USER MOD reduce.3.24.130724 H: found=0, std=0, add=635, rem=0, adj=12 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= -1.11 USER MOD Set 1.2: S 472 GLN : amide:sc= -1.65 K(o=-2.8,f=1.2) USER MOD Single : P 360 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 362 GLN : amide:sc= -1 X(o=-1,f=-0.85) USER MOD Single : P 370 SER OG : rot 180:sc= 0 USER MOD Single : P 376 ASN : amide:sc= 0 X(o=0,f=-0.007) USER MOD Single : P 378 CYS SG : rot -104:sc= -7.5! USER MOD Single : P 379 SER OG : rot 100:sc= 0.822 USER MOD Single : P 381 SER OG : rot 140:sc= -0.884 USER MOD Single : P 382 THR OG1 : rot 169:sc= -6.64! USER MOD Single : P 383 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 385 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 460 SER OG : rot -22:sc= -0.412 USER MOD Single : S 461 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : S 467 SER OG : rot 180:sc= 0 USER MOD Single : S 468 TYR OH : rot 3:sc= 0.452 USER MOD Single : S 479 GLN : amide:sc= -1.94 X(o=-1.9,f=-1.6) USER MOD Single : S 488 SER OG : rot 180:sc= 0.0727 USER MOD Single : S 489 LYS NZ :NH3+ -118:sc=-0.00495 (180deg=-0.0336) USER MOD Single : S 491 ASN : amide:sc= -7.94! C(o=-7.9!,f=-22!) USER MOD Single : S 499 SER OG : rot 180:sc= -0.959 USER MOD Single : S 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 502 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 508 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 90 N SER S 460 -3.649 -9.912 2.161 1.00 0.00 N ATOM 91 CA SER S 460 -4.943 -9.791 1.502 1.00 0.00 C ATOM 92 C SER S 460 -4.743 -9.269 0.084 1.00 0.00 C ATOM 93 O SER S 460 -3.607 -9.103 -0.359 1.00 0.00 O ATOM 94 CB SER S 460 -5.861 -8.852 2.286 1.00 0.00 C ATOM 95 OG SER S 460 -5.116 -7.845 2.949 1.00 0.00 O ATOM 0 HA SER S 460 -5.414 -10.773 1.463 1.00 0.00 H new ATOM 0 HB2 SER S 460 -6.579 -8.390 1.608 1.00 0.00 H new ATOM 0 HB3 SER S 460 -6.434 -9.424 3.015 1.00 0.00 H new ATOM 0 HG SER S 460 -4.190 -8.145 3.064 1.00 0.00 H new ATOM 101 N GLN S 461 -5.833 -9.007 -0.634 1.00 0.00 N ATOM 102 CA GLN S 461 -5.719 -8.502 -1.999 1.00 0.00 C ATOM 103 C GLN S 461 -6.971 -7.747 -2.436 1.00 0.00 C ATOM 104 O GLN S 461 -8.079 -8.037 -1.983 1.00 0.00 O ATOM 105 CB GLN S 461 -5.451 -9.651 -2.974 1.00 0.00 C ATOM 106 CG GLN S 461 -4.275 -10.528 -2.581 1.00 0.00 C ATOM 107 CD GLN S 461 -3.942 -11.564 -3.637 1.00 0.00 C ATOM 108 OE1 GLN S 461 -3.403 -11.238 -4.695 1.00 0.00 O ATOM 109 NE2 GLN S 461 -4.263 -12.821 -3.354 1.00 0.00 N ATOM 0 H GLN S 461 -6.789 -9.133 -0.301 1.00 0.00 H new ATOM 0 HA GLN S 461 -4.881 -7.805 -2.012 1.00 0.00 H new ATOM 0 HB2 GLN S 461 -6.345 -10.270 -3.046 1.00 0.00 H new ATOM 0 HB3 GLN S 461 -5.268 -9.238 -3.966 1.00 0.00 H new ATOM 0 HG2 GLN S 461 -3.401 -9.900 -2.405 1.00 0.00 H new ATOM 0 HG3 GLN S 461 -4.500 -11.032 -1.641 1.00 0.00 H new ATOM 0 HE21 GLN S 461 -4.709 -13.046 -2.464 1.00 0.00 H new ATOM 0 HE22 GLN S 461 -4.064 -13.562 -4.026 1.00 0.00 H new ATOM 118 N VAL S 462 -6.777 -6.781 -3.330 1.00 0.00 N ATOM 119 CA VAL S 462 -7.874 -5.975 -3.855 1.00 0.00 C ATOM 120 C VAL S 462 -7.477 -5.301 -5.163 1.00 0.00 C ATOM 121 O VAL S 462 -6.550 -4.490 -5.194 1.00 0.00 O ATOM 122 CB VAL S 462 -8.315 -4.887 -2.854 1.00 0.00 C ATOM 123 CG1 VAL S 462 -9.406 -5.413 -1.936 1.00 0.00 C ATOM 124 CG2 VAL S 462 -7.122 -4.382 -2.054 1.00 0.00 C ATOM 0 H VAL S 462 -5.862 -6.537 -3.708 1.00 0.00 H new ATOM 0 HA VAL S 462 -8.707 -6.657 -4.027 1.00 0.00 H new ATOM 0 HB VAL S 462 -8.725 -4.047 -3.415 1.00 0.00 H new ATOM 0 HG11 VAL S 462 -9.703 -4.630 -1.238 1.00 0.00 H new ATOM 0 HG12 VAL S 462 -10.268 -5.715 -2.531 1.00 0.00 H new ATOM 0 HG13 VAL S 462 -9.031 -6.272 -1.380 1.00 0.00 H new ATOM 0 HG21 VAL S 462 -7.452 -3.615 -1.353 1.00 0.00 H new ATOM 0 HG22 VAL S 462 -6.677 -5.210 -1.503 1.00 0.00 H new ATOM 0 HG23 VAL S 462 -6.382 -3.959 -2.733 1.00 0.00 H new ATOM 134 N GLU S 463 -8.178 -5.632 -6.244 1.00 0.00 N ATOM 135 CA GLU S 463 -7.888 -5.045 -7.547 1.00 0.00 C ATOM 136 C GLU S 463 -7.823 -3.524 -7.454 1.00 0.00 C ATOM 137 O GLU S 463 -8.445 -2.924 -6.577 1.00 0.00 O ATOM 138 CB GLU S 463 -8.951 -5.461 -8.564 1.00 0.00 C ATOM 139 CG GLU S 463 -8.454 -6.494 -9.558 1.00 0.00 C ATOM 140 CD GLU S 463 -9.384 -6.658 -10.745 1.00 0.00 C ATOM 141 OE1 GLU S 463 -9.265 -5.869 -11.706 1.00 0.00 O ATOM 142 OE2 GLU S 463 -10.230 -7.576 -10.713 1.00 0.00 O ATOM 0 H GLU S 463 -8.948 -6.301 -6.243 1.00 0.00 H new ATOM 0 HA GLU S 463 -6.917 -5.413 -7.877 1.00 0.00 H new ATOM 0 HB2 GLU S 463 -9.815 -5.862 -8.034 1.00 0.00 H new ATOM 0 HB3 GLU S 463 -9.291 -4.579 -9.106 1.00 0.00 H new ATOM 0 HG2 GLU S 463 -7.465 -6.204 -9.914 1.00 0.00 H new ATOM 0 HG3 GLU S 463 -8.343 -7.454 -9.053 1.00 0.00 H new ATOM 149 N ALA S 464 -7.073 -2.904 -8.358 1.00 0.00 N ATOM 150 CA ALA S 464 -6.943 -1.452 -8.361 1.00 0.00 C ATOM 151 C ALA S 464 -8.016 -0.813 -9.233 1.00 0.00 C ATOM 152 O ALA S 464 -8.772 -1.508 -9.911 1.00 0.00 O ATOM 153 CB ALA S 464 -5.558 -1.038 -8.838 1.00 0.00 C ATOM 0 H ALA S 464 -6.549 -3.380 -9.093 1.00 0.00 H new ATOM 0 HA ALA S 464 -7.077 -1.100 -7.338 1.00 0.00 H new ATOM 0 HB1 ALA S 464 -5.481 0.049 -8.833 1.00 0.00 H new ATOM 0 HB2 ALA S 464 -4.803 -1.458 -8.173 1.00 0.00 H new ATOM 0 HB3 ALA S 464 -5.396 -1.408 -9.850 1.00 0.00 H new ATOM 159 N LEU S 465 -8.085 0.512 -9.204 1.00 0.00 N ATOM 160 CA LEU S 465 -9.076 1.237 -9.989 1.00 0.00 C ATOM 161 C LEU S 465 -8.478 2.486 -10.634 1.00 0.00 C ATOM 162 O LEU S 465 -8.892 2.888 -11.720 1.00 0.00 O ATOM 163 CB LEU S 465 -10.269 1.618 -9.113 1.00 0.00 C ATOM 164 CG LEU S 465 -10.921 0.447 -8.374 1.00 0.00 C ATOM 165 CD1 LEU S 465 -10.047 -0.008 -7.218 1.00 0.00 C ATOM 166 CD2 LEU S 465 -12.308 0.833 -7.883 1.00 0.00 C ATOM 0 H LEU S 465 -7.469 1.105 -8.648 1.00 0.00 H new ATOM 0 HA LEU S 465 -9.413 0.577 -10.788 1.00 0.00 H new ATOM 0 HB2 LEU S 465 -9.943 2.356 -8.380 1.00 0.00 H new ATOM 0 HB3 LEU S 465 -11.021 2.100 -9.737 1.00 0.00 H new ATOM 0 HG LEU S 465 -11.025 -0.386 -9.070 1.00 0.00 H new ATOM 0 HD11 LEU S 465 -10.527 -0.841 -6.705 1.00 0.00 H new ATOM 0 HD12 LEU S 465 -9.077 -0.327 -7.599 1.00 0.00 H new ATOM 0 HD13 LEU S 465 -9.909 0.817 -6.520 1.00 0.00 H new ATOM 0 HD21 LEU S 465 -12.757 -0.011 -7.360 1.00 0.00 H new ATOM 0 HD22 LEU S 465 -12.230 1.681 -7.203 1.00 0.00 H new ATOM 0 HD23 LEU S 465 -12.932 1.106 -8.734 1.00 0.00 H new ATOM 178 N PHE S 466 -7.502 3.097 -9.966 1.00 0.00 N ATOM 179 CA PHE S 466 -6.859 4.297 -10.491 1.00 0.00 C ATOM 180 C PHE S 466 -5.345 4.161 -10.490 1.00 0.00 C ATOM 181 O PHE S 466 -4.764 3.609 -9.555 1.00 0.00 O ATOM 182 CB PHE S 466 -7.218 5.524 -9.659 1.00 0.00 C ATOM 183 CG PHE S 466 -8.655 5.612 -9.257 1.00 0.00 C ATOM 184 CD1 PHE S 466 -9.093 5.037 -8.074 1.00 0.00 C ATOM 185 CD2 PHE S 466 -9.561 6.294 -10.045 1.00 0.00 C ATOM 186 CE1 PHE S 466 -10.414 5.138 -7.693 1.00 0.00 C ATOM 187 CE2 PHE S 466 -10.880 6.405 -9.666 1.00 0.00 C ATOM 188 CZ PHE S 466 -11.307 5.828 -8.491 1.00 0.00 C ATOM 0 H PHE S 466 -7.141 2.782 -9.065 1.00 0.00 H new ATOM 0 HA PHE S 466 -7.220 4.418 -11.512 1.00 0.00 H new ATOM 0 HB2 PHE S 466 -6.603 5.528 -8.759 1.00 0.00 H new ATOM 0 HB3 PHE S 466 -6.959 6.418 -10.226 1.00 0.00 H new ATOM 0 HD1 PHE S 466 -8.394 4.506 -7.446 1.00 0.00 H new ATOM 0 HD2 PHE S 466 -9.231 6.745 -10.969 1.00 0.00 H new ATOM 0 HE1 PHE S 466 -10.750 4.680 -6.775 1.00 0.00 H new ATOM 0 HE2 PHE S 466 -11.578 6.944 -10.289 1.00 0.00 H new ATOM 0 HZ PHE S 466 -12.341 5.915 -8.192 1.00 0.00 H new ATOM 198 N SER S 467 -4.707 4.710 -11.514 1.00 0.00 N ATOM 199 CA SER S 467 -3.257 4.690 -11.588 1.00 0.00 C ATOM 200 C SER S 467 -2.717 5.680 -10.569 1.00 0.00 C ATOM 201 O SER S 467 -2.788 6.893 -10.767 1.00 0.00 O ATOM 202 CB SER S 467 -2.777 5.048 -12.995 1.00 0.00 C ATOM 203 OG SER S 467 -3.596 4.445 -13.983 1.00 0.00 O ATOM 0 H SER S 467 -5.168 5.171 -12.298 1.00 0.00 H new ATOM 0 HA SER S 467 -2.890 3.688 -11.367 1.00 0.00 H new ATOM 0 HB2 SER S 467 -2.787 6.131 -13.121 1.00 0.00 H new ATOM 0 HB3 SER S 467 -1.745 4.721 -13.125 1.00 0.00 H new ATOM 0 HG SER S 467 -3.269 4.691 -14.874 1.00 0.00 H new ATOM 209 N TYR S 468 -2.219 5.157 -9.464 1.00 0.00 N ATOM 210 CA TYR S 468 -1.711 5.989 -8.386 1.00 0.00 C ATOM 211 C TYR S 468 -0.315 6.511 -8.693 1.00 0.00 C ATOM 212 O TYR S 468 0.639 5.742 -8.792 1.00 0.00 O ATOM 213 CB TYR S 468 -1.707 5.183 -7.084 1.00 0.00 C ATOM 214 CG TYR S 468 -1.159 5.920 -5.884 1.00 0.00 C ATOM 215 CD1 TYR S 468 0.184 6.268 -5.800 1.00 0.00 C ATOM 216 CD2 TYR S 468 -1.989 6.256 -4.825 1.00 0.00 C ATOM 217 CE1 TYR S 468 0.683 6.931 -4.695 1.00 0.00 C ATOM 218 CE2 TYR S 468 -1.500 6.919 -3.719 1.00 0.00 C ATOM 219 CZ TYR S 468 -0.164 7.255 -3.657 1.00 0.00 C ATOM 220 OH TYR S 468 0.326 7.915 -2.554 1.00 0.00 O ATOM 0 H TYR S 468 -2.155 4.154 -9.288 1.00 0.00 H new ATOM 0 HA TYR S 468 -2.365 6.855 -8.279 1.00 0.00 H new ATOM 0 HB2 TYR S 468 -2.727 4.869 -6.865 1.00 0.00 H new ATOM 0 HB3 TYR S 468 -1.120 4.277 -7.236 1.00 0.00 H new ATOM 0 HD1 TYR S 468 0.849 6.016 -6.613 1.00 0.00 H new ATOM 0 HD2 TYR S 468 -3.036 5.994 -4.867 1.00 0.00 H new ATOM 0 HE1 TYR S 468 1.729 7.193 -4.645 1.00 0.00 H new ATOM 0 HE2 TYR S 468 -2.161 7.174 -2.904 1.00 0.00 H new ATOM 0 HH TYR S 468 1.277 8.113 -2.687 1.00 0.00 H new ATOM 230 N GLU S 469 -0.205 7.830 -8.828 1.00 0.00 N ATOM 231 CA GLU S 469 1.075 8.462 -9.103 1.00 0.00 C ATOM 232 C GLU S 469 1.967 8.364 -7.877 1.00 0.00 C ATOM 233 O GLU S 469 1.735 9.032 -6.870 1.00 0.00 O ATOM 234 CB GLU S 469 0.883 9.925 -9.497 1.00 0.00 C ATOM 235 CG GLU S 469 1.930 10.433 -10.474 1.00 0.00 C ATOM 236 CD GLU S 469 1.656 11.852 -10.935 1.00 0.00 C ATOM 237 OE1 GLU S 469 0.580 12.089 -11.521 1.00 0.00 O ATOM 238 OE2 GLU S 469 2.520 12.725 -10.709 1.00 0.00 O ATOM 0 H GLU S 469 -0.988 8.479 -8.751 1.00 0.00 H new ATOM 0 HA GLU S 469 1.548 7.944 -9.937 1.00 0.00 H new ATOM 0 HB2 GLU S 469 -0.105 10.047 -9.940 1.00 0.00 H new ATOM 0 HB3 GLU S 469 0.907 10.541 -8.598 1.00 0.00 H new ATOM 0 HG2 GLU S 469 2.912 10.391 -10.003 1.00 0.00 H new ATOM 0 HG3 GLU S 469 1.964 9.773 -11.341 1.00 0.00 H new ATOM 245 N ALA S 470 2.976 7.515 -7.966 1.00 0.00 N ATOM 246 CA ALA S 470 3.895 7.307 -6.859 1.00 0.00 C ATOM 247 C ALA S 470 5.031 8.323 -6.874 1.00 0.00 C ATOM 248 O ALA S 470 5.921 8.265 -7.721 1.00 0.00 O ATOM 249 CB ALA S 470 4.440 5.889 -6.898 1.00 0.00 C ATOM 0 H ALA S 470 3.180 6.957 -8.795 1.00 0.00 H new ATOM 0 HA ALA S 470 3.345 7.451 -5.929 1.00 0.00 H new ATOM 0 HB1 ALA S 470 5.128 5.741 -6.066 1.00 0.00 H new ATOM 0 HB2 ALA S 470 3.616 5.180 -6.819 1.00 0.00 H new ATOM 0 HB3 ALA S 470 4.968 5.728 -7.838 1.00 0.00 H new ATOM 255 N THR S 471 4.995 9.246 -5.918 1.00 0.00 N ATOM 256 CA THR S 471 6.024 10.273 -5.803 1.00 0.00 C ATOM 257 C THR S 471 7.030 9.890 -4.724 1.00 0.00 C ATOM 258 O THR S 471 8.209 10.232 -4.809 1.00 0.00 O ATOM 259 CB THR S 471 5.393 11.628 -5.475 1.00 0.00 C ATOM 260 OG1 THR S 471 4.203 11.458 -4.723 1.00 0.00 O ATOM 261 CG2 THR S 471 5.048 12.442 -6.703 1.00 0.00 C ATOM 0 H THR S 471 4.263 9.304 -5.210 1.00 0.00 H new ATOM 0 HA THR S 471 6.543 10.352 -6.758 1.00 0.00 H new ATOM 0 HB THR S 471 6.148 12.167 -4.903 1.00 0.00 H new ATOM 0 HG1 THR S 471 3.815 12.335 -4.522 1.00 0.00 H new ATOM 0 HG21 THR S 471 4.605 13.390 -6.398 1.00 0.00 H new ATOM 0 HG22 THR S 471 5.953 12.633 -7.279 1.00 0.00 H new ATOM 0 HG23 THR S 471 4.337 11.890 -7.318 1.00 0.00 H new ATOM 269 N GLN S 472 6.553 9.163 -3.720 1.00 0.00 N ATOM 270 CA GLN S 472 7.407 8.711 -2.627 1.00 0.00 C ATOM 271 C GLN S 472 7.764 7.238 -2.813 1.00 0.00 C ATOM 272 O GLN S 472 7.079 6.512 -3.531 1.00 0.00 O ATOM 273 CB GLN S 472 6.730 8.928 -1.267 1.00 0.00 C ATOM 274 CG GLN S 472 5.212 8.851 -1.306 1.00 0.00 C ATOM 275 CD GLN S 472 4.565 10.200 -1.550 1.00 0.00 C ATOM 276 OE1 GLN S 472 4.914 11.193 -0.910 1.00 0.00 O ATOM 277 NE2 GLN S 472 3.617 10.243 -2.478 1.00 0.00 N ATOM 0 H GLN S 472 5.578 8.873 -3.640 1.00 0.00 H new ATOM 0 HA GLN S 472 8.322 9.303 -2.645 1.00 0.00 H new ATOM 0 HB2 GLN S 472 7.102 8.182 -0.565 1.00 0.00 H new ATOM 0 HB3 GLN S 472 7.023 9.904 -0.880 1.00 0.00 H new ATOM 0 HG2 GLN S 472 4.907 8.159 -2.091 1.00 0.00 H new ATOM 0 HG3 GLN S 472 4.848 8.443 -0.363 1.00 0.00 H new ATOM 0 HE21 GLN S 472 3.360 9.395 -2.984 1.00 0.00 H new ATOM 0 HE22 GLN S 472 3.146 11.124 -2.685 1.00 0.00 H new ATOM 286 N PRO S 473 8.857 6.782 -2.180 1.00 0.00 N ATOM 287 CA PRO S 473 9.314 5.392 -2.296 1.00 0.00 C ATOM 288 C PRO S 473 8.333 4.377 -1.708 1.00 0.00 C ATOM 289 O PRO S 473 7.823 3.514 -2.421 1.00 0.00 O ATOM 290 CB PRO S 473 10.634 5.377 -1.518 1.00 0.00 C ATOM 291 CG PRO S 473 10.569 6.555 -0.608 1.00 0.00 C ATOM 292 CD PRO S 473 9.743 7.587 -1.321 1.00 0.00 C ATOM 0 HA PRO S 473 9.412 5.098 -3.341 1.00 0.00 H new ATOM 0 HB2 PRO S 473 10.748 4.451 -0.955 1.00 0.00 H new ATOM 0 HB3 PRO S 473 11.488 5.447 -2.192 1.00 0.00 H new ATOM 0 HG2 PRO S 473 10.117 6.286 0.347 1.00 0.00 H new ATOM 0 HG3 PRO S 473 11.567 6.936 -0.392 1.00 0.00 H new ATOM 0 HD2 PRO S 473 9.175 8.201 -0.621 1.00 0.00 H new ATOM 0 HD3 PRO S 473 10.364 8.264 -1.907 1.00 0.00 H new ATOM 300 N GLU S 474 8.091 4.467 -0.402 1.00 0.00 N ATOM 301 CA GLU S 474 7.189 3.536 0.277 1.00 0.00 C ATOM 302 C GLU S 474 5.852 3.398 -0.450 1.00 0.00 C ATOM 303 O GLU S 474 5.262 2.319 -0.471 1.00 0.00 O ATOM 304 CB GLU S 474 6.963 3.966 1.731 1.00 0.00 C ATOM 305 CG GLU S 474 5.999 5.132 1.894 1.00 0.00 C ATOM 306 CD GLU S 474 6.596 6.453 1.449 1.00 0.00 C ATOM 307 OE1 GLU S 474 7.815 6.496 1.182 1.00 0.00 O ATOM 308 OE2 GLU S 474 5.841 7.446 1.368 1.00 0.00 O ATOM 0 H GLU S 474 8.505 5.173 0.207 1.00 0.00 H new ATOM 0 HA GLU S 474 7.670 2.558 0.267 1.00 0.00 H new ATOM 0 HB2 GLU S 474 6.584 3.114 2.295 1.00 0.00 H new ATOM 0 HB3 GLU S 474 7.922 4.238 2.171 1.00 0.00 H new ATOM 0 HG2 GLU S 474 5.095 4.934 1.317 1.00 0.00 H new ATOM 0 HG3 GLU S 474 5.700 5.207 2.939 1.00 0.00 H new ATOM 315 N ASP S 475 5.372 4.488 -1.042 1.00 0.00 N ATOM 316 CA ASP S 475 4.105 4.468 -1.757 1.00 0.00 C ATOM 317 C ASP S 475 4.108 3.415 -2.859 1.00 0.00 C ATOM 318 O ASP S 475 4.912 3.477 -3.791 1.00 0.00 O ATOM 319 CB ASP S 475 3.819 5.846 -2.350 1.00 0.00 C ATOM 320 CG ASP S 475 3.036 6.735 -1.403 1.00 0.00 C ATOM 321 OD1 ASP S 475 2.762 6.299 -0.265 1.00 0.00 O ATOM 322 OD2 ASP S 475 2.696 7.870 -1.801 1.00 0.00 O ATOM 0 H ASP S 475 5.842 5.393 -1.039 1.00 0.00 H new ATOM 0 HA ASP S 475 3.320 4.210 -1.047 1.00 0.00 H new ATOM 0 HB2 ASP S 475 4.761 6.332 -2.603 1.00 0.00 H new ATOM 0 HB3 ASP S 475 3.261 5.729 -3.279 1.00 0.00 H new ATOM 327 N LEU S 476 3.197 2.455 -2.751 1.00 0.00 N ATOM 328 CA LEU S 476 3.080 1.393 -3.741 1.00 0.00 C ATOM 329 C LEU S 476 2.319 1.904 -4.959 1.00 0.00 C ATOM 330 O LEU S 476 1.114 2.142 -4.897 1.00 0.00 O ATOM 331 CB LEU S 476 2.367 0.175 -3.137 1.00 0.00 C ATOM 332 CG LEU S 476 1.921 -0.886 -4.146 1.00 0.00 C ATOM 333 CD1 LEU S 476 3.118 -1.473 -4.875 1.00 0.00 C ATOM 334 CD2 LEU S 476 1.123 -1.982 -3.463 1.00 0.00 C ATOM 0 H LEU S 476 2.527 2.391 -1.985 1.00 0.00 H new ATOM 0 HA LEU S 476 4.079 1.087 -4.051 1.00 0.00 H new ATOM 0 HB2 LEU S 476 3.033 -0.293 -2.412 1.00 0.00 H new ATOM 0 HB3 LEU S 476 1.492 0.522 -2.588 1.00 0.00 H new ATOM 0 HG LEU S 476 1.276 -0.402 -4.879 1.00 0.00 H new ATOM 0 HD11 LEU S 476 2.778 -2.225 -5.587 1.00 0.00 H new ATOM 0 HD12 LEU S 476 3.644 -0.681 -5.408 1.00 0.00 H new ATOM 0 HD13 LEU S 476 3.792 -1.935 -4.154 1.00 0.00 H new ATOM 0 HD21 LEU S 476 0.818 -2.724 -4.201 1.00 0.00 H new ATOM 0 HD22 LEU S 476 1.739 -2.460 -2.702 1.00 0.00 H new ATOM 0 HD23 LEU S 476 0.238 -1.550 -2.995 1.00 0.00 H new ATOM 346 N GLU S 477 3.037 2.084 -6.060 1.00 0.00 N ATOM 347 CA GLU S 477 2.436 2.584 -7.289 1.00 0.00 C ATOM 348 C GLU S 477 1.703 1.477 -8.037 1.00 0.00 C ATOM 349 O GLU S 477 2.104 0.314 -7.996 1.00 0.00 O ATOM 350 CB GLU S 477 3.512 3.179 -8.196 1.00 0.00 C ATOM 351 CG GLU S 477 3.003 4.297 -9.091 1.00 0.00 C ATOM 352 CD GLU S 477 4.046 4.770 -10.085 1.00 0.00 C ATOM 353 OE1 GLU S 477 5.252 4.587 -9.812 1.00 0.00 O ATOM 354 OE2 GLU S 477 3.659 5.324 -11.135 1.00 0.00 O ATOM 0 H GLU S 477 4.036 1.891 -6.127 1.00 0.00 H new ATOM 0 HA GLU S 477 1.715 3.355 -7.016 1.00 0.00 H new ATOM 0 HB2 GLU S 477 4.325 3.561 -7.579 1.00 0.00 H new ATOM 0 HB3 GLU S 477 3.929 2.388 -8.819 1.00 0.00 H new ATOM 0 HG2 GLU S 477 2.122 3.952 -9.632 1.00 0.00 H new ATOM 0 HG3 GLU S 477 2.688 5.138 -8.473 1.00 0.00 H new ATOM 361 N PHE S 478 0.637 1.854 -8.732 1.00 0.00 N ATOM 362 CA PHE S 478 -0.144 0.894 -9.510 1.00 0.00 C ATOM 363 C PHE S 478 -0.953 1.598 -10.595 1.00 0.00 C ATOM 364 O PHE S 478 -0.957 2.825 -10.683 1.00 0.00 O ATOM 365 CB PHE S 478 -1.075 0.073 -8.610 1.00 0.00 C ATOM 366 CG PHE S 478 -1.500 0.774 -7.353 1.00 0.00 C ATOM 367 CD1 PHE S 478 -2.427 1.804 -7.395 1.00 0.00 C ATOM 368 CD2 PHE S 478 -0.980 0.394 -6.126 1.00 0.00 C ATOM 369 CE1 PHE S 478 -2.825 2.442 -6.236 1.00 0.00 C ATOM 370 CE2 PHE S 478 -1.374 1.030 -4.964 1.00 0.00 C ATOM 371 CZ PHE S 478 -2.298 2.055 -5.019 1.00 0.00 C ATOM 0 H PHE S 478 0.293 2.813 -8.774 1.00 0.00 H new ATOM 0 HA PHE S 478 0.561 0.213 -9.987 1.00 0.00 H new ATOM 0 HB2 PHE S 478 -1.964 -0.198 -9.179 1.00 0.00 H new ATOM 0 HB3 PHE S 478 -0.573 -0.857 -8.341 1.00 0.00 H new ATOM 0 HD1 PHE S 478 -2.842 2.111 -8.344 1.00 0.00 H new ATOM 0 HD2 PHE S 478 -0.259 -0.408 -6.077 1.00 0.00 H new ATOM 0 HE1 PHE S 478 -3.548 3.243 -6.281 1.00 0.00 H new ATOM 0 HE2 PHE S 478 -0.960 0.726 -4.014 1.00 0.00 H new ATOM 0 HZ PHE S 478 -2.608 2.553 -4.112 1.00 0.00 H new ATOM 381 N GLN S 479 -1.628 0.810 -11.427 1.00 0.00 N ATOM 382 CA GLN S 479 -2.430 1.355 -12.516 1.00 0.00 C ATOM 383 C GLN S 479 -3.887 1.541 -12.093 1.00 0.00 C ATOM 384 O GLN S 479 -4.200 1.564 -10.903 1.00 0.00 O ATOM 385 CB GLN S 479 -2.339 0.442 -13.743 1.00 0.00 C ATOM 386 CG GLN S 479 -3.050 -0.892 -13.570 1.00 0.00 C ATOM 387 CD GLN S 479 -2.358 -2.021 -14.309 1.00 0.00 C ATOM 388 OE1 GLN S 479 -2.854 -2.509 -15.324 1.00 0.00 O ATOM 389 NE2 GLN S 479 -1.205 -2.440 -13.801 1.00 0.00 N ATOM 0 H GLN S 479 -1.635 -0.208 -11.367 1.00 0.00 H new ATOM 0 HA GLN S 479 -2.032 2.336 -12.774 1.00 0.00 H new ATOM 0 HB2 GLN S 479 -2.764 0.961 -14.602 1.00 0.00 H new ATOM 0 HB3 GLN S 479 -1.289 0.257 -13.969 1.00 0.00 H new ATOM 0 HG2 GLN S 479 -3.104 -1.136 -12.509 1.00 0.00 H new ATOM 0 HG3 GLN S 479 -4.075 -0.802 -13.929 1.00 0.00 H new ATOM 0 HE21 GLN S 479 -0.832 -2.006 -12.957 1.00 0.00 H new ATOM 0 HE22 GLN S 479 -0.693 -3.196 -14.255 1.00 0.00 H new ATOM 398 N GLU S 480 -4.773 1.687 -13.077 1.00 0.00 N ATOM 399 CA GLU S 480 -6.194 1.889 -12.812 1.00 0.00 C ATOM 400 C GLU S 480 -6.964 0.571 -12.815 1.00 0.00 C ATOM 401 O GLU S 480 -8.177 0.555 -13.019 1.00 0.00 O ATOM 402 CB GLU S 480 -6.787 2.832 -13.857 1.00 0.00 C ATOM 403 CG GLU S 480 -6.726 2.275 -15.268 1.00 0.00 C ATOM 404 CD GLU S 480 -7.318 3.221 -16.296 1.00 0.00 C ATOM 405 OE1 GLU S 480 -6.853 4.379 -16.372 1.00 0.00 O ATOM 406 OE2 GLU S 480 -8.243 2.805 -17.024 1.00 0.00 O ATOM 0 H GLU S 480 -4.529 1.669 -14.067 1.00 0.00 H new ATOM 0 HA GLU S 480 -6.287 2.329 -11.819 1.00 0.00 H new ATOM 0 HB2 GLU S 480 -7.825 3.041 -13.600 1.00 0.00 H new ATOM 0 HB3 GLU S 480 -6.253 3.782 -13.825 1.00 0.00 H new ATOM 0 HG2 GLU S 480 -5.688 2.066 -15.527 1.00 0.00 H new ATOM 0 HG3 GLU S 480 -7.261 1.326 -15.303 1.00 0.00 H new ATOM 413 N GLY S 481 -6.259 -0.528 -12.584 1.00 0.00 N ATOM 414 CA GLY S 481 -6.906 -1.825 -12.563 1.00 0.00 C ATOM 415 C GLY S 481 -5.915 -2.970 -12.547 1.00 0.00 C ATOM 416 O GLY S 481 -5.655 -3.587 -13.580 1.00 0.00 O ATOM 0 H GLY S 481 -5.254 -0.545 -12.411 1.00 0.00 H new ATOM 0 HA2 GLY S 481 -7.548 -1.893 -11.685 1.00 0.00 H new ATOM 0 HA3 GLY S 481 -7.551 -1.920 -13.437 1.00 0.00 H new ATOM 420 N ASP S 482 -5.355 -3.255 -11.377 1.00 0.00 N ATOM 421 CA ASP S 482 -4.388 -4.332 -11.246 1.00 0.00 C ATOM 422 C ASP S 482 -4.613 -5.147 -9.983 1.00 0.00 C ATOM 423 O ASP S 482 -5.256 -4.693 -9.036 1.00 0.00 O ATOM 424 CB ASP S 482 -2.964 -3.775 -11.264 1.00 0.00 C ATOM 425 CG ASP S 482 -1.909 -4.851 -11.090 1.00 0.00 C ATOM 426 OD1 ASP S 482 -1.804 -5.728 -11.973 1.00 0.00 O ATOM 427 OD2 ASP S 482 -1.189 -4.816 -10.070 1.00 0.00 O ATOM 0 H ASP S 482 -5.555 -2.756 -10.510 1.00 0.00 H new ATOM 0 HA ASP S 482 -4.526 -4.997 -12.098 1.00 0.00 H new ATOM 0 HB2 ASP S 482 -2.794 -3.255 -12.207 1.00 0.00 H new ATOM 0 HB3 ASP S 482 -2.858 -3.037 -10.469 1.00 0.00 H new ATOM 432 N ILE S 483 -4.072 -6.359 -9.987 1.00 0.00 N ATOM 433 CA ILE S 483 -4.198 -7.264 -8.851 1.00 0.00 C ATOM 434 C ILE S 483 -3.074 -7.044 -7.847 1.00 0.00 C ATOM 435 O ILE S 483 -2.053 -7.731 -7.882 1.00 0.00 O ATOM 436 CB ILE S 483 -4.182 -8.740 -9.300 1.00 0.00 C ATOM 437 CG1 ILE S 483 -5.045 -8.931 -10.549 1.00 0.00 C ATOM 438 CG2 ILE S 483 -4.664 -9.641 -8.173 1.00 0.00 C ATOM 439 CD1 ILE S 483 -6.514 -8.657 -10.317 1.00 0.00 C ATOM 0 H ILE S 483 -3.539 -6.740 -10.769 1.00 0.00 H new ATOM 0 HA ILE S 483 -5.156 -7.044 -8.379 1.00 0.00 H new ATOM 0 HB ILE S 483 -3.157 -9.016 -9.548 1.00 0.00 H new ATOM 0 HG12 ILE S 483 -4.681 -8.271 -11.337 1.00 0.00 H new ATOM 0 HG13 ILE S 483 -4.927 -9.953 -10.909 1.00 0.00 H new ATOM 0 HG21 ILE S 483 -4.647 -10.679 -8.505 1.00 0.00 H new ATOM 0 HG22 ILE S 483 -4.009 -9.525 -7.309 1.00 0.00 H new ATOM 0 HG23 ILE S 483 -5.682 -9.365 -7.896 1.00 0.00 H new ATOM 0 HD11 ILE S 483 -7.064 -8.812 -11.245 1.00 0.00 H new ATOM 0 HD12 ILE S 483 -6.894 -9.334 -9.552 1.00 0.00 H new ATOM 0 HD13 ILE S 483 -6.644 -7.627 -9.986 1.00 0.00 H new ATOM 451 N ILE S 484 -3.270 -6.086 -6.950 1.00 0.00 N ATOM 452 CA ILE S 484 -2.276 -5.778 -5.931 1.00 0.00 C ATOM 453 C ILE S 484 -2.356 -6.775 -4.782 1.00 0.00 C ATOM 454 O ILE S 484 -3.442 -7.189 -4.381 1.00 0.00 O ATOM 455 CB ILE S 484 -2.468 -4.354 -5.375 1.00 0.00 C ATOM 456 CG1 ILE S 484 -2.329 -3.325 -6.494 1.00 0.00 C ATOM 457 CG2 ILE S 484 -1.467 -4.068 -4.263 1.00 0.00 C ATOM 458 CD1 ILE S 484 -3.051 -2.029 -6.208 1.00 0.00 C ATOM 0 H ILE S 484 -4.110 -5.508 -6.908 1.00 0.00 H new ATOM 0 HA ILE S 484 -1.296 -5.844 -6.404 1.00 0.00 H new ATOM 0 HB ILE S 484 -3.472 -4.282 -4.956 1.00 0.00 H new ATOM 0 HG12 ILE S 484 -1.272 -3.116 -6.656 1.00 0.00 H new ATOM 0 HG13 ILE S 484 -2.715 -3.751 -7.420 1.00 0.00 H new ATOM 0 HG21 ILE S 484 -1.621 -3.057 -3.886 1.00 0.00 H new ATOM 0 HG22 ILE S 484 -1.609 -4.783 -3.453 1.00 0.00 H new ATOM 0 HG23 ILE S 484 -0.453 -4.159 -4.654 1.00 0.00 H new ATOM 0 HD11 ILE S 484 -2.911 -1.343 -7.043 1.00 0.00 H new ATOM 0 HD12 ILE S 484 -4.115 -2.227 -6.075 1.00 0.00 H new ATOM 0 HD13 ILE S 484 -2.649 -1.581 -5.299 1.00 0.00 H new ATOM 470 N LEU S 485 -1.199 -7.149 -4.254 1.00 0.00 N ATOM 471 CA LEU S 485 -1.142 -8.090 -3.145 1.00 0.00 C ATOM 472 C LEU S 485 -1.021 -7.341 -1.828 1.00 0.00 C ATOM 473 O LEU S 485 0.068 -6.932 -1.430 1.00 0.00 O ATOM 474 CB LEU S 485 0.038 -9.054 -3.323 1.00 0.00 C ATOM 475 CG LEU S 485 0.445 -9.883 -2.088 1.00 0.00 C ATOM 476 CD1 LEU S 485 1.529 -9.170 -1.293 1.00 0.00 C ATOM 477 CD2 LEU S 485 -0.753 -10.185 -1.195 1.00 0.00 C ATOM 0 H LEU S 485 -0.290 -6.816 -4.575 1.00 0.00 H new ATOM 0 HA LEU S 485 -2.064 -8.672 -3.132 1.00 0.00 H new ATOM 0 HB2 LEU S 485 -0.205 -9.744 -4.131 1.00 0.00 H new ATOM 0 HB3 LEU S 485 0.904 -8.476 -3.646 1.00 0.00 H new ATOM 0 HG LEU S 485 0.841 -10.832 -2.449 1.00 0.00 H new ATOM 0 HD11 LEU S 485 1.801 -9.773 -0.426 1.00 0.00 H new ATOM 0 HD12 LEU S 485 2.406 -9.025 -1.923 1.00 0.00 H new ATOM 0 HD13 LEU S 485 1.158 -8.201 -0.959 1.00 0.00 H new ATOM 0 HD21 LEU S 485 -0.427 -10.771 -0.335 1.00 0.00 H new ATOM 0 HD22 LEU S 485 -1.195 -9.250 -0.851 1.00 0.00 H new ATOM 0 HD23 LEU S 485 -1.494 -10.751 -1.760 1.00 0.00 H new ATOM 489 N VAL S 486 -2.144 -7.180 -1.142 1.00 0.00 N ATOM 490 CA VAL S 486 -2.138 -6.501 0.143 1.00 0.00 C ATOM 491 C VAL S 486 -1.453 -7.392 1.155 1.00 0.00 C ATOM 492 O VAL S 486 -1.805 -8.558 1.297 1.00 0.00 O ATOM 493 CB VAL S 486 -3.550 -6.161 0.671 1.00 0.00 C ATOM 494 CG1 VAL S 486 -3.504 -4.910 1.519 1.00 0.00 C ATOM 495 CG2 VAL S 486 -4.563 -5.998 -0.456 1.00 0.00 C ATOM 0 H VAL S 486 -3.060 -7.506 -1.450 1.00 0.00 H new ATOM 0 HA VAL S 486 -1.613 -5.557 -0.000 1.00 0.00 H new ATOM 0 HB VAL S 486 -3.879 -7.001 1.283 1.00 0.00 H new ATOM 0 HG11 VAL S 486 -4.505 -4.681 1.885 1.00 0.00 H new ATOM 0 HG12 VAL S 486 -2.836 -5.069 2.365 1.00 0.00 H new ATOM 0 HG13 VAL S 486 -3.138 -4.077 0.919 1.00 0.00 H new ATOM 0 HG21 VAL S 486 -5.540 -5.760 -0.035 1.00 0.00 H new ATOM 0 HG22 VAL S 486 -4.246 -5.191 -1.117 1.00 0.00 H new ATOM 0 HG23 VAL S 486 -4.629 -6.926 -1.023 1.00 0.00 H new ATOM 505 N LEU S 487 -0.461 -6.863 1.840 1.00 0.00 N ATOM 506 CA LEU S 487 0.265 -7.660 2.810 1.00 0.00 C ATOM 507 C LEU S 487 -0.287 -7.514 4.223 1.00 0.00 C ATOM 508 O LEU S 487 -0.018 -8.351 5.084 1.00 0.00 O ATOM 509 CB LEU S 487 1.738 -7.285 2.797 1.00 0.00 C ATOM 510 CG LEU S 487 2.605 -8.099 1.837 1.00 0.00 C ATOM 511 CD1 LEU S 487 4.077 -7.816 2.086 1.00 0.00 C ATOM 512 CD2 LEU S 487 2.316 -9.588 1.978 1.00 0.00 C ATOM 0 H LEU S 487 -0.141 -5.899 1.747 1.00 0.00 H new ATOM 0 HA LEU S 487 0.141 -8.703 2.518 1.00 0.00 H new ATOM 0 HB2 LEU S 487 1.826 -6.230 2.536 1.00 0.00 H new ATOM 0 HB3 LEU S 487 2.135 -7.398 3.806 1.00 0.00 H new ATOM 0 HG LEU S 487 2.361 -7.801 0.817 1.00 0.00 H new ATOM 0 HD11 LEU S 487 4.682 -8.403 1.395 1.00 0.00 H new ATOM 0 HD12 LEU S 487 4.275 -6.755 1.931 1.00 0.00 H new ATOM 0 HD13 LEU S 487 4.331 -8.087 3.111 1.00 0.00 H new ATOM 0 HD21 LEU S 487 2.944 -10.148 1.285 1.00 0.00 H new ATOM 0 HD22 LEU S 487 2.529 -9.905 2.999 1.00 0.00 H new ATOM 0 HD23 LEU S 487 1.267 -9.778 1.751 1.00 0.00 H new ATOM 524 N SER S 488 -1.045 -6.455 4.467 1.00 0.00 N ATOM 525 CA SER S 488 -1.602 -6.229 5.802 1.00 0.00 C ATOM 526 C SER S 488 -2.392 -4.929 5.881 1.00 0.00 C ATOM 527 O SER S 488 -2.646 -4.272 4.873 1.00 0.00 O ATOM 528 CB SER S 488 -0.472 -6.163 6.836 1.00 0.00 C ATOM 529 OG SER S 488 -0.902 -6.644 8.097 1.00 0.00 O ATOM 0 H SER S 488 -1.288 -5.747 3.774 1.00 0.00 H new ATOM 0 HA SER S 488 -2.274 -7.062 6.010 1.00 0.00 H new ATOM 0 HB2 SER S 488 0.377 -6.753 6.489 1.00 0.00 H new ATOM 0 HB3 SER S 488 -0.126 -5.134 6.935 1.00 0.00 H new ATOM 0 HG SER S 488 -0.161 -6.592 8.737 1.00 0.00 H new ATOM 535 N LYS S 489 -2.738 -4.556 7.109 1.00 0.00 N ATOM 536 CA LYS S 489 -3.455 -3.320 7.380 1.00 0.00 C ATOM 537 C LYS S 489 -2.511 -2.360 8.093 1.00 0.00 C ATOM 538 O LYS S 489 -1.946 -2.698 9.133 1.00 0.00 O ATOM 539 CB LYS S 489 -4.692 -3.588 8.240 1.00 0.00 C ATOM 540 CG LYS S 489 -5.825 -2.605 7.999 1.00 0.00 C ATOM 541 CD LYS S 489 -6.754 -2.520 9.200 1.00 0.00 C ATOM 542 CE LYS S 489 -6.410 -1.336 10.088 1.00 0.00 C ATOM 543 NZ LYS S 489 -5.483 -1.717 11.188 1.00 0.00 N ATOM 0 H LYS S 489 -2.528 -5.104 7.943 1.00 0.00 H new ATOM 0 HA LYS S 489 -3.793 -2.881 6.442 1.00 0.00 H new ATOM 0 HB2 LYS S 489 -5.050 -4.598 8.042 1.00 0.00 H new ATOM 0 HB3 LYS S 489 -4.408 -3.551 9.292 1.00 0.00 H new ATOM 0 HG2 LYS S 489 -5.413 -1.619 7.786 1.00 0.00 H new ATOM 0 HG3 LYS S 489 -6.392 -2.910 7.120 1.00 0.00 H new ATOM 0 HD2 LYS S 489 -7.785 -2.432 8.858 1.00 0.00 H new ATOM 0 HD3 LYS S 489 -6.688 -3.441 9.779 1.00 0.00 H new ATOM 0 HE2 LYS S 489 -5.954 -0.551 9.485 1.00 0.00 H new ATOM 0 HE3 LYS S 489 -7.325 -0.922 10.512 1.00 0.00 H new ATOM 0 HZ1 LYS S 489 -5.947 -1.555 12.105 1.00 0.00 H new ATOM 0 HZ2 LYS S 489 -5.233 -2.723 11.099 1.00 0.00 H new ATOM 0 HZ3 LYS S 489 -4.620 -1.140 11.130 1.00 0.00 H new ATOM 557 N VAL S 490 -2.314 -1.180 7.522 1.00 0.00 N ATOM 558 CA VAL S 490 -1.401 -0.209 8.111 1.00 0.00 C ATOM 559 C VAL S 490 -2.144 0.819 8.969 1.00 0.00 C ATOM 560 O VAL S 490 -2.359 0.581 10.157 1.00 0.00 O ATOM 561 CB VAL S 490 -0.531 0.471 7.023 1.00 0.00 C ATOM 562 CG1 VAL S 490 0.341 1.575 7.609 1.00 0.00 C ATOM 563 CG2 VAL S 490 0.337 -0.578 6.330 1.00 0.00 C ATOM 0 H VAL S 490 -2.768 -0.874 6.661 1.00 0.00 H new ATOM 0 HA VAL S 490 -0.729 -0.750 8.777 1.00 0.00 H new ATOM 0 HB VAL S 490 -1.198 0.933 6.295 1.00 0.00 H new ATOM 0 HG11 VAL S 490 0.936 2.028 6.816 1.00 0.00 H new ATOM 0 HG12 VAL S 490 -0.293 2.335 8.066 1.00 0.00 H new ATOM 0 HG13 VAL S 490 1.004 1.153 8.364 1.00 0.00 H new ATOM 0 HG21 VAL S 490 0.948 -0.098 5.566 1.00 0.00 H new ATOM 0 HG22 VAL S 490 0.985 -1.057 7.064 1.00 0.00 H new ATOM 0 HG23 VAL S 490 -0.302 -1.329 5.865 1.00 0.00 H new ATOM 573 N ASN S 491 -2.544 1.954 8.396 1.00 0.00 N ATOM 574 CA ASN S 491 -3.255 2.963 9.182 1.00 0.00 C ATOM 575 C ASN S 491 -4.756 2.951 8.877 1.00 0.00 C ATOM 576 O ASN S 491 -5.256 2.059 8.189 1.00 0.00 O ATOM 577 CB ASN S 491 -2.644 4.358 8.965 1.00 0.00 C ATOM 578 CG ASN S 491 -3.275 5.135 7.828 1.00 0.00 C ATOM 579 OD1 ASN S 491 -3.886 4.560 6.931 1.00 0.00 O ATOM 580 ND2 ASN S 491 -3.131 6.456 7.866 1.00 0.00 N ATOM 0 H ASN S 491 -2.393 2.195 7.416 1.00 0.00 H new ATOM 0 HA ASN S 491 -3.139 2.711 10.236 1.00 0.00 H new ATOM 0 HB2 ASN S 491 -2.743 4.934 9.885 1.00 0.00 H new ATOM 0 HB3 ASN S 491 -1.577 4.250 8.770 1.00 0.00 H new ATOM 0 HD21 ASN S 491 -3.536 7.035 7.130 1.00 0.00 H new ATOM 0 HD22 ASN S 491 -2.615 6.891 8.631 1.00 0.00 H new ATOM 587 N GLU S 492 -5.471 3.935 9.416 1.00 0.00 N ATOM 588 CA GLU S 492 -6.919 4.038 9.234 1.00 0.00 C ATOM 589 C GLU S 492 -7.325 4.036 7.760 1.00 0.00 C ATOM 590 O GLU S 492 -8.438 3.636 7.422 1.00 0.00 O ATOM 591 CB GLU S 492 -7.441 5.307 9.910 1.00 0.00 C ATOM 592 CG GLU S 492 -8.810 5.137 10.548 1.00 0.00 C ATOM 593 CD GLU S 492 -9.691 6.358 10.373 1.00 0.00 C ATOM 594 OE1 GLU S 492 -9.859 6.810 9.220 1.00 0.00 O ATOM 595 OE2 GLU S 492 -10.215 6.863 11.387 1.00 0.00 O ATOM 0 H GLU S 492 -5.069 4.678 9.987 1.00 0.00 H new ATOM 0 HA GLU S 492 -7.364 3.157 9.696 1.00 0.00 H new ATOM 0 HB2 GLU S 492 -6.730 5.621 10.674 1.00 0.00 H new ATOM 0 HB3 GLU S 492 -7.490 6.108 9.172 1.00 0.00 H new ATOM 0 HG2 GLU S 492 -9.306 4.270 10.110 1.00 0.00 H new ATOM 0 HG3 GLU S 492 -8.688 4.931 11.611 1.00 0.00 H new ATOM 602 N GLU S 493 -6.432 4.489 6.888 1.00 0.00 N ATOM 603 CA GLU S 493 -6.726 4.539 5.458 1.00 0.00 C ATOM 604 C GLU S 493 -5.480 4.243 4.630 1.00 0.00 C ATOM 605 O GLU S 493 -5.183 4.944 3.666 1.00 0.00 O ATOM 606 CB GLU S 493 -7.292 5.909 5.082 1.00 0.00 C ATOM 607 CG GLU S 493 -8.773 6.061 5.386 1.00 0.00 C ATOM 608 CD GLU S 493 -9.494 6.920 4.366 1.00 0.00 C ATOM 609 OE1 GLU S 493 -9.077 8.079 4.166 1.00 0.00 O ATOM 610 OE2 GLU S 493 -10.476 6.431 3.767 1.00 0.00 O ATOM 0 H GLU S 493 -5.503 4.825 7.142 1.00 0.00 H new ATOM 0 HA GLU S 493 -7.470 3.773 5.240 1.00 0.00 H new ATOM 0 HB2 GLU S 493 -6.739 6.681 5.618 1.00 0.00 H new ATOM 0 HB3 GLU S 493 -7.129 6.080 4.018 1.00 0.00 H new ATOM 0 HG2 GLU S 493 -9.236 5.075 5.417 1.00 0.00 H new ATOM 0 HG3 GLU S 493 -8.893 6.501 6.376 1.00 0.00 H new ATOM 617 N TRP S 494 -4.769 3.190 5.015 1.00 0.00 N ATOM 618 CA TRP S 494 -3.555 2.769 4.323 1.00 0.00 C ATOM 619 C TRP S 494 -3.207 1.343 4.722 1.00 0.00 C ATOM 620 O TRP S 494 -3.676 0.842 5.744 1.00 0.00 O ATOM 621 CB TRP S 494 -2.360 3.666 4.675 1.00 0.00 C ATOM 622 CG TRP S 494 -2.400 5.046 4.091 1.00 0.00 C ATOM 623 CD1 TRP S 494 -3.062 6.128 4.593 1.00 0.00 C ATOM 624 CD2 TRP S 494 -1.719 5.505 2.914 1.00 0.00 C ATOM 625 NE1 TRP S 494 -2.840 7.226 3.802 1.00 0.00 N ATOM 626 CE2 TRP S 494 -2.024 6.870 2.763 1.00 0.00 C ATOM 627 CE3 TRP S 494 -0.886 4.896 1.971 1.00 0.00 C ATOM 628 CZ2 TRP S 494 -1.526 7.638 1.714 1.00 0.00 C ATOM 629 CZ3 TRP S 494 -0.391 5.659 0.927 1.00 0.00 C ATOM 630 CH2 TRP S 494 -0.713 7.018 0.808 1.00 0.00 C ATOM 0 H TRP S 494 -5.016 2.605 5.813 1.00 0.00 H new ATOM 0 HA TRP S 494 -3.749 2.841 3.253 1.00 0.00 H new ATOM 0 HB2 TRP S 494 -2.297 3.750 5.760 1.00 0.00 H new ATOM 0 HB3 TRP S 494 -1.447 3.174 4.340 1.00 0.00 H new ATOM 0 HD1 TRP S 494 -3.672 6.121 5.484 1.00 0.00 H new ATOM 0 HE1 TRP S 494 -3.222 8.158 3.962 1.00 0.00 H new ATOM 0 HE3 TRP S 494 -0.633 3.849 2.055 1.00 0.00 H new ATOM 0 HZ2 TRP S 494 -1.773 8.685 1.620 1.00 0.00 H new ATOM 0 HZ3 TRP S 494 0.254 5.200 0.192 1.00 0.00 H new ATOM 0 HH2 TRP S 494 -0.310 7.587 -0.017 1.00 0.00 H new ATOM 641 N LEU S 495 -2.369 0.701 3.926 1.00 0.00 N ATOM 642 CA LEU S 495 -1.945 -0.652 4.210 1.00 0.00 C ATOM 643 C LEU S 495 -0.661 -1.002 3.478 1.00 0.00 C ATOM 644 O LEU S 495 -0.117 -0.191 2.730 1.00 0.00 O ATOM 645 CB LEU S 495 -3.049 -1.650 3.892 1.00 0.00 C ATOM 646 CG LEU S 495 -4.032 -1.243 2.796 1.00 0.00 C ATOM 647 CD1 LEU S 495 -3.588 -1.784 1.448 1.00 0.00 C ATOM 648 CD2 LEU S 495 -5.428 -1.735 3.152 1.00 0.00 C ATOM 0 H LEU S 495 -1.970 1.100 3.076 1.00 0.00 H new ATOM 0 HA LEU S 495 -1.736 -0.712 5.278 1.00 0.00 H new ATOM 0 HB2 LEU S 495 -2.585 -2.593 3.603 1.00 0.00 H new ATOM 0 HB3 LEU S 495 -3.613 -1.839 4.805 1.00 0.00 H new ATOM 0 HG LEU S 495 -4.054 -0.156 2.723 1.00 0.00 H new ATOM 0 HD11 LEU S 495 -4.302 -1.482 0.682 1.00 0.00 H new ATOM 0 HD12 LEU S 495 -2.603 -1.386 1.203 1.00 0.00 H new ATOM 0 HD13 LEU S 495 -3.539 -2.872 1.491 1.00 0.00 H new ATOM 0 HD21 LEU S 495 -6.127 -1.443 2.368 1.00 0.00 H new ATOM 0 HD22 LEU S 495 -5.419 -2.821 3.244 1.00 0.00 H new ATOM 0 HD23 LEU S 495 -5.739 -1.293 4.099 1.00 0.00 H new ATOM 660 N GLU S 496 -0.168 -2.208 3.725 1.00 0.00 N ATOM 661 CA GLU S 496 1.070 -2.658 3.114 1.00 0.00 C ATOM 662 C GLU S 496 0.845 -3.111 1.680 1.00 0.00 C ATOM 663 O GLU S 496 -0.257 -3.519 1.309 1.00 0.00 O ATOM 664 CB GLU S 496 1.688 -3.782 3.944 1.00 0.00 C ATOM 665 CG GLU S 496 3.025 -4.271 3.412 1.00 0.00 C ATOM 666 CD GLU S 496 3.595 -5.415 4.230 1.00 0.00 C ATOM 667 OE1 GLU S 496 2.927 -5.850 5.191 1.00 0.00 O ATOM 668 OE2 GLU S 496 4.711 -5.874 3.908 1.00 0.00 O ATOM 0 H GLU S 496 -0.607 -2.890 4.344 1.00 0.00 H new ATOM 0 HA GLU S 496 1.763 -1.817 3.090 1.00 0.00 H new ATOM 0 HB2 GLU S 496 1.820 -3.434 4.969 1.00 0.00 H new ATOM 0 HB3 GLU S 496 0.992 -4.620 3.979 1.00 0.00 H new ATOM 0 HG2 GLU S 496 2.904 -4.593 2.378 1.00 0.00 H new ATOM 0 HG3 GLU S 496 3.735 -3.444 3.407 1.00 0.00 H new ATOM 675 N GLY S 497 1.894 -3.013 0.872 1.00 0.00 N ATOM 676 CA GLY S 497 1.792 -3.390 -0.520 1.00 0.00 C ATOM 677 C GLY S 497 3.002 -4.150 -1.032 1.00 0.00 C ATOM 678 O GLY S 497 4.133 -3.686 -0.909 1.00 0.00 O ATOM 0 H GLY S 497 2.814 -2.678 1.159 1.00 0.00 H new ATOM 0 HA2 GLY S 497 0.902 -4.004 -0.657 1.00 0.00 H new ATOM 0 HA3 GLY S 497 1.655 -2.492 -1.122 1.00 0.00 H new ATOM 682 N GLU S 498 2.763 -5.317 -1.625 1.00 0.00 N ATOM 683 CA GLU S 498 3.838 -6.133 -2.179 1.00 0.00 C ATOM 684 C GLU S 498 3.412 -6.708 -3.527 1.00 0.00 C ATOM 685 O GLU S 498 2.992 -7.860 -3.618 1.00 0.00 O ATOM 686 CB GLU S 498 4.214 -7.260 -1.214 1.00 0.00 C ATOM 687 CG GLU S 498 5.714 -7.465 -1.077 1.00 0.00 C ATOM 688 CD GLU S 498 6.101 -8.931 -1.051 1.00 0.00 C ATOM 689 OE1 GLU S 498 5.455 -9.702 -0.310 1.00 0.00 O ATOM 690 OE2 GLU S 498 7.051 -9.307 -1.769 1.00 0.00 O ATOM 0 H GLU S 498 1.832 -5.719 -1.734 1.00 0.00 H new ATOM 0 HA GLU S 498 4.715 -5.502 -2.324 1.00 0.00 H new ATOM 0 HB2 GLU S 498 3.794 -7.042 -0.232 1.00 0.00 H new ATOM 0 HB3 GLU S 498 3.758 -8.189 -1.557 1.00 0.00 H new ATOM 0 HG2 GLU S 498 6.222 -6.973 -1.907 1.00 0.00 H new ATOM 0 HG3 GLU S 498 6.061 -6.985 -0.162 1.00 0.00 H new ATOM 697 N SER S 499 3.506 -5.886 -4.567 1.00 0.00 N ATOM 698 CA SER S 499 3.111 -6.301 -5.908 1.00 0.00 C ATOM 699 C SER S 499 4.266 -6.953 -6.660 1.00 0.00 C ATOM 700 O SER S 499 5.101 -6.274 -7.257 1.00 0.00 O ATOM 701 CB SER S 499 2.574 -5.101 -6.697 1.00 0.00 C ATOM 702 OG SER S 499 2.640 -5.335 -8.093 1.00 0.00 O ATOM 0 H SER S 499 3.852 -4.928 -4.507 1.00 0.00 H new ATOM 0 HA SER S 499 2.322 -7.046 -5.805 1.00 0.00 H new ATOM 0 HB2 SER S 499 1.542 -4.904 -6.407 1.00 0.00 H new ATOM 0 HB3 SER S 499 3.151 -4.210 -6.447 1.00 0.00 H new ATOM 0 HG SER S 499 2.290 -4.555 -8.572 1.00 0.00 H new ATOM 708 N LYS S 500 4.288 -8.280 -6.631 1.00 0.00 N ATOM 709 CA LYS S 500 5.317 -9.063 -7.314 1.00 0.00 C ATOM 710 C LYS S 500 6.702 -8.845 -6.702 1.00 0.00 C ATOM 711 O LYS S 500 7.071 -9.519 -5.739 1.00 0.00 O ATOM 712 CB LYS S 500 5.331 -8.734 -8.811 1.00 0.00 C ATOM 713 CG LYS S 500 4.107 -9.243 -9.557 1.00 0.00 C ATOM 714 CD LYS S 500 3.839 -8.428 -10.811 1.00 0.00 C ATOM 715 CE LYS S 500 2.731 -7.411 -10.587 1.00 0.00 C ATOM 716 NZ LYS S 500 2.783 -6.304 -11.582 1.00 0.00 N ATOM 0 H LYS S 500 3.597 -8.844 -6.136 1.00 0.00 H new ATOM 0 HA LYS S 500 5.068 -10.116 -7.185 1.00 0.00 H new ATOM 0 HB2 LYS S 500 5.399 -7.653 -8.937 1.00 0.00 H new ATOM 0 HB3 LYS S 500 6.226 -9.165 -9.261 1.00 0.00 H new ATOM 0 HG2 LYS S 500 4.253 -10.289 -9.826 1.00 0.00 H new ATOM 0 HG3 LYS S 500 3.237 -9.201 -8.902 1.00 0.00 H new ATOM 0 HD2 LYS S 500 4.751 -7.914 -11.114 1.00 0.00 H new ATOM 0 HD3 LYS S 500 3.563 -9.095 -11.628 1.00 0.00 H new ATOM 0 HE2 LYS S 500 1.763 -7.909 -10.648 1.00 0.00 H new ATOM 0 HE3 LYS S 500 2.814 -6.999 -9.581 1.00 0.00 H new ATOM 0 HZ1 LYS S 500 2.011 -5.632 -11.395 1.00 0.00 H new ATOM 0 HZ2 LYS S 500 3.696 -5.812 -11.507 1.00 0.00 H new ATOM 0 HZ3 LYS S 500 2.678 -6.694 -12.541 1.00 0.00 H new ATOM 730 N GLY S 501 7.476 -7.916 -7.266 1.00 0.00 N ATOM 731 CA GLY S 501 8.812 -7.660 -6.756 1.00 0.00 C ATOM 732 C GLY S 501 9.003 -6.232 -6.286 1.00 0.00 C ATOM 733 O GLY S 501 10.042 -5.624 -6.542 1.00 0.00 O ATOM 0 H GLY S 501 7.202 -7.340 -8.062 1.00 0.00 H new ATOM 0 HA2 GLY S 501 9.015 -8.339 -5.928 1.00 0.00 H new ATOM 0 HA3 GLY S 501 9.541 -7.881 -7.536 1.00 0.00 H new ATOM 737 N LYS S 502 8.007 -5.699 -5.592 1.00 0.00 N ATOM 738 CA LYS S 502 8.079 -4.337 -5.080 1.00 0.00 C ATOM 739 C LYS S 502 7.265 -4.197 -3.802 1.00 0.00 C ATOM 740 O LYS S 502 6.072 -4.496 -3.778 1.00 0.00 O ATOM 741 CB LYS S 502 7.584 -3.341 -6.128 1.00 0.00 C ATOM 742 CG LYS S 502 8.687 -2.825 -7.035 1.00 0.00 C ATOM 743 CD LYS S 502 8.249 -2.799 -8.491 1.00 0.00 C ATOM 744 CE LYS S 502 9.419 -3.050 -9.430 1.00 0.00 C ATOM 745 NZ LYS S 502 9.039 -3.930 -10.569 1.00 0.00 N ATOM 0 H LYS S 502 7.140 -6.188 -5.371 1.00 0.00 H new ATOM 0 HA LYS S 502 9.122 -4.117 -4.853 1.00 0.00 H new ATOM 0 HB2 LYS S 502 6.815 -3.817 -6.737 1.00 0.00 H new ATOM 0 HB3 LYS S 502 7.114 -2.497 -5.623 1.00 0.00 H new ATOM 0 HG2 LYS S 502 8.975 -1.821 -6.723 1.00 0.00 H new ATOM 0 HG3 LYS S 502 9.569 -3.457 -6.931 1.00 0.00 H new ATOM 0 HD2 LYS S 502 7.481 -3.555 -8.655 1.00 0.00 H new ATOM 0 HD3 LYS S 502 7.799 -1.833 -8.719 1.00 0.00 H new ATOM 0 HE2 LYS S 502 9.787 -2.098 -9.814 1.00 0.00 H new ATOM 0 HE3 LYS S 502 10.238 -3.508 -8.875 1.00 0.00 H new ATOM 0 HZ1 LYS S 502 9.864 -4.076 -11.185 1.00 0.00 H new ATOM 0 HZ2 LYS S 502 8.712 -4.848 -10.205 1.00 0.00 H new ATOM 0 HZ3 LYS S 502 8.275 -3.482 -11.114 1.00 0.00 H new ATOM 759 N VAL S 503 7.920 -3.745 -2.739 1.00 0.00 N ATOM 760 CA VAL S 503 7.249 -3.571 -1.458 1.00 0.00 C ATOM 761 C VAL S 503 7.001 -2.099 -1.158 1.00 0.00 C ATOM 762 O VAL S 503 7.935 -1.312 -1.006 1.00 0.00 O ATOM 763 CB VAL S 503 8.049 -4.191 -0.295 1.00 0.00 C ATOM 764 CG1 VAL S 503 7.150 -4.402 0.916 1.00 0.00 C ATOM 765 CG2 VAL S 503 8.692 -5.504 -0.717 1.00 0.00 C ATOM 0 H VAL S 503 8.909 -3.494 -2.739 1.00 0.00 H new ATOM 0 HA VAL S 503 6.295 -4.091 -1.542 1.00 0.00 H new ATOM 0 HB VAL S 503 8.844 -3.497 -0.021 1.00 0.00 H new ATOM 0 HG11 VAL S 503 7.730 -4.840 1.728 1.00 0.00 H new ATOM 0 HG12 VAL S 503 6.742 -3.444 1.238 1.00 0.00 H new ATOM 0 HG13 VAL S 503 6.333 -5.073 0.650 1.00 0.00 H new ATOM 0 HG21 VAL S 503 9.251 -5.921 0.121 1.00 0.00 H new ATOM 0 HG22 VAL S 503 7.917 -6.207 -1.023 1.00 0.00 H new ATOM 0 HG23 VAL S 503 9.370 -5.325 -1.552 1.00 0.00 H new ATOM 775 N GLY S 504 5.729 -1.748 -1.063 1.00 0.00 N ATOM 776 CA GLY S 504 5.334 -0.386 -0.769 1.00 0.00 C ATOM 777 C GLY S 504 4.043 -0.358 0.016 1.00 0.00 C ATOM 778 O GLY S 504 3.712 -1.333 0.685 1.00 0.00 O ATOM 0 H GLY S 504 4.950 -2.395 -1.187 1.00 0.00 H new ATOM 0 HA2 GLY S 504 6.121 0.111 -0.201 1.00 0.00 H new ATOM 0 HA3 GLY S 504 5.212 0.170 -1.698 1.00 0.00 H new ATOM 782 N ILE S 505 3.305 0.742 -0.067 1.00 0.00 N ATOM 783 CA ILE S 505 2.039 0.858 0.648 1.00 0.00 C ATOM 784 C ILE S 505 1.069 1.767 -0.084 1.00 0.00 C ATOM 785 O ILE S 505 1.466 2.566 -0.928 1.00 0.00 O ATOM 786 CB ILE S 505 2.240 1.385 2.079 1.00 0.00 C ATOM 787 CG1 ILE S 505 3.186 2.588 2.083 1.00 0.00 C ATOM 788 CG2 ILE S 505 2.773 0.277 2.970 1.00 0.00 C ATOM 789 CD1 ILE S 505 2.809 3.648 3.097 1.00 0.00 C ATOM 0 H ILE S 505 3.558 1.562 -0.618 1.00 0.00 H new ATOM 0 HA ILE S 505 1.620 -0.147 0.697 1.00 0.00 H new ATOM 0 HB ILE S 505 1.277 1.714 2.470 1.00 0.00 H new ATOM 0 HG12 ILE S 505 4.199 2.243 2.289 1.00 0.00 H new ATOM 0 HG13 ILE S 505 3.197 3.035 1.089 1.00 0.00 H new ATOM 0 HG21 ILE S 505 2.912 0.659 3.981 1.00 0.00 H new ATOM 0 HG22 ILE S 505 2.062 -0.549 2.989 1.00 0.00 H new ATOM 0 HG23 ILE S 505 3.728 -0.076 2.580 1.00 0.00 H new ATOM 0 HD11 ILE S 505 3.522 4.471 3.045 1.00 0.00 H new ATOM 0 HD12 ILE S 505 1.808 4.020 2.879 1.00 0.00 H new ATOM 0 HD13 ILE S 505 2.825 3.216 4.098 1.00 0.00 H new ATOM 801 N PHE S 506 -0.210 1.645 0.245 1.00 0.00 N ATOM 802 CA PHE S 506 -1.226 2.470 -0.401 1.00 0.00 C ATOM 803 C PHE S 506 -2.381 2.779 0.542 1.00 0.00 C ATOM 804 O PHE S 506 -2.524 2.152 1.592 1.00 0.00 O ATOM 805 CB PHE S 506 -1.750 1.796 -1.673 1.00 0.00 C ATOM 806 CG PHE S 506 -2.047 0.330 -1.522 1.00 0.00 C ATOM 807 CD1 PHE S 506 -1.032 -0.574 -1.250 1.00 0.00 C ATOM 808 CD2 PHE S 506 -3.340 -0.146 -1.665 1.00 0.00 C ATOM 809 CE1 PHE S 506 -1.303 -1.923 -1.119 1.00 0.00 C ATOM 810 CE2 PHE S 506 -3.615 -1.495 -1.537 1.00 0.00 C ATOM 811 CZ PHE S 506 -2.595 -2.384 -1.264 1.00 0.00 C ATOM 0 H PHE S 506 -0.567 0.994 0.944 1.00 0.00 H new ATOM 0 HA PHE S 506 -0.751 3.413 -0.673 1.00 0.00 H new ATOM 0 HB2 PHE S 506 -2.658 2.307 -1.993 1.00 0.00 H new ATOM 0 HB3 PHE S 506 -1.015 1.925 -2.467 1.00 0.00 H new ATOM 0 HD1 PHE S 506 -0.018 -0.220 -1.139 1.00 0.00 H new ATOM 0 HD2 PHE S 506 -4.142 0.544 -1.879 1.00 0.00 H new ATOM 0 HE1 PHE S 506 -0.503 -2.616 -0.903 1.00 0.00 H new ATOM 0 HE2 PHE S 506 -4.628 -1.853 -1.651 1.00 0.00 H new ATOM 0 HZ PHE S 506 -2.808 -3.438 -1.164 1.00 0.00 H new ATOM 821 N PRO S 507 -3.218 3.767 0.177 1.00 0.00 N ATOM 822 CA PRO S 507 -4.362 4.188 0.982 1.00 0.00 C ATOM 823 C PRO S 507 -5.577 3.277 0.819 1.00 0.00 C ATOM 824 O PRO S 507 -6.663 3.585 1.310 1.00 0.00 O ATOM 825 CB PRO S 507 -4.685 5.596 0.451 1.00 0.00 C ATOM 826 CG PRO S 507 -3.678 5.888 -0.617 1.00 0.00 C ATOM 827 CD PRO S 507 -3.108 4.568 -1.045 1.00 0.00 C ATOM 0 HA PRO S 507 -4.126 4.156 2.046 1.00 0.00 H new ATOM 0 HB2 PRO S 507 -5.698 5.637 0.051 1.00 0.00 H new ATOM 0 HB3 PRO S 507 -4.628 6.335 1.250 1.00 0.00 H new ATOM 0 HG2 PRO S 507 -4.144 6.399 -1.459 1.00 0.00 H new ATOM 0 HG3 PRO S 507 -2.894 6.544 -0.240 1.00 0.00 H new ATOM 0 HD2 PRO S 507 -3.671 4.131 -1.870 1.00 0.00 H new ATOM 0 HD3 PRO S 507 -2.074 4.661 -1.378 1.00 0.00 H new ATOM 835 N LYS S 508 -5.389 2.157 0.130 1.00 0.00 N ATOM 836 CA LYS S 508 -6.446 1.201 -0.097 1.00 0.00 C ATOM 837 C LYS S 508 -7.706 1.832 -0.695 1.00 0.00 C ATOM 838 O LYS S 508 -8.721 1.154 -0.860 1.00 0.00 O ATOM 839 CB LYS S 508 -6.767 0.505 1.202 1.00 0.00 C ATOM 840 CG LYS S 508 -7.319 -0.884 0.986 1.00 0.00 C ATOM 841 CD LYS S 508 -8.275 -1.300 2.093 1.00 0.00 C ATOM 842 CE LYS S 508 -9.619 -1.737 1.535 1.00 0.00 C ATOM 843 NZ LYS S 508 -10.313 -2.695 2.440 1.00 0.00 N ATOM 0 H LYS S 508 -4.495 1.894 -0.284 1.00 0.00 H new ATOM 0 HA LYS S 508 -6.090 0.481 -0.834 1.00 0.00 H new ATOM 0 HB2 LYS S 508 -5.866 0.445 1.812 1.00 0.00 H new ATOM 0 HB3 LYS S 508 -7.491 1.099 1.761 1.00 0.00 H new ATOM 0 HG2 LYS S 508 -7.837 -0.923 0.028 1.00 0.00 H new ATOM 0 HG3 LYS S 508 -6.496 -1.596 0.932 1.00 0.00 H new ATOM 0 HD2 LYS S 508 -7.836 -2.116 2.667 1.00 0.00 H new ATOM 0 HD3 LYS S 508 -8.419 -0.468 2.782 1.00 0.00 H new ATOM 0 HE2 LYS S 508 -10.250 -0.862 1.381 1.00 0.00 H new ATOM 0 HE3 LYS S 508 -9.473 -2.200 0.559 1.00 0.00 H new ATOM 0 HZ1 LYS S 508 -11.226 -2.968 2.023 1.00 0.00 H new ATOM 0 HZ2 LYS S 508 -9.723 -3.542 2.567 1.00 0.00 H new ATOM 0 HZ3 LYS S 508 -10.476 -2.245 3.363 1.00 0.00 H new ATOM 857 N VAL S 509 -7.636 3.110 -1.051 1.00 0.00 N ATOM 858 CA VAL S 509 -8.773 3.784 -1.664 1.00 0.00 C ATOM 859 C VAL S 509 -8.756 3.536 -3.168 1.00 0.00 C ATOM 860 O VAL S 509 -9.778 3.662 -3.846 1.00 0.00 O ATOM 861 CB VAL S 509 -8.785 5.306 -1.376 1.00 0.00 C ATOM 862 CG1 VAL S 509 -7.414 5.924 -1.587 1.00 0.00 C ATOM 863 CG2 VAL S 509 -9.817 6.011 -2.243 1.00 0.00 C ATOM 0 H VAL S 509 -6.810 3.696 -0.927 1.00 0.00 H new ATOM 0 HA VAL S 509 -9.680 3.370 -1.224 1.00 0.00 H new ATOM 0 HB VAL S 509 -9.057 5.437 -0.329 1.00 0.00 H new ATOM 0 HG11 VAL S 509 -7.460 6.992 -1.376 1.00 0.00 H new ATOM 0 HG12 VAL S 509 -6.695 5.452 -0.917 1.00 0.00 H new ATOM 0 HG13 VAL S 509 -7.101 5.771 -2.620 1.00 0.00 H new ATOM 0 HG21 VAL S 509 -9.808 7.079 -2.024 1.00 0.00 H new ATOM 0 HG22 VAL S 509 -9.577 5.854 -3.295 1.00 0.00 H new ATOM 0 HG23 VAL S 509 -10.807 5.606 -2.033 1.00 0.00 H new ATOM 873 N PHE S 510 -7.587 3.160 -3.677 1.00 0.00 N ATOM 874 CA PHE S 510 -7.414 2.863 -5.089 1.00 0.00 C ATOM 875 C PHE S 510 -7.582 1.368 -5.336 1.00 0.00 C ATOM 876 O PHE S 510 -7.161 0.850 -6.369 1.00 0.00 O ATOM 877 CB PHE S 510 -6.025 3.308 -5.548 1.00 0.00 C ATOM 878 CG PHE S 510 -5.791 4.781 -5.396 1.00 0.00 C ATOM 879 CD1 PHE S 510 -5.801 5.377 -4.147 1.00 0.00 C ATOM 880 CD2 PHE S 510 -5.569 5.568 -6.508 1.00 0.00 C ATOM 881 CE1 PHE S 510 -5.595 6.735 -4.015 1.00 0.00 C ATOM 882 CE2 PHE S 510 -5.368 6.926 -6.384 1.00 0.00 C ATOM 883 CZ PHE S 510 -5.381 7.511 -5.134 1.00 0.00 C ATOM 0 H PHE S 510 -6.738 3.054 -3.122 1.00 0.00 H new ATOM 0 HA PHE S 510 -8.171 3.404 -5.657 1.00 0.00 H new ATOM 0 HB2 PHE S 510 -5.271 2.767 -4.976 1.00 0.00 H new ATOM 0 HB3 PHE S 510 -5.891 3.032 -6.594 1.00 0.00 H new ATOM 0 HD1 PHE S 510 -5.972 4.774 -3.268 1.00 0.00 H new ATOM 0 HD2 PHE S 510 -5.553 5.114 -7.488 1.00 0.00 H new ATOM 0 HE1 PHE S 510 -5.601 7.190 -3.035 1.00 0.00 H new ATOM 0 HE2 PHE S 510 -5.201 7.531 -7.263 1.00 0.00 H new ATOM 0 HZ PHE S 510 -5.224 8.575 -5.033 1.00 0.00 H new ATOM 893 N VAL S 511 -8.183 0.681 -4.368 1.00 0.00 N ATOM 894 CA VAL S 511 -8.393 -0.754 -4.459 1.00 0.00 C ATOM 895 C VAL S 511 -9.579 -1.185 -3.595 1.00 0.00 C ATOM 896 O VAL S 511 -9.441 -2.032 -2.713 1.00 0.00 O ATOM 897 CB VAL S 511 -7.140 -1.520 -3.987 1.00 0.00 C ATOM 898 CG1 VAL S 511 -5.944 -1.228 -4.875 1.00 0.00 C ATOM 899 CG2 VAL S 511 -6.818 -1.159 -2.549 1.00 0.00 C ATOM 0 H VAL S 511 -8.534 1.102 -3.508 1.00 0.00 H new ATOM 0 HA VAL S 511 -8.596 -0.988 -5.504 1.00 0.00 H new ATOM 0 HB VAL S 511 -7.356 -2.586 -4.052 1.00 0.00 H new ATOM 0 HG11 VAL S 511 -5.079 -1.784 -4.514 1.00 0.00 H new ATOM 0 HG12 VAL S 511 -6.168 -1.530 -5.898 1.00 0.00 H new ATOM 0 HG13 VAL S 511 -5.725 -0.160 -4.851 1.00 0.00 H new ATOM 0 HG21 VAL S 511 -5.932 -1.706 -2.226 1.00 0.00 H new ATOM 0 HG22 VAL S 511 -6.630 -0.088 -2.476 1.00 0.00 H new ATOM 0 HG23 VAL S 511 -7.660 -1.424 -1.910 1.00 0.00 H new ATOM 909 N GLU S 512 -10.741 -0.593 -3.846 1.00 0.00 N ATOM 910 CA GLU S 512 -11.945 -0.914 -3.081 1.00 0.00 C ATOM 911 C GLU S 512 -12.481 -2.306 -3.409 1.00 0.00 C ATOM 912 O GLU S 512 -13.607 -2.646 -3.045 1.00 0.00 O ATOM 913 CB GLU S 512 -13.028 0.130 -3.344 1.00 0.00 C ATOM 914 CG GLU S 512 -13.516 0.138 -4.783 1.00 0.00 C ATOM 915 CD GLU S 512 -14.537 1.227 -5.049 1.00 0.00 C ATOM 916 OE1 GLU S 512 -15.668 1.120 -4.531 1.00 0.00 O ATOM 917 OE2 GLU S 512 -14.204 2.188 -5.774 1.00 0.00 O ATOM 0 H GLU S 512 -10.877 0.111 -4.572 1.00 0.00 H new ATOM 0 HA GLU S 512 -11.671 -0.904 -2.026 1.00 0.00 H new ATOM 0 HB2 GLU S 512 -13.873 -0.058 -2.682 1.00 0.00 H new ATOM 0 HB3 GLU S 512 -12.640 1.117 -3.093 1.00 0.00 H new ATOM 0 HG2 GLU S 512 -12.665 0.273 -5.450 1.00 0.00 H new ATOM 0 HG3 GLU S 512 -13.955 -0.831 -5.019 1.00 0.00 H new ATOM 986 N LYS P 360 -11.090 8.834 -15.277 1.00 0.00 N ATOM 987 CA LYS P 360 -11.650 9.026 -13.944 1.00 0.00 C ATOM 988 C LYS P 360 -10.673 9.768 -13.040 1.00 0.00 C ATOM 989 O LYS P 360 -9.466 9.534 -13.084 1.00 0.00 O ATOM 990 CB LYS P 360 -12.010 7.678 -13.315 1.00 0.00 C ATOM 991 CG LYS P 360 -13.432 7.227 -13.603 1.00 0.00 C ATOM 992 CD LYS P 360 -14.033 6.496 -12.413 1.00 0.00 C ATOM 993 CE LYS P 360 -15.389 5.898 -12.753 1.00 0.00 C ATOM 994 NZ LYS P 360 -16.003 5.210 -11.584 1.00 0.00 N ATOM 0 HA LYS P 360 -12.553 9.627 -14.047 1.00 0.00 H new ATOM 0 HB2 LYS P 360 -11.317 6.920 -13.681 1.00 0.00 H new ATOM 0 HB3 LYS P 360 -11.871 7.742 -12.236 1.00 0.00 H new ATOM 0 HG2 LYS P 360 -14.047 8.093 -13.849 1.00 0.00 H new ATOM 0 HG3 LYS P 360 -13.439 6.573 -14.475 1.00 0.00 H new ATOM 0 HD2 LYS P 360 -13.356 5.705 -12.091 1.00 0.00 H new ATOM 0 HD3 LYS P 360 -14.138 7.186 -11.576 1.00 0.00 H new ATOM 0 HE2 LYS P 360 -16.056 6.686 -13.101 1.00 0.00 H new ATOM 0 HE3 LYS P 360 -15.277 5.189 -13.574 1.00 0.00 H new ATOM 0 HZ1 LYS P 360 -16.926 4.817 -11.858 1.00 0.00 H new ATOM 0 HZ2 LYS P 360 -15.379 4.441 -11.267 1.00 0.00 H new ATOM 0 HZ3 LYS P 360 -16.134 5.892 -10.809 1.00 0.00 H new ATOM 1008 N PRO P 361 -11.192 10.678 -12.201 1.00 0.00 N ATOM 1009 CA PRO P 361 -10.388 11.466 -11.273 1.00 0.00 C ATOM 1010 C PRO P 361 -10.060 10.676 -10.010 1.00 0.00 C ATOM 1011 O PRO P 361 -10.868 10.610 -9.083 1.00 0.00 O ATOM 1012 CB PRO P 361 -11.296 12.666 -10.944 1.00 0.00 C ATOM 1013 CG PRO P 361 -12.532 12.481 -11.772 1.00 0.00 C ATOM 1014 CD PRO P 361 -12.606 11.022 -12.078 1.00 0.00 C ATOM 0 HA PRO P 361 -9.426 11.756 -11.695 1.00 0.00 H new ATOM 0 HB2 PRO P 361 -11.538 12.694 -9.881 1.00 0.00 H new ATOM 0 HB3 PRO P 361 -10.802 13.608 -11.184 1.00 0.00 H new ATOM 0 HG2 PRO P 361 -13.418 12.812 -11.230 1.00 0.00 H new ATOM 0 HG3 PRO P 361 -12.480 13.070 -12.688 1.00 0.00 H new ATOM 0 HD2 PRO P 361 -13.097 10.461 -11.283 1.00 0.00 H new ATOM 0 HD3 PRO P 361 -13.158 10.823 -12.997 1.00 0.00 H new ATOM 1022 N GLN P 362 -8.880 10.065 -9.987 1.00 0.00 N ATOM 1023 CA GLN P 362 -8.456 9.262 -8.841 1.00 0.00 C ATOM 1024 C GLN P 362 -8.722 9.971 -7.523 1.00 0.00 C ATOM 1025 O GLN P 362 -8.829 11.195 -7.463 1.00 0.00 O ATOM 1026 CB GLN P 362 -6.963 8.928 -8.924 1.00 0.00 C ATOM 1027 CG GLN P 362 -6.067 10.152 -8.995 1.00 0.00 C ATOM 1028 CD GLN P 362 -5.874 10.654 -10.414 1.00 0.00 C ATOM 1029 OE1 GLN P 362 -6.147 11.816 -10.716 1.00 0.00 O ATOM 1030 NE2 GLN P 362 -5.402 9.777 -11.293 1.00 0.00 N ATOM 0 H GLN P 362 -8.200 10.109 -10.746 1.00 0.00 H new ATOM 0 HA GLN P 362 -9.042 8.344 -8.875 1.00 0.00 H new ATOM 0 HB2 GLN P 362 -6.684 8.334 -8.054 1.00 0.00 H new ATOM 0 HB3 GLN P 362 -6.787 8.308 -9.803 1.00 0.00 H new ATOM 0 HG2 GLN P 362 -6.497 10.948 -8.388 1.00 0.00 H new ATOM 0 HG3 GLN P 362 -5.095 9.912 -8.564 1.00 0.00 H new ATOM 0 HE21 GLN P 362 -5.189 8.824 -10.999 1.00 0.00 H new ATOM 0 HE22 GLN P 362 -5.252 10.057 -12.262 1.00 0.00 H new ATOM 1039 N PRO P 363 -8.817 9.185 -6.447 1.00 0.00 N ATOM 1040 CA PRO P 363 -9.057 9.707 -5.109 1.00 0.00 C ATOM 1041 C PRO P 363 -7.888 10.535 -4.600 1.00 0.00 C ATOM 1042 O PRO P 363 -6.783 10.018 -4.436 1.00 0.00 O ATOM 1043 CB PRO P 363 -9.219 8.461 -4.233 1.00 0.00 C ATOM 1044 CG PRO P 363 -8.790 7.288 -5.053 1.00 0.00 C ATOM 1045 CD PRO P 363 -8.687 7.723 -6.481 1.00 0.00 C ATOM 0 HA PRO P 363 -9.926 10.365 -5.096 1.00 0.00 H new ATOM 0 HB2 PRO P 363 -8.612 8.543 -3.331 1.00 0.00 H new ATOM 0 HB3 PRO P 363 -10.254 8.348 -3.912 1.00 0.00 H new ATOM 0 HG2 PRO P 363 -7.830 6.910 -4.701 1.00 0.00 H new ATOM 0 HG3 PRO P 363 -9.508 6.474 -4.955 1.00 0.00 H new ATOM 0 HD2 PRO P 363 -7.734 7.422 -6.917 1.00 0.00 H new ATOM 0 HD3 PRO P 363 -9.472 7.272 -7.088 1.00 0.00 H new ATOM 1053 N ALA P 364 -8.131 11.815 -4.328 1.00 0.00 N ATOM 1054 CA ALA P 364 -7.080 12.679 -3.808 1.00 0.00 C ATOM 1055 C ALA P 364 -6.406 11.994 -2.626 1.00 0.00 C ATOM 1056 O ALA P 364 -6.964 11.940 -1.531 1.00 0.00 O ATOM 1057 CB ALA P 364 -7.650 14.027 -3.394 1.00 0.00 C ATOM 0 H ALA P 364 -9.035 12.270 -4.458 1.00 0.00 H new ATOM 0 HA ALA P 364 -6.341 12.856 -4.589 1.00 0.00 H new ATOM 0 HB1 ALA P 364 -6.849 14.658 -3.008 1.00 0.00 H new ATOM 0 HB2 ALA P 364 -8.108 14.509 -4.258 1.00 0.00 H new ATOM 0 HB3 ALA P 364 -8.402 13.881 -2.619 1.00 0.00 H new ATOM 1063 N VAL P 365 -5.224 11.435 -2.862 1.00 0.00 N ATOM 1064 CA VAL P 365 -4.513 10.714 -1.812 1.00 0.00 C ATOM 1065 C VAL P 365 -4.443 11.534 -0.525 1.00 0.00 C ATOM 1066 O VAL P 365 -4.144 12.729 -0.548 1.00 0.00 O ATOM 1067 CB VAL P 365 -3.088 10.288 -2.230 1.00 0.00 C ATOM 1068 CG1 VAL P 365 -2.692 9.025 -1.494 1.00 0.00 C ATOM 1069 CG2 VAL P 365 -2.990 10.050 -3.726 1.00 0.00 C ATOM 0 H VAL P 365 -4.742 11.466 -3.760 1.00 0.00 H new ATOM 0 HA VAL P 365 -5.090 9.807 -1.634 1.00 0.00 H new ATOM 0 HB VAL P 365 -2.410 11.101 -1.970 1.00 0.00 H new ATOM 0 HG11 VAL P 365 -1.686 8.730 -1.793 1.00 0.00 H new ATOM 0 HG12 VAL P 365 -2.712 9.208 -0.420 1.00 0.00 H new ATOM 0 HG13 VAL P 365 -3.392 8.226 -1.739 1.00 0.00 H new ATOM 0 HG21 VAL P 365 -1.973 9.752 -3.981 1.00 0.00 H new ATOM 0 HG22 VAL P 365 -3.683 9.260 -4.015 1.00 0.00 H new ATOM 0 HG23 VAL P 365 -3.244 10.967 -4.258 1.00 0.00 H new ATOM 1079 N PRO P 366 -4.744 10.893 0.617 1.00 0.00 N ATOM 1080 CA PRO P 366 -4.746 11.545 1.930 1.00 0.00 C ATOM 1081 C PRO P 366 -3.358 11.637 2.554 1.00 0.00 C ATOM 1082 O PRO P 366 -2.395 11.071 2.036 1.00 0.00 O ATOM 1083 CB PRO P 366 -5.634 10.614 2.754 1.00 0.00 C ATOM 1084 CG PRO P 366 -5.378 9.261 2.184 1.00 0.00 C ATOM 1085 CD PRO P 366 -5.128 9.469 0.713 1.00 0.00 C ATOM 0 HA PRO P 366 -5.090 12.578 1.875 1.00 0.00 H new ATOM 0 HB2 PRO P 366 -5.378 10.654 3.813 1.00 0.00 H new ATOM 0 HB3 PRO P 366 -6.685 10.889 2.669 1.00 0.00 H new ATOM 0 HG2 PRO P 366 -4.518 8.792 2.663 1.00 0.00 H new ATOM 0 HG3 PRO P 366 -6.231 8.602 2.345 1.00 0.00 H new ATOM 0 HD2 PRO P 366 -4.336 8.816 0.346 1.00 0.00 H new ATOM 0 HD3 PRO P 366 -6.018 9.254 0.122 1.00 0.00 H new ATOM 1093 N PRO P 367 -3.242 12.338 3.699 1.00 0.00 N ATOM 1094 CA PRO P 367 -1.969 12.483 4.413 1.00 0.00 C ATOM 1095 C PRO P 367 -1.485 11.144 4.938 1.00 0.00 C ATOM 1096 O PRO P 367 -1.844 10.718 6.035 1.00 0.00 O ATOM 1097 CB PRO P 367 -2.313 13.416 5.570 1.00 0.00 C ATOM 1098 CG PRO P 367 -3.762 13.192 5.781 1.00 0.00 C ATOM 1099 CD PRO P 367 -4.336 13.023 4.406 1.00 0.00 C ATOM 0 HA PRO P 367 -1.171 12.864 3.776 1.00 0.00 H new ATOM 0 HB2 PRO P 367 -1.736 13.176 6.463 1.00 0.00 H new ATOM 0 HB3 PRO P 367 -2.100 14.456 5.323 1.00 0.00 H new ATOM 0 HG2 PRO P 367 -3.939 12.308 6.393 1.00 0.00 H new ATOM 0 HG3 PRO P 367 -4.220 14.035 6.298 1.00 0.00 H new ATOM 0 HD2 PRO P 367 -5.250 12.429 4.416 1.00 0.00 H new ATOM 0 HD3 PRO P 367 -4.582 13.980 3.946 1.00 0.00 H new ATOM 1107 N ARG P 368 -0.691 10.480 4.120 1.00 0.00 N ATOM 1108 CA ARG P 368 -0.152 9.157 4.443 1.00 0.00 C ATOM 1109 C ARG P 368 0.253 9.033 5.908 1.00 0.00 C ATOM 1110 O ARG P 368 0.469 10.021 6.608 1.00 0.00 O ATOM 1111 CB ARG P 368 1.045 8.795 3.545 1.00 0.00 C ATOM 1112 CG ARG P 368 1.490 9.896 2.594 1.00 0.00 C ATOM 1113 CD ARG P 368 2.928 9.695 2.142 1.00 0.00 C ATOM 1114 NE ARG P 368 3.885 10.127 3.158 1.00 0.00 N ATOM 1115 CZ ARG P 368 4.063 11.397 3.516 1.00 0.00 C ATOM 1116 NH1 ARG P 368 3.349 12.360 2.947 1.00 0.00 N ATOM 1117 NH2 ARG P 368 4.954 11.705 4.449 1.00 0.00 N ATOM 0 H ARG P 368 -0.397 10.836 3.211 1.00 0.00 H new ATOM 0 HA ARG P 368 -0.962 8.453 4.255 1.00 0.00 H new ATOM 0 HB2 ARG P 368 1.887 8.522 4.180 1.00 0.00 H new ATOM 0 HB3 ARG P 368 0.787 7.912 2.960 1.00 0.00 H new ATOM 0 HG2 ARG P 368 0.833 9.914 1.724 1.00 0.00 H new ATOM 0 HG3 ARG P 368 1.394 10.864 3.086 1.00 0.00 H new ATOM 0 HD2 ARG P 368 3.093 8.642 1.913 1.00 0.00 H new ATOM 0 HD3 ARG P 368 3.100 10.252 1.221 1.00 0.00 H new ATOM 0 HE ARG P 368 4.450 9.414 3.620 1.00 0.00 H new ATOM 0 HH11 ARG P 368 2.660 12.129 2.232 1.00 0.00 H new ATOM 0 HH12 ARG P 368 3.489 13.331 3.225 1.00 0.00 H new ATOM 0 HH21 ARG P 368 5.503 10.969 4.893 1.00 0.00 H new ATOM 0 HH22 ARG P 368 5.090 12.678 4.723 1.00 0.00 H new ATOM 1131 N PRO P 369 0.346 7.781 6.365 1.00 0.00 N ATOM 1132 CA PRO P 369 0.712 7.430 7.742 1.00 0.00 C ATOM 1133 C PRO P 369 1.953 8.173 8.223 1.00 0.00 C ATOM 1134 O PRO P 369 2.575 8.917 7.464 1.00 0.00 O ATOM 1135 CB PRO P 369 0.966 5.927 7.638 1.00 0.00 C ATOM 1136 CG PRO P 369 0.045 5.492 6.550 1.00 0.00 C ATOM 1137 CD PRO P 369 0.092 6.587 5.542 1.00 0.00 C ATOM 0 HA PRO P 369 -0.055 7.700 8.467 1.00 0.00 H new ATOM 0 HB2 PRO P 369 2.006 5.712 7.393 1.00 0.00 H new ATOM 0 HB3 PRO P 369 0.747 5.417 8.576 1.00 0.00 H new ATOM 0 HG2 PRO P 369 0.365 4.544 6.118 1.00 0.00 H new ATOM 0 HG3 PRO P 369 -0.968 5.345 6.926 1.00 0.00 H new ATOM 0 HD2 PRO P 369 0.882 6.427 4.808 1.00 0.00 H new ATOM 0 HD3 PRO P 369 -0.844 6.668 4.990 1.00 0.00 H new ATOM 1145 N SER P 370 2.306 7.975 9.489 1.00 0.00 N ATOM 1146 CA SER P 370 3.467 8.638 10.071 1.00 0.00 C ATOM 1147 C SER P 370 4.740 7.815 9.876 1.00 0.00 C ATOM 1148 O SER P 370 5.715 7.989 10.606 1.00 0.00 O ATOM 1149 CB SER P 370 3.238 8.894 11.561 1.00 0.00 C ATOM 1150 OG SER P 370 2.640 10.160 11.775 1.00 0.00 O ATOM 0 H SER P 370 1.805 7.361 10.131 1.00 0.00 H new ATOM 0 HA SER P 370 3.597 9.589 9.555 1.00 0.00 H new ATOM 0 HB2 SER P 370 2.600 8.113 11.974 1.00 0.00 H new ATOM 0 HB3 SER P 370 4.188 8.843 12.092 1.00 0.00 H new ATOM 0 HG SER P 370 2.503 10.299 12.735 1.00 0.00 H new ATOM 1156 N ALA P 371 4.727 6.920 8.890 1.00 0.00 N ATOM 1157 CA ALA P 371 5.883 6.076 8.602 1.00 0.00 C ATOM 1158 C ALA P 371 6.115 5.055 9.715 1.00 0.00 C ATOM 1159 O ALA P 371 6.073 3.850 9.483 1.00 0.00 O ATOM 1160 CB ALA P 371 7.125 6.929 8.388 1.00 0.00 C ATOM 0 H ALA P 371 3.927 6.761 8.277 1.00 0.00 H new ATOM 0 HA ALA P 371 5.677 5.526 7.684 1.00 0.00 H new ATOM 0 HB1 ALA P 371 7.977 6.284 8.174 1.00 0.00 H new ATOM 0 HB2 ALA P 371 6.962 7.605 7.548 1.00 0.00 H new ATOM 0 HB3 ALA P 371 7.327 7.510 9.288 1.00 0.00 H new ATOM 1166 N ASP P 372 6.368 5.537 10.925 1.00 0.00 N ATOM 1167 CA ASP P 372 6.605 4.647 12.056 1.00 0.00 C ATOM 1168 C ASP P 372 5.471 3.642 12.207 1.00 0.00 C ATOM 1169 O ASP P 372 5.717 2.436 12.216 1.00 0.00 O ATOM 1170 CB ASP P 372 6.784 5.447 13.347 1.00 0.00 C ATOM 1171 CG ASP P 372 7.389 4.618 14.462 1.00 0.00 C ATOM 1172 OD1 ASP P 372 6.721 3.671 14.928 1.00 0.00 O ATOM 1173 OD2 ASP P 372 8.531 4.916 14.870 1.00 0.00 O ATOM 0 H ASP P 372 6.414 6.531 11.148 1.00 0.00 H new ATOM 0 HA ASP P 372 7.525 4.096 11.860 1.00 0.00 H new ATOM 0 HB2 ASP P 372 7.422 6.309 13.152 1.00 0.00 H new ATOM 0 HB3 ASP P 372 5.817 5.833 13.669 1.00 0.00 H new ATOM 1178 N LEU P 373 4.225 4.113 12.307 1.00 0.00 N ATOM 1179 CA LEU P 373 3.114 3.177 12.430 1.00 0.00 C ATOM 1180 C LEU P 373 3.163 2.208 11.261 1.00 0.00 C ATOM 1181 O LEU P 373 2.811 1.037 11.395 1.00 0.00 O ATOM 1182 CB LEU P 373 1.749 3.880 12.543 1.00 0.00 C ATOM 1183 CG LEU P 373 1.197 4.578 11.292 1.00 0.00 C ATOM 1184 CD1 LEU P 373 1.025 3.610 10.135 1.00 0.00 C ATOM 1185 CD2 LEU P 373 -0.139 5.217 11.617 1.00 0.00 C ATOM 0 H LEU P 373 3.969 5.100 12.305 1.00 0.00 H new ATOM 0 HA LEU P 373 3.224 2.626 13.364 1.00 0.00 H new ATOM 0 HB2 LEU P 373 1.016 3.139 12.864 1.00 0.00 H new ATOM 0 HB3 LEU P 373 1.820 4.623 13.337 1.00 0.00 H new ATOM 0 HG LEU P 373 1.917 5.338 10.989 1.00 0.00 H new ATOM 0 HD11 LEU P 373 0.632 4.144 9.269 1.00 0.00 H new ATOM 0 HD12 LEU P 373 1.990 3.169 9.883 1.00 0.00 H new ATOM 0 HD13 LEU P 373 0.329 2.821 10.421 1.00 0.00 H new ATOM 0 HD21 LEU P 373 -0.531 5.713 10.729 1.00 0.00 H new ATOM 0 HD22 LEU P 373 -0.840 4.449 11.943 1.00 0.00 H new ATOM 0 HD23 LEU P 373 -0.008 5.950 12.413 1.00 0.00 H new ATOM 1197 N ILE P 374 3.674 2.687 10.122 1.00 0.00 N ATOM 1198 CA ILE P 374 3.840 1.833 8.962 1.00 0.00 C ATOM 1199 C ILE P 374 4.895 0.807 9.315 1.00 0.00 C ATOM 1200 O ILE P 374 4.717 -0.393 9.121 1.00 0.00 O ATOM 1201 CB ILE P 374 4.290 2.614 7.705 1.00 0.00 C ATOM 1202 CG1 ILE P 374 3.198 3.579 7.244 1.00 0.00 C ATOM 1203 CG2 ILE P 374 4.663 1.650 6.592 1.00 0.00 C ATOM 1204 CD1 ILE P 374 3.628 4.472 6.102 1.00 0.00 C ATOM 0 H ILE P 374 3.974 3.653 9.988 1.00 0.00 H new ATOM 0 HA ILE P 374 2.880 1.376 8.720 1.00 0.00 H new ATOM 0 HB ILE P 374 5.170 3.203 7.962 1.00 0.00 H new ATOM 0 HG12 ILE P 374 2.323 3.006 6.938 1.00 0.00 H new ATOM 0 HG13 ILE P 374 2.893 4.200 8.086 1.00 0.00 H new ATOM 0 HG21 ILE P 374 4.978 2.213 5.713 1.00 0.00 H new ATOM 0 HG22 ILE P 374 5.480 1.009 6.924 1.00 0.00 H new ATOM 0 HG23 ILE P 374 3.799 1.035 6.339 1.00 0.00 H new ATOM 0 HD11 ILE P 374 2.805 5.131 5.826 1.00 0.00 H new ATOM 0 HD12 ILE P 374 4.484 5.071 6.411 1.00 0.00 H new ATOM 0 HD13 ILE P 374 3.905 3.858 5.245 1.00 0.00 H new ATOM 1216 N LEU P 375 5.980 1.306 9.895 1.00 0.00 N ATOM 1217 CA LEU P 375 7.064 0.460 10.350 1.00 0.00 C ATOM 1218 C LEU P 375 6.534 -0.516 11.392 1.00 0.00 C ATOM 1219 O LEU P 375 7.088 -1.593 11.607 1.00 0.00 O ATOM 1220 CB LEU P 375 8.193 1.329 10.916 1.00 0.00 C ATOM 1221 CG LEU P 375 8.900 2.196 9.872 1.00 0.00 C ATOM 1222 CD1 LEU P 375 9.233 3.570 10.435 1.00 0.00 C ATOM 1223 CD2 LEU P 375 10.166 1.515 9.366 1.00 0.00 C ATOM 0 H LEU P 375 6.128 2.302 10.060 1.00 0.00 H new ATOM 0 HA LEU P 375 7.470 -0.115 9.517 1.00 0.00 H new ATOM 0 HB2 LEU P 375 7.784 1.976 11.693 1.00 0.00 H new ATOM 0 HB3 LEU P 375 8.929 0.683 11.394 1.00 0.00 H new ATOM 0 HG LEU P 375 8.216 2.325 9.033 1.00 0.00 H new ATOM 0 HD11 LEU P 375 9.735 4.164 9.671 1.00 0.00 H new ATOM 0 HD12 LEU P 375 8.314 4.071 10.739 1.00 0.00 H new ATOM 0 HD13 LEU P 375 9.889 3.460 11.298 1.00 0.00 H new ATOM 0 HD21 LEU P 375 10.650 2.151 8.625 1.00 0.00 H new ATOM 0 HD22 LEU P 375 10.847 1.347 10.200 1.00 0.00 H new ATOM 0 HD23 LEU P 375 9.908 0.559 8.910 1.00 0.00 H new ATOM 1235 N ASN P 376 5.428 -0.120 12.012 1.00 0.00 N ATOM 1236 CA ASN P 376 4.756 -0.927 13.012 1.00 0.00 C ATOM 1237 C ASN P 376 3.708 -1.827 12.357 1.00 0.00 C ATOM 1238 O ASN P 376 3.251 -2.801 12.955 1.00 0.00 O ATOM 1239 CB ASN P 376 4.074 -0.010 14.031 1.00 0.00 C ATOM 1240 CG ASN P 376 4.417 -0.374 15.462 1.00 0.00 C ATOM 1241 OD1 ASN P 376 5.576 -0.309 15.872 1.00 0.00 O ATOM 1242 ND2 ASN P 376 3.406 -0.761 16.233 1.00 0.00 N ATOM 0 H ASN P 376 4.974 0.775 11.831 1.00 0.00 H new ATOM 0 HA ASN P 376 5.494 -1.554 13.512 1.00 0.00 H new ATOM 0 HB2 ASN P 376 4.370 1.022 13.841 1.00 0.00 H new ATOM 0 HB3 ASN P 376 2.994 -0.062 13.895 1.00 0.00 H new ATOM 0 HD21 ASN P 376 3.576 -1.018 17.205 1.00 0.00 H new ATOM 0 HD22 ASN P 376 2.460 -0.801 15.852 1.00 0.00 H new ATOM 1249 N ARG P 377 3.307 -1.469 11.136 1.00 0.00 N ATOM 1250 CA ARG P 377 2.283 -2.219 10.417 1.00 0.00 C ATOM 1251 C ARG P 377 2.697 -2.556 8.975 1.00 0.00 C ATOM 1252 O ARG P 377 1.854 -2.580 8.080 1.00 0.00 O ATOM 1253 CB ARG P 377 0.978 -1.409 10.408 1.00 0.00 C ATOM 1254 CG ARG P 377 0.619 -0.802 11.764 1.00 0.00 C ATOM 1255 CD ARG P 377 0.018 0.596 11.633 1.00 0.00 C ATOM 1256 NE ARG P 377 -1.216 0.731 12.405 1.00 0.00 N ATOM 1257 CZ ARG P 377 -1.251 0.831 13.733 1.00 0.00 C ATOM 1258 NH1 ARG P 377 -0.126 0.814 14.437 1.00 0.00 N ATOM 1259 NH2 ARG P 377 -2.415 0.951 14.357 1.00 0.00 N ATOM 0 H ARG P 377 3.676 -0.666 10.628 1.00 0.00 H new ATOM 0 HA ARG P 377 2.143 -3.167 10.937 1.00 0.00 H new ATOM 0 HB2 ARG P 377 1.063 -0.608 9.673 1.00 0.00 H new ATOM 0 HB3 ARG P 377 0.163 -2.055 10.082 1.00 0.00 H new ATOM 0 HG2 ARG P 377 -0.090 -1.453 12.275 1.00 0.00 H new ATOM 0 HG3 ARG P 377 1.513 -0.754 12.386 1.00 0.00 H new ATOM 0 HD2 ARG P 377 0.742 1.336 11.973 1.00 0.00 H new ATOM 0 HD3 ARG P 377 -0.185 0.807 10.583 1.00 0.00 H new ATOM 0 HE ARG P 377 -2.101 0.750 11.898 1.00 0.00 H new ATOM 0 HH11 ARG P 377 0.772 0.724 13.961 1.00 0.00 H new ATOM 0 HH12 ARG P 377 -0.159 0.891 15.454 1.00 0.00 H new ATOM 0 HH21 ARG P 377 -3.282 0.967 13.820 1.00 0.00 H new ATOM 0 HH22 ARG P 377 -2.443 1.028 15.374 1.00 0.00 H new ATOM 1273 N CYS P 378 3.986 -2.834 8.750 1.00 0.00 N ATOM 1274 CA CYS P 378 4.461 -3.184 7.404 1.00 0.00 C ATOM 1275 C CYS P 378 5.720 -4.047 7.449 1.00 0.00 C ATOM 1276 O CYS P 378 6.205 -4.413 8.520 1.00 0.00 O ATOM 1277 CB CYS P 378 4.739 -1.934 6.564 1.00 0.00 C ATOM 1278 SG CYS P 378 3.321 -1.355 5.609 1.00 0.00 S ATOM 0 H CYS P 378 4.710 -2.824 9.469 1.00 0.00 H new ATOM 0 HA CYS P 378 3.660 -3.758 6.938 1.00 0.00 H new ATOM 0 HB2 CYS P 378 5.070 -1.132 7.224 1.00 0.00 H new ATOM 0 HB3 CYS P 378 5.562 -2.145 5.881 1.00 0.00 H new ATOM 0 HG CYS P 378 3.478 -1.678 4.360 1.00 0.00 H new ATOM 1284 N SER P 379 6.241 -4.366 6.263 1.00 0.00 N ATOM 1285 CA SER P 379 7.444 -5.182 6.134 1.00 0.00 C ATOM 1286 C SER P 379 8.702 -4.321 6.222 1.00 0.00 C ATOM 1287 O SER P 379 8.623 -3.094 6.261 1.00 0.00 O ATOM 1288 CB SER P 379 7.428 -5.942 4.803 1.00 0.00 C ATOM 1289 OG SER P 379 6.818 -7.211 4.948 1.00 0.00 O ATOM 0 H SER P 379 5.843 -4.067 5.373 1.00 0.00 H new ATOM 0 HA SER P 379 7.456 -5.897 6.957 1.00 0.00 H new ATOM 0 HB2 SER P 379 6.890 -5.360 4.055 1.00 0.00 H new ATOM 0 HB3 SER P 379 8.448 -6.065 4.439 1.00 0.00 H new ATOM 0 HG SER P 379 5.894 -7.169 4.623 1.00 0.00 H new ATOM 1295 N GLU P 380 9.858 -4.976 6.251 1.00 0.00 N ATOM 1296 CA GLU P 380 11.134 -4.273 6.332 1.00 0.00 C ATOM 1297 C GLU P 380 11.403 -3.472 5.062 1.00 0.00 C ATOM 1298 O GLU P 380 11.902 -2.348 5.121 1.00 0.00 O ATOM 1299 CB GLU P 380 12.273 -5.268 6.572 1.00 0.00 C ATOM 1300 CG GLU P 380 13.356 -4.741 7.499 1.00 0.00 C ATOM 1301 CD GLU P 380 13.998 -5.837 8.325 1.00 0.00 C ATOM 1302 OE1 GLU P 380 13.354 -6.315 9.282 1.00 0.00 O ATOM 1303 OE2 GLU P 380 15.147 -6.218 8.015 1.00 0.00 O ATOM 0 H GLU P 380 9.938 -5.992 6.220 1.00 0.00 H new ATOM 0 HA GLU P 380 11.082 -3.578 7.170 1.00 0.00 H new ATOM 0 HB2 GLU P 380 11.861 -6.185 6.993 1.00 0.00 H new ATOM 0 HB3 GLU P 380 12.722 -5.531 5.614 1.00 0.00 H new ATOM 0 HG2 GLU P 380 14.123 -4.240 6.908 1.00 0.00 H new ATOM 0 HG3 GLU P 380 12.927 -3.993 8.165 1.00 0.00 H new ATOM 1310 N SER P 381 11.072 -4.056 3.915 1.00 0.00 N ATOM 1311 CA SER P 381 11.281 -3.394 2.631 1.00 0.00 C ATOM 1312 C SER P 381 10.616 -2.020 2.609 1.00 0.00 C ATOM 1313 O SER P 381 11.293 -0.994 2.548 1.00 0.00 O ATOM 1314 CB SER P 381 10.731 -4.258 1.495 1.00 0.00 C ATOM 1315 OG SER P 381 11.042 -3.697 0.230 1.00 0.00 O ATOM 0 H SER P 381 10.658 -4.986 3.848 1.00 0.00 H new ATOM 0 HA SER P 381 12.353 -3.259 2.491 1.00 0.00 H new ATOM 0 HB2 SER P 381 11.148 -5.263 1.563 1.00 0.00 H new ATOM 0 HB3 SER P 381 9.650 -4.354 1.598 1.00 0.00 H new ATOM 0 HG SER P 381 11.290 -4.412 -0.393 1.00 0.00 H new ATOM 1321 N THR P 382 9.289 -2.006 2.669 1.00 0.00 N ATOM 1322 CA THR P 382 8.535 -0.756 2.666 1.00 0.00 C ATOM 1323 C THR P 382 8.938 0.119 3.852 1.00 0.00 C ATOM 1324 O THR P 382 8.742 1.334 3.835 1.00 0.00 O ATOM 1325 CB THR P 382 7.030 -1.043 2.711 1.00 0.00 C ATOM 1326 OG1 THR P 382 6.607 -1.682 1.520 1.00 0.00 O ATOM 1327 CG2 THR P 382 6.181 0.199 2.890 1.00 0.00 C ATOM 0 H THR P 382 8.712 -2.846 2.720 1.00 0.00 H new ATOM 0 HA THR P 382 8.765 -0.219 1.746 1.00 0.00 H new ATOM 0 HB THR P 382 6.888 -1.685 3.580 1.00 0.00 H new ATOM 0 HG1 THR P 382 5.692 -2.015 1.635 1.00 0.00 H new ATOM 0 HG21 THR P 382 5.128 -0.080 2.913 1.00 0.00 H new ATOM 0 HG22 THR P 382 6.447 0.690 3.826 1.00 0.00 H new ATOM 0 HG23 THR P 382 6.357 0.883 2.060 1.00 0.00 H new ATOM 1335 N LYS P 383 9.497 -0.511 4.880 1.00 0.00 N ATOM 1336 CA LYS P 383 9.923 0.201 6.076 1.00 0.00 C ATOM 1337 C LYS P 383 11.180 1.027 5.812 1.00 0.00 C ATOM 1338 O LYS P 383 11.221 2.223 6.102 1.00 0.00 O ATOM 1339 CB LYS P 383 10.189 -0.790 7.208 1.00 0.00 C ATOM 1340 CG LYS P 383 8.968 -1.064 8.062 1.00 0.00 C ATOM 1341 CD LYS P 383 9.134 -2.324 8.897 1.00 0.00 C ATOM 1342 CE LYS P 383 10.070 -2.092 10.071 1.00 0.00 C ATOM 1343 NZ LYS P 383 10.103 -3.261 10.995 1.00 0.00 N ATOM 0 H LYS P 383 9.665 -1.517 4.907 1.00 0.00 H new ATOM 0 HA LYS P 383 9.121 0.880 6.365 1.00 0.00 H new ATOM 0 HB2 LYS P 383 10.546 -1.729 6.784 1.00 0.00 H new ATOM 0 HB3 LYS P 383 10.987 -0.403 7.841 1.00 0.00 H new ATOM 0 HG2 LYS P 383 8.786 -0.214 8.719 1.00 0.00 H new ATOM 0 HG3 LYS P 383 8.092 -1.165 7.422 1.00 0.00 H new ATOM 0 HD2 LYS P 383 8.161 -2.650 9.264 1.00 0.00 H new ATOM 0 HD3 LYS P 383 9.524 -3.128 8.272 1.00 0.00 H new ATOM 0 HE2 LYS P 383 11.076 -1.894 9.700 1.00 0.00 H new ATOM 0 HE3 LYS P 383 9.752 -1.205 10.619 1.00 0.00 H new ATOM 0 HZ1 LYS P 383 10.753 -3.063 11.782 1.00 0.00 H new ATOM 0 HZ2 LYS P 383 9.148 -3.435 11.369 1.00 0.00 H new ATOM 0 HZ3 LYS P 383 10.431 -4.102 10.479 1.00 0.00 H new ATOM 1357 N ARG P 384 12.205 0.379 5.265 1.00 0.00 N ATOM 1358 CA ARG P 384 13.469 1.050 4.966 1.00 0.00 C ATOM 1359 C ARG P 384 13.236 2.362 4.220 1.00 0.00 C ATOM 1360 O ARG P 384 14.036 3.294 4.319 1.00 0.00 O ATOM 1361 CB ARG P 384 14.369 0.133 4.135 1.00 0.00 C ATOM 1362 CG ARG P 384 15.112 -0.900 4.966 1.00 0.00 C ATOM 1363 CD ARG P 384 16.416 -1.319 4.300 1.00 0.00 C ATOM 1364 NE ARG P 384 16.289 -2.595 3.604 1.00 0.00 N ATOM 1365 CZ ARG P 384 16.249 -3.775 4.219 1.00 0.00 C ATOM 1366 NH1 ARG P 384 16.322 -3.843 5.544 1.00 0.00 N ATOM 1367 NH2 ARG P 384 16.132 -4.889 3.510 1.00 0.00 N ATOM 0 H ARG P 384 12.186 -0.611 5.019 1.00 0.00 H new ATOM 0 HA ARG P 384 13.960 1.278 5.912 1.00 0.00 H new ATOM 0 HB2 ARG P 384 13.762 -0.380 3.389 1.00 0.00 H new ATOM 0 HB3 ARG P 384 15.093 0.741 3.593 1.00 0.00 H new ATOM 0 HG2 ARG P 384 15.322 -0.491 5.954 1.00 0.00 H new ATOM 0 HG3 ARG P 384 14.479 -1.775 5.111 1.00 0.00 H new ATOM 0 HD2 ARG P 384 16.725 -0.550 3.593 1.00 0.00 H new ATOM 0 HD3 ARG P 384 17.200 -1.393 5.053 1.00 0.00 H new ATOM 0 HE ARG P 384 16.227 -2.582 2.586 1.00 0.00 H new ATOM 0 HH11 ARG P 384 16.409 -2.989 6.094 1.00 0.00 H new ATOM 0 HH12 ARG P 384 16.291 -4.749 6.011 1.00 0.00 H new ATOM 0 HH21 ARG P 384 16.073 -4.842 2.493 1.00 0.00 H new ATOM 0 HH22 ARG P 384 16.101 -5.793 3.982 1.00 0.00 H new ATOM 1381 N LYS P 385 12.138 2.429 3.478 1.00 0.00 N ATOM 1382 CA LYS P 385 11.798 3.627 2.718 1.00 0.00 C ATOM 1383 C LYS P 385 11.438 4.779 3.653 1.00 0.00 C ATOM 1384 O LYS P 385 11.633 5.946 3.319 1.00 0.00 O ATOM 1385 CB LYS P 385 10.634 3.340 1.766 1.00 0.00 C ATOM 1386 CG LYS P 385 10.688 1.955 1.137 1.00 0.00 C ATOM 1387 CD LYS P 385 10.551 2.015 -0.374 1.00 0.00 C ATOM 1388 CE LYS P 385 10.144 0.670 -0.952 1.00 0.00 C ATOM 1389 NZ LYS P 385 10.750 0.433 -2.292 1.00 0.00 N ATOM 0 H LYS P 385 11.466 1.667 3.386 1.00 0.00 H new ATOM 0 HA LYS P 385 12.671 3.918 2.133 1.00 0.00 H new ATOM 0 HB2 LYS P 385 9.696 3.446 2.310 1.00 0.00 H new ATOM 0 HB3 LYS P 385 10.630 4.089 0.974 1.00 0.00 H new ATOM 0 HG2 LYS P 385 11.631 1.474 1.397 1.00 0.00 H new ATOM 0 HG3 LYS P 385 9.891 1.337 1.550 1.00 0.00 H new ATOM 0 HD2 LYS P 385 9.809 2.767 -0.643 1.00 0.00 H new ATOM 0 HD3 LYS P 385 11.498 2.329 -0.814 1.00 0.00 H new ATOM 0 HE2 LYS P 385 10.448 -0.125 -0.271 1.00 0.00 H new ATOM 0 HE3 LYS P 385 9.058 0.623 -1.032 1.00 0.00 H new ATOM 0 HZ1 LYS P 385 10.447 -0.495 -2.651 1.00 0.00 H new ATOM 0 HZ2 LYS P 385 10.440 1.176 -2.950 1.00 0.00 H new ATOM 0 HZ3 LYS P 385 11.787 0.452 -2.212 1.00 0.00 H new ATOM 1403 N LEU P 386 10.914 4.439 4.827 1.00 0.00 N ATOM 1404 CA LEU P 386 10.532 5.443 5.816 1.00 0.00 C ATOM 1405 C LEU P 386 11.354 5.284 7.092 1.00 0.00 C ATOM 1406 O LEU P 386 12.261 4.454 7.158 1.00 0.00 O ATOM 1407 CB LEU P 386 9.036 5.340 6.144 1.00 0.00 C ATOM 1408 CG LEU P 386 8.432 3.940 6.018 1.00 0.00 C ATOM 1409 CD1 LEU P 386 7.434 3.687 7.133 1.00 0.00 C ATOM 1410 CD2 LEU P 386 7.761 3.766 4.666 1.00 0.00 C ATOM 0 H LEU P 386 10.744 3.476 5.117 1.00 0.00 H new ATOM 0 HA LEU P 386 10.732 6.426 5.390 1.00 0.00 H new ATOM 0 HB2 LEU P 386 8.879 5.695 7.163 1.00 0.00 H new ATOM 0 HB3 LEU P 386 8.489 6.014 5.484 1.00 0.00 H new ATOM 0 HG LEU P 386 9.240 3.213 6.101 1.00 0.00 H new ATOM 0 HD11 LEU P 386 7.015 2.686 7.026 1.00 0.00 H new ATOM 0 HD12 LEU P 386 7.937 3.769 8.097 1.00 0.00 H new ATOM 0 HD13 LEU P 386 6.632 4.424 7.078 1.00 0.00 H new ATOM 0 HD21 LEU P 386 7.338 2.764 4.596 1.00 0.00 H new ATOM 0 HD22 LEU P 386 6.966 4.504 4.557 1.00 0.00 H new ATOM 0 HD23 LEU P 386 8.497 3.905 3.874 1.00 0.00 H new