USER MOD reduce.3.24.130724 H: found=0, std=0, add=329, rem=0, adj=6 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 161:sc= 0 (180deg=-0.609) USER MOD Single : A 433 MET CE :methyl -160:sc= -0.0427 (180deg=-0.628) USER MOD Single : A 434 THR OG1 : rot 67:sc= 1.21 USER MOD Single : A 436 GLN : amide:sc= 0.142 X(o=0.14,f=-0.033) USER MOD Single : A 464 GLN : amide:sc= -0.0846 X(o=-0.085,f=0) USER MOD Single : A 467 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 473 GLN : amide:sc= -0.0234 X(o=-0.023,f=0) USER MOD Single : A 477 HIS : no HD1:sc= -0.0347 X(o=-0.035,f=-0.00057) USER MOD Single : A 482 MET CE :methyl 177:sc= 0 (180deg=-0.0109) USER MOD Single : A 483 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 GLN : amide:sc= 0.361 X(o=0.36,f=0) USER MOD ----------------------------------------------------------------- ATOM 113 N GLU A 419 1.483 -49.975 -33.576 1.00 25.00 N ATOM 114 CA GLU A 419 0.966 -48.961 -34.496 1.00 25.00 C ATOM 115 C GLU A 419 -0.146 -48.197 -33.795 1.00 25.00 C ATOM 116 O GLU A 419 -0.263 -46.990 -33.910 1.00 25.00 O ATOM 117 CB GLU A 419 0.392 -49.615 -35.762 1.00 25.00 C ATOM 118 CG GLU A 419 1.355 -50.530 -36.510 1.00 25.00 C ATOM 119 CD GLU A 419 2.550 -49.807 -37.099 1.00 25.00 C ATOM 120 OE1 GLU A 419 3.686 -50.201 -36.767 1.00 25.00 O ATOM 121 OE2 GLU A 419 2.356 -48.869 -37.894 1.00 25.00 O ATOM 0 HA GLU A 419 1.779 -48.295 -34.783 1.00 25.00 H new ATOM 0 HB2 GLU A 419 -0.492 -50.191 -35.486 1.00 25.00 H new ATOM 0 HB3 GLU A 419 0.061 -48.829 -36.441 1.00 25.00 H new ATOM 0 HG2 GLU A 419 1.709 -51.304 -35.829 1.00 25.00 H new ATOM 0 HG3 GLU A 419 0.815 -51.034 -37.312 1.00 25.00 H new ATOM 128 N VAL A 420 -0.965 -48.926 -33.049 1.00 25.00 N ATOM 129 CA VAL A 420 -2.083 -48.323 -32.333 1.00 25.00 C ATOM 130 C VAL A 420 -1.572 -47.474 -31.173 1.00 25.00 C ATOM 131 O VAL A 420 -2.165 -46.460 -30.841 1.00 25.00 O ATOM 132 CB VAL A 420 -3.079 -49.407 -31.835 1.00 25.00 C ATOM 133 CG1 VAL A 420 -4.237 -48.778 -31.053 1.00 25.00 C ATOM 134 CG2 VAL A 420 -3.641 -50.178 -33.040 1.00 25.00 C ATOM 0 H VAL A 420 -0.877 -49.934 -32.923 1.00 25.00 H new ATOM 0 HA VAL A 420 -2.622 -47.674 -33.023 1.00 25.00 H new ATOM 0 HB VAL A 420 -2.542 -50.085 -31.171 1.00 25.00 H new ATOM 0 HG11 VAL A 420 -4.917 -49.561 -30.718 1.00 25.00 H new ATOM 0 HG12 VAL A 420 -3.844 -48.244 -30.188 1.00 25.00 H new ATOM 0 HG13 VAL A 420 -4.775 -48.082 -31.696 1.00 25.00 H new ATOM 0 HG21 VAL A 420 -4.340 -50.939 -32.692 1.00 25.00 H new ATOM 0 HG22 VAL A 420 -4.159 -49.487 -33.705 1.00 25.00 H new ATOM 0 HG23 VAL A 420 -2.823 -50.656 -33.579 1.00 25.00 H new ATOM 144 N SER A 421 -0.466 -47.866 -30.563 1.00 25.00 N ATOM 145 CA SER A 421 0.105 -47.078 -29.476 1.00 25.00 C ATOM 146 C SER A 421 0.619 -45.726 -29.964 1.00 25.00 C ATOM 147 O SER A 421 0.473 -44.726 -29.270 1.00 25.00 O ATOM 148 CB SER A 421 1.242 -47.841 -28.809 1.00 25.00 C ATOM 149 OG SER A 421 0.745 -48.992 -28.141 1.00 25.00 O ATOM 0 H SER A 421 0.051 -48.714 -30.796 1.00 25.00 H new ATOM 0 HA SER A 421 -0.692 -46.899 -28.754 1.00 25.00 H new ATOM 0 HB2 SER A 421 1.977 -48.137 -29.557 1.00 25.00 H new ATOM 0 HB3 SER A 421 1.754 -47.193 -28.098 1.00 25.00 H new ATOM 0 HG SER A 421 1.488 -49.472 -27.719 1.00 25.00 H new ATOM 155 N ASP A 422 1.203 -45.682 -31.153 1.00 25.00 N ATOM 156 CA ASP A 422 1.687 -44.412 -31.705 1.00 25.00 C ATOM 157 C ASP A 422 0.488 -43.596 -32.191 1.00 25.00 C ATOM 158 O ASP A 422 0.431 -42.380 -32.056 1.00 25.00 O ATOM 159 CB ASP A 422 2.658 -44.671 -32.859 1.00 25.00 C ATOM 160 CG ASP A 422 3.902 -43.801 -32.775 1.00 25.00 C ATOM 161 OD1 ASP A 422 5.017 -44.345 -32.943 1.00 25.00 O ATOM 162 OD2 ASP A 422 3.774 -42.585 -32.532 1.00 25.00 O ATOM 0 H ASP A 422 1.355 -46.494 -31.751 1.00 25.00 H new ATOM 0 HA ASP A 422 2.219 -43.856 -30.933 1.00 25.00 H new ATOM 0 HB2 ASP A 422 2.951 -45.721 -32.855 1.00 25.00 H new ATOM 0 HB3 ASP A 422 2.151 -44.485 -33.806 1.00 25.00 H new ATOM 167 N MET A 423 -0.496 -44.293 -32.736 1.00 25.00 N ATOM 168 CA MET A 423 -1.720 -43.654 -33.227 1.00 25.00 C ATOM 169 C MET A 423 -2.512 -43.053 -32.058 1.00 25.00 C ATOM 170 O MET A 423 -3.245 -42.082 -32.216 1.00 25.00 O ATOM 171 CB MET A 423 -2.550 -44.691 -33.990 1.00 25.00 C ATOM 172 CG MET A 423 -3.792 -44.157 -34.678 1.00 25.00 C ATOM 173 SD MET A 423 -4.351 -45.263 -36.026 1.00 25.00 S ATOM 174 CE MET A 423 -4.340 -46.924 -35.250 1.00 25.00 C ATOM 0 H MET A 423 -0.476 -45.306 -32.853 1.00 25.00 H new ATOM 0 HA MET A 423 -1.468 -42.838 -33.904 1.00 25.00 H new ATOM 0 HB2 MET A 423 -1.913 -45.159 -34.741 1.00 25.00 H new ATOM 0 HB3 MET A 423 -2.850 -45.474 -33.294 1.00 25.00 H new ATOM 0 HG2 MET A 423 -4.592 -44.042 -33.946 1.00 25.00 H new ATOM 0 HG3 MET A 423 -3.586 -43.166 -35.083 1.00 25.00 H new ATOM 0 HE1 MET A 423 -4.962 -47.603 -35.834 1.00 25.00 H new ATOM 0 HE2 MET A 423 -3.319 -47.304 -35.218 1.00 25.00 H new ATOM 0 HE3 MET A 423 -4.733 -46.854 -34.236 1.00 25.00 H new ATOM 184 N ALA A 424 -2.340 -43.619 -30.873 1.00 25.00 N ATOM 185 CA ALA A 424 -2.986 -43.102 -29.671 1.00 25.00 C ATOM 186 C ALA A 424 -2.413 -41.733 -29.299 1.00 25.00 C ATOM 187 O ALA A 424 -3.119 -40.886 -28.753 1.00 25.00 O ATOM 188 CB ALA A 424 -2.791 -44.078 -28.516 1.00 25.00 C ATOM 0 H ALA A 424 -1.756 -44.440 -30.715 1.00 25.00 H new ATOM 0 HA ALA A 424 -4.052 -42.990 -29.871 1.00 25.00 H new ATOM 0 HB1 ALA A 424 -3.276 -43.685 -27.622 1.00 25.00 H new ATOM 0 HB2 ALA A 424 -3.232 -45.041 -28.775 1.00 25.00 H new ATOM 0 HB3 ALA A 424 -1.726 -44.207 -28.324 1.00 25.00 H new ATOM 194 N ALA A 425 -1.140 -41.517 -29.596 1.00 25.00 N ATOM 195 CA ALA A 425 -0.507 -40.236 -29.308 1.00 25.00 C ATOM 196 C ALA A 425 -1.120 -39.180 -30.231 1.00 25.00 C ATOM 197 O ALA A 425 -1.342 -38.040 -29.826 1.00 25.00 O ATOM 198 CB ALA A 425 1.014 -40.330 -29.515 1.00 25.00 C ATOM 0 H ALA A 425 -0.528 -42.206 -30.033 1.00 25.00 H new ATOM 0 HA ALA A 425 -0.679 -39.958 -28.268 1.00 25.00 H new ATOM 0 HB1 ALA A 425 1.471 -39.365 -29.296 1.00 25.00 H new ATOM 0 HB2 ALA A 425 1.426 -41.087 -28.848 1.00 25.00 H new ATOM 0 HB3 ALA A 425 1.224 -40.605 -30.549 1.00 25.00 H new ATOM 204 N VAL A 426 -1.403 -39.577 -31.464 1.00 25.00 N ATOM 205 CA VAL A 426 -2.026 -38.678 -32.431 1.00 25.00 C ATOM 206 C VAL A 426 -3.435 -38.327 -31.952 1.00 25.00 C ATOM 207 O VAL A 426 -3.818 -37.165 -31.965 1.00 25.00 O ATOM 208 CB VAL A 426 -2.086 -39.322 -33.851 1.00 25.00 C ATOM 209 CG1 VAL A 426 -2.707 -38.352 -34.863 1.00 25.00 C ATOM 210 CG2 VAL A 426 -0.671 -39.723 -34.316 1.00 25.00 C ATOM 0 H VAL A 426 -1.212 -40.514 -31.820 1.00 25.00 H new ATOM 0 HA VAL A 426 -1.422 -37.773 -32.505 1.00 25.00 H new ATOM 0 HB VAL A 426 -2.711 -40.213 -33.793 1.00 25.00 H new ATOM 0 HG11 VAL A 426 -2.739 -38.822 -35.846 1.00 25.00 H new ATOM 0 HG12 VAL A 426 -3.720 -38.098 -34.550 1.00 25.00 H new ATOM 0 HG13 VAL A 426 -2.105 -37.445 -34.914 1.00 25.00 H new ATOM 0 HG21 VAL A 426 -0.727 -40.171 -35.308 1.00 25.00 H new ATOM 0 HG22 VAL A 426 -0.036 -38.838 -34.353 1.00 25.00 H new ATOM 0 HG23 VAL A 426 -0.249 -40.444 -33.616 1.00 25.00 H new ATOM 220 N GLU A 427 -4.194 -39.323 -31.508 1.00 25.00 N ATOM 221 CA GLU A 427 -5.551 -39.081 -31.001 1.00 25.00 C ATOM 222 C GLU A 427 -5.515 -38.092 -29.844 1.00 25.00 C ATOM 223 O GLU A 427 -6.313 -37.165 -29.789 1.00 25.00 O ATOM 224 CB GLU A 427 -6.189 -40.385 -30.506 1.00 25.00 C ATOM 225 CG GLU A 427 -6.824 -41.236 -31.602 1.00 25.00 C ATOM 226 CD GLU A 427 -8.354 -41.108 -31.654 1.00 25.00 C ATOM 227 OE1 GLU A 427 -8.900 -40.967 -32.771 1.00 25.00 O ATOM 228 OE2 GLU A 427 -9.010 -41.168 -30.587 1.00 25.00 O ATOM 0 H GLU A 427 -3.901 -40.300 -31.486 1.00 25.00 H new ATOM 0 HA GLU A 427 -6.142 -38.675 -31.821 1.00 25.00 H new ATOM 0 HB2 GLU A 427 -5.427 -40.978 -29.999 1.00 25.00 H new ATOM 0 HB3 GLU A 427 -6.950 -40.143 -29.764 1.00 25.00 H new ATOM 0 HG2 GLU A 427 -6.408 -40.945 -32.567 1.00 25.00 H new ATOM 0 HG3 GLU A 427 -6.558 -42.281 -31.442 1.00 25.00 H new ATOM 235 N ALA A 428 -4.580 -38.279 -28.921 1.00 25.00 N ATOM 236 CA ALA A 428 -4.473 -37.392 -27.769 1.00 25.00 C ATOM 237 C ALA A 428 -4.196 -35.954 -28.221 1.00 25.00 C ATOM 238 O ALA A 428 -4.757 -35.001 -27.667 1.00 25.00 O ATOM 239 CB ALA A 428 -3.366 -37.888 -26.829 1.00 25.00 C ATOM 0 H ALA A 428 -3.890 -39.030 -28.946 1.00 25.00 H new ATOM 0 HA ALA A 428 -5.420 -37.400 -27.229 1.00 25.00 H new ATOM 0 HB1 ALA A 428 -3.292 -37.221 -25.970 1.00 25.00 H new ATOM 0 HB2 ALA A 428 -3.604 -38.895 -26.486 1.00 25.00 H new ATOM 0 HB3 ALA A 428 -2.415 -37.901 -27.362 1.00 25.00 H new ATOM 245 N ALA A 429 -3.345 -35.808 -29.227 1.00 25.00 N ATOM 246 CA ALA A 429 -2.998 -34.494 -29.752 1.00 25.00 C ATOM 247 C ALA A 429 -4.209 -33.835 -30.422 1.00 25.00 C ATOM 248 O ALA A 429 -4.472 -32.655 -30.208 1.00 25.00 O ATOM 249 CB ALA A 429 -1.834 -34.618 -30.748 1.00 25.00 C ATOM 0 H ALA A 429 -2.881 -36.585 -29.697 1.00 25.00 H new ATOM 0 HA ALA A 429 -2.687 -33.860 -28.921 1.00 25.00 H new ATOM 0 HB1 ALA A 429 -1.581 -33.631 -31.136 1.00 25.00 H new ATOM 0 HB2 ALA A 429 -0.967 -35.043 -30.243 1.00 25.00 H new ATOM 0 HB3 ALA A 429 -2.128 -35.268 -31.572 1.00 25.00 H new ATOM 255 N GLU A 430 -4.954 -34.584 -31.221 1.00 25.00 N ATOM 256 CA GLU A 430 -6.127 -34.021 -31.897 1.00 25.00 C ATOM 257 C GLU A 430 -7.161 -33.599 -30.865 1.00 25.00 C ATOM 258 O GLU A 430 -7.760 -32.523 -30.957 1.00 25.00 O ATOM 259 CB GLU A 430 -6.765 -35.027 -32.862 1.00 25.00 C ATOM 260 CG GLU A 430 -5.827 -35.491 -33.968 1.00 25.00 C ATOM 261 CD GLU A 430 -6.497 -35.570 -35.340 1.00 25.00 C ATOM 262 OE1 GLU A 430 -5.801 -35.311 -36.348 1.00 25.00 O ATOM 263 OE2 GLU A 430 -7.705 -35.893 -35.418 1.00 25.00 O ATOM 0 H GLU A 430 -4.777 -35.569 -31.419 1.00 25.00 H new ATOM 0 HA GLU A 430 -5.792 -33.159 -32.474 1.00 25.00 H new ATOM 0 HB2 GLU A 430 -7.104 -35.895 -32.297 1.00 25.00 H new ATOM 0 HB3 GLU A 430 -7.649 -34.575 -33.313 1.00 25.00 H new ATOM 0 HG2 GLU A 430 -4.979 -34.809 -34.025 1.00 25.00 H new ATOM 0 HG3 GLU A 430 -5.430 -36.472 -33.709 1.00 25.00 H new ATOM 270 N LEU A 431 -7.362 -34.443 -29.868 1.00 25.00 N ATOM 271 CA LEU A 431 -8.337 -34.165 -28.818 1.00 25.00 C ATOM 272 C LEU A 431 -7.980 -32.908 -28.032 1.00 25.00 C ATOM 273 O LEU A 431 -8.861 -32.103 -27.720 1.00 25.00 O ATOM 274 CB LEU A 431 -8.453 -35.361 -27.866 1.00 25.00 C ATOM 275 CG LEU A 431 -9.195 -36.583 -28.444 1.00 25.00 C ATOM 276 CD1 LEU A 431 -8.966 -37.799 -27.550 1.00 25.00 C ATOM 277 CD2 LEU A 431 -10.701 -36.316 -28.575 1.00 25.00 C ATOM 0 H LEU A 431 -6.865 -35.327 -29.760 1.00 25.00 H new ATOM 0 HA LEU A 431 -9.298 -33.995 -29.303 1.00 25.00 H new ATOM 0 HB2 LEU A 431 -7.450 -35.670 -27.570 1.00 25.00 H new ATOM 0 HB3 LEU A 431 -8.967 -35.037 -26.961 1.00 25.00 H new ATOM 0 HG LEU A 431 -8.797 -36.776 -29.440 1.00 25.00 H new ATOM 0 HD11 LEU A 431 -9.493 -38.659 -27.964 1.00 25.00 H new ATOM 0 HD12 LEU A 431 -7.899 -38.017 -27.499 1.00 25.00 H new ATOM 0 HD13 LEU A 431 -9.342 -37.590 -26.549 1.00 25.00 H new ATOM 0 HD21 LEU A 431 -11.193 -37.198 -28.985 1.00 25.00 H new ATOM 0 HD22 LEU A 431 -11.118 -36.092 -27.593 1.00 25.00 H new ATOM 0 HD23 LEU A 431 -10.864 -35.468 -29.240 1.00 25.00 H new ATOM 289 N GLU A 432 -6.710 -32.700 -27.709 1.00 25.00 N ATOM 290 CA GLU A 432 -6.349 -31.476 -26.999 1.00 25.00 C ATOM 291 C GLU A 432 -6.367 -30.256 -27.916 1.00 25.00 C ATOM 292 O GLU A 432 -6.725 -29.165 -27.471 1.00 25.00 O ATOM 293 CB GLU A 432 -5.030 -31.597 -26.228 1.00 25.00 C ATOM 294 CG GLU A 432 -3.756 -31.604 -27.053 1.00 25.00 C ATOM 295 CD GLU A 432 -2.517 -31.684 -26.171 1.00 25.00 C ATOM 296 OE1 GLU A 432 -2.648 -31.466 -24.941 1.00 25.00 O ATOM 297 OE2 GLU A 432 -1.420 -31.952 -26.699 1.00 25.00 O ATOM 0 H GLU A 432 -5.938 -33.334 -27.916 1.00 25.00 H new ATOM 0 HA GLU A 432 -7.124 -31.324 -26.247 1.00 25.00 H new ATOM 0 HB2 GLU A 432 -4.972 -30.770 -25.520 1.00 25.00 H new ATOM 0 HB3 GLU A 432 -5.061 -32.516 -25.643 1.00 25.00 H new ATOM 0 HG2 GLU A 432 -3.771 -32.451 -27.739 1.00 25.00 H new ATOM 0 HG3 GLU A 432 -3.712 -30.701 -27.663 1.00 25.00 H new ATOM 304 N MET A 433 -6.015 -30.415 -29.186 1.00 25.00 N ATOM 305 CA MET A 433 -6.056 -29.288 -30.123 1.00 25.00 C ATOM 306 C MET A 433 -7.492 -28.848 -30.340 1.00 25.00 C ATOM 307 O MET A 433 -7.760 -27.662 -30.521 1.00 25.00 O ATOM 308 CB MET A 433 -5.426 -29.648 -31.470 1.00 25.00 C ATOM 309 CG MET A 433 -3.910 -29.603 -31.450 1.00 25.00 C ATOM 310 SD MET A 433 -3.183 -29.832 -33.096 1.00 25.00 S ATOM 311 CE MET A 433 -3.494 -31.587 -33.412 1.00 25.00 C ATOM 0 H MET A 433 -5.702 -31.297 -29.591 1.00 25.00 H new ATOM 0 HA MET A 433 -5.478 -28.474 -29.685 1.00 25.00 H new ATOM 0 HB2 MET A 433 -5.750 -30.648 -31.760 1.00 25.00 H new ATOM 0 HB3 MET A 433 -5.794 -28.960 -32.232 1.00 25.00 H new ATOM 0 HG2 MET A 433 -3.584 -28.646 -31.043 1.00 25.00 H new ATOM 0 HG3 MET A 433 -3.536 -30.378 -30.781 1.00 25.00 H new ATOM 0 HE1 MET A 433 -2.816 -31.943 -34.188 1.00 25.00 H new ATOM 0 HE2 MET A 433 -3.329 -32.156 -32.497 1.00 25.00 H new ATOM 0 HE3 MET A 433 -4.524 -31.720 -33.742 1.00 25.00 H new ATOM 321 N THR A 434 -8.420 -29.794 -30.296 1.00 25.00 N ATOM 322 CA THR A 434 -9.847 -29.491 -30.424 1.00 25.00 C ATOM 323 C THR A 434 -10.262 -28.498 -29.338 1.00 25.00 C ATOM 324 O THR A 434 -11.087 -27.617 -29.566 1.00 25.00 O ATOM 325 CB THR A 434 -10.709 -30.780 -30.312 1.00 25.00 C ATOM 326 OG1 THR A 434 -10.328 -31.699 -31.336 1.00 25.00 O ATOM 327 CG2 THR A 434 -12.190 -30.486 -30.503 1.00 25.00 C ATOM 0 H THR A 434 -8.213 -30.785 -30.172 1.00 25.00 H new ATOM 0 HA THR A 434 -10.015 -29.054 -31.408 1.00 25.00 H new ATOM 0 HB THR A 434 -10.544 -31.192 -29.316 1.00 25.00 H new ATOM 0 HG1 THR A 434 -9.414 -32.011 -31.172 1.00 25.00 H new ATOM 0 HG21 THR A 434 -12.759 -31.412 -30.418 1.00 25.00 H new ATOM 0 HG22 THR A 434 -12.523 -29.784 -29.739 1.00 25.00 H new ATOM 0 HG23 THR A 434 -12.350 -30.051 -31.490 1.00 25.00 H new ATOM 335 N ARG A 435 -9.681 -28.611 -28.153 1.00 25.00 N ATOM 336 CA ARG A 435 -10.015 -27.675 -27.078 1.00 25.00 C ATOM 337 C ARG A 435 -9.518 -26.286 -27.438 1.00 25.00 C ATOM 338 O ARG A 435 -10.221 -25.305 -27.253 1.00 25.00 O ATOM 339 CB ARG A 435 -9.404 -28.116 -25.746 1.00 25.00 C ATOM 340 CG ARG A 435 -9.796 -29.522 -25.357 1.00 25.00 C ATOM 341 CD ARG A 435 -9.399 -29.840 -23.923 1.00 25.00 C ATOM 342 NE ARG A 435 -9.762 -31.226 -23.568 1.00 25.00 N ATOM 343 CZ ARG A 435 -8.939 -32.272 -23.579 1.00 25.00 C ATOM 344 NH1 ARG A 435 -7.670 -32.170 -23.885 1.00 25.00 N ATOM 345 NH2 ARG A 435 -9.408 -33.446 -23.265 1.00 25.00 N ATOM 0 H ARG A 435 -8.991 -29.322 -27.909 1.00 25.00 H new ATOM 0 HA ARG A 435 -11.099 -27.660 -26.963 1.00 25.00 H new ATOM 0 HB2 ARG A 435 -8.318 -28.052 -25.811 1.00 25.00 H new ATOM 0 HB3 ARG A 435 -9.718 -27.427 -24.962 1.00 25.00 H new ATOM 0 HG2 ARG A 435 -10.873 -29.645 -25.472 1.00 25.00 H new ATOM 0 HG3 ARG A 435 -9.320 -30.233 -26.033 1.00 25.00 H new ATOM 0 HD2 ARG A 435 -8.325 -29.699 -23.799 1.00 25.00 H new ATOM 0 HD3 ARG A 435 -9.892 -29.146 -23.243 1.00 25.00 H new ATOM 0 HE ARG A 435 -10.728 -31.397 -23.290 1.00 25.00 H new ATOM 0 HH11 ARG A 435 -7.275 -31.261 -24.128 1.00 25.00 H new ATOM 0 HH12 ARG A 435 -7.076 -32.999 -23.880 1.00 25.00 H new ATOM 0 HH21 ARG A 435 -10.391 -33.552 -23.016 1.00 25.00 H new ATOM 0 HH22 ARG A 435 -8.792 -34.259 -23.268 1.00 25.00 H new ATOM 359 N GLN A 436 -8.305 -26.208 -27.961 1.00 25.00 N ATOM 360 CA GLN A 436 -7.706 -24.910 -28.285 1.00 25.00 C ATOM 361 C GLN A 436 -8.477 -24.171 -29.377 1.00 25.00 C ATOM 362 O GLN A 436 -8.677 -22.968 -29.286 1.00 25.00 O ATOM 363 CB GLN A 436 -6.243 -25.050 -28.742 1.00 25.00 C ATOM 364 CG GLN A 436 -5.381 -26.033 -27.949 1.00 25.00 C ATOM 365 CD GLN A 436 -5.480 -25.880 -26.447 1.00 25.00 C ATOM 366 OE1 GLN A 436 -5.552 -24.786 -25.910 1.00 25.00 O ATOM 367 NE2 GLN A 436 -5.494 -26.991 -25.764 1.00 25.00 N ATOM 0 H GLN A 436 -7.716 -27.014 -28.171 1.00 25.00 H new ATOM 0 HA GLN A 436 -7.749 -24.334 -27.361 1.00 25.00 H new ATOM 0 HB2 GLN A 436 -6.238 -25.356 -29.788 1.00 25.00 H new ATOM 0 HB3 GLN A 436 -5.774 -24.067 -28.695 1.00 25.00 H new ATOM 0 HG2 GLN A 436 -5.669 -27.049 -28.218 1.00 25.00 H new ATOM 0 HG3 GLN A 436 -4.340 -25.907 -28.247 1.00 25.00 H new ATOM 0 HE21 GLN A 436 -5.432 -27.887 -26.247 1.00 25.00 H new ATOM 0 HE22 GLN A 436 -5.567 -26.964 -24.747 1.00 25.00 H new ATOM 376 N VAL A 437 -8.912 -24.883 -30.408 1.00 25.00 N ATOM 377 CA VAL A 437 -9.629 -24.235 -31.512 1.00 25.00 C ATOM 378 C VAL A 437 -11.006 -23.742 -31.085 1.00 25.00 C ATOM 379 O VAL A 437 -11.496 -22.737 -31.581 1.00 25.00 O ATOM 380 CB VAL A 437 -9.757 -25.153 -32.759 1.00 25.00 C ATOM 381 CG1 VAL A 437 -8.367 -25.398 -33.381 1.00 25.00 C ATOM 382 CG2 VAL A 437 -10.411 -26.479 -32.445 1.00 25.00 C ATOM 0 H VAL A 437 -8.787 -25.890 -30.509 1.00 25.00 H new ATOM 0 HA VAL A 437 -9.024 -23.373 -31.792 1.00 25.00 H new ATOM 0 HB VAL A 437 -10.401 -24.633 -33.468 1.00 25.00 H new ATOM 0 HG11 VAL A 437 -8.468 -26.043 -34.254 1.00 25.00 H new ATOM 0 HG12 VAL A 437 -7.930 -24.446 -33.681 1.00 25.00 H new ATOM 0 HG13 VAL A 437 -7.720 -25.879 -32.648 1.00 25.00 H new ATOM 0 HG21 VAL A 437 -10.474 -27.078 -33.353 1.00 25.00 H new ATOM 0 HG22 VAL A 437 -9.818 -27.010 -31.700 1.00 25.00 H new ATOM 0 HG23 VAL A 437 -11.414 -26.307 -32.054 1.00 25.00 H new ATOM 392 N LEU A 438 -11.624 -24.437 -30.148 1.00 25.00 N ATOM 393 CA LEU A 438 -12.905 -23.993 -29.600 1.00 25.00 C ATOM 394 C LEU A 438 -12.694 -22.755 -28.729 1.00 25.00 C ATOM 395 O LEU A 438 -13.518 -21.843 -28.725 1.00 25.00 O ATOM 396 CB LEU A 438 -13.556 -25.106 -28.773 1.00 25.00 C ATOM 397 CG LEU A 438 -14.102 -26.296 -29.581 1.00 25.00 C ATOM 398 CD1 LEU A 438 -14.503 -27.418 -28.624 1.00 25.00 C ATOM 399 CD2 LEU A 438 -15.308 -25.894 -30.445 1.00 25.00 C ATOM 0 H LEU A 438 -11.268 -25.306 -29.749 1.00 25.00 H new ATOM 0 HA LEU A 438 -13.569 -23.745 -30.428 1.00 25.00 H new ATOM 0 HB2 LEU A 438 -12.823 -25.480 -28.058 1.00 25.00 H new ATOM 0 HB3 LEU A 438 -14.374 -24.675 -28.195 1.00 25.00 H new ATOM 0 HG LEU A 438 -13.314 -26.638 -30.252 1.00 25.00 H new ATOM 0 HD11 LEU A 438 -14.890 -28.262 -29.195 1.00 25.00 H new ATOM 0 HD12 LEU A 438 -13.632 -27.736 -28.051 1.00 25.00 H new ATOM 0 HD13 LEU A 438 -15.273 -27.057 -27.943 1.00 25.00 H new ATOM 0 HD21 LEU A 438 -15.664 -26.762 -31.000 1.00 25.00 H new ATOM 0 HD22 LEU A 438 -16.107 -25.521 -29.804 1.00 25.00 H new ATOM 0 HD23 LEU A 438 -15.010 -25.113 -31.145 1.00 25.00 H new ATOM 720 N ALA A 462 -18.286 -32.842 -45.554 1.00 25.00 N ATOM 721 CA ALA A 462 -17.185 -33.050 -44.631 1.00 25.00 C ATOM 722 C ALA A 462 -17.714 -33.656 -43.331 1.00 25.00 C ATOM 723 O ALA A 462 -17.161 -34.628 -42.823 1.00 25.00 O ATOM 724 CB ALA A 462 -16.466 -31.724 -44.361 1.00 25.00 C ATOM 0 HA ALA A 462 -16.467 -33.742 -45.072 1.00 25.00 H new ATOM 0 HB1 ALA A 462 -15.642 -31.892 -43.667 1.00 25.00 H new ATOM 0 HB2 ALA A 462 -16.077 -31.324 -45.297 1.00 25.00 H new ATOM 0 HB3 ALA A 462 -17.167 -31.012 -43.926 1.00 25.00 H new ATOM 730 N LEU A 463 -18.792 -33.095 -42.792 1.00 25.00 N ATOM 731 CA LEU A 463 -19.330 -33.594 -41.531 1.00 25.00 C ATOM 732 C LEU A 463 -19.887 -34.999 -41.676 1.00 25.00 C ATOM 733 O LEU A 463 -19.767 -35.790 -40.762 1.00 25.00 O ATOM 734 CB LEU A 463 -20.368 -32.627 -40.933 1.00 25.00 C ATOM 735 CG LEU A 463 -21.876 -32.794 -41.216 1.00 25.00 C ATOM 736 CD1 LEU A 463 -22.570 -33.834 -40.312 1.00 25.00 C ATOM 737 CD2 LEU A 463 -22.534 -31.457 -40.993 1.00 25.00 C ATOM 0 H LEU A 463 -19.302 -32.310 -43.198 1.00 25.00 H new ATOM 0 HA LEU A 463 -18.500 -33.649 -40.826 1.00 25.00 H new ATOM 0 HB2 LEU A 463 -20.243 -32.656 -39.851 1.00 25.00 H new ATOM 0 HB3 LEU A 463 -20.093 -31.624 -41.259 1.00 25.00 H new ATOM 0 HG LEU A 463 -21.977 -33.153 -42.240 1.00 25.00 H new ATOM 0 HD11 LEU A 463 -23.627 -33.894 -40.572 1.00 25.00 H new ATOM 0 HD12 LEU A 463 -22.105 -34.809 -40.456 1.00 25.00 H new ATOM 0 HD13 LEU A 463 -22.469 -33.534 -39.269 1.00 25.00 H new ATOM 0 HD21 LEU A 463 -23.604 -31.541 -41.185 1.00 25.00 H new ATOM 0 HD22 LEU A 463 -22.375 -31.140 -39.962 1.00 25.00 H new ATOM 0 HD23 LEU A 463 -22.101 -30.721 -41.670 1.00 25.00 H new ATOM 749 N GLN A 464 -20.483 -35.339 -42.809 1.00 25.00 N ATOM 750 CA GLN A 464 -21.003 -36.698 -42.973 1.00 25.00 C ATOM 751 C GLN A 464 -19.865 -37.728 -42.957 1.00 25.00 C ATOM 752 O GLN A 464 -20.065 -38.876 -42.565 1.00 25.00 O ATOM 753 CB GLN A 464 -21.910 -36.816 -44.205 1.00 25.00 C ATOM 754 CG GLN A 464 -21.242 -37.113 -45.545 1.00 25.00 C ATOM 755 CD GLN A 464 -22.266 -37.331 -46.644 1.00 25.00 C ATOM 756 OE1 GLN A 464 -22.304 -36.617 -47.643 1.00 25.00 O ATOM 757 NE2 GLN A 464 -23.107 -38.312 -46.456 1.00 25.00 N ATOM 0 H GLN A 464 -20.619 -34.719 -43.608 1.00 25.00 H new ATOM 0 HA GLN A 464 -21.639 -36.925 -42.117 1.00 25.00 H new ATOM 0 HB2 GLN A 464 -22.640 -37.602 -44.011 1.00 25.00 H new ATOM 0 HB3 GLN A 464 -22.465 -35.883 -44.305 1.00 25.00 H new ATOM 0 HG2 GLN A 464 -20.587 -36.286 -45.817 1.00 25.00 H new ATOM 0 HG3 GLN A 464 -20.614 -37.999 -45.451 1.00 25.00 H new ATOM 0 HE21 GLN A 464 -23.044 -38.883 -45.613 1.00 25.00 H new ATOM 0 HE22 GLN A 464 -23.827 -38.507 -47.152 1.00 25.00 H new ATOM 766 N GLY A 465 -18.667 -37.304 -43.338 1.00 25.00 N ATOM 767 CA GLY A 465 -17.503 -38.162 -43.230 1.00 25.00 C ATOM 768 C GLY A 465 -17.080 -38.208 -41.777 1.00 25.00 C ATOM 769 O GLY A 465 -16.774 -39.270 -41.254 1.00 25.00 O ATOM 0 H GLY A 465 -18.480 -36.377 -43.721 1.00 25.00 H new ATOM 0 HA2 GLY A 465 -17.735 -39.164 -43.590 1.00 25.00 H new ATOM 0 HA3 GLY A 465 -16.691 -37.781 -43.850 1.00 25.00 H new ATOM 773 N ALA A 466 -17.091 -37.055 -41.116 1.00 25.00 N ATOM 774 CA ALA A 466 -16.719 -36.949 -39.699 1.00 25.00 C ATOM 775 C ALA A 466 -17.564 -37.881 -38.818 1.00 25.00 C ATOM 776 O ALA A 466 -17.066 -38.495 -37.887 1.00 25.00 O ATOM 777 CB ALA A 466 -16.862 -35.503 -39.223 1.00 25.00 C ATOM 0 H ALA A 466 -17.356 -36.167 -41.541 1.00 25.00 H new ATOM 0 HA ALA A 466 -15.678 -37.259 -39.606 1.00 25.00 H new ATOM 0 HB1 ALA A 466 -16.584 -35.437 -38.171 1.00 25.00 H new ATOM 0 HB2 ALA A 466 -16.209 -34.860 -39.812 1.00 25.00 H new ATOM 0 HB3 ALA A 466 -17.896 -35.180 -39.346 1.00 25.00 H new ATOM 783 N GLN A 467 -18.844 -37.990 -39.130 1.00 25.00 N ATOM 784 CA GLN A 467 -19.743 -38.867 -38.383 1.00 25.00 C ATOM 785 C GLN A 467 -19.321 -40.330 -38.525 1.00 25.00 C ATOM 786 O GLN A 467 -19.345 -41.092 -37.563 1.00 25.00 O ATOM 787 CB GLN A 467 -21.155 -38.724 -38.937 1.00 25.00 C ATOM 788 CG GLN A 467 -21.799 -37.350 -38.722 1.00 25.00 C ATOM 789 CD GLN A 467 -22.172 -37.069 -37.288 1.00 25.00 C ATOM 790 OE1 GLN A 467 -22.776 -37.885 -36.616 1.00 25.00 O ATOM 791 NE2 GLN A 467 -21.821 -35.899 -36.819 1.00 25.00 N ATOM 0 H GLN A 467 -19.289 -37.484 -39.895 1.00 25.00 H new ATOM 0 HA GLN A 467 -19.704 -38.582 -37.332 1.00 25.00 H new ATOM 0 HB2 GLN A 467 -21.133 -38.935 -40.006 1.00 25.00 H new ATOM 0 HB3 GLN A 467 -21.789 -39.482 -38.476 1.00 25.00 H new ATOM 0 HG2 GLN A 467 -21.110 -36.579 -39.066 1.00 25.00 H new ATOM 0 HG3 GLN A 467 -22.693 -37.278 -39.341 1.00 25.00 H new ATOM 0 HE21 GLN A 467 -21.316 -35.242 -37.413 1.00 25.00 H new ATOM 0 HE22 GLN A 467 -22.053 -35.644 -35.859 1.00 25.00 H new ATOM 800 N ALA A 468 -18.945 -40.719 -39.735 1.00 25.00 N ATOM 801 CA ALA A 468 -18.567 -42.099 -40.007 1.00 25.00 C ATOM 802 C ALA A 468 -17.222 -42.440 -39.364 1.00 25.00 C ATOM 803 O ALA A 468 -17.066 -43.502 -38.758 1.00 25.00 O ATOM 804 CB ALA A 468 -18.505 -42.332 -41.524 1.00 25.00 C ATOM 0 H ALA A 468 -18.893 -40.099 -40.544 1.00 25.00 H new ATOM 0 HA ALA A 468 -19.322 -42.754 -39.572 1.00 25.00 H new ATOM 0 HB1 ALA A 468 -18.222 -43.366 -41.722 1.00 25.00 H new ATOM 0 HB2 ALA A 468 -19.483 -42.133 -41.963 1.00 25.00 H new ATOM 0 HB3 ALA A 468 -17.766 -41.663 -41.965 1.00 25.00 H new ATOM 810 N VAL A 469 -16.249 -41.550 -39.498 1.00 25.00 N ATOM 811 CA VAL A 469 -14.919 -41.808 -38.947 1.00 25.00 C ATOM 812 C VAL A 469 -14.948 -41.788 -37.433 1.00 25.00 C ATOM 813 O VAL A 469 -14.135 -42.431 -36.813 1.00 25.00 O ATOM 814 CB VAL A 469 -13.827 -40.812 -39.452 1.00 25.00 C ATOM 815 CG1 VAL A 469 -13.753 -40.829 -40.973 1.00 25.00 C ATOM 816 CG2 VAL A 469 -14.098 -39.402 -38.973 1.00 25.00 C ATOM 0 H VAL A 469 -16.349 -40.654 -39.976 1.00 25.00 H new ATOM 0 HA VAL A 469 -14.644 -42.800 -39.306 1.00 25.00 H new ATOM 0 HB VAL A 469 -12.872 -41.137 -39.039 1.00 25.00 H new ATOM 0 HG11 VAL A 469 -12.987 -40.129 -41.308 1.00 25.00 H new ATOM 0 HG12 VAL A 469 -13.501 -41.833 -41.314 1.00 25.00 H new ATOM 0 HG13 VAL A 469 -14.718 -40.537 -41.388 1.00 25.00 H new ATOM 0 HG21 VAL A 469 -13.319 -38.736 -39.343 1.00 25.00 H new ATOM 0 HG22 VAL A 469 -15.067 -39.070 -39.347 1.00 25.00 H new ATOM 0 HG23 VAL A 469 -14.104 -39.383 -37.883 1.00 25.00 H new ATOM 826 N ALA A 470 -15.884 -41.064 -36.831 1.00 25.00 N ATOM 827 CA ALA A 470 -15.975 -40.992 -35.369 1.00 25.00 C ATOM 828 C ALA A 470 -16.148 -42.381 -34.742 1.00 25.00 C ATOM 829 O ALA A 470 -15.710 -42.624 -33.614 1.00 25.00 O ATOM 830 CB ALA A 470 -17.116 -40.075 -34.957 1.00 25.00 C ATOM 0 H ALA A 470 -16.590 -40.519 -37.326 1.00 25.00 H new ATOM 0 HA ALA A 470 -15.037 -40.580 -34.998 1.00 25.00 H new ATOM 0 HB1 ALA A 470 -17.172 -40.031 -33.869 1.00 25.00 H new ATOM 0 HB2 ALA A 470 -16.940 -39.075 -35.352 1.00 25.00 H new ATOM 0 HB3 ALA A 470 -18.055 -40.462 -35.353 1.00 25.00 H new ATOM 836 N ALA A 471 -16.764 -43.300 -35.478 1.00 25.00 N ATOM 837 CA ALA A 471 -16.920 -44.671 -35.004 1.00 25.00 C ATOM 838 C ALA A 471 -15.540 -45.344 -34.904 1.00 25.00 C ATOM 839 O ALA A 471 -15.307 -46.167 -34.026 1.00 25.00 O ATOM 840 CB ALA A 471 -17.837 -45.452 -35.952 1.00 25.00 C ATOM 0 H ALA A 471 -17.162 -43.122 -36.400 1.00 25.00 H new ATOM 0 HA ALA A 471 -17.377 -44.663 -34.014 1.00 25.00 H new ATOM 0 HB1 ALA A 471 -17.948 -46.474 -35.591 1.00 25.00 H new ATOM 0 HB2 ALA A 471 -18.815 -44.972 -35.990 1.00 25.00 H new ATOM 0 HB3 ALA A 471 -17.401 -45.466 -36.951 1.00 25.00 H new ATOM 846 N ALA A 472 -14.634 -44.970 -35.798 1.00 25.00 N ATOM 847 CA ALA A 472 -13.267 -45.482 -35.788 1.00 25.00 C ATOM 848 C ALA A 472 -12.497 -44.868 -34.626 1.00 25.00 C ATOM 849 O ALA A 472 -11.686 -45.525 -33.998 1.00 25.00 O ATOM 850 CB ALA A 472 -12.549 -45.130 -37.116 1.00 25.00 C ATOM 0 H ALA A 472 -14.823 -44.306 -36.549 1.00 25.00 H new ATOM 0 HA ALA A 472 -13.303 -46.566 -35.677 1.00 25.00 H new ATOM 0 HB1 ALA A 472 -11.531 -45.518 -37.093 1.00 25.00 H new ATOM 0 HB2 ALA A 472 -13.089 -45.576 -37.951 1.00 25.00 H new ATOM 0 HB3 ALA A 472 -12.522 -44.047 -37.239 1.00 25.00 H new ATOM 856 N GLN A 473 -12.748 -43.597 -34.357 1.00 25.00 N ATOM 857 CA GLN A 473 -12.006 -42.884 -33.323 1.00 25.00 C ATOM 858 C GLN A 473 -12.350 -43.374 -31.927 1.00 25.00 C ATOM 859 O GLN A 473 -11.477 -43.632 -31.112 1.00 25.00 O ATOM 860 CB GLN A 473 -12.233 -41.376 -33.447 1.00 25.00 C ATOM 861 CG GLN A 473 -12.113 -40.915 -34.884 1.00 25.00 C ATOM 862 CD GLN A 473 -11.663 -39.506 -35.049 1.00 25.00 C ATOM 863 OE1 GLN A 473 -12.196 -38.589 -34.445 1.00 25.00 O ATOM 864 NE2 GLN A 473 -10.694 -39.322 -35.898 1.00 25.00 N ATOM 0 H GLN A 473 -13.455 -43.038 -34.835 1.00 25.00 H new ATOM 0 HA GLN A 473 -10.947 -43.093 -33.478 1.00 25.00 H new ATOM 0 HB2 GLN A 473 -13.221 -41.123 -33.064 1.00 25.00 H new ATOM 0 HB3 GLN A 473 -11.507 -40.845 -32.831 1.00 25.00 H new ATOM 0 HG2 GLN A 473 -11.413 -41.569 -35.404 1.00 25.00 H new ATOM 0 HG3 GLN A 473 -13.081 -41.032 -35.371 1.00 25.00 H new ATOM 0 HE21 GLN A 473 -10.279 -40.120 -36.379 1.00 25.00 H new ATOM 0 HE22 GLN A 473 -10.349 -38.380 -36.082 1.00 25.00 H new ATOM 873 N ARG A 474 -13.634 -43.545 -31.647 1.00 25.00 N ATOM 874 CA ARG A 474 -14.039 -44.072 -30.339 1.00 25.00 C ATOM 875 C ARG A 474 -13.490 -45.484 -30.163 1.00 25.00 C ATOM 876 O ARG A 474 -13.276 -45.946 -29.048 1.00 25.00 O ATOM 877 CB ARG A 474 -15.561 -44.050 -30.175 1.00 25.00 C ATOM 878 CG ARG A 474 -16.329 -44.954 -31.129 1.00 25.00 C ATOM 879 CD ARG A 474 -17.825 -44.813 -30.935 1.00 25.00 C ATOM 880 NE ARG A 474 -18.241 -45.276 -29.599 1.00 25.00 N ATOM 881 CZ ARG A 474 -19.480 -45.234 -29.124 1.00 25.00 C ATOM 882 NH1 ARG A 474 -20.483 -44.761 -29.824 1.00 25.00 N ATOM 883 NH2 ARG A 474 -19.715 -45.674 -27.919 1.00 25.00 N ATOM 0 H ARG A 474 -14.401 -43.335 -32.286 1.00 25.00 H new ATOM 0 HA ARG A 474 -13.623 -43.431 -29.562 1.00 25.00 H new ATOM 0 HB2 ARG A 474 -15.804 -44.338 -29.152 1.00 25.00 H new ATOM 0 HB3 ARG A 474 -15.910 -43.026 -30.310 1.00 25.00 H new ATOM 0 HG2 ARG A 474 -16.068 -44.706 -32.158 1.00 25.00 H new ATOM 0 HG3 ARG A 474 -16.035 -45.991 -30.967 1.00 25.00 H new ATOM 0 HD2 ARG A 474 -18.114 -43.770 -31.066 1.00 25.00 H new ATOM 0 HD3 ARG A 474 -18.348 -45.387 -31.700 1.00 25.00 H new ATOM 0 HE ARG A 474 -17.518 -45.660 -28.990 1.00 25.00 H new ATOM 0 HH11 ARG A 474 -20.325 -44.409 -30.768 1.00 25.00 H new ATOM 0 HH12 ARG A 474 -21.421 -44.745 -29.424 1.00 25.00 H new ATOM 0 HH21 ARG A 474 -18.951 -46.045 -27.353 1.00 25.00 H new ATOM 0 HH22 ARG A 474 -20.662 -45.647 -27.542 1.00 25.00 H new ATOM 897 N LEU A 475 -13.268 -46.159 -31.279 1.00 25.00 N ATOM 898 CA LEU A 475 -12.718 -47.504 -31.281 1.00 25.00 C ATOM 899 C LEU A 475 -11.208 -47.475 -31.004 1.00 25.00 C ATOM 900 O LEU A 475 -10.737 -48.212 -30.144 1.00 25.00 O ATOM 901 CB LEU A 475 -13.025 -48.169 -32.633 1.00 25.00 C ATOM 902 CG LEU A 475 -11.989 -49.135 -33.225 1.00 25.00 C ATOM 903 CD1 LEU A 475 -11.906 -50.420 -32.394 1.00 25.00 C ATOM 904 CD2 LEU A 475 -12.351 -49.474 -34.657 1.00 25.00 C ATOM 0 H LEU A 475 -13.464 -45.789 -32.209 1.00 25.00 H new ATOM 0 HA LEU A 475 -13.180 -48.088 -30.485 1.00 25.00 H new ATOM 0 HB2 LEU A 475 -13.964 -48.712 -32.530 1.00 25.00 H new ATOM 0 HB3 LEU A 475 -13.194 -47.376 -33.362 1.00 25.00 H new ATOM 0 HG LEU A 475 -11.016 -48.645 -33.206 1.00 25.00 H new ATOM 0 HD11 LEU A 475 -11.166 -51.089 -32.832 1.00 25.00 H new ATOM 0 HD12 LEU A 475 -11.614 -50.175 -31.373 1.00 25.00 H new ATOM 0 HD13 LEU A 475 -12.879 -50.911 -32.385 1.00 25.00 H new ATOM 0 HD21 LEU A 475 -11.610 -50.160 -35.067 1.00 25.00 H new ATOM 0 HD22 LEU A 475 -13.334 -49.945 -34.682 1.00 25.00 H new ATOM 0 HD23 LEU A 475 -12.370 -48.562 -35.253 1.00 25.00 H new ATOM 916 N VAL A 476 -10.445 -46.652 -31.714 1.00 25.00 N ATOM 917 CA VAL A 476 -8.990 -46.637 -31.521 1.00 25.00 C ATOM 918 C VAL A 476 -8.684 -46.179 -30.105 1.00 25.00 C ATOM 919 O VAL A 476 -7.793 -46.714 -29.444 1.00 25.00 O ATOM 920 CB VAL A 476 -8.229 -45.782 -32.590 1.00 25.00 C ATOM 921 CG1 VAL A 476 -8.649 -44.347 -32.577 1.00 25.00 C ATOM 922 CG2 VAL A 476 -6.720 -45.880 -32.380 1.00 25.00 C ATOM 0 H VAL A 476 -10.794 -45.998 -32.415 1.00 25.00 H new ATOM 0 HA VAL A 476 -8.621 -47.653 -31.664 1.00 25.00 H new ATOM 0 HB VAL A 476 -8.490 -46.193 -33.565 1.00 25.00 H new ATOM 0 HG11 VAL A 476 -8.092 -43.798 -33.336 1.00 25.00 H new ATOM 0 HG12 VAL A 476 -9.716 -44.278 -32.789 1.00 25.00 H new ATOM 0 HG13 VAL A 476 -8.446 -43.917 -31.596 1.00 25.00 H new ATOM 0 HG21 VAL A 476 -6.208 -45.280 -33.132 1.00 25.00 H new ATOM 0 HG22 VAL A 476 -6.466 -45.511 -31.386 1.00 25.00 H new ATOM 0 HG23 VAL A 476 -6.407 -46.920 -32.471 1.00 25.00 H new ATOM 932 N HIS A 477 -9.448 -45.214 -29.625 1.00 25.00 N ATOM 933 CA HIS A 477 -9.283 -44.710 -28.286 1.00 25.00 C ATOM 934 C HIS A 477 -9.555 -45.815 -27.267 1.00 25.00 C ATOM 935 O HIS A 477 -8.915 -45.872 -26.231 1.00 25.00 O ATOM 936 CB HIS A 477 -10.220 -43.525 -28.075 1.00 25.00 C ATOM 937 CG HIS A 477 -9.804 -42.637 -26.950 1.00 25.00 C ATOM 938 ND1 HIS A 477 -10.388 -41.435 -26.647 1.00 25.00 N ATOM 939 CD2 HIS A 477 -8.809 -42.785 -26.041 1.00 25.00 C ATOM 940 CE1 HIS A 477 -9.766 -40.927 -25.588 1.00 25.00 C ATOM 941 NE2 HIS A 477 -8.796 -41.714 -25.169 1.00 25.00 N ATOM 0 H HIS A 477 -10.195 -44.764 -30.154 1.00 25.00 H new ATOM 0 HA HIS A 477 -8.256 -44.374 -28.145 1.00 25.00 H new ATOM 0 HB2 HIS A 477 -10.266 -42.939 -28.993 1.00 25.00 H new ATOM 0 HB3 HIS A 477 -11.227 -43.896 -27.883 1.00 25.00 H new ATOM 0 HD2 HIS A 477 -8.125 -43.620 -26.004 1.00 25.00 H new ATOM 0 HE1 HIS A 477 -10.024 -39.985 -25.127 1.00 25.00 H new ATOM 0 HE2 HIS A 477 -8.173 -41.565 -24.375 1.00 25.00 H new ATOM 949 N ALA A 478 -10.485 -46.714 -27.562 1.00 25.00 N ATOM 950 CA ALA A 478 -10.772 -47.805 -26.640 1.00 25.00 C ATOM 951 C ALA A 478 -9.532 -48.692 -26.474 1.00 25.00 C ATOM 952 O ALA A 478 -9.195 -49.094 -25.366 1.00 25.00 O ATOM 953 CB ALA A 478 -11.965 -48.625 -27.138 1.00 25.00 C ATOM 0 H ALA A 478 -11.044 -46.711 -28.415 1.00 25.00 H new ATOM 0 HA ALA A 478 -11.031 -47.387 -25.667 1.00 25.00 H new ATOM 0 HB1 ALA A 478 -12.167 -49.436 -26.438 1.00 25.00 H new ATOM 0 HB2 ALA A 478 -12.843 -47.983 -27.212 1.00 25.00 H new ATOM 0 HB3 ALA A 478 -11.736 -49.041 -28.119 1.00 25.00 H new ATOM 959 N ILE A 479 -8.843 -48.988 -27.569 1.00 25.00 N ATOM 960 CA ILE A 479 -7.644 -49.829 -27.502 1.00 25.00 C ATOM 961 C ILE A 479 -6.515 -49.052 -26.858 1.00 25.00 C ATOM 962 O ILE A 479 -5.708 -49.619 -26.148 1.00 25.00 O ATOM 963 CB ILE A 479 -7.175 -50.291 -28.891 1.00 25.00 C ATOM 964 CG1 ILE A 479 -8.302 -51.010 -29.632 1.00 25.00 C ATOM 965 CG2 ILE A 479 -5.961 -51.254 -28.802 1.00 25.00 C ATOM 966 CD1 ILE A 479 -8.439 -50.481 -30.985 1.00 25.00 C ATOM 0 H ILE A 479 -9.086 -48.665 -28.506 1.00 25.00 H new ATOM 0 HA ILE A 479 -7.905 -50.710 -26.915 1.00 25.00 H new ATOM 0 HB ILE A 479 -6.879 -49.392 -29.432 1.00 25.00 H new ATOM 0 HG12 ILE A 479 -8.095 -52.079 -29.672 1.00 25.00 H new ATOM 0 HG13 ILE A 479 -9.239 -50.886 -29.090 1.00 25.00 H new ATOM 0 HG21 ILE A 479 -5.662 -51.556 -29.806 1.00 25.00 H new ATOM 0 HG22 ILE A 479 -5.129 -50.747 -28.313 1.00 25.00 H new ATOM 0 HG23 ILE A 479 -6.238 -52.136 -28.225 1.00 25.00 H new ATOM 0 HD11 ILE A 479 -9.245 -51.003 -31.500 1.00 25.00 H new ATOM 0 HD12 ILE A 479 -8.668 -49.416 -30.938 1.00 25.00 H new ATOM 0 HD13 ILE A 479 -7.506 -50.628 -31.529 1.00 25.00 H new ATOM 978 N ALA A 480 -6.469 -47.749 -27.085 1.00 25.00 N ATOM 979 CA ALA A 480 -5.443 -46.898 -26.490 1.00 25.00 C ATOM 980 C ALA A 480 -5.489 -47.018 -24.963 1.00 25.00 C ATOM 981 O ALA A 480 -4.487 -46.834 -24.271 1.00 25.00 O ATOM 982 CB ALA A 480 -5.656 -45.452 -26.921 1.00 25.00 C ATOM 0 H ALA A 480 -7.133 -47.253 -27.680 1.00 25.00 H new ATOM 0 HA ALA A 480 -4.461 -47.222 -26.834 1.00 25.00 H new ATOM 0 HB1 ALA A 480 -4.887 -44.822 -26.474 1.00 25.00 H new ATOM 0 HB2 ALA A 480 -5.595 -45.383 -28.007 1.00 25.00 H new ATOM 0 HB3 ALA A 480 -6.639 -45.115 -26.591 1.00 25.00 H new ATOM 988 N LEU A 481 -6.658 -47.342 -24.437 1.00 25.00 N ATOM 989 CA LEU A 481 -6.799 -47.550 -22.992 1.00 25.00 C ATOM 990 C LEU A 481 -6.320 -48.936 -22.627 1.00 25.00 C ATOM 991 O LEU A 481 -5.633 -49.133 -21.637 1.00 25.00 O ATOM 992 CB LEU A 481 -8.246 -47.373 -22.557 1.00 25.00 C ATOM 993 CG LEU A 481 -8.748 -45.979 -22.919 1.00 25.00 C ATOM 994 CD1 LEU A 481 -10.260 -46.003 -23.033 1.00 25.00 C ATOM 995 CD2 LEU A 481 -8.301 -44.926 -21.909 1.00 25.00 C ATOM 0 H LEU A 481 -7.516 -47.467 -24.973 1.00 25.00 H new ATOM 0 HA LEU A 481 -6.192 -46.806 -22.476 1.00 25.00 H new ATOM 0 HB2 LEU A 481 -8.871 -48.126 -23.037 1.00 25.00 H new ATOM 0 HB3 LEU A 481 -8.330 -47.528 -21.481 1.00 25.00 H new ATOM 0 HG LEU A 481 -8.312 -45.700 -23.878 1.00 25.00 H new ATOM 0 HD11 LEU A 481 -10.621 -45.008 -23.292 1.00 25.00 H new ATOM 0 HD12 LEU A 481 -10.555 -46.709 -23.809 1.00 25.00 H new ATOM 0 HD13 LEU A 481 -10.692 -46.309 -22.080 1.00 25.00 H new ATOM 0 HD21 LEU A 481 -8.682 -43.950 -22.208 1.00 25.00 H new ATOM 0 HD22 LEU A 481 -8.689 -45.180 -20.923 1.00 25.00 H new ATOM 0 HD23 LEU A 481 -7.212 -44.895 -21.873 1.00 25.00 H new ATOM 1007 N MET A 482 -6.675 -49.910 -23.443 1.00 25.00 N ATOM 1008 CA MET A 482 -6.277 -51.293 -23.193 1.00 25.00 C ATOM 1009 C MET A 482 -4.785 -51.463 -23.252 1.00 25.00 C ATOM 1010 O MET A 482 -4.236 -52.364 -22.633 1.00 25.00 O ATOM 1011 CB MET A 482 -6.899 -52.229 -24.219 1.00 25.00 C ATOM 1012 CG MET A 482 -8.366 -52.131 -24.191 1.00 25.00 C ATOM 1013 SD MET A 482 -9.204 -53.585 -24.854 1.00 25.00 S ATOM 1014 CE MET A 482 -8.999 -53.340 -26.619 1.00 25.00 C ATOM 0 H MET A 482 -7.237 -49.776 -24.284 1.00 25.00 H new ATOM 0 HA MET A 482 -6.630 -51.540 -22.192 1.00 25.00 H new ATOM 0 HB2 MET A 482 -6.532 -51.980 -25.215 1.00 25.00 H new ATOM 0 HB3 MET A 482 -6.594 -53.255 -24.014 1.00 25.00 H new ATOM 0 HG2 MET A 482 -8.691 -51.973 -23.163 1.00 25.00 H new ATOM 0 HG3 MET A 482 -8.674 -51.254 -24.761 1.00 25.00 H new ATOM 0 HE1 MET A 482 -9.421 -54.190 -27.156 1.00 25.00 H new ATOM 0 HE2 MET A 482 -9.513 -52.428 -26.922 1.00 25.00 H new ATOM 0 HE3 MET A 482 -7.938 -53.253 -26.854 1.00 25.00 H new ATOM 1024 N THR A 483 -4.115 -50.611 -24.000 1.00 25.00 N ATOM 1025 CA THR A 483 -2.675 -50.768 -24.152 1.00 25.00 C ATOM 1026 C THR A 483 -1.976 -50.302 -22.888 1.00 25.00 C ATOM 1027 O THR A 483 -1.001 -50.912 -22.465 1.00 25.00 O ATOM 1028 CB THR A 483 -2.154 -50.028 -25.386 1.00 25.00 C ATOM 1029 OG1 THR A 483 -2.602 -48.676 -25.352 1.00 25.00 O ATOM 1030 CG2 THR A 483 -2.691 -50.687 -26.655 1.00 25.00 C ATOM 0 H THR A 483 -4.525 -49.823 -24.501 1.00 25.00 H new ATOM 0 HA THR A 483 -2.454 -51.824 -24.306 1.00 25.00 H new ATOM 0 HB THR A 483 -1.065 -50.065 -25.385 1.00 25.00 H new ATOM 0 HG1 THR A 483 -2.268 -48.201 -26.141 1.00 25.00 H new ATOM 0 HG21 THR A 483 -2.315 -50.154 -27.529 1.00 25.00 H new ATOM 0 HG22 THR A 483 -2.361 -51.725 -26.694 1.00 25.00 H new ATOM 0 HG23 THR A 483 -3.780 -50.653 -26.650 1.00 25.00 H new ATOM 1038 N GLN A 484 -2.475 -49.248 -22.263 1.00 25.00 N ATOM 1039 CA GLN A 484 -1.872 -48.765 -21.027 1.00 25.00 C ATOM 1040 C GLN A 484 -2.330 -49.604 -19.834 1.00 25.00 C ATOM 1041 O GLN A 484 -1.549 -49.850 -18.916 1.00 25.00 O ATOM 1042 CB GLN A 484 -2.140 -47.263 -20.818 1.00 25.00 C ATOM 1043 CG GLN A 484 -3.600 -46.846 -20.854 1.00 25.00 C ATOM 1044 CD GLN A 484 -3.768 -45.348 -20.853 1.00 25.00 C ATOM 1045 OE1 GLN A 484 -3.608 -44.696 -19.836 1.00 25.00 O ATOM 1046 NE2 GLN A 484 -4.084 -44.798 -21.995 1.00 25.00 N ATOM 0 H GLN A 484 -3.284 -48.716 -22.583 1.00 25.00 H new ATOM 0 HA GLN A 484 -0.791 -48.881 -21.110 1.00 25.00 H new ATOM 0 HB2 GLN A 484 -1.720 -46.968 -19.857 1.00 25.00 H new ATOM 0 HB3 GLN A 484 -1.603 -46.706 -21.585 1.00 25.00 H new ATOM 0 HG2 GLN A 484 -4.072 -47.262 -21.744 1.00 25.00 H new ATOM 0 HG3 GLN A 484 -4.117 -47.268 -19.992 1.00 25.00 H new ATOM 0 HE21 GLN A 484 -4.209 -45.379 -22.824 1.00 25.00 H new ATOM 0 HE22 GLN A 484 -4.206 -43.787 -22.058 1.00 25.00 H new ATOM 1055 N PHE A 485 -3.572 -50.074 -19.843 1.00 25.00 N ATOM 1056 CA PHE A 485 -4.060 -50.909 -18.765 1.00 25.00 C ATOM 1057 C PHE A 485 -3.410 -52.287 -18.840 1.00 25.00 C ATOM 1058 O PHE A 485 -3.185 -52.932 -17.822 1.00 25.00 O ATOM 1059 CB PHE A 485 -5.576 -51.034 -18.857 1.00 25.00 C ATOM 1060 CG PHE A 485 -6.320 -49.874 -18.238 1.00 25.00 C ATOM 1061 CD1 PHE A 485 -6.105 -49.526 -16.887 1.00 25.00 C ATOM 1062 CD2 PHE A 485 -7.245 -49.126 -18.990 1.00 25.00 C ATOM 1063 CE1 PHE A 485 -6.793 -48.435 -16.299 1.00 25.00 C ATOM 1064 CE2 PHE A 485 -7.938 -48.030 -18.413 1.00 25.00 C ATOM 1065 CZ PHE A 485 -7.707 -47.685 -17.067 1.00 25.00 C ATOM 0 H PHE A 485 -4.251 -49.890 -20.581 1.00 25.00 H new ATOM 0 HA PHE A 485 -3.801 -50.452 -17.810 1.00 25.00 H new ATOM 0 HB2 PHE A 485 -5.862 -51.119 -19.905 1.00 25.00 H new ATOM 0 HB3 PHE A 485 -5.886 -51.956 -18.366 1.00 25.00 H new ATOM 0 HD1 PHE A 485 -5.407 -50.098 -16.294 1.00 25.00 H new ATOM 0 HD2 PHE A 485 -7.430 -49.390 -20.021 1.00 25.00 H new ATOM 0 HE1 PHE A 485 -6.617 -48.179 -15.265 1.00 25.00 H new ATOM 0 HE2 PHE A 485 -8.641 -47.462 -19.005 1.00 25.00 H new ATOM 0 HZ PHE A 485 -8.228 -46.849 -16.625 1.00 25.00 H new