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 133:sc= -0.0399 (180deg=-0.943) USER MOD Single : A 433 MET CE :methyl -149:sc= -0.0088 (180deg=-1.28) USER MOD Single : A 434 THR OG1 : rot 74:sc= 1.26 USER MOD Single : A 436 GLN : amide:sc= 0.375 X(o=0.38,f=0) USER MOD Single : A 464 GLN : amide:sc= -0.0127 X(o=-0.013,f=0) USER MOD Single : A 467 GLN : amide:sc= -0.0378 X(o=-0.038,f=-0.033) USER MOD Single : A 473 GLN : amide:sc= 0 K(o=0,f=-0.92) USER MOD Single : A 477 HIS : no HD1:sc= -0.0142 X(o=-0.014,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= 0.0586 X(o=0.059,f=-0.012) USER MOD ----------------------------------------------------------------- ATOM 113 N GLU A 419 -17.395 -53.132 -21.517 1.00 25.00 N ATOM 114 CA GLU A 419 -17.484 -51.702 -21.786 1.00 25.00 C ATOM 115 C GLU A 419 -18.468 -51.022 -20.824 1.00 25.00 C ATOM 116 O GLU A 419 -18.315 -49.862 -20.507 1.00 25.00 O ATOM 117 CB GLU A 419 -17.926 -51.523 -23.243 1.00 25.00 C ATOM 118 CG GLU A 419 -17.741 -50.118 -23.827 1.00 25.00 C ATOM 119 CD GLU A 419 -18.097 -50.071 -25.315 1.00 25.00 C ATOM 120 OE1 GLU A 419 -18.323 -51.159 -25.890 1.00 25.00 O ATOM 121 OE2 GLU A 419 -18.165 -48.970 -25.909 1.00 25.00 O ATOM 0 HA GLU A 419 -16.513 -51.231 -21.630 1.00 25.00 H new ATOM 0 HB2 GLU A 419 -17.371 -52.229 -23.861 1.00 25.00 H new ATOM 0 HB3 GLU A 419 -18.979 -51.792 -23.319 1.00 25.00 H new ATOM 0 HG2 GLU A 419 -18.366 -49.412 -23.281 1.00 25.00 H new ATOM 0 HG3 GLU A 419 -16.707 -49.800 -23.690 1.00 25.00 H new ATOM 128 N VAL A 420 -19.465 -51.757 -20.344 1.00 25.00 N ATOM 129 CA VAL A 420 -20.445 -51.215 -19.397 1.00 25.00 C ATOM 130 C VAL A 420 -19.754 -50.870 -18.070 1.00 25.00 C ATOM 131 O VAL A 420 -20.119 -49.906 -17.403 1.00 25.00 O ATOM 132 CB VAL A 420 -21.620 -52.235 -19.166 1.00 25.00 C ATOM 133 CG1 VAL A 420 -22.617 -51.729 -18.111 1.00 25.00 C ATOM 134 CG2 VAL A 420 -22.358 -52.490 -20.484 1.00 25.00 C ATOM 0 H VAL A 420 -19.620 -52.734 -20.594 1.00 25.00 H new ATOM 0 HA VAL A 420 -20.871 -50.304 -19.817 1.00 25.00 H new ATOM 0 HB VAL A 420 -21.181 -53.163 -18.799 1.00 25.00 H new ATOM 0 HG11 VAL A 420 -23.413 -52.462 -17.981 1.00 25.00 H new ATOM 0 HG12 VAL A 420 -22.100 -51.583 -17.163 1.00 25.00 H new ATOM 0 HG13 VAL A 420 -23.046 -50.783 -18.440 1.00 25.00 H new ATOM 0 HG21 VAL A 420 -23.170 -53.197 -20.315 1.00 25.00 H new ATOM 0 HG22 VAL A 420 -22.766 -51.552 -20.860 1.00 25.00 H new ATOM 0 HG23 VAL A 420 -21.664 -52.903 -21.216 1.00 25.00 H new ATOM 144 N SER A 421 -18.743 -51.637 -17.693 1.00 25.00 N ATOM 145 CA SER A 421 -18.016 -51.359 -16.455 1.00 25.00 C ATOM 146 C SER A 421 -17.202 -50.074 -16.579 1.00 25.00 C ATOM 147 O SER A 421 -17.090 -49.306 -15.629 1.00 25.00 O ATOM 148 CB SER A 421 -17.077 -52.512 -16.129 1.00 25.00 C ATOM 149 OG SER A 421 -17.796 -53.734 -16.043 1.00 25.00 O ATOM 0 H SER A 421 -18.407 -52.447 -18.215 1.00 25.00 H new ATOM 0 HA SER A 421 -18.747 -51.241 -15.656 1.00 25.00 H new ATOM 0 HB2 SER A 421 -16.308 -52.590 -16.897 1.00 25.00 H new ATOM 0 HB3 SER A 421 -16.567 -52.317 -15.186 1.00 25.00 H new ATOM 0 HG SER A 421 -17.176 -54.464 -15.835 1.00 25.00 H new ATOM 155 N ASP A 422 -16.644 -49.841 -17.758 1.00 25.00 N ATOM 156 CA ASP A 422 -15.855 -48.630 -18.010 1.00 25.00 C ATOM 157 C ASP A 422 -16.796 -47.447 -18.164 1.00 25.00 C ATOM 158 O ASP A 422 -16.472 -46.323 -17.804 1.00 25.00 O ATOM 159 CB ASP A 422 -15.011 -48.808 -19.275 1.00 25.00 C ATOM 160 CG ASP A 422 -13.899 -47.771 -19.387 1.00 25.00 C ATOM 161 OD1 ASP A 422 -13.631 -47.307 -20.516 1.00 25.00 O ATOM 162 OD2 ASP A 422 -13.284 -47.437 -18.351 1.00 25.00 O ATOM 0 H ASP A 422 -16.719 -50.469 -18.558 1.00 25.00 H new ATOM 0 HA ASP A 422 -15.183 -48.449 -17.171 1.00 25.00 H new ATOM 0 HB2 ASP A 422 -14.574 -49.806 -19.278 1.00 25.00 H new ATOM 0 HB3 ASP A 422 -15.656 -48.740 -20.151 1.00 25.00 H new ATOM 167 N MET A 423 -17.983 -47.719 -18.681 1.00 25.00 N ATOM 168 CA MET A 423 -19.006 -46.694 -18.842 1.00 25.00 C ATOM 169 C MET A 423 -19.403 -46.174 -17.462 1.00 25.00 C ATOM 170 O MET A 423 -19.537 -44.983 -17.264 1.00 25.00 O ATOM 171 CB MET A 423 -20.209 -47.268 -19.596 1.00 25.00 C ATOM 172 CG MET A 423 -21.295 -46.262 -19.932 1.00 25.00 C ATOM 173 SD MET A 423 -22.523 -46.994 -21.062 1.00 25.00 S ATOM 174 CE MET A 423 -23.234 -48.297 -20.045 1.00 25.00 C ATOM 0 H MET A 423 -18.265 -48.646 -18.999 1.00 25.00 H new ATOM 0 HA MET A 423 -18.619 -45.862 -19.430 1.00 25.00 H new ATOM 0 HB2 MET A 423 -19.856 -47.721 -20.522 1.00 25.00 H new ATOM 0 HB3 MET A 423 -20.647 -48.066 -18.997 1.00 25.00 H new ATOM 0 HG2 MET A 423 -21.787 -45.931 -19.017 1.00 25.00 H new ATOM 0 HG3 MET A 423 -20.851 -45.379 -20.392 1.00 25.00 H new ATOM 0 HE1 MET A 423 -24.321 -48.260 -20.114 1.00 25.00 H new ATOM 0 HE2 MET A 423 -22.881 -49.266 -20.396 1.00 25.00 H new ATOM 0 HE3 MET A 423 -22.932 -48.155 -19.008 1.00 25.00 H new ATOM 184 N ALA A 424 -19.559 -47.069 -16.499 1.00 25.00 N ATOM 185 CA ALA A 424 -19.902 -46.661 -15.138 1.00 25.00 C ATOM 186 C ALA A 424 -18.761 -45.837 -14.512 1.00 25.00 C ATOM 187 O ALA A 424 -18.992 -44.941 -13.697 1.00 25.00 O ATOM 188 CB ALA A 424 -20.197 -47.901 -14.286 1.00 25.00 C ATOM 0 H ALA A 424 -19.455 -48.075 -16.629 1.00 25.00 H new ATOM 0 HA ALA A 424 -20.792 -46.033 -15.173 1.00 25.00 H new ATOM 0 HB1 ALA A 424 -20.452 -47.593 -13.272 1.00 25.00 H new ATOM 0 HB2 ALA A 424 -21.033 -48.450 -14.720 1.00 25.00 H new ATOM 0 HB3 ALA A 424 -19.316 -48.542 -14.260 1.00 25.00 H new ATOM 194 N ALA A 425 -17.528 -46.152 -14.886 1.00 25.00 N ATOM 195 CA ALA A 425 -16.370 -45.443 -14.355 1.00 25.00 C ATOM 196 C ALA A 425 -16.295 -44.015 -14.906 1.00 25.00 C ATOM 197 O ALA A 425 -16.065 -43.062 -14.158 1.00 25.00 O ATOM 198 CB ALA A 425 -15.086 -46.212 -14.698 1.00 25.00 C ATOM 0 H ALA A 425 -17.304 -46.891 -15.552 1.00 25.00 H new ATOM 0 HA ALA A 425 -16.474 -45.380 -13.272 1.00 25.00 H new ATOM 0 HB1 ALA A 425 -14.224 -45.677 -14.299 1.00 25.00 H new ATOM 0 HB2 ALA A 425 -15.130 -47.209 -14.259 1.00 25.00 H new ATOM 0 HB3 ALA A 425 -14.991 -46.297 -15.781 1.00 25.00 H new ATOM 204 N VAL A 426 -16.476 -43.866 -16.211 1.00 25.00 N ATOM 205 CA VAL A 426 -16.400 -42.549 -16.841 1.00 25.00 C ATOM 206 C VAL A 426 -17.589 -41.689 -16.438 1.00 25.00 C ATOM 207 O VAL A 426 -17.458 -40.483 -16.284 1.00 25.00 O ATOM 208 CB VAL A 426 -16.254 -42.672 -18.381 1.00 25.00 C ATOM 209 CG1 VAL A 426 -17.486 -43.242 -19.047 1.00 25.00 C ATOM 210 CG2 VAL A 426 -15.890 -41.333 -18.996 1.00 25.00 C ATOM 0 H VAL A 426 -16.675 -44.633 -16.853 1.00 25.00 H new ATOM 0 HA VAL A 426 -15.503 -42.045 -16.481 1.00 25.00 H new ATOM 0 HB VAL A 426 -15.444 -43.380 -18.559 1.00 25.00 H new ATOM 0 HG11 VAL A 426 -17.323 -43.303 -20.123 1.00 25.00 H new ATOM 0 HG12 VAL A 426 -17.685 -44.239 -18.653 1.00 25.00 H new ATOM 0 HG13 VAL A 426 -18.340 -42.595 -18.846 1.00 25.00 H new ATOM 0 HG21 VAL A 426 -15.793 -41.443 -20.076 1.00 25.00 H new ATOM 0 HG22 VAL A 426 -16.671 -40.606 -18.774 1.00 25.00 H new ATOM 0 HG23 VAL A 426 -14.944 -40.987 -18.580 1.00 25.00 H new ATOM 220 N GLU A 427 -18.733 -42.318 -16.231 1.00 25.00 N ATOM 221 CA GLU A 427 -19.928 -41.620 -15.739 1.00 25.00 C ATOM 222 C GLU A 427 -19.603 -40.940 -14.405 1.00 25.00 C ATOM 223 O GLU A 427 -19.933 -39.777 -14.182 1.00 25.00 O ATOM 224 CB GLU A 427 -21.082 -42.606 -15.520 1.00 25.00 C ATOM 225 CG GLU A 427 -21.918 -42.908 -16.768 1.00 25.00 C ATOM 226 CD GLU A 427 -22.919 -44.048 -16.537 1.00 25.00 C ATOM 227 OE1 GLU A 427 -23.541 -44.511 -17.523 1.00 25.00 O ATOM 228 OE2 GLU A 427 -23.095 -44.477 -15.370 1.00 25.00 O ATOM 0 H GLU A 427 -18.869 -43.316 -16.394 1.00 25.00 H new ATOM 0 HA GLU A 427 -20.227 -40.881 -16.482 1.00 25.00 H new ATOM 0 HB2 GLU A 427 -20.674 -43.542 -15.139 1.00 25.00 H new ATOM 0 HB3 GLU A 427 -21.740 -42.207 -14.748 1.00 25.00 H new ATOM 0 HG2 GLU A 427 -22.457 -42.009 -17.068 1.00 25.00 H new ATOM 0 HG3 GLU A 427 -21.255 -43.171 -17.592 1.00 25.00 H new ATOM 235 N ALA A 428 -18.940 -41.662 -13.512 1.00 25.00 N ATOM 236 CA ALA A 428 -18.568 -41.097 -12.218 1.00 25.00 C ATOM 237 C ALA A 428 -17.539 -39.970 -12.399 1.00 25.00 C ATOM 238 O ALA A 428 -17.572 -38.956 -11.689 1.00 25.00 O ATOM 239 CB ALA A 428 -18.006 -42.200 -11.312 1.00 25.00 C ATOM 0 H ALA A 428 -18.650 -42.630 -13.655 1.00 25.00 H new ATOM 0 HA ALA A 428 -19.456 -40.674 -11.748 1.00 25.00 H new ATOM 0 HB1 ALA A 428 -17.730 -41.773 -10.348 1.00 25.00 H new ATOM 0 HB2 ALA A 428 -18.763 -42.971 -11.165 1.00 25.00 H new ATOM 0 HB3 ALA A 428 -17.125 -42.641 -11.779 1.00 25.00 H new ATOM 245 N ALA A 429 -16.633 -40.155 -13.349 1.00 25.00 N ATOM 246 CA ALA A 429 -15.584 -39.177 -13.614 1.00 25.00 C ATOM 247 C ALA A 429 -16.153 -37.869 -14.175 1.00 25.00 C ATOM 248 O ALA A 429 -15.757 -36.785 -13.752 1.00 25.00 O ATOM 249 CB ALA A 429 -14.561 -39.767 -14.590 1.00 25.00 C ATOM 0 H ALA A 429 -16.603 -40.977 -13.952 1.00 25.00 H new ATOM 0 HA ALA A 429 -15.097 -38.944 -12.667 1.00 25.00 H new ATOM 0 HB1 ALA A 429 -13.779 -39.033 -14.785 1.00 25.00 H new ATOM 0 HB2 ALA A 429 -14.118 -40.663 -14.155 1.00 25.00 H new ATOM 0 HB3 ALA A 429 -15.058 -40.026 -15.525 1.00 25.00 H new ATOM 255 N GLU A 430 -17.070 -37.949 -15.128 1.00 25.00 N ATOM 256 CA GLU A 430 -17.632 -36.732 -15.703 1.00 25.00 C ATOM 257 C GLU A 430 -18.510 -36.038 -14.674 1.00 25.00 C ATOM 258 O GLU A 430 -18.584 -34.810 -14.651 1.00 25.00 O ATOM 259 CB GLU A 430 -18.385 -36.992 -17.018 1.00 25.00 C ATOM 260 CG GLU A 430 -19.651 -37.819 -16.904 1.00 25.00 C ATOM 261 CD GLU A 430 -20.330 -38.001 -18.252 1.00 25.00 C ATOM 262 OE1 GLU A 430 -20.757 -36.985 -18.846 1.00 25.00 O ATOM 263 OE2 GLU A 430 -20.429 -39.153 -18.724 1.00 25.00 O ATOM 0 H GLU A 430 -17.435 -38.820 -15.513 1.00 25.00 H new ATOM 0 HA GLU A 430 -16.806 -36.070 -15.964 1.00 25.00 H new ATOM 0 HB2 GLU A 430 -18.641 -36.031 -17.464 1.00 25.00 H new ATOM 0 HB3 GLU A 430 -17.707 -37.494 -17.709 1.00 25.00 H new ATOM 0 HG2 GLU A 430 -19.411 -38.795 -16.483 1.00 25.00 H new ATOM 0 HG3 GLU A 430 -20.340 -37.335 -16.212 1.00 25.00 H new ATOM 270 N LEU A 431 -19.149 -36.801 -13.797 1.00 25.00 N ATOM 271 CA LEU A 431 -19.964 -36.203 -12.747 1.00 25.00 C ATOM 272 C LEU A 431 -19.090 -35.357 -11.833 1.00 25.00 C ATOM 273 O LEU A 431 -19.473 -34.245 -11.467 1.00 25.00 O ATOM 274 CB LEU A 431 -20.686 -37.278 -11.928 1.00 25.00 C ATOM 275 CG LEU A 431 -21.992 -37.818 -12.537 1.00 25.00 C ATOM 276 CD1 LEU A 431 -22.436 -39.062 -11.770 1.00 25.00 C ATOM 277 CD2 LEU A 431 -23.107 -36.764 -12.498 1.00 25.00 C ATOM 0 H LEU A 431 -19.121 -37.821 -13.790 1.00 25.00 H new ATOM 0 HA LEU A 431 -20.717 -35.571 -13.218 1.00 25.00 H new ATOM 0 HB2 LEU A 431 -20.003 -38.115 -11.779 1.00 25.00 H new ATOM 0 HB3 LEU A 431 -20.908 -36.869 -10.942 1.00 25.00 H new ATOM 0 HG LEU A 431 -21.802 -38.070 -13.580 1.00 25.00 H new ATOM 0 HD11 LEU A 431 -23.361 -39.444 -12.201 1.00 25.00 H new ATOM 0 HD12 LEU A 431 -21.662 -39.826 -11.836 1.00 25.00 H new ATOM 0 HD13 LEU A 431 -22.603 -38.804 -10.724 1.00 25.00 H new ATOM 0 HD21 LEU A 431 -24.015 -37.179 -12.936 1.00 25.00 H new ATOM 0 HD22 LEU A 431 -23.301 -36.477 -11.464 1.00 25.00 H new ATOM 0 HD23 LEU A 431 -22.798 -35.886 -13.066 1.00 25.00 H new ATOM 289 N GLU A 432 -17.919 -35.849 -11.451 1.00 25.00 N ATOM 290 CA GLU A 432 -17.043 -35.035 -10.611 1.00 25.00 C ATOM 291 C GLU A 432 -16.382 -33.900 -11.386 1.00 25.00 C ATOM 292 O GLU A 432 -16.158 -32.828 -10.825 1.00 25.00 O ATOM 293 CB GLU A 432 -16.030 -35.865 -9.812 1.00 25.00 C ATOM 294 CG GLU A 432 -14.850 -36.437 -10.569 1.00 25.00 C ATOM 295 CD GLU A 432 -13.849 -37.081 -9.619 1.00 25.00 C ATOM 296 OE1 GLU A 432 -12.690 -37.300 -10.022 1.00 25.00 O ATOM 297 OE2 GLU A 432 -14.227 -37.354 -8.453 1.00 25.00 O ATOM 0 H GLU A 432 -17.561 -36.772 -11.696 1.00 25.00 H new ATOM 0 HA GLU A 432 -17.694 -34.569 -9.871 1.00 25.00 H new ATOM 0 HB2 GLU A 432 -15.643 -35.241 -9.006 1.00 25.00 H new ATOM 0 HB3 GLU A 432 -16.565 -36.692 -9.346 1.00 25.00 H new ATOM 0 HG2 GLU A 432 -15.200 -37.176 -11.289 1.00 25.00 H new ATOM 0 HG3 GLU A 432 -14.360 -35.646 -11.137 1.00 25.00 H new ATOM 304 N MET A 433 -16.090 -34.100 -12.665 1.00 25.00 N ATOM 305 CA MET A 433 -15.503 -33.032 -13.476 1.00 25.00 C ATOM 306 C MET A 433 -16.499 -31.899 -13.657 1.00 25.00 C ATOM 307 O MET A 433 -16.113 -30.732 -13.694 1.00 25.00 O ATOM 308 CB MET A 433 -15.057 -33.546 -14.845 1.00 25.00 C ATOM 309 CG MET A 433 -13.658 -34.132 -14.819 1.00 25.00 C ATOM 310 SD MET A 433 -13.052 -34.612 -16.459 1.00 25.00 S ATOM 311 CE MET A 433 -13.994 -36.114 -16.792 1.00 25.00 C ATOM 0 H MET A 433 -16.246 -34.978 -13.161 1.00 25.00 H new ATOM 0 HA MET A 433 -14.624 -32.664 -12.947 1.00 25.00 H new ATOM 0 HB2 MET A 433 -15.759 -34.305 -15.191 1.00 25.00 H new ATOM 0 HB3 MET A 433 -15.091 -32.728 -15.565 1.00 25.00 H new ATOM 0 HG2 MET A 433 -12.974 -33.403 -14.386 1.00 25.00 H new ATOM 0 HG3 MET A 433 -13.649 -35.005 -14.166 1.00 25.00 H new ATOM 0 HE1 MET A 433 -13.401 -36.785 -17.413 1.00 25.00 H new ATOM 0 HE2 MET A 433 -14.235 -36.609 -15.851 1.00 25.00 H new ATOM 0 HE3 MET A 433 -14.916 -35.857 -17.313 1.00 25.00 H new ATOM 321 N THR A 434 -17.779 -32.234 -13.740 1.00 25.00 N ATOM 322 CA THR A 434 -18.840 -31.231 -13.846 1.00 25.00 C ATOM 323 C THR A 434 -18.778 -30.302 -12.633 1.00 25.00 C ATOM 324 O THR A 434 -18.998 -29.101 -12.743 1.00 25.00 O ATOM 325 CB THR A 434 -20.240 -31.900 -13.931 1.00 25.00 C ATOM 326 OG1 THR A 434 -20.289 -32.756 -15.073 1.00 25.00 O ATOM 327 CG2 THR A 434 -21.346 -30.871 -14.094 1.00 25.00 C ATOM 0 H THR A 434 -18.113 -33.198 -13.736 1.00 25.00 H new ATOM 0 HA THR A 434 -18.687 -30.658 -14.761 1.00 25.00 H new ATOM 0 HB THR A 434 -20.391 -32.453 -13.004 1.00 25.00 H new ATOM 0 HG1 THR A 434 -19.763 -33.565 -14.899 1.00 25.00 H new ATOM 0 HG21 THR A 434 -22.309 -31.378 -14.150 1.00 25.00 H new ATOM 0 HG22 THR A 434 -21.341 -30.193 -13.240 1.00 25.00 H new ATOM 0 HG23 THR A 434 -21.182 -30.302 -15.009 1.00 25.00 H new ATOM 335 N ARG A 435 -18.453 -30.843 -11.469 1.00 25.00 N ATOM 336 CA ARG A 435 -18.357 -30.013 -10.267 1.00 25.00 C ATOM 337 C ARG A 435 -17.207 -29.032 -10.409 1.00 25.00 C ATOM 338 O ARG A 435 -17.327 -27.874 -10.050 1.00 25.00 O ATOM 339 CB ARG A 435 -18.166 -30.875 -9.015 1.00 25.00 C ATOM 340 CG ARG A 435 -19.253 -31.918 -8.866 1.00 25.00 C ATOM 341 CD ARG A 435 -19.233 -32.614 -7.503 1.00 25.00 C ATOM 342 NE ARG A 435 -18.753 -34.010 -7.588 1.00 25.00 N ATOM 343 CZ ARG A 435 -19.486 -35.060 -7.958 1.00 25.00 C ATOM 344 NH1 ARG A 435 -20.741 -34.952 -8.319 1.00 25.00 N ATOM 345 NH2 ARG A 435 -18.942 -36.247 -7.967 1.00 25.00 N ATOM 0 H ARG A 435 -18.254 -31.833 -11.326 1.00 25.00 H new ATOM 0 HA ARG A 435 -19.290 -29.461 -10.156 1.00 25.00 H new ATOM 0 HB2 ARG A 435 -17.195 -31.369 -9.061 1.00 25.00 H new ATOM 0 HB3 ARG A 435 -18.157 -30.234 -8.133 1.00 25.00 H new ATOM 0 HG2 ARG A 435 -20.224 -31.446 -9.012 1.00 25.00 H new ATOM 0 HG3 ARG A 435 -19.141 -32.666 -9.651 1.00 25.00 H new ATOM 0 HD2 ARG A 435 -18.593 -32.054 -6.822 1.00 25.00 H new ATOM 0 HD3 ARG A 435 -20.237 -32.603 -7.078 1.00 25.00 H new ATOM 0 HE ARG A 435 -17.778 -34.184 -7.343 1.00 25.00 H new ATOM 0 HH11 ARG A 435 -21.193 -34.038 -8.324 1.00 25.00 H new ATOM 0 HH12 ARG A 435 -21.266 -35.782 -8.595 1.00 25.00 H new ATOM 0 HH21 ARG A 435 -17.966 -36.363 -7.693 1.00 25.00 H new ATOM 0 HH22 ARG A 435 -19.493 -37.058 -8.248 1.00 25.00 H new ATOM 359 N GLN A 436 -16.094 -29.501 -10.947 1.00 25.00 N ATOM 360 CA GLN A 436 -14.913 -28.643 -11.094 1.00 25.00 C ATOM 361 C GLN A 436 -15.184 -27.472 -12.036 1.00 25.00 C ATOM 362 O GLN A 436 -14.814 -26.339 -11.746 1.00 25.00 O ATOM 363 CB GLN A 436 -13.697 -29.414 -11.639 1.00 25.00 C ATOM 364 CG GLN A 436 -13.429 -30.771 -11.005 1.00 25.00 C ATOM 365 CD GLN A 436 -13.430 -30.755 -9.499 1.00 25.00 C ATOM 366 OE1 GLN A 436 -12.790 -29.933 -8.865 1.00 25.00 O ATOM 367 NE2 GLN A 436 -14.152 -31.674 -8.920 1.00 25.00 N ATOM 0 H GLN A 436 -15.976 -30.455 -11.287 1.00 25.00 H new ATOM 0 HA GLN A 436 -14.691 -28.276 -10.092 1.00 25.00 H new ATOM 0 HB2 GLN A 436 -13.833 -29.556 -12.711 1.00 25.00 H new ATOM 0 HB3 GLN A 436 -12.810 -28.793 -11.510 1.00 25.00 H new ATOM 0 HG2 GLN A 436 -14.183 -31.477 -11.351 1.00 25.00 H new ATOM 0 HG3 GLN A 436 -12.464 -31.139 -11.353 1.00 25.00 H new ATOM 0 HE21 GLN A 436 -14.674 -32.344 -9.485 1.00 25.00 H new ATOM 0 HE22 GLN A 436 -14.195 -31.723 -7.902 1.00 25.00 H new ATOM 376 N VAL A 437 -15.818 -27.745 -13.167 1.00 25.00 N ATOM 377 CA VAL A 437 -16.058 -26.699 -14.164 1.00 25.00 C ATOM 378 C VAL A 437 -17.092 -25.674 -13.711 1.00 25.00 C ATOM 379 O VAL A 437 -16.973 -24.493 -14.015 1.00 25.00 O ATOM 380 CB VAL A 437 -16.458 -27.289 -15.547 1.00 25.00 C ATOM 381 CG1 VAL A 437 -15.282 -28.101 -16.134 1.00 25.00 C ATOM 382 CG2 VAL A 437 -17.685 -28.169 -15.480 1.00 25.00 C ATOM 0 H VAL A 437 -16.173 -28.667 -13.420 1.00 25.00 H new ATOM 0 HA VAL A 437 -15.106 -26.179 -14.274 1.00 25.00 H new ATOM 0 HB VAL A 437 -16.698 -26.442 -16.190 1.00 25.00 H new ATOM 0 HG11 VAL A 437 -15.570 -28.511 -17.102 1.00 25.00 H new ATOM 0 HG12 VAL A 437 -14.417 -27.450 -16.258 1.00 25.00 H new ATOM 0 HG13 VAL A 437 -15.028 -28.916 -15.456 1.00 25.00 H new ATOM 0 HG21 VAL A 437 -17.914 -28.551 -16.475 1.00 25.00 H new ATOM 0 HG22 VAL A 437 -17.497 -29.004 -14.805 1.00 25.00 H new ATOM 0 HG23 VAL A 437 -18.530 -27.588 -15.111 1.00 25.00 H new ATOM 392 N LEU A 438 -18.090 -26.120 -12.968 1.00 25.00 N ATOM 393 CA LEU A 438 -19.119 -25.219 -12.435 1.00 25.00 C ATOM 394 C LEU A 438 -18.571 -24.299 -11.347 1.00 25.00 C ATOM 395 O LEU A 438 -19.144 -23.251 -11.068 1.00 25.00 O ATOM 396 CB LEU A 438 -20.288 -26.023 -11.854 1.00 25.00 C ATOM 397 CG LEU A 438 -21.218 -26.710 -12.869 1.00 25.00 C ATOM 398 CD1 LEU A 438 -22.215 -27.590 -12.114 1.00 25.00 C ATOM 399 CD2 LEU A 438 -21.976 -25.695 -13.730 1.00 25.00 C ATOM 0 H LEU A 438 -18.217 -27.100 -12.715 1.00 25.00 H new ATOM 0 HA LEU A 438 -19.460 -24.606 -13.269 1.00 25.00 H new ATOM 0 HB2 LEU A 438 -19.881 -26.787 -11.192 1.00 25.00 H new ATOM 0 HB3 LEU A 438 -20.889 -25.355 -11.238 1.00 25.00 H new ATOM 0 HG LEU A 438 -20.605 -27.314 -13.538 1.00 25.00 H new ATOM 0 HD11 LEU A 438 -22.879 -28.081 -12.826 1.00 25.00 H new ATOM 0 HD12 LEU A 438 -21.674 -28.344 -11.542 1.00 25.00 H new ATOM 0 HD13 LEU A 438 -22.804 -26.973 -11.435 1.00 25.00 H new ATOM 0 HD21 LEU A 438 -22.621 -26.223 -14.432 1.00 25.00 H new ATOM 0 HD22 LEU A 438 -22.584 -25.056 -13.089 1.00 25.00 H new ATOM 0 HD23 LEU A 438 -21.263 -25.082 -14.282 1.00 25.00 H new ATOM 720 N ALA A 462 -16.828 -32.577 -45.638 1.00 25.00 N ATOM 721 CA ALA A 462 -15.806 -32.759 -44.616 1.00 25.00 C ATOM 722 C ALA A 462 -16.461 -33.155 -43.286 1.00 25.00 C ATOM 723 O ALA A 462 -16.003 -34.078 -42.613 1.00 25.00 O ATOM 724 CB ALA A 462 -14.992 -31.475 -44.452 1.00 25.00 C ATOM 0 HA ALA A 462 -15.132 -33.558 -44.924 1.00 25.00 H new ATOM 0 HB1 ALA A 462 -14.231 -31.622 -43.686 1.00 25.00 H new ATOM 0 HB2 ALA A 462 -14.511 -31.226 -45.398 1.00 25.00 H new ATOM 0 HB3 ALA A 462 -15.653 -30.661 -44.155 1.00 25.00 H new ATOM 730 N LEU A 463 -17.536 -32.470 -42.910 1.00 25.00 N ATOM 731 CA LEU A 463 -18.221 -32.779 -41.659 1.00 25.00 C ATOM 732 C LEU A 463 -18.847 -34.170 -41.719 1.00 25.00 C ATOM 733 O LEU A 463 -18.824 -34.885 -40.738 1.00 25.00 O ATOM 734 CB LEU A 463 -19.239 -31.679 -41.300 1.00 25.00 C ATOM 735 CG LEU A 463 -20.740 -31.830 -41.619 1.00 25.00 C ATOM 736 CD1 LEU A 463 -21.491 -32.661 -40.575 1.00 25.00 C ATOM 737 CD2 LEU A 463 -21.358 -30.446 -41.683 1.00 25.00 C ATOM 0 H LEU A 463 -17.948 -31.706 -43.446 1.00 25.00 H new ATOM 0 HA LEU A 463 -17.489 -32.796 -40.851 1.00 25.00 H new ATOM 0 HB2 LEU A 463 -19.159 -31.513 -40.226 1.00 25.00 H new ATOM 0 HB3 LEU A 463 -18.902 -30.765 -41.789 1.00 25.00 H new ATOM 0 HG LEU A 463 -20.825 -32.355 -42.570 1.00 25.00 H new ATOM 0 HD11 LEU A 463 -22.542 -32.732 -40.854 1.00 25.00 H new ATOM 0 HD12 LEU A 463 -21.060 -33.661 -40.527 1.00 25.00 H new ATOM 0 HD13 LEU A 463 -21.406 -32.182 -39.599 1.00 25.00 H new ATOM 0 HD21 LEU A 463 -22.421 -30.532 -41.908 1.00 25.00 H new ATOM 0 HD22 LEU A 463 -21.230 -29.945 -40.723 1.00 25.00 H new ATOM 0 HD23 LEU A 463 -20.868 -29.864 -42.464 1.00 25.00 H new ATOM 749 N GLN A 464 -19.380 -34.575 -42.866 1.00 25.00 N ATOM 750 CA GLN A 464 -19.930 -35.925 -43.004 1.00 25.00 C ATOM 751 C GLN A 464 -18.851 -36.978 -42.793 1.00 25.00 C ATOM 752 O GLN A 464 -19.117 -38.059 -42.267 1.00 25.00 O ATOM 753 CB GLN A 464 -20.577 -36.098 -44.371 1.00 25.00 C ATOM 754 CG GLN A 464 -21.858 -35.314 -44.493 1.00 25.00 C ATOM 755 CD GLN A 464 -22.572 -35.575 -45.780 1.00 25.00 C ATOM 756 OE1 GLN A 464 -22.052 -35.371 -46.874 1.00 25.00 O ATOM 757 NE2 GLN A 464 -23.770 -36.043 -45.659 1.00 25.00 N ATOM 0 H GLN A 464 -19.444 -33.999 -43.706 1.00 25.00 H new ATOM 0 HA GLN A 464 -20.691 -36.060 -42.236 1.00 25.00 H new ATOM 0 HB2 GLN A 464 -19.880 -35.777 -45.145 1.00 25.00 H new ATOM 0 HB3 GLN A 464 -20.781 -37.155 -44.544 1.00 25.00 H new ATOM 0 HG2 GLN A 464 -22.514 -35.566 -43.660 1.00 25.00 H new ATOM 0 HG3 GLN A 464 -21.637 -34.250 -44.414 1.00 25.00 H new ATOM 0 HE21 GLN A 464 -24.166 -36.198 -44.732 1.00 25.00 H new ATOM 0 HE22 GLN A 464 -24.320 -36.257 -46.491 1.00 25.00 H new ATOM 766 N GLY A 465 -17.629 -36.650 -43.179 1.00 25.00 N ATOM 767 CA GLY A 465 -16.512 -37.543 -42.958 1.00 25.00 C ATOM 768 C GLY A 465 -16.292 -37.654 -41.468 1.00 25.00 C ATOM 769 O GLY A 465 -16.167 -38.750 -40.946 1.00 25.00 O ATOM 0 H GLY A 465 -17.389 -35.775 -43.645 1.00 25.00 H new ATOM 0 HA2 GLY A 465 -16.717 -38.524 -43.387 1.00 25.00 H new ATOM 0 HA3 GLY A 465 -15.616 -37.162 -43.448 1.00 25.00 H new ATOM 773 N ALA A 466 -16.278 -36.516 -40.784 1.00 25.00 N ATOM 774 CA ALA A 466 -16.077 -36.467 -39.332 1.00 25.00 C ATOM 775 C ALA A 466 -17.062 -37.376 -38.580 1.00 25.00 C ATOM 776 O ALA A 466 -16.701 -38.031 -37.609 1.00 25.00 O ATOM 777 CB ALA A 466 -16.220 -35.026 -38.839 1.00 25.00 C ATOM 0 H ALA A 466 -16.405 -35.600 -41.215 1.00 25.00 H new ATOM 0 HA ALA A 466 -15.071 -36.833 -39.126 1.00 25.00 H new ATOM 0 HB1 ALA A 466 -16.070 -34.994 -37.760 1.00 25.00 H new ATOM 0 HB2 ALA A 466 -15.475 -34.399 -39.328 1.00 25.00 H new ATOM 0 HB3 ALA A 466 -17.218 -34.657 -39.078 1.00 25.00 H new ATOM 783 N GLN A 467 -18.301 -37.419 -39.038 1.00 25.00 N ATOM 784 CA GLN A 467 -19.310 -38.262 -38.402 1.00 25.00 C ATOM 785 C GLN A 467 -19.007 -39.750 -38.584 1.00 25.00 C ATOM 786 O GLN A 467 -19.158 -40.545 -37.662 1.00 25.00 O ATOM 787 CB GLN A 467 -20.676 -37.987 -39.018 1.00 25.00 C ATOM 788 CG GLN A 467 -21.127 -36.528 -38.967 1.00 25.00 C ATOM 789 CD GLN A 467 -21.123 -35.937 -37.577 1.00 25.00 C ATOM 790 OE1 GLN A 467 -21.647 -36.510 -36.642 1.00 25.00 O ATOM 791 NE2 GLN A 467 -20.537 -34.773 -37.445 1.00 25.00 N ATOM 0 H GLN A 467 -18.635 -36.886 -39.841 1.00 25.00 H new ATOM 0 HA GLN A 467 -19.301 -38.023 -37.339 1.00 25.00 H new ATOM 0 HB2 GLN A 467 -20.660 -38.310 -40.059 1.00 25.00 H new ATOM 0 HB3 GLN A 467 -21.418 -38.599 -38.506 1.00 25.00 H new ATOM 0 HG2 GLN A 467 -20.475 -35.933 -39.606 1.00 25.00 H new ATOM 0 HG3 GLN A 467 -22.133 -36.454 -39.380 1.00 25.00 H new ATOM 0 HE21 GLN A 467 -20.108 -34.323 -38.254 1.00 25.00 H new ATOM 0 HE22 GLN A 467 -20.510 -34.316 -36.533 1.00 25.00 H new ATOM 800 N ALA A 468 -18.590 -40.128 -39.784 1.00 25.00 N ATOM 801 CA ALA A 468 -18.322 -41.530 -40.091 1.00 25.00 C ATOM 802 C ALA A 468 -17.073 -42.030 -39.359 1.00 25.00 C ATOM 803 O ALA A 468 -17.052 -43.136 -38.814 1.00 25.00 O ATOM 804 CB ALA A 468 -18.154 -41.702 -41.609 1.00 25.00 C ATOM 0 H ALA A 468 -18.430 -39.487 -40.561 1.00 25.00 H new ATOM 0 HA ALA A 468 -19.168 -42.126 -39.749 1.00 25.00 H new ATOM 0 HB1 ALA A 468 -17.954 -42.749 -41.837 1.00 25.00 H new ATOM 0 HB2 ALA A 468 -19.068 -41.389 -42.114 1.00 25.00 H new ATOM 0 HB3 ALA A 468 -17.321 -41.090 -41.955 1.00 25.00 H new ATOM 810 N VAL A 469 -16.032 -41.212 -39.354 1.00 25.00 N ATOM 811 CA VAL A 469 -14.767 -41.582 -38.719 1.00 25.00 C ATOM 812 C VAL A 469 -14.916 -41.668 -37.213 1.00 25.00 C ATOM 813 O VAL A 469 -14.175 -42.385 -36.574 1.00 25.00 O ATOM 814 CB VAL A 469 -13.598 -40.624 -39.090 1.00 25.00 C ATOM 815 CG1 VAL A 469 -13.420 -40.592 -40.604 1.00 25.00 C ATOM 816 CG2 VAL A 469 -13.842 -39.221 -38.571 1.00 25.00 C ATOM 0 H VAL A 469 -16.034 -40.286 -39.782 1.00 25.00 H new ATOM 0 HA VAL A 469 -14.510 -42.567 -39.109 1.00 25.00 H new ATOM 0 HB VAL A 469 -12.690 -41.002 -38.620 1.00 25.00 H new ATOM 0 HG11 VAL A 469 -12.601 -39.920 -40.860 1.00 25.00 H new ATOM 0 HG12 VAL A 469 -13.193 -41.595 -40.965 1.00 25.00 H new ATOM 0 HG13 VAL A 469 -14.339 -40.238 -41.071 1.00 25.00 H new ATOM 0 HG21 VAL A 469 -13.005 -38.580 -38.849 1.00 25.00 H new ATOM 0 HG22 VAL A 469 -14.761 -38.827 -39.005 1.00 25.00 H new ATOM 0 HG23 VAL A 469 -13.935 -39.246 -37.485 1.00 25.00 H new ATOM 826 N ALA A 470 -15.861 -40.931 -36.646 1.00 25.00 N ATOM 827 CA ALA A 470 -16.075 -40.933 -35.192 1.00 25.00 C ATOM 828 C ALA A 470 -16.214 -42.353 -34.611 1.00 25.00 C ATOM 829 O ALA A 470 -15.711 -42.631 -33.525 1.00 25.00 O ATOM 830 CB ALA A 470 -17.305 -40.094 -34.838 1.00 25.00 C ATOM 0 H ALA A 470 -16.495 -40.322 -37.164 1.00 25.00 H new ATOM 0 HA ALA A 470 -15.187 -40.491 -34.740 1.00 25.00 H new ATOM 0 HB1 ALA A 470 -17.453 -40.103 -33.758 1.00 25.00 H new ATOM 0 HB2 ALA A 470 -17.155 -39.068 -35.175 1.00 25.00 H new ATOM 0 HB3 ALA A 470 -18.184 -40.512 -35.328 1.00 25.00 H new ATOM 836 N ALA A 471 -16.876 -43.250 -35.333 1.00 25.00 N ATOM 837 CA ALA A 471 -17.022 -44.636 -34.884 1.00 25.00 C ATOM 838 C ALA A 471 -15.652 -45.333 -34.812 1.00 25.00 C ATOM 839 O ALA A 471 -15.398 -46.131 -33.920 1.00 25.00 O ATOM 840 CB ALA A 471 -17.963 -45.394 -35.829 1.00 25.00 C ATOM 0 H ALA A 471 -17.320 -43.047 -36.229 1.00 25.00 H new ATOM 0 HA ALA A 471 -17.453 -44.635 -33.883 1.00 25.00 H new ATOM 0 HB1 ALA A 471 -18.067 -46.424 -35.489 1.00 25.00 H new ATOM 0 HB2 ALA A 471 -18.941 -44.912 -35.832 1.00 25.00 H new ATOM 0 HB3 ALA A 471 -17.551 -45.385 -36.838 1.00 25.00 H new ATOM 846 N ALA A 472 -14.772 -45.018 -35.748 1.00 25.00 N ATOM 847 CA ALA A 472 -13.416 -45.559 -35.748 1.00 25.00 C ATOM 848 C ALA A 472 -12.586 -44.911 -34.634 1.00 25.00 C ATOM 849 O ALA A 472 -11.694 -45.534 -34.081 1.00 25.00 O ATOM 850 CB ALA A 472 -12.753 -45.337 -37.116 1.00 25.00 C ATOM 0 H ALA A 472 -14.971 -44.386 -36.524 1.00 25.00 H new ATOM 0 HA ALA A 472 -13.467 -46.632 -35.561 1.00 25.00 H new ATOM 0 HB1 ALA A 472 -11.743 -45.745 -37.101 1.00 25.00 H new ATOM 0 HB2 ALA A 472 -13.336 -45.839 -37.888 1.00 25.00 H new ATOM 0 HB3 ALA A 472 -12.710 -44.269 -37.330 1.00 25.00 H new ATOM 856 N GLN A 473 -12.871 -43.657 -34.318 1.00 25.00 N ATOM 857 CA GLN A 473 -12.107 -42.935 -33.309 1.00 25.00 C ATOM 858 C GLN A 473 -12.393 -43.450 -31.918 1.00 25.00 C ATOM 859 O GLN A 473 -11.482 -43.692 -31.144 1.00 25.00 O ATOM 860 CB GLN A 473 -12.418 -41.439 -33.341 1.00 25.00 C ATOM 861 CG GLN A 473 -12.013 -40.735 -34.620 1.00 25.00 C ATOM 862 CD GLN A 473 -10.511 -40.558 -34.766 1.00 25.00 C ATOM 863 OE1 GLN A 473 -9.757 -40.705 -33.822 1.00 25.00 O ATOM 864 NE2 GLN A 473 -10.077 -40.251 -35.959 1.00 25.00 N ATOM 0 H GLN A 473 -13.625 -43.118 -34.744 1.00 25.00 H new ATOM 0 HA GLN A 473 -11.056 -43.098 -33.547 1.00 25.00 H new ATOM 0 HB2 GLN A 473 -13.489 -41.301 -33.190 1.00 25.00 H new ATOM 0 HB3 GLN A 473 -11.913 -40.959 -32.503 1.00 25.00 H new ATOM 0 HG2 GLN A 473 -12.388 -41.302 -35.472 1.00 25.00 H new ATOM 0 HG3 GLN A 473 -12.491 -39.756 -34.653 1.00 25.00 H new ATOM 0 HE21 GLN A 473 -10.737 -40.135 -36.728 1.00 25.00 H new ATOM 0 HE22 GLN A 473 -9.078 -40.127 -36.122 1.00 25.00 H new ATOM 873 N ARG A 474 -13.664 -43.640 -31.596 1.00 25.00 N ATOM 874 CA ARG A 474 -14.022 -44.193 -30.281 1.00 25.00 C ATOM 875 C ARG A 474 -13.415 -45.587 -30.155 1.00 25.00 C ATOM 876 O ARG A 474 -13.079 -46.029 -29.071 1.00 25.00 O ATOM 877 CB ARG A 474 -15.545 -44.246 -30.069 1.00 25.00 C ATOM 878 CG ARG A 474 -16.291 -45.085 -31.091 1.00 25.00 C ATOM 879 CD ARG A 474 -17.751 -45.244 -30.772 1.00 25.00 C ATOM 880 NE ARG A 474 -17.958 -46.198 -29.656 1.00 25.00 N ATOM 881 CZ ARG A 474 -19.131 -46.693 -29.267 1.00 25.00 C ATOM 882 NH1 ARG A 474 -20.254 -46.353 -29.848 1.00 25.00 N ATOM 883 NH2 ARG A 474 -19.184 -47.549 -28.285 1.00 25.00 N ATOM 0 H ARG A 474 -14.454 -43.428 -32.205 1.00 25.00 H new ATOM 0 HA ARG A 474 -13.622 -43.537 -29.508 1.00 25.00 H new ATOM 0 HB2 ARG A 474 -15.748 -44.642 -29.074 1.00 25.00 H new ATOM 0 HB3 ARG A 474 -15.939 -43.230 -30.094 1.00 25.00 H new ATOM 0 HG2 ARG A 474 -16.188 -44.625 -32.074 1.00 25.00 H new ATOM 0 HG3 ARG A 474 -15.829 -46.070 -31.150 1.00 25.00 H new ATOM 0 HD2 ARG A 474 -18.175 -44.275 -30.508 1.00 25.00 H new ATOM 0 HD3 ARG A 474 -18.283 -45.595 -31.657 1.00 25.00 H new ATOM 0 HE ARG A 474 -17.131 -46.501 -29.142 1.00 25.00 H new ATOM 0 HH11 ARG A 474 -20.247 -45.690 -30.623 1.00 25.00 H new ATOM 0 HH12 ARG A 474 -21.136 -46.751 -29.525 1.00 25.00 H new ATOM 0 HH21 ARG A 474 -18.327 -47.839 -27.815 1.00 25.00 H new ATOM 0 HH22 ARG A 474 -20.083 -47.928 -27.987 1.00 25.00 H new ATOM 897 N LEU A 475 -13.270 -46.264 -31.284 1.00 25.00 N ATOM 898 CA LEU A 475 -12.690 -47.593 -31.313 1.00 25.00 C ATOM 899 C LEU A 475 -11.184 -47.526 -31.053 1.00 25.00 C ATOM 900 O LEU A 475 -10.684 -48.240 -30.199 1.00 25.00 O ATOM 901 CB LEU A 475 -12.994 -48.247 -32.673 1.00 25.00 C ATOM 902 CG LEU A 475 -11.925 -49.163 -33.288 1.00 25.00 C ATOM 903 CD1 LEU A 475 -11.749 -50.445 -32.456 1.00 25.00 C ATOM 904 CD2 LEU A 475 -12.303 -49.524 -34.712 1.00 25.00 C ATOM 0 H LEU A 475 -13.550 -45.909 -32.198 1.00 25.00 H new ATOM 0 HA LEU A 475 -13.131 -48.202 -30.524 1.00 25.00 H new ATOM 0 HB2 LEU A 475 -13.910 -48.828 -32.567 1.00 25.00 H new ATOM 0 HB3 LEU A 475 -13.202 -47.451 -33.387 1.00 25.00 H new ATOM 0 HG LEU A 475 -10.979 -48.622 -33.291 1.00 25.00 H new ATOM 0 HD11 LEU A 475 -10.986 -51.075 -32.915 1.00 25.00 H new ATOM 0 HD12 LEU A 475 -11.442 -50.182 -31.444 1.00 25.00 H new ATOM 0 HD13 LEU A 475 -12.694 -50.988 -32.420 1.00 25.00 H new ATOM 0 HD21 LEU A 475 -11.538 -50.173 -35.138 1.00 25.00 H new ATOM 0 HD22 LEU A 475 -13.262 -50.043 -34.714 1.00 25.00 H new ATOM 0 HD23 LEU A 475 -12.381 -48.615 -35.309 1.00 25.00 H new ATOM 916 N VAL A 476 -10.453 -46.688 -31.779 1.00 25.00 N ATOM 917 CA VAL A 476 -8.996 -46.652 -31.616 1.00 25.00 C ATOM 918 C VAL A 476 -8.668 -46.174 -30.210 1.00 25.00 C ATOM 919 O VAL A 476 -7.718 -46.643 -29.578 1.00 25.00 O ATOM 920 CB VAL A 476 -8.286 -45.804 -32.719 1.00 25.00 C ATOM 921 CG1 VAL A 476 -8.697 -44.354 -32.686 1.00 25.00 C ATOM 922 CG2 VAL A 476 -6.764 -45.932 -32.603 1.00 25.00 C ATOM 0 H VAL A 476 -10.828 -46.038 -32.470 1.00 25.00 H new ATOM 0 HA VAL A 476 -8.604 -47.661 -31.746 1.00 25.00 H new ATOM 0 HB VAL A 476 -8.605 -46.205 -33.681 1.00 25.00 H new ATOM 0 HG11 VAL A 476 -8.175 -43.810 -33.473 1.00 25.00 H new ATOM 0 HG12 VAL A 476 -9.773 -44.277 -32.844 1.00 25.00 H new ATOM 0 HG13 VAL A 476 -8.441 -43.925 -31.717 1.00 25.00 H new ATOM 0 HG21 VAL A 476 -6.288 -45.334 -33.380 1.00 25.00 H new ATOM 0 HG22 VAL A 476 -6.443 -45.577 -31.624 1.00 25.00 H new ATOM 0 HG23 VAL A 476 -6.477 -46.977 -32.722 1.00 25.00 H new ATOM 932 N HIS A 477 -9.479 -45.260 -29.712 1.00 25.00 N ATOM 933 CA HIS A 477 -9.319 -44.746 -28.376 1.00 25.00 C ATOM 934 C HIS A 477 -9.521 -45.853 -27.359 1.00 25.00 C ATOM 935 O HIS A 477 -8.833 -45.889 -26.358 1.00 25.00 O ATOM 936 CB HIS A 477 -10.322 -43.629 -28.135 1.00 25.00 C ATOM 937 CG HIS A 477 -10.062 -42.866 -26.877 1.00 25.00 C ATOM 938 ND1 HIS A 477 -11.009 -42.567 -25.930 1.00 25.00 N ATOM 939 CD2 HIS A 477 -8.904 -42.348 -26.393 1.00 25.00 C ATOM 940 CE1 HIS A 477 -10.414 -41.895 -24.947 1.00 25.00 C ATOM 941 NE2 HIS A 477 -9.127 -41.728 -25.180 1.00 25.00 N ATOM 0 H HIS A 477 -10.263 -44.857 -30.225 1.00 25.00 H new ATOM 0 HA HIS A 477 -8.309 -44.352 -28.266 1.00 25.00 H new ATOM 0 HB2 HIS A 477 -10.300 -42.941 -28.980 1.00 25.00 H new ATOM 0 HB3 HIS A 477 -11.325 -44.053 -28.094 1.00 25.00 H new ATOM 0 HD2 HIS A 477 -7.945 -42.412 -26.886 1.00 25.00 H new ATOM 0 HE1 HIS A 477 -10.923 -41.531 -24.067 1.00 25.00 H new ATOM 0 HE2 HIS A 477 -8.446 -41.247 -24.593 1.00 25.00 H new ATOM 949 N ALA A 478 -10.448 -46.766 -27.617 1.00 25.00 N ATOM 950 CA ALA A 478 -10.705 -47.849 -26.678 1.00 25.00 C ATOM 951 C ALA A 478 -9.426 -48.651 -26.450 1.00 25.00 C ATOM 952 O ALA A 478 -9.061 -48.925 -25.317 1.00 25.00 O ATOM 953 CB ALA A 478 -11.827 -48.757 -27.194 1.00 25.00 C ATOM 0 H ALA A 478 -11.027 -46.779 -28.457 1.00 25.00 H new ATOM 0 HA ALA A 478 -11.027 -47.422 -25.728 1.00 25.00 H new ATOM 0 HB1 ALA A 478 -12.004 -49.560 -26.478 1.00 25.00 H new ATOM 0 HB2 ALA A 478 -12.739 -48.174 -27.317 1.00 25.00 H new ATOM 0 HB3 ALA A 478 -11.537 -49.184 -28.154 1.00 25.00 H new ATOM 959 N ILE A 479 -8.735 -49.018 -27.520 1.00 25.00 N ATOM 960 CA ILE A 479 -7.512 -49.816 -27.376 1.00 25.00 C ATOM 961 C ILE A 479 -6.433 -48.973 -26.722 1.00 25.00 C ATOM 962 O ILE A 479 -5.628 -49.471 -25.939 1.00 25.00 O ATOM 963 CB ILE A 479 -6.969 -50.342 -28.725 1.00 25.00 C ATOM 964 CG1 ILE A 479 -8.074 -51.050 -29.515 1.00 25.00 C ATOM 965 CG2 ILE A 479 -5.801 -51.333 -28.502 1.00 25.00 C ATOM 966 CD1 ILE A 479 -8.319 -50.383 -30.808 1.00 25.00 C ATOM 0 H ILE A 479 -8.988 -48.785 -28.480 1.00 25.00 H new ATOM 0 HA ILE A 479 -7.772 -50.679 -26.763 1.00 25.00 H new ATOM 0 HB ILE A 479 -6.610 -49.482 -29.290 1.00 25.00 H new ATOM 0 HG12 ILE A 479 -7.793 -52.089 -29.687 1.00 25.00 H new ATOM 0 HG13 ILE A 479 -8.993 -51.061 -28.929 1.00 25.00 H new ATOM 0 HG21 ILE A 479 -5.437 -51.689 -29.466 1.00 25.00 H new ATOM 0 HG22 ILE A 479 -4.993 -50.829 -27.972 1.00 25.00 H new ATOM 0 HG23 ILE A 479 -6.150 -52.180 -27.911 1.00 25.00 H new ATOM 0 HD11 ILE A 479 -9.108 -50.909 -31.345 1.00 25.00 H new ATOM 0 HD12 ILE A 479 -8.624 -49.351 -30.633 1.00 25.00 H new ATOM 0 HD13 ILE A 479 -7.406 -50.395 -31.403 1.00 25.00 H new ATOM 978 N ALA A 480 -6.422 -47.683 -27.023 1.00 25.00 N ATOM 979 CA ALA A 480 -5.438 -46.788 -26.442 1.00 25.00 C ATOM 980 C ALA A 480 -5.587 -46.808 -24.915 1.00 25.00 C ATOM 981 O ALA A 480 -4.619 -46.633 -24.201 1.00 25.00 O ATOM 982 CB ALA A 480 -5.613 -45.365 -27.003 1.00 25.00 C ATOM 0 H ALA A 480 -7.080 -47.237 -27.662 1.00 25.00 H new ATOM 0 HA ALA A 480 -4.433 -47.121 -26.703 1.00 25.00 H new ATOM 0 HB1 ALA A 480 -4.868 -44.705 -26.559 1.00 25.00 H new ATOM 0 HB2 ALA A 480 -5.483 -45.382 -28.085 1.00 25.00 H new ATOM 0 HB3 ALA A 480 -6.612 -45.000 -26.763 1.00 25.00 H new ATOM 988 N LEU A 481 -6.795 -47.037 -24.422 1.00 25.00 N ATOM 989 CA LEU A 481 -7.023 -47.142 -22.972 1.00 25.00 C ATOM 990 C LEU A 481 -6.606 -48.497 -22.457 1.00 25.00 C ATOM 991 O LEU A 481 -5.973 -48.604 -21.415 1.00 25.00 O ATOM 992 CB LEU A 481 -8.487 -46.912 -22.627 1.00 25.00 C ATOM 993 CG LEU A 481 -8.934 -45.544 -23.115 1.00 25.00 C ATOM 994 CD1 LEU A 481 -10.439 -45.551 -23.307 1.00 25.00 C ATOM 995 CD2 LEU A 481 -8.513 -44.423 -22.177 1.00 25.00 C ATOM 0 H LEU A 481 -7.633 -47.154 -24.992 1.00 25.00 H new ATOM 0 HA LEU A 481 -6.417 -46.371 -22.496 1.00 25.00 H new ATOM 0 HB2 LEU A 481 -9.102 -47.688 -23.084 1.00 25.00 H new ATOM 0 HB3 LEU A 481 -8.630 -46.986 -21.549 1.00 25.00 H new ATOM 0 HG LEU A 481 -8.440 -45.347 -24.067 1.00 25.00 H new ATOM 0 HD11 LEU A 481 -10.766 -44.572 -23.657 1.00 25.00 H new ATOM 0 HD12 LEU A 481 -10.708 -46.308 -24.043 1.00 25.00 H new ATOM 0 HD13 LEU A 481 -10.926 -45.778 -22.359 1.00 25.00 H new ATOM 0 HD21 LEU A 481 -8.858 -43.468 -22.573 1.00 25.00 H new ATOM 0 HD22 LEU A 481 -8.953 -44.587 -21.193 1.00 25.00 H new ATOM 0 HD23 LEU A 481 -7.426 -44.409 -22.091 1.00 25.00 H new ATOM 1007 N MET A 482 -6.953 -49.536 -23.203 1.00 25.00 N ATOM 1008 CA MET A 482 -6.630 -50.913 -22.819 1.00 25.00 C ATOM 1009 C MET A 482 -5.147 -51.111 -22.651 1.00 25.00 C ATOM 1010 O MET A 482 -4.704 -51.989 -21.924 1.00 25.00 O ATOM 1011 CB MET A 482 -7.119 -51.908 -23.872 1.00 25.00 C ATOM 1012 CG MET A 482 -8.588 -51.848 -24.046 1.00 25.00 C ATOM 1013 SD MET A 482 -9.320 -53.378 -24.646 1.00 25.00 S ATOM 1014 CE MET A 482 -9.184 -53.140 -26.410 1.00 25.00 C ATOM 0 H MET A 482 -7.461 -49.456 -24.084 1.00 25.00 H new ATOM 0 HA MET A 482 -7.134 -51.091 -21.869 1.00 25.00 H new ATOM 0 HB2 MET A 482 -6.632 -51.698 -24.824 1.00 25.00 H new ATOM 0 HB3 MET A 482 -6.829 -52.917 -23.581 1.00 25.00 H new ATOM 0 HG2 MET A 482 -9.046 -51.589 -23.091 1.00 25.00 H new ATOM 0 HG3 MET A 482 -8.828 -51.045 -24.743 1.00 25.00 H new ATOM 0 HE1 MET A 482 -9.596 -54.006 -26.927 1.00 25.00 H new ATOM 0 HE2 MET A 482 -9.737 -52.247 -26.700 1.00 25.00 H new ATOM 0 HE3 MET A 482 -8.135 -53.021 -26.681 1.00 25.00 H new ATOM 1024 N THR A 483 -4.369 -50.286 -23.321 1.00 25.00 N ATOM 1025 CA THR A 483 -2.915 -50.457 -23.259 1.00 25.00 C ATOM 1026 C THR A 483 -2.342 -49.812 -22.001 1.00 25.00 C ATOM 1027 O THR A 483 -1.253 -50.162 -21.550 1.00 25.00 O ATOM 1028 CB THR A 483 -2.231 -49.937 -24.528 1.00 25.00 C ATOM 1029 OG1 THR A 483 -2.609 -48.582 -24.762 1.00 25.00 O ATOM 1030 CG2 THR A 483 -2.652 -50.774 -25.734 1.00 25.00 C ATOM 0 H THR A 483 -4.695 -49.512 -23.899 1.00 25.00 H new ATOM 0 HA THR A 483 -2.708 -51.526 -23.203 1.00 25.00 H new ATOM 0 HB THR A 483 -1.152 -50.006 -24.391 1.00 25.00 H new ATOM 0 HG1 THR A 483 -2.168 -48.255 -25.574 1.00 25.00 H new ATOM 0 HG21 THR A 483 -2.160 -50.395 -26.630 1.00 25.00 H new ATOM 0 HG22 THR A 483 -2.364 -51.813 -25.574 1.00 25.00 H new ATOM 0 HG23 THR A 483 -3.733 -50.712 -25.860 1.00 25.00 H new ATOM 1038 N GLN A 484 -3.094 -48.891 -21.416 1.00 25.00 N ATOM 1039 CA GLN A 484 -2.707 -48.240 -20.164 1.00 25.00 C ATOM 1040 C GLN A 484 -3.242 -49.060 -19.015 1.00 25.00 C ATOM 1041 O GLN A 484 -2.607 -49.206 -17.977 1.00 25.00 O ATOM 1042 CB GLN A 484 -3.272 -46.831 -20.109 1.00 25.00 C ATOM 1043 CG GLN A 484 -2.951 -46.110 -21.365 1.00 25.00 C ATOM 1044 CD GLN A 484 -3.245 -44.633 -21.307 1.00 25.00 C ATOM 1045 OE1 GLN A 484 -2.724 -43.916 -20.469 1.00 25.00 O ATOM 1046 NE2 GLN A 484 -4.076 -44.172 -22.203 1.00 25.00 N ATOM 0 H GLN A 484 -3.987 -48.572 -21.791 1.00 25.00 H new ATOM 0 HA GLN A 484 -1.621 -48.174 -20.100 1.00 25.00 H new ATOM 0 HB2 GLN A 484 -4.352 -46.868 -19.966 1.00 25.00 H new ATOM 0 HB3 GLN A 484 -2.856 -46.296 -19.255 1.00 25.00 H new ATOM 0 HG2 GLN A 484 -1.895 -46.253 -21.596 1.00 25.00 H new ATOM 0 HG3 GLN A 484 -3.519 -46.553 -22.183 1.00 25.00 H new ATOM 0 HE21 GLN A 484 -4.491 -44.805 -22.887 1.00 25.00 H new ATOM 0 HE22 GLN A 484 -4.310 -43.179 -22.219 1.00 25.00 H new ATOM 1055 N PHE A 485 -4.414 -49.635 -19.233 1.00 25.00 N ATOM 1056 CA PHE A 485 -5.006 -50.569 -18.297 1.00 25.00 C ATOM 1057 C PHE A 485 -4.098 -51.793 -18.226 1.00 25.00 C ATOM 1058 O PHE A 485 -4.079 -52.510 -17.234 1.00 25.00 O ATOM 1059 CB PHE A 485 -6.390 -50.969 -18.793 1.00 25.00 C ATOM 1060 CG PHE A 485 -7.509 -50.164 -18.188 1.00 25.00 C ATOM 1061 CD1 PHE A 485 -8.183 -49.185 -18.945 1.00 25.00 C ATOM 1062 CD2 PHE A 485 -7.905 -50.390 -16.856 1.00 25.00 C ATOM 1063 CE1 PHE A 485 -9.250 -48.439 -18.381 1.00 25.00 C ATOM 1064 CE2 PHE A 485 -8.970 -49.648 -16.281 1.00 25.00 C ATOM 1065 CZ PHE A 485 -9.643 -48.673 -17.050 1.00 25.00 C ATOM 0 H PHE A 485 -4.979 -49.465 -20.065 1.00 25.00 H new ATOM 0 HA PHE A 485 -5.108 -50.120 -17.309 1.00 25.00 H new ATOM 0 HB2 PHE A 485 -6.422 -50.861 -19.877 1.00 25.00 H new ATOM 0 HB3 PHE A 485 -6.554 -52.024 -18.573 1.00 25.00 H new ATOM 0 HD1 PHE A 485 -7.884 -49.000 -19.966 1.00 25.00 H new ATOM 0 HD2 PHE A 485 -7.393 -51.136 -16.266 1.00 25.00 H new ATOM 0 HE1 PHE A 485 -9.760 -47.693 -18.972 1.00 25.00 H new ATOM 0 HE2 PHE A 485 -9.265 -49.829 -15.258 1.00 25.00 H new ATOM 0 HZ PHE A 485 -10.456 -48.109 -16.618 1.00 25.00 H new