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 34:sc= 1.1 USER MOD Set 1.2: S 472 GLN : amide:sc= 0.275 K(o=1.4,f=-4.3!) USER MOD Set 2.1: P 382 THR OG1 : rot 136:sc= -4.84! USER MOD Set 2.2: P 385 LYS NZ :NH3+ 134:sc= -2.99! (180deg=-6.25!) USER MOD Single : P 360 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 362 GLN : amide:sc= 0.841 K(o=0.84,f=-6.9!) USER MOD Single : P 370 SER OG : rot 180:sc= 0 USER MOD Single : P 376 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : P 378 CYS SG : rot 14:sc= -7.44 USER MOD Single : P 379 SER OG : rot 87:sc= 0.582 USER MOD Single : P 381 SER OG : rot 170:sc= -0.0513 USER MOD Single : P 383 LYS NZ :NH3+ -163:sc= 1.21 (180deg=0.237) USER MOD Single : S 460 SER OG : rot 180:sc= -0.04 USER MOD Single : S 461 GLN : amide:sc= -0.116 X(o=-0.12,f=0) USER MOD Single : S 467 SER OG : rot 180:sc= -0.73 USER MOD Single : S 468 TYR OH : rot -99:sc= 0.609 USER MOD Single : S 479 GLN : amide:sc= -0.301 X(o=-0.3,f=-0.16) 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= -6.54! C(o=-6.5!,f=-14!) USER MOD Single : S 499 SER OG : rot 180:sc= -0.0106 USER MOD Single : S 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 502 LYS NZ :NH3+ 165:sc=-0.00199 (180deg=-0.0851) USER MOD Single : S 508 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 90 N SER S 460 -4.170 -9.959 2.553 1.00 0.00 N ATOM 91 CA SER S 460 -5.360 -10.136 1.729 1.00 0.00 C ATOM 92 C SER S 460 -5.224 -9.373 0.418 1.00 0.00 C ATOM 93 O SER S 460 -4.150 -8.867 0.099 1.00 0.00 O ATOM 94 CB SER S 460 -6.599 -9.659 2.486 1.00 0.00 C ATOM 95 OG SER S 460 -6.861 -8.289 2.235 1.00 0.00 O ATOM 0 HA SER S 460 -5.467 -11.197 1.502 1.00 0.00 H new ATOM 0 HB2 SER S 460 -7.461 -10.256 2.190 1.00 0.00 H new ATOM 0 HB3 SER S 460 -6.456 -9.814 3.555 1.00 0.00 H new ATOM 0 HG SER S 460 -7.660 -8.012 2.731 1.00 0.00 H new ATOM 101 N GLN S 461 -6.315 -9.282 -0.336 1.00 0.00 N ATOM 102 CA GLN S 461 -6.300 -8.565 -1.609 1.00 0.00 C ATOM 103 C GLN S 461 -7.436 -7.555 -1.673 1.00 0.00 C ATOM 104 O GLN S 461 -8.320 -7.542 -0.817 1.00 0.00 O ATOM 105 CB GLN S 461 -6.407 -9.534 -2.790 1.00 0.00 C ATOM 106 CG GLN S 461 -5.805 -10.905 -2.521 1.00 0.00 C ATOM 107 CD GLN S 461 -6.860 -11.960 -2.251 1.00 0.00 C ATOM 108 OE1 GLN S 461 -7.416 -12.550 -3.177 1.00 0.00 O ATOM 109 NE2 GLN S 461 -7.139 -12.204 -0.975 1.00 0.00 N ATOM 0 H GLN S 461 -7.216 -9.693 -0.091 1.00 0.00 H new ATOM 0 HA GLN S 461 -5.349 -8.036 -1.676 1.00 0.00 H new ATOM 0 HB2 GLN S 461 -7.458 -9.655 -3.053 1.00 0.00 H new ATOM 0 HB3 GLN S 461 -5.910 -9.094 -3.654 1.00 0.00 H new ATOM 0 HG2 GLN S 461 -5.203 -11.208 -3.378 1.00 0.00 H new ATOM 0 HG3 GLN S 461 -5.132 -10.841 -1.666 1.00 0.00 H new ATOM 0 HE21 GLN S 461 -6.653 -11.691 -0.240 1.00 0.00 H new ATOM 0 HE22 GLN S 461 -7.839 -12.905 -0.731 1.00 0.00 H new ATOM 118 N VAL S 462 -7.402 -6.704 -2.693 1.00 0.00 N ATOM 119 CA VAL S 462 -8.428 -5.682 -2.861 1.00 0.00 C ATOM 120 C VAL S 462 -8.506 -5.157 -4.299 1.00 0.00 C ATOM 121 O VAL S 462 -9.486 -4.515 -4.673 1.00 0.00 O ATOM 122 CB VAL S 462 -8.182 -4.492 -1.914 1.00 0.00 C ATOM 123 CG1 VAL S 462 -8.565 -4.852 -0.488 1.00 0.00 C ATOM 124 CG2 VAL S 462 -6.731 -4.044 -1.989 1.00 0.00 C ATOM 0 H VAL S 462 -6.679 -6.701 -3.412 1.00 0.00 H new ATOM 0 HA VAL S 462 -9.375 -6.164 -2.618 1.00 0.00 H new ATOM 0 HB VAL S 462 -8.812 -3.662 -2.233 1.00 0.00 H new ATOM 0 HG11 VAL S 462 -8.383 -3.998 0.164 1.00 0.00 H new ATOM 0 HG12 VAL S 462 -9.621 -5.119 -0.451 1.00 0.00 H new ATOM 0 HG13 VAL S 462 -7.965 -5.698 -0.153 1.00 0.00 H new ATOM 0 HG21 VAL S 462 -6.575 -3.203 -1.314 1.00 0.00 H new ATOM 0 HG22 VAL S 462 -6.080 -4.869 -1.698 1.00 0.00 H new ATOM 0 HG23 VAL S 462 -6.497 -3.739 -3.009 1.00 0.00 H new ATOM 134 N GLU S 463 -7.475 -5.428 -5.100 1.00 0.00 N ATOM 135 CA GLU S 463 -7.436 -4.977 -6.482 1.00 0.00 C ATOM 136 C GLU S 463 -7.520 -3.460 -6.581 1.00 0.00 C ATOM 137 O GLU S 463 -8.229 -2.812 -5.813 1.00 0.00 O ATOM 138 CB GLU S 463 -8.554 -5.627 -7.285 1.00 0.00 C ATOM 139 CG GLU S 463 -8.061 -6.808 -8.086 1.00 0.00 C ATOM 140 CD GLU S 463 -9.169 -7.509 -8.848 1.00 0.00 C ATOM 141 OE1 GLU S 463 -10.126 -6.825 -9.265 1.00 0.00 O ATOM 142 OE2 GLU S 463 -9.078 -8.742 -9.030 1.00 0.00 O ATOM 0 H GLU S 463 -6.655 -5.960 -4.809 1.00 0.00 H new ATOM 0 HA GLU S 463 -6.477 -5.281 -6.902 1.00 0.00 H new ATOM 0 HB2 GLU S 463 -9.345 -5.952 -6.609 1.00 0.00 H new ATOM 0 HB3 GLU S 463 -8.993 -4.890 -7.958 1.00 0.00 H new ATOM 0 HG2 GLU S 463 -7.300 -6.471 -8.790 1.00 0.00 H new ATOM 0 HG3 GLU S 463 -7.581 -7.521 -7.415 1.00 0.00 H new ATOM 149 N ALA S 464 -6.780 -2.900 -7.533 1.00 0.00 N ATOM 150 CA ALA S 464 -6.761 -1.458 -7.730 1.00 0.00 C ATOM 151 C ALA S 464 -7.816 -1.014 -8.735 1.00 0.00 C ATOM 152 O ALA S 464 -8.396 -1.830 -9.448 1.00 0.00 O ATOM 153 CB ALA S 464 -5.381 -1.008 -8.182 1.00 0.00 C ATOM 0 H ALA S 464 -6.188 -3.423 -8.178 1.00 0.00 H new ATOM 0 HA ALA S 464 -6.996 -0.989 -6.774 1.00 0.00 H new ATOM 0 HB1 ALA S 464 -5.380 0.072 -8.326 1.00 0.00 H new ATOM 0 HB2 ALA S 464 -4.645 -1.274 -7.423 1.00 0.00 H new ATOM 0 HB3 ALA S 464 -5.128 -1.499 -9.121 1.00 0.00 H new ATOM 159 N LEU S 465 -8.048 0.290 -8.786 1.00 0.00 N ATOM 160 CA LEU S 465 -9.022 0.866 -9.709 1.00 0.00 C ATOM 161 C LEU S 465 -8.492 2.146 -10.356 1.00 0.00 C ATOM 162 O LEU S 465 -9.152 2.734 -11.213 1.00 0.00 O ATOM 163 CB LEU S 465 -10.322 1.169 -8.974 1.00 0.00 C ATOM 164 CG LEU S 465 -11.009 -0.050 -8.363 1.00 0.00 C ATOM 165 CD1 LEU S 465 -10.320 -0.452 -7.070 1.00 0.00 C ATOM 166 CD2 LEU S 465 -12.484 0.235 -8.125 1.00 0.00 C ATOM 0 H LEU S 465 -7.573 0.974 -8.197 1.00 0.00 H new ATOM 0 HA LEU S 465 -9.205 0.135 -10.497 1.00 0.00 H new ATOM 0 HB2 LEU S 465 -10.116 1.888 -8.181 1.00 0.00 H new ATOM 0 HB3 LEU S 465 -11.013 1.648 -9.668 1.00 0.00 H new ATOM 0 HG LEU S 465 -10.933 -0.882 -9.063 1.00 0.00 H new ATOM 0 HD11 LEU S 465 -10.821 -1.322 -6.646 1.00 0.00 H new ATOM 0 HD12 LEU S 465 -9.278 -0.697 -7.274 1.00 0.00 H new ATOM 0 HD13 LEU S 465 -10.366 0.374 -6.361 1.00 0.00 H new ATOM 0 HD21 LEU S 465 -12.959 -0.644 -7.689 1.00 0.00 H new ATOM 0 HD22 LEU S 465 -12.586 1.079 -7.442 1.00 0.00 H new ATOM 0 HD23 LEU S 465 -12.966 0.475 -9.073 1.00 0.00 H new ATOM 178 N PHE S 466 -7.306 2.584 -9.937 1.00 0.00 N ATOM 179 CA PHE S 466 -6.709 3.799 -10.473 1.00 0.00 C ATOM 180 C PHE S 466 -5.198 3.674 -10.598 1.00 0.00 C ATOM 181 O PHE S 466 -4.593 2.725 -10.103 1.00 0.00 O ATOM 182 CB PHE S 466 -7.015 4.980 -9.558 1.00 0.00 C ATOM 183 CG PHE S 466 -8.462 5.124 -9.208 1.00 0.00 C ATOM 184 CD1 PHE S 466 -9.338 5.715 -10.098 1.00 0.00 C ATOM 185 CD2 PHE S 466 -8.944 4.685 -7.983 1.00 0.00 C ATOM 186 CE1 PHE S 466 -10.669 5.869 -9.778 1.00 0.00 C ATOM 187 CE2 PHE S 466 -10.275 4.840 -7.658 1.00 0.00 C ATOM 188 CZ PHE S 466 -11.136 5.434 -8.559 1.00 0.00 C ATOM 0 H PHE S 466 -6.742 2.114 -9.229 1.00 0.00 H new ATOM 0 HA PHE S 466 -7.136 3.958 -11.463 1.00 0.00 H new ATOM 0 HB2 PHE S 466 -6.439 4.872 -8.639 1.00 0.00 H new ATOM 0 HB3 PHE S 466 -6.676 5.897 -10.041 1.00 0.00 H new ATOM 0 HD1 PHE S 466 -8.975 6.060 -11.055 1.00 0.00 H new ATOM 0 HD2 PHE S 466 -8.271 4.218 -7.279 1.00 0.00 H new ATOM 0 HE1 PHE S 466 -11.345 6.330 -10.483 1.00 0.00 H new ATOM 0 HE2 PHE S 466 -10.643 4.498 -6.702 1.00 0.00 H new ATOM 0 HZ PHE S 466 -12.179 5.558 -8.306 1.00 0.00 H new ATOM 198 N SER S 467 -4.596 4.673 -11.234 1.00 0.00 N ATOM 199 CA SER S 467 -3.153 4.723 -11.397 1.00 0.00 C ATOM 200 C SER S 467 -2.590 5.760 -10.439 1.00 0.00 C ATOM 201 O SER S 467 -2.653 6.962 -10.697 1.00 0.00 O ATOM 202 CB SER S 467 -2.781 5.071 -12.839 1.00 0.00 C ATOM 203 OG SER S 467 -2.951 3.952 -13.694 1.00 0.00 O ATOM 0 H SER S 467 -5.092 5.463 -11.647 1.00 0.00 H new ATOM 0 HA SER S 467 -2.729 3.744 -11.173 1.00 0.00 H new ATOM 0 HB2 SER S 467 -3.400 5.897 -13.188 1.00 0.00 H new ATOM 0 HB3 SER S 467 -1.746 5.410 -12.879 1.00 0.00 H new ATOM 0 HG SER S 467 -2.708 4.201 -14.610 1.00 0.00 H new ATOM 209 N TYR S 468 -2.073 5.288 -9.313 1.00 0.00 N ATOM 210 CA TYR S 468 -1.538 6.170 -8.288 1.00 0.00 C ATOM 211 C TYR S 468 -0.137 6.663 -8.632 1.00 0.00 C ATOM 212 O TYR S 468 0.812 5.883 -8.694 1.00 0.00 O ATOM 213 CB TYR S 468 -1.520 5.442 -6.941 1.00 0.00 C ATOM 214 CG TYR S 468 -0.899 6.233 -5.808 1.00 0.00 C ATOM 215 CD1 TYR S 468 -0.737 7.611 -5.895 1.00 0.00 C ATOM 216 CD2 TYR S 468 -0.471 5.595 -4.651 1.00 0.00 C ATOM 217 CE1 TYR S 468 -0.167 8.327 -4.863 1.00 0.00 C ATOM 218 CE2 TYR S 468 0.098 6.308 -3.612 1.00 0.00 C ATOM 219 CZ TYR S 468 0.248 7.673 -3.725 1.00 0.00 C ATOM 220 OH TYR S 468 0.810 8.386 -2.693 1.00 0.00 O ATOM 0 H TYR S 468 -2.013 4.295 -9.087 1.00 0.00 H new ATOM 0 HA TYR S 468 -2.187 7.044 -8.229 1.00 0.00 H new ATOM 0 HB2 TYR S 468 -2.543 5.183 -6.668 1.00 0.00 H new ATOM 0 HB3 TYR S 468 -0.974 4.506 -7.056 1.00 0.00 H new ATOM 0 HD1 TYR S 468 -1.063 8.129 -6.785 1.00 0.00 H new ATOM 0 HD2 TYR S 468 -0.584 4.525 -4.561 1.00 0.00 H new ATOM 0 HE1 TYR S 468 -0.047 9.397 -4.947 1.00 0.00 H new ATOM 0 HE2 TYR S 468 0.423 5.798 -2.717 1.00 0.00 H new ATOM 0 HH TYR S 468 1.786 8.316 -2.740 1.00 0.00 H new ATOM 230 N GLU S 469 -0.016 7.975 -8.826 1.00 0.00 N ATOM 231 CA GLU S 469 1.269 8.585 -9.130 1.00 0.00 C ATOM 232 C GLU S 469 2.139 8.578 -7.881 1.00 0.00 C ATOM 233 O GLU S 469 1.846 9.268 -6.904 1.00 0.00 O ATOM 234 CB GLU S 469 1.080 10.018 -9.634 1.00 0.00 C ATOM 235 CG GLU S 469 2.036 10.401 -10.751 1.00 0.00 C ATOM 236 CD GLU S 469 1.508 11.536 -11.606 1.00 0.00 C ATOM 237 OE1 GLU S 469 0.742 11.260 -12.553 1.00 0.00 O ATOM 238 OE2 GLU S 469 1.860 12.702 -11.328 1.00 0.00 O ATOM 0 H GLU S 469 -0.794 8.633 -8.777 1.00 0.00 H new ATOM 0 HA GLU S 469 1.758 8.010 -9.916 1.00 0.00 H new ATOM 0 HB2 GLU S 469 0.056 10.138 -9.987 1.00 0.00 H new ATOM 0 HB3 GLU S 469 1.213 10.708 -8.801 1.00 0.00 H new ATOM 0 HG2 GLU S 469 2.995 10.691 -10.321 1.00 0.00 H new ATOM 0 HG3 GLU S 469 2.220 9.531 -11.381 1.00 0.00 H new ATOM 245 N ALA S 470 3.194 7.779 -7.910 1.00 0.00 N ATOM 246 CA ALA S 470 4.090 7.660 -6.769 1.00 0.00 C ATOM 247 C ALA S 470 5.219 8.682 -6.833 1.00 0.00 C ATOM 248 O ALA S 470 6.137 8.562 -7.644 1.00 0.00 O ATOM 249 CB ALA S 470 4.644 6.247 -6.693 1.00 0.00 C ATOM 0 H ALA S 470 3.451 7.203 -8.711 1.00 0.00 H new ATOM 0 HA ALA S 470 3.519 7.867 -5.864 1.00 0.00 H new ATOM 0 HB1 ALA S 470 5.314 6.164 -5.837 1.00 0.00 H new ATOM 0 HB2 ALA S 470 3.822 5.540 -6.580 1.00 0.00 H new ATOM 0 HB3 ALA S 470 5.194 6.022 -7.607 1.00 0.00 H new ATOM 255 N THR S 471 5.144 9.685 -5.964 1.00 0.00 N ATOM 256 CA THR S 471 6.158 10.729 -5.908 1.00 0.00 C ATOM 257 C THR S 471 7.136 10.467 -4.766 1.00 0.00 C ATOM 258 O THR S 471 8.303 10.851 -4.835 1.00 0.00 O ATOM 259 CB THR S 471 5.502 12.100 -5.730 1.00 0.00 C ATOM 260 OG1 THR S 471 4.409 12.020 -4.832 1.00 0.00 O ATOM 261 CG2 THR S 471 4.988 12.691 -7.025 1.00 0.00 C ATOM 0 H THR S 471 4.389 9.796 -5.288 1.00 0.00 H new ATOM 0 HA THR S 471 6.709 10.721 -6.848 1.00 0.00 H new ATOM 0 HB THR S 471 6.288 12.747 -5.341 1.00 0.00 H new ATOM 0 HG1 THR S 471 4.601 11.351 -4.142 1.00 0.00 H new ATOM 0 HG21 THR S 471 4.535 13.663 -6.827 1.00 0.00 H new ATOM 0 HG22 THR S 471 5.816 12.812 -7.724 1.00 0.00 H new ATOM 0 HG23 THR S 471 4.242 12.025 -7.458 1.00 0.00 H new ATOM 269 N GLN S 472 6.651 9.802 -3.721 1.00 0.00 N ATOM 270 CA GLN S 472 7.487 9.481 -2.567 1.00 0.00 C ATOM 271 C GLN S 472 7.972 8.033 -2.637 1.00 0.00 C ATOM 272 O GLN S 472 7.434 7.224 -3.391 1.00 0.00 O ATOM 273 CB GLN S 472 6.737 9.730 -1.251 1.00 0.00 C ATOM 274 CG GLN S 472 5.231 9.546 -1.344 1.00 0.00 C ATOM 275 CD GLN S 472 4.514 10.821 -1.737 1.00 0.00 C ATOM 276 OE1 GLN S 472 3.777 10.855 -2.723 1.00 0.00 O ATOM 277 NE2 GLN S 472 4.723 11.881 -0.963 1.00 0.00 N ATOM 0 H GLN S 472 5.687 9.476 -3.649 1.00 0.00 H new ATOM 0 HA GLN S 472 8.355 10.140 -2.592 1.00 0.00 H new ATOM 0 HB2 GLN S 472 7.127 9.054 -0.490 1.00 0.00 H new ATOM 0 HB3 GLN S 472 6.947 10.745 -0.913 1.00 0.00 H new ATOM 0 HG2 GLN S 472 5.008 8.768 -2.074 1.00 0.00 H new ATOM 0 HG3 GLN S 472 4.850 9.200 -0.383 1.00 0.00 H new ATOM 0 HE21 GLN S 472 5.342 11.809 -0.155 1.00 0.00 H new ATOM 0 HE22 GLN S 472 4.265 12.767 -1.177 1.00 0.00 H new ATOM 286 N PRO S 473 9.019 7.700 -1.862 1.00 0.00 N ATOM 287 CA PRO S 473 9.606 6.352 -1.849 1.00 0.00 C ATOM 288 C PRO S 473 8.634 5.249 -1.415 1.00 0.00 C ATOM 289 O PRO S 473 8.102 4.521 -2.253 1.00 0.00 O ATOM 290 CB PRO S 473 10.765 6.472 -0.847 1.00 0.00 C ATOM 291 CG PRO S 473 10.464 7.687 -0.040 1.00 0.00 C ATOM 292 CD PRO S 473 9.732 8.618 -0.959 1.00 0.00 C ATOM 0 HA PRO S 473 9.909 6.054 -2.853 1.00 0.00 H new ATOM 0 HB2 PRO S 473 10.831 5.587 -0.215 1.00 0.00 H new ATOM 0 HB3 PRO S 473 11.721 6.569 -1.361 1.00 0.00 H new ATOM 0 HG2 PRO S 473 9.856 7.438 0.830 1.00 0.00 H new ATOM 0 HG3 PRO S 473 11.380 8.146 0.333 1.00 0.00 H new ATOM 0 HD2 PRO S 473 9.043 9.264 -0.414 1.00 0.00 H new ATOM 0 HD3 PRO S 473 10.416 9.269 -1.503 1.00 0.00 H new ATOM 300 N GLU S 474 8.434 5.108 -0.102 1.00 0.00 N ATOM 301 CA GLU S 474 7.561 4.066 0.451 1.00 0.00 C ATOM 302 C GLU S 474 6.275 3.888 -0.362 1.00 0.00 C ATOM 303 O GLU S 474 5.824 2.764 -0.578 1.00 0.00 O ATOM 304 CB GLU S 474 7.214 4.381 1.909 1.00 0.00 C ATOM 305 CG GLU S 474 6.200 5.501 2.076 1.00 0.00 C ATOM 306 CD GLU S 474 6.730 6.843 1.611 1.00 0.00 C ATOM 307 OE1 GLU S 474 7.789 7.271 2.118 1.00 0.00 O ATOM 308 OE2 GLU S 474 6.086 7.465 0.740 1.00 0.00 O ATOM 0 H GLU S 474 8.867 5.705 0.602 1.00 0.00 H new ATOM 0 HA GLU S 474 8.114 3.128 0.399 1.00 0.00 H new ATOM 0 HB2 GLU S 474 6.825 3.479 2.382 1.00 0.00 H new ATOM 0 HB3 GLU S 474 8.128 4.650 2.439 1.00 0.00 H new ATOM 0 HG2 GLU S 474 5.299 5.256 1.514 1.00 0.00 H new ATOM 0 HG3 GLU S 474 5.912 5.572 3.125 1.00 0.00 H new ATOM 315 N ASP S 475 5.687 4.996 -0.806 1.00 0.00 N ATOM 316 CA ASP S 475 4.456 4.955 -1.583 1.00 0.00 C ATOM 317 C ASP S 475 4.550 3.955 -2.731 1.00 0.00 C ATOM 318 O ASP S 475 5.347 4.124 -3.654 1.00 0.00 O ATOM 319 CB ASP S 475 4.142 6.345 -2.122 1.00 0.00 C ATOM 320 CG ASP S 475 3.279 7.151 -1.171 1.00 0.00 C ATOM 321 OD1 ASP S 475 2.985 6.650 -0.066 1.00 0.00 O ATOM 322 OD2 ASP S 475 2.897 8.283 -1.530 1.00 0.00 O ATOM 0 H ASP S 475 6.047 5.936 -0.639 1.00 0.00 H new ATOM 0 HA ASP S 475 3.651 4.628 -0.925 1.00 0.00 H new ATOM 0 HB2 ASP S 475 5.074 6.880 -2.305 1.00 0.00 H new ATOM 0 HB3 ASP S 475 3.633 6.253 -3.082 1.00 0.00 H new ATOM 327 N LEU S 476 3.721 2.920 -2.667 1.00 0.00 N ATOM 328 CA LEU S 476 3.694 1.893 -3.701 1.00 0.00 C ATOM 329 C LEU S 476 2.896 2.390 -4.901 1.00 0.00 C ATOM 330 O LEU S 476 1.705 2.675 -4.791 1.00 0.00 O ATOM 331 CB LEU S 476 3.082 0.595 -3.151 1.00 0.00 C ATOM 332 CG LEU S 476 2.572 -0.395 -4.207 1.00 0.00 C ATOM 333 CD1 LEU S 476 3.695 -0.815 -5.141 1.00 0.00 C ATOM 334 CD2 LEU S 476 1.949 -1.612 -3.547 1.00 0.00 C ATOM 0 H LEU S 476 3.057 2.770 -1.908 1.00 0.00 H new ATOM 0 HA LEU S 476 4.716 1.683 -4.018 1.00 0.00 H new ATOM 0 HB2 LEU S 476 3.830 0.092 -2.538 1.00 0.00 H new ATOM 0 HB3 LEU S 476 2.253 0.855 -2.492 1.00 0.00 H new ATOM 0 HG LEU S 476 1.805 0.107 -4.797 1.00 0.00 H new ATOM 0 HD11 LEU S 476 3.310 -1.517 -5.881 1.00 0.00 H new ATOM 0 HD12 LEU S 476 4.095 0.063 -5.648 1.00 0.00 H new ATOM 0 HD13 LEU S 476 4.487 -1.293 -4.565 1.00 0.00 H new ATOM 0 HD21 LEU S 476 1.594 -2.300 -4.314 1.00 0.00 H new ATOM 0 HD22 LEU S 476 2.694 -2.111 -2.928 1.00 0.00 H new ATOM 0 HD23 LEU S 476 1.111 -1.299 -2.925 1.00 0.00 H new ATOM 346 N GLU S 477 3.563 2.502 -6.041 1.00 0.00 N ATOM 347 CA GLU S 477 2.917 2.974 -7.259 1.00 0.00 C ATOM 348 C GLU S 477 2.222 1.831 -7.985 1.00 0.00 C ATOM 349 O GLU S 477 2.759 0.728 -8.082 1.00 0.00 O ATOM 350 CB GLU S 477 3.944 3.607 -8.193 1.00 0.00 C ATOM 351 CG GLU S 477 3.383 4.739 -9.034 1.00 0.00 C ATOM 352 CD GLU S 477 4.435 5.391 -9.912 1.00 0.00 C ATOM 353 OE1 GLU S 477 5.234 4.653 -10.525 1.00 0.00 O ATOM 354 OE2 GLU S 477 4.458 6.637 -9.985 1.00 0.00 O ATOM 0 H GLU S 477 4.551 2.273 -6.149 1.00 0.00 H new ATOM 0 HA GLU S 477 2.173 3.718 -6.973 1.00 0.00 H new ATOM 0 HB2 GLU S 477 4.778 3.984 -7.601 1.00 0.00 H new ATOM 0 HB3 GLU S 477 4.344 2.838 -8.854 1.00 0.00 H new ATOM 0 HG2 GLU S 477 2.578 4.356 -9.661 1.00 0.00 H new ATOM 0 HG3 GLU S 477 2.945 5.492 -8.378 1.00 0.00 H new ATOM 361 N PHE S 478 1.033 2.103 -8.508 1.00 0.00 N ATOM 362 CA PHE S 478 0.284 1.085 -9.241 1.00 0.00 C ATOM 363 C PHE S 478 -0.662 1.722 -10.254 1.00 0.00 C ATOM 364 O PHE S 478 -0.989 2.903 -10.154 1.00 0.00 O ATOM 365 CB PHE S 478 -0.498 0.187 -8.281 1.00 0.00 C ATOM 366 CG PHE S 478 -1.160 0.929 -7.159 1.00 0.00 C ATOM 367 CD1 PHE S 478 -0.410 1.451 -6.119 1.00 0.00 C ATOM 368 CD2 PHE S 478 -2.533 1.103 -7.144 1.00 0.00 C ATOM 369 CE1 PHE S 478 -1.018 2.134 -5.084 1.00 0.00 C ATOM 370 CE2 PHE S 478 -3.147 1.783 -6.113 1.00 0.00 C ATOM 371 CZ PHE S 478 -2.389 2.301 -5.080 1.00 0.00 C ATOM 0 H PHE S 478 0.569 3.009 -8.441 1.00 0.00 H new ATOM 0 HA PHE S 478 1.004 0.471 -9.782 1.00 0.00 H new ATOM 0 HB2 PHE S 478 -1.258 -0.355 -8.844 1.00 0.00 H new ATOM 0 HB3 PHE S 478 0.179 -0.557 -7.862 1.00 0.00 H new ATOM 0 HD1 PHE S 478 0.662 1.323 -6.117 1.00 0.00 H new ATOM 0 HD2 PHE S 478 -3.131 0.702 -7.949 1.00 0.00 H new ATOM 0 HE1 PHE S 478 -0.422 2.537 -4.279 1.00 0.00 H new ATOM 0 HE2 PHE S 478 -4.219 1.911 -6.113 1.00 0.00 H new ATOM 0 HZ PHE S 478 -2.867 2.835 -4.272 1.00 0.00 H new ATOM 381 N GLN S 479 -1.091 0.928 -11.231 1.00 0.00 N ATOM 382 CA GLN S 479 -1.995 1.408 -12.271 1.00 0.00 C ATOM 383 C GLN S 479 -3.443 1.063 -11.936 1.00 0.00 C ATOM 384 O GLN S 479 -3.716 0.381 -10.948 1.00 0.00 O ATOM 385 CB GLN S 479 -1.615 0.805 -13.624 1.00 0.00 C ATOM 386 CG GLN S 479 -1.576 -0.715 -13.622 1.00 0.00 C ATOM 387 CD GLN S 479 -2.160 -1.315 -14.887 1.00 0.00 C ATOM 388 OE1 GLN S 479 -1.593 -1.177 -15.971 1.00 0.00 O ATOM 389 NE2 GLN S 479 -3.298 -1.983 -14.753 1.00 0.00 N ATOM 0 H GLN S 479 -0.826 -0.053 -11.324 1.00 0.00 H new ATOM 0 HA GLN S 479 -1.902 2.493 -12.325 1.00 0.00 H new ATOM 0 HB2 GLN S 479 -2.329 1.141 -14.376 1.00 0.00 H new ATOM 0 HB3 GLN S 479 -0.637 1.185 -13.920 1.00 0.00 H new ATOM 0 HG2 GLN S 479 -0.544 -1.048 -13.509 1.00 0.00 H new ATOM 0 HG3 GLN S 479 -2.128 -1.088 -12.759 1.00 0.00 H new ATOM 0 HE21 GLN S 479 -3.732 -2.072 -13.834 1.00 0.00 H new ATOM 0 HE22 GLN S 479 -3.739 -2.408 -15.569 1.00 0.00 H new ATOM 398 N GLU S 480 -4.367 1.541 -12.764 1.00 0.00 N ATOM 399 CA GLU S 480 -5.786 1.280 -12.554 1.00 0.00 C ATOM 400 C GLU S 480 -6.111 -0.190 -12.800 1.00 0.00 C ATOM 401 O GLU S 480 -5.419 -0.868 -13.559 1.00 0.00 O ATOM 402 CB GLU S 480 -6.634 2.171 -13.468 1.00 0.00 C ATOM 403 CG GLU S 480 -6.633 1.730 -14.924 1.00 0.00 C ATOM 404 CD GLU S 480 -6.235 2.845 -15.872 1.00 0.00 C ATOM 405 OE1 GLU S 480 -6.910 3.895 -15.871 1.00 0.00 O ATOM 406 OE2 GLU S 480 -5.248 2.667 -16.617 1.00 0.00 O ATOM 0 H GLU S 480 -4.159 2.110 -13.585 1.00 0.00 H new ATOM 0 HA GLU S 480 -6.024 1.514 -11.516 1.00 0.00 H new ATOM 0 HB2 GLU S 480 -7.660 2.180 -13.101 1.00 0.00 H new ATOM 0 HB3 GLU S 480 -6.265 3.195 -13.407 1.00 0.00 H new ATOM 0 HG2 GLU S 480 -5.946 0.893 -15.045 1.00 0.00 H new ATOM 0 HG3 GLU S 480 -7.626 1.369 -15.191 1.00 0.00 H new ATOM 413 N GLY S 481 -7.164 -0.676 -12.151 1.00 0.00 N ATOM 414 CA GLY S 481 -7.560 -2.066 -12.309 1.00 0.00 C ATOM 415 C GLY S 481 -6.386 -3.012 -12.166 1.00 0.00 C ATOM 416 O GLY S 481 -6.007 -3.688 -13.123 1.00 0.00 O ATOM 0 H GLY S 481 -7.751 -0.133 -11.518 1.00 0.00 H new ATOM 0 HA2 GLY S 481 -8.317 -2.314 -11.565 1.00 0.00 H new ATOM 0 HA3 GLY S 481 -8.018 -2.203 -13.288 1.00 0.00 H new ATOM 420 N ASP S 482 -5.794 -3.049 -10.975 1.00 0.00 N ATOM 421 CA ASP S 482 -4.643 -3.909 -10.734 1.00 0.00 C ATOM 422 C ASP S 482 -4.910 -4.935 -9.645 1.00 0.00 C ATOM 423 O ASP S 482 -5.834 -4.796 -8.850 1.00 0.00 O ATOM 424 CB ASP S 482 -3.417 -3.064 -10.379 1.00 0.00 C ATOM 425 CG ASP S 482 -2.181 -3.902 -10.110 1.00 0.00 C ATOM 426 OD1 ASP S 482 -2.012 -4.943 -10.780 1.00 0.00 O ATOM 427 OD2 ASP S 482 -1.380 -3.515 -9.234 1.00 0.00 O ATOM 0 H ASP S 482 -6.090 -2.498 -10.169 1.00 0.00 H new ATOM 0 HA ASP S 482 -4.449 -4.459 -11.655 1.00 0.00 H new ATOM 0 HB2 ASP S 482 -3.210 -2.372 -11.195 1.00 0.00 H new ATOM 0 HB3 ASP S 482 -3.640 -2.461 -9.499 1.00 0.00 H new ATOM 432 N ILE S 483 -4.081 -5.968 -9.626 1.00 0.00 N ATOM 433 CA ILE S 483 -4.198 -7.032 -8.643 1.00 0.00 C ATOM 434 C ILE S 483 -3.116 -6.892 -7.580 1.00 0.00 C ATOM 435 O ILE S 483 -2.217 -7.726 -7.476 1.00 0.00 O ATOM 436 CB ILE S 483 -4.085 -8.419 -9.303 1.00 0.00 C ATOM 437 CG1 ILE S 483 -4.958 -8.491 -10.557 1.00 0.00 C ATOM 438 CG2 ILE S 483 -4.478 -9.503 -8.315 1.00 0.00 C ATOM 439 CD1 ILE S 483 -6.432 -8.285 -10.280 1.00 0.00 C ATOM 0 H ILE S 483 -3.314 -6.091 -10.287 1.00 0.00 H new ATOM 0 HA ILE S 483 -5.181 -6.945 -8.180 1.00 0.00 H new ATOM 0 HB ILE S 483 -3.049 -8.579 -9.601 1.00 0.00 H new ATOM 0 HG12 ILE S 483 -4.621 -7.737 -11.268 1.00 0.00 H new ATOM 0 HG13 ILE S 483 -4.818 -9.462 -11.032 1.00 0.00 H new ATOM 0 HG21 ILE S 483 -4.394 -10.479 -8.793 1.00 0.00 H new ATOM 0 HG22 ILE S 483 -3.816 -9.465 -7.450 1.00 0.00 H new ATOM 0 HG23 ILE S 483 -5.507 -9.345 -7.991 1.00 0.00 H new ATOM 0 HD11 ILE S 483 -6.990 -8.349 -11.214 1.00 0.00 H new ATOM 0 HD12 ILE S 483 -6.784 -9.055 -9.593 1.00 0.00 H new ATOM 0 HD13 ILE S 483 -6.584 -7.303 -9.833 1.00 0.00 H new ATOM 451 N ILE S 484 -3.205 -5.823 -6.797 1.00 0.00 N ATOM 452 CA ILE S 484 -2.231 -5.566 -5.746 1.00 0.00 C ATOM 453 C ILE S 484 -2.523 -6.413 -4.518 1.00 0.00 C ATOM 454 O ILE S 484 -3.639 -6.416 -4.000 1.00 0.00 O ATOM 455 CB ILE S 484 -2.221 -4.080 -5.339 1.00 0.00 C ATOM 456 CG1 ILE S 484 -2.105 -3.190 -6.577 1.00 0.00 C ATOM 457 CG2 ILE S 484 -1.079 -3.802 -4.372 1.00 0.00 C ATOM 458 CD1 ILE S 484 -2.688 -1.807 -6.382 1.00 0.00 C ATOM 0 H ILE S 484 -3.942 -5.121 -6.871 1.00 0.00 H new ATOM 0 HA ILE S 484 -1.252 -5.830 -6.147 1.00 0.00 H new ATOM 0 HB ILE S 484 -3.161 -3.851 -4.836 1.00 0.00 H new ATOM 0 HG12 ILE S 484 -1.054 -3.097 -6.851 1.00 0.00 H new ATOM 0 HG13 ILE S 484 -2.611 -3.675 -7.412 1.00 0.00 H new ATOM 0 HG21 ILE S 484 -1.086 -2.748 -4.094 1.00 0.00 H new ATOM 0 HG22 ILE S 484 -1.202 -4.414 -3.478 1.00 0.00 H new ATOM 0 HG23 ILE S 484 -0.130 -4.045 -4.850 1.00 0.00 H new ATOM 0 HD11 ILE S 484 -2.571 -1.230 -7.300 1.00 0.00 H new ATOM 0 HD12 ILE S 484 -3.747 -1.890 -6.138 1.00 0.00 H new ATOM 0 HD13 ILE S 484 -2.166 -1.304 -5.568 1.00 0.00 H new ATOM 470 N LEU S 485 -1.508 -7.134 -4.057 1.00 0.00 N ATOM 471 CA LEU S 485 -1.652 -7.991 -2.889 1.00 0.00 C ATOM 472 C LEU S 485 -1.562 -7.172 -1.611 1.00 0.00 C ATOM 473 O LEU S 485 -0.496 -6.666 -1.260 1.00 0.00 O ATOM 474 CB LEU S 485 -0.563 -9.075 -2.894 1.00 0.00 C ATOM 475 CG LEU S 485 -0.655 -10.166 -1.805 1.00 0.00 C ATOM 476 CD1 LEU S 485 0.666 -10.297 -1.062 1.00 0.00 C ATOM 477 CD2 LEU S 485 -1.783 -9.899 -0.814 1.00 0.00 C ATOM 0 H LEU S 485 -0.577 -7.142 -4.475 1.00 0.00 H new ATOM 0 HA LEU S 485 -2.631 -8.468 -2.928 1.00 0.00 H new ATOM 0 HB2 LEU S 485 -0.578 -9.566 -3.867 1.00 0.00 H new ATOM 0 HB3 LEU S 485 0.405 -8.583 -2.800 1.00 0.00 H new ATOM 0 HG LEU S 485 -0.877 -11.103 -2.315 1.00 0.00 H new ATOM 0 HD11 LEU S 485 0.579 -11.071 -0.299 1.00 0.00 H new ATOM 0 HD12 LEU S 485 1.454 -10.567 -1.765 1.00 0.00 H new ATOM 0 HD13 LEU S 485 0.913 -9.347 -0.588 1.00 0.00 H new ATOM 0 HD21 LEU S 485 -1.807 -10.693 -0.068 1.00 0.00 H new ATOM 0 HD22 LEU S 485 -1.614 -8.942 -0.320 1.00 0.00 H new ATOM 0 HD23 LEU S 485 -2.735 -9.871 -1.345 1.00 0.00 H new ATOM 489 N VAL S 486 -2.679 -7.069 -0.900 1.00 0.00 N ATOM 490 CA VAL S 486 -2.694 -6.335 0.357 1.00 0.00 C ATOM 491 C VAL S 486 -1.875 -7.107 1.367 1.00 0.00 C ATOM 492 O VAL S 486 -2.274 -8.191 1.781 1.00 0.00 O ATOM 493 CB VAL S 486 -4.106 -6.149 0.960 1.00 0.00 C ATOM 494 CG1 VAL S 486 -4.178 -4.857 1.739 1.00 0.00 C ATOM 495 CG2 VAL S 486 -5.208 -6.194 -0.087 1.00 0.00 C ATOM 0 H VAL S 486 -3.574 -7.479 -1.168 1.00 0.00 H new ATOM 0 HA VAL S 486 -2.294 -5.344 0.142 1.00 0.00 H new ATOM 0 HB VAL S 486 -4.274 -6.991 1.631 1.00 0.00 H new ATOM 0 HG11 VAL S 486 -5.178 -4.740 2.157 1.00 0.00 H new ATOM 0 HG12 VAL S 486 -3.447 -4.878 2.547 1.00 0.00 H new ATOM 0 HG13 VAL S 486 -3.962 -4.020 1.076 1.00 0.00 H new ATOM 0 HG21 VAL S 486 -6.175 -6.058 0.397 1.00 0.00 H new ATOM 0 HG22 VAL S 486 -5.051 -5.398 -0.815 1.00 0.00 H new ATOM 0 HG23 VAL S 486 -5.189 -7.159 -0.594 1.00 0.00 H new ATOM 505 N LEU S 487 -0.735 -6.572 1.759 1.00 0.00 N ATOM 506 CA LEU S 487 0.107 -7.270 2.715 1.00 0.00 C ATOM 507 C LEU S 487 -0.404 -7.105 4.143 1.00 0.00 C ATOM 508 O LEU S 487 -0.092 -7.920 5.010 1.00 0.00 O ATOM 509 CB LEU S 487 1.545 -6.775 2.617 1.00 0.00 C ATOM 510 CG LEU S 487 2.436 -7.560 1.650 1.00 0.00 C ATOM 511 CD1 LEU S 487 2.833 -8.895 2.265 1.00 0.00 C ATOM 512 CD2 LEU S 487 1.730 -7.777 0.320 1.00 0.00 C ATOM 0 H LEU S 487 -0.374 -5.673 1.439 1.00 0.00 H new ATOM 0 HA LEU S 487 0.073 -8.331 2.467 1.00 0.00 H new ATOM 0 HB2 LEU S 487 1.533 -5.730 2.309 1.00 0.00 H new ATOM 0 HB3 LEU S 487 1.994 -6.810 3.610 1.00 0.00 H new ATOM 0 HG LEU S 487 3.338 -6.977 1.465 1.00 0.00 H new ATOM 0 HD11 LEU S 487 3.466 -9.443 1.567 1.00 0.00 H new ATOM 0 HD12 LEU S 487 3.380 -8.720 3.191 1.00 0.00 H new ATOM 0 HD13 LEU S 487 1.937 -9.479 2.477 1.00 0.00 H new ATOM 0 HD21 LEU S 487 2.382 -8.337 -0.351 1.00 0.00 H new ATOM 0 HD22 LEU S 487 0.810 -8.338 0.484 1.00 0.00 H new ATOM 0 HD23 LEU S 487 1.492 -6.812 -0.127 1.00 0.00 H new ATOM 524 N SER S 488 -1.193 -6.058 4.380 1.00 0.00 N ATOM 525 CA SER S 488 -1.753 -5.790 5.713 1.00 0.00 C ATOM 526 C SER S 488 -2.292 -4.369 5.808 1.00 0.00 C ATOM 527 O SER S 488 -1.948 -3.510 4.999 1.00 0.00 O ATOM 528 CB SER S 488 -0.691 -5.965 6.807 1.00 0.00 C ATOM 529 OG SER S 488 -1.278 -6.398 8.022 1.00 0.00 O ATOM 0 H SER S 488 -1.462 -5.378 3.669 1.00 0.00 H new ATOM 0 HA SER S 488 -2.561 -6.506 5.861 1.00 0.00 H new ATOM 0 HB2 SER S 488 0.055 -6.690 6.481 1.00 0.00 H new ATOM 0 HB3 SER S 488 -0.170 -5.021 6.967 1.00 0.00 H new ATOM 0 HG SER S 488 -0.581 -6.504 8.703 1.00 0.00 H new ATOM 535 N LYS S 489 -3.102 -4.115 6.834 1.00 0.00 N ATOM 536 CA LYS S 489 -3.647 -2.783 7.065 1.00 0.00 C ATOM 537 C LYS S 489 -2.584 -1.930 7.744 1.00 0.00 C ATOM 538 O LYS S 489 -1.949 -2.377 8.700 1.00 0.00 O ATOM 539 CB LYS S 489 -4.904 -2.857 7.933 1.00 0.00 C ATOM 540 CG LYS S 489 -5.571 -1.510 8.155 1.00 0.00 C ATOM 541 CD LYS S 489 -6.732 -1.618 9.129 1.00 0.00 C ATOM 542 CE LYS S 489 -8.056 -1.787 8.401 1.00 0.00 C ATOM 543 NZ LYS S 489 -8.973 -2.710 9.123 1.00 0.00 N ATOM 0 H LYS S 489 -3.394 -4.815 7.517 1.00 0.00 H new ATOM 0 HA LYS S 489 -3.926 -2.335 6.111 1.00 0.00 H new ATOM 0 HB2 LYS S 489 -5.619 -3.534 7.465 1.00 0.00 H new ATOM 0 HB3 LYS S 489 -4.643 -3.287 8.900 1.00 0.00 H new ATOM 0 HG2 LYS S 489 -4.839 -0.799 8.537 1.00 0.00 H new ATOM 0 HG3 LYS S 489 -5.929 -1.118 7.203 1.00 0.00 H new ATOM 0 HD2 LYS S 489 -6.571 -2.465 9.796 1.00 0.00 H new ATOM 0 HD3 LYS S 489 -6.770 -0.725 9.752 1.00 0.00 H new ATOM 0 HE2 LYS S 489 -8.535 -0.814 8.288 1.00 0.00 H new ATOM 0 HE3 LYS S 489 -7.872 -2.170 7.397 1.00 0.00 H new ATOM 0 HZ1 LYS S 489 -9.864 -2.798 8.594 1.00 0.00 H new ATOM 0 HZ2 LYS S 489 -8.527 -3.646 9.209 1.00 0.00 H new ATOM 0 HZ3 LYS S 489 -9.170 -2.332 10.072 1.00 0.00 H new ATOM 557 N VAL S 490 -2.355 -0.723 7.238 1.00 0.00 N ATOM 558 CA VAL S 490 -1.319 0.134 7.811 1.00 0.00 C ATOM 559 C VAL S 490 -1.887 1.319 8.600 1.00 0.00 C ATOM 560 O VAL S 490 -1.224 1.837 9.497 1.00 0.00 O ATOM 561 CB VAL S 490 -0.341 0.623 6.719 1.00 0.00 C ATOM 562 CG1 VAL S 490 0.652 1.632 7.279 1.00 0.00 C ATOM 563 CG2 VAL S 490 0.400 -0.564 6.116 1.00 0.00 C ATOM 0 H VAL S 490 -2.860 -0.320 6.449 1.00 0.00 H new ATOM 0 HA VAL S 490 -0.773 -0.482 8.525 1.00 0.00 H new ATOM 0 HB VAL S 490 -0.921 1.119 5.941 1.00 0.00 H new ATOM 0 HG11 VAL S 490 1.326 1.957 6.487 1.00 0.00 H new ATOM 0 HG12 VAL S 490 0.113 2.494 7.673 1.00 0.00 H new ATOM 0 HG13 VAL S 490 1.229 1.169 8.079 1.00 0.00 H new ATOM 0 HG21 VAL S 490 1.087 -0.211 5.347 1.00 0.00 H new ATOM 0 HG22 VAL S 490 0.961 -1.077 6.897 1.00 0.00 H new ATOM 0 HG23 VAL S 490 -0.318 -1.254 5.672 1.00 0.00 H new ATOM 573 N ASN S 491 -3.108 1.747 8.290 1.00 0.00 N ATOM 574 CA ASN S 491 -3.714 2.862 9.019 1.00 0.00 C ATOM 575 C ASN S 491 -5.129 3.162 8.517 1.00 0.00 C ATOM 576 O ASN S 491 -5.551 4.318 8.476 1.00 0.00 O ATOM 577 CB ASN S 491 -2.818 4.113 8.928 1.00 0.00 C ATOM 578 CG ASN S 491 -3.128 5.004 7.738 1.00 0.00 C ATOM 579 OD1 ASN S 491 -3.743 4.572 6.763 1.00 0.00 O ATOM 580 ND2 ASN S 491 -2.703 6.261 7.820 1.00 0.00 N ATOM 0 H ASN S 491 -3.690 1.349 7.553 1.00 0.00 H new ATOM 0 HA ASN S 491 -3.798 2.571 10.066 1.00 0.00 H new ATOM 0 HB2 ASN S 491 -2.928 4.694 9.844 1.00 0.00 H new ATOM 0 HB3 ASN S 491 -1.776 3.799 8.873 1.00 0.00 H new ATOM 0 HD21 ASN S 491 -2.883 6.911 7.055 1.00 0.00 H new ATOM 0 HD22 ASN S 491 -2.197 6.575 8.648 1.00 0.00 H new ATOM 587 N GLU S 492 -5.860 2.117 8.136 1.00 0.00 N ATOM 588 CA GLU S 492 -7.224 2.281 7.635 1.00 0.00 C ATOM 589 C GLU S 492 -7.206 2.872 6.228 1.00 0.00 C ATOM 590 O GLU S 492 -7.708 2.264 5.282 1.00 0.00 O ATOM 591 CB GLU S 492 -8.041 3.176 8.570 1.00 0.00 C ATOM 592 CG GLU S 492 -9.545 3.000 8.423 1.00 0.00 C ATOM 593 CD GLU S 492 -10.328 3.782 9.457 1.00 0.00 C ATOM 594 OE1 GLU S 492 -9.780 4.764 10.000 1.00 0.00 O ATOM 595 OE2 GLU S 492 -11.490 3.412 9.726 1.00 0.00 O ATOM 0 H GLU S 492 -5.533 1.151 8.164 1.00 0.00 H new ATOM 0 HA GLU S 492 -7.694 1.298 7.599 1.00 0.00 H new ATOM 0 HB2 GLU S 492 -7.758 2.964 9.601 1.00 0.00 H new ATOM 0 HB3 GLU S 492 -7.785 4.218 8.377 1.00 0.00 H new ATOM 0 HG2 GLU S 492 -9.848 3.319 7.426 1.00 0.00 H new ATOM 0 HG3 GLU S 492 -9.793 1.942 8.509 1.00 0.00 H new ATOM 602 N GLU S 493 -6.612 4.055 6.096 1.00 0.00 N ATOM 603 CA GLU S 493 -6.510 4.721 4.803 1.00 0.00 C ATOM 604 C GLU S 493 -5.202 4.349 4.106 1.00 0.00 C ATOM 605 O GLU S 493 -4.792 4.994 3.142 1.00 0.00 O ATOM 606 CB GLU S 493 -6.595 6.239 4.977 1.00 0.00 C ATOM 607 CG GLU S 493 -8.019 6.766 5.043 1.00 0.00 C ATOM 608 CD GLU S 493 -8.090 8.195 5.540 1.00 0.00 C ATOM 609 OE1 GLU S 493 -7.117 8.949 5.322 1.00 0.00 O ATOM 610 OE2 GLU S 493 -9.117 8.563 6.148 1.00 0.00 O ATOM 0 H GLU S 493 -6.194 4.572 6.870 1.00 0.00 H new ATOM 0 HA GLU S 493 -7.342 4.389 4.183 1.00 0.00 H new ATOM 0 HB2 GLU S 493 -6.069 6.522 5.889 1.00 0.00 H new ATOM 0 HB3 GLU S 493 -6.076 6.721 4.148 1.00 0.00 H new ATOM 0 HG2 GLU S 493 -8.470 6.707 4.053 1.00 0.00 H new ATOM 0 HG3 GLU S 493 -8.609 6.127 5.700 1.00 0.00 H new ATOM 617 N TRP S 494 -4.556 3.295 4.603 1.00 0.00 N ATOM 618 CA TRP S 494 -3.301 2.814 4.040 1.00 0.00 C ATOM 619 C TRP S 494 -3.066 1.367 4.440 1.00 0.00 C ATOM 620 O TRP S 494 -3.657 0.870 5.398 1.00 0.00 O ATOM 621 CB TRP S 494 -2.119 3.663 4.511 1.00 0.00 C ATOM 622 CG TRP S 494 -2.104 5.055 3.959 1.00 0.00 C ATOM 623 CD1 TRP S 494 -2.727 6.148 4.484 1.00 0.00 C ATOM 624 CD2 TRP S 494 -1.412 5.513 2.787 1.00 0.00 C ATOM 625 NE1 TRP S 494 -2.460 7.256 3.719 1.00 0.00 N ATOM 626 CE2 TRP S 494 -1.665 6.891 2.671 1.00 0.00 C ATOM 627 CE3 TRP S 494 -0.605 4.895 1.827 1.00 0.00 C ATOM 628 CZ2 TRP S 494 -1.142 7.663 1.643 1.00 0.00 C ATOM 629 CZ3 TRP S 494 -0.084 5.667 0.803 1.00 0.00 C ATOM 630 CH2 TRP S 494 -0.356 7.039 0.720 1.00 0.00 C ATOM 0 H TRP S 494 -4.888 2.755 5.402 1.00 0.00 H new ATOM 0 HA TRP S 494 -3.376 2.890 2.955 1.00 0.00 H new ATOM 0 HB2 TRP S 494 -2.135 3.716 5.600 1.00 0.00 H new ATOM 0 HB3 TRP S 494 -1.192 3.163 4.230 1.00 0.00 H new ATOM 0 HD1 TRP S 494 -3.341 6.143 5.372 1.00 0.00 H new ATOM 0 HE1 TRP S 494 -2.801 8.200 3.904 1.00 0.00 H new ATOM 0 HE3 TRP S 494 -0.393 3.838 1.883 1.00 0.00 H new ATOM 0 HZ2 TRP S 494 -1.350 8.721 1.577 1.00 0.00 H new ATOM 0 HZ3 TRP S 494 0.543 5.204 0.055 1.00 0.00 H new ATOM 0 HH2 TRP S 494 0.065 7.614 -0.091 1.00 0.00 H new ATOM 641 N LEU S 495 -2.206 0.698 3.694 1.00 0.00 N ATOM 642 CA LEU S 495 -1.888 -0.691 3.953 1.00 0.00 C ATOM 643 C LEU S 495 -0.569 -1.078 3.306 1.00 0.00 C ATOM 644 O LEU S 495 0.007 -0.306 2.540 1.00 0.00 O ATOM 645 CB LEU S 495 -3.020 -1.587 3.460 1.00 0.00 C ATOM 646 CG LEU S 495 -3.826 -1.033 2.286 1.00 0.00 C ATOM 647 CD1 LEU S 495 -3.593 -1.854 1.025 1.00 0.00 C ATOM 648 CD2 LEU S 495 -5.304 -0.992 2.645 1.00 0.00 C ATOM 0 H LEU S 495 -1.712 1.100 2.897 1.00 0.00 H new ATOM 0 HA LEU S 495 -1.780 -0.827 5.029 1.00 0.00 H new ATOM 0 HB2 LEU S 495 -2.599 -2.549 3.169 1.00 0.00 H new ATOM 0 HB3 LEU S 495 -3.701 -1.775 4.290 1.00 0.00 H new ATOM 0 HG LEU S 495 -3.488 -0.017 2.081 1.00 0.00 H new ATOM 0 HD11 LEU S 495 -4.179 -1.437 0.206 1.00 0.00 H new ATOM 0 HD12 LEU S 495 -2.535 -1.828 0.764 1.00 0.00 H new ATOM 0 HD13 LEU S 495 -3.898 -2.886 1.201 1.00 0.00 H new ATOM 0 HD21 LEU S 495 -5.872 -0.596 1.803 1.00 0.00 H new ATOM 0 HD22 LEU S 495 -5.651 -2.000 2.875 1.00 0.00 H new ATOM 0 HD23 LEU S 495 -5.450 -0.351 3.515 1.00 0.00 H new ATOM 660 N GLU S 496 -0.088 -2.271 3.627 1.00 0.00 N ATOM 661 CA GLU S 496 1.170 -2.743 3.080 1.00 0.00 C ATOM 662 C GLU S 496 0.981 -3.258 1.664 1.00 0.00 C ATOM 663 O GLU S 496 0.135 -4.114 1.405 1.00 0.00 O ATOM 664 CB GLU S 496 1.768 -3.831 3.972 1.00 0.00 C ATOM 665 CG GLU S 496 3.171 -4.252 3.564 1.00 0.00 C ATOM 666 CD GLU S 496 3.748 -5.321 4.474 1.00 0.00 C ATOM 667 OE1 GLU S 496 3.089 -5.670 5.476 1.00 0.00 O ATOM 668 OE2 GLU S 496 4.860 -5.810 4.182 1.00 0.00 O ATOM 0 H GLU S 496 -0.549 -2.924 4.260 1.00 0.00 H new ATOM 0 HA GLU S 496 1.865 -1.904 3.048 1.00 0.00 H new ATOM 0 HB2 GLU S 496 1.790 -3.473 5.001 1.00 0.00 H new ATOM 0 HB3 GLU S 496 1.116 -4.704 3.952 1.00 0.00 H new ATOM 0 HG2 GLU S 496 3.151 -4.624 2.540 1.00 0.00 H new ATOM 0 HG3 GLU S 496 3.825 -3.380 3.574 1.00 0.00 H new ATOM 675 N GLY S 497 1.764 -2.706 0.747 1.00 0.00 N ATOM 676 CA GLY S 497 1.668 -3.089 -0.642 1.00 0.00 C ATOM 677 C GLY S 497 2.848 -3.917 -1.119 1.00 0.00 C ATOM 678 O GLY S 497 3.994 -3.646 -0.760 1.00 0.00 O ATOM 0 H GLY S 497 2.468 -1.995 0.945 1.00 0.00 H new ATOM 0 HA2 GLY S 497 0.750 -3.657 -0.793 1.00 0.00 H new ATOM 0 HA3 GLY S 497 1.592 -2.191 -1.255 1.00 0.00 H new ATOM 682 N GLU S 498 2.561 -4.925 -1.939 1.00 0.00 N ATOM 683 CA GLU S 498 3.595 -5.799 -2.484 1.00 0.00 C ATOM 684 C GLU S 498 3.119 -6.425 -3.793 1.00 0.00 C ATOM 685 O GLU S 498 2.408 -7.430 -3.786 1.00 0.00 O ATOM 686 CB GLU S 498 3.953 -6.895 -1.479 1.00 0.00 C ATOM 687 CG GLU S 498 5.412 -7.317 -1.534 1.00 0.00 C ATOM 688 CD GLU S 498 5.592 -8.730 -2.055 1.00 0.00 C ATOM 689 OE1 GLU S 498 5.077 -9.670 -1.415 1.00 0.00 O ATOM 690 OE2 GLU S 498 6.250 -8.896 -3.104 1.00 0.00 O ATOM 0 H GLU S 498 1.615 -5.157 -2.242 1.00 0.00 H new ATOM 0 HA GLU S 498 4.485 -5.201 -2.680 1.00 0.00 H new ATOM 0 HB2 GLU S 498 3.723 -6.544 -0.473 1.00 0.00 H new ATOM 0 HB3 GLU S 498 3.324 -7.766 -1.664 1.00 0.00 H new ATOM 0 HG2 GLU S 498 5.962 -6.626 -2.172 1.00 0.00 H new ATOM 0 HG3 GLU S 498 5.845 -7.244 -0.537 1.00 0.00 H new ATOM 697 N SER S 499 3.499 -5.818 -4.914 1.00 0.00 N ATOM 698 CA SER S 499 3.090 -6.313 -6.224 1.00 0.00 C ATOM 699 C SER S 499 4.213 -7.086 -6.914 1.00 0.00 C ATOM 700 O SER S 499 5.114 -6.498 -7.515 1.00 0.00 O ATOM 701 CB SER S 499 2.630 -5.147 -7.107 1.00 0.00 C ATOM 702 OG SER S 499 2.869 -5.411 -8.478 1.00 0.00 O ATOM 0 H SER S 499 4.088 -4.985 -4.941 1.00 0.00 H new ATOM 0 HA SER S 499 2.259 -7.003 -6.074 1.00 0.00 H new ATOM 0 HB2 SER S 499 1.567 -4.967 -6.950 1.00 0.00 H new ATOM 0 HB3 SER S 499 3.154 -4.237 -6.813 1.00 0.00 H new ATOM 0 HG SER S 499 2.564 -4.650 -9.016 1.00 0.00 H new ATOM 708 N LYS S 500 4.133 -8.409 -6.836 1.00 0.00 N ATOM 709 CA LYS S 500 5.116 -9.289 -7.461 1.00 0.00 C ATOM 710 C LYS S 500 6.517 -9.094 -6.870 1.00 0.00 C ATOM 711 O LYS S 500 6.852 -9.696 -5.850 1.00 0.00 O ATOM 712 CB LYS S 500 5.135 -9.064 -8.976 1.00 0.00 C ATOM 713 CG LYS S 500 3.877 -9.549 -9.679 1.00 0.00 C ATOM 714 CD LYS S 500 3.487 -8.629 -10.824 1.00 0.00 C ATOM 715 CE LYS S 500 1.996 -8.331 -10.819 1.00 0.00 C ATOM 716 NZ LYS S 500 1.600 -7.461 -11.960 1.00 0.00 N ATOM 0 H LYS S 500 3.389 -8.901 -6.341 1.00 0.00 H new ATOM 0 HA LYS S 500 4.819 -10.317 -7.255 1.00 0.00 H new ATOM 0 HB2 LYS S 500 5.265 -8.000 -9.175 1.00 0.00 H new ATOM 0 HB3 LYS S 500 5.999 -9.576 -9.400 1.00 0.00 H new ATOM 0 HG2 LYS S 500 4.038 -10.557 -10.060 1.00 0.00 H new ATOM 0 HG3 LYS S 500 3.058 -9.606 -8.962 1.00 0.00 H new ATOM 0 HD2 LYS S 500 4.045 -7.696 -10.748 1.00 0.00 H new ATOM 0 HD3 LYS S 500 3.763 -9.090 -11.772 1.00 0.00 H new ATOM 0 HE2 LYS S 500 1.439 -9.267 -10.865 1.00 0.00 H new ATOM 0 HE3 LYS S 500 1.726 -7.845 -9.881 1.00 0.00 H new ATOM 0 HZ1 LYS S 500 0.576 -7.281 -11.921 1.00 0.00 H new ATOM 0 HZ2 LYS S 500 2.113 -6.558 -11.902 1.00 0.00 H new ATOM 0 HZ3 LYS S 500 1.834 -7.935 -12.856 1.00 0.00 H new ATOM 730 N GLY S 501 7.336 -8.267 -7.520 1.00 0.00 N ATOM 731 CA GLY S 501 8.685 -8.037 -7.039 1.00 0.00 C ATOM 732 C GLY S 501 8.929 -6.597 -6.634 1.00 0.00 C ATOM 733 O GLY S 501 9.935 -6.000 -7.014 1.00 0.00 O ATOM 0 H GLY S 501 7.088 -7.756 -8.367 1.00 0.00 H new ATOM 0 HA2 GLY S 501 8.877 -8.687 -6.185 1.00 0.00 H new ATOM 0 HA3 GLY S 501 9.395 -8.316 -7.817 1.00 0.00 H new ATOM 737 N LYS S 502 8.006 -6.042 -5.859 1.00 0.00 N ATOM 738 CA LYS S 502 8.123 -4.667 -5.393 1.00 0.00 C ATOM 739 C LYS S 502 7.304 -4.460 -4.129 1.00 0.00 C ATOM 740 O LYS S 502 6.102 -4.722 -4.106 1.00 0.00 O ATOM 741 CB LYS S 502 7.670 -3.689 -6.477 1.00 0.00 C ATOM 742 CG LYS S 502 8.797 -3.236 -7.390 1.00 0.00 C ATOM 743 CD LYS S 502 8.446 -3.434 -8.857 1.00 0.00 C ATOM 744 CE LYS S 502 7.656 -2.256 -9.403 1.00 0.00 C ATOM 745 NZ LYS S 502 8.516 -1.061 -9.616 1.00 0.00 N ATOM 0 H LYS S 502 7.166 -6.525 -5.539 1.00 0.00 H new ATOM 0 HA LYS S 502 9.172 -4.474 -5.167 1.00 0.00 H new ATOM 0 HB2 LYS S 502 6.892 -4.159 -7.078 1.00 0.00 H new ATOM 0 HB3 LYS S 502 7.222 -2.815 -6.004 1.00 0.00 H new ATOM 0 HG2 LYS S 502 9.014 -2.184 -7.206 1.00 0.00 H new ATOM 0 HG3 LYS S 502 9.703 -3.794 -7.154 1.00 0.00 H new ATOM 0 HD2 LYS S 502 9.360 -3.561 -9.437 1.00 0.00 H new ATOM 0 HD3 LYS S 502 7.865 -4.349 -8.973 1.00 0.00 H new ATOM 0 HE2 LYS S 502 7.188 -2.539 -10.346 1.00 0.00 H new ATOM 0 HE3 LYS S 502 6.852 -2.006 -8.710 1.00 0.00 H new ATOM 0 HZ1 LYS S 502 8.014 -0.374 -10.215 1.00 0.00 H new ATOM 0 HZ2 LYS S 502 8.737 -0.624 -8.698 1.00 0.00 H new ATOM 0 HZ3 LYS S 502 9.399 -1.348 -10.084 1.00 0.00 H new ATOM 759 N VAL S 503 7.963 -3.991 -3.077 1.00 0.00 N ATOM 760 CA VAL S 503 7.293 -3.754 -1.808 1.00 0.00 C ATOM 761 C VAL S 503 7.064 -2.266 -1.572 1.00 0.00 C ATOM 762 O VAL S 503 7.866 -1.427 -1.980 1.00 0.00 O ATOM 763 CB VAL S 503 8.090 -4.340 -0.628 1.00 0.00 C ATOM 764 CG1 VAL S 503 7.285 -4.250 0.660 1.00 0.00 C ATOM 765 CG2 VAL S 503 8.485 -5.781 -0.918 1.00 0.00 C ATOM 0 H VAL S 503 8.958 -3.768 -3.079 1.00 0.00 H new ATOM 0 HA VAL S 503 6.328 -4.258 -1.865 1.00 0.00 H new ATOM 0 HB VAL S 503 9.000 -3.754 -0.500 1.00 0.00 H new ATOM 0 HG11 VAL S 503 7.865 -4.669 1.482 1.00 0.00 H new ATOM 0 HG12 VAL S 503 7.055 -3.206 0.873 1.00 0.00 H new ATOM 0 HG13 VAL S 503 6.357 -4.810 0.549 1.00 0.00 H new ATOM 0 HG21 VAL S 503 9.048 -6.181 -0.074 1.00 0.00 H new ATOM 0 HG22 VAL S 503 7.588 -6.380 -1.072 1.00 0.00 H new ATOM 0 HG23 VAL S 503 9.103 -5.815 -1.815 1.00 0.00 H new ATOM 775 N GLY S 504 5.958 -1.958 -0.911 1.00 0.00 N ATOM 776 CA GLY S 504 5.612 -0.582 -0.620 1.00 0.00 C ATOM 777 C GLY S 504 4.293 -0.495 0.111 1.00 0.00 C ATOM 778 O GLY S 504 3.921 -1.429 0.816 1.00 0.00 O ATOM 0 H GLY S 504 5.287 -2.645 -0.568 1.00 0.00 H new ATOM 0 HA2 GLY S 504 6.397 -0.127 -0.016 1.00 0.00 H new ATOM 0 HA3 GLY S 504 5.555 -0.014 -1.549 1.00 0.00 H new ATOM 782 N ILE S 505 3.581 0.612 -0.056 1.00 0.00 N ATOM 783 CA ILE S 505 2.290 0.786 0.601 1.00 0.00 C ATOM 784 C ILE S 505 1.367 1.676 -0.211 1.00 0.00 C ATOM 785 O ILE S 505 1.816 2.476 -1.031 1.00 0.00 O ATOM 786 CB ILE S 505 2.440 1.378 2.012 1.00 0.00 C ATOM 787 CG1 ILE S 505 3.490 2.491 2.025 1.00 0.00 C ATOM 788 CG2 ILE S 505 2.803 0.281 2.997 1.00 0.00 C ATOM 789 CD1 ILE S 505 3.161 3.618 2.982 1.00 0.00 C ATOM 0 H ILE S 505 3.872 1.399 -0.636 1.00 0.00 H new ATOM 0 HA ILE S 505 1.853 -0.209 0.680 1.00 0.00 H new ATOM 0 HB ILE S 505 1.488 1.815 2.312 1.00 0.00 H new ATOM 0 HG12 ILE S 505 4.456 2.065 2.295 1.00 0.00 H new ATOM 0 HG13 ILE S 505 3.591 2.897 1.018 1.00 0.00 H new ATOM 0 HG21 ILE S 505 2.908 0.708 3.995 1.00 0.00 H new ATOM 0 HG22 ILE S 505 2.017 -0.474 3.006 1.00 0.00 H new ATOM 0 HG23 ILE S 505 3.745 -0.179 2.698 1.00 0.00 H new ATOM 0 HD11 ILE S 505 3.947 4.372 2.940 1.00 0.00 H new ATOM 0 HD12 ILE S 505 2.210 4.069 2.699 1.00 0.00 H new ATOM 0 HD13 ILE S 505 3.089 3.225 3.996 1.00 0.00 H new ATOM 801 N PHE S 506 0.069 1.533 0.022 1.00 0.00 N ATOM 802 CA PHE S 506 -0.916 2.331 -0.697 1.00 0.00 C ATOM 803 C PHE S 506 -2.219 2.456 0.087 1.00 0.00 C ATOM 804 O PHE S 506 -2.537 1.612 0.925 1.00 0.00 O ATOM 805 CB PHE S 506 -1.186 1.727 -2.079 1.00 0.00 C ATOM 806 CG PHE S 506 -2.086 0.523 -2.058 1.00 0.00 C ATOM 807 CD1 PHE S 506 -3.463 0.673 -2.085 1.00 0.00 C ATOM 808 CD2 PHE S 506 -1.555 -0.756 -2.013 1.00 0.00 C ATOM 809 CE1 PHE S 506 -4.294 -0.431 -2.068 1.00 0.00 C ATOM 810 CE2 PHE S 506 -2.382 -1.864 -1.999 1.00 0.00 C ATOM 811 CZ PHE S 506 -3.753 -1.701 -2.026 1.00 0.00 C ATOM 0 H PHE S 506 -0.324 0.878 0.697 1.00 0.00 H new ATOM 0 HA PHE S 506 -0.503 3.332 -0.820 1.00 0.00 H new ATOM 0 HB2 PHE S 506 -1.633 2.490 -2.716 1.00 0.00 H new ATOM 0 HB3 PHE S 506 -0.235 1.449 -2.534 1.00 0.00 H new ATOM 0 HD1 PHE S 506 -3.892 1.664 -2.120 1.00 0.00 H new ATOM 0 HD2 PHE S 506 -0.483 -0.889 -1.989 1.00 0.00 H new ATOM 0 HE1 PHE S 506 -5.366 -0.301 -2.088 1.00 0.00 H new ATOM 0 HE2 PHE S 506 -1.956 -2.856 -1.967 1.00 0.00 H new ATOM 0 HZ PHE S 506 -4.401 -2.565 -2.014 1.00 0.00 H new ATOM 821 N PRO S 507 -2.995 3.519 -0.186 1.00 0.00 N ATOM 822 CA PRO S 507 -4.270 3.759 0.486 1.00 0.00 C ATOM 823 C PRO S 507 -5.398 2.912 -0.095 1.00 0.00 C ATOM 824 O PRO S 507 -5.601 2.871 -1.308 1.00 0.00 O ATOM 825 CB PRO S 507 -4.512 5.244 0.236 1.00 0.00 C ATOM 826 CG PRO S 507 -3.856 5.516 -1.074 1.00 0.00 C ATOM 827 CD PRO S 507 -2.688 4.569 -1.175 1.00 0.00 C ATOM 0 HA PRO S 507 -4.243 3.492 1.542 1.00 0.00 H new ATOM 0 HB2 PRO S 507 -5.577 5.472 0.201 1.00 0.00 H new ATOM 0 HB3 PRO S 507 -4.082 5.855 1.029 1.00 0.00 H new ATOM 0 HG2 PRO S 507 -4.554 5.360 -1.897 1.00 0.00 H new ATOM 0 HG3 PRO S 507 -3.521 6.552 -1.132 1.00 0.00 H new ATOM 0 HD2 PRO S 507 -2.594 4.156 -2.179 1.00 0.00 H new ATOM 0 HD3 PRO S 507 -1.747 5.070 -0.947 1.00 0.00 H new ATOM 835 N LYS S 508 -6.117 2.226 0.788 1.00 0.00 N ATOM 836 CA LYS S 508 -7.220 1.358 0.394 1.00 0.00 C ATOM 837 C LYS S 508 -8.205 2.064 -0.541 1.00 0.00 C ATOM 838 O LYS S 508 -8.932 1.413 -1.290 1.00 0.00 O ATOM 839 CB LYS S 508 -7.947 0.866 1.643 1.00 0.00 C ATOM 840 CG LYS S 508 -8.572 -0.506 1.478 1.00 0.00 C ATOM 841 CD LYS S 508 -10.021 -0.524 1.936 1.00 0.00 C ATOM 842 CE LYS S 508 -10.155 -1.104 3.335 1.00 0.00 C ATOM 843 NZ LYS S 508 -10.052 -0.054 4.385 1.00 0.00 N ATOM 0 H LYS S 508 -5.952 2.256 1.794 1.00 0.00 H new ATOM 0 HA LYS S 508 -6.803 0.514 -0.155 1.00 0.00 H new ATOM 0 HB2 LYS S 508 -7.244 0.839 2.476 1.00 0.00 H new ATOM 0 HB3 LYS S 508 -8.726 1.582 1.906 1.00 0.00 H new ATOM 0 HG2 LYS S 508 -8.518 -0.807 0.432 1.00 0.00 H new ATOM 0 HG3 LYS S 508 -8.001 -1.237 2.050 1.00 0.00 H new ATOM 0 HD2 LYS S 508 -10.421 0.490 1.921 1.00 0.00 H new ATOM 0 HD3 LYS S 508 -10.617 -1.112 1.238 1.00 0.00 H new ATOM 0 HE2 LYS S 508 -11.114 -1.615 3.426 1.00 0.00 H new ATOM 0 HE3 LYS S 508 -9.379 -1.853 3.493 1.00 0.00 H new ATOM 0 HZ1 LYS S 508 -10.148 -0.491 5.324 1.00 0.00 H new ATOM 0 HZ2 LYS S 508 -9.127 0.417 4.316 1.00 0.00 H new ATOM 0 HZ3 LYS S 508 -10.808 0.647 4.250 1.00 0.00 H new ATOM 857 N VAL S 509 -8.236 3.391 -0.491 1.00 0.00 N ATOM 858 CA VAL S 509 -9.144 4.163 -1.333 1.00 0.00 C ATOM 859 C VAL S 509 -8.919 3.877 -2.820 1.00 0.00 C ATOM 860 O VAL S 509 -9.797 4.130 -3.645 1.00 0.00 O ATOM 861 CB VAL S 509 -8.999 5.678 -1.073 1.00 0.00 C ATOM 862 CG1 VAL S 509 -7.538 6.092 -1.105 1.00 0.00 C ATOM 863 CG2 VAL S 509 -9.810 6.485 -2.079 1.00 0.00 C ATOM 0 H VAL S 509 -7.645 3.954 0.121 1.00 0.00 H new ATOM 0 HA VAL S 509 -10.155 3.852 -1.068 1.00 0.00 H new ATOM 0 HB VAL S 509 -9.392 5.888 -0.078 1.00 0.00 H new ATOM 0 HG11 VAL S 509 -7.459 7.163 -0.919 1.00 0.00 H new ATOM 0 HG12 VAL S 509 -6.989 5.549 -0.336 1.00 0.00 H new ATOM 0 HG13 VAL S 509 -7.116 5.861 -2.083 1.00 0.00 H new ATOM 0 HG21 VAL S 509 -9.690 7.549 -1.873 1.00 0.00 H new ATOM 0 HG22 VAL S 509 -9.458 6.269 -3.088 1.00 0.00 H new ATOM 0 HG23 VAL S 509 -10.863 6.216 -1.997 1.00 0.00 H new ATOM 873 N PHE S 510 -7.744 3.352 -3.164 1.00 0.00 N ATOM 874 CA PHE S 510 -7.429 3.045 -4.558 1.00 0.00 C ATOM 875 C PHE S 510 -7.644 1.572 -4.866 1.00 0.00 C ATOM 876 O PHE S 510 -7.006 1.017 -5.760 1.00 0.00 O ATOM 877 CB PHE S 510 -5.985 3.421 -4.877 1.00 0.00 C ATOM 878 CG PHE S 510 -5.774 4.896 -4.988 1.00 0.00 C ATOM 879 CD1 PHE S 510 -5.895 5.703 -3.874 1.00 0.00 C ATOM 880 CD2 PHE S 510 -5.467 5.475 -6.207 1.00 0.00 C ATOM 881 CE1 PHE S 510 -5.716 7.065 -3.969 1.00 0.00 C ATOM 882 CE2 PHE S 510 -5.283 6.837 -6.310 1.00 0.00 C ATOM 883 CZ PHE S 510 -5.410 7.633 -5.187 1.00 0.00 C ATOM 0 H PHE S 510 -7.000 3.132 -2.502 1.00 0.00 H new ATOM 0 HA PHE S 510 -8.105 3.633 -5.179 1.00 0.00 H new ATOM 0 HB2 PHE S 510 -5.332 3.024 -4.099 1.00 0.00 H new ATOM 0 HB3 PHE S 510 -5.691 2.946 -5.813 1.00 0.00 H new ATOM 0 HD1 PHE S 510 -6.133 5.261 -2.918 1.00 0.00 H new ATOM 0 HD2 PHE S 510 -5.371 4.854 -7.085 1.00 0.00 H new ATOM 0 HE1 PHE S 510 -5.815 7.687 -3.091 1.00 0.00 H new ATOM 0 HE2 PHE S 510 -5.041 7.281 -7.264 1.00 0.00 H new ATOM 0 HZ PHE S 510 -5.269 8.701 -5.264 1.00 0.00 H new ATOM 893 N VAL S 511 -8.539 0.937 -4.123 1.00 0.00 N ATOM 894 CA VAL S 511 -8.817 -0.475 -4.330 1.00 0.00 C ATOM 895 C VAL S 511 -10.250 -0.830 -3.940 1.00 0.00 C ATOM 896 O VAL S 511 -10.868 -1.688 -4.569 1.00 0.00 O ATOM 897 CB VAL S 511 -7.844 -1.357 -3.528 1.00 0.00 C ATOM 898 CG1 VAL S 511 -6.442 -1.286 -4.114 1.00 0.00 C ATOM 899 CG2 VAL S 511 -7.833 -0.942 -2.070 1.00 0.00 C ATOM 0 H VAL S 511 -9.081 1.374 -3.377 1.00 0.00 H new ATOM 0 HA VAL S 511 -8.684 -0.667 -5.395 1.00 0.00 H new ATOM 0 HB VAL S 511 -8.187 -2.390 -3.592 1.00 0.00 H new ATOM 0 HG11 VAL S 511 -5.772 -1.917 -3.531 1.00 0.00 H new ATOM 0 HG12 VAL S 511 -6.461 -1.634 -5.147 1.00 0.00 H new ATOM 0 HG13 VAL S 511 -6.087 -0.256 -4.085 1.00 0.00 H new ATOM 0 HG21 VAL S 511 -7.140 -1.576 -1.517 1.00 0.00 H new ATOM 0 HG22 VAL S 511 -7.517 0.098 -1.990 1.00 0.00 H new ATOM 0 HG23 VAL S 511 -8.835 -1.050 -1.653 1.00 0.00 H new ATOM 909 N GLU S 512 -10.769 -0.182 -2.888 1.00 0.00 N ATOM 910 CA GLU S 512 -12.134 -0.436 -2.395 1.00 0.00 C ATOM 911 C GLU S 512 -12.455 -1.932 -2.364 1.00 0.00 C ATOM 912 O GLU S 512 -13.618 -2.327 -2.287 1.00 0.00 O ATOM 913 CB GLU S 512 -13.152 0.291 -3.267 1.00 0.00 C ATOM 914 CG GLU S 512 -12.924 0.060 -4.743 1.00 0.00 C ATOM 915 CD GLU S 512 -14.022 0.651 -5.606 1.00 0.00 C ATOM 916 OE1 GLU S 512 -14.029 1.885 -5.795 1.00 0.00 O ATOM 917 OE2 GLU S 512 -14.876 -0.121 -6.093 1.00 0.00 O ATOM 0 H GLU S 512 -10.262 0.527 -2.358 1.00 0.00 H new ATOM 0 HA GLU S 512 -12.191 -0.058 -1.374 1.00 0.00 H new ATOM 0 HB2 GLU S 512 -14.155 -0.042 -3.002 1.00 0.00 H new ATOM 0 HB3 GLU S 512 -13.105 1.360 -3.059 1.00 0.00 H new ATOM 0 HG2 GLU S 512 -11.967 0.496 -5.031 1.00 0.00 H new ATOM 0 HG3 GLU S 512 -12.856 -1.011 -4.932 1.00 0.00 H new ATOM 986 N LYS P 360 -11.051 7.796 -15.699 1.00 0.00 N ATOM 987 CA LYS P 360 -11.544 8.065 -14.354 1.00 0.00 C ATOM 988 C LYS P 360 -10.528 8.860 -13.543 1.00 0.00 C ATOM 989 O LYS P 360 -9.332 8.571 -13.571 1.00 0.00 O ATOM 990 CB LYS P 360 -11.869 6.755 -13.631 1.00 0.00 C ATOM 991 CG LYS P 360 -13.300 6.286 -13.825 1.00 0.00 C ATOM 992 CD LYS P 360 -13.870 5.702 -12.541 1.00 0.00 C ATOM 993 CE LYS P 360 -15.335 5.325 -12.702 1.00 0.00 C ATOM 994 NZ LYS P 360 -15.950 4.921 -11.409 1.00 0.00 N ATOM 0 HA LYS P 360 -12.453 8.659 -14.448 1.00 0.00 H new ATOM 0 HB2 LYS P 360 -11.191 5.978 -13.984 1.00 0.00 H new ATOM 0 HB3 LYS P 360 -11.680 6.883 -12.565 1.00 0.00 H new ATOM 0 HG2 LYS P 360 -13.918 7.122 -14.152 1.00 0.00 H new ATOM 0 HG3 LYS P 360 -13.335 5.536 -14.615 1.00 0.00 H new ATOM 0 HD2 LYS P 360 -13.296 4.821 -12.255 1.00 0.00 H new ATOM 0 HD3 LYS P 360 -13.766 6.426 -11.733 1.00 0.00 H new ATOM 0 HE2 LYS P 360 -15.884 6.171 -13.116 1.00 0.00 H new ATOM 0 HE3 LYS P 360 -15.423 4.507 -13.417 1.00 0.00 H new ATOM 0 HZ1 LYS P 360 -16.948 4.672 -11.562 1.00 0.00 H new ATOM 0 HZ2 LYS P 360 -15.443 4.098 -11.025 1.00 0.00 H new ATOM 0 HZ3 LYS P 360 -15.890 5.710 -10.734 1.00 0.00 H new ATOM 1008 N PRO P 361 -10.999 9.879 -12.806 1.00 0.00 N ATOM 1009 CA PRO P 361 -10.150 10.729 -11.977 1.00 0.00 C ATOM 1010 C PRO P 361 -9.865 10.088 -10.624 1.00 0.00 C ATOM 1011 O PRO P 361 -10.708 10.108 -9.728 1.00 0.00 O ATOM 1012 CB PRO P 361 -10.992 12.010 -11.803 1.00 0.00 C ATOM 1013 CG PRO P 361 -12.255 11.778 -12.579 1.00 0.00 C ATOM 1014 CD PRO P 361 -12.395 10.297 -12.710 1.00 0.00 C ATOM 0 HA PRO P 361 -9.173 10.908 -12.426 1.00 0.00 H new ATOM 0 HB2 PRO P 361 -11.208 12.196 -10.751 1.00 0.00 H new ATOM 0 HB3 PRO P 361 -10.458 12.883 -12.178 1.00 0.00 H new ATOM 0 HG2 PRO P 361 -13.114 12.206 -12.062 1.00 0.00 H new ATOM 0 HG3 PRO P 361 -12.203 12.253 -13.559 1.00 0.00 H new ATOM 0 HD2 PRO P 361 -12.897 9.855 -11.849 1.00 0.00 H new ATOM 0 HD3 PRO P 361 -12.969 10.016 -13.593 1.00 0.00 H new ATOM 1022 N GLN P 362 -8.677 9.505 -10.486 1.00 0.00 N ATOM 1023 CA GLN P 362 -8.289 8.843 -9.243 1.00 0.00 C ATOM 1024 C GLN P 362 -8.604 9.700 -8.027 1.00 0.00 C ATOM 1025 O GLN P 362 -8.713 10.923 -8.114 1.00 0.00 O ATOM 1026 CB GLN P 362 -6.790 8.518 -9.235 1.00 0.00 C ATOM 1027 CG GLN P 362 -5.901 9.735 -9.427 1.00 0.00 C ATOM 1028 CD GLN P 362 -5.645 10.048 -10.888 1.00 0.00 C ATOM 1029 OE1 GLN P 362 -6.420 9.661 -11.763 1.00 0.00 O ATOM 1030 NE2 GLN P 362 -4.553 10.753 -11.160 1.00 0.00 N ATOM 0 H GLN P 362 -7.967 9.477 -11.218 1.00 0.00 H new ATOM 0 HA GLN P 362 -8.867 7.921 -9.190 1.00 0.00 H new ATOM 0 HB2 GLN P 362 -6.536 8.039 -8.289 1.00 0.00 H new ATOM 0 HB3 GLN P 362 -6.579 7.797 -10.025 1.00 0.00 H new ATOM 0 HG2 GLN P 362 -6.366 10.598 -8.951 1.00 0.00 H new ATOM 0 HG3 GLN P 362 -4.949 9.567 -8.923 1.00 0.00 H new ATOM 0 HE21 GLN P 362 -3.938 11.053 -10.403 1.00 0.00 H new ATOM 0 HE22 GLN P 362 -4.329 10.994 -12.125 1.00 0.00 H new ATOM 1039 N PRO P 363 -8.747 9.047 -6.872 1.00 0.00 N ATOM 1040 CA PRO P 363 -9.042 9.721 -5.615 1.00 0.00 C ATOM 1041 C PRO P 363 -7.870 10.546 -5.109 1.00 0.00 C ATOM 1042 O PRO P 363 -6.714 10.195 -5.332 1.00 0.00 O ATOM 1043 CB PRO P 363 -9.310 8.582 -4.628 1.00 0.00 C ATOM 1044 CG PRO P 363 -8.797 7.331 -5.259 1.00 0.00 C ATOM 1045 CD PRO P 363 -8.622 7.589 -6.724 1.00 0.00 C ATOM 0 HA PRO P 363 -9.875 10.414 -5.735 1.00 0.00 H new ATOM 0 HB2 PRO P 363 -8.809 8.769 -3.678 1.00 0.00 H new ATOM 0 HB3 PRO P 363 -10.376 8.498 -4.415 1.00 0.00 H new ATOM 0 HG2 PRO P 363 -7.849 7.038 -4.808 1.00 0.00 H new ATOM 0 HG3 PRO P 363 -9.495 6.509 -5.098 1.00 0.00 H new ATOM 0 HD2 PRO P 363 -7.651 7.239 -7.073 1.00 0.00 H new ATOM 0 HD3 PRO P 363 -9.378 7.067 -7.310 1.00 0.00 H new ATOM 1053 N ALA P 364 -8.167 11.618 -4.388 1.00 0.00 N ATOM 1054 CA ALA P 364 -7.117 12.439 -3.815 1.00 0.00 C ATOM 1055 C ALA P 364 -6.422 11.626 -2.736 1.00 0.00 C ATOM 1056 O ALA P 364 -7.025 11.305 -1.711 1.00 0.00 O ATOM 1057 CB ALA P 364 -7.689 13.728 -3.240 1.00 0.00 C ATOM 0 H ALA P 364 -9.116 11.935 -4.189 1.00 0.00 H new ATOM 0 HA ALA P 364 -6.402 12.723 -4.587 1.00 0.00 H new ATOM 0 HB1 ALA P 364 -6.883 14.327 -2.816 1.00 0.00 H new ATOM 0 HB2 ALA P 364 -8.182 14.292 -4.032 1.00 0.00 H new ATOM 0 HB3 ALA P 364 -8.412 13.489 -2.460 1.00 0.00 H new ATOM 1063 N VAL P 365 -5.172 11.244 -2.980 1.00 0.00 N ATOM 1064 CA VAL P 365 -4.450 10.414 -2.020 1.00 0.00 C ATOM 1065 C VAL P 365 -4.560 10.988 -0.606 1.00 0.00 C ATOM 1066 O VAL P 365 -4.424 12.194 -0.398 1.00 0.00 O ATOM 1067 CB VAL P 365 -2.963 10.209 -2.387 1.00 0.00 C ATOM 1068 CG1 VAL P 365 -2.491 8.861 -1.883 1.00 0.00 C ATOM 1069 CG2 VAL P 365 -2.738 10.287 -3.882 1.00 0.00 C ATOM 0 H VAL P 365 -4.645 11.490 -3.818 1.00 0.00 H new ATOM 0 HA VAL P 365 -4.928 9.435 -2.055 1.00 0.00 H new ATOM 0 HB VAL P 365 -2.394 11.009 -1.914 1.00 0.00 H new ATOM 0 HG11 VAL P 365 -1.442 8.722 -2.144 1.00 0.00 H new ATOM 0 HG12 VAL P 365 -2.604 8.818 -0.800 1.00 0.00 H new ATOM 0 HG13 VAL P 365 -3.087 8.072 -2.342 1.00 0.00 H new ATOM 0 HG21 VAL P 365 -1.680 10.138 -4.099 1.00 0.00 H new ATOM 0 HG22 VAL P 365 -3.323 9.513 -4.379 1.00 0.00 H new ATOM 0 HG23 VAL P 365 -3.048 11.266 -4.246 1.00 0.00 H new ATOM 1079 N PRO P 366 -4.840 10.115 0.376 1.00 0.00 N ATOM 1080 CA PRO P 366 -5.011 10.510 1.782 1.00 0.00 C ATOM 1081 C PRO P 366 -3.708 10.902 2.470 1.00 0.00 C ATOM 1082 O PRO P 366 -2.625 10.744 1.907 1.00 0.00 O ATOM 1083 CB PRO P 366 -5.584 9.245 2.426 1.00 0.00 C ATOM 1084 CG PRO P 366 -5.069 8.133 1.584 1.00 0.00 C ATOM 1085 CD PRO P 366 -5.038 8.668 0.182 1.00 0.00 C ATOM 0 HA PRO P 366 -5.641 11.395 1.871 1.00 0.00 H new ATOM 0 HB2 PRO P 366 -5.257 9.143 3.461 1.00 0.00 H new ATOM 0 HB3 PRO P 366 -6.674 9.263 2.436 1.00 0.00 H new ATOM 0 HG2 PRO P 366 -4.075 7.824 1.908 1.00 0.00 H new ATOM 0 HG3 PRO P 366 -5.714 7.257 1.655 1.00 0.00 H new ATOM 0 HD2 PRO P 366 -4.229 8.226 -0.400 1.00 0.00 H new ATOM 0 HD3 PRO P 366 -5.966 8.457 -0.350 1.00 0.00 H new ATOM 1093 N PRO P 367 -3.802 11.404 3.716 1.00 0.00 N ATOM 1094 CA PRO P 367 -2.631 11.805 4.503 1.00 0.00 C ATOM 1095 C PRO P 367 -1.804 10.600 4.912 1.00 0.00 C ATOM 1096 O PRO P 367 -2.052 9.971 5.941 1.00 0.00 O ATOM 1097 CB PRO P 367 -3.242 12.470 5.731 1.00 0.00 C ATOM 1098 CG PRO P 367 -4.552 11.794 5.873 1.00 0.00 C ATOM 1099 CD PRO P 367 -5.051 11.605 4.470 1.00 0.00 C ATOM 0 HA PRO P 367 -1.956 12.456 3.947 1.00 0.00 H new ATOM 0 HB2 PRO P 367 -2.620 12.330 6.615 1.00 0.00 H new ATOM 0 HB3 PRO P 367 -3.358 13.545 5.590 1.00 0.00 H new ATOM 0 HG2 PRO P 367 -4.448 10.838 6.386 1.00 0.00 H new ATOM 0 HG3 PRO P 367 -5.245 12.397 6.460 1.00 0.00 H new ATOM 0 HD2 PRO P 367 -5.718 10.747 4.388 1.00 0.00 H new ATOM 0 HD3 PRO P 367 -5.605 12.474 4.115 1.00 0.00 H new ATOM 1107 N ARG P 368 -0.832 10.284 4.080 1.00 0.00 N ATOM 1108 CA ARG P 368 0.060 9.149 4.292 1.00 0.00 C ATOM 1109 C ARG P 368 0.454 8.993 5.763 1.00 0.00 C ATOM 1110 O ARG P 368 0.601 9.972 6.494 1.00 0.00 O ATOM 1111 CB ARG P 368 1.289 9.307 3.401 1.00 0.00 C ATOM 1112 CG ARG P 368 2.050 8.018 3.158 1.00 0.00 C ATOM 1113 CD ARG P 368 3.186 8.219 2.170 1.00 0.00 C ATOM 1114 NE ARG P 368 4.190 9.154 2.672 1.00 0.00 N ATOM 1115 CZ ARG P 368 5.051 8.867 3.644 1.00 0.00 C ATOM 1116 NH1 ARG P 368 5.036 7.673 4.222 1.00 0.00 N ATOM 1117 NH2 ARG P 368 5.932 9.776 4.041 1.00 0.00 N ATOM 0 H ARG P 368 -0.633 10.809 3.229 1.00 0.00 H new ATOM 0 HA ARG P 368 -0.469 8.235 4.020 1.00 0.00 H new ATOM 0 HB2 ARG P 368 0.977 9.718 2.441 1.00 0.00 H new ATOM 0 HB3 ARG P 368 1.963 10.033 3.856 1.00 0.00 H new ATOM 0 HG2 ARG P 368 2.449 7.647 4.102 1.00 0.00 H new ATOM 0 HG3 ARG P 368 1.367 7.257 2.779 1.00 0.00 H new ATOM 0 HD2 ARG P 368 3.658 7.259 1.960 1.00 0.00 H new ATOM 0 HD3 ARG P 368 2.785 8.590 1.227 1.00 0.00 H new ATOM 0 HE ARG P 368 4.233 10.082 2.252 1.00 0.00 H new ATOM 0 HH11 ARG P 368 4.362 6.969 3.921 1.00 0.00 H new ATOM 0 HH12 ARG P 368 5.699 7.459 4.967 1.00 0.00 H new ATOM 0 HH21 ARG P 368 5.949 10.696 3.601 1.00 0.00 H new ATOM 0 HH22 ARG P 368 6.592 9.555 4.787 1.00 0.00 H new ATOM 1131 N PRO P 369 0.604 7.732 6.207 1.00 0.00 N ATOM 1132 CA PRO P 369 0.955 7.391 7.594 1.00 0.00 C ATOM 1133 C PRO P 369 2.186 8.130 8.097 1.00 0.00 C ATOM 1134 O PRO P 369 2.865 8.821 7.336 1.00 0.00 O ATOM 1135 CB PRO P 369 1.217 5.889 7.515 1.00 0.00 C ATOM 1136 CG PRO P 369 0.348 5.435 6.397 1.00 0.00 C ATOM 1137 CD PRO P 369 0.424 6.525 5.382 1.00 0.00 C ATOM 0 HA PRO P 369 0.170 7.672 8.296 1.00 0.00 H new ATOM 0 HB2 PRO P 369 2.267 5.676 7.317 1.00 0.00 H new ATOM 0 HB3 PRO P 369 0.961 5.389 8.449 1.00 0.00 H new ATOM 0 HG2 PRO P 369 0.697 4.488 5.986 1.00 0.00 H new ATOM 0 HG3 PRO P 369 -0.677 5.279 6.732 1.00 0.00 H new ATOM 0 HD2 PRO P 369 1.256 6.379 4.694 1.00 0.00 H new ATOM 0 HD3 PRO P 369 -0.482 6.579 4.779 1.00 0.00 H new ATOM 1145 N SER P 370 2.468 7.979 9.387 1.00 0.00 N ATOM 1146 CA SER P 370 3.618 8.628 10.002 1.00 0.00 C ATOM 1147 C SER P 370 4.856 7.738 9.925 1.00 0.00 C ATOM 1148 O SER P 370 5.756 7.843 10.759 1.00 0.00 O ATOM 1149 CB SER P 370 3.316 8.976 11.460 1.00 0.00 C ATOM 1150 OG SER P 370 4.065 10.102 11.883 1.00 0.00 O ATOM 0 H SER P 370 1.913 7.411 10.027 1.00 0.00 H new ATOM 0 HA SER P 370 3.820 9.546 9.451 1.00 0.00 H new ATOM 0 HB2 SER P 370 2.251 9.180 11.575 1.00 0.00 H new ATOM 0 HB3 SER P 370 3.548 8.122 12.096 1.00 0.00 H new ATOM 0 HG SER P 370 3.852 10.304 12.818 1.00 0.00 H new ATOM 1156 N ALA P 371 4.895 6.865 8.919 1.00 0.00 N ATOM 1157 CA ALA P 371 6.021 5.958 8.726 1.00 0.00 C ATOM 1158 C ALA P 371 6.098 4.911 9.834 1.00 0.00 C ATOM 1159 O ALA P 371 5.986 3.715 9.580 1.00 0.00 O ATOM 1160 CB ALA P 371 7.322 6.741 8.640 1.00 0.00 C ATOM 0 H ALA P 371 4.155 6.768 8.223 1.00 0.00 H new ATOM 0 HA ALA P 371 5.864 5.429 7.786 1.00 0.00 H new ATOM 0 HB1 ALA P 371 8.153 6.051 8.496 1.00 0.00 H new ATOM 0 HB2 ALA P 371 7.275 7.433 7.799 1.00 0.00 H new ATOM 0 HB3 ALA P 371 7.471 7.301 9.563 1.00 0.00 H new ATOM 1166 N ASP P 372 6.304 5.360 11.062 1.00 0.00 N ATOM 1167 CA ASP P 372 6.410 4.446 12.198 1.00 0.00 C ATOM 1168 C ASP P 372 5.275 3.426 12.211 1.00 0.00 C ATOM 1169 O ASP P 372 5.536 2.225 12.174 1.00 0.00 O ATOM 1170 CB ASP P 372 6.437 5.224 13.514 1.00 0.00 C ATOM 1171 CG ASP P 372 7.820 5.741 13.851 1.00 0.00 C ATOM 1172 OD1 ASP P 372 8.807 5.187 13.322 1.00 0.00 O ATOM 1173 OD2 ASP P 372 7.920 6.701 14.645 1.00 0.00 O ATOM 0 H ASP P 372 6.401 6.347 11.301 1.00 0.00 H new ATOM 0 HA ASP P 372 7.347 3.900 12.090 1.00 0.00 H new ATOM 0 HB2 ASP P 372 5.744 6.063 13.451 1.00 0.00 H new ATOM 0 HB3 ASP P 372 6.086 4.580 14.321 1.00 0.00 H new ATOM 1178 N LEU P 373 4.015 3.875 12.255 1.00 0.00 N ATOM 1179 CA LEU P 373 2.914 2.916 12.258 1.00 0.00 C ATOM 1180 C LEU P 373 3.053 1.990 11.060 1.00 0.00 C ATOM 1181 O LEU P 373 2.654 0.826 11.110 1.00 0.00 O ATOM 1182 CB LEU P 373 1.526 3.586 12.328 1.00 0.00 C ATOM 1183 CG LEU P 373 1.014 4.336 11.088 1.00 0.00 C ATOM 1184 CD1 LEU P 373 1.047 3.468 9.842 1.00 0.00 C ATOM 1185 CD2 LEU P 373 -0.408 4.804 11.334 1.00 0.00 C ATOM 0 H LEU P 373 3.742 4.857 12.288 1.00 0.00 H new ATOM 0 HA LEU P 373 2.980 2.325 13.171 1.00 0.00 H new ATOM 0 HB2 LEU P 373 0.797 2.814 12.574 1.00 0.00 H new ATOM 0 HB3 LEU P 373 1.538 4.290 13.160 1.00 0.00 H new ATOM 0 HG LEU P 373 1.674 5.187 10.920 1.00 0.00 H new ATOM 0 HD11 LEU P 373 0.676 4.039 8.991 1.00 0.00 H new ATOM 0 HD12 LEU P 373 2.071 3.150 9.647 1.00 0.00 H new ATOM 0 HD13 LEU P 373 0.417 2.591 9.993 1.00 0.00 H new ATOM 0 HD21 LEU P 373 -0.773 5.336 10.456 1.00 0.00 H new ATOM 0 HD22 LEU P 373 -1.046 3.942 11.527 1.00 0.00 H new ATOM 0 HD23 LEU P 373 -0.428 5.471 12.196 1.00 0.00 H new ATOM 1197 N ILE P 374 3.689 2.496 9.999 1.00 0.00 N ATOM 1198 CA ILE P 374 3.949 1.685 8.824 1.00 0.00 C ATOM 1199 C ILE P 374 4.981 0.651 9.224 1.00 0.00 C ATOM 1200 O ILE P 374 4.823 -0.545 8.989 1.00 0.00 O ATOM 1201 CB ILE P 374 4.497 2.515 7.641 1.00 0.00 C ATOM 1202 CG1 ILE P 374 3.486 3.580 7.214 1.00 0.00 C ATOM 1203 CG2 ILE P 374 4.854 1.605 6.479 1.00 0.00 C ATOM 1204 CD1 ILE P 374 3.964 4.444 6.068 1.00 0.00 C ATOM 0 H ILE P 374 4.028 3.456 9.937 1.00 0.00 H new ATOM 0 HA ILE P 374 3.015 1.235 8.488 1.00 0.00 H new ATOM 0 HB ILE P 374 5.404 3.026 7.965 1.00 0.00 H new ATOM 0 HG12 ILE P 374 2.556 3.091 6.926 1.00 0.00 H new ATOM 0 HG13 ILE P 374 3.260 4.217 8.069 1.00 0.00 H new ATOM 0 HG21 ILE P 374 5.239 2.203 5.653 1.00 0.00 H new ATOM 0 HG22 ILE P 374 5.615 0.892 6.796 1.00 0.00 H new ATOM 0 HG23 ILE P 374 3.965 1.065 6.153 1.00 0.00 H new ATOM 0 HD11 ILE P 374 3.196 5.176 5.819 1.00 0.00 H new ATOM 0 HD12 ILE P 374 4.878 4.962 6.359 1.00 0.00 H new ATOM 0 HD13 ILE P 374 4.163 3.818 5.198 1.00 0.00 H new ATOM 1216 N LEU P 375 6.019 1.145 9.887 1.00 0.00 N ATOM 1217 CA LEU P 375 7.080 0.305 10.400 1.00 0.00 C ATOM 1218 C LEU P 375 6.500 -0.681 11.405 1.00 0.00 C ATOM 1219 O LEU P 375 7.073 -1.737 11.674 1.00 0.00 O ATOM 1220 CB LEU P 375 8.155 1.188 11.042 1.00 0.00 C ATOM 1221 CG LEU P 375 8.852 2.135 10.064 1.00 0.00 C ATOM 1222 CD1 LEU P 375 9.137 3.479 10.717 1.00 0.00 C ATOM 1223 CD2 LEU P 375 10.143 1.524 9.540 1.00 0.00 C ATOM 0 H LEU P 375 6.144 2.139 10.081 1.00 0.00 H new ATOM 0 HA LEU P 375 7.540 -0.263 9.592 1.00 0.00 H new ATOM 0 HB2 LEU P 375 7.699 1.777 11.838 1.00 0.00 H new ATOM 0 HB3 LEU P 375 8.904 0.548 11.508 1.00 0.00 H new ATOM 0 HG LEU P 375 8.178 2.294 9.222 1.00 0.00 H new ATOM 0 HD11 LEU P 375 9.633 4.134 10.000 1.00 0.00 H new ATOM 0 HD12 LEU P 375 8.200 3.934 11.036 1.00 0.00 H new ATOM 0 HD13 LEU P 375 9.783 3.333 11.583 1.00 0.00 H new ATOM 0 HD21 LEU P 375 10.619 2.218 8.847 1.00 0.00 H new ATOM 0 HD22 LEU P 375 10.816 1.326 10.374 1.00 0.00 H new ATOM 0 HD23 LEU P 375 9.920 0.590 9.023 1.00 0.00 H new ATOM 1235 N ASN P 376 5.335 -0.320 11.933 1.00 0.00 N ATOM 1236 CA ASN P 376 4.621 -1.141 12.891 1.00 0.00 C ATOM 1237 C ASN P 376 3.661 -2.089 12.174 1.00 0.00 C ATOM 1238 O ASN P 376 3.232 -3.095 12.740 1.00 0.00 O ATOM 1239 CB ASN P 376 3.832 -0.240 13.844 1.00 0.00 C ATOM 1240 CG ASN P 376 3.999 -0.645 15.297 1.00 0.00 C ATOM 1241 OD1 ASN P 376 5.079 -0.507 15.871 1.00 0.00 O ATOM 1242 ND2 ASN P 376 2.926 -1.147 15.897 1.00 0.00 N ATOM 0 H ASN P 376 4.862 0.554 11.704 1.00 0.00 H new ATOM 0 HA ASN P 376 5.343 -1.733 13.453 1.00 0.00 H new ATOM 0 HB2 ASN P 376 4.159 0.792 13.718 1.00 0.00 H new ATOM 0 HB3 ASN P 376 2.775 -0.274 13.580 1.00 0.00 H new ATOM 0 HD21 ASN P 376 2.977 -1.437 16.874 1.00 0.00 H new ATOM 0 HD22 ASN P 376 2.051 -1.243 15.381 1.00 0.00 H new ATOM 1249 N ARG P 377 3.299 -1.744 10.936 1.00 0.00 N ATOM 1250 CA ARG P 377 2.356 -2.551 10.169 1.00 0.00 C ATOM 1251 C ARG P 377 2.816 -2.780 8.721 1.00 0.00 C ATOM 1252 O ARG P 377 2.010 -2.693 7.794 1.00 0.00 O ATOM 1253 CB ARG P 377 0.977 -1.879 10.173 1.00 0.00 C ATOM 1254 CG ARG P 377 0.603 -1.222 11.500 1.00 0.00 C ATOM 1255 CD ARG P 377 -0.163 0.078 11.291 1.00 0.00 C ATOM 1256 NE ARG P 377 -1.609 -0.132 11.324 1.00 0.00 N ATOM 1257 CZ ARG P 377 -2.329 -0.170 12.442 1.00 0.00 C ATOM 1258 NH1 ARG P 377 -1.743 -0.020 13.625 1.00 0.00 N ATOM 1259 NH2 ARG P 377 -3.640 -0.363 12.380 1.00 0.00 N ATOM 0 H ARG P 377 3.643 -0.917 10.449 1.00 0.00 H new ATOM 0 HA ARG P 377 2.302 -3.528 10.649 1.00 0.00 H new ATOM 0 HB2 ARG P 377 0.951 -1.124 9.387 1.00 0.00 H new ATOM 0 HB3 ARG P 377 0.222 -2.624 9.924 1.00 0.00 H new ATOM 0 HG2 ARG P 377 -0.003 -1.911 12.088 1.00 0.00 H new ATOM 0 HG3 ARG P 377 1.507 -1.023 12.075 1.00 0.00 H new ATOM 0 HD2 ARG P 377 0.118 0.794 12.064 1.00 0.00 H new ATOM 0 HD3 ARG P 377 0.119 0.516 10.333 1.00 0.00 H new ATOM 0 HE ARG P 377 -2.095 -0.257 10.436 1.00 0.00 H new ATOM 0 HH11 ARG P 377 -0.735 0.125 13.680 1.00 0.00 H new ATOM 0 HH12 ARG P 377 -2.301 -0.050 14.478 1.00 0.00 H new ATOM 0 HH21 ARG P 377 -4.096 -0.482 11.475 1.00 0.00 H new ATOM 0 HH22 ARG P 377 -4.192 -0.392 13.237 1.00 0.00 H new ATOM 1273 N CYS P 378 4.097 -3.097 8.524 1.00 0.00 N ATOM 1274 CA CYS P 378 4.616 -3.360 7.176 1.00 0.00 C ATOM 1275 C CYS P 378 5.897 -4.185 7.217 1.00 0.00 C ATOM 1276 O CYS P 378 6.431 -4.476 8.287 1.00 0.00 O ATOM 1277 CB CYS P 378 4.871 -2.060 6.405 1.00 0.00 C ATOM 1278 SG CYS P 378 3.409 -1.402 5.572 1.00 0.00 S ATOM 0 H CYS P 378 4.789 -3.178 9.269 1.00 0.00 H new ATOM 0 HA CYS P 378 3.847 -3.932 6.656 1.00 0.00 H new ATOM 0 HB2 CYS P 378 5.252 -1.308 7.096 1.00 0.00 H new ATOM 0 HB3 CYS P 378 5.651 -2.236 5.664 1.00 0.00 H new ATOM 0 HG CYS P 378 2.347 -2.000 6.023 1.00 0.00 H new ATOM 1284 N SER P 379 6.381 -4.557 6.034 1.00 0.00 N ATOM 1285 CA SER P 379 7.599 -5.349 5.912 1.00 0.00 C ATOM 1286 C SER P 379 8.837 -4.465 6.018 1.00 0.00 C ATOM 1287 O SER P 379 8.747 -3.241 5.923 1.00 0.00 O ATOM 1288 CB SER P 379 7.612 -6.100 4.577 1.00 0.00 C ATOM 1289 OG SER P 379 7.037 -7.389 4.710 1.00 0.00 O ATOM 0 H SER P 379 5.944 -4.320 5.143 1.00 0.00 H new ATOM 0 HA SER P 379 7.616 -6.069 6.730 1.00 0.00 H new ATOM 0 HB2 SER P 379 7.062 -5.528 3.830 1.00 0.00 H new ATOM 0 HB3 SER P 379 8.637 -6.191 4.218 1.00 0.00 H new ATOM 0 HG SER P 379 6.068 -7.330 4.579 1.00 0.00 H new ATOM 1295 N GLU P 380 9.992 -5.092 6.211 1.00 0.00 N ATOM 1296 CA GLU P 380 11.248 -4.361 6.326 1.00 0.00 C ATOM 1297 C GLU P 380 11.532 -3.573 5.051 1.00 0.00 C ATOM 1298 O GLU P 380 12.172 -2.521 5.090 1.00 0.00 O ATOM 1299 CB GLU P 380 12.401 -5.324 6.612 1.00 0.00 C ATOM 1300 CG GLU P 380 13.676 -4.630 7.063 1.00 0.00 C ATOM 1301 CD GLU P 380 13.856 -4.659 8.568 1.00 0.00 C ATOM 1302 OE1 GLU P 380 12.849 -4.847 9.283 1.00 0.00 O ATOM 1303 OE2 GLU P 380 15.003 -4.494 9.032 1.00 0.00 O ATOM 0 H GLU P 380 10.084 -6.105 6.291 1.00 0.00 H new ATOM 0 HA GLU P 380 11.158 -3.660 7.156 1.00 0.00 H new ATOM 0 HB2 GLU P 380 12.090 -6.031 7.381 1.00 0.00 H new ATOM 0 HB3 GLU P 380 12.611 -5.903 5.713 1.00 0.00 H new ATOM 0 HG2 GLU P 380 14.533 -5.109 6.589 1.00 0.00 H new ATOM 0 HG3 GLU P 380 13.661 -3.595 6.723 1.00 0.00 H new ATOM 1310 N SER P 381 11.053 -4.087 3.923 1.00 0.00 N ATOM 1311 CA SER P 381 11.254 -3.428 2.637 1.00 0.00 C ATOM 1312 C SER P 381 10.675 -2.017 2.655 1.00 0.00 C ATOM 1313 O SER P 381 11.415 -1.035 2.605 1.00 0.00 O ATOM 1314 CB SER P 381 10.609 -4.244 1.516 1.00 0.00 C ATOM 1315 OG SER P 381 11.335 -4.113 0.306 1.00 0.00 O ATOM 0 H SER P 381 10.523 -4.957 3.873 1.00 0.00 H new ATOM 0 HA SER P 381 12.326 -3.359 2.454 1.00 0.00 H new ATOM 0 HB2 SER P 381 10.565 -5.294 1.805 1.00 0.00 H new ATOM 0 HB3 SER P 381 9.582 -3.912 1.365 1.00 0.00 H new ATOM 0 HG SER P 381 11.002 -4.763 -0.347 1.00 0.00 H new ATOM 1321 N THR P 382 9.349 -1.922 2.736 1.00 0.00 N ATOM 1322 CA THR P 382 8.683 -0.624 2.771 1.00 0.00 C ATOM 1323 C THR P 382 9.197 0.204 3.940 1.00 0.00 C ATOM 1324 O THR P 382 9.287 1.429 3.859 1.00 0.00 O ATOM 1325 CB THR P 382 7.167 -0.798 2.884 1.00 0.00 C ATOM 1326 OG1 THR P 382 6.654 -1.487 1.759 1.00 0.00 O ATOM 1327 CG2 THR P 382 6.420 0.516 2.997 1.00 0.00 C ATOM 0 H THR P 382 8.719 -2.723 2.778 1.00 0.00 H new ATOM 0 HA THR P 382 8.907 -0.102 1.841 1.00 0.00 H new ATOM 0 HB THR P 382 7.011 -1.368 3.800 1.00 0.00 H new ATOM 0 HG1 THR P 382 6.011 -2.164 2.056 1.00 0.00 H new ATOM 0 HG21 THR P 382 5.350 0.321 3.074 1.00 0.00 H new ATOM 0 HG22 THR P 382 6.756 1.050 3.886 1.00 0.00 H new ATOM 0 HG23 THR P 382 6.616 1.123 2.113 1.00 0.00 H new ATOM 1335 N LYS P 383 9.533 -0.480 5.027 1.00 0.00 N ATOM 1336 CA LYS P 383 10.041 0.180 6.221 1.00 0.00 C ATOM 1337 C LYS P 383 11.305 0.976 5.909 1.00 0.00 C ATOM 1338 O LYS P 383 11.505 2.072 6.432 1.00 0.00 O ATOM 1339 CB LYS P 383 10.333 -0.856 7.306 1.00 0.00 C ATOM 1340 CG LYS P 383 9.146 -1.129 8.210 1.00 0.00 C ATOM 1341 CD LYS P 383 9.210 -2.514 8.826 1.00 0.00 C ATOM 1342 CE LYS P 383 10.225 -2.570 9.958 1.00 0.00 C ATOM 1343 NZ LYS P 383 10.620 -3.969 10.282 1.00 0.00 N ATOM 0 H LYS P 383 9.462 -1.495 5.105 1.00 0.00 H new ATOM 0 HA LYS P 383 9.279 0.873 6.579 1.00 0.00 H new ATOM 0 HB2 LYS P 383 10.644 -1.788 6.834 1.00 0.00 H new ATOM 0 HB3 LYS P 383 11.171 -0.511 7.912 1.00 0.00 H new ATOM 0 HG2 LYS P 383 9.113 -0.381 9.002 1.00 0.00 H new ATOM 0 HG3 LYS P 383 8.224 -1.028 7.638 1.00 0.00 H new ATOM 0 HD2 LYS P 383 8.226 -2.792 9.203 1.00 0.00 H new ATOM 0 HD3 LYS P 383 9.476 -3.243 8.060 1.00 0.00 H new ATOM 0 HE2 LYS P 383 11.110 -1.998 9.680 1.00 0.00 H new ATOM 0 HE3 LYS P 383 9.805 -2.097 10.846 1.00 0.00 H new ATOM 0 HZ1 LYS P 383 11.073 -3.994 11.218 1.00 0.00 H new ATOM 0 HZ2 LYS P 383 9.775 -4.575 10.290 1.00 0.00 H new ATOM 0 HZ3 LYS P 383 11.289 -4.316 9.565 1.00 0.00 H new ATOM 1357 N ARG P 384 12.151 0.414 5.054 1.00 0.00 N ATOM 1358 CA ARG P 384 13.395 1.067 4.667 1.00 0.00 C ATOM 1359 C ARG P 384 13.129 2.403 3.974 1.00 0.00 C ATOM 1360 O ARG P 384 14.022 3.241 3.863 1.00 0.00 O ATOM 1361 CB ARG P 384 14.207 0.156 3.745 1.00 0.00 C ATOM 1362 CG ARG P 384 15.147 -0.781 4.486 1.00 0.00 C ATOM 1363 CD ARG P 384 16.585 -0.290 4.436 1.00 0.00 C ATOM 1364 NE ARG P 384 16.712 1.092 4.899 1.00 0.00 N ATOM 1365 CZ ARG P 384 16.787 2.149 4.090 1.00 0.00 C ATOM 1366 NH1 ARG P 384 16.736 1.998 2.771 1.00 0.00 N ATOM 1367 NH2 ARG P 384 16.910 3.364 4.604 1.00 0.00 N ATOM 0 H ARG P 384 11.998 -0.494 4.615 1.00 0.00 H new ATOM 0 HA ARG P 384 13.966 1.262 5.575 1.00 0.00 H new ATOM 0 HB2 ARG P 384 13.522 -0.436 3.138 1.00 0.00 H new ATOM 0 HB3 ARG P 384 14.788 0.773 3.060 1.00 0.00 H new ATOM 0 HG2 ARG P 384 14.829 -0.869 5.525 1.00 0.00 H new ATOM 0 HG3 ARG P 384 15.087 -1.777 4.048 1.00 0.00 H new ATOM 0 HD2 ARG P 384 17.210 -0.937 5.052 1.00 0.00 H new ATOM 0 HD3 ARG P 384 16.958 -0.365 3.414 1.00 0.00 H new ATOM 0 HE ARG P 384 16.745 1.257 5.905 1.00 0.00 H new ATOM 0 HH11 ARG P 384 16.639 1.066 2.368 1.00 0.00 H new ATOM 0 HH12 ARG P 384 16.794 2.814 2.162 1.00 0.00 H new ATOM 0 HH21 ARG P 384 16.947 3.488 5.616 1.00 0.00 H new ATOM 0 HH22 ARG P 384 16.968 4.175 3.988 1.00 0.00 H new ATOM 1381 N LYS P 385 11.896 2.594 3.508 1.00 0.00 N ATOM 1382 CA LYS P 385 11.524 3.827 2.825 1.00 0.00 C ATOM 1383 C LYS P 385 10.877 4.820 3.791 1.00 0.00 C ATOM 1384 O LYS P 385 10.035 5.627 3.395 1.00 0.00 O ATOM 1385 CB LYS P 385 10.577 3.522 1.661 1.00 0.00 C ATOM 1386 CG LYS P 385 11.303 3.102 0.393 1.00 0.00 C ATOM 1387 CD LYS P 385 10.369 2.444 -0.610 1.00 0.00 C ATOM 1388 CE LYS P 385 9.871 1.100 -0.107 1.00 0.00 C ATOM 1389 NZ LYS P 385 8.410 0.927 -0.333 1.00 0.00 N ATOM 0 H LYS P 385 11.142 1.912 3.591 1.00 0.00 H new ATOM 0 HA LYS P 385 12.432 4.284 2.432 1.00 0.00 H new ATOM 0 HB2 LYS P 385 9.890 2.730 1.958 1.00 0.00 H new ATOM 0 HB3 LYS P 385 9.974 4.405 1.451 1.00 0.00 H new ATOM 0 HG2 LYS P 385 11.768 3.975 -0.064 1.00 0.00 H new ATOM 0 HG3 LYS P 385 12.106 2.410 0.648 1.00 0.00 H new ATOM 0 HD2 LYS P 385 9.520 3.099 -0.802 1.00 0.00 H new ATOM 0 HD3 LYS P 385 10.889 2.309 -1.559 1.00 0.00 H new ATOM 0 HE2 LYS P 385 10.413 0.300 -0.612 1.00 0.00 H new ATOM 0 HE3 LYS P 385 10.087 1.009 0.958 1.00 0.00 H new ATOM 0 HZ1 LYS P 385 8.230 -0.016 -0.732 1.00 0.00 H new ATOM 0 HZ2 LYS P 385 7.905 1.022 0.571 1.00 0.00 H new ATOM 0 HZ3 LYS P 385 8.073 1.654 -0.996 1.00 0.00 H new ATOM 1403 N LEU P 386 11.286 4.761 5.056 1.00 0.00 N ATOM 1404 CA LEU P 386 10.761 5.659 6.080 1.00 0.00 C ATOM 1405 C LEU P 386 11.529 5.492 7.389 1.00 0.00 C ATOM 1406 O LEU P 386 10.950 5.557 8.473 1.00 0.00 O ATOM 1407 CB LEU P 386 9.267 5.412 6.318 1.00 0.00 C ATOM 1408 CG LEU P 386 8.784 3.979 6.075 1.00 0.00 C ATOM 1409 CD1 LEU P 386 7.890 3.522 7.213 1.00 0.00 C ATOM 1410 CD2 LEU P 386 8.042 3.880 4.754 1.00 0.00 C ATOM 0 H LEU P 386 11.982 4.098 5.397 1.00 0.00 H new ATOM 0 HA LEU P 386 10.890 6.680 5.721 1.00 0.00 H new ATOM 0 HB2 LEU P 386 9.032 5.686 7.346 1.00 0.00 H new ATOM 0 HB3 LEU P 386 8.699 6.082 5.672 1.00 0.00 H new ATOM 0 HG LEU P 386 9.657 3.327 6.031 1.00 0.00 H new ATOM 0 HD11 LEU P 386 7.555 2.502 7.025 1.00 0.00 H new ATOM 0 HD12 LEU P 386 8.447 3.555 8.149 1.00 0.00 H new ATOM 0 HD13 LEU P 386 7.025 4.181 7.283 1.00 0.00 H new ATOM 0 HD21 LEU P 386 7.707 2.854 4.601 1.00 0.00 H new ATOM 0 HD22 LEU P 386 7.178 4.545 4.771 1.00 0.00 H new ATOM 0 HD23 LEU P 386 8.707 4.170 3.941 1.00 0.00 H new