USER MOD reduce.3.24.130724 H: found=0, std=0, add=733, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 739 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: S 471 THR OG1 : rot 55:sc= 1.17 USER MOD Set 1.2: S 472 GLN : amide:sc= 0.85 K(o=2,f=-4.3!) USER MOD Single : P 359 SER OG : rot 14:sc= 0.742 USER MOD Single : P 360 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 362 GLN : amide:sc= 0.748 K(o=0.75,f=-6.3!) USER MOD Single : P 370 SER OG : rot -91:sc= 0.00289 USER MOD Single : P 376 ASN : amide:sc= -0.217 K(o=-0.22,f=-0.74) USER MOD Single : P 378 CYS SG : rot -178:sc= -10! USER MOD Single : P 379 SER OG : rot 180:sc= 0 USER MOD Single : P 381 SER OG : rot 120:sc= -1.88 USER MOD Single : P 382 THR OG1 : rot -144:sc= -5.43! USER MOD Single : P 383 LYS NZ :NH3+ -140:sc= -0.0636 (180deg=-1.29) USER MOD Single : P 385 LYS NZ :NH3+ -116:sc= 1.19 (180deg=-0.837) USER MOD Single : P 388 SER OG : rot 180:sc= 0.012 USER MOD Single : S 455 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : S 457 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 458 LYS NZ :NH3+ -124:sc= 0 (180deg=-0.103) USER MOD Single : S 460 SER OG : rot -43:sc= 0.38 USER MOD Single : S 461 GLN : amide:sc= -0.149 X(o=-0.15,f=-0.03) USER MOD Single : S 467 SER OG : rot 180:sc= -0.0293 USER MOD Single : S 468 TYR OH : rot -110:sc= 0.834 USER MOD Single : S 479 GLN : amide:sc= 0.0816 K(o=0.082,f=-2.6!) USER MOD Single : S 488 SER OG : rot 180:sc= 0 USER MOD Single : S 489 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 491 ASN : amide:sc= -9.2! C(o=-9.2!,f=-4.7!) USER MOD Single : S 499 SER OG : rot 180:sc= 0 USER MOD Single : S 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 502 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 508 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 514 SER OG : rot 168:sc= -0.251 USER MOD Single : S 516 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN S 455 7.440 -22.839 2.663 1.00 0.00 N ATOM 2 CA GLN S 455 6.013 -22.432 2.588 1.00 0.00 C ATOM 3 C GLN S 455 5.875 -21.000 2.080 1.00 0.00 C ATOM 4 O GLN S 455 6.862 -20.368 1.704 1.00 0.00 O ATOM 5 CB GLN S 455 5.395 -22.560 3.981 1.00 0.00 C ATOM 6 CG GLN S 455 3.972 -23.090 3.970 1.00 0.00 C ATOM 7 CD GLN S 455 3.900 -24.573 4.273 1.00 0.00 C ATOM 8 OE1 GLN S 455 4.143 -25.001 5.402 1.00 0.00 O ATOM 9 NE2 GLN S 455 3.565 -25.368 3.263 1.00 0.00 N ATOM 0 HA GLN S 455 5.492 -23.082 1.885 1.00 0.00 H new ATOM 0 HB2 GLN S 455 6.015 -23.222 4.585 1.00 0.00 H new ATOM 0 HB3 GLN S 455 5.406 -21.583 4.465 1.00 0.00 H new ATOM 0 HG2 GLN S 455 3.379 -22.544 4.704 1.00 0.00 H new ATOM 0 HG3 GLN S 455 3.525 -22.900 2.994 1.00 0.00 H new ATOM 0 HE21 GLN S 455 3.372 -24.971 2.344 1.00 0.00 H new ATOM 0 HE22 GLN S 455 3.501 -26.376 3.407 1.00 0.00 H new ATOM 20 N LEU S 456 4.645 -20.496 2.070 1.00 0.00 N ATOM 21 CA LEU S 456 4.379 -19.139 1.607 1.00 0.00 C ATOM 22 C LEU S 456 3.247 -18.504 2.409 1.00 0.00 C ATOM 23 O LEU S 456 2.198 -19.114 2.611 1.00 0.00 O ATOM 24 CB LEU S 456 4.026 -19.145 0.120 1.00 0.00 C ATOM 25 CG LEU S 456 5.213 -19.332 -0.827 1.00 0.00 C ATOM 26 CD1 LEU S 456 4.779 -20.054 -2.092 1.00 0.00 C ATOM 27 CD2 LEU S 456 5.841 -17.988 -1.165 1.00 0.00 C ATOM 0 H LEU S 456 3.817 -21.007 2.377 1.00 0.00 H new ATOM 0 HA LEU S 456 5.282 -18.547 1.755 1.00 0.00 H new ATOM 0 HB2 LEU S 456 3.305 -19.942 -0.063 1.00 0.00 H new ATOM 0 HB3 LEU S 456 3.531 -18.205 -0.124 1.00 0.00 H new ATOM 0 HG LEU S 456 5.962 -19.944 -0.324 1.00 0.00 H new ATOM 0 HD11 LEU S 456 5.637 -20.178 -2.753 1.00 0.00 H new ATOM 0 HD12 LEU S 456 4.377 -21.033 -1.832 1.00 0.00 H new ATOM 0 HD13 LEU S 456 4.011 -19.470 -2.599 1.00 0.00 H new ATOM 0 HD21 LEU S 456 6.684 -18.140 -1.839 1.00 0.00 H new ATOM 0 HD22 LEU S 456 5.100 -17.351 -1.648 1.00 0.00 H new ATOM 0 HD23 LEU S 456 6.190 -17.509 -0.250 1.00 0.00 H new ATOM 39 N LYS S 457 3.468 -17.274 2.862 1.00 0.00 N ATOM 40 CA LYS S 457 2.467 -16.555 3.642 1.00 0.00 C ATOM 41 C LYS S 457 1.797 -15.473 2.800 1.00 0.00 C ATOM 42 O LYS S 457 2.280 -15.124 1.724 1.00 0.00 O ATOM 43 CB LYS S 457 3.108 -15.930 4.883 1.00 0.00 C ATOM 44 CG LYS S 457 4.153 -14.874 4.562 1.00 0.00 C ATOM 45 CD LYS S 457 5.030 -14.575 5.766 1.00 0.00 C ATOM 46 CE LYS S 457 5.973 -15.728 6.069 1.00 0.00 C ATOM 47 NZ LYS S 457 6.133 -15.948 7.533 1.00 0.00 N ATOM 0 H LYS S 457 4.331 -16.755 2.702 1.00 0.00 H new ATOM 0 HA LYS S 457 1.706 -17.269 3.957 1.00 0.00 H new ATOM 0 HB2 LYS S 457 2.328 -15.482 5.498 1.00 0.00 H new ATOM 0 HB3 LYS S 457 3.570 -16.717 5.478 1.00 0.00 H new ATOM 0 HG2 LYS S 457 4.774 -15.215 3.734 1.00 0.00 H new ATOM 0 HG3 LYS S 457 3.659 -13.959 4.234 1.00 0.00 H new ATOM 0 HD2 LYS S 457 5.608 -13.670 5.580 1.00 0.00 H new ATOM 0 HD3 LYS S 457 4.402 -14.379 6.635 1.00 0.00 H new ATOM 0 HE2 LYS S 457 5.593 -16.638 5.605 1.00 0.00 H new ATOM 0 HE3 LYS S 457 6.947 -15.526 5.624 1.00 0.00 H new ATOM 0 HZ1 LYS S 457 6.784 -16.743 7.696 1.00 0.00 H new ATOM 0 HZ2 LYS S 457 6.519 -15.089 7.973 1.00 0.00 H new ATOM 0 HZ3 LYS S 457 5.208 -16.166 7.954 1.00 0.00 H new ATOM 61 N LYS S 458 0.682 -14.947 3.299 1.00 0.00 N ATOM 62 CA LYS S 458 -0.052 -13.905 2.592 1.00 0.00 C ATOM 63 C LYS S 458 -0.771 -12.983 3.571 1.00 0.00 C ATOM 64 O LYS S 458 -1.175 -13.404 4.654 1.00 0.00 O ATOM 65 CB LYS S 458 -1.062 -14.527 1.627 1.00 0.00 C ATOM 66 CG LYS S 458 -1.808 -13.506 0.783 1.00 0.00 C ATOM 67 CD LYS S 458 -3.178 -13.193 1.365 1.00 0.00 C ATOM 68 CE LYS S 458 -4.246 -14.116 0.801 1.00 0.00 C ATOM 69 NZ LYS S 458 -4.555 -15.240 1.726 1.00 0.00 N ATOM 0 H LYS S 458 0.268 -15.225 4.189 1.00 0.00 H new ATOM 0 HA LYS S 458 0.667 -13.314 2.025 1.00 0.00 H new ATOM 0 HB2 LYS S 458 -0.541 -15.220 0.967 1.00 0.00 H new ATOM 0 HB3 LYS S 458 -1.784 -15.111 2.197 1.00 0.00 H new ATOM 0 HG2 LYS S 458 -1.222 -12.589 0.717 1.00 0.00 H new ATOM 0 HG3 LYS S 458 -1.921 -13.885 -0.232 1.00 0.00 H new ATOM 0 HD2 LYS S 458 -3.145 -13.293 2.450 1.00 0.00 H new ATOM 0 HD3 LYS S 458 -3.439 -12.157 1.148 1.00 0.00 H new ATOM 0 HE2 LYS S 458 -5.154 -13.545 0.608 1.00 0.00 H new ATOM 0 HE3 LYS S 458 -3.911 -14.516 -0.156 1.00 0.00 H new ATOM 0 HZ1 LYS S 458 -4.420 -16.144 1.231 1.00 0.00 H new ATOM 0 HZ2 LYS S 458 -3.920 -15.198 2.548 1.00 0.00 H new ATOM 0 HZ3 LYS S 458 -5.542 -15.165 2.046 1.00 0.00 H new ATOM 83 N GLY S 459 -0.927 -11.722 3.180 1.00 0.00 N ATOM 84 CA GLY S 459 -1.597 -10.757 4.032 1.00 0.00 C ATOM 85 C GLY S 459 -3.072 -10.623 3.704 1.00 0.00 C ATOM 86 O GLY S 459 -3.933 -11.036 4.480 1.00 0.00 O ATOM 0 H GLY S 459 -0.601 -11.351 2.287 1.00 0.00 H new ATOM 0 HA2 GLY S 459 -1.485 -11.057 5.074 1.00 0.00 H new ATOM 0 HA3 GLY S 459 -1.114 -9.786 3.926 1.00 0.00 H new ATOM 90 N SER S 460 -3.358 -10.045 2.541 1.00 0.00 N ATOM 91 CA SER S 460 -4.727 -9.847 2.080 1.00 0.00 C ATOM 92 C SER S 460 -4.728 -9.481 0.600 1.00 0.00 C ATOM 93 O SER S 460 -3.712 -9.630 -0.078 1.00 0.00 O ATOM 94 CB SER S 460 -5.412 -8.747 2.894 1.00 0.00 C ATOM 95 OG SER S 460 -5.085 -8.848 4.270 1.00 0.00 O ATOM 0 H SER S 460 -2.649 -9.702 1.894 1.00 0.00 H new ATOM 0 HA SER S 460 -5.281 -10.776 2.218 1.00 0.00 H new ATOM 0 HB2 SER S 460 -5.110 -7.770 2.517 1.00 0.00 H new ATOM 0 HB3 SER S 460 -6.492 -8.817 2.768 1.00 0.00 H new ATOM 0 HG SER S 460 -5.127 -9.787 4.548 1.00 0.00 H new ATOM 101 N GLN S 461 -5.860 -8.998 0.096 1.00 0.00 N ATOM 102 CA GLN S 461 -5.950 -8.617 -1.310 1.00 0.00 C ATOM 103 C GLN S 461 -7.001 -7.537 -1.534 1.00 0.00 C ATOM 104 O GLN S 461 -8.010 -7.480 -0.831 1.00 0.00 O ATOM 105 CB GLN S 461 -6.273 -9.831 -2.189 1.00 0.00 C ATOM 106 CG GLN S 461 -5.745 -11.149 -1.643 1.00 0.00 C ATOM 107 CD GLN S 461 -6.280 -12.350 -2.399 1.00 0.00 C ATOM 108 OE1 GLN S 461 -6.721 -13.330 -1.798 1.00 0.00 O ATOM 109 NE2 GLN S 461 -6.245 -12.278 -3.724 1.00 0.00 N ATOM 0 H GLN S 461 -6.717 -8.862 0.632 1.00 0.00 H new ATOM 0 HA GLN S 461 -4.976 -8.218 -1.592 1.00 0.00 H new ATOM 0 HB2 GLN S 461 -7.354 -9.905 -2.305 1.00 0.00 H new ATOM 0 HB3 GLN S 461 -5.856 -9.668 -3.183 1.00 0.00 H new ATOM 0 HG2 GLN S 461 -4.656 -11.149 -1.693 1.00 0.00 H new ATOM 0 HG3 GLN S 461 -6.016 -11.237 -0.591 1.00 0.00 H new ATOM 0 HE21 GLN S 461 -5.871 -11.446 -4.180 1.00 0.00 H new ATOM 0 HE22 GLN S 461 -6.592 -13.055 -4.286 1.00 0.00 H new ATOM 118 N VAL S 462 -6.754 -6.690 -2.529 1.00 0.00 N ATOM 119 CA VAL S 462 -7.670 -5.608 -2.870 1.00 0.00 C ATOM 120 C VAL S 462 -7.431 -5.119 -4.296 1.00 0.00 C ATOM 121 O VAL S 462 -6.377 -4.560 -4.598 1.00 0.00 O ATOM 122 CB VAL S 462 -7.511 -4.413 -1.909 1.00 0.00 C ATOM 123 CG1 VAL S 462 -7.879 -4.808 -0.487 1.00 0.00 C ATOM 124 CG2 VAL S 462 -6.093 -3.868 -1.972 1.00 0.00 C ATOM 0 H VAL S 462 -5.921 -6.734 -3.116 1.00 0.00 H new ATOM 0 HA VAL S 462 -8.679 -6.010 -2.782 1.00 0.00 H new ATOM 0 HB VAL S 462 -8.195 -3.625 -2.224 1.00 0.00 H new ATOM 0 HG11 VAL S 462 -7.759 -3.948 0.172 1.00 0.00 H new ATOM 0 HG12 VAL S 462 -8.915 -5.144 -0.459 1.00 0.00 H new ATOM 0 HG13 VAL S 462 -7.227 -5.615 -0.153 1.00 0.00 H new ATOM 0 HG21 VAL S 462 -5.997 -3.025 -1.288 1.00 0.00 H new ATOM 0 HG22 VAL S 462 -5.390 -4.650 -1.686 1.00 0.00 H new ATOM 0 HG23 VAL S 462 -5.875 -3.538 -2.988 1.00 0.00 H new ATOM 134 N GLU S 463 -8.414 -5.320 -5.167 1.00 0.00 N ATOM 135 CA GLU S 463 -8.292 -4.880 -6.552 1.00 0.00 C ATOM 136 C GLU S 463 -8.154 -3.361 -6.610 1.00 0.00 C ATOM 137 O GLU S 463 -8.686 -2.655 -5.755 1.00 0.00 O ATOM 138 CB GLU S 463 -9.502 -5.346 -7.373 1.00 0.00 C ATOM 139 CG GLU S 463 -10.646 -4.344 -7.418 1.00 0.00 C ATOM 140 CD GLU S 463 -11.993 -5.003 -7.646 1.00 0.00 C ATOM 141 OE1 GLU S 463 -12.111 -5.796 -8.603 1.00 0.00 O ATOM 142 OE2 GLU S 463 -12.928 -4.724 -6.866 1.00 0.00 O ATOM 0 H GLU S 463 -9.296 -5.780 -4.942 1.00 0.00 H new ATOM 0 HA GLU S 463 -7.396 -5.327 -6.984 1.00 0.00 H new ATOM 0 HB2 GLU S 463 -9.177 -5.556 -8.392 1.00 0.00 H new ATOM 0 HB3 GLU S 463 -9.871 -6.283 -6.957 1.00 0.00 H new ATOM 0 HG2 GLU S 463 -10.673 -3.787 -6.481 1.00 0.00 H new ATOM 0 HG3 GLU S 463 -10.460 -3.622 -8.213 1.00 0.00 H new ATOM 149 N ALA S 464 -7.443 -2.861 -7.615 1.00 0.00 N ATOM 150 CA ALA S 464 -7.252 -1.426 -7.758 1.00 0.00 C ATOM 151 C ALA S 464 -8.348 -0.815 -8.615 1.00 0.00 C ATOM 152 O ALA S 464 -9.181 -1.524 -9.178 1.00 0.00 O ATOM 153 CB ALA S 464 -5.883 -1.122 -8.347 1.00 0.00 C ATOM 0 H ALA S 464 -6.993 -3.425 -8.336 1.00 0.00 H new ATOM 0 HA ALA S 464 -7.307 -0.979 -6.766 1.00 0.00 H new ATOM 0 HB1 ALA S 464 -5.761 -0.043 -8.446 1.00 0.00 H new ATOM 0 HB2 ALA S 464 -5.108 -1.516 -7.690 1.00 0.00 H new ATOM 0 HB3 ALA S 464 -5.798 -1.588 -9.329 1.00 0.00 H new ATOM 159 N LEU S 465 -8.350 0.508 -8.702 1.00 0.00 N ATOM 160 CA LEU S 465 -9.353 1.216 -9.486 1.00 0.00 C ATOM 161 C LEU S 465 -8.759 2.433 -10.194 1.00 0.00 C ATOM 162 O LEU S 465 -9.197 2.792 -11.285 1.00 0.00 O ATOM 163 CB LEU S 465 -10.513 1.640 -8.587 1.00 0.00 C ATOM 164 CG LEU S 465 -11.236 0.485 -7.893 1.00 0.00 C ATOM 165 CD1 LEU S 465 -10.471 0.041 -6.658 1.00 0.00 C ATOM 166 CD2 LEU S 465 -12.657 0.888 -7.528 1.00 0.00 C ATOM 0 H LEU S 465 -7.670 1.112 -8.240 1.00 0.00 H new ATOM 0 HA LEU S 465 -9.721 0.535 -10.254 1.00 0.00 H new ATOM 0 HB2 LEU S 465 -10.135 2.324 -7.827 1.00 0.00 H new ATOM 0 HB3 LEU S 465 -11.235 2.196 -9.185 1.00 0.00 H new ATOM 0 HG LEU S 465 -11.285 -0.356 -8.585 1.00 0.00 H new ATOM 0 HD11 LEU S 465 -11.001 -0.782 -6.178 1.00 0.00 H new ATOM 0 HD12 LEU S 465 -9.474 -0.290 -6.947 1.00 0.00 H new ATOM 0 HD13 LEU S 465 -10.389 0.875 -5.961 1.00 0.00 H new ATOM 0 HD21 LEU S 465 -13.156 0.054 -7.035 1.00 0.00 H new ATOM 0 HD22 LEU S 465 -12.631 1.745 -6.854 1.00 0.00 H new ATOM 0 HD23 LEU S 465 -13.203 1.155 -8.433 1.00 0.00 H new ATOM 178 N PHE S 466 -7.766 3.065 -9.574 1.00 0.00 N ATOM 179 CA PHE S 466 -7.128 4.237 -10.166 1.00 0.00 C ATOM 180 C PHE S 466 -5.616 4.081 -10.227 1.00 0.00 C ATOM 181 O PHE S 466 -5.012 3.425 -9.378 1.00 0.00 O ATOM 182 CB PHE S 466 -7.437 5.497 -9.359 1.00 0.00 C ATOM 183 CG PHE S 466 -8.853 5.615 -8.891 1.00 0.00 C ATOM 184 CD1 PHE S 466 -9.824 6.143 -9.721 1.00 0.00 C ATOM 185 CD2 PHE S 466 -9.209 5.222 -7.610 1.00 0.00 C ATOM 186 CE1 PHE S 466 -11.125 6.282 -9.286 1.00 0.00 C ATOM 187 CE2 PHE S 466 -10.511 5.353 -7.171 1.00 0.00 C ATOM 188 CZ PHE S 466 -11.467 5.887 -8.012 1.00 0.00 C ATOM 0 H PHE S 466 -7.388 2.788 -8.668 1.00 0.00 H new ATOM 0 HA PHE S 466 -7.529 4.328 -11.176 1.00 0.00 H new ATOM 0 HB2 PHE S 466 -6.779 5.525 -8.490 1.00 0.00 H new ATOM 0 HB3 PHE S 466 -7.197 6.369 -9.968 1.00 0.00 H new ATOM 0 HD1 PHE S 466 -9.560 6.450 -10.722 1.00 0.00 H new ATOM 0 HD2 PHE S 466 -8.461 4.810 -6.950 1.00 0.00 H new ATOM 0 HE1 PHE S 466 -11.874 6.700 -9.943 1.00 0.00 H new ATOM 0 HE2 PHE S 466 -10.781 5.039 -6.174 1.00 0.00 H new ATOM 0 HZ PHE S 466 -12.486 5.995 -7.670 1.00 0.00 H new ATOM 198 N SER S 467 -5.005 4.728 -11.213 1.00 0.00 N ATOM 199 CA SER S 467 -3.558 4.702 -11.356 1.00 0.00 C ATOM 200 C SER S 467 -2.953 5.737 -10.416 1.00 0.00 C ATOM 201 O SER S 467 -3.004 6.938 -10.684 1.00 0.00 O ATOM 202 CB SER S 467 -3.151 4.992 -12.802 1.00 0.00 C ATOM 203 OG SER S 467 -3.491 3.912 -13.655 1.00 0.00 O ATOM 0 H SER S 467 -5.490 5.276 -11.923 1.00 0.00 H new ATOM 0 HA SER S 467 -3.187 3.710 -11.099 1.00 0.00 H new ATOM 0 HB2 SER S 467 -3.645 5.901 -13.147 1.00 0.00 H new ATOM 0 HB3 SER S 467 -2.077 5.174 -12.851 1.00 0.00 H new ATOM 0 HG SER S 467 -3.222 4.123 -14.573 1.00 0.00 H new ATOM 209 N TYR S 468 -2.416 5.269 -9.298 1.00 0.00 N ATOM 210 CA TYR S 468 -1.841 6.157 -8.296 1.00 0.00 C ATOM 211 C TYR S 468 -0.440 6.622 -8.679 1.00 0.00 C ATOM 212 O TYR S 468 0.474 5.814 -8.838 1.00 0.00 O ATOM 213 CB TYR S 468 -1.799 5.445 -6.939 1.00 0.00 C ATOM 214 CG TYR S 468 -1.079 6.214 -5.849 1.00 0.00 C ATOM 215 CD1 TYR S 468 -0.951 7.599 -5.906 1.00 0.00 C ATOM 216 CD2 TYR S 468 -0.525 5.552 -4.762 1.00 0.00 C ATOM 217 CE1 TYR S 468 -0.291 8.295 -4.911 1.00 0.00 C ATOM 218 CE2 TYR S 468 0.134 6.244 -3.763 1.00 0.00 C ATOM 219 CZ TYR S 468 0.249 7.614 -3.844 1.00 0.00 C ATOM 220 OH TYR S 468 0.902 8.306 -2.852 1.00 0.00 O ATOM 0 H TYR S 468 -2.366 4.278 -9.061 1.00 0.00 H new ATOM 0 HA TYR S 468 -2.475 7.041 -8.234 1.00 0.00 H new ATOM 0 HB2 TYR S 468 -2.821 5.249 -6.614 1.00 0.00 H new ATOM 0 HB3 TYR S 468 -1.313 4.477 -7.065 1.00 0.00 H new ATOM 0 HD1 TYR S 468 -1.374 8.138 -6.741 1.00 0.00 H new ATOM 0 HD2 TYR S 468 -0.610 4.477 -4.696 1.00 0.00 H new ATOM 0 HE1 TYR S 468 -0.199 9.369 -4.971 1.00 0.00 H new ATOM 0 HE2 TYR S 468 0.557 5.713 -2.923 1.00 0.00 H new ATOM 0 HH TYR S 468 1.862 8.113 -2.896 1.00 0.00 H new ATOM 230 N GLU S 469 -0.279 7.937 -8.799 1.00 0.00 N ATOM 231 CA GLU S 469 1.011 8.520 -9.130 1.00 0.00 C ATOM 232 C GLU S 469 1.923 8.459 -7.913 1.00 0.00 C ATOM 233 O GLU S 469 1.693 9.144 -6.917 1.00 0.00 O ATOM 234 CB GLU S 469 0.848 9.969 -9.595 1.00 0.00 C ATOM 235 CG GLU S 469 1.806 10.362 -10.706 1.00 0.00 C ATOM 236 CD GLU S 469 1.528 11.751 -11.251 1.00 0.00 C ATOM 237 OE1 GLU S 469 1.658 12.726 -10.482 1.00 0.00 O ATOM 238 OE2 GLU S 469 1.182 11.862 -12.445 1.00 0.00 O ATOM 0 H GLU S 469 -1.029 8.617 -8.671 1.00 0.00 H new ATOM 0 HA GLU S 469 1.456 7.950 -9.946 1.00 0.00 H new ATOM 0 HB2 GLU S 469 -0.175 10.118 -9.939 1.00 0.00 H new ATOM 0 HB3 GLU S 469 0.999 10.634 -8.745 1.00 0.00 H new ATOM 0 HG2 GLU S 469 2.829 10.321 -10.331 1.00 0.00 H new ATOM 0 HG3 GLU S 469 1.734 9.637 -11.516 1.00 0.00 H new ATOM 245 N ALA S 470 2.941 7.619 -7.993 1.00 0.00 N ATOM 246 CA ALA S 470 3.874 7.443 -6.890 1.00 0.00 C ATOM 247 C ALA S 470 5.050 8.410 -6.988 1.00 0.00 C ATOM 248 O ALA S 470 5.843 8.349 -7.927 1.00 0.00 O ATOM 249 CB ALA S 470 4.362 6.003 -6.849 1.00 0.00 C ATOM 0 H ALA S 470 3.144 7.046 -8.812 1.00 0.00 H new ATOM 0 HA ALA S 470 3.348 7.667 -5.962 1.00 0.00 H new ATOM 0 HB1 ALA S 470 5.060 5.879 -6.021 1.00 0.00 H new ATOM 0 HB2 ALA S 470 3.512 5.335 -6.711 1.00 0.00 H new ATOM 0 HB3 ALA S 470 4.864 5.762 -7.786 1.00 0.00 H new ATOM 255 N THR S 471 5.151 9.302 -6.006 1.00 0.00 N ATOM 256 CA THR S 471 6.227 10.285 -5.970 1.00 0.00 C ATOM 257 C THR S 471 7.236 9.940 -4.878 1.00 0.00 C ATOM 258 O THR S 471 8.428 10.219 -5.009 1.00 0.00 O ATOM 259 CB THR S 471 5.660 11.684 -5.734 1.00 0.00 C ATOM 260 OG1 THR S 471 4.474 11.622 -4.963 1.00 0.00 O ATOM 261 CG2 THR S 471 5.337 12.424 -7.015 1.00 0.00 C ATOM 0 H THR S 471 4.499 9.363 -5.224 1.00 0.00 H new ATOM 0 HA THR S 471 6.737 10.268 -6.933 1.00 0.00 H new ATOM 0 HB THR S 471 6.445 12.227 -5.208 1.00 0.00 H new ATOM 0 HG1 THR S 471 4.652 11.143 -4.127 1.00 0.00 H new ATOM 0 HG21 THR S 471 4.939 13.410 -6.775 1.00 0.00 H new ATOM 0 HG22 THR S 471 6.244 12.534 -7.610 1.00 0.00 H new ATOM 0 HG23 THR S 471 4.596 11.862 -7.583 1.00 0.00 H new ATOM 269 N GLN S 472 6.750 9.324 -3.805 1.00 0.00 N ATOM 270 CA GLN S 472 7.612 8.934 -2.692 1.00 0.00 C ATOM 271 C GLN S 472 7.961 7.447 -2.772 1.00 0.00 C ATOM 272 O GLN S 472 7.310 6.684 -3.485 1.00 0.00 O ATOM 273 CB GLN S 472 6.958 9.254 -1.341 1.00 0.00 C ATOM 274 CG GLN S 472 5.438 9.206 -1.354 1.00 0.00 C ATOM 275 CD GLN S 472 4.815 10.551 -1.668 1.00 0.00 C ATOM 276 OE1 GLN S 472 4.121 10.707 -2.674 1.00 0.00 O ATOM 277 NE2 GLN S 472 5.059 11.533 -0.809 1.00 0.00 N ATOM 0 H GLN S 472 5.766 9.084 -3.682 1.00 0.00 H new ATOM 0 HA GLN S 472 8.532 9.514 -2.769 1.00 0.00 H new ATOM 0 HB2 GLN S 472 7.326 8.548 -0.596 1.00 0.00 H new ATOM 0 HB3 GLN S 472 7.276 10.247 -1.023 1.00 0.00 H new ATOM 0 HG2 GLN S 472 5.108 8.475 -2.092 1.00 0.00 H new ATOM 0 HG3 GLN S 472 5.081 8.862 -0.383 1.00 0.00 H new ATOM 0 HE21 GLN S 472 5.639 11.360 0.012 1.00 0.00 H new ATOM 0 HE22 GLN S 472 4.666 12.460 -0.970 1.00 0.00 H new ATOM 286 N PRO S 473 9.017 7.023 -2.055 1.00 0.00 N ATOM 287 CA PRO S 473 9.476 5.628 -2.061 1.00 0.00 C ATOM 288 C PRO S 473 8.436 4.634 -1.537 1.00 0.00 C ATOM 289 O PRO S 473 7.829 3.899 -2.317 1.00 0.00 O ATOM 290 CB PRO S 473 10.711 5.647 -1.153 1.00 0.00 C ATOM 291 CG PRO S 473 10.580 6.887 -0.334 1.00 0.00 C ATOM 292 CD PRO S 473 9.860 7.877 -1.201 1.00 0.00 C ATOM 0 HA PRO S 473 9.678 5.289 -3.077 1.00 0.00 H new ATOM 0 HB2 PRO S 473 10.747 4.760 -0.520 1.00 0.00 H new ATOM 0 HB3 PRO S 473 11.630 5.658 -1.739 1.00 0.00 H new ATOM 0 HG2 PRO S 473 10.023 6.693 0.583 1.00 0.00 H new ATOM 0 HG3 PRO S 473 11.559 7.265 -0.039 1.00 0.00 H new ATOM 0 HD2 PRO S 473 9.262 8.571 -0.610 1.00 0.00 H new ATOM 0 HD3 PRO S 473 10.554 8.476 -1.790 1.00 0.00 H new ATOM 300 N GLU S 474 8.252 4.592 -0.217 1.00 0.00 N ATOM 301 CA GLU S 474 7.304 3.662 0.404 1.00 0.00 C ATOM 302 C GLU S 474 5.981 3.589 -0.359 1.00 0.00 C ATOM 303 O GLU S 474 5.319 2.552 -0.368 1.00 0.00 O ATOM 304 CB GLU S 474 7.049 4.043 1.868 1.00 0.00 C ATOM 305 CG GLU S 474 6.050 5.174 2.052 1.00 0.00 C ATOM 306 CD GLU S 474 6.508 6.468 1.408 1.00 0.00 C ATOM 307 OE1 GLU S 474 7.469 7.079 1.922 1.00 0.00 O ATOM 308 OE2 GLU S 474 5.906 6.871 0.391 1.00 0.00 O ATOM 0 H GLU S 474 8.746 5.191 0.444 1.00 0.00 H new ATOM 0 HA GLU S 474 7.760 2.673 0.366 1.00 0.00 H new ATOM 0 HB2 GLU S 474 6.689 3.164 2.403 1.00 0.00 H new ATOM 0 HB3 GLU S 474 7.995 4.330 2.327 1.00 0.00 H new ATOM 0 HG2 GLU S 474 5.091 4.880 1.625 1.00 0.00 H new ATOM 0 HG3 GLU S 474 5.887 5.340 3.117 1.00 0.00 H new ATOM 315 N ASP S 475 5.598 4.690 -0.999 1.00 0.00 N ATOM 316 CA ASP S 475 4.357 4.734 -1.756 1.00 0.00 C ATOM 317 C ASP S 475 4.397 3.757 -2.925 1.00 0.00 C ATOM 318 O ASP S 475 5.150 3.940 -3.880 1.00 0.00 O ATOM 319 CB ASP S 475 4.106 6.149 -2.266 1.00 0.00 C ATOM 320 CG ASP S 475 3.313 6.987 -1.281 1.00 0.00 C ATOM 321 OD1 ASP S 475 3.033 6.491 -0.169 1.00 0.00 O ATOM 322 OD2 ASP S 475 2.974 8.138 -1.621 1.00 0.00 O ATOM 0 H ASP S 475 6.130 5.560 -1.007 1.00 0.00 H new ATOM 0 HA ASP S 475 3.542 4.442 -1.094 1.00 0.00 H new ATOM 0 HB2 ASP S 475 5.061 6.635 -2.466 1.00 0.00 H new ATOM 0 HB3 ASP S 475 3.569 6.101 -3.213 1.00 0.00 H new ATOM 327 N LEU S 476 3.570 2.724 -2.841 1.00 0.00 N ATOM 328 CA LEU S 476 3.492 1.715 -3.888 1.00 0.00 C ATOM 329 C LEU S 476 2.643 2.232 -5.043 1.00 0.00 C ATOM 330 O LEU S 476 1.474 2.574 -4.862 1.00 0.00 O ATOM 331 CB LEU S 476 2.902 0.409 -3.331 1.00 0.00 C ATOM 332 CG LEU S 476 2.181 -0.478 -4.354 1.00 0.00 C ATOM 333 CD1 LEU S 476 3.113 -0.847 -5.497 1.00 0.00 C ATOM 334 CD2 LEU S 476 1.631 -1.729 -3.695 1.00 0.00 C ATOM 0 H LEU S 476 2.941 2.563 -2.055 1.00 0.00 H new ATOM 0 HA LEU S 476 4.497 1.508 -4.254 1.00 0.00 H new ATOM 0 HB2 LEU S 476 3.707 -0.169 -2.878 1.00 0.00 H new ATOM 0 HB3 LEU S 476 2.201 0.658 -2.534 1.00 0.00 H new ATOM 0 HG LEU S 476 1.344 0.090 -4.760 1.00 0.00 H new ATOM 0 HD11 LEU S 476 2.582 -1.476 -6.211 1.00 0.00 H new ATOM 0 HD12 LEU S 476 3.454 0.060 -5.996 1.00 0.00 H new ATOM 0 HD13 LEU S 476 3.973 -1.390 -5.105 1.00 0.00 H new ATOM 0 HD21 LEU S 476 1.125 -2.341 -4.442 1.00 0.00 H new ATOM 0 HD22 LEU S 476 2.450 -2.298 -3.254 1.00 0.00 H new ATOM 0 HD23 LEU S 476 0.923 -1.448 -2.915 1.00 0.00 H new ATOM 346 N GLU S 477 3.240 2.296 -6.224 1.00 0.00 N ATOM 347 CA GLU S 477 2.542 2.782 -7.405 1.00 0.00 C ATOM 348 C GLU S 477 1.799 1.655 -8.104 1.00 0.00 C ATOM 349 O GLU S 477 2.328 0.556 -8.273 1.00 0.00 O ATOM 350 CB GLU S 477 3.528 3.413 -8.385 1.00 0.00 C ATOM 351 CG GLU S 477 2.945 4.579 -9.163 1.00 0.00 C ATOM 352 CD GLU S 477 3.953 5.211 -10.104 1.00 0.00 C ATOM 353 OE1 GLU S 477 4.446 4.505 -11.008 1.00 0.00 O ATOM 354 OE2 GLU S 477 4.248 6.414 -9.935 1.00 0.00 O ATOM 0 H GLU S 477 4.207 2.017 -6.390 1.00 0.00 H new ATOM 0 HA GLU S 477 1.822 3.531 -7.077 1.00 0.00 H new ATOM 0 HB2 GLU S 477 4.405 3.755 -7.836 1.00 0.00 H new ATOM 0 HB3 GLU S 477 3.868 2.652 -9.087 1.00 0.00 H new ATOM 0 HG2 GLU S 477 2.084 4.235 -9.736 1.00 0.00 H new ATOM 0 HG3 GLU S 477 2.583 5.333 -8.464 1.00 0.00 H new ATOM 361 N PHE S 478 0.576 1.941 -8.529 1.00 0.00 N ATOM 362 CA PHE S 478 -0.231 0.951 -9.235 1.00 0.00 C ATOM 363 C PHE S 478 -1.164 1.628 -10.231 1.00 0.00 C ATOM 364 O PHE S 478 -1.576 2.771 -10.030 1.00 0.00 O ATOM 365 CB PHE S 478 -1.029 0.088 -8.253 1.00 0.00 C ATOM 366 CG PHE S 478 -1.645 0.860 -7.124 1.00 0.00 C ATOM 367 CD1 PHE S 478 -0.854 1.446 -6.151 1.00 0.00 C ATOM 368 CD2 PHE S 478 -3.019 0.995 -7.037 1.00 0.00 C ATOM 369 CE1 PHE S 478 -1.423 2.155 -5.112 1.00 0.00 C ATOM 370 CE2 PHE S 478 -3.596 1.703 -6.002 1.00 0.00 C ATOM 371 CZ PHE S 478 -2.797 2.285 -5.038 1.00 0.00 C ATOM 0 H PHE S 478 0.121 2.845 -8.399 1.00 0.00 H new ATOM 0 HA PHE S 478 0.447 0.298 -9.785 1.00 0.00 H new ATOM 0 HB2 PHE S 478 -1.818 -0.430 -8.798 1.00 0.00 H new ATOM 0 HB3 PHE S 478 -0.372 -0.677 -7.840 1.00 0.00 H new ATOM 0 HD1 PHE S 478 0.220 1.348 -6.205 1.00 0.00 H new ATOM 0 HD2 PHE S 478 -3.648 0.541 -7.788 1.00 0.00 H new ATOM 0 HE1 PHE S 478 -0.796 2.607 -4.358 1.00 0.00 H new ATOM 0 HE2 PHE S 478 -4.670 1.801 -5.946 1.00 0.00 H new ATOM 0 HZ PHE S 478 -3.245 2.841 -4.228 1.00 0.00 H new ATOM 381 N GLN S 479 -1.478 0.925 -11.314 1.00 0.00 N ATOM 382 CA GLN S 479 -2.347 1.466 -12.355 1.00 0.00 C ATOM 383 C GLN S 479 -3.805 1.080 -12.123 1.00 0.00 C ATOM 384 O GLN S 479 -4.107 0.208 -11.309 1.00 0.00 O ATOM 385 CB GLN S 479 -1.894 0.974 -13.731 1.00 0.00 C ATOM 386 CG GLN S 479 -1.906 -0.539 -13.870 1.00 0.00 C ATOM 387 CD GLN S 479 -0.511 -1.134 -13.903 1.00 0.00 C ATOM 388 OE1 GLN S 479 0.174 -1.195 -12.883 1.00 0.00 O ATOM 389 NE2 GLN S 479 -0.085 -1.577 -15.079 1.00 0.00 N ATOM 0 H GLN S 479 -1.144 -0.022 -11.495 1.00 0.00 H new ATOM 0 HA GLN S 479 -2.273 2.553 -12.316 1.00 0.00 H new ATOM 0 HB2 GLN S 479 -2.542 1.406 -14.494 1.00 0.00 H new ATOM 0 HB3 GLN S 479 -0.886 1.340 -13.925 1.00 0.00 H new ATOM 0 HG2 GLN S 479 -2.462 -0.972 -13.038 1.00 0.00 H new ATOM 0 HG3 GLN S 479 -2.435 -0.812 -14.783 1.00 0.00 H new ATOM 0 HE21 GLN S 479 -0.687 -1.506 -15.899 1.00 0.00 H new ATOM 0 HE22 GLN S 479 0.845 -1.988 -15.163 1.00 0.00 H new ATOM 398 N GLU S 480 -4.702 1.740 -12.849 1.00 0.00 N ATOM 399 CA GLU S 480 -6.133 1.482 -12.738 1.00 0.00 C ATOM 400 C GLU S 480 -6.440 -0.009 -12.803 1.00 0.00 C ATOM 401 O GLU S 480 -5.755 -0.765 -13.492 1.00 0.00 O ATOM 402 CB GLU S 480 -6.880 2.209 -13.854 1.00 0.00 C ATOM 403 CG GLU S 480 -7.229 3.639 -13.509 1.00 0.00 C ATOM 404 CD GLU S 480 -7.324 4.531 -14.732 1.00 0.00 C ATOM 405 OE1 GLU S 480 -6.279 5.060 -15.164 1.00 0.00 O ATOM 406 OE2 GLU S 480 -8.445 4.699 -15.258 1.00 0.00 O ATOM 0 H GLU S 480 -4.460 2.463 -13.526 1.00 0.00 H new ATOM 0 HA GLU S 480 -6.465 1.854 -11.768 1.00 0.00 H new ATOM 0 HB2 GLU S 480 -6.269 2.199 -14.757 1.00 0.00 H new ATOM 0 HB3 GLU S 480 -7.796 1.664 -14.083 1.00 0.00 H new ATOM 0 HG2 GLU S 480 -8.180 3.658 -12.976 1.00 0.00 H new ATOM 0 HG3 GLU S 480 -6.475 4.039 -12.831 1.00 0.00 H new ATOM 413 N GLY S 481 -7.483 -0.416 -12.083 1.00 0.00 N ATOM 414 CA GLY S 481 -7.888 -1.815 -12.060 1.00 0.00 C ATOM 415 C GLY S 481 -6.712 -2.772 -12.025 1.00 0.00 C ATOM 416 O GLY S 481 -6.237 -3.217 -13.072 1.00 0.00 O ATOM 0 H GLY S 481 -8.059 0.202 -11.511 1.00 0.00 H new ATOM 0 HA2 GLY S 481 -8.518 -1.991 -11.188 1.00 0.00 H new ATOM 0 HA3 GLY S 481 -8.495 -2.026 -12.940 1.00 0.00 H new ATOM 420 N ASP S 482 -6.231 -3.087 -10.827 1.00 0.00 N ATOM 421 CA ASP S 482 -5.098 -3.991 -10.686 1.00 0.00 C ATOM 422 C ASP S 482 -5.265 -4.941 -9.509 1.00 0.00 C ATOM 423 O ASP S 482 -6.065 -4.705 -8.607 1.00 0.00 O ATOM 424 CB ASP S 482 -3.801 -3.196 -10.542 1.00 0.00 C ATOM 425 CG ASP S 482 -2.580 -4.083 -10.383 1.00 0.00 C ATOM 426 OD1 ASP S 482 -2.356 -4.591 -9.266 1.00 0.00 O ATOM 427 OD2 ASP S 482 -1.850 -4.271 -11.380 1.00 0.00 O ATOM 0 H ASP S 482 -6.605 -2.732 -9.947 1.00 0.00 H new ATOM 0 HA ASP S 482 -5.052 -4.597 -11.591 1.00 0.00 H new ATOM 0 HB2 ASP S 482 -3.671 -2.561 -11.418 1.00 0.00 H new ATOM 0 HB3 ASP S 482 -3.879 -2.536 -9.678 1.00 0.00 H new ATOM 432 N ILE S 483 -4.496 -6.021 -9.536 1.00 0.00 N ATOM 433 CA ILE S 483 -4.540 -7.024 -8.486 1.00 0.00 C ATOM 434 C ILE S 483 -3.247 -7.031 -7.679 1.00 0.00 C ATOM 435 O ILE S 483 -2.386 -7.890 -7.873 1.00 0.00 O ATOM 436 CB ILE S 483 -4.779 -8.427 -9.073 1.00 0.00 C ATOM 437 CG1 ILE S 483 -5.977 -8.413 -10.023 1.00 0.00 C ATOM 438 CG2 ILE S 483 -4.993 -9.433 -7.957 1.00 0.00 C ATOM 439 CD1 ILE S 483 -7.248 -7.891 -9.390 1.00 0.00 C ATOM 0 H ILE S 483 -3.830 -6.224 -10.281 1.00 0.00 H new ATOM 0 HA ILE S 483 -5.369 -6.766 -7.827 1.00 0.00 H new ATOM 0 HB ILE S 483 -3.897 -8.722 -9.641 1.00 0.00 H new ATOM 0 HG12 ILE S 483 -5.735 -7.799 -10.890 1.00 0.00 H new ATOM 0 HG13 ILE S 483 -6.152 -9.425 -10.388 1.00 0.00 H new ATOM 0 HG21 ILE S 483 -5.161 -10.421 -8.385 1.00 0.00 H new ATOM 0 HG22 ILE S 483 -4.111 -9.460 -7.317 1.00 0.00 H new ATOM 0 HG23 ILE S 483 -5.861 -9.141 -7.366 1.00 0.00 H new ATOM 0 HD11 ILE S 483 -8.054 -7.911 -10.123 1.00 0.00 H new ATOM 0 HD12 ILE S 483 -7.515 -8.519 -8.540 1.00 0.00 H new ATOM 0 HD13 ILE S 483 -7.091 -6.867 -9.050 1.00 0.00 H new ATOM 451 N ILE S 484 -3.122 -6.072 -6.769 1.00 0.00 N ATOM 452 CA ILE S 484 -1.938 -5.970 -5.925 1.00 0.00 C ATOM 453 C ILE S 484 -2.018 -6.966 -4.776 1.00 0.00 C ATOM 454 O ILE S 484 -3.103 -7.427 -4.419 1.00 0.00 O ATOM 455 CB ILE S 484 -1.782 -4.545 -5.353 1.00 0.00 C ATOM 456 CG1 ILE S 484 -1.669 -3.526 -6.488 1.00 0.00 C ATOM 457 CG2 ILE S 484 -0.568 -4.463 -4.439 1.00 0.00 C ATOM 458 CD1 ILE S 484 -2.984 -2.863 -6.835 1.00 0.00 C ATOM 0 H ILE S 484 -3.826 -5.354 -6.597 1.00 0.00 H new ATOM 0 HA ILE S 484 -1.071 -6.196 -6.545 1.00 0.00 H new ATOM 0 HB ILE S 484 -2.669 -4.311 -4.764 1.00 0.00 H new ATOM 0 HG12 ILE S 484 -0.947 -2.759 -6.207 1.00 0.00 H new ATOM 0 HG13 ILE S 484 -1.276 -4.023 -7.375 1.00 0.00 H new ATOM 0 HG21 ILE S 484 -0.476 -3.450 -4.046 1.00 0.00 H new ATOM 0 HG22 ILE S 484 -0.687 -5.163 -3.612 1.00 0.00 H new ATOM 0 HG23 ILE S 484 0.330 -4.716 -5.003 1.00 0.00 H new ATOM 0 HD11 ILE S 484 -2.830 -2.153 -7.647 1.00 0.00 H new ATOM 0 HD12 ILE S 484 -3.702 -3.621 -7.147 1.00 0.00 H new ATOM 0 HD13 ILE S 484 -3.368 -2.337 -5.961 1.00 0.00 H new ATOM 470 N LEU S 485 -0.872 -7.294 -4.195 1.00 0.00 N ATOM 471 CA LEU S 485 -0.830 -8.232 -3.086 1.00 0.00 C ATOM 472 C LEU S 485 -0.739 -7.487 -1.767 1.00 0.00 C ATOM 473 O LEU S 485 0.346 -7.108 -1.326 1.00 0.00 O ATOM 474 CB LEU S 485 0.353 -9.194 -3.242 1.00 0.00 C ATOM 475 CG LEU S 485 0.702 -10.056 -2.013 1.00 0.00 C ATOM 476 CD1 LEU S 485 1.804 -9.398 -1.201 1.00 0.00 C ATOM 477 CD2 LEU S 485 -0.522 -10.310 -1.142 1.00 0.00 C ATOM 0 H LEU S 485 0.037 -6.925 -4.473 1.00 0.00 H new ATOM 0 HA LEU S 485 -1.751 -8.815 -3.091 1.00 0.00 H new ATOM 0 HB2 LEU S 485 0.143 -9.861 -4.078 1.00 0.00 H new ATOM 0 HB3 LEU S 485 1.234 -8.611 -3.512 1.00 0.00 H new ATOM 0 HG LEU S 485 1.058 -11.021 -2.374 1.00 0.00 H new ATOM 0 HD11 LEU S 485 2.039 -10.019 -0.337 1.00 0.00 H new ATOM 0 HD12 LEU S 485 2.694 -9.285 -1.820 1.00 0.00 H new ATOM 0 HD13 LEU S 485 1.471 -8.417 -0.863 1.00 0.00 H new ATOM 0 HD21 LEU S 485 -0.238 -10.921 -0.285 1.00 0.00 H new ATOM 0 HD22 LEU S 485 -0.924 -9.359 -0.793 1.00 0.00 H new ATOM 0 HD23 LEU S 485 -1.281 -10.832 -1.724 1.00 0.00 H new ATOM 489 N VAL S 486 -1.885 -7.292 -1.132 1.00 0.00 N ATOM 490 CA VAL S 486 -1.923 -6.606 0.148 1.00 0.00 C ATOM 491 C VAL S 486 -1.243 -7.458 1.190 1.00 0.00 C ATOM 492 O VAL S 486 -1.685 -8.567 1.479 1.00 0.00 O ATOM 493 CB VAL S 486 -3.352 -6.314 0.644 1.00 0.00 C ATOM 494 CG1 VAL S 486 -3.340 -5.163 1.628 1.00 0.00 C ATOM 495 CG2 VAL S 486 -4.305 -6.015 -0.505 1.00 0.00 C ATOM 0 H VAL S 486 -2.794 -7.597 -1.480 1.00 0.00 H new ATOM 0 HA VAL S 486 -1.416 -5.652 -0.000 1.00 0.00 H new ATOM 0 HB VAL S 486 -3.715 -7.212 1.144 1.00 0.00 H new ATOM 0 HG11 VAL S 486 -4.356 -4.967 1.971 1.00 0.00 H new ATOM 0 HG12 VAL S 486 -2.712 -5.420 2.481 1.00 0.00 H new ATOM 0 HG13 VAL S 486 -2.943 -4.272 1.141 1.00 0.00 H new ATOM 0 HG21 VAL S 486 -5.301 -5.815 -0.109 1.00 0.00 H new ATOM 0 HG22 VAL S 486 -3.951 -5.142 -1.054 1.00 0.00 H new ATOM 0 HG23 VAL S 486 -4.347 -6.873 -1.176 1.00 0.00 H new ATOM 505 N LEU S 487 -0.163 -6.957 1.747 1.00 0.00 N ATOM 506 CA LEU S 487 0.561 -7.711 2.750 1.00 0.00 C ATOM 507 C LEU S 487 -0.054 -7.545 4.135 1.00 0.00 C ATOM 508 O LEU S 487 0.198 -8.353 5.028 1.00 0.00 O ATOM 509 CB LEU S 487 2.020 -7.283 2.773 1.00 0.00 C ATOM 510 CG LEU S 487 2.946 -8.080 1.849 1.00 0.00 C ATOM 511 CD1 LEU S 487 4.399 -7.742 2.133 1.00 0.00 C ATOM 512 CD2 LEU S 487 2.705 -9.575 2.003 1.00 0.00 C ATOM 0 H LEU S 487 0.231 -6.042 1.527 1.00 0.00 H new ATOM 0 HA LEU S 487 0.496 -8.766 2.482 1.00 0.00 H new ATOM 0 HB2 LEU S 487 2.078 -6.230 2.499 1.00 0.00 H new ATOM 0 HB3 LEU S 487 2.391 -7.367 3.794 1.00 0.00 H new ATOM 0 HG LEU S 487 2.722 -7.803 0.819 1.00 0.00 H new ATOM 0 HD11 LEU S 487 5.043 -8.317 1.468 1.00 0.00 H new ATOM 0 HD12 LEU S 487 4.564 -6.677 1.967 1.00 0.00 H new ATOM 0 HD13 LEU S 487 4.634 -7.989 3.168 1.00 0.00 H new ATOM 0 HD21 LEU S 487 3.373 -10.122 1.338 1.00 0.00 H new ATOM 0 HD22 LEU S 487 2.898 -9.870 3.034 1.00 0.00 H new ATOM 0 HD23 LEU S 487 1.671 -9.805 1.748 1.00 0.00 H new ATOM 524 N SER S 488 -0.856 -6.498 4.310 1.00 0.00 N ATOM 525 CA SER S 488 -1.500 -6.233 5.603 1.00 0.00 C ATOM 526 C SER S 488 -2.145 -4.852 5.639 1.00 0.00 C ATOM 527 O SER S 488 -2.005 -4.063 4.708 1.00 0.00 O ATOM 528 CB SER S 488 -0.474 -6.290 6.741 1.00 0.00 C ATOM 529 OG SER S 488 -1.068 -6.741 7.945 1.00 0.00 O ATOM 0 H SER S 488 -1.077 -5.820 3.581 1.00 0.00 H new ATOM 0 HA SER S 488 -2.263 -7.000 5.731 1.00 0.00 H new ATOM 0 HB2 SER S 488 0.343 -6.956 6.464 1.00 0.00 H new ATOM 0 HB3 SER S 488 -0.042 -5.301 6.894 1.00 0.00 H new ATOM 0 HG SER S 488 -0.391 -6.769 8.653 1.00 0.00 H new ATOM 535 N LYS S 489 -2.803 -4.555 6.758 1.00 0.00 N ATOM 536 CA LYS S 489 -3.421 -3.253 6.968 1.00 0.00 C ATOM 537 C LYS S 489 -2.397 -2.349 7.639 1.00 0.00 C ATOM 538 O LYS S 489 -1.686 -2.791 8.541 1.00 0.00 O ATOM 539 CB LYS S 489 -4.673 -3.380 7.839 1.00 0.00 C ATOM 540 CG LYS S 489 -5.453 -2.083 7.975 1.00 0.00 C ATOM 541 CD LYS S 489 -5.928 -1.861 9.402 1.00 0.00 C ATOM 542 CE LYS S 489 -7.392 -2.239 9.567 1.00 0.00 C ATOM 543 NZ LYS S 489 -8.008 -1.569 10.746 1.00 0.00 N ATOM 0 H LYS S 489 -2.921 -5.205 7.536 1.00 0.00 H new ATOM 0 HA LYS S 489 -3.729 -2.830 6.012 1.00 0.00 H new ATOM 0 HB2 LYS S 489 -5.325 -4.144 7.415 1.00 0.00 H new ATOM 0 HB3 LYS S 489 -4.382 -3.725 8.831 1.00 0.00 H new ATOM 0 HG2 LYS S 489 -4.826 -1.247 7.666 1.00 0.00 H new ATOM 0 HG3 LYS S 489 -6.312 -2.103 7.304 1.00 0.00 H new ATOM 0 HD2 LYS S 489 -5.319 -2.453 10.086 1.00 0.00 H new ATOM 0 HD3 LYS S 489 -5.788 -0.815 9.675 1.00 0.00 H new ATOM 0 HE2 LYS S 489 -7.941 -1.966 8.666 1.00 0.00 H new ATOM 0 HE3 LYS S 489 -7.478 -3.320 9.678 1.00 0.00 H new ATOM 0 HZ1 LYS S 489 -9.006 -1.852 10.824 1.00 0.00 H new ATOM 0 HZ2 LYS S 489 -7.500 -1.849 11.609 1.00 0.00 H new ATOM 0 HZ3 LYS S 489 -7.949 -0.537 10.629 1.00 0.00 H new ATOM 557 N VAL S 490 -2.280 -1.104 7.189 1.00 0.00 N ATOM 558 CA VAL S 490 -1.278 -0.206 7.764 1.00 0.00 C ATOM 559 C VAL S 490 -1.886 0.911 8.624 1.00 0.00 C ATOM 560 O VAL S 490 -1.261 1.352 9.587 1.00 0.00 O ATOM 561 CB VAL S 490 -0.358 0.363 6.661 1.00 0.00 C ATOM 562 CG1 VAL S 490 0.625 1.384 7.221 1.00 0.00 C ATOM 563 CG2 VAL S 490 0.398 -0.781 5.989 1.00 0.00 C ATOM 0 H VAL S 490 -2.850 -0.699 6.446 1.00 0.00 H new ATOM 0 HA VAL S 490 -0.674 -0.806 8.445 1.00 0.00 H new ATOM 0 HB VAL S 490 -0.981 0.875 5.927 1.00 0.00 H new ATOM 0 HG11 VAL S 490 1.255 1.762 6.416 1.00 0.00 H new ATOM 0 HG12 VAL S 490 0.075 2.211 7.670 1.00 0.00 H new ATOM 0 HG13 VAL S 490 1.249 0.910 7.979 1.00 0.00 H new ATOM 0 HG21 VAL S 490 1.047 -0.380 5.211 1.00 0.00 H new ATOM 0 HG22 VAL S 490 1.001 -1.304 6.731 1.00 0.00 H new ATOM 0 HG23 VAL S 490 -0.314 -1.476 5.545 1.00 0.00 H new ATOM 573 N ASN S 491 -3.100 1.357 8.308 1.00 0.00 N ATOM 574 CA ASN S 491 -3.747 2.399 9.108 1.00 0.00 C ATOM 575 C ASN S 491 -5.175 2.672 8.625 1.00 0.00 C ATOM 576 O ASN S 491 -5.673 3.792 8.737 1.00 0.00 O ATOM 577 CB ASN S 491 -2.908 3.687 9.106 1.00 0.00 C ATOM 578 CG ASN S 491 -3.264 4.639 7.980 1.00 0.00 C ATOM 579 OD1 ASN S 491 -3.273 5.857 8.159 1.00 0.00 O ATOM 580 ND2 ASN S 491 -3.559 4.086 6.814 1.00 0.00 N ATOM 0 H ASN S 491 -3.650 1.021 7.517 1.00 0.00 H new ATOM 0 HA ASN S 491 -3.813 2.037 10.134 1.00 0.00 H new ATOM 0 HB2 ASN S 491 -3.040 4.199 10.059 1.00 0.00 H new ATOM 0 HB3 ASN S 491 -1.853 3.424 9.029 1.00 0.00 H new ATOM 0 HD21 ASN S 491 -3.807 4.675 6.019 1.00 0.00 H new ATOM 0 HD22 ASN S 491 -3.539 3.071 6.711 1.00 0.00 H new ATOM 587 N GLU S 492 -5.831 1.641 8.097 1.00 0.00 N ATOM 588 CA GLU S 492 -7.204 1.770 7.605 1.00 0.00 C ATOM 589 C GLU S 492 -7.248 2.508 6.268 1.00 0.00 C ATOM 590 O GLU S 492 -7.753 1.981 5.277 1.00 0.00 O ATOM 591 CB GLU S 492 -8.080 2.495 8.631 1.00 0.00 C ATOM 592 CG GLU S 492 -9.487 1.932 8.735 1.00 0.00 C ATOM 593 CD GLU S 492 -10.459 2.616 7.796 1.00 0.00 C ATOM 594 OE1 GLU S 492 -10.347 3.847 7.616 1.00 0.00 O ATOM 595 OE2 GLU S 492 -11.333 1.921 7.236 1.00 0.00 O ATOM 0 H GLU S 492 -5.435 0.706 7.998 1.00 0.00 H new ATOM 0 HA GLU S 492 -7.595 0.764 7.453 1.00 0.00 H new ATOM 0 HB2 GLU S 492 -7.602 2.439 9.609 1.00 0.00 H new ATOM 0 HB3 GLU S 492 -8.139 3.550 8.365 1.00 0.00 H new ATOM 0 HG2 GLU S 492 -9.465 0.865 8.514 1.00 0.00 H new ATOM 0 HG3 GLU S 492 -9.842 2.038 9.760 1.00 0.00 H new ATOM 602 N GLU S 493 -6.720 3.728 6.247 1.00 0.00 N ATOM 603 CA GLU S 493 -6.703 4.533 5.027 1.00 0.00 C ATOM 604 C GLU S 493 -5.563 4.106 4.103 1.00 0.00 C ATOM 605 O GLU S 493 -5.442 4.596 2.980 1.00 0.00 O ATOM 606 CB GLU S 493 -6.562 6.017 5.373 1.00 0.00 C ATOM 607 CG GLU S 493 -7.784 6.597 6.068 1.00 0.00 C ATOM 608 CD GLU S 493 -7.498 7.928 6.736 1.00 0.00 C ATOM 609 OE1 GLU S 493 -6.452 8.042 7.410 1.00 0.00 O ATOM 610 OE2 GLU S 493 -8.319 8.856 6.586 1.00 0.00 O ATOM 0 H GLU S 493 -6.299 4.181 7.058 1.00 0.00 H new ATOM 0 HA GLU S 493 -7.647 4.373 4.506 1.00 0.00 H new ATOM 0 HB2 GLU S 493 -5.691 6.151 6.015 1.00 0.00 H new ATOM 0 HB3 GLU S 493 -6.373 6.579 4.458 1.00 0.00 H new ATOM 0 HG2 GLU S 493 -8.585 6.725 5.340 1.00 0.00 H new ATOM 0 HG3 GLU S 493 -8.143 5.889 6.815 1.00 0.00 H new ATOM 617 N TRP S 494 -4.741 3.179 4.583 1.00 0.00 N ATOM 618 CA TRP S 494 -3.614 2.662 3.817 1.00 0.00 C ATOM 619 C TRP S 494 -3.272 1.259 4.288 1.00 0.00 C ATOM 620 O TRP S 494 -3.796 0.782 5.294 1.00 0.00 O ATOM 621 CB TRP S 494 -2.372 3.544 3.973 1.00 0.00 C ATOM 622 CG TRP S 494 -2.478 4.906 3.352 1.00 0.00 C ATOM 623 CD1 TRP S 494 -3.245 5.945 3.782 1.00 0.00 C ATOM 624 CD2 TRP S 494 -1.766 5.384 2.202 1.00 0.00 C ATOM 625 NE1 TRP S 494 -3.061 7.038 2.975 1.00 0.00 N ATOM 626 CE2 TRP S 494 -2.161 6.719 1.995 1.00 0.00 C ATOM 627 CE3 TRP S 494 -0.836 4.816 1.326 1.00 0.00 C ATOM 628 CZ2 TRP S 494 -1.659 7.494 0.953 1.00 0.00 C ATOM 629 CZ3 TRP S 494 -0.339 5.587 0.292 1.00 0.00 C ATOM 630 CH2 TRP S 494 -0.751 6.914 0.113 1.00 0.00 C ATOM 0 H TRP S 494 -4.837 2.766 5.511 1.00 0.00 H new ATOM 0 HA TRP S 494 -3.908 2.654 2.768 1.00 0.00 H new ATOM 0 HB2 TRP S 494 -2.160 3.661 5.036 1.00 0.00 H new ATOM 0 HB3 TRP S 494 -1.520 3.026 3.533 1.00 0.00 H new ATOM 0 HD1 TRP S 494 -3.904 5.913 4.637 1.00 0.00 H new ATOM 0 HE1 TRP S 494 -3.520 7.942 3.087 1.00 0.00 H new ATOM 0 HE3 TRP S 494 -0.512 3.794 1.455 1.00 0.00 H new ATOM 0 HZ2 TRP S 494 -1.976 8.517 0.814 1.00 0.00 H new ATOM 0 HZ3 TRP S 494 0.380 5.159 -0.390 1.00 0.00 H new ATOM 0 HH2 TRP S 494 -0.343 7.490 -0.705 1.00 0.00 H new ATOM 641 N LEU S 495 -2.390 0.604 3.553 1.00 0.00 N ATOM 642 CA LEU S 495 -1.969 -0.740 3.883 1.00 0.00 C ATOM 643 C LEU S 495 -0.650 -1.083 3.207 1.00 0.00 C ATOM 644 O LEU S 495 -0.125 -0.292 2.421 1.00 0.00 O ATOM 645 CB LEU S 495 -3.064 -1.733 3.511 1.00 0.00 C ATOM 646 CG LEU S 495 -3.978 -1.303 2.364 1.00 0.00 C ATOM 647 CD1 LEU S 495 -3.690 -2.103 1.105 1.00 0.00 C ATOM 648 CD2 LEU S 495 -5.434 -1.451 2.776 1.00 0.00 C ATOM 0 H LEU S 495 -1.950 0.988 2.717 1.00 0.00 H new ATOM 0 HA LEU S 495 -1.802 -0.801 4.958 1.00 0.00 H new ATOM 0 HB2 LEU S 495 -2.596 -2.681 3.244 1.00 0.00 H new ATOM 0 HB3 LEU S 495 -3.678 -1.918 4.392 1.00 0.00 H new ATOM 0 HG LEU S 495 -3.781 -0.254 2.141 1.00 0.00 H new ATOM 0 HD11 LEU S 495 -4.355 -1.776 0.306 1.00 0.00 H new ATOM 0 HD12 LEU S 495 -2.655 -1.946 0.803 1.00 0.00 H new ATOM 0 HD13 LEU S 495 -3.853 -3.163 1.302 1.00 0.00 H new ATOM 0 HD21 LEU S 495 -6.078 -1.142 1.953 1.00 0.00 H new ATOM 0 HD22 LEU S 495 -5.638 -2.492 3.025 1.00 0.00 H new ATOM 0 HD23 LEU S 495 -5.632 -0.824 3.646 1.00 0.00 H new ATOM 660 N GLU S 496 -0.112 -2.255 3.518 1.00 0.00 N ATOM 661 CA GLU S 496 1.153 -2.673 2.936 1.00 0.00 C ATOM 662 C GLU S 496 0.943 -3.185 1.525 1.00 0.00 C ATOM 663 O GLU S 496 -0.031 -3.886 1.245 1.00 0.00 O ATOM 664 CB GLU S 496 1.831 -3.734 3.800 1.00 0.00 C ATOM 665 CG GLU S 496 3.349 -3.691 3.719 1.00 0.00 C ATOM 666 CD GLU S 496 3.912 -4.606 2.651 1.00 0.00 C ATOM 667 OE1 GLU S 496 3.300 -4.704 1.566 1.00 0.00 O ATOM 668 OE2 GLU S 496 4.972 -5.220 2.895 1.00 0.00 O ATOM 0 H GLU S 496 -0.528 -2.926 4.164 1.00 0.00 H new ATOM 0 HA GLU S 496 1.811 -1.805 2.895 1.00 0.00 H new ATOM 0 HB2 GLU S 496 1.525 -3.599 4.837 1.00 0.00 H new ATOM 0 HB3 GLU S 496 1.485 -4.720 3.491 1.00 0.00 H new ATOM 0 HG2 GLU S 496 3.668 -2.668 3.518 1.00 0.00 H new ATOM 0 HG3 GLU S 496 3.767 -3.971 4.686 1.00 0.00 H new ATOM 675 N GLY S 497 1.843 -2.801 0.631 1.00 0.00 N ATOM 676 CA GLY S 497 1.715 -3.201 -0.750 1.00 0.00 C ATOM 677 C GLY S 497 2.983 -3.787 -1.346 1.00 0.00 C ATOM 678 O GLY S 497 3.984 -3.090 -1.491 1.00 0.00 O ATOM 0 H GLY S 497 2.656 -2.221 0.839 1.00 0.00 H new ATOM 0 HA2 GLY S 497 0.915 -3.936 -0.831 1.00 0.00 H new ATOM 0 HA3 GLY S 497 1.414 -2.336 -1.341 1.00 0.00 H new ATOM 682 N GLU S 498 2.929 -5.062 -1.720 1.00 0.00 N ATOM 683 CA GLU S 498 4.072 -5.732 -2.334 1.00 0.00 C ATOM 684 C GLU S 498 3.675 -6.281 -3.702 1.00 0.00 C ATOM 685 O GLU S 498 3.042 -7.334 -3.796 1.00 0.00 O ATOM 686 CB GLU S 498 4.577 -6.863 -1.434 1.00 0.00 C ATOM 687 CG GLU S 498 5.728 -7.651 -2.036 1.00 0.00 C ATOM 688 CD GLU S 498 6.202 -8.774 -1.132 1.00 0.00 C ATOM 689 OE1 GLU S 498 5.567 -9.848 -1.139 1.00 0.00 O ATOM 690 OE2 GLU S 498 7.207 -8.575 -0.415 1.00 0.00 O ATOM 0 H GLU S 498 2.105 -5.653 -1.609 1.00 0.00 H new ATOM 0 HA GLU S 498 4.878 -5.009 -2.461 1.00 0.00 H new ATOM 0 HB2 GLU S 498 4.895 -6.442 -0.480 1.00 0.00 H new ATOM 0 HB3 GLU S 498 3.752 -7.544 -1.223 1.00 0.00 H new ATOM 0 HG2 GLU S 498 5.417 -8.068 -2.994 1.00 0.00 H new ATOM 0 HG3 GLU S 498 6.560 -6.976 -2.237 1.00 0.00 H new ATOM 697 N SER S 499 4.028 -5.554 -4.760 1.00 0.00 N ATOM 698 CA SER S 499 3.682 -5.967 -6.116 1.00 0.00 C ATOM 699 C SER S 499 4.889 -5.916 -7.048 1.00 0.00 C ATOM 700 O SER S 499 5.427 -4.843 -7.330 1.00 0.00 O ATOM 701 CB SER S 499 2.570 -5.074 -6.668 1.00 0.00 C ATOM 702 OG SER S 499 1.758 -5.780 -7.590 1.00 0.00 O ATOM 0 H SER S 499 4.551 -4.680 -4.704 1.00 0.00 H new ATOM 0 HA SER S 499 3.337 -7.000 -6.067 1.00 0.00 H new ATOM 0 HB2 SER S 499 1.956 -4.704 -5.847 1.00 0.00 H new ATOM 0 HB3 SER S 499 3.008 -4.203 -7.157 1.00 0.00 H new ATOM 0 HG SER S 499 1.054 -5.187 -7.927 1.00 0.00 H new ATOM 708 N LYS S 500 5.293 -7.081 -7.537 1.00 0.00 N ATOM 709 CA LYS S 500 6.422 -7.190 -8.461 1.00 0.00 C ATOM 710 C LYS S 500 7.754 -6.922 -7.767 1.00 0.00 C ATOM 711 O LYS S 500 8.332 -5.844 -7.910 1.00 0.00 O ATOM 712 CB LYS S 500 6.246 -6.221 -9.635 1.00 0.00 C ATOM 713 CG LYS S 500 4.831 -6.193 -10.194 1.00 0.00 C ATOM 714 CD LYS S 500 4.794 -6.645 -11.646 1.00 0.00 C ATOM 715 CE LYS S 500 4.308 -8.081 -11.770 1.00 0.00 C ATOM 716 NZ LYS S 500 2.894 -8.152 -12.227 1.00 0.00 N ATOM 0 H LYS S 500 4.853 -7.973 -7.309 1.00 0.00 H new ATOM 0 HA LYS S 500 6.438 -8.214 -8.833 1.00 0.00 H new ATOM 0 HB2 LYS S 500 6.520 -5.217 -9.311 1.00 0.00 H new ATOM 0 HB3 LYS S 500 6.937 -6.498 -10.431 1.00 0.00 H new ATOM 0 HG2 LYS S 500 4.189 -6.839 -9.595 1.00 0.00 H new ATOM 0 HG3 LYS S 500 4.428 -5.183 -10.116 1.00 0.00 H new ATOM 0 HD2 LYS S 500 4.138 -5.987 -12.216 1.00 0.00 H new ATOM 0 HD3 LYS S 500 5.790 -6.558 -12.081 1.00 0.00 H new ATOM 0 HE2 LYS S 500 4.944 -8.620 -12.473 1.00 0.00 H new ATOM 0 HE3 LYS S 500 4.403 -8.581 -10.806 1.00 0.00 H new ATOM 0 HZ1 LYS S 500 2.602 -9.148 -12.298 1.00 0.00 H new ATOM 0 HZ2 LYS S 500 2.283 -7.660 -11.544 1.00 0.00 H new ATOM 0 HZ3 LYS S 500 2.807 -7.698 -13.159 1.00 0.00 H new ATOM 730 N GLY S 501 8.242 -7.920 -7.030 1.00 0.00 N ATOM 731 CA GLY S 501 9.516 -7.797 -6.329 1.00 0.00 C ATOM 732 C GLY S 501 9.775 -6.404 -5.785 1.00 0.00 C ATOM 733 O GLY S 501 10.900 -5.908 -5.847 1.00 0.00 O ATOM 0 H GLY S 501 7.775 -8.818 -6.904 1.00 0.00 H new ATOM 0 HA2 GLY S 501 9.539 -8.510 -5.505 1.00 0.00 H new ATOM 0 HA3 GLY S 501 10.324 -8.069 -7.009 1.00 0.00 H new ATOM 737 N LYS S 502 8.736 -5.777 -5.251 1.00 0.00 N ATOM 738 CA LYS S 502 8.857 -4.437 -4.691 1.00 0.00 C ATOM 739 C LYS S 502 7.868 -4.250 -3.554 1.00 0.00 C ATOM 740 O LYS S 502 6.673 -4.505 -3.709 1.00 0.00 O ATOM 741 CB LYS S 502 8.626 -3.380 -5.771 1.00 0.00 C ATOM 742 CG LYS S 502 9.900 -2.958 -6.484 1.00 0.00 C ATOM 743 CD LYS S 502 9.597 -2.264 -7.802 1.00 0.00 C ATOM 744 CE LYS S 502 9.752 -3.213 -8.980 1.00 0.00 C ATOM 745 NZ LYS S 502 9.705 -2.493 -10.282 1.00 0.00 N ATOM 0 H LYS S 502 7.799 -6.175 -5.193 1.00 0.00 H new ATOM 0 HA LYS S 502 9.868 -4.317 -4.301 1.00 0.00 H new ATOM 0 HB2 LYS S 502 7.920 -3.769 -6.504 1.00 0.00 H new ATOM 0 HB3 LYS S 502 8.164 -2.503 -5.318 1.00 0.00 H new ATOM 0 HG2 LYS S 502 10.473 -2.288 -5.842 1.00 0.00 H new ATOM 0 HG3 LYS S 502 10.523 -3.834 -6.667 1.00 0.00 H new ATOM 0 HD2 LYS S 502 8.581 -1.870 -7.782 1.00 0.00 H new ATOM 0 HD3 LYS S 502 10.266 -1.413 -7.929 1.00 0.00 H new ATOM 0 HE2 LYS S 502 10.698 -3.747 -8.894 1.00 0.00 H new ATOM 0 HE3 LYS S 502 8.960 -3.961 -8.950 1.00 0.00 H new ATOM 0 HZ1 LYS S 502 9.814 -3.175 -11.060 1.00 0.00 H new ATOM 0 HZ2 LYS S 502 8.792 -2.004 -10.376 1.00 0.00 H new ATOM 0 HZ3 LYS S 502 10.476 -1.796 -10.321 1.00 0.00 H new ATOM 759 N VAL S 503 8.370 -3.812 -2.410 1.00 0.00 N ATOM 760 CA VAL S 503 7.521 -3.605 -1.247 1.00 0.00 C ATOM 761 C VAL S 503 7.292 -2.122 -0.976 1.00 0.00 C ATOM 762 O VAL S 503 8.233 -1.339 -0.860 1.00 0.00 O ATOM 763 CB VAL S 503 8.106 -4.270 0.011 1.00 0.00 C ATOM 764 CG1 VAL S 503 7.052 -4.366 1.104 1.00 0.00 C ATOM 765 CG2 VAL S 503 8.659 -5.647 -0.324 1.00 0.00 C ATOM 0 H VAL S 503 9.355 -3.594 -2.262 1.00 0.00 H new ATOM 0 HA VAL S 503 6.564 -4.073 -1.477 1.00 0.00 H new ATOM 0 HB VAL S 503 8.924 -3.652 0.380 1.00 0.00 H new ATOM 0 HG11 VAL S 503 7.484 -4.839 1.986 1.00 0.00 H new ATOM 0 HG12 VAL S 503 6.704 -3.366 1.363 1.00 0.00 H new ATOM 0 HG13 VAL S 503 6.212 -4.962 0.748 1.00 0.00 H new ATOM 0 HG21 VAL S 503 9.069 -6.103 0.577 1.00 0.00 H new ATOM 0 HG22 VAL S 503 7.859 -6.275 -0.717 1.00 0.00 H new ATOM 0 HG23 VAL S 503 9.446 -5.551 -1.072 1.00 0.00 H new ATOM 775 N GLY S 504 6.022 -1.765 -0.867 1.00 0.00 N ATOM 776 CA GLY S 504 5.630 -0.398 -0.599 1.00 0.00 C ATOM 777 C GLY S 504 4.279 -0.358 0.079 1.00 0.00 C ATOM 778 O GLY S 504 3.920 -1.298 0.783 1.00 0.00 O ATOM 0 H GLY S 504 5.241 -2.414 -0.962 1.00 0.00 H new ATOM 0 HA2 GLY S 504 6.376 0.083 0.034 1.00 0.00 H new ATOM 0 HA3 GLY S 504 5.592 0.165 -1.531 1.00 0.00 H new ATOM 782 N ILE S 505 3.519 0.709 -0.137 1.00 0.00 N ATOM 783 CA ILE S 505 2.198 0.822 0.471 1.00 0.00 C ATOM 784 C ILE S 505 1.259 1.662 -0.377 1.00 0.00 C ATOM 785 O ILE S 505 1.690 2.404 -1.255 1.00 0.00 O ATOM 786 CB ILE S 505 2.269 1.417 1.886 1.00 0.00 C ATOM 787 CG1 ILE S 505 3.266 2.576 1.939 1.00 0.00 C ATOM 788 CG2 ILE S 505 2.646 0.331 2.876 1.00 0.00 C ATOM 789 CD1 ILE S 505 2.875 3.664 2.916 1.00 0.00 C ATOM 0 H ILE S 505 3.790 1.500 -0.721 1.00 0.00 H new ATOM 0 HA ILE S 505 1.806 -0.193 0.535 1.00 0.00 H new ATOM 0 HB ILE S 505 1.290 1.813 2.154 1.00 0.00 H new ATOM 0 HG12 ILE S 505 4.247 2.188 2.213 1.00 0.00 H new ATOM 0 HG13 ILE S 505 3.361 3.009 0.943 1.00 0.00 H new ATOM 0 HG21 ILE S 505 2.696 0.755 3.879 1.00 0.00 H new ATOM 0 HG22 ILE S 505 1.895 -0.459 2.853 1.00 0.00 H new ATOM 0 HG23 ILE S 505 3.618 -0.084 2.608 1.00 0.00 H new ATOM 0 HD11 ILE S 505 3.627 4.453 2.901 1.00 0.00 H new ATOM 0 HD12 ILE S 505 1.908 4.078 2.631 1.00 0.00 H new ATOM 0 HD13 ILE S 505 2.809 3.245 3.920 1.00 0.00 H new ATOM 801 N PHE S 506 -0.034 1.539 -0.112 1.00 0.00 N ATOM 802 CA PHE S 506 -1.027 2.291 -0.868 1.00 0.00 C ATOM 803 C PHE S 506 -2.297 2.514 -0.055 1.00 0.00 C ATOM 804 O PHE S 506 -2.569 1.794 0.904 1.00 0.00 O ATOM 805 CB PHE S 506 -1.356 1.565 -2.173 1.00 0.00 C ATOM 806 CG PHE S 506 -1.815 0.147 -1.987 1.00 0.00 C ATOM 807 CD1 PHE S 506 -0.963 -0.807 -1.453 1.00 0.00 C ATOM 808 CD2 PHE S 506 -3.095 -0.234 -2.353 1.00 0.00 C ATOM 809 CE1 PHE S 506 -1.382 -2.114 -1.289 1.00 0.00 C ATOM 810 CE2 PHE S 506 -3.519 -1.538 -2.191 1.00 0.00 C ATOM 811 CZ PHE S 506 -2.660 -2.480 -1.659 1.00 0.00 C ATOM 0 H PHE S 506 -0.418 0.933 0.613 1.00 0.00 H new ATOM 0 HA PHE S 506 -0.603 3.268 -1.098 1.00 0.00 H new ATOM 0 HB2 PHE S 506 -2.132 2.121 -2.700 1.00 0.00 H new ATOM 0 HB3 PHE S 506 -0.472 1.569 -2.811 1.00 0.00 H new ATOM 0 HD1 PHE S 506 0.038 -0.526 -1.162 1.00 0.00 H new ATOM 0 HD2 PHE S 506 -3.770 0.498 -2.771 1.00 0.00 H new ATOM 0 HE1 PHE S 506 -0.709 -2.849 -0.871 1.00 0.00 H new ATOM 0 HE2 PHE S 506 -4.520 -1.821 -2.480 1.00 0.00 H new ATOM 0 HZ PHE S 506 -2.988 -3.501 -1.533 1.00 0.00 H new ATOM 821 N PRO S 507 -3.093 3.528 -0.439 1.00 0.00 N ATOM 822 CA PRO S 507 -4.338 3.858 0.247 1.00 0.00 C ATOM 823 C PRO S 507 -5.503 2.997 -0.234 1.00 0.00 C ATOM 824 O PRO S 507 -5.776 2.911 -1.431 1.00 0.00 O ATOM 825 CB PRO S 507 -4.545 5.319 -0.131 1.00 0.00 C ATOM 826 CG PRO S 507 -3.964 5.434 -1.499 1.00 0.00 C ATOM 827 CD PRO S 507 -2.837 4.434 -1.576 1.00 0.00 C ATOM 0 HA PRO S 507 -4.290 3.682 1.322 1.00 0.00 H new ATOM 0 HB2 PRO S 507 -5.602 5.585 -0.125 1.00 0.00 H new ATOM 0 HB3 PRO S 507 -4.044 5.986 0.571 1.00 0.00 H new ATOM 0 HG2 PRO S 507 -4.718 5.227 -2.258 1.00 0.00 H new ATOM 0 HG3 PRO S 507 -3.598 6.445 -1.680 1.00 0.00 H new ATOM 0 HD2 PRO S 507 -2.842 3.897 -2.525 1.00 0.00 H new ATOM 0 HD3 PRO S 507 -1.865 4.919 -1.490 1.00 0.00 H new ATOM 835 N LYS S 508 -6.174 2.350 0.711 1.00 0.00 N ATOM 836 CA LYS S 508 -7.299 1.476 0.405 1.00 0.00 C ATOM 837 C LYS S 508 -8.345 2.167 -0.471 1.00 0.00 C ATOM 838 O LYS S 508 -9.101 1.503 -1.180 1.00 0.00 O ATOM 839 CB LYS S 508 -7.941 0.998 1.707 1.00 0.00 C ATOM 840 CG LYS S 508 -8.571 -0.378 1.601 1.00 0.00 C ATOM 841 CD LYS S 508 -10.070 -0.332 1.853 1.00 0.00 C ATOM 842 CE LYS S 508 -10.401 -0.645 3.303 1.00 0.00 C ATOM 843 NZ LYS S 508 -11.846 -0.440 3.599 1.00 0.00 N ATOM 0 H LYS S 508 -5.955 2.416 1.705 1.00 0.00 H new ATOM 0 HA LYS S 508 -6.917 0.625 -0.158 1.00 0.00 H new ATOM 0 HB2 LYS S 508 -7.185 0.983 2.492 1.00 0.00 H new ATOM 0 HB3 LYS S 508 -8.703 1.715 2.012 1.00 0.00 H new ATOM 0 HG2 LYS S 508 -8.381 -0.790 0.610 1.00 0.00 H new ATOM 0 HG3 LYS S 508 -8.102 -1.049 2.320 1.00 0.00 H new ATOM 0 HD2 LYS S 508 -10.453 0.656 1.596 1.00 0.00 H new ATOM 0 HD3 LYS S 508 -10.572 -1.048 1.202 1.00 0.00 H new ATOM 0 HE2 LYS S 508 -10.128 -1.677 3.523 1.00 0.00 H new ATOM 0 HE3 LYS S 508 -9.803 -0.011 3.957 1.00 0.00 H new ATOM 0 HZ1 LYS S 508 -12.031 -0.664 4.598 1.00 0.00 H new ATOM 0 HZ2 LYS S 508 -12.101 0.551 3.413 1.00 0.00 H new ATOM 0 HZ3 LYS S 508 -12.416 -1.064 2.993 1.00 0.00 H new ATOM 857 N VAL S 509 -8.392 3.496 -0.423 1.00 0.00 N ATOM 858 CA VAL S 509 -9.358 4.246 -1.222 1.00 0.00 C ATOM 859 C VAL S 509 -9.216 3.916 -2.708 1.00 0.00 C ATOM 860 O VAL S 509 -10.182 4.002 -3.466 1.00 0.00 O ATOM 861 CB VAL S 509 -9.215 5.771 -1.007 1.00 0.00 C ATOM 862 CG1 VAL S 509 -7.757 6.191 -1.079 1.00 0.00 C ATOM 863 CG2 VAL S 509 -10.052 6.545 -2.017 1.00 0.00 C ATOM 0 H VAL S 509 -7.779 4.071 0.155 1.00 0.00 H new ATOM 0 HA VAL S 509 -10.351 3.945 -0.887 1.00 0.00 H new ATOM 0 HB VAL S 509 -9.588 6.007 -0.010 1.00 0.00 H new ATOM 0 HG11 VAL S 509 -7.680 7.267 -0.925 1.00 0.00 H new ATOM 0 HG12 VAL S 509 -7.190 5.673 -0.306 1.00 0.00 H new ATOM 0 HG13 VAL S 509 -7.353 5.935 -2.058 1.00 0.00 H new ATOM 0 HG21 VAL S 509 -9.934 7.615 -1.844 1.00 0.00 H new ATOM 0 HG22 VAL S 509 -9.721 6.302 -3.027 1.00 0.00 H new ATOM 0 HG23 VAL S 509 -11.102 6.273 -1.904 1.00 0.00 H new ATOM 873 N PHE S 510 -8.010 3.528 -3.117 1.00 0.00 N ATOM 874 CA PHE S 510 -7.754 3.174 -4.511 1.00 0.00 C ATOM 875 C PHE S 510 -7.954 1.683 -4.742 1.00 0.00 C ATOM 876 O PHE S 510 -7.564 1.155 -5.783 1.00 0.00 O ATOM 877 CB PHE S 510 -6.324 3.541 -4.907 1.00 0.00 C ATOM 878 CG PHE S 510 -6.096 5.011 -5.038 1.00 0.00 C ATOM 879 CD1 PHE S 510 -6.233 5.839 -3.944 1.00 0.00 C ATOM 880 CD2 PHE S 510 -5.746 5.565 -6.256 1.00 0.00 C ATOM 881 CE1 PHE S 510 -6.031 7.195 -4.056 1.00 0.00 C ATOM 882 CE2 PHE S 510 -5.539 6.923 -6.379 1.00 0.00 C ATOM 883 CZ PHE S 510 -5.685 7.741 -5.274 1.00 0.00 C ATOM 0 H PHE S 510 -7.197 3.451 -2.505 1.00 0.00 H new ATOM 0 HA PHE S 510 -8.462 3.734 -5.123 1.00 0.00 H new ATOM 0 HB2 PHE S 510 -5.636 3.141 -4.162 1.00 0.00 H new ATOM 0 HB3 PHE S 510 -6.084 3.059 -5.855 1.00 0.00 H new ATOM 0 HD1 PHE S 510 -6.502 5.417 -2.987 1.00 0.00 H new ATOM 0 HD2 PHE S 510 -5.634 4.927 -7.120 1.00 0.00 H new ATOM 0 HE1 PHE S 510 -6.143 7.831 -3.191 1.00 0.00 H new ATOM 0 HE2 PHE S 510 -5.264 7.346 -7.334 1.00 0.00 H new ATOM 0 HZ PHE S 510 -5.528 8.806 -5.365 1.00 0.00 H new ATOM 893 N VAL S 511 -8.544 1.002 -3.767 1.00 0.00 N ATOM 894 CA VAL S 511 -8.760 -0.429 -3.877 1.00 0.00 C ATOM 895 C VAL S 511 -9.925 -0.887 -2.998 1.00 0.00 C ATOM 896 O VAL S 511 -9.730 -1.419 -1.906 1.00 0.00 O ATOM 897 CB VAL S 511 -7.490 -1.203 -3.476 1.00 0.00 C ATOM 898 CG1 VAL S 511 -6.283 -0.713 -4.259 1.00 0.00 C ATOM 899 CG2 VAL S 511 -7.240 -1.061 -1.989 1.00 0.00 C ATOM 0 H VAL S 511 -8.878 1.418 -2.898 1.00 0.00 H new ATOM 0 HA VAL S 511 -9.002 -0.640 -4.919 1.00 0.00 H new ATOM 0 HB VAL S 511 -7.644 -2.256 -3.712 1.00 0.00 H new ATOM 0 HG11 VAL S 511 -5.400 -1.276 -3.957 1.00 0.00 H new ATOM 0 HG12 VAL S 511 -6.458 -0.857 -5.325 1.00 0.00 H new ATOM 0 HG13 VAL S 511 -6.124 0.346 -4.058 1.00 0.00 H new ATOM 0 HG21 VAL S 511 -6.340 -1.612 -1.717 1.00 0.00 H new ATOM 0 HG22 VAL S 511 -7.109 -0.008 -1.741 1.00 0.00 H new ATOM 0 HG23 VAL S 511 -8.091 -1.461 -1.437 1.00 0.00 H new ATOM 909 N GLU S 512 -11.138 -0.691 -3.484 1.00 0.00 N ATOM 910 CA GLU S 512 -12.332 -1.099 -2.749 1.00 0.00 C ATOM 911 C GLU S 512 -12.376 -2.613 -2.557 1.00 0.00 C ATOM 912 O GLU S 512 -13.306 -3.152 -1.959 1.00 0.00 O ATOM 913 CB GLU S 512 -13.597 -0.618 -3.465 1.00 0.00 C ATOM 914 CG GLU S 512 -13.820 -1.277 -4.817 1.00 0.00 C ATOM 915 CD GLU S 512 -14.969 -0.655 -5.586 1.00 0.00 C ATOM 916 OE1 GLU S 512 -15.903 -0.135 -4.939 1.00 0.00 O ATOM 917 OE2 GLU S 512 -14.937 -0.690 -6.833 1.00 0.00 O ATOM 0 H GLU S 512 -11.327 -0.252 -4.385 1.00 0.00 H new ATOM 0 HA GLU S 512 -12.288 -0.635 -1.764 1.00 0.00 H new ATOM 0 HB2 GLU S 512 -14.460 -0.812 -2.829 1.00 0.00 H new ATOM 0 HB3 GLU S 512 -13.538 0.462 -3.602 1.00 0.00 H new ATOM 0 HG2 GLU S 512 -12.908 -1.201 -5.409 1.00 0.00 H new ATOM 0 HG3 GLU S 512 -14.018 -2.339 -4.671 1.00 0.00 H new ATOM 924 N ASP S 513 -11.348 -3.280 -3.054 1.00 0.00 N ATOM 925 CA ASP S 513 -11.214 -4.724 -2.941 1.00 0.00 C ATOM 926 C ASP S 513 -12.286 -5.466 -3.732 1.00 0.00 C ATOM 927 O ASP S 513 -13.332 -4.908 -4.064 1.00 0.00 O ATOM 928 CB ASP S 513 -11.262 -5.147 -1.469 1.00 0.00 C ATOM 929 CG ASP S 513 -11.057 -6.638 -1.281 1.00 0.00 C ATOM 930 OD1 ASP S 513 -10.352 -7.250 -2.111 1.00 0.00 O ATOM 931 OD2 ASP S 513 -11.600 -7.194 -0.305 1.00 0.00 O ATOM 0 H ASP S 513 -10.578 -2.833 -3.551 1.00 0.00 H new ATOM 0 HA ASP S 513 -10.247 -4.993 -3.367 1.00 0.00 H new ATOM 0 HB2 ASP S 513 -10.495 -4.606 -0.915 1.00 0.00 H new ATOM 0 HB3 ASP S 513 -12.224 -4.860 -1.044 1.00 0.00 H new ATOM 936 N SER S 514 -12.007 -6.734 -4.023 1.00 0.00 N ATOM 937 CA SER S 514 -12.931 -7.577 -4.769 1.00 0.00 C ATOM 938 C SER S 514 -13.031 -8.964 -4.133 1.00 0.00 C ATOM 939 O SER S 514 -14.122 -9.526 -4.025 1.00 0.00 O ATOM 940 CB SER S 514 -12.478 -7.700 -6.226 1.00 0.00 C ATOM 941 OG SER S 514 -13.485 -7.241 -7.112 1.00 0.00 O ATOM 0 H SER S 514 -11.142 -7.201 -3.750 1.00 0.00 H new ATOM 0 HA SER S 514 -13.916 -7.112 -4.742 1.00 0.00 H new ATOM 0 HB2 SER S 514 -11.566 -7.123 -6.377 1.00 0.00 H new ATOM 0 HB3 SER S 514 -12.238 -8.740 -6.449 1.00 0.00 H new ATOM 0 HG SER S 514 -13.110 -7.144 -8.012 1.00 0.00 H new ATOM 947 N ALA S 515 -11.891 -9.511 -3.714 1.00 0.00 N ATOM 948 CA ALA S 515 -11.863 -10.829 -3.093 1.00 0.00 C ATOM 949 C ALA S 515 -10.571 -11.040 -2.310 1.00 0.00 C ATOM 950 O ALA S 515 -9.501 -11.208 -2.893 1.00 0.00 O ATOM 951 CB ALA S 515 -12.027 -11.914 -4.147 1.00 0.00 C ATOM 0 H ALA S 515 -10.979 -9.062 -3.794 1.00 0.00 H new ATOM 0 HA ALA S 515 -12.696 -10.890 -2.393 1.00 0.00 H new ATOM 0 HB1 ALA S 515 -12.004 -12.893 -3.668 1.00 0.00 H new ATOM 0 HB2 ALA S 515 -12.980 -11.783 -4.659 1.00 0.00 H new ATOM 0 HB3 ALA S 515 -11.214 -11.845 -4.870 1.00 0.00 H new ATOM 957 N THR S 516 -10.679 -11.032 -0.985 1.00 0.00 N ATOM 958 CA THR S 516 -9.517 -11.223 -0.123 1.00 0.00 C ATOM 959 C THR S 516 -9.311 -12.701 0.193 1.00 0.00 C ATOM 960 O THR S 516 -8.487 -13.006 1.080 1.00 0.00 O ATOM 961 CB THR S 516 -9.684 -10.431 1.174 1.00 0.00 C ATOM 962 OG1 THR S 516 -10.864 -10.820 1.852 1.00 0.00 O ATOM 963 CG2 THR S 516 -9.751 -8.934 0.958 1.00 0.00 C ATOM 964 OXT THR S 516 -9.978 -13.541 -0.449 1.00 0.00 O ATOM 0 H THR S 516 -11.558 -10.896 -0.485 1.00 0.00 H new ATOM 0 HA THR S 516 -8.638 -10.858 -0.654 1.00 0.00 H new ATOM 0 HB THR S 516 -8.797 -10.657 1.765 1.00 0.00 H new ATOM 0 HG1 THR S 516 -10.951 -10.303 2.680 1.00 0.00 H new ATOM 0 HG21 THR S 516 -9.870 -8.433 1.919 1.00 0.00 H new ATOM 0 HG22 THR S 516 -8.831 -8.594 0.482 1.00 0.00 H new ATOM 0 HG23 THR S 516 -10.600 -8.696 0.317 1.00 0.00 H new TER 972 THR S 516 ATOM 973 N SER P 359 -13.199 6.643 -18.128 1.00 0.00 N ATOM 974 CA SER P 359 -12.494 7.805 -17.524 1.00 0.00 C ATOM 975 C SER P 359 -13.015 8.096 -16.120 1.00 0.00 C ATOM 976 O SER P 359 -14.218 8.271 -15.918 1.00 0.00 O ATOM 977 CB SER P 359 -12.698 9.023 -18.427 1.00 0.00 C ATOM 978 OG SER P 359 -12.916 8.632 -19.772 1.00 0.00 O ATOM 0 HA SER P 359 -11.432 7.575 -17.439 1.00 0.00 H new ATOM 0 HB2 SER P 359 -13.549 9.604 -18.072 1.00 0.00 H new ATOM 0 HB3 SER P 359 -11.824 9.671 -18.371 1.00 0.00 H new ATOM 0 HG SER P 359 -13.115 7.673 -19.806 1.00 0.00 H new ATOM 986 N LYS P 360 -12.105 8.147 -15.154 1.00 0.00 N ATOM 987 CA LYS P 360 -12.474 8.418 -13.771 1.00 0.00 C ATOM 988 C LYS P 360 -11.404 9.249 -13.069 1.00 0.00 C ATOM 989 O LYS P 360 -10.209 8.993 -13.213 1.00 0.00 O ATOM 990 CB LYS P 360 -12.692 7.107 -13.008 1.00 0.00 C ATOM 991 CG LYS P 360 -14.122 6.599 -13.060 1.00 0.00 C ATOM 992 CD LYS P 360 -14.506 5.894 -11.769 1.00 0.00 C ATOM 993 CE LYS P 360 -15.840 5.176 -11.900 1.00 0.00 C ATOM 994 NZ LYS P 360 -15.858 3.894 -11.142 1.00 0.00 N ATOM 0 H LYS P 360 -11.106 8.004 -15.304 1.00 0.00 H new ATOM 0 HA LYS P 360 -13.404 8.987 -13.781 1.00 0.00 H new ATOM 0 HB2 LYS P 360 -12.030 6.344 -13.418 1.00 0.00 H new ATOM 0 HB3 LYS P 360 -12.405 7.251 -11.966 1.00 0.00 H new ATOM 0 HG2 LYS P 360 -14.800 7.434 -13.236 1.00 0.00 H new ATOM 0 HG3 LYS P 360 -14.236 5.913 -13.899 1.00 0.00 H new ATOM 0 HD2 LYS P 360 -13.731 5.176 -11.501 1.00 0.00 H new ATOM 0 HD3 LYS P 360 -14.561 6.621 -10.959 1.00 0.00 H new ATOM 0 HE2 LYS P 360 -16.638 5.824 -11.537 1.00 0.00 H new ATOM 0 HE3 LYS P 360 -16.044 4.978 -12.952 1.00 0.00 H new ATOM 0 HZ1 LYS P 360 -16.784 3.436 -11.257 1.00 0.00 H new ATOM 0 HZ2 LYS P 360 -15.113 3.265 -11.505 1.00 0.00 H new ATOM 0 HZ3 LYS P 360 -15.689 4.084 -10.134 1.00 0.00 H new ATOM 1008 N PRO P 361 -11.828 10.262 -12.296 1.00 0.00 N ATOM 1009 CA PRO P 361 -10.925 11.144 -11.562 1.00 0.00 C ATOM 1010 C PRO P 361 -10.491 10.528 -10.238 1.00 0.00 C ATOM 1011 O PRO P 361 -11.227 10.575 -9.251 1.00 0.00 O ATOM 1012 CB PRO P 361 -11.779 12.404 -11.321 1.00 0.00 C ATOM 1013 CG PRO P 361 -13.108 12.128 -11.963 1.00 0.00 C ATOM 1014 CD PRO P 361 -13.219 10.643 -12.066 1.00 0.00 C ATOM 0 HA PRO P 361 -10.001 11.342 -12.106 1.00 0.00 H new ATOM 0 HB2 PRO P 361 -11.893 12.601 -10.255 1.00 0.00 H new ATOM 0 HB3 PRO P 361 -11.309 13.284 -11.759 1.00 0.00 H new ATOM 0 HG2 PRO P 361 -13.922 12.539 -11.366 1.00 0.00 H new ATOM 0 HG3 PRO P 361 -13.169 12.592 -12.947 1.00 0.00 H new ATOM 0 HD2 PRO P 361 -13.621 10.198 -11.156 1.00 0.00 H new ATOM 0 HD3 PRO P 361 -13.869 10.336 -12.885 1.00 0.00 H new ATOM 1022 N GLN P 362 -9.298 9.940 -10.223 1.00 0.00 N ATOM 1023 CA GLN P 362 -8.778 9.302 -9.016 1.00 0.00 C ATOM 1024 C GLN P 362 -8.915 10.206 -7.798 1.00 0.00 C ATOM 1025 O GLN P 362 -8.983 11.430 -7.914 1.00 0.00 O ATOM 1026 CB GLN P 362 -7.304 8.922 -9.189 1.00 0.00 C ATOM 1027 CG GLN P 362 -6.387 10.117 -9.397 1.00 0.00 C ATOM 1028 CD GLN P 362 -6.370 10.596 -10.835 1.00 0.00 C ATOM 1029 OE1 GLN P 362 -7.130 10.110 -11.673 1.00 0.00 O ATOM 1030 NE2 GLN P 362 -5.498 11.555 -11.128 1.00 0.00 N ATOM 0 H GLN P 362 -8.675 9.892 -11.029 1.00 0.00 H new ATOM 0 HA GLN P 362 -9.372 8.402 -8.856 1.00 0.00 H new ATOM 0 HB2 GLN P 362 -6.974 8.370 -8.309 1.00 0.00 H new ATOM 0 HB3 GLN P 362 -7.209 8.249 -10.041 1.00 0.00 H new ATOM 0 HG2 GLN P 362 -6.708 10.933 -8.750 1.00 0.00 H new ATOM 0 HG3 GLN P 362 -5.374 9.850 -9.095 1.00 0.00 H new ATOM 0 HE21 GLN P 362 -4.887 11.928 -10.401 1.00 0.00 H new ATOM 0 HE22 GLN P 362 -5.439 11.918 -12.080 1.00 0.00 H new ATOM 1039 N PRO P 363 -8.944 9.596 -6.610 1.00 0.00 N ATOM 1040 CA PRO P 363 -9.061 10.321 -5.352 1.00 0.00 C ATOM 1041 C PRO P 363 -7.762 11.005 -4.948 1.00 0.00 C ATOM 1042 O PRO P 363 -6.728 10.354 -4.824 1.00 0.00 O ATOM 1043 CB PRO P 363 -9.407 9.239 -4.325 1.00 0.00 C ATOM 1044 CG PRO P 363 -9.129 7.916 -4.965 1.00 0.00 C ATOM 1045 CD PRO P 363 -8.859 8.140 -6.424 1.00 0.00 C ATOM 0 HA PRO P 363 -9.804 11.114 -5.428 1.00 0.00 H new ATOM 0 HB2 PRO P 363 -8.810 9.362 -3.421 1.00 0.00 H new ATOM 0 HB3 PRO P 363 -10.453 9.311 -4.029 1.00 0.00 H new ATOM 0 HG2 PRO P 363 -8.272 7.438 -4.490 1.00 0.00 H new ATOM 0 HG3 PRO P 363 -9.979 7.247 -4.836 1.00 0.00 H new ATOM 0 HD2 PRO P 363 -7.876 7.763 -6.705 1.00 0.00 H new ATOM 0 HD3 PRO P 363 -9.589 7.620 -7.044 1.00 0.00 H new ATOM 1053 N ALA P 364 -7.817 12.312 -4.707 1.00 0.00 N ATOM 1054 CA ALA P 364 -6.628 13.043 -4.283 1.00 0.00 C ATOM 1055 C ALA P 364 -5.994 12.324 -3.097 1.00 0.00 C ATOM 1056 O ALA P 364 -6.470 12.435 -1.968 1.00 0.00 O ATOM 1057 CB ALA P 364 -6.984 14.476 -3.916 1.00 0.00 C ATOM 0 H ALA P 364 -8.660 12.880 -4.796 1.00 0.00 H new ATOM 0 HA ALA P 364 -5.913 13.078 -5.105 1.00 0.00 H new ATOM 0 HB1 ALA P 364 -6.084 15.005 -3.602 1.00 0.00 H new ATOM 0 HB2 ALA P 364 -7.416 14.977 -4.782 1.00 0.00 H new ATOM 0 HB3 ALA P 364 -7.707 14.474 -3.100 1.00 0.00 H new ATOM 1063 N VAL P 365 -4.944 11.555 -3.367 1.00 0.00 N ATOM 1064 CA VAL P 365 -4.287 10.782 -2.315 1.00 0.00 C ATOM 1065 C VAL P 365 -3.971 11.654 -1.099 1.00 0.00 C ATOM 1066 O VAL P 365 -3.518 12.791 -1.234 1.00 0.00 O ATOM 1067 CB VAL P 365 -2.992 10.084 -2.793 1.00 0.00 C ATOM 1068 CG1 VAL P 365 -2.782 8.799 -2.012 1.00 0.00 C ATOM 1069 CG2 VAL P 365 -3.033 9.774 -4.278 1.00 0.00 C ATOM 0 H VAL P 365 -4.532 11.450 -4.294 1.00 0.00 H new ATOM 0 HA VAL P 365 -4.999 10.006 -2.035 1.00 0.00 H new ATOM 0 HB VAL P 365 -2.163 10.769 -2.616 1.00 0.00 H new ATOM 0 HG11 VAL P 365 -1.869 8.311 -2.353 1.00 0.00 H new ATOM 0 HG12 VAL P 365 -2.696 9.029 -0.950 1.00 0.00 H new ATOM 0 HG13 VAL P 365 -3.630 8.133 -2.172 1.00 0.00 H new ATOM 0 HG21 VAL P 365 -2.105 9.284 -4.573 1.00 0.00 H new ATOM 0 HG22 VAL P 365 -3.875 9.114 -4.489 1.00 0.00 H new ATOM 0 HG23 VAL P 365 -3.149 10.701 -4.840 1.00 0.00 H new ATOM 1079 N PRO P 366 -4.233 11.127 0.110 1.00 0.00 N ATOM 1080 CA PRO P 366 -4.008 11.843 1.367 1.00 0.00 C ATOM 1081 C PRO P 366 -2.602 11.638 1.927 1.00 0.00 C ATOM 1082 O PRO P 366 -1.830 10.830 1.411 1.00 0.00 O ATOM 1083 CB PRO P 366 -5.038 11.189 2.283 1.00 0.00 C ATOM 1084 CG PRO P 366 -5.074 9.767 1.834 1.00 0.00 C ATOM 1085 CD PRO P 366 -4.793 9.784 0.349 1.00 0.00 C ATOM 0 HA PRO P 366 -4.102 12.923 1.256 1.00 0.00 H new ATOM 0 HB2 PRO P 366 -4.747 11.269 3.331 1.00 0.00 H new ATOM 0 HB3 PRO P 366 -6.015 11.662 2.186 1.00 0.00 H new ATOM 0 HG2 PRO P 366 -4.329 9.173 2.364 1.00 0.00 H new ATOM 0 HG3 PRO P 366 -6.046 9.318 2.041 1.00 0.00 H new ATOM 0 HD2 PRO P 366 -4.089 9.001 0.067 1.00 0.00 H new ATOM 0 HD3 PRO P 366 -5.701 9.621 -0.231 1.00 0.00 H new ATOM 1093 N PRO P 367 -2.258 12.357 3.015 1.00 0.00 N ATOM 1094 CA PRO P 367 -0.948 12.234 3.665 1.00 0.00 C ATOM 1095 C PRO P 367 -0.775 10.858 4.283 1.00 0.00 C ATOM 1096 O PRO P 367 -1.166 10.616 5.424 1.00 0.00 O ATOM 1097 CB PRO P 367 -0.987 13.306 4.750 1.00 0.00 C ATOM 1098 CG PRO P 367 -2.433 13.448 5.044 1.00 0.00 C ATOM 1099 CD PRO P 367 -3.117 13.324 3.716 1.00 0.00 C ATOM 0 HA PRO P 367 -0.119 12.358 2.969 1.00 0.00 H new ATOM 0 HB2 PRO P 367 -0.426 13.003 5.634 1.00 0.00 H new ATOM 0 HB3 PRO P 367 -0.554 14.244 4.403 1.00 0.00 H new ATOM 0 HG2 PRO P 367 -2.772 12.677 5.735 1.00 0.00 H new ATOM 0 HG3 PRO P 367 -2.648 14.410 5.510 1.00 0.00 H new ATOM 0 HD2 PRO P 367 -4.140 12.962 3.817 1.00 0.00 H new ATOM 0 HD3 PRO P 367 -3.167 14.279 3.193 1.00 0.00 H new ATOM 1107 N ARG P 368 -0.212 9.961 3.498 1.00 0.00 N ATOM 1108 CA ARG P 368 0.005 8.575 3.910 1.00 0.00 C ATOM 1109 C ARG P 368 0.452 8.451 5.370 1.00 0.00 C ATOM 1110 O ARG P 368 1.247 9.249 5.866 1.00 0.00 O ATOM 1111 CB ARG P 368 1.027 7.888 2.997 1.00 0.00 C ATOM 1112 CG ARG P 368 2.150 8.795 2.513 1.00 0.00 C ATOM 1113 CD ARG P 368 3.208 8.999 3.587 1.00 0.00 C ATOM 1114 NE ARG P 368 3.476 10.414 3.831 1.00 0.00 N ATOM 1115 CZ ARG P 368 4.557 10.866 4.462 1.00 0.00 C ATOM 1116 NH1 ARG P 368 5.471 10.019 4.917 1.00 0.00 N ATOM 1117 NH2 ARG P 368 4.725 12.169 4.639 1.00 0.00 N ATOM 0 H ARG P 368 0.111 10.166 2.553 1.00 0.00 H new ATOM 0 HA ARG P 368 -0.960 8.076 3.820 1.00 0.00 H new ATOM 0 HB2 ARG P 368 1.463 7.044 3.531 1.00 0.00 H new ATOM 0 HB3 ARG P 368 0.506 7.482 2.130 1.00 0.00 H new ATOM 0 HG2 ARG P 368 2.611 8.362 1.625 1.00 0.00 H new ATOM 0 HG3 ARG P 368 1.738 9.760 2.220 1.00 0.00 H new ATOM 0 HD2 ARG P 368 2.880 8.527 4.513 1.00 0.00 H new ATOM 0 HD3 ARG P 368 4.130 8.502 3.286 1.00 0.00 H new ATOM 0 HE ARG P 368 2.794 11.096 3.498 1.00 0.00 H new ATOM 0 HH11 ARG P 368 5.347 9.015 4.784 1.00 0.00 H new ATOM 0 HH12 ARG P 368 6.297 10.371 5.400 1.00 0.00 H new ATOM 0 HH21 ARG P 368 4.026 12.825 4.292 1.00 0.00 H new ATOM 0 HH22 ARG P 368 5.554 12.515 5.123 1.00 0.00 H new ATOM 1131 N PRO P 369 -0.069 7.418 6.061 1.00 0.00 N ATOM 1132 CA PRO P 369 0.229 7.109 7.457 1.00 0.00 C ATOM 1133 C PRO P 369 1.652 7.460 7.861 1.00 0.00 C ATOM 1134 O PRO P 369 2.573 7.408 7.046 1.00 0.00 O ATOM 1135 CB PRO P 369 0.018 5.588 7.526 1.00 0.00 C ATOM 1136 CG PRO P 369 -0.585 5.186 6.210 1.00 0.00 C ATOM 1137 CD PRO P 369 -1.004 6.442 5.522 1.00 0.00 C ATOM 0 HA PRO P 369 -0.398 7.686 8.137 1.00 0.00 H new ATOM 0 HB2 PRO P 369 0.963 5.072 7.695 1.00 0.00 H new ATOM 0 HB3 PRO P 369 -0.641 5.324 8.353 1.00 0.00 H new ATOM 0 HG2 PRO P 369 0.138 4.638 5.606 1.00 0.00 H new ATOM 0 HG3 PRO P 369 -1.439 4.526 6.362 1.00 0.00 H new ATOM 0 HD2 PRO P 369 -0.924 6.358 4.438 1.00 0.00 H new ATOM 0 HD3 PRO P 369 -2.038 6.703 5.746 1.00 0.00 H new ATOM 1145 N SER P 370 1.827 7.805 9.131 1.00 0.00 N ATOM 1146 CA SER P 370 3.140 8.147 9.647 1.00 0.00 C ATOM 1147 C SER P 370 4.065 6.942 9.538 1.00 0.00 C ATOM 1148 O SER P 370 3.783 5.886 10.105 1.00 0.00 O ATOM 1149 CB SER P 370 3.041 8.604 11.103 1.00 0.00 C ATOM 1150 OG SER P 370 3.970 9.638 11.378 1.00 0.00 O ATOM 0 H SER P 370 1.075 7.854 9.819 1.00 0.00 H new ATOM 0 HA SER P 370 3.548 8.967 9.056 1.00 0.00 H new ATOM 0 HB2 SER P 370 2.030 8.955 11.309 1.00 0.00 H new ATOM 0 HB3 SER P 370 3.226 7.759 11.766 1.00 0.00 H new ATOM 0 HG SER P 370 4.808 9.247 11.703 1.00 0.00 H new ATOM 1156 N ALA P 371 5.158 7.109 8.797 1.00 0.00 N ATOM 1157 CA ALA P 371 6.138 6.042 8.589 1.00 0.00 C ATOM 1158 C ALA P 371 6.174 5.062 9.761 1.00 0.00 C ATOM 1159 O ALA P 371 6.191 3.847 9.575 1.00 0.00 O ATOM 1160 CB ALA P 371 7.515 6.649 8.372 1.00 0.00 C ATOM 0 H ALA P 371 5.390 7.983 8.325 1.00 0.00 H new ATOM 0 HA ALA P 371 5.838 5.480 7.704 1.00 0.00 H new ATOM 0 HB1 ALA P 371 8.243 5.853 8.217 1.00 0.00 H new ATOM 0 HB2 ALA P 371 7.493 7.296 7.495 1.00 0.00 H new ATOM 0 HB3 ALA P 371 7.797 7.234 9.248 1.00 0.00 H new ATOM 1166 N ASP P 372 6.195 5.606 10.964 1.00 0.00 N ATOM 1167 CA ASP P 372 6.237 4.789 12.172 1.00 0.00 C ATOM 1168 C ASP P 372 5.077 3.801 12.239 1.00 0.00 C ATOM 1169 O ASP P 372 5.308 2.593 12.284 1.00 0.00 O ATOM 1170 CB ASP P 372 6.245 5.676 13.421 1.00 0.00 C ATOM 1171 CG ASP P 372 7.193 5.165 14.490 1.00 0.00 C ATOM 1172 OD1 ASP P 372 8.057 4.322 14.167 1.00 0.00 O ATOM 1173 OD2 ASP P 372 7.071 5.609 15.650 1.00 0.00 O ATOM 0 H ASP P 372 6.184 6.611 11.135 1.00 0.00 H new ATOM 0 HA ASP P 372 7.160 4.211 12.135 1.00 0.00 H new ATOM 0 HB2 ASP P 372 6.531 6.690 13.141 1.00 0.00 H new ATOM 0 HB3 ASP P 372 5.236 5.731 13.830 1.00 0.00 H new ATOM 1178 N LEU P 373 3.827 4.281 12.255 1.00 0.00 N ATOM 1179 CA LEU P 373 2.709 3.344 12.322 1.00 0.00 C ATOM 1180 C LEU P 373 2.831 2.331 11.195 1.00 0.00 C ATOM 1181 O LEU P 373 2.430 1.178 11.338 1.00 0.00 O ATOM 1182 CB LEU P 373 1.322 4.037 12.374 1.00 0.00 C ATOM 1183 CG LEU P 373 0.694 4.592 11.074 1.00 0.00 C ATOM 1184 CD1 LEU P 373 0.888 3.678 9.881 1.00 0.00 C ATOM 1185 CD2 LEU P 373 -0.796 4.811 11.288 1.00 0.00 C ATOM 0 H LEU P 373 3.574 5.269 12.224 1.00 0.00 H new ATOM 0 HA LEU P 373 2.770 2.812 13.272 1.00 0.00 H new ATOM 0 HB2 LEU P 373 0.616 3.322 12.797 1.00 0.00 H new ATOM 0 HB3 LEU P 373 1.398 4.865 13.079 1.00 0.00 H new ATOM 0 HG LEU P 373 1.204 5.529 10.852 1.00 0.00 H new ATOM 0 HD11 LEU P 373 0.425 4.125 9.001 1.00 0.00 H new ATOM 0 HD12 LEU P 373 1.954 3.539 9.699 1.00 0.00 H new ATOM 0 HD13 LEU P 373 0.426 2.712 10.084 1.00 0.00 H new ATOM 0 HD21 LEU P 373 -1.241 5.202 10.373 1.00 0.00 H new ATOM 0 HD22 LEU P 373 -1.270 3.864 11.546 1.00 0.00 H new ATOM 0 HD23 LEU P 373 -0.946 5.524 12.098 1.00 0.00 H new ATOM 1197 N ILE P 374 3.451 2.751 10.092 1.00 0.00 N ATOM 1198 CA ILE P 374 3.681 1.850 8.980 1.00 0.00 C ATOM 1199 C ILE P 374 4.723 0.840 9.430 1.00 0.00 C ATOM 1200 O ILE P 374 4.571 -0.365 9.241 1.00 0.00 O ATOM 1201 CB ILE P 374 4.160 2.590 7.707 1.00 0.00 C ATOM 1202 CG1 ILE P 374 2.991 3.329 7.048 1.00 0.00 C ATOM 1203 CG2 ILE P 374 4.792 1.614 6.728 1.00 0.00 C ATOM 1204 CD1 ILE P 374 3.271 4.790 6.782 1.00 0.00 C ATOM 0 H ILE P 374 3.797 3.700 9.952 1.00 0.00 H new ATOM 0 HA ILE P 374 2.744 1.363 8.710 1.00 0.00 H new ATOM 0 HB ILE P 374 4.914 3.322 7.996 1.00 0.00 H new ATOM 0 HG12 ILE P 374 2.746 2.837 6.106 1.00 0.00 H new ATOM 0 HG13 ILE P 374 2.113 3.247 7.688 1.00 0.00 H new ATOM 0 HG21 ILE P 374 5.122 2.152 5.840 1.00 0.00 H new ATOM 0 HG22 ILE P 374 5.648 1.130 7.198 1.00 0.00 H new ATOM 0 HG23 ILE P 374 4.059 0.859 6.443 1.00 0.00 H new ATOM 0 HD11 ILE P 374 2.399 5.248 6.315 1.00 0.00 H new ATOM 0 HD12 ILE P 374 3.487 5.296 7.723 1.00 0.00 H new ATOM 0 HD13 ILE P 374 4.129 4.881 6.116 1.00 0.00 H new ATOM 1216 N LEU P 375 5.756 1.356 10.090 1.00 0.00 N ATOM 1217 CA LEU P 375 6.809 0.521 10.641 1.00 0.00 C ATOM 1218 C LEU P 375 6.197 -0.461 11.634 1.00 0.00 C ATOM 1219 O LEU P 375 6.757 -1.520 11.916 1.00 0.00 O ATOM 1220 CB LEU P 375 7.864 1.399 11.329 1.00 0.00 C ATOM 1221 CG LEU P 375 8.726 2.222 10.374 1.00 0.00 C ATOM 1222 CD1 LEU P 375 9.056 3.582 10.975 1.00 0.00 C ATOM 1223 CD2 LEU P 375 10.008 1.480 10.024 1.00 0.00 C ATOM 0 H LEU P 375 5.883 2.355 10.255 1.00 0.00 H new ATOM 0 HA LEU P 375 7.297 -0.037 9.842 1.00 0.00 H new ATOM 0 HB2 LEU P 375 7.360 2.076 12.019 1.00 0.00 H new ATOM 0 HB3 LEU P 375 8.515 0.761 11.927 1.00 0.00 H new ATOM 0 HG LEU P 375 8.153 2.377 9.459 1.00 0.00 H new ATOM 0 HD11 LEU P 375 9.671 4.149 10.276 1.00 0.00 H new ATOM 0 HD12 LEU P 375 8.133 4.127 11.171 1.00 0.00 H new ATOM 0 HD13 LEU P 375 9.601 3.445 11.909 1.00 0.00 H new ATOM 0 HD21 LEU P 375 10.605 2.086 9.343 1.00 0.00 H new ATOM 0 HD22 LEU P 375 10.578 1.289 10.933 1.00 0.00 H new ATOM 0 HD23 LEU P 375 9.761 0.533 9.545 1.00 0.00 H new ATOM 1235 N ASN P 376 5.028 -0.086 12.148 1.00 0.00 N ATOM 1236 CA ASN P 376 4.292 -0.898 13.101 1.00 0.00 C ATOM 1237 C ASN P 376 3.326 -1.846 12.390 1.00 0.00 C ATOM 1238 O ASN P 376 2.852 -2.815 12.982 1.00 0.00 O ATOM 1239 CB ASN P 376 3.508 0.015 14.045 1.00 0.00 C ATOM 1240 CG ASN P 376 3.718 -0.341 15.504 1.00 0.00 C ATOM 1241 OD1 ASN P 376 2.761 -0.500 16.261 1.00 0.00 O ATOM 1242 ND2 ASN P 376 4.978 -0.465 15.906 1.00 0.00 N ATOM 0 H ASN P 376 4.567 0.793 11.912 1.00 0.00 H new ATOM 0 HA ASN P 376 5.006 -1.498 13.665 1.00 0.00 H new ATOM 0 HB2 ASN P 376 3.810 1.049 13.879 1.00 0.00 H new ATOM 0 HB3 ASN P 376 2.446 -0.049 13.808 1.00 0.00 H new ATOM 0 HD21 ASN P 376 5.183 -0.701 16.877 1.00 0.00 H new ATOM 0 HD22 ASN P 376 5.741 -0.324 15.244 1.00 0.00 H new ATOM 1249 N ARG P 377 3.010 -1.547 11.129 1.00 0.00 N ATOM 1250 CA ARG P 377 2.069 -2.365 10.372 1.00 0.00 C ATOM 1251 C ARG P 377 2.559 -2.682 8.953 1.00 0.00 C ATOM 1252 O ARG P 377 1.752 -2.791 8.031 1.00 0.00 O ATOM 1253 CB ARG P 377 0.715 -1.654 10.300 1.00 0.00 C ATOM 1254 CG ARG P 377 0.156 -1.253 11.662 1.00 0.00 C ATOM 1255 CD ARG P 377 -0.097 0.247 11.758 1.00 0.00 C ATOM 1256 NE ARG P 377 0.441 0.813 12.993 1.00 0.00 N ATOM 1257 CZ ARG P 377 -0.157 0.708 14.178 1.00 0.00 C ATOM 1258 NH1 ARG P 377 -1.312 0.062 14.291 1.00 0.00 N ATOM 1259 NH2 ARG P 377 0.400 1.252 15.251 1.00 0.00 N ATOM 0 H ARG P 377 3.389 -0.751 10.616 1.00 0.00 H new ATOM 0 HA ARG P 377 1.976 -3.315 10.898 1.00 0.00 H new ATOM 0 HB2 ARG P 377 0.816 -0.762 9.682 1.00 0.00 H new ATOM 0 HB3 ARG P 377 -0.002 -2.307 9.802 1.00 0.00 H new ATOM 0 HG2 ARG P 377 -0.775 -1.790 11.844 1.00 0.00 H new ATOM 0 HG3 ARG P 377 0.855 -1.553 12.443 1.00 0.00 H new ATOM 0 HD2 ARG P 377 0.356 0.747 10.902 1.00 0.00 H new ATOM 0 HD3 ARG P 377 -1.169 0.438 11.708 1.00 0.00 H new ATOM 0 HE ARG P 377 1.326 1.318 12.945 1.00 0.00 H new ATOM 0 HH11 ARG P 377 -1.745 -0.357 13.468 1.00 0.00 H new ATOM 0 HH12 ARG P 377 -1.766 -0.016 15.201 1.00 0.00 H new ATOM 0 HH21 ARG P 377 1.286 1.751 15.168 1.00 0.00 H new ATOM 0 HH22 ARG P 377 -0.057 1.172 16.159 1.00 0.00 H new ATOM 1273 N CYS P 378 3.870 -2.850 8.775 1.00 0.00 N ATOM 1274 CA CYS P 378 4.416 -3.174 7.452 1.00 0.00 C ATOM 1275 C CYS P 378 5.622 -4.101 7.557 1.00 0.00 C ATOM 1276 O CYS P 378 6.068 -4.442 8.651 1.00 0.00 O ATOM 1277 CB CYS P 378 4.819 -1.911 6.685 1.00 0.00 C ATOM 1278 SG CYS P 378 3.503 -1.211 5.664 1.00 0.00 S ATOM 0 H CYS P 378 4.566 -2.769 9.516 1.00 0.00 H new ATOM 0 HA CYS P 378 3.622 -3.683 6.905 1.00 0.00 H new ATOM 0 HB2 CYS P 378 5.150 -1.156 7.399 1.00 0.00 H new ATOM 0 HB3 CYS P 378 5.673 -2.143 6.048 1.00 0.00 H new ATOM 0 HG CYS P 378 3.954 -0.172 5.027 1.00 0.00 H new ATOM 1284 N SER P 379 6.145 -4.493 6.400 1.00 0.00 N ATOM 1285 CA SER P 379 7.307 -5.372 6.337 1.00 0.00 C ATOM 1286 C SER P 379 8.592 -4.557 6.382 1.00 0.00 C ATOM 1287 O SER P 379 8.601 -3.377 6.030 1.00 0.00 O ATOM 1288 CB SER P 379 7.265 -6.215 5.058 1.00 0.00 C ATOM 1289 OG SER P 379 6.811 -7.530 5.327 1.00 0.00 O ATOM 0 H SER P 379 5.780 -4.214 5.489 1.00 0.00 H new ATOM 0 HA SER P 379 7.284 -6.038 7.200 1.00 0.00 H new ATOM 0 HB2 SER P 379 6.607 -5.742 4.329 1.00 0.00 H new ATOM 0 HB3 SER P 379 8.259 -6.254 4.612 1.00 0.00 H new ATOM 0 HG SER P 379 6.792 -8.046 4.494 1.00 0.00 H new ATOM 1295 N GLU P 380 9.680 -5.189 6.812 1.00 0.00 N ATOM 1296 CA GLU P 380 10.969 -4.512 6.896 1.00 0.00 C ATOM 1297 C GLU P 380 11.334 -3.867 5.561 1.00 0.00 C ATOM 1298 O GLU P 380 12.088 -2.895 5.517 1.00 0.00 O ATOM 1299 CB GLU P 380 12.061 -5.500 7.314 1.00 0.00 C ATOM 1300 CG GLU P 380 12.049 -6.794 6.515 1.00 0.00 C ATOM 1301 CD GLU P 380 13.308 -7.614 6.717 1.00 0.00 C ATOM 1302 OE1 GLU P 380 13.371 -8.370 7.709 1.00 0.00 O ATOM 1303 OE2 GLU P 380 14.231 -7.502 5.882 1.00 0.00 O ATOM 0 H GLU P 380 9.695 -6.165 7.107 1.00 0.00 H new ATOM 0 HA GLU P 380 10.891 -3.727 7.648 1.00 0.00 H new ATOM 0 HB2 GLU P 380 13.034 -5.022 7.201 1.00 0.00 H new ATOM 0 HB3 GLU P 380 11.942 -5.735 8.372 1.00 0.00 H new ATOM 0 HG2 GLU P 380 11.182 -7.388 6.805 1.00 0.00 H new ATOM 0 HG3 GLU P 380 11.937 -6.562 5.456 1.00 0.00 H new ATOM 1310 N SER P 381 10.790 -4.412 4.476 1.00 0.00 N ATOM 1311 CA SER P 381 11.056 -3.886 3.144 1.00 0.00 C ATOM 1312 C SER P 381 10.510 -2.467 3.004 1.00 0.00 C ATOM 1313 O SER P 381 11.267 -1.523 2.778 1.00 0.00 O ATOM 1314 CB SER P 381 10.436 -4.795 2.082 1.00 0.00 C ATOM 1315 OG SER P 381 10.930 -4.486 0.790 1.00 0.00 O ATOM 0 H SER P 381 10.163 -5.217 4.495 1.00 0.00 H new ATOM 0 HA SER P 381 12.136 -3.856 2.998 1.00 0.00 H new ATOM 0 HB2 SER P 381 10.655 -5.836 2.318 1.00 0.00 H new ATOM 0 HB3 SER P 381 9.352 -4.686 2.095 1.00 0.00 H new ATOM 0 HG SER P 381 11.377 -5.273 0.414 1.00 0.00 H new ATOM 1321 N THR P 382 9.195 -2.320 3.147 1.00 0.00 N ATOM 1322 CA THR P 382 8.561 -1.008 3.045 1.00 0.00 C ATOM 1323 C THR P 382 9.129 -0.065 4.096 1.00 0.00 C ATOM 1324 O THR P 382 9.274 1.135 3.863 1.00 0.00 O ATOM 1325 CB THR P 382 7.045 -1.124 3.222 1.00 0.00 C ATOM 1326 OG1 THR P 382 6.485 -1.954 2.222 1.00 0.00 O ATOM 1327 CG2 THR P 382 6.329 0.212 3.161 1.00 0.00 C ATOM 0 H THR P 382 8.551 -3.089 3.333 1.00 0.00 H new ATOM 0 HA THR P 382 8.768 -0.607 2.053 1.00 0.00 H new ATOM 0 HB THR P 382 6.904 -1.550 4.215 1.00 0.00 H new ATOM 0 HG1 THR P 382 5.608 -1.604 1.959 1.00 0.00 H new ATOM 0 HG21 THR P 382 5.258 0.057 3.294 1.00 0.00 H new ATOM 0 HG22 THR P 382 6.703 0.861 3.953 1.00 0.00 H new ATOM 0 HG23 THR P 382 6.511 0.679 2.193 1.00 0.00 H new ATOM 1335 N LYS P 383 9.449 -0.622 5.259 1.00 0.00 N ATOM 1336 CA LYS P 383 10.003 0.158 6.354 1.00 0.00 C ATOM 1337 C LYS P 383 11.305 0.830 5.934 1.00 0.00 C ATOM 1338 O LYS P 383 11.606 1.946 6.360 1.00 0.00 O ATOM 1339 CB LYS P 383 10.236 -0.736 7.572 1.00 0.00 C ATOM 1340 CG LYS P 383 8.970 -0.997 8.370 1.00 0.00 C ATOM 1341 CD LYS P 383 9.010 -2.349 9.065 1.00 0.00 C ATOM 1342 CE LYS P 383 10.148 -2.425 10.068 1.00 0.00 C ATOM 1343 NZ LYS P 383 10.614 -3.824 10.275 1.00 0.00 N ATOM 0 H LYS P 383 9.333 -1.614 5.466 1.00 0.00 H new ATOM 0 HA LYS P 383 9.287 0.936 6.619 1.00 0.00 H new ATOM 0 HB2 LYS P 383 10.653 -1.687 7.242 1.00 0.00 H new ATOM 0 HB3 LYS P 383 10.978 -0.270 8.221 1.00 0.00 H new ATOM 0 HG2 LYS P 383 8.840 -0.210 9.113 1.00 0.00 H new ATOM 0 HG3 LYS P 383 8.107 -0.955 7.706 1.00 0.00 H new ATOM 0 HD2 LYS P 383 8.062 -2.526 9.574 1.00 0.00 H new ATOM 0 HD3 LYS P 383 9.125 -3.138 8.322 1.00 0.00 H new ATOM 0 HE2 LYS P 383 10.980 -1.813 9.720 1.00 0.00 H new ATOM 0 HE3 LYS P 383 9.821 -2.007 11.020 1.00 0.00 H new ATOM 0 HZ1 LYS P 383 10.818 -3.976 11.283 1.00 0.00 H new ATOM 0 HZ2 LYS P 383 9.873 -4.486 9.968 1.00 0.00 H new ATOM 0 HZ3 LYS P 383 11.477 -3.988 9.719 1.00 0.00 H new ATOM 1357 N ARG P 384 12.070 0.152 5.083 1.00 0.00 N ATOM 1358 CA ARG P 384 13.331 0.696 4.594 1.00 0.00 C ATOM 1359 C ARG P 384 13.086 2.006 3.856 1.00 0.00 C ATOM 1360 O ARG P 384 13.916 2.915 3.887 1.00 0.00 O ATOM 1361 CB ARG P 384 14.024 -0.307 3.667 1.00 0.00 C ATOM 1362 CG ARG P 384 14.579 -1.523 4.390 1.00 0.00 C ATOM 1363 CD ARG P 384 14.558 -2.756 3.502 1.00 0.00 C ATOM 1364 NE ARG P 384 15.789 -2.893 2.727 1.00 0.00 N ATOM 1365 CZ ARG P 384 16.945 -3.306 3.240 1.00 0.00 C ATOM 1366 NH1 ARG P 384 17.033 -3.624 4.527 1.00 0.00 N ATOM 1367 NH2 ARG P 384 18.017 -3.403 2.465 1.00 0.00 N ATOM 0 H ARG P 384 11.839 -0.772 4.719 1.00 0.00 H new ATOM 0 HA ARG P 384 13.980 0.886 5.448 1.00 0.00 H new ATOM 0 HB2 ARG P 384 13.314 -0.638 2.909 1.00 0.00 H new ATOM 0 HB3 ARG P 384 14.837 0.196 3.144 1.00 0.00 H new ATOM 0 HG2 ARG P 384 15.601 -1.322 4.711 1.00 0.00 H new ATOM 0 HG3 ARG P 384 13.993 -1.711 5.290 1.00 0.00 H new ATOM 0 HD2 ARG P 384 14.417 -3.644 4.118 1.00 0.00 H new ATOM 0 HD3 ARG P 384 13.707 -2.700 2.824 1.00 0.00 H new ATOM 0 HE ARG P 384 15.760 -2.658 1.735 1.00 0.00 H new ATOM 0 HH11 ARG P 384 16.212 -3.552 5.127 1.00 0.00 H new ATOM 0 HH12 ARG P 384 17.922 -3.940 4.915 1.00 0.00 H new ATOM 0 HH21 ARG P 384 17.955 -3.161 1.476 1.00 0.00 H new ATOM 0 HH22 ARG P 384 18.903 -3.720 2.858 1.00 0.00 H new ATOM 1381 N LYS P 385 11.932 2.095 3.204 1.00 0.00 N ATOM 1382 CA LYS P 385 11.557 3.293 2.466 1.00 0.00 C ATOM 1383 C LYS P 385 11.374 4.465 3.426 1.00 0.00 C ATOM 1384 O LYS P 385 11.789 5.589 3.142 1.00 0.00 O ATOM 1385 CB LYS P 385 10.267 3.046 1.683 1.00 0.00 C ATOM 1386 CG LYS P 385 10.276 1.747 0.888 1.00 0.00 C ATOM 1387 CD LYS P 385 10.544 1.995 -0.587 1.00 0.00 C ATOM 1388 CE LYS P 385 9.936 0.907 -1.454 1.00 0.00 C ATOM 1389 NZ LYS P 385 10.648 -0.393 -1.298 1.00 0.00 N ATOM 0 H LYS P 385 11.238 1.348 3.172 1.00 0.00 H new ATOM 0 HA LYS P 385 12.353 3.537 1.763 1.00 0.00 H new ATOM 0 HB2 LYS P 385 9.427 3.031 2.378 1.00 0.00 H new ATOM 0 HB3 LYS P 385 10.101 3.879 1.000 1.00 0.00 H new ATOM 0 HG2 LYS P 385 11.038 1.079 1.290 1.00 0.00 H new ATOM 0 HG3 LYS P 385 9.317 1.242 1.004 1.00 0.00 H new ATOM 0 HD2 LYS P 385 10.133 2.963 -0.875 1.00 0.00 H new ATOM 0 HD3 LYS P 385 11.619 2.041 -0.760 1.00 0.00 H new ATOM 0 HE2 LYS P 385 8.886 0.779 -1.192 1.00 0.00 H new ATOM 0 HE3 LYS P 385 9.969 1.215 -2.499 1.00 0.00 H new ATOM 0 HZ1 LYS P 385 11.090 -0.657 -2.202 1.00 0.00 H new ATOM 0 HZ2 LYS P 385 11.382 -0.301 -0.567 1.00 0.00 H new ATOM 0 HZ3 LYS P 385 9.969 -1.129 -1.016 1.00 0.00 H new ATOM 1403 N LEU P 386 10.764 4.181 4.571 1.00 0.00 N ATOM 1404 CA LEU P 386 10.535 5.193 5.598 1.00 0.00 C ATOM 1405 C LEU P 386 11.615 5.124 6.674 1.00 0.00 C ATOM 1406 O LEU P 386 12.576 5.893 6.648 1.00 0.00 O ATOM 1407 CB LEU P 386 9.142 5.033 6.224 1.00 0.00 C ATOM 1408 CG LEU P 386 8.574 3.609 6.220 1.00 0.00 C ATOM 1409 CD1 LEU P 386 7.622 3.412 7.382 1.00 0.00 C ATOM 1410 CD2 LEU P 386 7.864 3.324 4.905 1.00 0.00 C ATOM 0 H LEU P 386 10.417 3.253 4.813 1.00 0.00 H new ATOM 0 HA LEU P 386 10.585 6.172 5.122 1.00 0.00 H new ATOM 0 HB2 LEU P 386 9.184 5.385 7.255 1.00 0.00 H new ATOM 0 HB3 LEU P 386 8.447 5.684 5.692 1.00 0.00 H new ATOM 0 HG LEU P 386 9.403 2.909 6.328 1.00 0.00 H new ATOM 0 HD11 LEU P 386 7.229 2.395 7.362 1.00 0.00 H new ATOM 0 HD12 LEU P 386 8.153 3.578 8.319 1.00 0.00 H new ATOM 0 HD13 LEU P 386 6.798 4.121 7.301 1.00 0.00 H new ATOM 0 HD21 LEU P 386 7.467 2.309 4.919 1.00 0.00 H new ATOM 0 HD22 LEU P 386 7.046 4.032 4.772 1.00 0.00 H new ATOM 0 HD23 LEU P 386 8.570 3.426 4.081 1.00 0.00 H new ATOM 1422 N ALA P 387 11.458 4.199 7.616 1.00 0.00 N ATOM 1423 CA ALA P 387 12.427 4.033 8.695 1.00 0.00 C ATOM 1424 C ALA P 387 12.728 5.362 9.383 1.00 0.00 C ATOM 1425 O ALA P 387 13.800 5.539 9.965 1.00 0.00 O ATOM 1426 CB ALA P 387 13.708 3.412 8.160 1.00 0.00 C ATOM 0 H ALA P 387 10.670 3.553 7.654 1.00 0.00 H new ATOM 0 HA ALA P 387 11.991 3.365 9.438 1.00 0.00 H new ATOM 0 HB1 ALA P 387 14.423 3.293 8.974 1.00 0.00 H new ATOM 0 HB2 ALA P 387 13.486 2.437 7.727 1.00 0.00 H new ATOM 0 HB3 ALA P 387 14.135 4.060 7.395 1.00 0.00 H new ATOM 1432 N SER P 388 11.780 6.289 9.316 1.00 0.00 N ATOM 1433 CA SER P 388 11.946 7.597 9.936 1.00 0.00 C ATOM 1434 C SER P 388 11.185 7.665 11.253 1.00 0.00 C ATOM 1435 O SER P 388 11.637 8.288 12.214 1.00 0.00 O ATOM 1436 CB SER P 388 11.460 8.699 8.992 1.00 0.00 C ATOM 1437 OG SER P 388 10.226 8.347 8.390 1.00 0.00 O ATOM 0 H SER P 388 10.888 6.159 8.838 1.00 0.00 H new ATOM 0 HA SER P 388 13.006 7.748 10.138 1.00 0.00 H new ATOM 0 HB2 SER P 388 11.346 9.631 9.545 1.00 0.00 H new ATOM 0 HB3 SER P 388 12.208 8.876 8.219 1.00 0.00 H new ATOM 0 HG SER P 388 9.936 9.068 7.793 1.00 0.00 H new ATOM 1443 N ALA P 389 10.026 7.017 11.291 1.00 0.00 N ATOM 1444 CA ALA P 389 9.199 6.997 12.491 1.00 0.00 C ATOM 1445 C ALA P 389 8.832 8.411 12.932 1.00 0.00 C ATOM 1446 O ALA P 389 9.202 9.389 12.284 1.00 0.00 O ATOM 1447 CB ALA P 389 9.916 6.262 13.612 1.00 0.00 C ATOM 0 H ALA P 389 9.638 6.498 10.503 1.00 0.00 H new ATOM 0 HA ALA P 389 8.275 6.468 12.256 1.00 0.00 H new ATOM 0 HB1 ALA P 389 9.287 6.254 14.502 1.00 0.00 H new ATOM 0 HB2 ALA P 389 10.120 5.237 13.303 1.00 0.00 H new ATOM 0 HB3 ALA P 389 10.856 6.767 13.836 1.00 0.00 H new ATOM 1453 N VAL P 390 8.102 8.505 14.041 1.00 0.00 N ATOM 1454 CA VAL P 390 7.678 9.795 14.585 1.00 0.00 C ATOM 1455 C VAL P 390 7.161 10.726 13.487 1.00 0.00 C ATOM 1456 O VAL P 390 7.063 11.944 13.741 1.00 0.00 O ATOM 1457 CB VAL P 390 8.825 10.488 15.352 1.00 0.00 C ATOM 1458 CG1 VAL P 390 9.947 10.898 14.406 1.00 0.00 C ATOM 1459 CG2 VAL P 390 8.305 11.688 16.127 1.00 0.00 C ATOM 1460 OXT VAL P 390 6.860 10.226 12.383 1.00 0.00 O ATOM 0 H VAL P 390 7.790 7.700 14.584 1.00 0.00 H new ATOM 0 HA VAL P 390 6.864 9.589 15.280 1.00 0.00 H new ATOM 0 HB VAL P 390 9.234 9.773 16.065 1.00 0.00 H new ATOM 0 HG11 VAL P 390 10.741 11.384 14.973 1.00 0.00 H new ATOM 0 HG12 VAL P 390 10.345 10.014 13.908 1.00 0.00 H new ATOM 0 HG13 VAL P 390 9.559 11.591 13.659 1.00 0.00 H new ATOM 0 HG21 VAL P 390 9.129 12.162 16.660 1.00 0.00 H new ATOM 0 HG22 VAL P 390 7.861 12.404 15.435 1.00 0.00 H new ATOM 0 HG23 VAL P 390 7.551 11.360 16.842 1.00 0.00 H new TER 1470 VAL P 390