.908 -20.626 1.00 25.00 C ATOM 1043 CG GLN A 484 -3.802 -46.505 -20.690 1.00 25.00 C ATOM 1044 CD GLN A 484 -3.976 -45.010 -20.753 1.00 25.00 C ATOM 1045 OE1 GLN A 484 -3.771 -44.311 -19.778 1.00 25.00 O ATOM 1046 NE2 GLN A 484 -4.346 -44.514 -21.905 1.00 25.00 N ATOM 0 H GLN A 484 -3.428 -48.492 -22.330 1.00 25.00 H new ATOM 0 HA GLN A 484 -0.990 -48.546 -20.753 1.00 25.00 H new ATOM 0 HB2 GLN A 484 -1.922 -46.539 -19.691 1.00 25.00 H new ATOM 0 HB3 GLN A 484 -1.810 -46.408 -21.434 1.00 25.00 H new ATOM 0 HG2 GLN A 484 -4.265 -46.960 -21.565 1.00 25.00 H new ATOM 0 HG3 GLN A 484 -4.323 -46.893 -19.815 1.00 25.00 H new ATOM 0 HE21 GLN A 484 -4.508 -45.134 -22.699 1.00 25.00 H new ATOM 0 HE22 GLN A 484 -4.473 -43.507 -22.010 1.00 25.00 H new ATOM 1055 N PHE A 485 -3.772 -49.764 -19.556 1.00 25.00 N ATOM 1056 CA PHE A 485 -4.281 -50.541 -18.440 1.00 25.00 C ATOM 1057 C PHE A 485 -3.628 -51.923 -18.406 1.00 25.00 C ATOM 1058 O PHE A 485 -3.327 -52.459 -17.340 1.00 25.00 O ATOM 1059 CB PHE A 485 -5.796 -50.692 -18.556 1.00 25.00 C ATOM 1060 CG PHE A 485 -6.569 -49.648 -17.792 1.00 25.00 C ATOM 1061 CD1 PHE A 485 -6.981 -49.904 -16.469 1.00 25.00 C ATOM 1062 CD2 PHE A 485 -6.890 -48.406 -18.377 1.00 25.00 C ATOM 1063 CE1 PHE A 485 -7.718 -48.938 -15.738 1.00 25.00 C ATOM 1064 CE2 PHE A 485 -7.625 -47.432 -17.656 1.00 25.00 C ATOM 1065 CZ PHE A 485 -8.044 -47.702 -16.338 1.00 25.00 C ATOM 0 H PHE A 485 -4.391 -49.724 -20.366 1.00 25.00 H new ATOM 0 HA PHE A 485 -4.040 -50.015 -17.516 1.00 25.00 H new ATOM 0 HB2 PHE A 485 -6.078 -50.643 -19.608 1.00 25.00 H new ATOM 0 HB3 PHE A 485 -6.082 -51.680 -18.195 1.00 25.00 H new ATOM 0 HD1 PHE A 485 -6.732 -50.848 -16.006 1.00 25.00 H new ATOM 0 HD2 PHE A 485 -6.572 -48.194 -19.387 1.00 25.00 H new ATOM 0 HE1 PHE A 485 -8.029 -49.147 -14.725 1.00 25.00 H new ATOM 0 HE2 PHE A 485 -7.864 -46.484 -18.116 1.00 25.00 H new ATOM 0 HZ PHE A 485 -8.612 -46.966 -15.789 1.00 25.00 H new