USER MOD reduce.3.24.130724 H: found=0, std=0, add=635, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 637 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 180:sc= -1.23 USER MOD Set 1.2: S 472 GLN : amide:sc= -1.43 K(o=-2.7,f=0.92) USER MOD Single : P 360 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 362 GLN : amide:sc= 0.873 K(o=0.87,f=-5.8!) USER MOD Single : P 370 SER OG : rot 180:sc= 0 USER MOD Single : P 376 ASN : amide:sc= -0.191 K(o=-0.19,f=-2.4!) USER MOD Single : P 378 CYS SG : rot -99:sc= -10.2! USER MOD Single : P 379 SER OG : rot 122:sc= 1.16 USER MOD Single : P 381 SER OG : rot 150:sc= -0.842 USER MOD Single : P 382 THR OG1 : rot -180:sc= -4.14! USER MOD Single : P 383 LYS NZ :NH3+ -107:sc= 0.974 (180deg=-2.22) USER MOD Single : P 385 LYS NZ :NH3+ 138:sc= 1.11 (180deg=-1.04) USER MOD Single : S 460 SER OG : rot 180:sc= -1.37 USER MOD Single : S 461 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : S 467 SER OG : rot 104:sc= -0.74 USER MOD Single : S 468 TYR OH : rot -104:sc= 0.876 USER MOD Single : S 479 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : S 488 SER OG : rot 180:sc= 0.0653 USER MOD Single : S 489 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 491 ASN : amide:sc= -6.76! C(o=-6.8!,f=-20!) 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+ -169:sc= -1.05 (180deg=-1.15) USER MOD ----------------------------------------------------------------- ATOM 90 N SER S 460 -3.641 -9.862 2.453 1.00 0.00 N ATOM 91 CA SER S 460 -4.963 -9.821 1.843 1.00 0.00 C ATOM 92 C SER S 460 -4.842 -9.296 0.416 1.00 0.00 C ATOM 93 O SER S 460 -3.733 -9.052 -0.059 1.00 0.00 O ATOM 94 CB SER S 460 -5.912 -8.941 2.663 1.00 0.00 C ATOM 95 OG SER S 460 -5.922 -7.605 2.188 1.00 0.00 O ATOM 0 HA SER S 460 -5.379 -10.828 1.822 1.00 0.00 H new ATOM 0 HB2 SER S 460 -6.921 -9.352 2.618 1.00 0.00 H new ATOM 0 HB3 SER S 460 -5.609 -8.954 3.710 1.00 0.00 H new ATOM 0 HG SER S 460 -6.538 -7.070 2.731 1.00 0.00 H new ATOM 101 N GLN S 461 -5.965 -9.123 -0.274 1.00 0.00 N ATOM 102 CA GLN S 461 -5.913 -8.628 -1.646 1.00 0.00 C ATOM 103 C GLN S 461 -7.181 -7.878 -2.039 1.00 0.00 C ATOM 104 O GLN S 461 -8.277 -8.177 -1.563 1.00 0.00 O ATOM 105 CB GLN S 461 -5.687 -9.780 -2.632 1.00 0.00 C ATOM 106 CG GLN S 461 -4.889 -10.942 -2.058 1.00 0.00 C ATOM 107 CD GLN S 461 -4.592 -12.011 -3.091 1.00 0.00 C ATOM 108 OE1 GLN S 461 -5.314 -12.156 -4.077 1.00 0.00 O ATOM 109 NE2 GLN S 461 -3.523 -12.767 -2.870 1.00 0.00 N ATOM 0 H GLN S 461 -6.901 -9.313 0.083 1.00 0.00 H new ATOM 0 HA GLN S 461 -5.076 -7.932 -1.692 1.00 0.00 H new ATOM 0 HB2 GLN S 461 -6.655 -10.150 -2.970 1.00 0.00 H new ATOM 0 HB3 GLN S 461 -5.168 -9.396 -3.510 1.00 0.00 H new ATOM 0 HG2 GLN S 461 -3.951 -10.567 -1.649 1.00 0.00 H new ATOM 0 HG3 GLN S 461 -5.443 -11.385 -1.231 1.00 0.00 H new ATOM 0 HE21 GLN S 461 -2.952 -12.612 -2.039 1.00 0.00 H new ATOM 0 HE22 GLN S 461 -3.273 -13.502 -3.531 1.00 0.00 H new ATOM 118 N VAL S 462 -7.009 -6.909 -2.932 1.00 0.00 N ATOM 119 CA VAL S 462 -8.112 -6.103 -3.438 1.00 0.00 C ATOM 120 C VAL S 462 -7.725 -5.437 -4.751 1.00 0.00 C ATOM 121 O VAL S 462 -6.804 -4.621 -4.791 1.00 0.00 O ATOM 122 CB VAL S 462 -8.546 -5.010 -2.442 1.00 0.00 C ATOM 123 CG1 VAL S 462 -9.633 -5.528 -1.514 1.00 0.00 C ATOM 124 CG2 VAL S 462 -7.351 -4.498 -1.653 1.00 0.00 C ATOM 0 H VAL S 462 -6.101 -6.661 -3.325 1.00 0.00 H new ATOM 0 HA VAL S 462 -8.950 -6.784 -3.588 1.00 0.00 H new ATOM 0 HB VAL S 462 -8.959 -4.175 -3.008 1.00 0.00 H new ATOM 0 HG11 VAL S 462 -9.924 -4.740 -0.819 1.00 0.00 H new ATOM 0 HG12 VAL S 462 -10.499 -5.832 -2.102 1.00 0.00 H new ATOM 0 HG13 VAL S 462 -9.256 -6.384 -0.954 1.00 0.00 H new ATOM 0 HG21 VAL S 462 -7.679 -3.727 -0.956 1.00 0.00 H new ATOM 0 HG22 VAL S 462 -6.901 -5.322 -1.098 1.00 0.00 H new ATOM 0 HG23 VAL S 462 -6.615 -4.078 -2.339 1.00 0.00 H new ATOM 134 N GLU S 463 -8.426 -5.781 -5.827 1.00 0.00 N ATOM 135 CA GLU S 463 -8.137 -5.199 -7.132 1.00 0.00 C ATOM 136 C GLU S 463 -8.065 -3.676 -7.035 1.00 0.00 C ATOM 137 O GLU S 463 -8.667 -3.077 -6.143 1.00 0.00 O ATOM 138 CB GLU S 463 -9.195 -5.626 -8.158 1.00 0.00 C ATOM 139 CG GLU S 463 -10.434 -4.744 -8.175 1.00 0.00 C ATOM 140 CD GLU S 463 -11.677 -5.490 -8.624 1.00 0.00 C ATOM 141 OE1 GLU S 463 -12.054 -6.471 -7.951 1.00 0.00 O ATOM 142 OE2 GLU S 463 -12.270 -5.093 -9.648 1.00 0.00 O ATOM 0 H GLU S 463 -9.192 -6.454 -5.821 1.00 0.00 H new ATOM 0 HA GLU S 463 -7.167 -5.567 -7.467 1.00 0.00 H new ATOM 0 HB2 GLU S 463 -8.745 -5.622 -9.151 1.00 0.00 H new ATOM 0 HB3 GLU S 463 -9.496 -6.653 -7.948 1.00 0.00 H new ATOM 0 HG2 GLU S 463 -10.600 -4.338 -7.177 1.00 0.00 H new ATOM 0 HG3 GLU S 463 -10.263 -3.897 -8.840 1.00 0.00 H new ATOM 149 N ALA S 464 -7.332 -3.055 -7.948 1.00 0.00 N ATOM 150 CA ALA S 464 -7.195 -1.607 -7.945 1.00 0.00 C ATOM 151 C ALA S 464 -8.280 -0.962 -8.794 1.00 0.00 C ATOM 152 O ALA S 464 -9.044 -1.650 -9.469 1.00 0.00 O ATOM 153 CB ALA S 464 -5.815 -1.201 -8.444 1.00 0.00 C ATOM 0 H ALA S 464 -6.826 -3.529 -8.696 1.00 0.00 H new ATOM 0 HA ALA S 464 -7.309 -1.255 -6.920 1.00 0.00 H new ATOM 0 HB1 ALA S 464 -5.730 -0.114 -8.435 1.00 0.00 H new ATOM 0 HB2 ALA S 464 -5.052 -1.630 -7.794 1.00 0.00 H new ATOM 0 HB3 ALA S 464 -5.673 -1.568 -9.461 1.00 0.00 H new ATOM 159 N LEU S 465 -8.355 0.360 -8.746 1.00 0.00 N ATOM 160 CA LEU S 465 -9.363 1.088 -9.507 1.00 0.00 C ATOM 161 C LEU S 465 -8.802 2.365 -10.135 1.00 0.00 C ATOM 162 O LEU S 465 -9.495 3.041 -10.895 1.00 0.00 O ATOM 163 CB LEU S 465 -10.541 1.429 -8.602 1.00 0.00 C ATOM 164 CG LEU S 465 -11.198 0.224 -7.922 1.00 0.00 C ATOM 165 CD1 LEU S 465 -10.363 -0.249 -6.745 1.00 0.00 C ATOM 166 CD2 LEU S 465 -12.611 0.569 -7.476 1.00 0.00 C ATOM 0 H LEU S 465 -7.734 0.949 -8.191 1.00 0.00 H new ATOM 0 HA LEU S 465 -9.692 0.442 -10.321 1.00 0.00 H new ATOM 0 HB2 LEU S 465 -10.201 2.122 -7.832 1.00 0.00 H new ATOM 0 HB3 LEU S 465 -11.295 1.951 -9.191 1.00 0.00 H new ATOM 0 HG LEU S 465 -11.256 -0.589 -8.645 1.00 0.00 H new ATOM 0 HD11 LEU S 465 -10.847 -1.106 -6.276 1.00 0.00 H new ATOM 0 HD12 LEU S 465 -9.372 -0.539 -7.095 1.00 0.00 H new ATOM 0 HD13 LEU S 465 -10.269 0.558 -6.018 1.00 0.00 H new ATOM 0 HD21 LEU S 465 -13.063 -0.299 -6.995 1.00 0.00 H new ATOM 0 HD22 LEU S 465 -12.577 1.399 -6.770 1.00 0.00 H new ATOM 0 HD23 LEU S 465 -13.207 0.854 -8.343 1.00 0.00 H new ATOM 178 N PHE S 466 -7.554 2.696 -9.819 1.00 0.00 N ATOM 179 CA PHE S 466 -6.927 3.896 -10.360 1.00 0.00 C ATOM 180 C PHE S 466 -5.416 3.745 -10.451 1.00 0.00 C ATOM 181 O PHE S 466 -4.838 2.800 -9.915 1.00 0.00 O ATOM 182 CB PHE S 466 -7.244 5.105 -9.482 1.00 0.00 C ATOM 183 CG PHE S 466 -8.688 5.235 -9.114 1.00 0.00 C ATOM 184 CD1 PHE S 466 -9.575 5.866 -9.969 1.00 0.00 C ATOM 185 CD2 PHE S 466 -9.160 4.740 -7.907 1.00 0.00 C ATOM 186 CE1 PHE S 466 -10.902 6.007 -9.628 1.00 0.00 C ATOM 187 CE2 PHE S 466 -10.489 4.873 -7.564 1.00 0.00 C ATOM 188 CZ PHE S 466 -11.359 5.509 -8.427 1.00 0.00 C ATOM 0 H PHE S 466 -6.959 2.152 -9.194 1.00 0.00 H new ATOM 0 HA PHE S 466 -7.329 4.044 -11.362 1.00 0.00 H new ATOM 0 HB2 PHE S 466 -6.652 5.042 -8.569 1.00 0.00 H new ATOM 0 HB3 PHE S 466 -6.931 6.010 -10.003 1.00 0.00 H new ATOM 0 HD1 PHE S 466 -9.223 6.252 -10.914 1.00 0.00 H new ATOM 0 HD2 PHE S 466 -8.480 4.246 -7.229 1.00 0.00 H new ATOM 0 HE1 PHE S 466 -11.583 6.507 -10.301 1.00 0.00 H new ATOM 0 HE2 PHE S 466 -10.848 4.481 -6.624 1.00 0.00 H new ATOM 0 HZ PHE S 466 -12.400 5.616 -8.160 1.00 0.00 H new ATOM 198 N SER S 467 -4.782 4.708 -11.110 1.00 0.00 N ATOM 199 CA SER S 467 -3.335 4.719 -11.250 1.00 0.00 C ATOM 200 C SER S 467 -2.747 5.752 -10.297 1.00 0.00 C ATOM 201 O SER S 467 -2.829 6.957 -10.542 1.00 0.00 O ATOM 202 CB SER S 467 -2.933 5.035 -12.691 1.00 0.00 C ATOM 203 OG SER S 467 -3.251 3.960 -13.558 1.00 0.00 O ATOM 0 H SER S 467 -5.253 5.495 -11.557 1.00 0.00 H new ATOM 0 HA SER S 467 -2.945 3.732 -11.002 1.00 0.00 H new ATOM 0 HB2 SER S 467 -3.444 5.938 -13.024 1.00 0.00 H new ATOM 0 HB3 SER S 467 -1.863 5.239 -12.737 1.00 0.00 H new ATOM 0 HG SER S 467 -4.054 4.182 -14.074 1.00 0.00 H new ATOM 209 N TYR S 468 -2.184 5.273 -9.198 1.00 0.00 N ATOM 210 CA TYR S 468 -1.614 6.152 -8.187 1.00 0.00 C ATOM 211 C TYR S 468 -0.230 6.653 -8.578 1.00 0.00 C ATOM 212 O TYR S 468 0.713 5.873 -8.702 1.00 0.00 O ATOM 213 CB TYR S 468 -1.540 5.414 -6.845 1.00 0.00 C ATOM 214 CG TYR S 468 -0.887 6.209 -5.732 1.00 0.00 C ATOM 215 CD1 TYR S 468 -0.759 7.591 -5.811 1.00 0.00 C ATOM 216 CD2 TYR S 468 -0.394 5.570 -4.602 1.00 0.00 C ATOM 217 CE1 TYR S 468 -0.157 8.310 -4.796 1.00 0.00 C ATOM 218 CE2 TYR S 468 0.207 6.283 -3.583 1.00 0.00 C ATOM 219 CZ TYR S 468 0.321 7.652 -3.685 1.00 0.00 C ATOM 220 OH TYR S 468 0.918 8.368 -2.673 1.00 0.00 O ATOM 0 H TYR S 468 -2.109 4.279 -8.983 1.00 0.00 H new ATOM 0 HA TYR S 468 -2.265 7.022 -8.100 1.00 0.00 H new ATOM 0 HB2 TYR S 468 -2.550 5.142 -6.537 1.00 0.00 H new ATOM 0 HB3 TYR S 468 -0.988 4.485 -6.984 1.00 0.00 H new ATOM 0 HD1 TYR S 468 -1.136 8.111 -6.679 1.00 0.00 H new ATOM 0 HD2 TYR S 468 -0.482 4.497 -4.518 1.00 0.00 H new ATOM 0 HE1 TYR S 468 -0.062 9.383 -4.874 1.00 0.00 H new ATOM 0 HE2 TYR S 468 0.585 5.770 -2.711 1.00 0.00 H new ATOM 0 HH TYR S 468 1.890 8.247 -2.716 1.00 0.00 H new ATOM 230 N GLU S 469 -0.111 7.969 -8.738 1.00 0.00 N ATOM 231 CA GLU S 469 1.163 8.582 -9.079 1.00 0.00 C ATOM 232 C GLU S 469 2.073 8.564 -7.858 1.00 0.00 C ATOM 233 O GLU S 469 1.812 9.242 -6.865 1.00 0.00 O ATOM 234 CB GLU S 469 0.958 10.019 -9.563 1.00 0.00 C ATOM 235 CG GLU S 469 1.892 10.418 -10.694 1.00 0.00 C ATOM 236 CD GLU S 469 1.576 11.790 -11.255 1.00 0.00 C ATOM 237 OE1 GLU S 469 1.836 12.792 -10.555 1.00 0.00 O ATOM 238 OE2 GLU S 469 1.070 11.864 -12.393 1.00 0.00 O ATOM 0 H GLU S 469 -0.883 8.628 -8.636 1.00 0.00 H new ATOM 0 HA GLU S 469 1.626 8.015 -9.887 1.00 0.00 H new ATOM 0 HB2 GLU S 469 -0.073 10.138 -9.895 1.00 0.00 H new ATOM 0 HB3 GLU S 469 1.104 10.700 -8.725 1.00 0.00 H new ATOM 0 HG2 GLU S 469 2.920 10.405 -10.332 1.00 0.00 H new ATOM 0 HG3 GLU S 469 1.826 9.679 -11.493 1.00 0.00 H new ATOM 245 N ALA S 470 3.126 7.765 -7.928 1.00 0.00 N ATOM 246 CA ALA S 470 4.058 7.632 -6.817 1.00 0.00 C ATOM 247 C ALA S 470 5.191 8.648 -6.907 1.00 0.00 C ATOM 248 O ALA S 470 5.992 8.625 -7.842 1.00 0.00 O ATOM 249 CB ALA S 470 4.609 6.217 -6.769 1.00 0.00 C ATOM 0 H ALA S 470 3.358 7.198 -8.743 1.00 0.00 H new ATOM 0 HA ALA S 470 3.514 7.835 -5.894 1.00 0.00 H new ATOM 0 HB1 ALA S 470 5.305 6.126 -5.935 1.00 0.00 H new ATOM 0 HB2 ALA S 470 3.789 5.512 -6.636 1.00 0.00 H new ATOM 0 HB3 ALA S 470 5.129 5.997 -7.702 1.00 0.00 H new ATOM 255 N THR S 471 5.252 9.535 -5.918 1.00 0.00 N ATOM 256 CA THR S 471 6.288 10.562 -5.868 1.00 0.00 C ATOM 257 C THR S 471 7.278 10.272 -4.744 1.00 0.00 C ATOM 258 O THR S 471 8.448 10.644 -4.823 1.00 0.00 O ATOM 259 CB THR S 471 5.658 11.942 -5.671 1.00 0.00 C ATOM 260 OG1 THR S 471 4.493 11.851 -4.871 1.00 0.00 O ATOM 261 CG2 THR S 471 5.274 12.615 -6.970 1.00 0.00 C ATOM 0 H THR S 471 4.595 9.563 -5.139 1.00 0.00 H new ATOM 0 HA THR S 471 6.827 10.552 -6.815 1.00 0.00 H new ATOM 0 HB THR S 471 6.425 12.544 -5.183 1.00 0.00 H new ATOM 0 HG1 THR S 471 4.105 12.744 -4.755 1.00 0.00 H new ATOM 0 HG21 THR S 471 4.833 13.589 -6.759 1.00 0.00 H new ATOM 0 HG22 THR S 471 6.162 12.745 -7.589 1.00 0.00 H new ATOM 0 HG23 THR S 471 4.550 11.996 -7.500 1.00 0.00 H new ATOM 269 N GLN S 472 6.801 9.600 -3.698 1.00 0.00 N ATOM 270 CA GLN S 472 7.646 9.256 -2.561 1.00 0.00 C ATOM 271 C GLN S 472 8.071 7.790 -2.622 1.00 0.00 C ATOM 272 O GLN S 472 7.480 6.991 -3.349 1.00 0.00 O ATOM 273 CB GLN S 472 6.937 9.551 -1.233 1.00 0.00 C ATOM 274 CG GLN S 472 5.423 9.432 -1.293 1.00 0.00 C ATOM 275 CD GLN S 472 4.748 10.738 -1.661 1.00 0.00 C ATOM 276 OE1 GLN S 472 5.033 11.783 -1.077 1.00 0.00 O ATOM 277 NE2 GLN S 472 3.849 10.685 -2.636 1.00 0.00 N ATOM 0 H GLN S 472 5.835 9.284 -3.616 1.00 0.00 H new ATOM 0 HA GLN S 472 8.540 9.878 -2.615 1.00 0.00 H new ATOM 0 HB2 GLN S 472 7.314 8.866 -0.473 1.00 0.00 H new ATOM 0 HB3 GLN S 472 7.198 10.559 -0.911 1.00 0.00 H new ATOM 0 HG2 GLN S 472 5.151 8.669 -2.023 1.00 0.00 H new ATOM 0 HG3 GLN S 472 5.050 9.095 -0.326 1.00 0.00 H new ATOM 0 HE21 GLN S 472 3.644 9.796 -3.093 1.00 0.00 H new ATOM 0 HE22 GLN S 472 3.363 11.533 -2.928 1.00 0.00 H new ATOM 286 N PRO S 473 9.125 7.424 -1.871 1.00 0.00 N ATOM 287 CA PRO S 473 9.658 6.053 -1.852 1.00 0.00 C ATOM 288 C PRO S 473 8.650 4.999 -1.382 1.00 0.00 C ATOM 289 O PRO S 473 8.094 4.261 -2.195 1.00 0.00 O ATOM 290 CB PRO S 473 10.841 6.136 -0.875 1.00 0.00 C ATOM 291 CG PRO S 473 10.613 7.376 -0.083 1.00 0.00 C ATOM 292 CD PRO S 473 9.899 8.325 -0.999 1.00 0.00 C ATOM 0 HA PRO S 473 9.929 5.731 -2.857 1.00 0.00 H new ATOM 0 HB2 PRO S 473 10.880 5.259 -0.229 1.00 0.00 H new ATOM 0 HB3 PRO S 473 11.790 6.180 -1.410 1.00 0.00 H new ATOM 0 HG2 PRO S 473 10.017 7.168 0.805 1.00 0.00 H new ATOM 0 HG3 PRO S 473 11.557 7.800 0.259 1.00 0.00 H new ATOM 0 HD2 PRO S 473 9.252 9.008 -0.448 1.00 0.00 H new ATOM 0 HD3 PRO S 473 10.597 8.938 -1.569 1.00 0.00 H new ATOM 300 N GLU S 474 8.442 4.915 -0.067 1.00 0.00 N ATOM 301 CA GLU S 474 7.528 3.927 0.517 1.00 0.00 C ATOM 302 C GLU S 474 6.230 3.795 -0.284 1.00 0.00 C ATOM 303 O GLU S 474 5.682 2.700 -0.410 1.00 0.00 O ATOM 304 CB GLU S 474 7.211 4.285 1.971 1.00 0.00 C ATOM 305 CG GLU S 474 6.222 5.430 2.125 1.00 0.00 C ATOM 306 CD GLU S 474 6.760 6.742 1.589 1.00 0.00 C ATOM 307 OE1 GLU S 474 7.942 7.050 1.851 1.00 0.00 O ATOM 308 OE2 GLU S 474 6.000 7.462 0.908 1.00 0.00 O ATOM 0 H GLU S 474 8.895 5.521 0.617 1.00 0.00 H new ATOM 0 HA GLU S 474 8.035 2.963 0.483 1.00 0.00 H new ATOM 0 HB2 GLU S 474 6.811 3.404 2.473 1.00 0.00 H new ATOM 0 HB3 GLU S 474 8.138 4.548 2.480 1.00 0.00 H new ATOM 0 HG2 GLU S 474 5.298 5.180 1.603 1.00 0.00 H new ATOM 0 HG3 GLU S 474 5.970 5.548 3.179 1.00 0.00 H new ATOM 315 N ASP S 475 5.741 4.910 -0.814 1.00 0.00 N ATOM 316 CA ASP S 475 4.510 4.911 -1.590 1.00 0.00 C ATOM 317 C ASP S 475 4.596 3.942 -2.763 1.00 0.00 C ATOM 318 O ASP S 475 5.369 4.145 -3.698 1.00 0.00 O ATOM 319 CB ASP S 475 4.221 6.320 -2.093 1.00 0.00 C ATOM 320 CG ASP S 475 3.445 7.147 -1.086 1.00 0.00 C ATOM 321 OD1 ASP S 475 3.283 6.686 0.063 1.00 0.00 O ATOM 322 OD2 ASP S 475 3.000 8.256 -1.446 1.00 0.00 O ATOM 0 H ASP S 475 6.180 5.826 -0.719 1.00 0.00 H new ATOM 0 HA ASP S 475 3.697 4.582 -0.943 1.00 0.00 H new ATOM 0 HB2 ASP S 475 5.162 6.821 -2.322 1.00 0.00 H new ATOM 0 HB3 ASP S 475 3.656 6.262 -3.023 1.00 0.00 H new ATOM 327 N LEU S 476 3.786 2.892 -2.705 1.00 0.00 N ATOM 328 CA LEU S 476 3.751 1.889 -3.759 1.00 0.00 C ATOM 329 C LEU S 476 2.918 2.393 -4.932 1.00 0.00 C ATOM 330 O LEU S 476 1.738 2.708 -4.779 1.00 0.00 O ATOM 331 CB LEU S 476 3.180 0.568 -3.220 1.00 0.00 C ATOM 332 CG LEU S 476 2.544 -0.353 -4.267 1.00 0.00 C ATOM 333 CD1 LEU S 476 3.536 -0.677 -5.372 1.00 0.00 C ATOM 334 CD2 LEU S 476 2.034 -1.631 -3.619 1.00 0.00 C ATOM 0 H LEU S 476 3.142 2.714 -1.934 1.00 0.00 H new ATOM 0 HA LEU S 476 4.768 1.707 -4.106 1.00 0.00 H new ATOM 0 HB2 LEU S 476 3.981 0.023 -2.721 1.00 0.00 H new ATOM 0 HB3 LEU S 476 2.431 0.799 -2.462 1.00 0.00 H new ATOM 0 HG LEU S 476 1.696 0.171 -4.709 1.00 0.00 H new ATOM 0 HD11 LEU S 476 3.064 -1.332 -6.104 1.00 0.00 H new ATOM 0 HD12 LEU S 476 3.851 0.245 -5.860 1.00 0.00 H new ATOM 0 HD13 LEU S 476 4.405 -1.177 -4.945 1.00 0.00 H new ATOM 0 HD21 LEU S 476 1.586 -2.271 -4.379 1.00 0.00 H new ATOM 0 HD22 LEU S 476 2.864 -2.156 -3.146 1.00 0.00 H new ATOM 0 HD23 LEU S 476 1.285 -1.384 -2.866 1.00 0.00 H new ATOM 346 N GLU S 477 3.542 2.474 -6.100 1.00 0.00 N ATOM 347 CA GLU S 477 2.862 2.948 -7.297 1.00 0.00 C ATOM 348 C GLU S 477 2.143 1.807 -8.004 1.00 0.00 C ATOM 349 O GLU S 477 2.672 0.700 -8.112 1.00 0.00 O ATOM 350 CB GLU S 477 3.864 3.583 -8.261 1.00 0.00 C ATOM 351 CG GLU S 477 3.282 4.722 -9.078 1.00 0.00 C ATOM 352 CD GLU S 477 4.312 5.381 -9.975 1.00 0.00 C ATOM 353 OE1 GLU S 477 5.234 4.677 -10.438 1.00 0.00 O ATOM 354 OE2 GLU S 477 4.197 6.603 -10.211 1.00 0.00 O ATOM 0 H GLU S 477 4.519 2.217 -6.243 1.00 0.00 H new ATOM 0 HA GLU S 477 2.128 3.692 -6.989 1.00 0.00 H new ATOM 0 HB2 GLU S 477 4.717 3.953 -7.693 1.00 0.00 H new ATOM 0 HB3 GLU S 477 4.240 2.816 -8.938 1.00 0.00 H new ATOM 0 HG2 GLU S 477 2.462 4.344 -9.689 1.00 0.00 H new ATOM 0 HG3 GLU S 477 2.861 5.469 -8.405 1.00 0.00 H new ATOM 361 N PHE S 478 0.944 2.086 -8.496 1.00 0.00 N ATOM 362 CA PHE S 478 0.165 1.074 -9.206 1.00 0.00 C ATOM 363 C PHE S 478 -0.846 1.719 -10.147 1.00 0.00 C ATOM 364 O PHE S 478 -1.265 2.856 -9.936 1.00 0.00 O ATOM 365 CB PHE S 478 -0.552 0.151 -8.219 1.00 0.00 C ATOM 366 CG PHE S 478 -1.211 0.879 -7.085 1.00 0.00 C ATOM 367 CD1 PHE S 478 -0.450 1.456 -6.083 1.00 0.00 C ATOM 368 CD2 PHE S 478 -2.590 0.986 -7.022 1.00 0.00 C ATOM 369 CE1 PHE S 478 -1.053 2.128 -5.038 1.00 0.00 C ATOM 370 CE2 PHE S 478 -3.199 1.655 -5.978 1.00 0.00 C ATOM 371 CZ PHE S 478 -2.429 2.227 -4.985 1.00 0.00 C ATOM 0 H PHE S 478 0.490 2.996 -8.419 1.00 0.00 H new ATOM 0 HA PHE S 478 0.859 0.480 -9.801 1.00 0.00 H new ATOM 0 HB2 PHE S 478 -1.305 -0.426 -8.756 1.00 0.00 H new ATOM 0 HB3 PHE S 478 0.166 -0.562 -7.814 1.00 0.00 H new ATOM 0 HD1 PHE S 478 0.627 1.380 -6.119 1.00 0.00 H new ATOM 0 HD2 PHE S 478 -3.196 0.542 -7.798 1.00 0.00 H new ATOM 0 HE1 PHE S 478 -0.449 2.576 -4.263 1.00 0.00 H new ATOM 0 HE2 PHE S 478 -4.276 1.730 -5.939 1.00 0.00 H new ATOM 0 HZ PHE S 478 -2.902 2.751 -4.168 1.00 0.00 H new ATOM 381 N GLN S 479 -1.228 0.984 -11.186 1.00 0.00 N ATOM 382 CA GLN S 479 -2.190 1.480 -12.166 1.00 0.00 C ATOM 383 C GLN S 479 -3.618 1.163 -11.734 1.00 0.00 C ATOM 384 O GLN S 479 -3.843 0.601 -10.663 1.00 0.00 O ATOM 385 CB GLN S 479 -1.912 0.867 -13.539 1.00 0.00 C ATOM 386 CG GLN S 479 -1.865 -0.653 -13.527 1.00 0.00 C ATOM 387 CD GLN S 479 -2.055 -1.250 -14.908 1.00 0.00 C ATOM 388 OE1 GLN S 479 -3.075 -1.879 -15.190 1.00 0.00 O ATOM 389 NE2 GLN S 479 -1.070 -1.058 -15.777 1.00 0.00 N ATOM 0 H GLN S 479 -0.886 0.041 -11.372 1.00 0.00 H new ATOM 0 HA GLN S 479 -2.081 2.563 -12.231 1.00 0.00 H new ATOM 0 HB2 GLN S 479 -2.683 1.193 -14.237 1.00 0.00 H new ATOM 0 HB3 GLN S 479 -0.962 1.249 -13.913 1.00 0.00 H new ATOM 0 HG2 GLN S 479 -0.908 -0.981 -13.121 1.00 0.00 H new ATOM 0 HG3 GLN S 479 -2.640 -1.032 -12.861 1.00 0.00 H new ATOM 0 HE21 GLN S 479 -0.242 -0.530 -15.501 1.00 0.00 H new ATOM 0 HE22 GLN S 479 -1.141 -1.438 -16.721 1.00 0.00 H new ATOM 398 N GLU S 480 -4.579 1.527 -12.576 1.00 0.00 N ATOM 399 CA GLU S 480 -5.986 1.279 -12.280 1.00 0.00 C ATOM 400 C GLU S 480 -6.372 -0.154 -12.638 1.00 0.00 C ATOM 401 O GLU S 480 -5.751 -0.777 -13.499 1.00 0.00 O ATOM 402 CB GLU S 480 -6.871 2.270 -13.045 1.00 0.00 C ATOM 403 CG GLU S 480 -6.985 1.974 -14.532 1.00 0.00 C ATOM 404 CD GLU S 480 -6.725 3.195 -15.392 1.00 0.00 C ATOM 405 OE1 GLU S 480 -7.691 3.930 -15.684 1.00 0.00 O ATOM 406 OE2 GLU S 480 -5.557 3.414 -15.775 1.00 0.00 O ATOM 0 H GLU S 480 -4.410 1.994 -13.467 1.00 0.00 H new ATOM 0 HA GLU S 480 -6.139 1.419 -11.210 1.00 0.00 H new ATOM 0 HB2 GLU S 480 -7.869 2.265 -12.606 1.00 0.00 H new ATOM 0 HB3 GLU S 480 -6.471 3.275 -12.914 1.00 0.00 H new ATOM 0 HG2 GLU S 480 -6.276 1.190 -14.798 1.00 0.00 H new ATOM 0 HG3 GLU S 480 -7.982 1.589 -14.746 1.00 0.00 H new ATOM 413 N GLY S 481 -7.400 -0.671 -11.971 1.00 0.00 N ATOM 414 CA GLY S 481 -7.852 -2.026 -12.233 1.00 0.00 C ATOM 415 C GLY S 481 -6.712 -3.027 -12.263 1.00 0.00 C ATOM 416 O GLY S 481 -6.424 -3.613 -13.306 1.00 0.00 O ATOM 0 H GLY S 481 -7.928 -0.175 -11.253 1.00 0.00 H new ATOM 0 HA2 GLY S 481 -8.569 -2.320 -11.466 1.00 0.00 H new ATOM 0 HA3 GLY S 481 -8.378 -2.051 -13.187 1.00 0.00 H new ATOM 420 N ASP S 482 -6.060 -3.223 -11.121 1.00 0.00 N ATOM 421 CA ASP S 482 -4.945 -4.158 -11.039 1.00 0.00 C ATOM 422 C ASP S 482 -5.109 -5.129 -9.878 1.00 0.00 C ATOM 423 O ASP S 482 -5.850 -4.871 -8.935 1.00 0.00 O ATOM 424 CB ASP S 482 -3.619 -3.402 -10.913 1.00 0.00 C ATOM 425 CG ASP S 482 -2.437 -4.322 -10.673 1.00 0.00 C ATOM 426 OD1 ASP S 482 -1.996 -4.986 -11.635 1.00 0.00 O ATOM 427 OD2 ASP S 482 -1.953 -4.379 -9.523 1.00 0.00 O ATOM 0 H ASP S 482 -6.283 -2.750 -10.245 1.00 0.00 H new ATOM 0 HA ASP S 482 -4.937 -4.739 -11.961 1.00 0.00 H new ATOM 0 HB2 ASP S 482 -3.447 -2.827 -11.822 1.00 0.00 H new ATOM 0 HB3 ASP S 482 -3.690 -2.688 -10.093 1.00 0.00 H new ATOM 432 N ILE S 483 -4.404 -6.252 -9.966 1.00 0.00 N ATOM 433 CA ILE S 483 -4.459 -7.278 -8.934 1.00 0.00 C ATOM 434 C ILE S 483 -3.347 -7.088 -7.909 1.00 0.00 C ATOM 435 O ILE S 483 -2.284 -7.698 -8.011 1.00 0.00 O ATOM 436 CB ILE S 483 -4.348 -8.691 -9.539 1.00 0.00 C ATOM 437 CG1 ILE S 483 -5.315 -8.844 -10.714 1.00 0.00 C ATOM 438 CG2 ILE S 483 -4.621 -9.744 -8.478 1.00 0.00 C ATOM 439 CD1 ILE S 483 -6.759 -8.577 -10.347 1.00 0.00 C ATOM 0 H ILE S 483 -3.785 -6.474 -10.746 1.00 0.00 H new ATOM 0 HA ILE S 483 -5.426 -7.177 -8.440 1.00 0.00 H new ATOM 0 HB ILE S 483 -3.333 -8.833 -9.909 1.00 0.00 H new ATOM 0 HG12 ILE S 483 -5.018 -8.161 -11.510 1.00 0.00 H new ATOM 0 HG13 ILE S 483 -5.231 -9.854 -11.114 1.00 0.00 H new ATOM 0 HG21 ILE S 483 -4.539 -10.737 -8.921 1.00 0.00 H new ATOM 0 HG22 ILE S 483 -3.894 -9.645 -7.672 1.00 0.00 H new ATOM 0 HG23 ILE S 483 -5.626 -9.607 -8.079 1.00 0.00 H new ATOM 0 HD11 ILE S 483 -7.388 -8.704 -11.228 1.00 0.00 H new ATOM 0 HD12 ILE S 483 -7.073 -9.277 -9.573 1.00 0.00 H new ATOM 0 HD13 ILE S 483 -6.857 -7.557 -9.975 1.00 0.00 H new ATOM 451 N ILE S 484 -3.604 -6.238 -6.923 1.00 0.00 N ATOM 452 CA ILE S 484 -2.630 -5.961 -5.875 1.00 0.00 C ATOM 453 C ILE S 484 -2.714 -6.999 -4.763 1.00 0.00 C ATOM 454 O ILE S 484 -3.790 -7.509 -4.455 1.00 0.00 O ATOM 455 CB ILE S 484 -2.857 -4.564 -5.260 1.00 0.00 C ATOM 456 CG1 ILE S 484 -2.812 -3.489 -6.342 1.00 0.00 C ATOM 457 CG2 ILE S 484 -1.825 -4.278 -4.178 1.00 0.00 C ATOM 458 CD1 ILE S 484 -3.358 -2.156 -5.883 1.00 0.00 C ATOM 0 H ILE S 484 -4.482 -5.727 -6.827 1.00 0.00 H new ATOM 0 HA ILE S 484 -1.644 -5.999 -6.338 1.00 0.00 H new ATOM 0 HB ILE S 484 -3.845 -4.549 -4.801 1.00 0.00 H new ATOM 0 HG12 ILE S 484 -1.781 -3.358 -6.671 1.00 0.00 H new ATOM 0 HG13 ILE S 484 -3.382 -3.829 -7.206 1.00 0.00 H new ATOM 0 HG21 ILE S 484 -2.003 -3.288 -3.758 1.00 0.00 H new ATOM 0 HG22 ILE S 484 -1.907 -5.027 -3.390 1.00 0.00 H new ATOM 0 HG23 ILE S 484 -0.825 -4.314 -4.610 1.00 0.00 H new ATOM 0 HD11 ILE S 484 -3.297 -1.437 -6.700 1.00 0.00 H new ATOM 0 HD12 ILE S 484 -4.399 -2.274 -5.580 1.00 0.00 H new ATOM 0 HD13 ILE S 484 -2.773 -1.795 -5.037 1.00 0.00 H new ATOM 470 N LEU S 485 -1.574 -7.290 -4.147 1.00 0.00 N ATOM 471 CA LEU S 485 -1.528 -8.245 -3.050 1.00 0.00 C ATOM 472 C LEU S 485 -1.303 -7.508 -1.745 1.00 0.00 C ATOM 473 O LEU S 485 -0.168 -7.311 -1.311 1.00 0.00 O ATOM 474 CB LEU S 485 -0.430 -9.289 -3.275 1.00 0.00 C ATOM 475 CG LEU S 485 -0.087 -10.210 -2.083 1.00 0.00 C ATOM 476 CD1 LEU S 485 1.239 -9.806 -1.462 1.00 0.00 C ATOM 477 CD2 LEU S 485 -1.181 -10.214 -1.019 1.00 0.00 C ATOM 0 H LEU S 485 -0.672 -6.879 -4.389 1.00 0.00 H new ATOM 0 HA LEU S 485 -2.481 -8.772 -3.005 1.00 0.00 H new ATOM 0 HB2 LEU S 485 -0.726 -9.917 -4.115 1.00 0.00 H new ATOM 0 HB3 LEU S 485 0.479 -8.767 -3.573 1.00 0.00 H new ATOM 0 HG LEU S 485 -0.009 -11.223 -2.477 1.00 0.00 H new ATOM 0 HD11 LEU S 485 1.464 -10.466 -0.624 1.00 0.00 H new ATOM 0 HD12 LEU S 485 2.029 -9.885 -2.208 1.00 0.00 H new ATOM 0 HD13 LEU S 485 1.176 -8.777 -1.107 1.00 0.00 H new ATOM 0 HD21 LEU S 485 -0.892 -10.876 -0.203 1.00 0.00 H new ATOM 0 HD22 LEU S 485 -1.319 -9.203 -0.635 1.00 0.00 H new ATOM 0 HD23 LEU S 485 -2.115 -10.565 -1.458 1.00 0.00 H new ATOM 489 N VAL S 486 -2.399 -7.110 -1.121 1.00 0.00 N ATOM 490 CA VAL S 486 -2.333 -6.398 0.146 1.00 0.00 C ATOM 491 C VAL S 486 -1.544 -7.211 1.150 1.00 0.00 C ATOM 492 O VAL S 486 -1.897 -8.348 1.452 1.00 0.00 O ATOM 493 CB VAL S 486 -3.725 -6.112 0.748 1.00 0.00 C ATOM 494 CG1 VAL S 486 -3.658 -4.938 1.702 1.00 0.00 C ATOM 495 CG2 VAL S 486 -4.768 -5.860 -0.333 1.00 0.00 C ATOM 0 H VAL S 486 -3.345 -7.267 -1.470 1.00 0.00 H new ATOM 0 HA VAL S 486 -1.849 -5.443 -0.061 1.00 0.00 H new ATOM 0 HB VAL S 486 -4.032 -7.000 1.300 1.00 0.00 H new ATOM 0 HG11 VAL S 486 -4.648 -4.750 2.117 1.00 0.00 H new ATOM 0 HG12 VAL S 486 -2.962 -5.165 2.510 1.00 0.00 H new ATOM 0 HG13 VAL S 486 -3.315 -4.053 1.166 1.00 0.00 H new ATOM 0 HG21 VAL S 486 -5.734 -5.663 0.132 1.00 0.00 H new ATOM 0 HG22 VAL S 486 -4.471 -4.999 -0.932 1.00 0.00 H new ATOM 0 HG23 VAL S 486 -4.847 -6.738 -0.974 1.00 0.00 H new ATOM 505 N LEU S 487 -0.474 -6.638 1.660 1.00 0.00 N ATOM 506 CA LEU S 487 0.351 -7.342 2.622 1.00 0.00 C ATOM 507 C LEU S 487 -0.253 -7.296 4.020 1.00 0.00 C ATOM 508 O LEU S 487 0.051 -8.143 4.861 1.00 0.00 O ATOM 509 CB LEU S 487 1.753 -6.744 2.650 1.00 0.00 C ATOM 510 CG LEU S 487 2.751 -7.385 1.688 1.00 0.00 C ATOM 511 CD1 LEU S 487 3.299 -8.673 2.283 1.00 0.00 C ATOM 512 CD2 LEU S 487 2.100 -7.656 0.341 1.00 0.00 C ATOM 0 H LEU S 487 -0.157 -5.697 1.428 1.00 0.00 H new ATOM 0 HA LEU S 487 0.404 -8.385 2.309 1.00 0.00 H new ATOM 0 HB2 LEU S 487 1.682 -5.681 2.420 1.00 0.00 H new ATOM 0 HB3 LEU S 487 2.146 -6.825 3.664 1.00 0.00 H new ATOM 0 HG LEU S 487 3.577 -6.691 1.533 1.00 0.00 H new ATOM 0 HD11 LEU S 487 4.009 -9.121 1.588 1.00 0.00 H new ATOM 0 HD12 LEU S 487 3.802 -8.454 3.225 1.00 0.00 H new ATOM 0 HD13 LEU S 487 2.479 -9.368 2.463 1.00 0.00 H new ATOM 0 HD21 LEU S 487 2.828 -8.113 -0.330 1.00 0.00 H new ATOM 0 HD22 LEU S 487 1.255 -8.332 0.474 1.00 0.00 H new ATOM 0 HD23 LEU S 487 1.749 -6.718 -0.089 1.00 0.00 H new ATOM 524 N SER S 488 -1.102 -6.302 4.269 1.00 0.00 N ATOM 525 CA SER S 488 -1.734 -6.150 5.581 1.00 0.00 C ATOM 526 C SER S 488 -2.529 -4.851 5.663 1.00 0.00 C ATOM 527 O SER S 488 -2.754 -4.177 4.660 1.00 0.00 O ATOM 528 CB SER S 488 -0.669 -6.132 6.685 1.00 0.00 C ATOM 529 OG SER S 488 -1.173 -6.680 7.891 1.00 0.00 O ATOM 0 H SER S 488 -1.368 -5.593 3.586 1.00 0.00 H new ATOM 0 HA SER S 488 -2.407 -6.996 5.718 1.00 0.00 H new ATOM 0 HB2 SER S 488 0.204 -6.699 6.361 1.00 0.00 H new ATOM 0 HB3 SER S 488 -0.338 -5.108 6.858 1.00 0.00 H new ATOM 0 HG SER S 488 -0.474 -6.658 8.577 1.00 0.00 H new ATOM 535 N LYS S 489 -2.915 -4.495 6.884 1.00 0.00 N ATOM 536 CA LYS S 489 -3.643 -3.262 7.140 1.00 0.00 C ATOM 537 C LYS S 489 -2.733 -2.303 7.898 1.00 0.00 C ATOM 538 O LYS S 489 -2.327 -2.585 9.025 1.00 0.00 O ATOM 539 CB LYS S 489 -4.911 -3.542 7.951 1.00 0.00 C ATOM 540 CG LYS S 489 -5.979 -2.472 7.801 1.00 0.00 C ATOM 541 CD LYS S 489 -7.130 -2.693 8.768 1.00 0.00 C ATOM 542 CE LYS S 489 -8.008 -1.457 8.882 1.00 0.00 C ATOM 543 NZ LYS S 489 -9.124 -1.656 9.848 1.00 0.00 N ATOM 0 H LYS S 489 -2.732 -5.052 7.719 1.00 0.00 H new ATOM 0 HA LYS S 489 -3.943 -2.815 6.192 1.00 0.00 H new ATOM 0 HB2 LYS S 489 -5.325 -4.502 7.642 1.00 0.00 H new ATOM 0 HB3 LYS S 489 -4.646 -3.633 9.004 1.00 0.00 H new ATOM 0 HG2 LYS S 489 -5.539 -1.490 7.976 1.00 0.00 H new ATOM 0 HG3 LYS S 489 -6.356 -2.474 6.778 1.00 0.00 H new ATOM 0 HD2 LYS S 489 -7.731 -3.538 8.432 1.00 0.00 H new ATOM 0 HD3 LYS S 489 -6.736 -2.953 9.751 1.00 0.00 H new ATOM 0 HE2 LYS S 489 -7.401 -0.608 9.198 1.00 0.00 H new ATOM 0 HE3 LYS S 489 -8.416 -1.210 7.902 1.00 0.00 H new ATOM 0 HZ1 LYS S 489 -9.699 -0.791 9.897 1.00 0.00 H new ATOM 0 HZ2 LYS S 489 -9.718 -2.449 9.533 1.00 0.00 H new ATOM 0 HZ3 LYS S 489 -8.735 -1.867 10.789 1.00 0.00 H new ATOM 557 N VAL S 490 -2.388 -1.187 7.270 1.00 0.00 N ATOM 558 CA VAL S 490 -1.493 -0.220 7.900 1.00 0.00 C ATOM 559 C VAL S 490 -2.271 0.803 8.728 1.00 0.00 C ATOM 560 O VAL S 490 -2.536 0.564 9.905 1.00 0.00 O ATOM 561 CB VAL S 490 -0.577 0.465 6.855 1.00 0.00 C ATOM 562 CG1 VAL S 490 0.218 1.613 7.470 1.00 0.00 C ATOM 563 CG2 VAL S 490 0.376 -0.561 6.246 1.00 0.00 C ATOM 0 H VAL S 490 -2.708 -0.929 6.337 1.00 0.00 H new ATOM 0 HA VAL S 490 -0.847 -0.767 8.587 1.00 0.00 H new ATOM 0 HB VAL S 490 -1.214 0.881 6.074 1.00 0.00 H new ATOM 0 HG11 VAL S 490 0.849 2.069 6.707 1.00 0.00 H new ATOM 0 HG12 VAL S 490 -0.469 2.360 7.866 1.00 0.00 H new ATOM 0 HG13 VAL S 490 0.843 1.231 8.277 1.00 0.00 H new ATOM 0 HG21 VAL S 490 1.017 -0.072 5.512 1.00 0.00 H new ATOM 0 HG22 VAL S 490 0.992 -0.997 7.032 1.00 0.00 H new ATOM 0 HG23 VAL S 490 -0.200 -1.348 5.758 1.00 0.00 H new ATOM 573 N ASN S 491 -2.647 1.937 8.138 1.00 0.00 N ATOM 574 CA ASN S 491 -3.395 2.947 8.886 1.00 0.00 C ATOM 575 C ASN S 491 -4.874 2.944 8.491 1.00 0.00 C ATOM 576 O ASN S 491 -5.368 1.983 7.901 1.00 0.00 O ATOM 577 CB ASN S 491 -2.763 4.335 8.703 1.00 0.00 C ATOM 578 CG ASN S 491 -3.328 5.110 7.530 1.00 0.00 C ATOM 579 OD1 ASN S 491 -3.827 4.525 6.571 1.00 0.00 O ATOM 580 ND2 ASN S 491 -3.255 6.433 7.608 1.00 0.00 N ATOM 0 H ASN S 491 -2.452 2.177 7.166 1.00 0.00 H new ATOM 0 HA ASN S 491 -3.343 2.695 9.945 1.00 0.00 H new ATOM 0 HB2 ASN S 491 -2.909 4.914 9.615 1.00 0.00 H new ATOM 0 HB3 ASN S 491 -1.688 4.220 8.567 1.00 0.00 H new ATOM 0 HD21 ASN S 491 -3.622 7.010 6.851 1.00 0.00 H new ATOM 0 HD22 ASN S 491 -2.831 6.873 8.425 1.00 0.00 H new ATOM 587 N GLU S 492 -5.581 4.017 8.839 1.00 0.00 N ATOM 588 CA GLU S 492 -7.008 4.134 8.543 1.00 0.00 C ATOM 589 C GLU S 492 -7.297 4.059 7.042 1.00 0.00 C ATOM 590 O GLU S 492 -8.367 3.608 6.634 1.00 0.00 O ATOM 591 CB GLU S 492 -7.556 5.446 9.109 1.00 0.00 C ATOM 592 CG GLU S 492 -8.936 5.309 9.733 1.00 0.00 C ATOM 593 CD GLU S 492 -9.950 4.710 8.779 1.00 0.00 C ATOM 594 OE1 GLU S 492 -9.924 3.477 8.583 1.00 0.00 O ATOM 595 OE2 GLU S 492 -10.771 5.474 8.228 1.00 0.00 O ATOM 0 H GLU S 492 -5.188 4.821 9.328 1.00 0.00 H new ATOM 0 HA GLU S 492 -7.506 3.288 9.017 1.00 0.00 H new ATOM 0 HB2 GLU S 492 -6.863 5.826 9.860 1.00 0.00 H new ATOM 0 HB3 GLU S 492 -7.599 6.187 8.311 1.00 0.00 H new ATOM 0 HG2 GLU S 492 -8.868 4.685 10.624 1.00 0.00 H new ATOM 0 HG3 GLU S 492 -9.283 6.290 10.057 1.00 0.00 H new ATOM 602 N GLU S 493 -6.349 4.506 6.226 1.00 0.00 N ATOM 603 CA GLU S 493 -6.522 4.491 4.775 1.00 0.00 C ATOM 604 C GLU S 493 -5.211 4.160 4.072 1.00 0.00 C ATOM 605 O GLU S 493 -4.823 4.824 3.109 1.00 0.00 O ATOM 606 CB GLU S 493 -7.052 5.840 4.290 1.00 0.00 C ATOM 607 CG GLU S 493 -8.492 6.111 4.694 1.00 0.00 C ATOM 608 CD GLU S 493 -8.604 7.138 5.803 1.00 0.00 C ATOM 609 OE1 GLU S 493 -8.099 8.267 5.622 1.00 0.00 O ATOM 610 OE2 GLU S 493 -9.197 6.815 6.853 1.00 0.00 O ATOM 0 H GLU S 493 -5.455 4.882 6.541 1.00 0.00 H new ATOM 0 HA GLU S 493 -7.247 3.715 4.529 1.00 0.00 H new ATOM 0 HB2 GLU S 493 -6.417 6.633 4.685 1.00 0.00 H new ATOM 0 HB3 GLU S 493 -6.975 5.882 3.204 1.00 0.00 H new ATOM 0 HG2 GLU S 493 -9.050 6.459 3.825 1.00 0.00 H new ATOM 0 HG3 GLU S 493 -8.956 5.179 5.019 1.00 0.00 H new ATOM 617 N TRP S 494 -4.539 3.124 4.555 1.00 0.00 N ATOM 618 CA TRP S 494 -3.273 2.686 3.983 1.00 0.00 C ATOM 619 C TRP S 494 -2.972 1.256 4.395 1.00 0.00 C ATOM 620 O TRP S 494 -3.539 0.742 5.361 1.00 0.00 O ATOM 621 CB TRP S 494 -2.121 3.592 4.428 1.00 0.00 C ATOM 622 CG TRP S 494 -2.156 4.971 3.838 1.00 0.00 C ATOM 623 CD1 TRP S 494 -2.805 6.060 4.341 1.00 0.00 C ATOM 624 CD2 TRP S 494 -1.500 5.415 2.640 1.00 0.00 C ATOM 625 NE1 TRP S 494 -2.587 7.151 3.540 1.00 0.00 N ATOM 626 CE2 TRP S 494 -1.800 6.781 2.490 1.00 0.00 C ATOM 627 CE3 TRP S 494 -0.691 4.795 1.684 1.00 0.00 C ATOM 628 CZ2 TRP S 494 -1.321 7.538 1.426 1.00 0.00 C ATOM 629 CZ3 TRP S 494 -0.215 5.551 0.626 1.00 0.00 C ATOM 630 CH2 TRP S 494 -0.532 6.910 0.506 1.00 0.00 C ATOM 0 H TRP S 494 -4.853 2.567 5.349 1.00 0.00 H new ATOM 0 HA TRP S 494 -3.365 2.742 2.898 1.00 0.00 H new ATOM 0 HB2 TRP S 494 -2.138 3.674 5.515 1.00 0.00 H new ATOM 0 HB3 TRP S 494 -1.177 3.118 4.159 1.00 0.00 H new ATOM 0 HD1 TRP S 494 -3.404 6.062 5.240 1.00 0.00 H new ATOM 0 HE1 TRP S 494 -2.954 8.088 3.703 1.00 0.00 H new ATOM 0 HE3 TRP S 494 -0.442 3.747 1.769 1.00 0.00 H new ATOM 0 HZ2 TRP S 494 -1.565 8.586 1.331 1.00 0.00 H new ATOM 0 HZ3 TRP S 494 0.412 5.085 -0.120 1.00 0.00 H new ATOM 0 HH2 TRP S 494 -0.145 7.472 -0.331 1.00 0.00 H new ATOM 641 N LEU S 495 -2.081 0.615 3.658 1.00 0.00 N ATOM 642 CA LEU S 495 -1.703 -0.753 3.940 1.00 0.00 C ATOM 643 C LEU S 495 -0.367 -1.095 3.305 1.00 0.00 C ATOM 644 O LEU S 495 0.178 -0.315 2.525 1.00 0.00 O ATOM 645 CB LEU S 495 -2.784 -1.710 3.454 1.00 0.00 C ATOM 646 CG LEU S 495 -3.603 -1.226 2.255 1.00 0.00 C ATOM 647 CD1 LEU S 495 -3.179 -1.941 0.981 1.00 0.00 C ATOM 648 CD2 LEU S 495 -5.086 -1.428 2.522 1.00 0.00 C ATOM 0 H LEU S 495 -1.605 1.026 2.855 1.00 0.00 H new ATOM 0 HA LEU S 495 -1.598 -0.859 5.020 1.00 0.00 H new ATOM 0 HB2 LEU S 495 -2.314 -2.658 3.192 1.00 0.00 H new ATOM 0 HB3 LEU S 495 -3.466 -1.910 4.281 1.00 0.00 H new ATOM 0 HG LEU S 495 -3.416 -0.161 2.114 1.00 0.00 H new ATOM 0 HD11 LEU S 495 -3.776 -1.579 0.144 1.00 0.00 H new ATOM 0 HD12 LEU S 495 -2.125 -1.743 0.787 1.00 0.00 H new ATOM 0 HD13 LEU S 495 -3.332 -3.014 1.098 1.00 0.00 H new ATOM 0 HD21 LEU S 495 -5.661 -1.081 1.663 1.00 0.00 H new ATOM 0 HD22 LEU S 495 -5.285 -2.487 2.688 1.00 0.00 H new ATOM 0 HD23 LEU S 495 -5.377 -0.861 3.407 1.00 0.00 H new ATOM 660 N GLU S 496 0.156 -2.266 3.641 1.00 0.00 N ATOM 661 CA GLU S 496 1.429 -2.701 3.098 1.00 0.00 C ATOM 662 C GLU S 496 1.235 -3.234 1.690 1.00 0.00 C ATOM 663 O GLU S 496 0.406 -4.111 1.451 1.00 0.00 O ATOM 664 CB GLU S 496 2.065 -3.766 3.992 1.00 0.00 C ATOM 665 CG GLU S 496 3.416 -4.252 3.493 1.00 0.00 C ATOM 666 CD GLU S 496 3.965 -5.402 4.313 1.00 0.00 C ATOM 667 OE1 GLU S 496 3.774 -5.397 5.547 1.00 0.00 O ATOM 668 OE2 GLU S 496 4.584 -6.311 3.721 1.00 0.00 O ATOM 0 H GLU S 496 -0.281 -2.927 4.284 1.00 0.00 H new ATOM 0 HA GLU S 496 2.103 -1.845 3.062 1.00 0.00 H new ATOM 0 HB2 GLU S 496 2.182 -3.362 4.997 1.00 0.00 H new ATOM 0 HB3 GLU S 496 1.388 -4.617 4.068 1.00 0.00 H new ATOM 0 HG2 GLU S 496 3.323 -4.565 2.453 1.00 0.00 H new ATOM 0 HG3 GLU S 496 4.125 -3.425 3.515 1.00 0.00 H new ATOM 675 N GLY S 497 1.981 -2.665 0.755 1.00 0.00 N ATOM 676 CA GLY S 497 1.855 -3.061 -0.628 1.00 0.00 C ATOM 677 C GLY S 497 3.037 -3.855 -1.151 1.00 0.00 C ATOM 678 O GLY S 497 4.186 -3.577 -0.813 1.00 0.00 O ATOM 0 H GLY S 497 2.672 -1.935 0.932 1.00 0.00 H new ATOM 0 HA2 GLY S 497 0.950 -3.657 -0.744 1.00 0.00 H new ATOM 0 HA3 GLY S 497 1.730 -2.169 -1.241 1.00 0.00 H new ATOM 682 N GLU S 498 2.745 -4.840 -1.995 1.00 0.00 N ATOM 683 CA GLU S 498 3.772 -5.680 -2.601 1.00 0.00 C ATOM 684 C GLU S 498 3.262 -6.245 -3.923 1.00 0.00 C ATOM 685 O GLU S 498 2.545 -7.245 -3.944 1.00 0.00 O ATOM 686 CB GLU S 498 4.165 -6.819 -1.660 1.00 0.00 C ATOM 687 CG GLU S 498 5.606 -7.271 -1.821 1.00 0.00 C ATOM 688 CD GLU S 498 5.728 -8.562 -2.608 1.00 0.00 C ATOM 689 OE1 GLU S 498 5.697 -9.642 -1.985 1.00 0.00 O ATOM 690 OE2 GLU S 498 5.853 -8.490 -3.849 1.00 0.00 O ATOM 0 H GLU S 498 1.794 -5.078 -2.277 1.00 0.00 H new ATOM 0 HA GLU S 498 4.656 -5.070 -2.787 1.00 0.00 H new ATOM 0 HB2 GLU S 498 4.006 -6.499 -0.630 1.00 0.00 H new ATOM 0 HB3 GLU S 498 3.505 -7.668 -1.836 1.00 0.00 H new ATOM 0 HG2 GLU S 498 6.174 -6.488 -2.324 1.00 0.00 H new ATOM 0 HG3 GLU S 498 6.053 -7.407 -0.836 1.00 0.00 H new ATOM 697 N SER S 499 3.616 -5.590 -5.025 1.00 0.00 N ATOM 698 CA SER S 499 3.170 -6.022 -6.344 1.00 0.00 C ATOM 699 C SER S 499 4.332 -6.127 -7.329 1.00 0.00 C ATOM 700 O SER S 499 4.937 -5.123 -7.703 1.00 0.00 O ATOM 701 CB SER S 499 2.119 -5.050 -6.888 1.00 0.00 C ATOM 702 OG SER S 499 1.532 -5.548 -8.077 1.00 0.00 O ATOM 0 H SER S 499 4.209 -4.760 -5.030 1.00 0.00 H new ATOM 0 HA SER S 499 2.732 -7.014 -6.234 1.00 0.00 H new ATOM 0 HB2 SER S 499 1.346 -4.888 -6.137 1.00 0.00 H new ATOM 0 HB3 SER S 499 2.581 -4.082 -7.084 1.00 0.00 H new ATOM 0 HG SER S 499 0.863 -4.910 -8.404 1.00 0.00 H new ATOM 708 N LYS S 500 4.621 -7.352 -7.755 1.00 0.00 N ATOM 709 CA LYS S 500 5.693 -7.611 -8.715 1.00 0.00 C ATOM 710 C LYS S 500 7.072 -7.345 -8.117 1.00 0.00 C ATOM 711 O LYS S 500 7.671 -6.298 -8.361 1.00 0.00 O ATOM 712 CB LYS S 500 5.499 -6.756 -9.971 1.00 0.00 C ATOM 713 CG LYS S 500 4.102 -6.854 -10.562 1.00 0.00 C ATOM 714 CD LYS S 500 3.900 -8.169 -11.298 1.00 0.00 C ATOM 715 CE LYS S 500 3.445 -9.271 -10.356 1.00 0.00 C ATOM 716 NZ LYS S 500 1.979 -9.508 -10.443 1.00 0.00 N ATOM 0 H LYS S 500 4.124 -8.189 -7.449 1.00 0.00 H new ATOM 0 HA LYS S 500 5.642 -8.667 -8.980 1.00 0.00 H new ATOM 0 HB2 LYS S 500 5.710 -5.715 -9.728 1.00 0.00 H new ATOM 0 HB3 LYS S 500 6.226 -7.061 -10.724 1.00 0.00 H new ATOM 0 HG2 LYS S 500 3.362 -6.763 -9.767 1.00 0.00 H new ATOM 0 HG3 LYS S 500 3.937 -6.023 -11.248 1.00 0.00 H new ATOM 0 HD2 LYS S 500 3.160 -8.035 -12.087 1.00 0.00 H new ATOM 0 HD3 LYS S 500 4.832 -8.464 -11.781 1.00 0.00 H new ATOM 0 HE2 LYS S 500 3.976 -10.193 -10.593 1.00 0.00 H new ATOM 0 HE3 LYS S 500 3.709 -9.005 -9.332 1.00 0.00 H new ATOM 0 HZ1 LYS S 500 1.710 -10.267 -9.785 1.00 0.00 H new ATOM 0 HZ2 LYS S 500 1.471 -8.636 -10.192 1.00 0.00 H new ATOM 0 HZ3 LYS S 500 1.729 -9.787 -11.413 1.00 0.00 H new ATOM 730 N GLY S 501 7.573 -8.312 -7.347 1.00 0.00 N ATOM 731 CA GLY S 501 8.888 -8.191 -6.730 1.00 0.00 C ATOM 732 C GLY S 501 9.224 -6.779 -6.287 1.00 0.00 C ATOM 733 O GLY S 501 10.333 -6.296 -6.518 1.00 0.00 O ATOM 0 H GLY S 501 7.087 -9.184 -7.138 1.00 0.00 H new ATOM 0 HA2 GLY S 501 8.938 -8.855 -5.867 1.00 0.00 H new ATOM 0 HA3 GLY S 501 9.645 -8.531 -7.437 1.00 0.00 H new ATOM 737 N LYS S 502 8.268 -6.117 -5.648 1.00 0.00 N ATOM 738 CA LYS S 502 8.466 -4.756 -5.167 1.00 0.00 C ATOM 739 C LYS S 502 7.552 -4.473 -3.989 1.00 0.00 C ATOM 740 O LYS S 502 6.336 -4.632 -4.084 1.00 0.00 O ATOM 741 CB LYS S 502 8.211 -3.746 -6.286 1.00 0.00 C ATOM 742 CG LYS S 502 9.455 -3.405 -7.088 1.00 0.00 C ATOM 743 CD LYS S 502 9.191 -3.460 -8.585 1.00 0.00 C ATOM 744 CE LYS S 502 9.893 -2.328 -9.317 1.00 0.00 C ATOM 745 NZ LYS S 502 9.048 -1.760 -10.404 1.00 0.00 N ATOM 0 H LYS S 502 7.345 -6.502 -5.450 1.00 0.00 H new ATOM 0 HA LYS S 502 9.501 -4.657 -4.840 1.00 0.00 H new ATOM 0 HB2 LYS S 502 7.452 -4.145 -6.959 1.00 0.00 H new ATOM 0 HB3 LYS S 502 7.805 -2.832 -5.854 1.00 0.00 H new ATOM 0 HG2 LYS S 502 9.802 -2.408 -6.816 1.00 0.00 H new ATOM 0 HG3 LYS S 502 10.254 -4.101 -6.833 1.00 0.00 H new ATOM 0 HD2 LYS S 502 9.532 -4.417 -8.981 1.00 0.00 H new ATOM 0 HD3 LYS S 502 8.118 -3.403 -8.769 1.00 0.00 H new ATOM 0 HE2 LYS S 502 10.149 -1.541 -8.608 1.00 0.00 H new ATOM 0 HE3 LYS S 502 10.829 -2.694 -9.739 1.00 0.00 H new ATOM 0 HZ1 LYS S 502 9.563 -0.991 -10.878 1.00 0.00 H new ATOM 0 HZ2 LYS S 502 8.824 -2.505 -11.095 1.00 0.00 H new ATOM 0 HZ3 LYS S 502 8.166 -1.387 -9.999 1.00 0.00 H new ATOM 759 N VAL S 503 8.142 -4.061 -2.878 1.00 0.00 N ATOM 760 CA VAL S 503 7.373 -3.768 -1.679 1.00 0.00 C ATOM 761 C VAL S 503 7.194 -2.267 -1.480 1.00 0.00 C ATOM 762 O VAL S 503 8.028 -1.464 -1.892 1.00 0.00 O ATOM 763 CB VAL S 503 8.029 -4.378 -0.423 1.00 0.00 C ATOM 764 CG1 VAL S 503 7.086 -4.297 0.769 1.00 0.00 C ATOM 765 CG2 VAL S 503 8.442 -5.821 -0.685 1.00 0.00 C ATOM 0 H VAL S 503 9.148 -3.922 -2.782 1.00 0.00 H new ATOM 0 HA VAL S 503 6.392 -4.222 -1.820 1.00 0.00 H new ATOM 0 HB VAL S 503 8.924 -3.802 -0.188 1.00 0.00 H new ATOM 0 HG11 VAL S 503 7.568 -4.733 1.644 1.00 0.00 H new ATOM 0 HG12 VAL S 503 6.843 -3.254 0.970 1.00 0.00 H new ATOM 0 HG13 VAL S 503 6.171 -4.847 0.547 1.00 0.00 H new ATOM 0 HG21 VAL S 503 8.903 -6.236 0.211 1.00 0.00 H new ATOM 0 HG22 VAL S 503 7.562 -6.409 -0.946 1.00 0.00 H new ATOM 0 HG23 VAL S 503 9.156 -5.851 -1.508 1.00 0.00 H new ATOM 775 N GLY S 504 6.085 -1.911 -0.849 1.00 0.00 N ATOM 776 CA GLY S 504 5.763 -0.523 -0.588 1.00 0.00 C ATOM 777 C GLY S 504 4.454 -0.417 0.160 1.00 0.00 C ATOM 778 O GLY S 504 4.112 -1.316 0.924 1.00 0.00 O ATOM 0 H GLY S 504 5.389 -2.574 -0.507 1.00 0.00 H new ATOM 0 HA2 GLY S 504 6.560 -0.062 -0.005 1.00 0.00 H new ATOM 0 HA3 GLY S 504 5.697 0.025 -1.528 1.00 0.00 H new ATOM 782 N ILE S 505 3.708 0.659 -0.064 1.00 0.00 N ATOM 783 CA ILE S 505 2.422 0.834 0.602 1.00 0.00 C ATOM 784 C ILE S 505 1.473 1.682 -0.222 1.00 0.00 C ATOM 785 O ILE S 505 1.893 2.432 -1.100 1.00 0.00 O ATOM 786 CB ILE S 505 2.570 1.462 1.997 1.00 0.00 C ATOM 787 CG1 ILE S 505 3.619 2.578 1.986 1.00 0.00 C ATOM 788 CG2 ILE S 505 2.927 0.390 3.007 1.00 0.00 C ATOM 789 CD1 ILE S 505 3.306 3.707 2.944 1.00 0.00 C ATOM 0 H ILE S 505 3.968 1.417 -0.695 1.00 0.00 H new ATOM 0 HA ILE S 505 2.006 -0.168 0.711 1.00 0.00 H new ATOM 0 HB ILE S 505 1.618 1.909 2.284 1.00 0.00 H new ATOM 0 HG12 ILE S 505 4.591 2.155 2.240 1.00 0.00 H new ATOM 0 HG13 ILE S 505 3.700 2.980 0.976 1.00 0.00 H new ATOM 0 HG21 ILE S 505 3.031 0.840 3.994 1.00 0.00 H new ATOM 0 HG22 ILE S 505 2.139 -0.363 3.033 1.00 0.00 H new ATOM 0 HG23 ILE S 505 3.868 -0.080 2.722 1.00 0.00 H new ATOM 0 HD11 ILE S 505 4.090 4.462 2.885 1.00 0.00 H new ATOM 0 HD12 ILE S 505 2.349 4.155 2.678 1.00 0.00 H new ATOM 0 HD13 ILE S 505 3.254 3.318 3.961 1.00 0.00 H new ATOM 801 N PHE S 506 0.187 1.559 0.067 1.00 0.00 N ATOM 802 CA PHE S 506 -0.818 2.322 -0.661 1.00 0.00 C ATOM 803 C PHE S 506 -2.130 2.403 0.109 1.00 0.00 C ATOM 804 O PHE S 506 -2.391 1.597 1.001 1.00 0.00 O ATOM 805 CB PHE S 506 -1.054 1.703 -2.041 1.00 0.00 C ATOM 806 CG PHE S 506 -1.631 0.317 -2.000 1.00 0.00 C ATOM 807 CD1 PHE S 506 -0.833 -0.771 -1.687 1.00 0.00 C ATOM 808 CD2 PHE S 506 -2.971 0.103 -2.281 1.00 0.00 C ATOM 809 CE1 PHE S 506 -1.360 -2.049 -1.656 1.00 0.00 C ATOM 810 CE2 PHE S 506 -3.504 -1.171 -2.250 1.00 0.00 C ATOM 811 CZ PHE S 506 -2.697 -2.248 -1.938 1.00 0.00 C ATOM 0 H PHE S 506 -0.184 0.945 0.792 1.00 0.00 H new ATOM 0 HA PHE S 506 -0.440 3.337 -0.781 1.00 0.00 H new ATOM 0 HB2 PHE S 506 -1.726 2.348 -2.607 1.00 0.00 H new ATOM 0 HB3 PHE S 506 -0.108 1.675 -2.582 1.00 0.00 H new ATOM 0 HD1 PHE S 506 0.213 -0.619 -1.465 1.00 0.00 H new ATOM 0 HD2 PHE S 506 -3.606 0.942 -2.527 1.00 0.00 H new ATOM 0 HE1 PHE S 506 -0.727 -2.890 -1.412 1.00 0.00 H new ATOM 0 HE2 PHE S 506 -4.550 -1.325 -2.469 1.00 0.00 H new ATOM 0 HZ PHE S 506 -3.112 -3.245 -1.915 1.00 0.00 H new ATOM 821 N PRO S 507 -2.977 3.391 -0.233 1.00 0.00 N ATOM 822 CA PRO S 507 -4.265 3.587 0.419 1.00 0.00 C ATOM 823 C PRO S 507 -5.358 2.710 -0.180 1.00 0.00 C ATOM 824 O PRO S 507 -5.632 2.763 -1.379 1.00 0.00 O ATOM 825 CB PRO S 507 -4.543 5.065 0.174 1.00 0.00 C ATOM 826 CG PRO S 507 -3.881 5.372 -1.126 1.00 0.00 C ATOM 827 CD PRO S 507 -2.741 4.395 -1.285 1.00 0.00 C ATOM 0 HA PRO S 507 -4.249 3.313 1.474 1.00 0.00 H new ATOM 0 HB2 PRO S 507 -5.614 5.263 0.128 1.00 0.00 H new ATOM 0 HB3 PRO S 507 -4.139 5.681 0.978 1.00 0.00 H new ATOM 0 HG2 PRO S 507 -4.588 5.277 -1.950 1.00 0.00 H new ATOM 0 HG3 PRO S 507 -3.514 6.398 -1.138 1.00 0.00 H new ATOM 0 HD2 PRO S 507 -2.741 3.941 -2.276 1.00 0.00 H new ATOM 0 HD3 PRO S 507 -1.776 4.885 -1.159 1.00 0.00 H new ATOM 835 N LYS S 508 -5.969 1.895 0.672 1.00 0.00 N ATOM 836 CA LYS S 508 -7.028 0.981 0.267 1.00 0.00 C ATOM 837 C LYS S 508 -8.074 1.659 -0.621 1.00 0.00 C ATOM 838 O LYS S 508 -8.750 0.993 -1.405 1.00 0.00 O ATOM 839 CB LYS S 508 -7.695 0.405 1.517 1.00 0.00 C ATOM 840 CG LYS S 508 -8.249 -0.992 1.320 1.00 0.00 C ATOM 841 CD LYS S 508 -9.525 -1.206 2.119 1.00 0.00 C ATOM 842 CE LYS S 508 -10.693 -0.442 1.516 1.00 0.00 C ATOM 843 NZ LYS S 508 -11.577 -1.326 0.707 1.00 0.00 N ATOM 0 H LYS S 508 -5.743 1.850 1.666 1.00 0.00 H new ATOM 0 HA LYS S 508 -6.577 0.184 -0.325 1.00 0.00 H new ATOM 0 HB2 LYS S 508 -6.970 0.388 2.330 1.00 0.00 H new ATOM 0 HB3 LYS S 508 -8.504 1.068 1.825 1.00 0.00 H new ATOM 0 HG2 LYS S 508 -8.450 -1.159 0.262 1.00 0.00 H new ATOM 0 HG3 LYS S 508 -7.502 -1.726 1.622 1.00 0.00 H new ATOM 0 HD2 LYS S 508 -9.762 -2.269 2.151 1.00 0.00 H new ATOM 0 HD3 LYS S 508 -9.370 -0.883 3.148 1.00 0.00 H new ATOM 0 HE2 LYS S 508 -11.274 0.021 2.313 1.00 0.00 H new ATOM 0 HE3 LYS S 508 -10.314 0.365 0.888 1.00 0.00 H new ATOM 0 HZ1 LYS S 508 -12.248 -0.744 0.165 1.00 0.00 H new ATOM 0 HZ2 LYS S 508 -10.999 -1.889 0.051 1.00 0.00 H new ATOM 0 HZ3 LYS S 508 -12.103 -1.963 1.339 1.00 0.00 H new ATOM 857 N VAL S 509 -8.210 2.976 -0.496 1.00 0.00 N ATOM 858 CA VAL S 509 -9.185 3.719 -1.293 1.00 0.00 C ATOM 859 C VAL S 509 -9.037 3.413 -2.786 1.00 0.00 C ATOM 860 O VAL S 509 -10.011 3.466 -3.537 1.00 0.00 O ATOM 861 CB VAL S 509 -9.062 5.242 -1.062 1.00 0.00 C ATOM 862 CG1 VAL S 509 -7.613 5.688 -1.170 1.00 0.00 C ATOM 863 CG2 VAL S 509 -9.937 6.015 -2.040 1.00 0.00 C ATOM 0 H VAL S 509 -7.662 3.549 0.145 1.00 0.00 H new ATOM 0 HA VAL S 509 -10.172 3.394 -0.965 1.00 0.00 H new ATOM 0 HB VAL S 509 -9.412 5.458 -0.053 1.00 0.00 H new ATOM 0 HG11 VAL S 509 -7.550 6.763 -1.004 1.00 0.00 H new ATOM 0 HG12 VAL S 509 -7.016 5.169 -0.420 1.00 0.00 H new ATOM 0 HG13 VAL S 509 -7.233 5.451 -2.164 1.00 0.00 H new ATOM 0 HG21 VAL S 509 -9.832 7.084 -1.856 1.00 0.00 H new ATOM 0 HG22 VAL S 509 -9.628 5.791 -3.061 1.00 0.00 H new ATOM 0 HG23 VAL S 509 -10.979 5.724 -1.904 1.00 0.00 H new ATOM 873 N PHE S 510 -7.818 3.088 -3.211 1.00 0.00 N ATOM 874 CA PHE S 510 -7.560 2.770 -4.615 1.00 0.00 C ATOM 875 C PHE S 510 -7.775 1.288 -4.897 1.00 0.00 C ATOM 876 O PHE S 510 -7.466 0.805 -5.986 1.00 0.00 O ATOM 877 CB PHE S 510 -6.133 3.157 -5.000 1.00 0.00 C ATOM 878 CG PHE S 510 -5.916 4.637 -5.054 1.00 0.00 C ATOM 879 CD1 PHE S 510 -5.988 5.396 -3.903 1.00 0.00 C ATOM 880 CD2 PHE S 510 -5.652 5.267 -6.257 1.00 0.00 C ATOM 881 CE1 PHE S 510 -5.801 6.761 -3.946 1.00 0.00 C ATOM 882 CE2 PHE S 510 -5.461 6.633 -6.308 1.00 0.00 C ATOM 883 CZ PHE S 510 -5.540 7.382 -5.149 1.00 0.00 C ATOM 0 H PHE S 510 -6.997 3.038 -2.608 1.00 0.00 H new ATOM 0 HA PHE S 510 -8.266 3.345 -5.214 1.00 0.00 H new ATOM 0 HB2 PHE S 510 -5.439 2.721 -4.281 1.00 0.00 H new ATOM 0 HB3 PHE S 510 -5.897 2.726 -5.973 1.00 0.00 H new ATOM 0 HD1 PHE S 510 -6.193 4.915 -2.958 1.00 0.00 H new ATOM 0 HD2 PHE S 510 -5.595 4.685 -7.165 1.00 0.00 H new ATOM 0 HE1 PHE S 510 -5.859 7.343 -3.038 1.00 0.00 H new ATOM 0 HE2 PHE S 510 -5.250 7.115 -7.251 1.00 0.00 H new ATOM 0 HZ PHE S 510 -5.398 8.452 -5.186 1.00 0.00 H new ATOM 893 N VAL S 511 -8.297 0.568 -3.910 1.00 0.00 N ATOM 894 CA VAL S 511 -8.541 -0.858 -4.055 1.00 0.00 C ATOM 895 C VAL S 511 -9.757 -1.287 -3.236 1.00 0.00 C ATOM 896 O VAL S 511 -9.689 -2.225 -2.443 1.00 0.00 O ATOM 897 CB VAL S 511 -7.306 -1.670 -3.606 1.00 0.00 C ATOM 898 CG1 VAL S 511 -6.088 -1.300 -4.431 1.00 0.00 C ATOM 899 CG2 VAL S 511 -7.014 -1.433 -2.139 1.00 0.00 C ATOM 0 H VAL S 511 -8.559 0.951 -3.001 1.00 0.00 H new ATOM 0 HA VAL S 511 -8.736 -1.056 -5.109 1.00 0.00 H new ATOM 0 HB VAL S 511 -7.530 -2.726 -3.759 1.00 0.00 H new ATOM 0 HG11 VAL S 511 -5.231 -1.884 -4.097 1.00 0.00 H new ATOM 0 HG12 VAL S 511 -6.283 -1.511 -5.482 1.00 0.00 H new ATOM 0 HG13 VAL S 511 -5.874 -0.238 -4.307 1.00 0.00 H new ATOM 0 HG21 VAL S 511 -6.141 -2.014 -1.843 1.00 0.00 H new ATOM 0 HG22 VAL S 511 -6.818 -0.374 -1.974 1.00 0.00 H new ATOM 0 HG23 VAL S 511 -7.873 -1.740 -1.543 1.00 0.00 H new ATOM 909 N GLU S 512 -10.871 -0.590 -3.431 1.00 0.00 N ATOM 910 CA GLU S 512 -12.101 -0.895 -2.706 1.00 0.00 C ATOM 911 C GLU S 512 -12.794 -2.140 -3.256 1.00 0.00 C ATOM 912 O GLU S 512 -13.952 -2.406 -2.937 1.00 0.00 O ATOM 913 CB GLU S 512 -13.056 0.295 -2.770 1.00 0.00 C ATOM 914 CG GLU S 512 -13.524 0.612 -4.180 1.00 0.00 C ATOM 915 CD GLU S 512 -14.430 1.826 -4.236 1.00 0.00 C ATOM 916 OE1 GLU S 512 -13.910 2.960 -4.166 1.00 0.00 O ATOM 917 OE2 GLU S 512 -15.660 1.644 -4.351 1.00 0.00 O ATOM 0 H GLU S 512 -10.949 0.190 -4.084 1.00 0.00 H new ATOM 0 HA GLU S 512 -11.828 -1.094 -1.670 1.00 0.00 H new ATOM 0 HB2 GLU S 512 -13.924 0.090 -2.144 1.00 0.00 H new ATOM 0 HB3 GLU S 512 -12.562 1.172 -2.352 1.00 0.00 H new ATOM 0 HG2 GLU S 512 -12.656 0.782 -4.817 1.00 0.00 H new ATOM 0 HG3 GLU S 512 -14.053 -0.250 -4.585 1.00 0.00 H new ATOM 986 N LYS P 360 -11.666 8.200 -15.273 1.00 0.00 N ATOM 987 CA LYS P 360 -12.105 8.466 -13.907 1.00 0.00 C ATOM 988 C LYS P 360 -11.028 9.200 -13.117 1.00 0.00 C ATOM 989 O LYS P 360 -9.841 8.890 -13.225 1.00 0.00 O ATOM 990 CB LYS P 360 -12.461 7.157 -13.198 1.00 0.00 C ATOM 991 CG LYS P 360 -13.918 6.753 -13.352 1.00 0.00 C ATOM 992 CD LYS P 360 -14.442 6.080 -12.093 1.00 0.00 C ATOM 993 CE LYS P 360 -15.935 5.810 -12.185 1.00 0.00 C ATOM 994 NZ LYS P 360 -16.540 5.568 -10.846 1.00 0.00 N ATOM 0 HA LYS P 360 -12.990 9.101 -13.959 1.00 0.00 H new ATOM 0 HB2 LYS P 360 -11.829 6.359 -13.589 1.00 0.00 H new ATOM 0 HB3 LYS P 360 -12.231 7.255 -12.137 1.00 0.00 H new ATOM 0 HG2 LYS P 360 -14.520 7.634 -13.573 1.00 0.00 H new ATOM 0 HG3 LYS P 360 -14.022 6.075 -14.199 1.00 0.00 H new ATOM 0 HD2 LYS P 360 -13.911 5.142 -11.933 1.00 0.00 H new ATOM 0 HD3 LYS P 360 -14.238 6.713 -11.229 1.00 0.00 H new ATOM 0 HE2 LYS P 360 -16.429 6.659 -12.658 1.00 0.00 H new ATOM 0 HE3 LYS P 360 -16.108 4.944 -12.823 1.00 0.00 H new ATOM 0 HZ1 LYS P 360 -17.559 5.388 -10.953 1.00 0.00 H new ATOM 0 HZ2 LYS P 360 -16.087 4.743 -10.404 1.00 0.00 H new ATOM 0 HZ3 LYS P 360 -16.397 6.404 -10.244 1.00 0.00 H new ATOM 1008 N PRO P 361 -11.435 10.188 -12.304 1.00 0.00 N ATOM 1009 CA PRO P 361 -10.525 10.981 -11.484 1.00 0.00 C ATOM 1010 C PRO P 361 -10.172 10.262 -10.186 1.00 0.00 C ATOM 1011 O PRO P 361 -10.964 10.239 -9.244 1.00 0.00 O ATOM 1012 CB PRO P 361 -11.333 12.261 -11.192 1.00 0.00 C ATOM 1013 CG PRO P 361 -12.637 12.094 -11.914 1.00 0.00 C ATOM 1014 CD PRO P 361 -12.816 10.625 -12.113 1.00 0.00 C ATOM 0 HA PRO P 361 -9.574 11.173 -11.981 1.00 0.00 H new ATOM 0 HB2 PRO P 361 -11.492 12.387 -10.121 1.00 0.00 H new ATOM 0 HB3 PRO P 361 -10.803 13.147 -11.542 1.00 0.00 H new ATOM 0 HG2 PRO P 361 -13.460 12.512 -11.334 1.00 0.00 H new ATOM 0 HG3 PRO P 361 -12.623 12.618 -12.870 1.00 0.00 H new ATOM 0 HD2 PRO P 361 -13.282 10.148 -11.251 1.00 0.00 H new ATOM 0 HD3 PRO P 361 -13.441 10.401 -12.978 1.00 0.00 H new ATOM 1022 N GLN P 362 -8.985 9.664 -10.148 1.00 0.00 N ATOM 1023 CA GLN P 362 -8.535 8.930 -8.967 1.00 0.00 C ATOM 1024 C GLN P 362 -8.764 9.727 -7.690 1.00 0.00 C ATOM 1025 O GLN P 362 -8.808 10.957 -7.703 1.00 0.00 O ATOM 1026 CB GLN P 362 -7.048 8.578 -9.071 1.00 0.00 C ATOM 1027 CG GLN P 362 -6.145 9.790 -9.229 1.00 0.00 C ATOM 1028 CD GLN P 362 -5.980 10.213 -10.675 1.00 0.00 C ATOM 1029 OE1 GLN P 362 -6.679 9.722 -11.561 1.00 0.00 O ATOM 1030 NE2 GLN P 362 -5.049 11.128 -10.922 1.00 0.00 N ATOM 0 H GLN P 362 -8.318 9.672 -10.919 1.00 0.00 H new ATOM 0 HA GLN P 362 -9.125 8.014 -8.924 1.00 0.00 H new ATOM 0 HB2 GLN P 362 -6.750 8.028 -8.179 1.00 0.00 H new ATOM 0 HB3 GLN P 362 -6.900 7.912 -9.921 1.00 0.00 H new ATOM 0 HG2 GLN P 362 -6.556 10.621 -8.656 1.00 0.00 H new ATOM 0 HG3 GLN P 362 -5.166 9.566 -8.807 1.00 0.00 H new ATOM 0 HE21 GLN P 362 -4.492 11.508 -10.157 1.00 0.00 H new ATOM 0 HE22 GLN P 362 -4.891 11.450 -11.877 1.00 0.00 H new ATOM 1039 N PRO P 363 -8.904 9.015 -6.566 1.00 0.00 N ATOM 1040 CA PRO P 363 -9.120 9.635 -5.264 1.00 0.00 C ATOM 1041 C PRO P 363 -7.912 10.430 -4.796 1.00 0.00 C ATOM 1042 O PRO P 363 -6.824 9.880 -4.647 1.00 0.00 O ATOM 1043 CB PRO P 363 -9.354 8.457 -4.313 1.00 0.00 C ATOM 1044 CG PRO P 363 -8.950 7.218 -5.045 1.00 0.00 C ATOM 1045 CD PRO P 363 -8.856 7.547 -6.504 1.00 0.00 C ATOM 0 HA PRO P 363 -9.950 10.340 -5.302 1.00 0.00 H new ATOM 0 HB2 PRO P 363 -8.768 8.575 -3.402 1.00 0.00 H new ATOM 0 HB3 PRO P 363 -10.401 8.404 -4.014 1.00 0.00 H new ATOM 0 HG2 PRO P 363 -7.992 6.853 -4.675 1.00 0.00 H new ATOM 0 HG3 PRO P 363 -9.679 6.424 -4.880 1.00 0.00 H new ATOM 0 HD2 PRO P 363 -7.932 7.164 -6.936 1.00 0.00 H new ATOM 0 HD3 PRO P 363 -9.679 7.101 -7.063 1.00 0.00 H new ATOM 1053 N ALA P 364 -8.103 11.721 -4.536 1.00 0.00 N ATOM 1054 CA ALA P 364 -7.009 12.555 -4.055 1.00 0.00 C ATOM 1055 C ALA P 364 -6.331 11.865 -2.878 1.00 0.00 C ATOM 1056 O ALA P 364 -6.863 11.847 -1.769 1.00 0.00 O ATOM 1057 CB ALA P 364 -7.522 13.929 -3.649 1.00 0.00 C ATOM 0 H ALA P 364 -8.993 12.206 -4.649 1.00 0.00 H new ATOM 0 HA ALA P 364 -6.283 12.693 -4.856 1.00 0.00 H new ATOM 0 HB1 ALA P 364 -6.691 14.537 -3.293 1.00 0.00 H new ATOM 0 HB2 ALA P 364 -7.984 14.414 -4.509 1.00 0.00 H new ATOM 0 HB3 ALA P 364 -8.260 13.822 -2.854 1.00 0.00 H new ATOM 1063 N VAL P 365 -5.172 11.263 -3.132 1.00 0.00 N ATOM 1064 CA VAL P 365 -4.459 10.535 -2.086 1.00 0.00 C ATOM 1065 C VAL P 365 -4.331 11.381 -0.819 1.00 0.00 C ATOM 1066 O VAL P 365 -4.075 12.584 -0.886 1.00 0.00 O ATOM 1067 CB VAL P 365 -3.061 10.048 -2.531 1.00 0.00 C ATOM 1068 CG1 VAL P 365 -2.706 8.767 -1.801 1.00 0.00 C ATOM 1069 CG2 VAL P 365 -3.000 9.809 -4.029 1.00 0.00 C ATOM 0 H VAL P 365 -4.711 11.264 -4.042 1.00 0.00 H new ATOM 0 HA VAL P 365 -5.059 9.650 -1.875 1.00 0.00 H new ATOM 0 HB VAL P 365 -2.344 10.830 -2.283 1.00 0.00 H new ATOM 0 HG11 VAL P 365 -1.720 8.429 -2.119 1.00 0.00 H new ATOM 0 HG12 VAL P 365 -2.698 8.951 -0.727 1.00 0.00 H new ATOM 0 HG13 VAL P 365 -3.445 8.000 -2.032 1.00 0.00 H new ATOM 0 HG21 VAL P 365 -2.002 9.468 -4.303 1.00 0.00 H new ATOM 0 HG22 VAL P 365 -3.732 9.050 -4.306 1.00 0.00 H new ATOM 0 HG23 VAL P 365 -3.223 10.737 -4.555 1.00 0.00 H new ATOM 1079 N PRO P 366 -4.543 10.760 0.353 1.00 0.00 N ATOM 1080 CA PRO P 366 -4.490 11.438 1.649 1.00 0.00 C ATOM 1081 C PRO P 366 -3.105 11.431 2.282 1.00 0.00 C ATOM 1082 O PRO P 366 -2.265 10.596 1.949 1.00 0.00 O ATOM 1083 CB PRO P 366 -5.439 10.584 2.477 1.00 0.00 C ATOM 1084 CG PRO P 366 -5.175 9.199 1.987 1.00 0.00 C ATOM 1085 CD PRO P 366 -4.886 9.332 0.511 1.00 0.00 C ATOM 0 HA PRO P 366 -4.746 12.495 1.573 1.00 0.00 H new ATOM 0 HB2 PRO P 366 -5.237 10.678 3.544 1.00 0.00 H new ATOM 0 HB3 PRO P 366 -6.478 10.874 2.323 1.00 0.00 H new ATOM 0 HG2 PRO P 366 -4.330 8.753 2.512 1.00 0.00 H new ATOM 0 HG3 PRO P 366 -6.035 8.552 2.160 1.00 0.00 H new ATOM 0 HD2 PRO P 366 -4.064 8.686 0.203 1.00 0.00 H new ATOM 0 HD3 PRO P 366 -5.751 9.058 -0.093 1.00 0.00 H new ATOM 1093 N PRO P 367 -2.856 12.353 3.229 1.00 0.00 N ATOM 1094 CA PRO P 367 -1.573 12.437 3.933 1.00 0.00 C ATOM 1095 C PRO P 367 -1.161 11.095 4.497 1.00 0.00 C ATOM 1096 O PRO P 367 -1.604 10.685 5.570 1.00 0.00 O ATOM 1097 CB PRO P 367 -1.847 13.436 5.047 1.00 0.00 C ATOM 1098 CG PRO P 367 -2.898 14.303 4.472 1.00 0.00 C ATOM 1099 CD PRO P 367 -3.798 13.378 3.705 1.00 0.00 C ATOM 0 HA PRO P 367 -0.754 12.738 3.280 1.00 0.00 H new ATOM 0 HB2 PRO P 367 -2.186 12.941 5.957 1.00 0.00 H new ATOM 0 HB3 PRO P 367 -0.954 14.004 5.307 1.00 0.00 H new ATOM 0 HG2 PRO P 367 -3.447 14.827 5.254 1.00 0.00 H new ATOM 0 HG3 PRO P 367 -2.468 15.063 3.820 1.00 0.00 H new ATOM 0 HD2 PRO P 367 -4.578 12.953 4.336 1.00 0.00 H new ATOM 0 HD3 PRO P 367 -4.297 13.887 2.880 1.00 0.00 H new ATOM 1107 N ARG P 368 -0.331 10.415 3.738 1.00 0.00 N ATOM 1108 CA ARG P 368 0.161 9.085 4.102 1.00 0.00 C ATOM 1109 C ARG P 368 0.476 8.965 5.588 1.00 0.00 C ATOM 1110 O ARG P 368 0.638 9.956 6.301 1.00 0.00 O ATOM 1111 CB ARG P 368 1.390 8.683 3.270 1.00 0.00 C ATOM 1112 CG ARG P 368 2.061 9.825 2.520 1.00 0.00 C ATOM 1113 CD ARG P 368 2.571 10.898 3.468 1.00 0.00 C ATOM 1114 NE ARG P 368 2.837 12.157 2.779 1.00 0.00 N ATOM 1115 CZ ARG P 368 3.931 12.390 2.056 1.00 0.00 C ATOM 1116 NH1 ARG P 368 4.859 11.451 1.924 1.00 0.00 N ATOM 1117 NH2 ARG P 368 4.096 13.564 1.462 1.00 0.00 N ATOM 0 H ARG P 368 0.028 10.760 2.848 1.00 0.00 H new ATOM 0 HA ARG P 368 -0.652 8.395 3.877 1.00 0.00 H new ATOM 0 HB2 ARG P 368 2.123 8.223 3.932 1.00 0.00 H new ATOM 0 HB3 ARG P 368 1.089 7.922 2.550 1.00 0.00 H new ATOM 0 HG2 ARG P 368 2.891 9.435 1.931 1.00 0.00 H new ATOM 0 HG3 ARG P 368 1.352 10.266 1.819 1.00 0.00 H new ATOM 0 HD2 ARG P 368 1.836 11.064 4.256 1.00 0.00 H new ATOM 0 HD3 ARG P 368 3.484 10.550 3.952 1.00 0.00 H new ATOM 0 HE ARG P 368 2.145 12.902 2.856 1.00 0.00 H new ATOM 0 HH11 ARG P 368 4.736 10.546 2.377 1.00 0.00 H new ATOM 0 HH12 ARG P 368 5.695 11.635 1.369 1.00 0.00 H new ATOM 0 HH21 ARG P 368 3.385 14.289 1.559 1.00 0.00 H new ATOM 0 HH22 ARG P 368 4.934 13.742 0.908 1.00 0.00 H new ATOM 1131 N PRO P 369 0.553 7.715 6.050 1.00 0.00 N ATOM 1132 CA PRO P 369 0.833 7.367 7.449 1.00 0.00 C ATOM 1133 C PRO P 369 2.037 8.114 8.010 1.00 0.00 C ATOM 1134 O PRO P 369 2.711 8.853 7.290 1.00 0.00 O ATOM 1135 CB PRO P 369 1.109 5.869 7.363 1.00 0.00 C ATOM 1136 CG PRO P 369 0.279 5.419 6.210 1.00 0.00 C ATOM 1137 CD PRO P 369 0.360 6.522 5.212 1.00 0.00 C ATOM 0 HA PRO P 369 0.016 7.634 8.120 1.00 0.00 H new ATOM 0 HB2 PRO P 369 2.167 5.666 7.197 1.00 0.00 H new ATOM 0 HB3 PRO P 369 0.827 5.357 8.283 1.00 0.00 H new ATOM 0 HG2 PRO P 369 0.657 4.485 5.795 1.00 0.00 H new ATOM 0 HG3 PRO P 369 -0.752 5.239 6.514 1.00 0.00 H new ATOM 0 HD2 PRO P 369 1.188 6.378 4.518 1.00 0.00 H new ATOM 0 HD3 PRO P 369 -0.548 6.592 4.614 1.00 0.00 H new ATOM 1145 N SER P 370 2.297 7.925 9.299 1.00 0.00 N ATOM 1146 CA SER P 370 3.416 8.586 9.959 1.00 0.00 C ATOM 1147 C SER P 370 4.688 7.745 9.883 1.00 0.00 C ATOM 1148 O SER P 370 5.584 7.890 10.715 1.00 0.00 O ATOM 1149 CB SER P 370 3.071 8.874 11.422 1.00 0.00 C ATOM 1150 OG SER P 370 2.481 10.153 11.566 1.00 0.00 O ATOM 0 H SER P 370 1.747 7.319 9.908 1.00 0.00 H new ATOM 0 HA SER P 370 3.600 9.525 9.437 1.00 0.00 H new ATOM 0 HB2 SER P 370 2.387 8.111 11.794 1.00 0.00 H new ATOM 0 HB3 SER P 370 3.974 8.817 12.030 1.00 0.00 H new ATOM 0 HG SER P 370 2.269 10.311 12.510 1.00 0.00 H new ATOM 1156 N ALA P 371 4.766 6.872 8.879 1.00 0.00 N ATOM 1157 CA ALA P 371 5.932 6.012 8.694 1.00 0.00 C ATOM 1158 C ALA P 371 6.053 4.988 9.819 1.00 0.00 C ATOM 1159 O ALA P 371 5.954 3.787 9.590 1.00 0.00 O ATOM 1160 CB ALA P 371 7.198 6.850 8.597 1.00 0.00 C ATOM 0 H ALA P 371 4.034 6.742 8.181 1.00 0.00 H new ATOM 0 HA ALA P 371 5.800 5.465 7.760 1.00 0.00 H new ATOM 0 HB1 ALA P 371 8.058 6.195 8.459 1.00 0.00 H new ATOM 0 HB2 ALA P 371 7.120 7.530 7.749 1.00 0.00 H new ATOM 0 HB3 ALA P 371 7.324 7.426 9.514 1.00 0.00 H new ATOM 1166 N ASP P 372 6.271 5.464 11.036 1.00 0.00 N ATOM 1167 CA ASP P 372 6.406 4.571 12.184 1.00 0.00 C ATOM 1168 C ASP P 372 5.243 3.591 12.258 1.00 0.00 C ATOM 1169 O ASP P 372 5.462 2.381 12.279 1.00 0.00 O ATOM 1170 CB ASP P 372 6.511 5.372 13.483 1.00 0.00 C ATOM 1171 CG ASP P 372 7.040 4.540 14.634 1.00 0.00 C ATOM 1172 OD1 ASP P 372 6.447 3.479 14.921 1.00 0.00 O ATOM 1173 OD2 ASP P 372 8.048 4.949 15.248 1.00 0.00 O ATOM 0 H ASP P 372 6.358 6.456 11.256 1.00 0.00 H new ATOM 0 HA ASP P 372 7.324 3.998 12.054 1.00 0.00 H new ATOM 0 HB2 ASP P 372 7.166 6.229 13.326 1.00 0.00 H new ATOM 0 HB3 ASP P 372 5.529 5.766 13.744 1.00 0.00 H new ATOM 1178 N LEU P 373 4.001 4.089 12.280 1.00 0.00 N ATOM 1179 CA LEU P 373 2.862 3.178 12.329 1.00 0.00 C ATOM 1180 C LEU P 373 2.980 2.189 11.182 1.00 0.00 C ATOM 1181 O LEU P 373 2.592 1.027 11.305 1.00 0.00 O ATOM 1182 CB LEU P 373 1.508 3.914 12.320 1.00 0.00 C ATOM 1183 CG LEU P 373 1.056 4.568 11.006 1.00 0.00 C ATOM 1184 CD1 LEU P 373 0.946 3.559 9.876 1.00 0.00 C ATOM 1185 CD2 LEU P 373 -0.290 5.238 11.211 1.00 0.00 C ATOM 0 H LEU P 373 3.768 5.082 12.265 1.00 0.00 H new ATOM 0 HA LEU P 373 2.886 2.640 13.277 1.00 0.00 H new ATOM 0 HB2 LEU P 373 0.739 3.203 12.622 1.00 0.00 H new ATOM 0 HB3 LEU P 373 1.544 4.690 13.085 1.00 0.00 H new ATOM 0 HG LEU P 373 1.810 5.303 10.726 1.00 0.00 H new ATOM 0 HD11 LEU P 373 0.624 4.065 8.966 1.00 0.00 H new ATOM 0 HD12 LEU P 373 1.917 3.094 9.708 1.00 0.00 H new ATOM 0 HD13 LEU P 373 0.218 2.793 10.142 1.00 0.00 H new ATOM 0 HD21 LEU P 373 -0.611 5.702 10.279 1.00 0.00 H new ATOM 0 HD22 LEU P 373 -1.024 4.493 11.517 1.00 0.00 H new ATOM 0 HD23 LEU P 373 -0.203 6.001 11.985 1.00 0.00 H new ATOM 1197 N ILE P 374 3.582 2.644 10.081 1.00 0.00 N ATOM 1198 CA ILE P 374 3.816 1.780 8.943 1.00 0.00 C ATOM 1199 C ILE P 374 4.820 0.733 9.378 1.00 0.00 C ATOM 1200 O ILE P 374 4.607 -0.466 9.224 1.00 0.00 O ATOM 1201 CB ILE P 374 4.380 2.549 7.729 1.00 0.00 C ATOM 1202 CG1 ILE P 374 3.398 3.624 7.268 1.00 0.00 C ATOM 1203 CG2 ILE P 374 4.694 1.594 6.595 1.00 0.00 C ATOM 1204 CD1 ILE P 374 3.899 4.425 6.084 1.00 0.00 C ATOM 0 H ILE P 374 3.911 3.602 9.962 1.00 0.00 H new ATOM 0 HA ILE P 374 2.870 1.339 8.630 1.00 0.00 H new ATOM 0 HB ILE P 374 5.305 3.039 8.033 1.00 0.00 H new ATOM 0 HG12 ILE P 374 2.451 3.152 7.004 1.00 0.00 H new ATOM 0 HG13 ILE P 374 3.196 4.302 8.097 1.00 0.00 H new ATOM 0 HG21 ILE P 374 5.091 2.153 5.748 1.00 0.00 H new ATOM 0 HG22 ILE P 374 5.434 0.865 6.927 1.00 0.00 H new ATOM 0 HG23 ILE P 374 3.784 1.075 6.294 1.00 0.00 H new ATOM 0 HD11 ILE P 374 3.154 5.171 5.808 1.00 0.00 H new ATOM 0 HD12 ILE P 374 4.831 4.924 6.350 1.00 0.00 H new ATOM 0 HD13 ILE P 374 4.074 3.757 5.241 1.00 0.00 H new ATOM 1216 N LEU P 375 5.896 1.219 9.981 1.00 0.00 N ATOM 1217 CA LEU P 375 6.933 0.359 10.513 1.00 0.00 C ATOM 1218 C LEU P 375 6.326 -0.587 11.542 1.00 0.00 C ATOM 1219 O LEU P 375 6.851 -1.669 11.808 1.00 0.00 O ATOM 1220 CB LEU P 375 8.037 1.227 11.128 1.00 0.00 C ATOM 1221 CG LEU P 375 8.770 2.104 10.113 1.00 0.00 C ATOM 1222 CD1 LEU P 375 9.081 3.474 10.697 1.00 0.00 C ATOM 1223 CD2 LEU P 375 10.054 1.436 9.640 1.00 0.00 C ATOM 0 H LEU P 375 6.070 2.215 10.113 1.00 0.00 H new ATOM 0 HA LEU P 375 7.374 -0.244 9.720 1.00 0.00 H new ATOM 0 HB2 LEU P 375 7.599 1.865 11.896 1.00 0.00 H new ATOM 0 HB3 LEU P 375 8.760 0.580 11.625 1.00 0.00 H new ATOM 0 HG LEU P 375 8.109 2.234 9.256 1.00 0.00 H new ATOM 0 HD11 LEU P 375 9.602 4.077 9.953 1.00 0.00 H new ATOM 0 HD12 LEU P 375 8.152 3.969 10.978 1.00 0.00 H new ATOM 0 HD13 LEU P 375 9.712 3.359 11.578 1.00 0.00 H new ATOM 0 HD21 LEU P 375 10.555 2.081 8.919 1.00 0.00 H new ATOM 0 HD22 LEU P 375 10.711 1.266 10.493 1.00 0.00 H new ATOM 0 HD23 LEU P 375 9.816 0.482 9.169 1.00 0.00 H new ATOM 1235 N ASN P 376 5.193 -0.165 12.089 1.00 0.00 N ATOM 1236 CA ASN P 376 4.453 -0.943 13.063 1.00 0.00 C ATOM 1237 C ASN P 376 3.431 -1.842 12.368 1.00 0.00 C ATOM 1238 O ASN P 376 2.948 -2.814 12.948 1.00 0.00 O ATOM 1239 CB ASN P 376 3.729 0.002 14.025 1.00 0.00 C ATOM 1240 CG ASN P 376 3.979 -0.345 15.480 1.00 0.00 C ATOM 1241 OD1 ASN P 376 4.548 -1.391 15.792 1.00 0.00 O ATOM 1242 ND2 ASN P 376 3.551 0.534 16.379 1.00 0.00 N ATOM 0 H ASN P 376 4.763 0.732 11.865 1.00 0.00 H new ATOM 0 HA ASN P 376 5.153 -1.570 13.615 1.00 0.00 H new ATOM 0 HB2 ASN P 376 4.055 1.025 13.838 1.00 0.00 H new ATOM 0 HB3 ASN P 376 2.658 -0.033 13.826 1.00 0.00 H new ATOM 0 HD21 ASN P 376 3.689 0.355 17.374 1.00 0.00 H new ATOM 0 HD22 ASN P 376 3.084 1.388 16.075 1.00 0.00 H new ATOM 1249 N ARG P 377 3.078 -1.485 11.130 1.00 0.00 N ATOM 1250 CA ARG P 377 2.081 -2.234 10.375 1.00 0.00 C ATOM 1251 C ARG P 377 2.534 -2.546 8.939 1.00 0.00 C ATOM 1252 O ARG P 377 1.718 -2.539 8.020 1.00 0.00 O ATOM 1253 CB ARG P 377 0.767 -1.434 10.336 1.00 0.00 C ATOM 1254 CG ARG P 377 0.407 -0.765 11.661 1.00 0.00 C ATOM 1255 CD ARG P 377 -0.205 0.620 11.462 1.00 0.00 C ATOM 1256 NE ARG P 377 -1.470 0.764 12.179 1.00 0.00 N ATOM 1257 CZ ARG P 377 -1.560 0.922 13.498 1.00 0.00 C ATOM 1258 NH1 ARG P 377 -0.464 0.959 14.246 1.00 0.00 N ATOM 1259 NH2 ARG P 377 -2.750 1.043 14.071 1.00 0.00 N ATOM 0 H ARG P 377 3.469 -0.684 10.634 1.00 0.00 H new ATOM 0 HA ARG P 377 1.938 -3.188 10.882 1.00 0.00 H new ATOM 0 HB2 ARG P 377 0.842 -0.669 9.563 1.00 0.00 H new ATOM 0 HB3 ARG P 377 -0.044 -2.102 10.046 1.00 0.00 H new ATOM 0 HG2 ARG P 377 -0.296 -1.396 12.205 1.00 0.00 H new ATOM 0 HG3 ARG P 377 1.302 -0.680 12.278 1.00 0.00 H new ATOM 0 HD2 ARG P 377 0.496 1.380 11.807 1.00 0.00 H new ATOM 0 HD3 ARG P 377 -0.368 0.796 10.399 1.00 0.00 H new ATOM 0 HE ARG P 377 -2.334 0.742 11.638 1.00 0.00 H new ATOM 0 HH11 ARG P 377 0.454 0.866 13.811 1.00 0.00 H new ATOM 0 HH12 ARG P 377 -0.540 1.080 15.256 1.00 0.00 H new ATOM 0 HH21 ARG P 377 -3.596 1.015 13.501 1.00 0.00 H new ATOM 0 HH22 ARG P 377 -2.820 1.164 15.081 1.00 0.00 H new ATOM 1273 N CYS P 378 3.825 -2.832 8.743 1.00 0.00 N ATOM 1274 CA CYS P 378 4.330 -3.154 7.400 1.00 0.00 C ATOM 1275 C CYS P 378 5.516 -4.111 7.445 1.00 0.00 C ATOM 1276 O CYS P 378 5.933 -4.563 8.512 1.00 0.00 O ATOM 1277 CB CYS P 378 4.743 -1.888 6.643 1.00 0.00 C ATOM 1278 SG CYS P 378 3.418 -1.144 5.672 1.00 0.00 S ATOM 0 H CYS P 378 4.530 -2.848 9.480 1.00 0.00 H new ATOM 0 HA CYS P 378 3.508 -3.642 6.876 1.00 0.00 H new ATOM 0 HB2 CYS P 378 5.110 -1.153 7.359 1.00 0.00 H new ATOM 0 HB3 CYS P 378 5.573 -2.129 5.979 1.00 0.00 H new ATOM 0 HG CYS P 378 3.540 -1.499 4.427 1.00 0.00 H new ATOM 1284 N SER P 379 6.057 -4.402 6.262 1.00 0.00 N ATOM 1285 CA SER P 379 7.204 -5.292 6.129 1.00 0.00 C ATOM 1286 C SER P 379 8.506 -4.509 6.260 1.00 0.00 C ATOM 1287 O SER P 379 8.506 -3.279 6.209 1.00 0.00 O ATOM 1288 CB SER P 379 7.163 -6.008 4.774 1.00 0.00 C ATOM 1289 OG SER P 379 6.558 -7.283 4.888 1.00 0.00 O ATOM 0 H SER P 379 5.714 -4.029 5.377 1.00 0.00 H new ATOM 0 HA SER P 379 7.159 -6.033 6.927 1.00 0.00 H new ATOM 0 HB2 SER P 379 6.610 -5.403 4.056 1.00 0.00 H new ATOM 0 HB3 SER P 379 8.176 -6.116 4.386 1.00 0.00 H new ATOM 0 HG SER P 379 5.783 -7.332 4.290 1.00 0.00 H new ATOM 1295 N GLU P 380 9.612 -5.224 6.427 1.00 0.00 N ATOM 1296 CA GLU P 380 10.915 -4.586 6.563 1.00 0.00 C ATOM 1297 C GLU P 380 11.278 -3.821 5.295 1.00 0.00 C ATOM 1298 O GLU P 380 11.994 -2.820 5.345 1.00 0.00 O ATOM 1299 CB GLU P 380 11.990 -5.631 6.869 1.00 0.00 C ATOM 1300 CG GLU P 380 11.926 -6.172 8.288 1.00 0.00 C ATOM 1301 CD GLU P 380 12.943 -5.523 9.206 1.00 0.00 C ATOM 1302 OE1 GLU P 380 14.051 -5.198 8.731 1.00 0.00 O ATOM 1303 OE2 GLU P 380 12.629 -5.337 10.401 1.00 0.00 O ATOM 0 H GLU P 380 9.633 -6.243 6.471 1.00 0.00 H new ATOM 0 HA GLU P 380 10.862 -3.879 7.391 1.00 0.00 H new ATOM 0 HB2 GLU P 380 11.889 -6.460 6.168 1.00 0.00 H new ATOM 0 HB3 GLU P 380 12.972 -5.189 6.701 1.00 0.00 H new ATOM 0 HG2 GLU P 380 10.925 -6.011 8.689 1.00 0.00 H new ATOM 0 HG3 GLU P 380 12.093 -7.249 8.270 1.00 0.00 H new ATOM 1310 N SER P 381 10.779 -4.296 4.158 1.00 0.00 N ATOM 1311 CA SER P 381 11.052 -3.653 2.878 1.00 0.00 C ATOM 1312 C SER P 381 10.527 -2.221 2.869 1.00 0.00 C ATOM 1313 O SER P 381 11.305 -1.267 2.838 1.00 0.00 O ATOM 1314 CB SER P 381 10.418 -4.451 1.736 1.00 0.00 C ATOM 1315 OG SER P 381 11.014 -4.123 0.493 1.00 0.00 O ATOM 0 H SER P 381 10.184 -5.123 4.097 1.00 0.00 H new ATOM 0 HA SER P 381 12.132 -3.626 2.734 1.00 0.00 H new ATOM 0 HB2 SER P 381 10.531 -5.518 1.927 1.00 0.00 H new ATOM 0 HB3 SER P 381 9.348 -4.246 1.695 1.00 0.00 H new ATOM 0 HG SER P 381 10.980 -4.901 -0.102 1.00 0.00 H new ATOM 1321 N THR P 382 9.204 -2.072 2.907 1.00 0.00 N ATOM 1322 CA THR P 382 8.587 -0.749 2.913 1.00 0.00 C ATOM 1323 C THR P 382 9.113 0.075 4.081 1.00 0.00 C ATOM 1324 O THR P 382 9.286 1.288 3.974 1.00 0.00 O ATOM 1325 CB THR P 382 7.063 -0.866 3.006 1.00 0.00 C ATOM 1326 OG1 THR P 382 6.533 -1.478 1.844 1.00 0.00 O ATOM 1327 CG2 THR P 382 6.365 0.469 3.177 1.00 0.00 C ATOM 0 H THR P 382 8.542 -2.848 2.934 1.00 0.00 H new ATOM 0 HA THR P 382 8.845 -0.248 1.980 1.00 0.00 H new ATOM 0 HB THR P 382 6.878 -1.472 3.893 1.00 0.00 H new ATOM 0 HG1 THR P 382 5.558 -1.543 1.924 1.00 0.00 H new ATOM 0 HG21 THR P 382 5.288 0.312 3.236 1.00 0.00 H new ATOM 0 HG22 THR P 382 6.712 0.947 4.093 1.00 0.00 H new ATOM 0 HG23 THR P 382 6.592 1.110 2.325 1.00 0.00 H new ATOM 1335 N LYS P 383 9.363 -0.599 5.196 1.00 0.00 N ATOM 1336 CA LYS P 383 9.870 0.059 6.392 1.00 0.00 C ATOM 1337 C LYS P 383 11.142 0.844 6.090 1.00 0.00 C ATOM 1338 O LYS P 383 11.336 1.952 6.592 1.00 0.00 O ATOM 1339 CB LYS P 383 10.146 -0.978 7.482 1.00 0.00 C ATOM 1340 CG LYS P 383 8.951 -1.230 8.382 1.00 0.00 C ATOM 1341 CD LYS P 383 9.036 -2.578 9.072 1.00 0.00 C ATOM 1342 CE LYS P 383 10.154 -2.605 10.101 1.00 0.00 C ATOM 1343 NZ LYS P 383 10.424 -3.983 10.595 1.00 0.00 N ATOM 0 H LYS P 383 9.222 -1.604 5.297 1.00 0.00 H new ATOM 0 HA LYS P 383 9.111 0.759 6.741 1.00 0.00 H new ATOM 0 HB2 LYS P 383 10.445 -1.916 7.015 1.00 0.00 H new ATOM 0 HB3 LYS P 383 10.986 -0.642 8.090 1.00 0.00 H new ATOM 0 HG2 LYS P 383 8.889 -0.442 9.132 1.00 0.00 H new ATOM 0 HG3 LYS P 383 8.036 -1.181 7.792 1.00 0.00 H new ATOM 0 HD2 LYS P 383 8.086 -2.800 9.559 1.00 0.00 H new ATOM 0 HD3 LYS P 383 9.204 -3.358 8.330 1.00 0.00 H new ATOM 0 HE2 LYS P 383 11.062 -2.193 9.661 1.00 0.00 H new ATOM 0 HE3 LYS P 383 9.889 -1.964 10.942 1.00 0.00 H new ATOM 0 HZ1 LYS P 383 10.065 -4.080 11.566 1.00 0.00 H new ATOM 0 HZ2 LYS P 383 9.947 -4.672 9.979 1.00 0.00 H new ATOM 0 HZ3 LYS P 383 11.449 -4.161 10.585 1.00 0.00 H new ATOM 1357 N ARG P 384 12.005 0.263 5.263 1.00 0.00 N ATOM 1358 CA ARG P 384 13.260 0.906 4.889 1.00 0.00 C ATOM 1359 C ARG P 384 13.008 2.204 4.123 1.00 0.00 C ATOM 1360 O ARG P 384 13.909 3.030 3.977 1.00 0.00 O ATOM 1361 CB ARG P 384 14.108 -0.043 4.041 1.00 0.00 C ATOM 1362 CG ARG P 384 14.854 -1.086 4.858 1.00 0.00 C ATOM 1363 CD ARG P 384 16.354 -1.023 4.612 1.00 0.00 C ATOM 1364 NE ARG P 384 17.045 -0.243 5.636 1.00 0.00 N ATOM 1365 CZ ARG P 384 18.277 0.239 5.495 1.00 0.00 C ATOM 1366 NH1 ARG P 384 18.957 0.026 4.374 1.00 0.00 N ATOM 1367 NH2 ARG P 384 18.831 0.939 6.476 1.00 0.00 N ATOM 0 H ARG P 384 11.858 -0.653 4.839 1.00 0.00 H new ATOM 0 HA ARG P 384 13.799 1.149 5.805 1.00 0.00 H new ATOM 0 HB2 ARG P 384 13.463 -0.549 3.322 1.00 0.00 H new ATOM 0 HB3 ARG P 384 14.828 0.541 3.467 1.00 0.00 H new ATOM 0 HG2 ARG P 384 14.652 -0.931 5.918 1.00 0.00 H new ATOM 0 HG3 ARG P 384 14.485 -2.080 4.605 1.00 0.00 H new ATOM 0 HD2 ARG P 384 16.761 -2.034 4.591 1.00 0.00 H new ATOM 0 HD3 ARG P 384 16.542 -0.583 3.633 1.00 0.00 H new ATOM 0 HE ARG P 384 16.554 -0.057 6.510 1.00 0.00 H new ATOM 0 HH11 ARG P 384 18.535 -0.510 3.615 1.00 0.00 H new ATOM 0 HH12 ARG P 384 19.901 0.398 4.272 1.00 0.00 H new ATOM 0 HH21 ARG P 384 18.313 1.108 7.338 1.00 0.00 H new ATOM 0 HH22 ARG P 384 19.776 1.309 6.368 1.00 0.00 H new ATOM 1381 N LYS P 385 11.783 2.378 3.632 1.00 0.00 N ATOM 1382 CA LYS P 385 11.426 3.575 2.880 1.00 0.00 C ATOM 1383 C LYS P 385 10.785 4.629 3.784 1.00 0.00 C ATOM 1384 O LYS P 385 9.997 5.456 3.326 1.00 0.00 O ATOM 1385 CB LYS P 385 10.481 3.213 1.732 1.00 0.00 C ATOM 1386 CG LYS P 385 11.208 2.742 0.482 1.00 0.00 C ATOM 1387 CD LYS P 385 10.261 2.115 -0.529 1.00 0.00 C ATOM 1388 CE LYS P 385 9.797 0.739 -0.081 1.00 0.00 C ATOM 1389 NZ LYS P 385 10.182 -0.320 -1.054 1.00 0.00 N ATOM 0 H LYS P 385 11.024 1.706 3.742 1.00 0.00 H new ATOM 0 HA LYS P 385 12.341 4.001 2.468 1.00 0.00 H new ATOM 0 HB2 LYS P 385 9.799 2.430 2.065 1.00 0.00 H new ATOM 0 HB3 LYS P 385 9.872 4.082 1.484 1.00 0.00 H new ATOM 0 HG2 LYS P 385 11.721 3.586 0.022 1.00 0.00 H new ATOM 0 HG3 LYS P 385 11.973 2.017 0.760 1.00 0.00 H new ATOM 0 HD2 LYS P 385 9.396 2.764 -0.669 1.00 0.00 H new ATOM 0 HD3 LYS P 385 10.760 2.035 -1.495 1.00 0.00 H new ATOM 0 HE2 LYS P 385 10.227 0.510 0.894 1.00 0.00 H new ATOM 0 HE3 LYS P 385 8.714 0.743 0.042 1.00 0.00 H new ATOM 0 HZ1 LYS P 385 10.523 -1.157 -0.539 1.00 0.00 H new ATOM 0 HZ2 LYS P 385 9.355 -0.580 -1.629 1.00 0.00 H new ATOM 0 HZ3 LYS P 385 10.937 0.036 -1.674 1.00 0.00 H new ATOM 1403 N LEU P 386 11.137 4.597 5.068 1.00 0.00 N ATOM 1404 CA LEU P 386 10.608 5.553 6.037 1.00 0.00 C ATOM 1405 C LEU P 386 11.368 5.459 7.358 1.00 0.00 C ATOM 1406 O LEU P 386 10.791 5.635 8.431 1.00 0.00 O ATOM 1407 CB LEU P 386 9.111 5.320 6.281 1.00 0.00 C ATOM 1408 CG LEU P 386 8.634 3.875 6.118 1.00 0.00 C ATOM 1409 CD1 LEU P 386 7.709 3.490 7.259 1.00 0.00 C ATOM 1410 CD2 LEU P 386 7.927 3.691 4.785 1.00 0.00 C ATOM 0 H LEU P 386 11.788 3.917 5.461 1.00 0.00 H new ATOM 0 HA LEU P 386 10.741 6.552 5.622 1.00 0.00 H new ATOM 0 HB2 LEU P 386 8.869 5.652 7.291 1.00 0.00 H new ATOM 0 HB3 LEU P 386 8.546 5.950 5.594 1.00 0.00 H new ATOM 0 HG LEU P 386 9.507 3.223 6.140 1.00 0.00 H new ATOM 0 HD11 LEU P 386 7.379 2.460 7.128 1.00 0.00 H new ATOM 0 HD12 LEU P 386 8.241 3.583 8.206 1.00 0.00 H new ATOM 0 HD13 LEU P 386 6.842 4.151 7.264 1.00 0.00 H new ATOM 0 HD21 LEU P 386 7.596 2.657 4.689 1.00 0.00 H new ATOM 0 HD22 LEU P 386 7.064 4.355 4.736 1.00 0.00 H new ATOM 0 HD23 LEU P 386 8.614 3.929 3.973 1.00 0.00 H new