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 499 SER OG : rot 180:sc= 0 USER MOD Set 1.2: S 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 360 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 362 GLN : amide:sc= -0.938 K(o=-0.94,f=-3.1!) USER MOD Single : P 370 SER OG : rot 180:sc= 0.00802 USER MOD Single : P 376 ASN : amide:sc= -0.206 K(o=-0.21,f=-2.4!) USER MOD Single : P 378 CYS SG : rot 82:sc= -8.26! USER MOD Single : P 379 SER OG : rot 180:sc= 0 USER MOD Single : P 381 SER OG : rot 180:sc= 0 USER MOD Single : P 382 THR OG1 : rot 139:sc= -4.86! USER MOD Single : P 383 LYS NZ :NH3+ -142:sc= 0.924 (180deg=-0.221) USER MOD Single : P 385 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0254) USER MOD Single : S 460 SER OG : rot 180:sc= 0 USER MOD Single : S 461 GLN : amide:sc= -0.037 X(o=-0.037,f=-0.18) USER MOD Single : S 467 SER OG : rot 100:sc= -0.312 USER MOD Single : S 468 TYR OH : rot -89:sc= 0.941 USER MOD Single : S 471 THR OG1 : rot 180:sc= 0.0373 USER MOD Single : S 472 GLN : amide:sc= -3.32 K(o=-3.3,f=-5.5!) USER MOD Single : S 479 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : S 488 SER OG : rot 180:sc= 0 USER MOD Single : S 489 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 491 ASN : amide:sc= -9.51! C(o=-9.5!,f=-19!) USER MOD Single : S 502 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 508 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0122) USER MOD ----------------------------------------------------------------- ATOM 90 N SER S 460 -4.209 -9.931 2.607 1.00 0.00 N ATOM 91 CA SER S 460 -5.236 -10.192 1.610 1.00 0.00 C ATOM 92 C SER S 460 -4.959 -9.415 0.326 1.00 0.00 C ATOM 93 O SER S 460 -3.858 -8.902 0.130 1.00 0.00 O ATOM 94 CB SER S 460 -6.603 -9.816 2.174 1.00 0.00 C ATOM 95 OG SER S 460 -7.530 -10.879 2.023 1.00 0.00 O ATOM 0 HA SER S 460 -5.226 -11.255 1.367 1.00 0.00 H new ATOM 0 HB2 SER S 460 -6.506 -9.561 3.229 1.00 0.00 H new ATOM 0 HB3 SER S 460 -6.978 -8.928 1.665 1.00 0.00 H new ATOM 0 HG SER S 460 -8.397 -10.612 2.394 1.00 0.00 H new ATOM 101 N GLN S 461 -5.957 -9.332 -0.550 1.00 0.00 N ATOM 102 CA GLN S 461 -5.801 -8.617 -1.813 1.00 0.00 C ATOM 103 C GLN S 461 -7.061 -7.835 -2.168 1.00 0.00 C ATOM 104 O GLN S 461 -8.143 -8.103 -1.643 1.00 0.00 O ATOM 105 CB GLN S 461 -5.470 -9.593 -2.944 1.00 0.00 C ATOM 106 CG GLN S 461 -4.201 -10.398 -2.710 1.00 0.00 C ATOM 107 CD GLN S 461 -4.386 -11.876 -2.994 1.00 0.00 C ATOM 108 OE1 GLN S 461 -5.342 -12.494 -2.525 1.00 0.00 O ATOM 109 NE2 GLN S 461 -3.469 -12.451 -3.765 1.00 0.00 N ATOM 0 H GLN S 461 -6.877 -9.749 -0.410 1.00 0.00 H new ATOM 0 HA GLN S 461 -4.979 -7.912 -1.691 1.00 0.00 H new ATOM 0 HB2 GLN S 461 -6.306 -10.280 -3.074 1.00 0.00 H new ATOM 0 HB3 GLN S 461 -5.368 -9.035 -3.875 1.00 0.00 H new ATOM 0 HG2 GLN S 461 -3.405 -10.007 -3.344 1.00 0.00 H new ATOM 0 HG3 GLN S 461 -3.878 -10.268 -1.677 1.00 0.00 H new ATOM 0 HE21 GLN S 461 -2.693 -11.900 -4.132 1.00 0.00 H new ATOM 0 HE22 GLN S 461 -3.541 -13.443 -3.990 1.00 0.00 H new ATOM 118 N VAL S 462 -6.910 -6.865 -3.064 1.00 0.00 N ATOM 119 CA VAL S 462 -8.029 -6.035 -3.498 1.00 0.00 C ATOM 120 C VAL S 462 -7.728 -5.352 -4.827 1.00 0.00 C ATOM 121 O VAL S 462 -6.839 -4.505 -4.907 1.00 0.00 O ATOM 122 CB VAL S 462 -8.362 -4.952 -2.458 1.00 0.00 C ATOM 123 CG1 VAL S 462 -9.156 -5.538 -1.304 1.00 0.00 C ATOM 124 CG2 VAL S 462 -7.088 -4.283 -1.962 1.00 0.00 C ATOM 0 H VAL S 462 -6.020 -6.634 -3.505 1.00 0.00 H new ATOM 0 HA VAL S 462 -8.883 -6.702 -3.614 1.00 0.00 H new ATOM 0 HB VAL S 462 -8.981 -4.193 -2.936 1.00 0.00 H new ATOM 0 HG11 VAL S 462 -9.380 -4.754 -0.581 1.00 0.00 H new ATOM 0 HG12 VAL S 462 -10.087 -5.961 -1.681 1.00 0.00 H new ATOM 0 HG13 VAL S 462 -8.571 -6.321 -0.821 1.00 0.00 H new ATOM 0 HG21 VAL S 462 -7.341 -3.519 -1.227 1.00 0.00 H new ATOM 0 HG22 VAL S 462 -6.440 -5.029 -1.502 1.00 0.00 H new ATOM 0 HG23 VAL S 462 -6.569 -3.821 -2.802 1.00 0.00 H new ATOM 134 N GLU S 463 -8.474 -5.712 -5.869 1.00 0.00 N ATOM 135 CA GLU S 463 -8.278 -5.115 -7.184 1.00 0.00 C ATOM 136 C GLU S 463 -8.227 -3.593 -7.085 1.00 0.00 C ATOM 137 O GLU S 463 -8.872 -2.998 -6.221 1.00 0.00 O ATOM 138 CB GLU S 463 -9.394 -5.543 -8.134 1.00 0.00 C ATOM 139 CG GLU S 463 -8.943 -6.565 -9.158 1.00 0.00 C ATOM 140 CD GLU S 463 -9.996 -6.839 -10.215 1.00 0.00 C ATOM 141 OE1 GLU S 463 -10.011 -6.122 -11.237 1.00 0.00 O ATOM 142 OE2 GLU S 463 -10.806 -7.770 -10.020 1.00 0.00 O ATOM 0 H GLU S 463 -9.216 -6.411 -5.827 1.00 0.00 H new ATOM 0 HA GLU S 463 -7.325 -5.467 -7.579 1.00 0.00 H new ATOM 0 HB2 GLU S 463 -10.218 -5.958 -7.554 1.00 0.00 H new ATOM 0 HB3 GLU S 463 -9.779 -4.665 -8.651 1.00 0.00 H new ATOM 0 HG2 GLU S 463 -8.032 -6.211 -9.641 1.00 0.00 H new ATOM 0 HG3 GLU S 463 -8.693 -7.496 -8.650 1.00 0.00 H new ATOM 149 N ALA S 464 -7.457 -2.970 -7.968 1.00 0.00 N ATOM 150 CA ALA S 464 -7.327 -1.520 -7.968 1.00 0.00 C ATOM 151 C ALA S 464 -8.373 -0.879 -8.869 1.00 0.00 C ATOM 152 O ALA S 464 -9.148 -1.573 -9.526 1.00 0.00 O ATOM 153 CB ALA S 464 -5.927 -1.113 -8.404 1.00 0.00 C ATOM 0 H ALA S 464 -6.915 -3.444 -8.690 1.00 0.00 H new ATOM 0 HA ALA S 464 -7.493 -1.164 -6.951 1.00 0.00 H new ATOM 0 HB1 ALA S 464 -5.846 -0.026 -8.399 1.00 0.00 H new ATOM 0 HB2 ALA S 464 -5.195 -1.535 -7.716 1.00 0.00 H new ATOM 0 HB3 ALA S 464 -5.736 -1.486 -9.410 1.00 0.00 H new ATOM 159 N LEU S 465 -8.398 0.446 -8.886 1.00 0.00 N ATOM 160 CA LEU S 465 -9.361 1.179 -9.701 1.00 0.00 C ATOM 161 C LEU S 465 -8.767 2.462 -10.288 1.00 0.00 C ATOM 162 O LEU S 465 -9.421 3.146 -11.074 1.00 0.00 O ATOM 163 CB LEU S 465 -10.591 1.521 -8.866 1.00 0.00 C ATOM 164 CG LEU S 465 -11.311 0.316 -8.258 1.00 0.00 C ATOM 165 CD1 LEU S 465 -10.587 -0.168 -7.012 1.00 0.00 C ATOM 166 CD2 LEU S 465 -12.757 0.667 -7.939 1.00 0.00 C ATOM 0 H LEU S 465 -7.765 1.036 -8.347 1.00 0.00 H new ATOM 0 HA LEU S 465 -9.640 0.534 -10.534 1.00 0.00 H new ATOM 0 HB2 LEU S 465 -10.291 2.191 -8.060 1.00 0.00 H new ATOM 0 HB3 LEU S 465 -11.296 2.070 -9.491 1.00 0.00 H new ATOM 0 HG LEU S 465 -11.307 -0.493 -8.988 1.00 0.00 H new ATOM 0 HD11 LEU S 465 -11.115 -1.025 -6.595 1.00 0.00 H new ATOM 0 HD12 LEU S 465 -9.570 -0.460 -7.273 1.00 0.00 H new ATOM 0 HD13 LEU S 465 -10.557 0.634 -6.274 1.00 0.00 H new ATOM 0 HD21 LEU S 465 -13.255 -0.201 -7.507 1.00 0.00 H new ATOM 0 HD22 LEU S 465 -12.783 1.492 -7.227 1.00 0.00 H new ATOM 0 HD23 LEU S 465 -13.270 0.962 -8.854 1.00 0.00 H new ATOM 178 N PHE S 466 -7.539 2.796 -9.901 1.00 0.00 N ATOM 179 CA PHE S 466 -6.893 4.004 -10.396 1.00 0.00 C ATOM 180 C PHE S 466 -5.382 3.841 -10.474 1.00 0.00 C ATOM 181 O PHE S 466 -4.815 2.896 -9.928 1.00 0.00 O ATOM 182 CB PHE S 466 -7.203 5.182 -9.477 1.00 0.00 C ATOM 183 CG PHE S 466 -8.655 5.344 -9.151 1.00 0.00 C ATOM 184 CD1 PHE S 466 -9.500 6.002 -10.026 1.00 0.00 C ATOM 185 CD2 PHE S 466 -9.173 4.850 -7.964 1.00 0.00 C ATOM 186 CE1 PHE S 466 -10.836 6.166 -9.726 1.00 0.00 C ATOM 187 CE2 PHE S 466 -10.509 5.014 -7.656 1.00 0.00 C ATOM 188 CZ PHE S 466 -11.340 5.675 -8.540 1.00 0.00 C ATOM 0 H PHE S 466 -6.975 2.250 -9.250 1.00 0.00 H new ATOM 0 HA PHE S 466 -7.282 4.189 -11.397 1.00 0.00 H new ATOM 0 HB2 PHE S 466 -6.646 5.060 -8.548 1.00 0.00 H new ATOM 0 HB3 PHE S 466 -6.844 6.098 -9.946 1.00 0.00 H new ATOM 0 HD1 PHE S 466 -9.109 6.392 -10.954 1.00 0.00 H new ATOM 0 HD2 PHE S 466 -8.525 4.331 -7.273 1.00 0.00 H new ATOM 0 HE1 PHE S 466 -11.487 6.678 -10.419 1.00 0.00 H new ATOM 0 HE2 PHE S 466 -10.903 4.627 -6.728 1.00 0.00 H new ATOM 0 HZ PHE S 466 -12.385 5.807 -8.302 1.00 0.00 H new ATOM 198 N SER S 467 -4.738 4.799 -11.129 1.00 0.00 N ATOM 199 CA SER S 467 -3.291 4.806 -11.253 1.00 0.00 C ATOM 200 C SER S 467 -2.716 5.815 -10.271 1.00 0.00 C ATOM 201 O SER S 467 -2.789 7.024 -10.491 1.00 0.00 O ATOM 202 CB SER S 467 -2.870 5.153 -12.683 1.00 0.00 C ATOM 203 OG SER S 467 -3.224 4.120 -13.585 1.00 0.00 O ATOM 0 H SER S 467 -5.202 5.585 -11.585 1.00 0.00 H new ATOM 0 HA SER S 467 -2.906 3.812 -11.025 1.00 0.00 H new ATOM 0 HB2 SER S 467 -3.345 6.085 -12.989 1.00 0.00 H new ATOM 0 HB3 SER S 467 -1.793 5.317 -12.718 1.00 0.00 H new ATOM 0 HG SER S 467 -4.049 4.364 -14.054 1.00 0.00 H new ATOM 209 N TYR S 468 -2.179 5.312 -9.170 1.00 0.00 N ATOM 210 CA TYR S 468 -1.629 6.167 -8.128 1.00 0.00 C ATOM 211 C TYR S 468 -0.237 6.674 -8.483 1.00 0.00 C ATOM 212 O TYR S 468 0.717 5.900 -8.561 1.00 0.00 O ATOM 213 CB TYR S 468 -1.585 5.402 -6.804 1.00 0.00 C ATOM 214 CG TYR S 468 -0.961 6.170 -5.654 1.00 0.00 C ATOM 215 CD1 TYR S 468 -0.794 7.549 -5.715 1.00 0.00 C ATOM 216 CD2 TYR S 468 -0.539 5.510 -4.509 1.00 0.00 C ATOM 217 CE1 TYR S 468 -0.222 8.244 -4.667 1.00 0.00 C ATOM 218 CE2 TYR S 468 0.031 6.198 -3.457 1.00 0.00 C ATOM 219 CZ TYR S 468 0.188 7.565 -3.540 1.00 0.00 C ATOM 220 OH TYR S 468 0.754 8.254 -2.494 1.00 0.00 O ATOM 0 H TYR S 468 -2.112 4.313 -8.974 1.00 0.00 H new ATOM 0 HA TYR S 468 -2.280 7.036 -8.032 1.00 0.00 H new ATOM 0 HB2 TYR S 468 -2.601 5.121 -6.527 1.00 0.00 H new ATOM 0 HB3 TYR S 468 -1.027 4.477 -6.952 1.00 0.00 H new ATOM 0 HD1 TYR S 468 -1.116 8.085 -6.595 1.00 0.00 H new ATOM 0 HD2 TYR S 468 -0.659 4.439 -4.440 1.00 0.00 H new ATOM 0 HE1 TYR S 468 -0.097 9.315 -4.731 1.00 0.00 H new ATOM 0 HE2 TYR S 468 0.353 5.668 -2.573 1.00 0.00 H new ATOM 0 HH TYR S 468 1.723 8.313 -2.627 1.00 0.00 H new ATOM 230 N GLU S 469 -0.125 7.986 -8.670 1.00 0.00 N ATOM 231 CA GLU S 469 1.154 8.604 -8.981 1.00 0.00 C ATOM 232 C GLU S 469 2.037 8.586 -7.743 1.00 0.00 C ATOM 233 O GLU S 469 1.764 9.278 -6.762 1.00 0.00 O ATOM 234 CB GLU S 469 0.956 10.040 -9.468 1.00 0.00 C ATOM 235 CG GLU S 469 1.926 10.447 -10.566 1.00 0.00 C ATOM 236 CD GLU S 469 1.379 11.557 -11.443 1.00 0.00 C ATOM 237 OE1 GLU S 469 0.655 11.246 -12.412 1.00 0.00 O ATOM 238 OE2 GLU S 469 1.677 12.737 -11.161 1.00 0.00 O ATOM 0 H GLU S 469 -0.906 8.639 -8.611 1.00 0.00 H new ATOM 0 HA GLU S 469 1.636 8.039 -9.779 1.00 0.00 H new ATOM 0 HB2 GLU S 469 -0.064 10.153 -9.835 1.00 0.00 H new ATOM 0 HB3 GLU S 469 1.069 10.720 -8.624 1.00 0.00 H new ATOM 0 HG2 GLU S 469 2.863 10.773 -10.115 1.00 0.00 H new ATOM 0 HG3 GLU S 469 2.154 9.579 -11.184 1.00 0.00 H new ATOM 245 N ALA S 470 3.081 7.774 -7.785 1.00 0.00 N ATOM 246 CA ALA S 470 3.991 7.641 -6.656 1.00 0.00 C ATOM 247 C ALA S 470 5.113 8.670 -6.714 1.00 0.00 C ATOM 248 O ALA S 470 5.990 8.603 -7.577 1.00 0.00 O ATOM 249 CB ALA S 470 4.554 6.231 -6.606 1.00 0.00 C ATOM 0 H ALA S 470 3.321 7.195 -8.590 1.00 0.00 H new ATOM 0 HA ALA S 470 3.427 7.830 -5.743 1.00 0.00 H new ATOM 0 HB1 ALA S 470 5.234 6.140 -5.759 1.00 0.00 H new ATOM 0 HB2 ALA S 470 3.738 5.517 -6.495 1.00 0.00 H new ATOM 0 HB3 ALA S 470 5.095 6.022 -7.529 1.00 0.00 H new ATOM 255 N THR S 471 5.079 9.618 -5.783 1.00 0.00 N ATOM 256 CA THR S 471 6.095 10.662 -5.714 1.00 0.00 C ATOM 257 C THR S 471 7.127 10.333 -4.642 1.00 0.00 C ATOM 258 O THR S 471 8.296 10.703 -4.756 1.00 0.00 O ATOM 259 CB THR S 471 5.446 12.015 -5.419 1.00 0.00 C ATOM 260 OG1 THR S 471 4.279 11.853 -4.634 1.00 0.00 O ATOM 261 CG2 THR S 471 5.058 12.777 -6.668 1.00 0.00 C ATOM 0 H THR S 471 4.358 9.685 -5.065 1.00 0.00 H new ATOM 0 HA THR S 471 6.599 10.715 -6.679 1.00 0.00 H new ATOM 0 HB THR S 471 6.204 12.587 -4.884 1.00 0.00 H new ATOM 0 HG1 THR S 471 3.881 12.730 -4.455 1.00 0.00 H new ATOM 0 HG21 THR S 471 4.603 13.727 -6.388 1.00 0.00 H new ATOM 0 HG22 THR S 471 5.947 12.964 -7.271 1.00 0.00 H new ATOM 0 HG23 THR S 471 4.344 12.190 -7.246 1.00 0.00 H new ATOM 269 N GLN S 472 6.689 9.628 -3.603 1.00 0.00 N ATOM 270 CA GLN S 472 7.577 9.240 -2.513 1.00 0.00 C ATOM 271 C GLN S 472 7.939 7.759 -2.617 1.00 0.00 C ATOM 272 O GLN S 472 7.222 6.977 -3.241 1.00 0.00 O ATOM 273 CB GLN S 472 6.937 9.544 -1.153 1.00 0.00 C ATOM 274 CG GLN S 472 5.537 8.980 -0.987 1.00 0.00 C ATOM 275 CD GLN S 472 4.787 9.621 0.165 1.00 0.00 C ATOM 276 OE1 GLN S 472 3.658 10.083 0.004 1.00 0.00 O ATOM 277 NE2 GLN S 472 5.415 9.653 1.335 1.00 0.00 N ATOM 0 H GLN S 472 5.725 9.314 -3.493 1.00 0.00 H new ATOM 0 HA GLN S 472 8.493 9.826 -2.596 1.00 0.00 H new ATOM 0 HB2 GLN S 472 7.575 9.142 -0.365 1.00 0.00 H new ATOM 0 HB3 GLN S 472 6.901 10.624 -1.014 1.00 0.00 H new ATOM 0 HG2 GLN S 472 4.976 9.130 -1.910 1.00 0.00 H new ATOM 0 HG3 GLN S 472 5.599 7.904 -0.823 1.00 0.00 H new ATOM 0 HE21 GLN S 472 6.351 9.258 1.422 1.00 0.00 H new ATOM 0 HE22 GLN S 472 4.961 10.073 2.146 1.00 0.00 H new ATOM 286 N PRO S 473 9.075 7.361 -2.022 1.00 0.00 N ATOM 287 CA PRO S 473 9.558 5.972 -2.063 1.00 0.00 C ATOM 288 C PRO S 473 8.564 4.954 -1.494 1.00 0.00 C ATOM 289 O PRO S 473 7.942 4.204 -2.247 1.00 0.00 O ATOM 290 CB PRO S 473 10.840 6.010 -1.218 1.00 0.00 C ATOM 291 CG PRO S 473 10.755 7.268 -0.425 1.00 0.00 C ATOM 292 CD PRO S 473 9.997 8.236 -1.281 1.00 0.00 C ATOM 0 HA PRO S 473 9.712 5.642 -3.090 1.00 0.00 H new ATOM 0 HB2 PRO S 473 10.907 5.139 -0.566 1.00 0.00 H new ATOM 0 HB3 PRO S 473 11.728 6.004 -1.851 1.00 0.00 H new ATOM 0 HG2 PRO S 473 10.244 7.100 0.523 1.00 0.00 H new ATOM 0 HG3 PRO S 473 11.748 7.649 -0.188 1.00 0.00 H new ATOM 0 HD2 PRO S 473 9.462 8.973 -0.682 1.00 0.00 H new ATOM 0 HD3 PRO S 473 10.657 8.788 -1.950 1.00 0.00 H new ATOM 300 N GLU S 474 8.438 4.909 -0.165 1.00 0.00 N ATOM 301 CA GLU S 474 7.537 3.958 0.500 1.00 0.00 C ATOM 302 C GLU S 474 6.212 3.791 -0.247 1.00 0.00 C ATOM 303 O GLU S 474 5.657 2.694 -0.299 1.00 0.00 O ATOM 304 CB GLU S 474 7.272 4.383 1.947 1.00 0.00 C ATOM 305 CG GLU S 474 6.323 5.562 2.088 1.00 0.00 C ATOM 306 CD GLU S 474 6.967 6.880 1.704 1.00 0.00 C ATOM 307 OE1 GLU S 474 7.219 7.088 0.500 1.00 0.00 O ATOM 308 OE2 GLU S 474 7.220 7.703 2.609 1.00 0.00 O ATOM 0 H GLU S 474 8.948 5.519 0.474 1.00 0.00 H new ATOM 0 HA GLU S 474 8.041 2.992 0.495 1.00 0.00 H new ATOM 0 HB2 GLU S 474 6.862 3.534 2.494 1.00 0.00 H new ATOM 0 HB3 GLU S 474 8.221 4.637 2.419 1.00 0.00 H new ATOM 0 HG2 GLU S 474 5.446 5.395 1.462 1.00 0.00 H new ATOM 0 HG3 GLU S 474 5.973 5.620 3.119 1.00 0.00 H new ATOM 315 N ASP S 475 5.710 4.880 -0.824 1.00 0.00 N ATOM 316 CA ASP S 475 4.456 4.841 -1.561 1.00 0.00 C ATOM 317 C ASP S 475 4.513 3.830 -2.700 1.00 0.00 C ATOM 318 O ASP S 475 5.300 3.973 -3.636 1.00 0.00 O ATOM 319 CB ASP S 475 4.130 6.228 -2.109 1.00 0.00 C ATOM 320 CG ASP S 475 3.297 7.051 -1.146 1.00 0.00 C ATOM 321 OD1 ASP S 475 2.963 6.536 -0.057 1.00 0.00 O ATOM 322 OD2 ASP S 475 2.978 8.212 -1.479 1.00 0.00 O ATOM 0 H ASP S 475 6.154 5.798 -0.794 1.00 0.00 H new ATOM 0 HA ASP S 475 3.670 4.529 -0.873 1.00 0.00 H new ATOM 0 HB2 ASP S 475 5.058 6.757 -2.325 1.00 0.00 H new ATOM 0 HB3 ASP S 475 3.594 6.126 -3.052 1.00 0.00 H new ATOM 327 N LEU S 476 3.663 2.814 -2.615 1.00 0.00 N ATOM 328 CA LEU S 476 3.597 1.781 -3.639 1.00 0.00 C ATOM 329 C LEU S 476 2.792 2.287 -4.831 1.00 0.00 C ATOM 330 O LEU S 476 1.597 2.549 -4.716 1.00 0.00 O ATOM 331 CB LEU S 476 2.967 0.500 -3.070 1.00 0.00 C ATOM 332 CG LEU S 476 2.465 -0.507 -4.111 1.00 0.00 C ATOM 333 CD1 LEU S 476 3.611 -1.000 -4.980 1.00 0.00 C ATOM 334 CD2 LEU S 476 1.766 -1.675 -3.442 1.00 0.00 C ATOM 0 H LEU S 476 3.008 2.684 -1.844 1.00 0.00 H new ATOM 0 HA LEU S 476 4.609 1.546 -3.970 1.00 0.00 H new ATOM 0 HB2 LEU S 476 3.703 0.005 -2.436 1.00 0.00 H new ATOM 0 HB3 LEU S 476 2.131 0.781 -2.429 1.00 0.00 H new ATOM 0 HG LEU S 476 1.743 0.002 -4.749 1.00 0.00 H new ATOM 0 HD11 LEU S 476 3.232 -1.714 -5.712 1.00 0.00 H new ATOM 0 HD12 LEU S 476 4.064 -0.155 -5.498 1.00 0.00 H new ATOM 0 HD13 LEU S 476 4.360 -1.485 -4.354 1.00 0.00 H new ATOM 0 HD21 LEU S 476 1.419 -2.375 -4.202 1.00 0.00 H new ATOM 0 HD22 LEU S 476 2.462 -2.181 -2.773 1.00 0.00 H new ATOM 0 HD23 LEU S 476 0.914 -1.309 -2.869 1.00 0.00 H new ATOM 346 N GLU S 477 3.462 2.438 -5.967 1.00 0.00 N ATOM 347 CA GLU S 477 2.813 2.928 -7.176 1.00 0.00 C ATOM 348 C GLU S 477 2.115 1.800 -7.924 1.00 0.00 C ATOM 349 O GLU S 477 2.640 0.690 -8.023 1.00 0.00 O ATOM 350 CB GLU S 477 3.841 3.580 -8.099 1.00 0.00 C ATOM 351 CG GLU S 477 3.275 4.716 -8.932 1.00 0.00 C ATOM 352 CD GLU S 477 4.323 5.376 -9.807 1.00 0.00 C ATOM 353 OE1 GLU S 477 5.327 4.709 -10.135 1.00 0.00 O ATOM 354 OE2 GLU S 477 4.141 6.560 -10.161 1.00 0.00 O ATOM 0 H GLU S 477 4.454 2.228 -6.076 1.00 0.00 H new ATOM 0 HA GLU S 477 2.067 3.663 -6.876 1.00 0.00 H new ATOM 0 HB2 GLU S 477 4.668 3.958 -7.498 1.00 0.00 H new ATOM 0 HB3 GLU S 477 4.252 2.821 -8.765 1.00 0.00 H new ATOM 0 HG2 GLU S 477 2.470 4.335 -9.560 1.00 0.00 H new ATOM 0 HG3 GLU S 477 2.836 5.463 -8.271 1.00 0.00 H new ATOM 361 N PHE S 478 0.937 2.092 -8.459 1.00 0.00 N ATOM 362 CA PHE S 478 0.181 1.095 -9.213 1.00 0.00 C ATOM 363 C PHE S 478 -0.826 1.758 -10.147 1.00 0.00 C ATOM 364 O PHE S 478 -1.251 2.888 -9.916 1.00 0.00 O ATOM 365 CB PHE S 478 -0.537 0.131 -8.268 1.00 0.00 C ATOM 366 CG PHE S 478 -1.278 0.816 -7.159 1.00 0.00 C ATOM 367 CD1 PHE S 478 -0.591 1.408 -6.115 1.00 0.00 C ATOM 368 CD2 PHE S 478 -2.661 0.868 -7.163 1.00 0.00 C ATOM 369 CE1 PHE S 478 -1.269 2.041 -5.092 1.00 0.00 C ATOM 370 CE2 PHE S 478 -3.346 1.498 -6.143 1.00 0.00 C ATOM 371 CZ PHE S 478 -2.649 2.086 -5.106 1.00 0.00 C ATOM 0 H PHE S 478 0.485 3.004 -8.387 1.00 0.00 H new ATOM 0 HA PHE S 478 0.891 0.531 -9.818 1.00 0.00 H new ATOM 0 HB2 PHE S 478 -1.239 -0.473 -8.843 1.00 0.00 H new ATOM 0 HB3 PHE S 478 0.194 -0.553 -7.837 1.00 0.00 H new ATOM 0 HD1 PHE S 478 0.488 1.375 -6.100 1.00 0.00 H new ATOM 0 HD2 PHE S 478 -3.210 0.411 -7.973 1.00 0.00 H new ATOM 0 HE1 PHE S 478 -0.721 2.500 -4.282 1.00 0.00 H new ATOM 0 HE2 PHE S 478 -4.425 1.531 -6.156 1.00 0.00 H new ATOM 0 HZ PHE S 478 -3.182 2.580 -4.307 1.00 0.00 H new ATOM 381 N GLN S 479 -1.199 1.043 -11.204 1.00 0.00 N ATOM 382 CA GLN S 479 -2.155 1.558 -12.179 1.00 0.00 C ATOM 383 C GLN S 479 -3.586 1.264 -11.744 1.00 0.00 C ATOM 384 O GLN S 479 -3.818 0.733 -10.657 1.00 0.00 O ATOM 385 CB GLN S 479 -1.892 0.942 -13.555 1.00 0.00 C ATOM 386 CG GLN S 479 -2.094 -0.564 -13.596 1.00 0.00 C ATOM 387 CD GLN S 479 -1.699 -1.168 -14.930 1.00 0.00 C ATOM 388 OE1 GLN S 479 -1.052 -0.519 -15.751 1.00 0.00 O ATOM 389 NE2 GLN S 479 -2.088 -2.420 -15.150 1.00 0.00 N ATOM 0 H GLN S 479 -0.854 0.105 -11.407 1.00 0.00 H new ATOM 0 HA GLN S 479 -2.027 2.639 -12.241 1.00 0.00 H new ATOM 0 HB2 GLN S 479 -2.553 1.409 -14.285 1.00 0.00 H new ATOM 0 HB3 GLN S 479 -0.870 1.172 -13.857 1.00 0.00 H new ATOM 0 HG2 GLN S 479 -1.507 -1.028 -12.803 1.00 0.00 H new ATOM 0 HG3 GLN S 479 -3.140 -0.792 -13.393 1.00 0.00 H new ATOM 0 HE21 GLN S 479 -2.623 -2.920 -14.440 1.00 0.00 H new ATOM 0 HE22 GLN S 479 -1.851 -2.881 -16.029 1.00 0.00 H new ATOM 398 N GLU S 480 -4.543 1.614 -12.596 1.00 0.00 N ATOM 399 CA GLU S 480 -5.952 1.386 -12.298 1.00 0.00 C ATOM 400 C GLU S 480 -6.360 -0.038 -12.662 1.00 0.00 C ATOM 401 O GLU S 480 -5.762 -0.659 -13.542 1.00 0.00 O ATOM 402 CB GLU S 480 -6.825 2.398 -13.049 1.00 0.00 C ATOM 403 CG GLU S 480 -6.965 2.103 -14.536 1.00 0.00 C ATOM 404 CD GLU S 480 -6.650 3.305 -15.403 1.00 0.00 C ATOM 405 OE1 GLU S 480 -5.452 3.616 -15.572 1.00 0.00 O ATOM 406 OE2 GLU S 480 -7.600 3.935 -15.912 1.00 0.00 O ATOM 0 H GLU S 480 -4.369 2.057 -13.498 1.00 0.00 H new ATOM 0 HA GLU S 480 -6.101 1.520 -11.227 1.00 0.00 H new ATOM 0 HB2 GLU S 480 -7.816 2.415 -12.596 1.00 0.00 H new ATOM 0 HB3 GLU S 480 -6.400 3.394 -12.924 1.00 0.00 H new ATOM 0 HG2 GLU S 480 -6.299 1.283 -14.804 1.00 0.00 H new ATOM 0 HG3 GLU S 480 -7.982 1.768 -14.742 1.00 0.00 H new ATOM 413 N GLY S 481 -7.382 -0.550 -11.984 1.00 0.00 N ATOM 414 CA GLY S 481 -7.854 -1.898 -12.252 1.00 0.00 C ATOM 415 C GLY S 481 -6.731 -2.917 -12.270 1.00 0.00 C ATOM 416 O GLY S 481 -6.447 -3.516 -13.307 1.00 0.00 O ATOM 0 H GLY S 481 -7.893 -0.056 -11.253 1.00 0.00 H new ATOM 0 HA2 GLY S 481 -8.584 -2.181 -11.493 1.00 0.00 H new ATOM 0 HA3 GLY S 481 -8.370 -1.914 -13.212 1.00 0.00 H new ATOM 420 N ASP S 482 -6.086 -3.114 -11.122 1.00 0.00 N ATOM 421 CA ASP S 482 -4.987 -4.067 -11.030 1.00 0.00 C ATOM 422 C ASP S 482 -5.148 -5.002 -9.840 1.00 0.00 C ATOM 423 O ASP S 482 -5.855 -4.698 -8.884 1.00 0.00 O ATOM 424 CB ASP S 482 -3.647 -3.332 -10.946 1.00 0.00 C ATOM 425 CG ASP S 482 -2.477 -4.267 -10.701 1.00 0.00 C ATOM 426 OD1 ASP S 482 -2.229 -5.143 -11.555 1.00 0.00 O ATOM 427 OD2 ASP S 482 -1.809 -4.122 -9.655 1.00 0.00 O ATOM 0 H ASP S 482 -6.304 -2.630 -10.251 1.00 0.00 H new ATOM 0 HA ASP S 482 -5.005 -4.675 -11.935 1.00 0.00 H new ATOM 0 HB2 ASP S 482 -3.480 -2.784 -11.873 1.00 0.00 H new ATOM 0 HB3 ASP S 482 -3.692 -2.595 -10.144 1.00 0.00 H new ATOM 432 N ILE S 483 -4.480 -6.146 -9.919 1.00 0.00 N ATOM 433 CA ILE S 483 -4.535 -7.145 -8.859 1.00 0.00 C ATOM 434 C ILE S 483 -3.392 -6.960 -7.868 1.00 0.00 C ATOM 435 O ILE S 483 -2.383 -7.662 -7.929 1.00 0.00 O ATOM 436 CB ILE S 483 -4.476 -8.574 -9.431 1.00 0.00 C ATOM 437 CG1 ILE S 483 -5.437 -8.719 -10.612 1.00 0.00 C ATOM 438 CG2 ILE S 483 -4.803 -9.591 -8.348 1.00 0.00 C ATOM 439 CD1 ILE S 483 -6.883 -8.445 -10.253 1.00 0.00 C ATOM 0 H ILE S 483 -3.891 -6.406 -10.710 1.00 0.00 H new ATOM 0 HA ILE S 483 -5.485 -7.006 -8.343 1.00 0.00 H new ATOM 0 HB ILE S 483 -3.464 -8.763 -9.788 1.00 0.00 H new ATOM 0 HG12 ILE S 483 -5.132 -8.035 -11.404 1.00 0.00 H new ATOM 0 HG13 ILE S 483 -5.356 -9.729 -11.014 1.00 0.00 H new ATOM 0 HG21 ILE S 483 -4.757 -10.596 -8.767 1.00 0.00 H new ATOM 0 HG22 ILE S 483 -4.081 -9.503 -7.536 1.00 0.00 H new ATOM 0 HG23 ILE S 483 -5.806 -9.403 -7.963 1.00 0.00 H new ATOM 0 HD11 ILE S 483 -7.507 -8.566 -11.138 1.00 0.00 H new ATOM 0 HD12 ILE S 483 -7.206 -9.146 -9.483 1.00 0.00 H new ATOM 0 HD13 ILE S 483 -6.978 -7.426 -9.879 1.00 0.00 H new ATOM 451 N ILE S 484 -3.559 -6.010 -6.954 1.00 0.00 N ATOM 452 CA ILE S 484 -2.543 -5.735 -5.947 1.00 0.00 C ATOM 453 C ILE S 484 -2.618 -6.741 -4.807 1.00 0.00 C ATOM 454 O ILE S 484 -3.649 -7.379 -4.594 1.00 0.00 O ATOM 455 CB ILE S 484 -2.699 -4.315 -5.368 1.00 0.00 C ATOM 456 CG1 ILE S 484 -2.772 -3.287 -6.495 1.00 0.00 C ATOM 457 CG2 ILE S 484 -1.549 -3.995 -4.425 1.00 0.00 C ATOM 458 CD1 ILE S 484 -2.925 -1.866 -6.000 1.00 0.00 C ATOM 0 H ILE S 484 -4.388 -5.419 -6.891 1.00 0.00 H new ATOM 0 HA ILE S 484 -1.575 -5.817 -6.442 1.00 0.00 H new ATOM 0 HB ILE S 484 -3.629 -4.272 -4.801 1.00 0.00 H new ATOM 0 HG12 ILE S 484 -1.869 -3.358 -7.101 1.00 0.00 H new ATOM 0 HG13 ILE S 484 -3.612 -3.530 -7.145 1.00 0.00 H new ATOM 0 HG21 ILE S 484 -1.675 -2.989 -4.026 1.00 0.00 H new ATOM 0 HG22 ILE S 484 -1.541 -4.713 -3.605 1.00 0.00 H new ATOM 0 HG23 ILE S 484 -0.606 -4.054 -4.968 1.00 0.00 H new ATOM 0 HD11 ILE S 484 -2.970 -1.187 -6.851 1.00 0.00 H new ATOM 0 HD12 ILE S 484 -3.843 -1.780 -5.418 1.00 0.00 H new ATOM 0 HD13 ILE S 484 -2.072 -1.605 -5.373 1.00 0.00 H new ATOM 470 N LEU S 485 -1.519 -6.875 -4.075 1.00 0.00 N ATOM 471 CA LEU S 485 -1.462 -7.800 -2.952 1.00 0.00 C ATOM 472 C LEU S 485 -1.349 -7.039 -1.637 1.00 0.00 C ATOM 473 O LEU S 485 -0.294 -6.495 -1.310 1.00 0.00 O ATOM 474 CB LEU S 485 -0.277 -8.761 -3.117 1.00 0.00 C ATOM 475 CG LEU S 485 0.123 -9.562 -1.866 1.00 0.00 C ATOM 476 CD1 LEU S 485 1.118 -8.776 -1.026 1.00 0.00 C ATOM 477 CD2 LEU S 485 -1.097 -9.934 -1.036 1.00 0.00 C ATOM 0 H LEU S 485 -0.657 -6.355 -4.239 1.00 0.00 H new ATOM 0 HA LEU S 485 -2.384 -8.381 -2.934 1.00 0.00 H new ATOM 0 HB2 LEU S 485 -0.515 -9.465 -3.914 1.00 0.00 H new ATOM 0 HB3 LEU S 485 0.588 -8.186 -3.447 1.00 0.00 H new ATOM 0 HG LEU S 485 0.598 -10.486 -2.197 1.00 0.00 H new ATOM 0 HD11 LEU S 485 1.390 -9.358 -0.145 1.00 0.00 H new ATOM 0 HD12 LEU S 485 2.011 -8.572 -1.616 1.00 0.00 H new ATOM 0 HD13 LEU S 485 0.667 -7.834 -0.714 1.00 0.00 H new ATOM 0 HD21 LEU S 485 -0.782 -10.499 -0.159 1.00 0.00 H new ATOM 0 HD22 LEU S 485 -1.611 -9.027 -0.718 1.00 0.00 H new ATOM 0 HD23 LEU S 485 -1.773 -10.543 -1.636 1.00 0.00 H new ATOM 489 N VAL S 486 -2.439 -7.016 -0.880 1.00 0.00 N ATOM 490 CA VAL S 486 -2.450 -6.337 0.407 1.00 0.00 C ATOM 491 C VAL S 486 -1.698 -7.176 1.414 1.00 0.00 C ATOM 492 O VAL S 486 -2.184 -8.227 1.803 1.00 0.00 O ATOM 493 CB VAL S 486 -3.870 -6.130 0.982 1.00 0.00 C ATOM 494 CG1 VAL S 486 -3.929 -4.875 1.819 1.00 0.00 C ATOM 495 CG2 VAL S 486 -4.937 -6.105 -0.101 1.00 0.00 C ATOM 0 H VAL S 486 -3.322 -7.458 -1.135 1.00 0.00 H new ATOM 0 HA VAL S 486 -1.996 -5.361 0.238 1.00 0.00 H new ATOM 0 HB VAL S 486 -4.084 -6.988 1.619 1.00 0.00 H new ATOM 0 HG11 VAL S 486 -4.937 -4.748 2.214 1.00 0.00 H new ATOM 0 HG12 VAL S 486 -3.223 -4.955 2.645 1.00 0.00 H new ATOM 0 HG13 VAL S 486 -3.670 -4.014 1.203 1.00 0.00 H new ATOM 0 HG21 VAL S 486 -5.916 -5.957 0.356 1.00 0.00 H new ATOM 0 HG22 VAL S 486 -4.733 -5.289 -0.794 1.00 0.00 H new ATOM 0 HG23 VAL S 486 -4.928 -7.051 -0.642 1.00 0.00 H new ATOM 505 N LEU S 487 -0.531 -6.734 1.841 1.00 0.00 N ATOM 506 CA LEU S 487 0.220 -7.514 2.814 1.00 0.00 C ATOM 507 C LEU S 487 -0.311 -7.319 4.229 1.00 0.00 C ATOM 508 O LEU S 487 -0.067 -8.148 5.104 1.00 0.00 O ATOM 509 CB LEU S 487 1.700 -7.164 2.768 1.00 0.00 C ATOM 510 CG LEU S 487 2.553 -8.023 1.825 1.00 0.00 C ATOM 511 CD1 LEU S 487 4.026 -7.877 2.166 1.00 0.00 C ATOM 512 CD2 LEU S 487 2.141 -9.490 1.898 1.00 0.00 C ATOM 0 H LEU S 487 -0.089 -5.865 1.542 1.00 0.00 H new ATOM 0 HA LEU S 487 0.093 -8.562 2.544 1.00 0.00 H new ATOM 0 HB2 LEU S 487 1.800 -6.120 2.470 1.00 0.00 H new ATOM 0 HB3 LEU S 487 2.107 -7.248 3.776 1.00 0.00 H new ATOM 0 HG LEU S 487 2.388 -7.672 0.806 1.00 0.00 H new ATOM 0 HD11 LEU S 487 4.619 -8.492 1.489 1.00 0.00 H new ATOM 0 HD12 LEU S 487 4.322 -6.833 2.061 1.00 0.00 H new ATOM 0 HD13 LEU S 487 4.196 -8.201 3.193 1.00 0.00 H new ATOM 0 HD21 LEU S 487 2.761 -10.076 1.220 1.00 0.00 H new ATOM 0 HD22 LEU S 487 2.272 -9.855 2.917 1.00 0.00 H new ATOM 0 HD23 LEU S 487 1.095 -9.589 1.609 1.00 0.00 H new ATOM 524 N SER S 488 -1.040 -6.228 4.450 1.00 0.00 N ATOM 525 CA SER S 488 -1.605 -5.937 5.774 1.00 0.00 C ATOM 526 C SER S 488 -2.159 -4.520 5.845 1.00 0.00 C ATOM 527 O SER S 488 -1.853 -3.678 5.003 1.00 0.00 O ATOM 528 CB SER S 488 -0.536 -6.079 6.866 1.00 0.00 C ATOM 529 OG SER S 488 -1.110 -6.495 8.093 1.00 0.00 O ATOM 0 H SER S 488 -1.255 -5.531 3.737 1.00 0.00 H new ATOM 0 HA SER S 488 -2.410 -6.654 5.935 1.00 0.00 H new ATOM 0 HB2 SER S 488 0.217 -6.801 6.550 1.00 0.00 H new ATOM 0 HB3 SER S 488 -0.025 -5.126 7.005 1.00 0.00 H new ATOM 0 HG SER S 488 -0.407 -6.579 8.771 1.00 0.00 H new ATOM 535 N LYS S 489 -2.943 -4.253 6.888 1.00 0.00 N ATOM 536 CA LYS S 489 -3.499 -2.924 7.105 1.00 0.00 C ATOM 537 C LYS S 489 -2.428 -2.044 7.735 1.00 0.00 C ATOM 538 O LYS S 489 -1.729 -2.479 8.652 1.00 0.00 O ATOM 539 CB LYS S 489 -4.730 -2.996 8.012 1.00 0.00 C ATOM 540 CG LYS S 489 -5.746 -1.896 7.748 1.00 0.00 C ATOM 541 CD LYS S 489 -6.475 -1.495 9.020 1.00 0.00 C ATOM 542 CE LYS S 489 -7.830 -2.176 9.123 1.00 0.00 C ATOM 543 NZ LYS S 489 -7.714 -3.565 9.650 1.00 0.00 N ATOM 0 H LYS S 489 -3.206 -4.941 7.594 1.00 0.00 H new ATOM 0 HA LYS S 489 -3.812 -2.500 6.151 1.00 0.00 H new ATOM 0 HB2 LYS S 489 -5.213 -3.964 7.879 1.00 0.00 H new ATOM 0 HB3 LYS S 489 -4.408 -2.940 9.052 1.00 0.00 H new ATOM 0 HG2 LYS S 489 -5.241 -1.026 7.327 1.00 0.00 H new ATOM 0 HG3 LYS S 489 -6.468 -2.236 7.005 1.00 0.00 H new ATOM 0 HD2 LYS S 489 -5.868 -1.757 9.887 1.00 0.00 H new ATOM 0 HD3 LYS S 489 -6.608 -0.413 9.039 1.00 0.00 H new ATOM 0 HE2 LYS S 489 -8.481 -1.593 9.775 1.00 0.00 H new ATOM 0 HE3 LYS S 489 -8.301 -2.199 8.140 1.00 0.00 H new ATOM 0 HZ1 LYS S 489 -8.659 -3.995 9.705 1.00 0.00 H new ATOM 0 HZ2 LYS S 489 -7.114 -4.128 9.015 1.00 0.00 H new ATOM 0 HZ3 LYS S 489 -7.288 -3.542 10.599 1.00 0.00 H new ATOM 557 N VAL S 490 -2.266 -0.827 7.230 1.00 0.00 N ATOM 558 CA VAL S 490 -1.229 0.058 7.754 1.00 0.00 C ATOM 559 C VAL S 490 -1.801 1.254 8.526 1.00 0.00 C ATOM 560 O VAL S 490 -1.136 1.790 9.412 1.00 0.00 O ATOM 561 CB VAL S 490 -0.282 0.522 6.622 1.00 0.00 C ATOM 562 CG1 VAL S 490 0.662 1.621 7.094 1.00 0.00 C ATOM 563 CG2 VAL S 490 0.517 -0.668 6.095 1.00 0.00 C ATOM 0 H VAL S 490 -2.826 -0.434 6.473 1.00 0.00 H new ATOM 0 HA VAL S 490 -0.652 -0.522 8.474 1.00 0.00 H new ATOM 0 HB VAL S 490 -0.894 0.934 5.819 1.00 0.00 H new ATOM 0 HG11 VAL S 490 1.311 1.921 6.272 1.00 0.00 H new ATOM 0 HG12 VAL S 490 0.081 2.480 7.430 1.00 0.00 H new ATOM 0 HG13 VAL S 490 1.270 1.249 7.919 1.00 0.00 H new ATOM 0 HG21 VAL S 490 1.182 -0.335 5.298 1.00 0.00 H new ATOM 0 HG22 VAL S 490 1.107 -1.097 6.905 1.00 0.00 H new ATOM 0 HG23 VAL S 490 -0.167 -1.422 5.706 1.00 0.00 H new ATOM 573 N ASN S 491 -3.031 1.664 8.220 1.00 0.00 N ATOM 574 CA ASN S 491 -3.646 2.782 8.938 1.00 0.00 C ATOM 575 C ASN S 491 -5.070 3.057 8.450 1.00 0.00 C ATOM 576 O ASN S 491 -5.505 4.207 8.395 1.00 0.00 O ATOM 577 CB ASN S 491 -2.772 4.044 8.828 1.00 0.00 C ATOM 578 CG ASN S 491 -3.088 4.904 7.616 1.00 0.00 C ATOM 579 OD1 ASN S 491 -3.701 4.442 6.655 1.00 0.00 O ATOM 580 ND2 ASN S 491 -2.671 6.165 7.666 1.00 0.00 N ATOM 0 H ASN S 491 -3.614 1.248 7.493 1.00 0.00 H new ATOM 0 HA ASN S 491 -3.714 2.500 9.989 1.00 0.00 H new ATOM 0 HB2 ASN S 491 -2.899 4.643 9.730 1.00 0.00 H new ATOM 0 HB3 ASN S 491 -1.724 3.747 8.788 1.00 0.00 H new ATOM 0 HD21 ASN S 491 -2.856 6.795 6.885 1.00 0.00 H new ATOM 0 HD22 ASN S 491 -2.166 6.503 8.485 1.00 0.00 H new ATOM 587 N GLU S 492 -5.796 1.999 8.099 1.00 0.00 N ATOM 588 CA GLU S 492 -7.170 2.138 7.617 1.00 0.00 C ATOM 589 C GLU S 492 -7.190 2.710 6.203 1.00 0.00 C ATOM 590 O GLU S 492 -7.702 2.080 5.276 1.00 0.00 O ATOM 591 CB GLU S 492 -7.984 3.035 8.556 1.00 0.00 C ATOM 592 CG GLU S 492 -9.486 2.842 8.431 1.00 0.00 C ATOM 593 CD GLU S 492 -10.056 1.974 9.536 1.00 0.00 C ATOM 594 OE1 GLU S 492 -9.969 0.733 9.420 1.00 0.00 O ATOM 595 OE2 GLU S 492 -10.587 2.534 10.517 1.00 0.00 O ATOM 0 H GLU S 492 -5.458 1.037 8.139 1.00 0.00 H new ATOM 0 HA GLU S 492 -7.623 1.147 7.600 1.00 0.00 H new ATOM 0 HB2 GLU S 492 -7.685 2.836 9.585 1.00 0.00 H new ATOM 0 HB3 GLU S 492 -7.742 4.077 8.350 1.00 0.00 H new ATOM 0 HG2 GLU S 492 -9.976 3.815 8.449 1.00 0.00 H new ATOM 0 HG3 GLU S 492 -9.711 2.389 7.465 1.00 0.00 H new ATOM 602 N GLU S 493 -6.614 3.899 6.039 1.00 0.00 N ATOM 603 CA GLU S 493 -6.552 4.543 4.730 1.00 0.00 C ATOM 604 C GLU S 493 -5.233 4.212 4.032 1.00 0.00 C ATOM 605 O GLU S 493 -4.857 4.852 3.049 1.00 0.00 O ATOM 606 CB GLU S 493 -6.715 6.062 4.860 1.00 0.00 C ATOM 607 CG GLU S 493 -6.012 6.658 6.069 1.00 0.00 C ATOM 608 CD GLU S 493 -5.577 8.092 5.842 1.00 0.00 C ATOM 609 OE1 GLU S 493 -6.460 8.963 5.688 1.00 0.00 O ATOM 610 OE2 GLU S 493 -4.355 8.346 5.817 1.00 0.00 O ATOM 0 H GLU S 493 -6.185 4.434 6.794 1.00 0.00 H new ATOM 0 HA GLU S 493 -7.374 4.159 4.126 1.00 0.00 H new ATOM 0 HB2 GLU S 493 -6.330 6.537 3.958 1.00 0.00 H new ATOM 0 HB3 GLU S 493 -7.777 6.300 4.917 1.00 0.00 H new ATOM 0 HG2 GLU S 493 -6.679 6.617 6.930 1.00 0.00 H new ATOM 0 HG3 GLU S 493 -5.140 6.052 6.313 1.00 0.00 H new ATOM 617 N TRP S 494 -4.547 3.194 4.544 1.00 0.00 N ATOM 618 CA TRP S 494 -3.280 2.743 3.984 1.00 0.00 C ATOM 619 C TRP S 494 -3.001 1.315 4.415 1.00 0.00 C ATOM 620 O TRP S 494 -3.572 0.822 5.388 1.00 0.00 O ATOM 621 CB TRP S 494 -2.116 3.636 4.422 1.00 0.00 C ATOM 622 CG TRP S 494 -2.161 5.024 3.863 1.00 0.00 C ATOM 623 CD1 TRP S 494 -2.839 6.088 4.378 1.00 0.00 C ATOM 624 CD2 TRP S 494 -1.487 5.507 2.692 1.00 0.00 C ATOM 625 NE1 TRP S 494 -2.624 7.202 3.608 1.00 0.00 N ATOM 626 CE2 TRP S 494 -1.805 6.872 2.566 1.00 0.00 C ATOM 627 CE3 TRP S 494 -0.647 4.922 1.739 1.00 0.00 C ATOM 628 CZ2 TRP S 494 -1.313 7.661 1.531 1.00 0.00 C ATOM 629 CZ3 TRP S 494 -0.159 5.709 0.711 1.00 0.00 C ATOM 630 CH2 TRP S 494 -0.494 7.066 0.615 1.00 0.00 C ATOM 0 H TRP S 494 -4.854 2.660 5.357 1.00 0.00 H new ATOM 0 HA TRP S 494 -3.365 2.798 2.899 1.00 0.00 H new ATOM 0 HB2 TRP S 494 -2.108 3.695 5.510 1.00 0.00 H new ATOM 0 HB3 TRP S 494 -1.180 3.166 4.122 1.00 0.00 H new ATOM 0 HD1 TRP S 494 -3.456 6.058 5.264 1.00 0.00 H new ATOM 0 HE1 TRP S 494 -3.013 8.128 3.785 1.00 0.00 H new ATOM 0 HE3 TRP S 494 -0.384 3.876 1.804 1.00 0.00 H new ATOM 0 HZ2 TRP S 494 -1.570 8.707 1.455 1.00 0.00 H new ATOM 0 HZ3 TRP S 494 0.492 5.269 -0.031 1.00 0.00 H new ATOM 0 HH2 TRP S 494 -0.096 7.653 -0.200 1.00 0.00 H new ATOM 641 N LEU S 495 -2.126 0.657 3.681 1.00 0.00 N ATOM 642 CA LEU S 495 -1.765 -0.713 3.967 1.00 0.00 C ATOM 643 C LEU S 495 -0.438 -1.065 3.321 1.00 0.00 C ATOM 644 O LEU S 495 0.106 -0.284 2.541 1.00 0.00 O ATOM 645 CB LEU S 495 -2.871 -1.655 3.499 1.00 0.00 C ATOM 646 CG LEU S 495 -3.709 -1.152 2.321 1.00 0.00 C ATOM 647 CD1 LEU S 495 -3.385 -1.921 1.048 1.00 0.00 C ATOM 648 CD2 LEU S 495 -5.188 -1.252 2.657 1.00 0.00 C ATOM 0 H LEU S 495 -1.648 1.057 2.873 1.00 0.00 H new ATOM 0 HA LEU S 495 -1.649 -0.827 5.045 1.00 0.00 H new ATOM 0 HB2 LEU S 495 -2.420 -2.608 3.221 1.00 0.00 H new ATOM 0 HB3 LEU S 495 -3.537 -1.851 4.339 1.00 0.00 H new ATOM 0 HG LEU S 495 -3.462 -0.106 2.142 1.00 0.00 H new ATOM 0 HD11 LEU S 495 -3.995 -1.542 0.228 1.00 0.00 H new ATOM 0 HD12 LEU S 495 -2.330 -1.793 0.804 1.00 0.00 H new ATOM 0 HD13 LEU S 495 -3.597 -2.980 1.198 1.00 0.00 H new ATOM 0 HD21 LEU S 495 -5.778 -0.892 1.814 1.00 0.00 H new ATOM 0 HD22 LEU S 495 -5.445 -2.291 2.862 1.00 0.00 H new ATOM 0 HD23 LEU S 495 -5.403 -0.644 3.536 1.00 0.00 H new ATOM 660 N GLU S 496 0.087 -2.237 3.649 1.00 0.00 N ATOM 661 CA GLU S 496 1.356 -2.661 3.090 1.00 0.00 C ATOM 662 C GLU S 496 1.155 -3.172 1.680 1.00 0.00 C ATOM 663 O GLU S 496 0.146 -3.811 1.374 1.00 0.00 O ATOM 664 CB GLU S 496 2.012 -3.730 3.962 1.00 0.00 C ATOM 665 CG GLU S 496 3.522 -3.820 3.789 1.00 0.00 C ATOM 666 CD GLU S 496 3.949 -4.170 2.377 1.00 0.00 C ATOM 667 OE1 GLU S 496 3.251 -4.969 1.721 1.00 0.00 O ATOM 668 OE2 GLU S 496 4.988 -3.643 1.926 1.00 0.00 O ATOM 0 H GLU S 496 -0.342 -2.902 4.292 1.00 0.00 H new ATOM 0 HA GLU S 496 2.024 -1.800 3.062 1.00 0.00 H new ATOM 0 HB2 GLU S 496 1.787 -3.521 5.008 1.00 0.00 H new ATOM 0 HB3 GLU S 496 1.570 -4.699 3.728 1.00 0.00 H new ATOM 0 HG2 GLU S 496 3.969 -2.866 4.070 1.00 0.00 H new ATOM 0 HG3 GLU S 496 3.914 -4.570 4.475 1.00 0.00 H new ATOM 675 N GLY S 497 2.103 -2.856 0.817 1.00 0.00 N ATOM 676 CA GLY S 497 1.998 -3.255 -0.565 1.00 0.00 C ATOM 677 C GLY S 497 3.165 -4.095 -1.051 1.00 0.00 C ATOM 678 O GLY S 497 4.320 -3.685 -0.953 1.00 0.00 O ATOM 0 H GLY S 497 2.945 -2.329 1.050 1.00 0.00 H new ATOM 0 HA2 GLY S 497 1.075 -3.819 -0.701 1.00 0.00 H new ATOM 0 HA3 GLY S 497 1.921 -2.363 -1.186 1.00 0.00 H new ATOM 682 N GLU S 498 2.851 -5.265 -1.596 1.00 0.00 N ATOM 683 CA GLU S 498 3.863 -6.170 -2.129 1.00 0.00 C ATOM 684 C GLU S 498 3.383 -6.748 -3.456 1.00 0.00 C ATOM 685 O GLU S 498 2.778 -7.819 -3.493 1.00 0.00 O ATOM 686 CB GLU S 498 4.154 -7.296 -1.136 1.00 0.00 C ATOM 687 CG GLU S 498 5.584 -7.807 -1.197 1.00 0.00 C ATOM 688 CD GLU S 498 5.670 -9.315 -1.064 1.00 0.00 C ATOM 689 OE1 GLU S 498 5.169 -9.853 -0.055 1.00 0.00 O ATOM 690 OE2 GLU S 498 6.242 -9.958 -1.971 1.00 0.00 O ATOM 0 H GLU S 498 1.895 -5.611 -1.681 1.00 0.00 H new ATOM 0 HA GLU S 498 4.785 -5.612 -2.292 1.00 0.00 H new ATOM 0 HB2 GLU S 498 3.947 -6.941 -0.126 1.00 0.00 H new ATOM 0 HB3 GLU S 498 3.472 -8.124 -1.329 1.00 0.00 H new ATOM 0 HG2 GLU S 498 6.035 -7.503 -2.142 1.00 0.00 H new ATOM 0 HG3 GLU S 498 6.166 -7.342 -0.402 1.00 0.00 H new ATOM 697 N SER S 499 3.632 -6.021 -4.543 1.00 0.00 N ATOM 698 CA SER S 499 3.196 -6.453 -5.866 1.00 0.00 C ATOM 699 C SER S 499 4.375 -6.842 -6.757 1.00 0.00 C ATOM 700 O SER S 499 5.066 -5.983 -7.305 1.00 0.00 O ATOM 701 CB SER S 499 2.380 -5.347 -6.539 1.00 0.00 C ATOM 702 OG SER S 499 2.083 -5.677 -7.885 1.00 0.00 O ATOM 0 H SER S 499 4.132 -5.132 -4.533 1.00 0.00 H new ATOM 0 HA SER S 499 2.574 -7.338 -5.732 1.00 0.00 H new ATOM 0 HB2 SER S 499 1.453 -5.188 -5.988 1.00 0.00 H new ATOM 0 HB3 SER S 499 2.935 -4.410 -6.505 1.00 0.00 H new ATOM 0 HG SER S 499 1.560 -4.955 -8.291 1.00 0.00 H new ATOM 708 N LYS S 500 4.576 -8.145 -6.908 1.00 0.00 N ATOM 709 CA LYS S 500 5.649 -8.673 -7.747 1.00 0.00 C ATOM 710 C LYS S 500 7.010 -8.095 -7.370 1.00 0.00 C ATOM 711 O LYS S 500 7.376 -7.006 -7.812 1.00 0.00 O ATOM 712 CB LYS S 500 5.356 -8.385 -9.220 1.00 0.00 C ATOM 713 CG LYS S 500 4.551 -9.476 -9.907 1.00 0.00 C ATOM 714 CD LYS S 500 3.153 -9.591 -9.320 1.00 0.00 C ATOM 715 CE LYS S 500 2.239 -8.494 -9.842 1.00 0.00 C ATOM 716 NZ LYS S 500 0.923 -8.491 -9.144 1.00 0.00 N ATOM 0 H LYS S 500 4.007 -8.862 -6.458 1.00 0.00 H new ATOM 0 HA LYS S 500 5.689 -9.750 -7.583 1.00 0.00 H new ATOM 0 HB2 LYS S 500 4.813 -7.443 -9.296 1.00 0.00 H new ATOM 0 HB3 LYS S 500 6.299 -8.253 -9.750 1.00 0.00 H new ATOM 0 HG2 LYS S 500 4.482 -9.262 -10.974 1.00 0.00 H new ATOM 0 HG3 LYS S 500 5.069 -10.430 -9.806 1.00 0.00 H new ATOM 0 HD2 LYS S 500 2.732 -10.566 -9.568 1.00 0.00 H new ATOM 0 HD3 LYS S 500 3.208 -9.534 -8.233 1.00 0.00 H new ATOM 0 HE2 LYS S 500 2.722 -7.526 -9.711 1.00 0.00 H new ATOM 0 HE3 LYS S 500 2.082 -8.630 -10.912 1.00 0.00 H new ATOM 0 HZ1 LYS S 500 0.328 -7.729 -9.528 1.00 0.00 H new ATOM 0 HZ2 LYS S 500 0.451 -9.406 -9.290 1.00 0.00 H new ATOM 0 HZ3 LYS S 500 1.070 -8.336 -8.126 1.00 0.00 H new ATOM 730 N GLY S 501 7.761 -8.848 -6.565 1.00 0.00 N ATOM 731 CA GLY S 501 9.089 -8.426 -6.141 1.00 0.00 C ATOM 732 C GLY S 501 9.213 -6.930 -5.910 1.00 0.00 C ATOM 733 O GLY S 501 10.250 -6.336 -6.207 1.00 0.00 O ATOM 0 H GLY S 501 7.469 -9.753 -6.196 1.00 0.00 H new ATOM 0 HA2 GLY S 501 9.350 -8.949 -5.221 1.00 0.00 H new ATOM 0 HA3 GLY S 501 9.814 -8.729 -6.896 1.00 0.00 H new ATOM 737 N LYS S 502 8.161 -6.321 -5.377 1.00 0.00 N ATOM 738 CA LYS S 502 8.168 -4.892 -5.105 1.00 0.00 C ATOM 739 C LYS S 502 7.389 -4.586 -3.838 1.00 0.00 C ATOM 740 O LYS S 502 6.203 -4.892 -3.737 1.00 0.00 O ATOM 741 CB LYS S 502 7.587 -4.113 -6.282 1.00 0.00 C ATOM 742 CG LYS S 502 8.636 -3.698 -7.298 1.00 0.00 C ATOM 743 CD LYS S 502 8.128 -3.855 -8.723 1.00 0.00 C ATOM 744 CE LYS S 502 6.905 -2.991 -8.978 1.00 0.00 C ATOM 745 NZ LYS S 502 6.285 -3.282 -10.300 1.00 0.00 N ATOM 0 H LYS S 502 7.294 -6.795 -5.125 1.00 0.00 H new ATOM 0 HA LYS S 502 9.203 -4.581 -4.963 1.00 0.00 H new ATOM 0 HB2 LYS S 502 6.832 -4.724 -6.777 1.00 0.00 H new ATOM 0 HB3 LYS S 502 7.081 -3.223 -5.907 1.00 0.00 H new ATOM 0 HG2 LYS S 502 8.921 -2.660 -7.125 1.00 0.00 H new ATOM 0 HG3 LYS S 502 9.534 -4.301 -7.162 1.00 0.00 H new ATOM 0 HD2 LYS S 502 8.918 -3.584 -9.424 1.00 0.00 H new ATOM 0 HD3 LYS S 502 7.881 -4.900 -8.909 1.00 0.00 H new ATOM 0 HE2 LYS S 502 6.172 -3.158 -8.189 1.00 0.00 H new ATOM 0 HE3 LYS S 502 7.188 -1.939 -8.933 1.00 0.00 H new ATOM 0 HZ1 LYS S 502 5.454 -2.672 -10.436 1.00 0.00 H new ATOM 0 HZ2 LYS S 502 6.976 -3.099 -11.055 1.00 0.00 H new ATOM 0 HZ3 LYS S 502 5.991 -4.279 -10.334 1.00 0.00 H new ATOM 759 N VAL S 503 8.068 -3.986 -2.873 1.00 0.00 N ATOM 760 CA VAL S 503 7.442 -3.645 -1.605 1.00 0.00 C ATOM 761 C VAL S 503 7.151 -2.152 -1.510 1.00 0.00 C ATOM 762 O VAL S 503 7.880 -1.325 -2.059 1.00 0.00 O ATOM 763 CB VAL S 503 8.313 -4.079 -0.409 1.00 0.00 C ATOM 764 CG1 VAL S 503 7.514 -4.030 0.886 1.00 0.00 C ATOM 765 CG2 VAL S 503 8.872 -5.475 -0.636 1.00 0.00 C ATOM 0 H VAL S 503 9.052 -3.725 -2.943 1.00 0.00 H new ATOM 0 HA VAL S 503 6.498 -4.189 -1.565 1.00 0.00 H new ATOM 0 HB VAL S 503 9.146 -3.382 -0.323 1.00 0.00 H new ATOM 0 HG11 VAL S 503 8.148 -4.340 1.717 1.00 0.00 H new ATOM 0 HG12 VAL S 503 7.162 -3.013 1.058 1.00 0.00 H new ATOM 0 HG13 VAL S 503 6.659 -4.702 0.812 1.00 0.00 H new ATOM 0 HG21 VAL S 503 9.484 -5.765 0.218 1.00 0.00 H new ATOM 0 HG22 VAL S 503 8.050 -6.182 -0.750 1.00 0.00 H new ATOM 0 HG23 VAL S 503 9.483 -5.480 -1.539 1.00 0.00 H new ATOM 775 N GLY S 504 6.072 -1.827 -0.813 1.00 0.00 N ATOM 776 CA GLY S 504 5.662 -0.449 -0.641 1.00 0.00 C ATOM 777 C GLY S 504 4.359 -0.377 0.121 1.00 0.00 C ATOM 778 O GLY S 504 4.054 -1.278 0.896 1.00 0.00 O ATOM 0 H GLY S 504 5.464 -2.507 -0.356 1.00 0.00 H new ATOM 0 HA2 GLY S 504 6.435 0.103 -0.105 1.00 0.00 H new ATOM 0 HA3 GLY S 504 5.548 0.027 -1.615 1.00 0.00 H new ATOM 782 N ILE S 505 3.581 0.673 -0.103 1.00 0.00 N ATOM 783 CA ILE S 505 2.296 0.817 0.575 1.00 0.00 C ATOM 784 C ILE S 505 1.322 1.634 -0.255 1.00 0.00 C ATOM 785 O ILE S 505 1.723 2.483 -1.046 1.00 0.00 O ATOM 786 CB ILE S 505 2.447 1.463 1.965 1.00 0.00 C ATOM 787 CG1 ILE S 505 3.461 2.608 1.926 1.00 0.00 C ATOM 788 CG2 ILE S 505 2.857 0.411 2.979 1.00 0.00 C ATOM 789 CD1 ILE S 505 3.148 3.724 2.900 1.00 0.00 C ATOM 0 H ILE S 505 3.812 1.433 -0.743 1.00 0.00 H new ATOM 0 HA ILE S 505 1.901 -0.191 0.702 1.00 0.00 H new ATOM 0 HB ILE S 505 1.486 1.882 2.264 1.00 0.00 H new ATOM 0 HG12 ILE S 505 4.453 2.212 2.145 1.00 0.00 H new ATOM 0 HG13 ILE S 505 3.497 3.017 0.916 1.00 0.00 H new ATOM 0 HG21 ILE S 505 2.962 0.873 3.960 1.00 0.00 H new ATOM 0 HG22 ILE S 505 2.095 -0.367 3.024 1.00 0.00 H new ATOM 0 HG23 ILE S 505 3.808 -0.030 2.681 1.00 0.00 H new ATOM 0 HD11 ILE S 505 3.907 4.502 2.819 1.00 0.00 H new ATOM 0 HD12 ILE S 505 2.170 4.146 2.668 1.00 0.00 H new ATOM 0 HD13 ILE S 505 3.141 3.329 3.916 1.00 0.00 H new ATOM 801 N PHE S 506 0.036 1.368 -0.076 1.00 0.00 N ATOM 802 CA PHE S 506 -0.987 2.084 -0.828 1.00 0.00 C ATOM 803 C PHE S 506 -2.282 2.213 -0.038 1.00 0.00 C ATOM 804 O PHE S 506 -2.613 1.355 0.778 1.00 0.00 O ATOM 805 CB PHE S 506 -1.256 1.376 -2.157 1.00 0.00 C ATOM 806 CG PHE S 506 -1.743 -0.039 -2.003 1.00 0.00 C ATOM 807 CD1 PHE S 506 -0.935 -1.006 -1.428 1.00 0.00 C ATOM 808 CD2 PHE S 506 -3.008 -0.401 -2.441 1.00 0.00 C ATOM 809 CE1 PHE S 506 -1.378 -2.308 -1.292 1.00 0.00 C ATOM 810 CE2 PHE S 506 -3.456 -1.700 -2.306 1.00 0.00 C ATOM 811 CZ PHE S 506 -2.640 -2.656 -1.731 1.00 0.00 C ATOM 0 H PHE S 506 -0.322 0.670 0.576 1.00 0.00 H new ATOM 0 HA PHE S 506 -0.612 3.089 -1.020 1.00 0.00 H new ATOM 0 HB2 PHE S 506 -1.996 1.946 -2.718 1.00 0.00 H new ATOM 0 HB3 PHE S 506 -0.340 1.373 -2.748 1.00 0.00 H new ATOM 0 HD1 PHE S 506 0.053 -0.739 -1.082 1.00 0.00 H new ATOM 0 HD2 PHE S 506 -3.650 0.341 -2.893 1.00 0.00 H new ATOM 0 HE1 PHE S 506 -0.738 -3.053 -0.843 1.00 0.00 H new ATOM 0 HE2 PHE S 506 -4.444 -1.969 -2.650 1.00 0.00 H new ATOM 0 HZ PHE S 506 -2.989 -3.673 -1.625 1.00 0.00 H new ATOM 821 N PRO S 507 -3.038 3.298 -0.280 1.00 0.00 N ATOM 822 CA PRO S 507 -4.308 3.545 0.403 1.00 0.00 C ATOM 823 C PRO S 507 -5.438 2.683 -0.150 1.00 0.00 C ATOM 824 O PRO S 507 -5.648 2.615 -1.363 1.00 0.00 O ATOM 825 CB PRO S 507 -4.561 5.025 0.131 1.00 0.00 C ATOM 826 CG PRO S 507 -3.907 5.278 -1.181 1.00 0.00 C ATOM 827 CD PRO S 507 -2.711 4.367 -1.243 1.00 0.00 C ATOM 0 HA PRO S 507 -4.267 3.297 1.464 1.00 0.00 H new ATOM 0 HB2 PRO S 507 -5.628 5.245 0.092 1.00 0.00 H new ATOM 0 HB3 PRO S 507 -4.135 5.651 0.915 1.00 0.00 H new ATOM 0 HG2 PRO S 507 -4.593 5.074 -2.003 1.00 0.00 H new ATOM 0 HG3 PRO S 507 -3.605 6.322 -1.270 1.00 0.00 H new ATOM 0 HD2 PRO S 507 -2.561 3.970 -2.247 1.00 0.00 H new ATOM 0 HD3 PRO S 507 -1.795 4.889 -0.967 1.00 0.00 H new ATOM 835 N LYS S 508 -6.152 2.018 0.750 1.00 0.00 N ATOM 836 CA LYS S 508 -7.255 1.140 0.382 1.00 0.00 C ATOM 837 C LYS S 508 -8.284 1.843 -0.507 1.00 0.00 C ATOM 838 O LYS S 508 -9.078 1.187 -1.181 1.00 0.00 O ATOM 839 CB LYS S 508 -7.928 0.620 1.652 1.00 0.00 C ATOM 840 CG LYS S 508 -8.539 -0.758 1.493 1.00 0.00 C ATOM 841 CD LYS S 508 -10.054 -0.690 1.373 1.00 0.00 C ATOM 842 CE LYS S 508 -10.723 -1.834 2.117 1.00 0.00 C ATOM 843 NZ LYS S 508 -10.356 -3.160 1.546 1.00 0.00 N ATOM 0 H LYS S 508 -5.983 2.072 1.754 1.00 0.00 H new ATOM 0 HA LYS S 508 -6.847 0.311 -0.196 1.00 0.00 H new ATOM 0 HB2 LYS S 508 -7.194 0.592 2.457 1.00 0.00 H new ATOM 0 HB3 LYS S 508 -8.706 1.321 1.954 1.00 0.00 H new ATOM 0 HG2 LYS S 508 -8.125 -1.240 0.607 1.00 0.00 H new ATOM 0 HG3 LYS S 508 -8.269 -1.377 2.349 1.00 0.00 H new ATOM 0 HD2 LYS S 508 -10.409 0.261 1.770 1.00 0.00 H new ATOM 0 HD3 LYS S 508 -10.339 -0.723 0.321 1.00 0.00 H new ATOM 0 HE2 LYS S 508 -10.436 -1.800 3.168 1.00 0.00 H new ATOM 0 HE3 LYS S 508 -11.805 -1.709 2.077 1.00 0.00 H new ATOM 0 HZ1 LYS S 508 -10.885 -3.908 2.038 1.00 0.00 H new ATOM 0 HZ2 LYS S 508 -10.590 -3.179 0.533 1.00 0.00 H new ATOM 0 HZ3 LYS S 508 -9.336 -3.320 1.668 1.00 0.00 H new ATOM 857 N VAL S 509 -8.277 3.170 -0.508 1.00 0.00 N ATOM 858 CA VAL S 509 -9.221 3.930 -1.321 1.00 0.00 C ATOM 859 C VAL S 509 -9.004 3.680 -2.816 1.00 0.00 C ATOM 860 O VAL S 509 -9.869 3.994 -3.634 1.00 0.00 O ATOM 861 CB VAL S 509 -9.119 5.446 -1.037 1.00 0.00 C ATOM 862 CG1 VAL S 509 -7.668 5.898 -1.053 1.00 0.00 C ATOM 863 CG2 VAL S 509 -9.943 6.244 -2.038 1.00 0.00 C ATOM 0 H VAL S 509 -7.633 3.740 0.041 1.00 0.00 H new ATOM 0 HA VAL S 509 -10.217 3.584 -1.046 1.00 0.00 H new ATOM 0 HB VAL S 509 -9.525 5.632 -0.043 1.00 0.00 H new ATOM 0 HG11 VAL S 509 -7.618 6.968 -0.851 1.00 0.00 H new ATOM 0 HG12 VAL S 509 -7.110 5.358 -0.288 1.00 0.00 H new ATOM 0 HG13 VAL S 509 -7.234 5.693 -2.031 1.00 0.00 H new ATOM 0 HG21 VAL S 509 -9.854 7.308 -1.816 1.00 0.00 H new ATOM 0 HG22 VAL S 509 -9.577 6.052 -3.046 1.00 0.00 H new ATOM 0 HG23 VAL S 509 -10.989 5.945 -1.969 1.00 0.00 H new ATOM 873 N PHE S 510 -7.849 3.122 -3.174 1.00 0.00 N ATOM 874 CA PHE S 510 -7.540 2.848 -4.576 1.00 0.00 C ATOM 875 C PHE S 510 -7.754 1.382 -4.925 1.00 0.00 C ATOM 876 O PHE S 510 -7.167 0.876 -5.882 1.00 0.00 O ATOM 877 CB PHE S 510 -6.101 3.244 -4.893 1.00 0.00 C ATOM 878 CG PHE S 510 -5.900 4.724 -4.982 1.00 0.00 C ATOM 879 CD1 PHE S 510 -6.029 5.515 -3.857 1.00 0.00 C ATOM 880 CD2 PHE S 510 -5.589 5.324 -6.189 1.00 0.00 C ATOM 881 CE1 PHE S 510 -5.851 6.880 -3.929 1.00 0.00 C ATOM 882 CE2 PHE S 510 -5.413 6.691 -6.272 1.00 0.00 C ATOM 883 CZ PHE S 510 -5.545 7.469 -5.138 1.00 0.00 C ATOM 0 H PHE S 510 -7.116 2.852 -2.518 1.00 0.00 H new ATOM 0 HA PHE S 510 -8.224 3.445 -5.180 1.00 0.00 H new ATOM 0 HB2 PHE S 510 -5.443 2.841 -4.124 1.00 0.00 H new ATOM 0 HB3 PHE S 510 -5.805 2.787 -5.837 1.00 0.00 H new ATOM 0 HD1 PHE S 510 -6.272 5.058 -2.909 1.00 0.00 H new ATOM 0 HD2 PHE S 510 -5.483 4.717 -7.076 1.00 0.00 H new ATOM 0 HE1 PHE S 510 -5.951 7.487 -3.041 1.00 0.00 H new ATOM 0 HE2 PHE S 510 -5.173 7.150 -7.220 1.00 0.00 H new ATOM 0 HZ PHE S 510 -5.409 8.539 -5.198 1.00 0.00 H new ATOM 893 N VAL S 511 -8.592 0.701 -4.157 1.00 0.00 N ATOM 894 CA VAL S 511 -8.869 -0.704 -4.408 1.00 0.00 C ATOM 895 C VAL S 511 -10.277 -1.081 -3.954 1.00 0.00 C ATOM 896 O VAL S 511 -11.065 -1.604 -4.742 1.00 0.00 O ATOM 897 CB VAL S 511 -7.836 -1.618 -3.715 1.00 0.00 C ATOM 898 CG1 VAL S 511 -6.440 -1.355 -4.253 1.00 0.00 C ATOM 899 CG2 VAL S 511 -7.861 -1.420 -2.212 1.00 0.00 C ATOM 0 H VAL S 511 -9.089 1.097 -3.359 1.00 0.00 H new ATOM 0 HA VAL S 511 -8.796 -0.853 -5.485 1.00 0.00 H new ATOM 0 HB VAL S 511 -8.105 -2.652 -3.932 1.00 0.00 H new ATOM 0 HG11 VAL S 511 -5.727 -2.010 -3.751 1.00 0.00 H new ATOM 0 HG12 VAL S 511 -6.420 -1.551 -5.325 1.00 0.00 H new ATOM 0 HG13 VAL S 511 -6.169 -0.315 -4.069 1.00 0.00 H new ATOM 0 HG21 VAL S 511 -7.125 -2.075 -1.746 1.00 0.00 H new ATOM 0 HG22 VAL S 511 -7.623 -0.382 -1.978 1.00 0.00 H new ATOM 0 HG23 VAL S 511 -8.853 -1.660 -1.830 1.00 0.00 H new ATOM 909 N GLU S 512 -10.594 -0.800 -2.683 1.00 0.00 N ATOM 910 CA GLU S 512 -11.916 -1.094 -2.111 1.00 0.00 C ATOM 911 C GLU S 512 -12.475 -2.436 -2.587 1.00 0.00 C ATOM 912 O GLU S 512 -13.683 -2.666 -2.538 1.00 0.00 O ATOM 913 CB GLU S 512 -12.886 0.013 -2.494 1.00 0.00 C ATOM 914 CG GLU S 512 -12.911 0.251 -3.987 1.00 0.00 C ATOM 915 CD GLU S 512 -14.011 1.204 -4.415 1.00 0.00 C ATOM 916 OE1 GLU S 512 -13.928 2.401 -4.069 1.00 0.00 O ATOM 917 OE2 GLU S 512 -14.953 0.752 -5.097 1.00 0.00 O ATOM 0 H GLU S 512 -9.946 -0.365 -2.026 1.00 0.00 H new ATOM 0 HA GLU S 512 -11.798 -1.151 -1.029 1.00 0.00 H new ATOM 0 HB2 GLU S 512 -13.887 -0.248 -2.151 1.00 0.00 H new ATOM 0 HB3 GLU S 512 -12.604 0.934 -1.984 1.00 0.00 H new ATOM 0 HG2 GLU S 512 -11.947 0.651 -4.302 1.00 0.00 H new ATOM 0 HG3 GLU S 512 -13.043 -0.702 -4.499 1.00 0.00 H new ATOM 986 N LYS P 360 -11.538 8.730 -15.125 1.00 0.00 N ATOM 987 CA LYS P 360 -11.970 8.545 -13.744 1.00 0.00 C ATOM 988 C LYS P 360 -10.987 9.180 -12.771 1.00 0.00 C ATOM 989 O LYS P 360 -10.085 8.517 -12.259 1.00 0.00 O ATOM 990 CB LYS P 360 -12.128 7.056 -13.427 1.00 0.00 C ATOM 991 CG LYS P 360 -13.524 6.518 -13.705 1.00 0.00 C ATOM 992 CD LYS P 360 -14.128 5.871 -12.468 1.00 0.00 C ATOM 993 CE LYS P 360 -15.615 5.613 -12.646 1.00 0.00 C ATOM 994 NZ LYS P 360 -15.881 4.267 -13.226 1.00 0.00 N ATOM 0 HA LYS P 360 -12.935 9.038 -13.629 1.00 0.00 H new ATOM 0 HB2 LYS P 360 -11.406 6.489 -14.015 1.00 0.00 H new ATOM 0 HB3 LYS P 360 -11.886 6.889 -12.377 1.00 0.00 H new ATOM 0 HG2 LYS P 360 -14.167 7.330 -14.043 1.00 0.00 H new ATOM 0 HG3 LYS P 360 -13.480 5.789 -14.514 1.00 0.00 H new ATOM 0 HD2 LYS P 360 -13.617 4.931 -12.261 1.00 0.00 H new ATOM 0 HD3 LYS P 360 -13.970 6.517 -11.604 1.00 0.00 H new ATOM 0 HE2 LYS P 360 -16.116 5.698 -11.682 1.00 0.00 H new ATOM 0 HE3 LYS P 360 -16.041 6.378 -13.295 1.00 0.00 H new ATOM 0 HZ1 LYS P 360 -16.907 4.131 -13.331 1.00 0.00 H new ATOM 0 HZ2 LYS P 360 -15.425 4.194 -14.158 1.00 0.00 H new ATOM 0 HZ3 LYS P 360 -15.498 3.535 -12.595 1.00 0.00 H new ATOM 1008 N PRO P 361 -11.167 10.479 -12.492 1.00 0.00 N ATOM 1009 CA PRO P 361 -10.320 11.228 -11.561 1.00 0.00 C ATOM 1010 C PRO P 361 -10.047 10.449 -10.280 1.00 0.00 C ATOM 1011 O PRO P 361 -10.901 10.371 -9.395 1.00 0.00 O ATOM 1012 CB PRO P 361 -11.154 12.490 -11.260 1.00 0.00 C ATOM 1013 CG PRO P 361 -12.487 12.246 -11.896 1.00 0.00 C ATOM 1014 CD PRO P 361 -12.224 11.329 -13.041 1.00 0.00 C ATOM 0 HA PRO P 361 -9.337 11.442 -11.980 1.00 0.00 H new ATOM 0 HB2 PRO P 361 -11.254 12.648 -10.186 1.00 0.00 H new ATOM 0 HB3 PRO P 361 -10.680 13.381 -11.671 1.00 0.00 H new ATOM 0 HG2 PRO P 361 -13.183 11.798 -11.187 1.00 0.00 H new ATOM 0 HG3 PRO P 361 -12.935 13.179 -12.236 1.00 0.00 H new ATOM 0 HD2 PRO P 361 -13.108 10.756 -13.320 1.00 0.00 H new ATOM 0 HD3 PRO P 361 -11.898 11.867 -13.931 1.00 0.00 H new ATOM 1022 N GLN P 362 -8.855 9.868 -10.186 1.00 0.00 N ATOM 1023 CA GLN P 362 -8.475 9.086 -9.011 1.00 0.00 C ATOM 1024 C GLN P 362 -8.709 9.868 -7.725 1.00 0.00 C ATOM 1025 O GLN P 362 -8.730 11.099 -7.723 1.00 0.00 O ATOM 1026 CB GLN P 362 -7.003 8.675 -9.088 1.00 0.00 C ATOM 1027 CG GLN P 362 -6.051 9.848 -9.246 1.00 0.00 C ATOM 1028 CD GLN P 362 -5.742 10.158 -10.697 1.00 0.00 C ATOM 1029 OE1 GLN P 362 -5.927 9.316 -11.576 1.00 0.00 O ATOM 1030 NE2 GLN P 362 -5.266 11.369 -10.956 1.00 0.00 N ATOM 0 H GLN P 362 -8.136 9.923 -10.907 1.00 0.00 H new ATOM 0 HA GLN P 362 -9.102 8.194 -9.000 1.00 0.00 H new ATOM 0 HB2 GLN P 362 -6.741 8.124 -8.185 1.00 0.00 H new ATOM 0 HB3 GLN P 362 -6.868 7.993 -9.928 1.00 0.00 H new ATOM 0 HG2 GLN P 362 -6.486 10.730 -8.775 1.00 0.00 H new ATOM 0 HG3 GLN P 362 -5.122 9.630 -8.719 1.00 0.00 H new ATOM 0 HE21 GLN P 362 -5.128 12.036 -10.197 1.00 0.00 H new ATOM 0 HE22 GLN P 362 -5.038 11.633 -11.914 1.00 0.00 H new ATOM 1039 N PRO P 363 -8.883 9.148 -6.612 1.00 0.00 N ATOM 1040 CA PRO P 363 -9.109 9.759 -5.308 1.00 0.00 C ATOM 1041 C PRO P 363 -7.901 10.540 -4.816 1.00 0.00 C ATOM 1042 O PRO P 363 -6.821 9.977 -4.652 1.00 0.00 O ATOM 1043 CB PRO P 363 -9.371 8.578 -4.370 1.00 0.00 C ATOM 1044 CG PRO P 363 -8.972 7.340 -5.104 1.00 0.00 C ATOM 1045 CD PRO P 363 -8.866 7.677 -6.561 1.00 0.00 C ATOM 0 HA PRO P 363 -9.931 10.474 -5.352 1.00 0.00 H new ATOM 0 HB2 PRO P 363 -8.797 8.682 -3.449 1.00 0.00 H new ATOM 0 HB3 PRO P 363 -10.423 8.536 -4.087 1.00 0.00 H new ATOM 0 HG2 PRO P 363 -8.019 6.966 -4.729 1.00 0.00 H new ATOM 0 HG3 PRO P 363 -9.708 6.551 -4.948 1.00 0.00 H new ATOM 0 HD2 PRO P 363 -7.949 7.277 -6.993 1.00 0.00 H new ATOM 0 HD3 PRO P 363 -9.696 7.253 -7.126 1.00 0.00 H new ATOM 1053 N ALA P 364 -8.082 11.830 -4.552 1.00 0.00 N ATOM 1054 CA ALA P 364 -6.988 12.653 -4.048 1.00 0.00 C ATOM 1055 C ALA P 364 -6.335 11.952 -2.863 1.00 0.00 C ATOM 1056 O ALA P 364 -6.872 11.955 -1.756 1.00 0.00 O ATOM 1057 CB ALA P 364 -7.495 14.030 -3.646 1.00 0.00 C ATOM 0 H ALA P 364 -8.966 12.324 -4.677 1.00 0.00 H new ATOM 0 HA ALA P 364 -6.247 12.788 -4.836 1.00 0.00 H new ATOM 0 HB1 ALA P 364 -6.664 14.629 -3.273 1.00 0.00 H new ATOM 0 HB2 ALA P 364 -7.937 14.522 -4.512 1.00 0.00 H new ATOM 0 HB3 ALA P 364 -8.248 13.927 -2.864 1.00 0.00 H new ATOM 1063 N VAL P 365 -5.191 11.319 -3.109 1.00 0.00 N ATOM 1064 CA VAL P 365 -4.500 10.579 -2.057 1.00 0.00 C ATOM 1065 C VAL P 365 -4.351 11.431 -0.796 1.00 0.00 C ATOM 1066 O VAL P 365 -4.057 12.624 -0.868 1.00 0.00 O ATOM 1067 CB VAL P 365 -3.110 10.059 -2.495 1.00 0.00 C ATOM 1068 CG1 VAL P 365 -2.783 8.774 -1.761 1.00 0.00 C ATOM 1069 CG2 VAL P 365 -3.047 9.815 -3.993 1.00 0.00 C ATOM 0 H VAL P 365 -4.727 11.303 -4.017 1.00 0.00 H new ATOM 0 HA VAL P 365 -5.123 9.711 -1.844 1.00 0.00 H new ATOM 0 HB VAL P 365 -2.378 10.827 -2.245 1.00 0.00 H new ATOM 0 HG11 VAL P 365 -1.803 8.415 -2.075 1.00 0.00 H new ATOM 0 HG12 VAL P 365 -2.774 8.961 -0.687 1.00 0.00 H new ATOM 0 HG13 VAL P 365 -3.537 8.021 -1.992 1.00 0.00 H new ATOM 0 HG21 VAL P 365 -2.055 9.451 -4.261 1.00 0.00 H new ATOM 0 HG22 VAL P 365 -3.794 9.072 -4.272 1.00 0.00 H new ATOM 0 HG23 VAL P 365 -3.246 10.747 -4.522 1.00 0.00 H new ATOM 1079 N PRO P 366 -4.581 10.822 0.381 1.00 0.00 N ATOM 1080 CA PRO P 366 -4.506 11.514 1.669 1.00 0.00 C ATOM 1081 C PRO P 366 -3.090 11.583 2.231 1.00 0.00 C ATOM 1082 O PRO P 366 -2.169 10.968 1.692 1.00 0.00 O ATOM 1083 CB PRO P 366 -5.381 10.634 2.560 1.00 0.00 C ATOM 1084 CG PRO P 366 -5.173 9.257 2.030 1.00 0.00 C ATOM 1085 CD PRO P 366 -4.960 9.404 0.544 1.00 0.00 C ATOM 0 HA PRO P 366 -4.822 12.555 1.594 1.00 0.00 H new ATOM 0 HB2 PRO P 366 -5.085 10.707 3.606 1.00 0.00 H new ATOM 0 HB3 PRO P 366 -6.429 10.928 2.504 1.00 0.00 H new ATOM 0 HG2 PRO P 366 -4.311 8.785 2.502 1.00 0.00 H new ATOM 0 HG3 PRO P 366 -6.036 8.625 2.239 1.00 0.00 H new ATOM 0 HD2 PRO P 366 -4.177 8.737 0.184 1.00 0.00 H new ATOM 0 HD3 PRO P 366 -5.864 9.165 -0.015 1.00 0.00 H new ATOM 1093 N PRO P 367 -2.903 12.316 3.346 1.00 0.00 N ATOM 1094 CA PRO P 367 -1.598 12.442 4.000 1.00 0.00 C ATOM 1095 C PRO P 367 -1.141 11.107 4.560 1.00 0.00 C ATOM 1096 O PRO P 367 -1.521 10.712 5.664 1.00 0.00 O ATOM 1097 CB PRO P 367 -1.859 13.433 5.130 1.00 0.00 C ATOM 1098 CG PRO P 367 -3.303 13.260 5.415 1.00 0.00 C ATOM 1099 CD PRO P 367 -3.944 13.056 4.075 1.00 0.00 C ATOM 0 HA PRO P 367 -0.814 12.767 3.316 1.00 0.00 H new ATOM 0 HB2 PRO P 367 -1.248 13.213 6.006 1.00 0.00 H new ATOM 0 HB3 PRO P 367 -1.629 14.455 4.829 1.00 0.00 H new ATOM 0 HG2 PRO P 367 -3.476 12.405 6.069 1.00 0.00 H new ATOM 0 HG3 PRO P 367 -3.713 14.135 5.919 1.00 0.00 H new ATOM 0 HD2 PRO P 367 -4.872 12.488 4.149 1.00 0.00 H new ATOM 0 HD3 PRO P 367 -4.187 14.002 3.591 1.00 0.00 H new ATOM 1107 N ARG P 368 -0.350 10.413 3.768 1.00 0.00 N ATOM 1108 CA ARG P 368 0.161 9.090 4.128 1.00 0.00 C ATOM 1109 C ARG P 368 0.551 8.989 5.598 1.00 0.00 C ATOM 1110 O ARG P 368 0.781 9.985 6.282 1.00 0.00 O ATOM 1111 CB ARG P 368 1.349 8.692 3.240 1.00 0.00 C ATOM 1112 CG ARG P 368 2.141 9.861 2.677 1.00 0.00 C ATOM 1113 CD ARG P 368 2.790 10.679 3.781 1.00 0.00 C ATOM 1114 NE ARG P 368 1.961 11.812 4.189 1.00 0.00 N ATOM 1115 CZ ARG P 368 1.882 12.954 3.510 1.00 0.00 C ATOM 1116 NH1 ARG P 368 2.567 13.116 2.385 1.00 0.00 N ATOM 1117 NH2 ARG P 368 1.111 13.938 3.957 1.00 0.00 N ATOM 0 H ARG P 368 -0.038 10.743 2.855 1.00 0.00 H new ATOM 0 HA ARG P 368 -0.659 8.392 3.959 1.00 0.00 H new ATOM 0 HB2 ARG P 368 2.022 8.060 3.819 1.00 0.00 H new ATOM 0 HB3 ARG P 368 0.979 8.088 2.411 1.00 0.00 H new ATOM 0 HG2 ARG P 368 2.909 9.488 2.000 1.00 0.00 H new ATOM 0 HG3 ARG P 368 1.481 10.500 2.090 1.00 0.00 H new ATOM 0 HD2 ARG P 368 2.977 10.039 4.643 1.00 0.00 H new ATOM 0 HD3 ARG P 368 3.758 11.044 3.439 1.00 0.00 H new ATOM 0 HE ARG P 368 1.411 11.722 5.044 1.00 0.00 H new ATOM 0 HH11 ARG P 368 3.159 12.363 2.035 1.00 0.00 H new ATOM 0 HH12 ARG P 368 2.502 13.994 1.870 1.00 0.00 H new ATOM 0 HH21 ARG P 368 0.580 13.818 4.820 1.00 0.00 H new ATOM 0 HH22 ARG P 368 1.049 14.814 3.438 1.00 0.00 H new ATOM 1131 N PRO P 369 0.609 7.743 6.079 1.00 0.00 N ATOM 1132 CA PRO P 369 0.951 7.408 7.466 1.00 0.00 C ATOM 1133 C PRO P 369 2.198 8.133 7.957 1.00 0.00 C ATOM 1134 O PRO P 369 2.902 8.775 7.178 1.00 0.00 O ATOM 1135 CB PRO P 369 1.184 5.902 7.393 1.00 0.00 C ATOM 1136 CG PRO P 369 0.285 5.456 6.291 1.00 0.00 C ATOM 1137 CD PRO P 369 0.334 6.544 5.275 1.00 0.00 C ATOM 0 HA PRO P 369 0.175 7.706 8.171 1.00 0.00 H new ATOM 0 HB2 PRO P 369 2.227 5.669 7.178 1.00 0.00 H new ATOM 0 HB3 PRO P 369 0.936 5.413 8.335 1.00 0.00 H new ATOM 0 HG2 PRO P 369 0.621 4.509 5.869 1.00 0.00 H new ATOM 0 HG3 PRO P 369 -0.732 5.301 6.652 1.00 0.00 H new ATOM 0 HD2 PRO P 369 1.114 6.368 4.534 1.00 0.00 H new ATOM 0 HD3 PRO P 369 -0.607 6.631 4.732 1.00 0.00 H new ATOM 1145 N SER P 370 2.462 8.030 9.256 1.00 0.00 N ATOM 1146 CA SER P 370 3.620 8.680 9.855 1.00 0.00 C ATOM 1147 C SER P 370 4.843 7.767 9.832 1.00 0.00 C ATOM 1148 O SER P 370 5.739 7.899 10.668 1.00 0.00 O ATOM 1149 CB SER P 370 3.309 9.098 11.292 1.00 0.00 C ATOM 1150 OG SER P 370 2.749 8.024 12.026 1.00 0.00 O ATOM 0 H SER P 370 1.888 7.502 9.914 1.00 0.00 H new ATOM 0 HA SER P 370 3.847 9.567 9.264 1.00 0.00 H new ATOM 0 HB2 SER P 370 4.222 9.439 11.780 1.00 0.00 H new ATOM 0 HB3 SER P 370 2.616 9.940 11.287 1.00 0.00 H new ATOM 0 HG SER P 370 2.561 8.317 12.942 1.00 0.00 H new ATOM 1156 N ALA P 371 4.878 6.842 8.875 1.00 0.00 N ATOM 1157 CA ALA P 371 5.992 5.910 8.740 1.00 0.00 C ATOM 1158 C ALA P 371 6.038 4.919 9.902 1.00 0.00 C ATOM 1159 O ALA P 371 5.928 3.715 9.705 1.00 0.00 O ATOM 1160 CB ALA P 371 7.309 6.665 8.627 1.00 0.00 C ATOM 0 H ALA P 371 4.143 6.719 8.179 1.00 0.00 H new ATOM 0 HA ALA P 371 5.837 5.339 7.825 1.00 0.00 H new ATOM 0 HB1 ALA P 371 8.129 5.954 8.527 1.00 0.00 H new ATOM 0 HB2 ALA P 371 7.283 7.314 7.751 1.00 0.00 H new ATOM 0 HB3 ALA P 371 7.460 7.269 9.522 1.00 0.00 H new ATOM 1166 N ASP P 372 6.214 5.427 11.112 1.00 0.00 N ATOM 1167 CA ASP P 372 6.281 4.569 12.295 1.00 0.00 C ATOM 1168 C ASP P 372 5.165 3.526 12.301 1.00 0.00 C ATOM 1169 O ASP P 372 5.449 2.329 12.298 1.00 0.00 O ATOM 1170 CB ASP P 372 6.226 5.408 13.573 1.00 0.00 C ATOM 1171 CG ASP P 372 7.492 6.216 13.788 1.00 0.00 C ATOM 1172 OD1 ASP P 372 8.495 5.634 14.254 1.00 0.00 O ATOM 1173 OD2 ASP P 372 7.480 7.428 13.490 1.00 0.00 O ATOM 0 H ASP P 372 6.313 6.424 11.305 1.00 0.00 H new ATOM 0 HA ASP P 372 7.233 4.039 12.259 1.00 0.00 H new ATOM 0 HB2 ASP P 372 5.371 6.083 13.525 1.00 0.00 H new ATOM 0 HB3 ASP P 372 6.067 4.752 14.429 1.00 0.00 H new ATOM 1178 N LEU P 373 3.897 3.952 12.296 1.00 0.00 N ATOM 1179 CA LEU P 373 2.813 2.973 12.286 1.00 0.00 C ATOM 1180 C LEU P 373 2.997 2.033 11.104 1.00 0.00 C ATOM 1181 O LEU P 373 2.622 0.862 11.162 1.00 0.00 O ATOM 1182 CB LEU P 373 1.415 3.622 12.302 1.00 0.00 C ATOM 1183 CG LEU P 373 0.962 4.388 11.049 1.00 0.00 C ATOM 1184 CD1 LEU P 373 1.024 3.527 9.802 1.00 0.00 C ATOM 1185 CD2 LEU P 373 -0.459 4.884 11.250 1.00 0.00 C ATOM 0 H LEU P 373 3.606 4.930 12.299 1.00 0.00 H new ATOM 0 HA LEU P 373 2.866 2.397 13.210 1.00 0.00 H new ATOM 0 HB2 LEU P 373 0.684 2.837 12.496 1.00 0.00 H new ATOM 0 HB3 LEU P 373 1.376 4.310 13.147 1.00 0.00 H new ATOM 0 HG LEU P 373 1.643 5.227 10.907 1.00 0.00 H new ATOM 0 HD11 LEU P 373 0.695 4.109 8.941 1.00 0.00 H new ATOM 0 HD12 LEU P 373 2.049 3.191 9.643 1.00 0.00 H new ATOM 0 HD13 LEU P 373 0.373 2.661 9.925 1.00 0.00 H new ATOM 0 HD21 LEU P 373 -0.783 5.428 10.363 1.00 0.00 H new ATOM 0 HD22 LEU P 373 -1.121 4.034 11.417 1.00 0.00 H new ATOM 0 HD23 LEU P 373 -0.494 5.547 12.115 1.00 0.00 H new ATOM 1197 N ILE P 374 3.637 2.541 10.048 1.00 0.00 N ATOM 1198 CA ILE P 374 3.938 1.728 8.885 1.00 0.00 C ATOM 1199 C ILE P 374 4.967 0.701 9.316 1.00 0.00 C ATOM 1200 O ILE P 374 4.838 -0.495 9.060 1.00 0.00 O ATOM 1201 CB ILE P 374 4.506 2.570 7.720 1.00 0.00 C ATOM 1202 CG1 ILE P 374 3.492 3.626 7.278 1.00 0.00 C ATOM 1203 CG2 ILE P 374 4.903 1.681 6.556 1.00 0.00 C ATOM 1204 CD1 ILE P 374 3.928 4.425 6.068 1.00 0.00 C ATOM 0 H ILE P 374 3.953 3.509 9.982 1.00 0.00 H new ATOM 0 HA ILE P 374 3.022 1.261 8.522 1.00 0.00 H new ATOM 0 HB ILE P 374 5.401 3.082 8.072 1.00 0.00 H new ATOM 0 HG12 ILE P 374 2.545 3.135 7.055 1.00 0.00 H new ATOM 0 HG13 ILE P 374 3.310 4.310 8.107 1.00 0.00 H new ATOM 0 HG21 ILE P 374 5.300 2.295 5.748 1.00 0.00 H new ATOM 0 HG22 ILE P 374 5.665 0.973 6.882 1.00 0.00 H new ATOM 0 HG23 ILE P 374 4.029 1.135 6.201 1.00 0.00 H new ATOM 0 HD11 ILE P 374 3.157 5.153 5.816 1.00 0.00 H new ATOM 0 HD12 ILE P 374 4.859 4.945 6.292 1.00 0.00 H new ATOM 0 HD13 ILE P 374 4.082 3.752 5.224 1.00 0.00 H new ATOM 1216 N LEU P 375 5.965 1.202 10.032 1.00 0.00 N ATOM 1217 CA LEU P 375 7.020 0.381 10.588 1.00 0.00 C ATOM 1218 C LEU P 375 6.418 -0.585 11.599 1.00 0.00 C ATOM 1219 O LEU P 375 6.985 -1.634 11.905 1.00 0.00 O ATOM 1220 CB LEU P 375 8.063 1.292 11.240 1.00 0.00 C ATOM 1221 CG LEU P 375 8.755 2.243 10.264 1.00 0.00 C ATOM 1222 CD1 LEU P 375 9.065 3.575 10.931 1.00 0.00 C ATOM 1223 CD2 LEU P 375 10.031 1.619 9.717 1.00 0.00 C ATOM 0 H LEU P 375 6.061 2.196 10.242 1.00 0.00 H new ATOM 0 HA LEU P 375 7.509 -0.202 9.808 1.00 0.00 H new ATOM 0 HB2 LEU P 375 7.580 1.878 12.022 1.00 0.00 H new ATOM 0 HB3 LEU P 375 8.818 0.674 11.725 1.00 0.00 H new ATOM 0 HG LEU P 375 8.073 2.424 9.433 1.00 0.00 H new ATOM 0 HD11 LEU P 375 9.557 4.234 10.216 1.00 0.00 H new ATOM 0 HD12 LEU P 375 8.138 4.036 11.271 1.00 0.00 H new ATOM 0 HD13 LEU P 375 9.722 3.410 11.785 1.00 0.00 H new ATOM 0 HD21 LEU P 375 10.507 2.313 9.024 1.00 0.00 H new ATOM 0 HD22 LEU P 375 10.712 1.403 10.540 1.00 0.00 H new ATOM 0 HD23 LEU P 375 9.788 0.694 9.194 1.00 0.00 H new ATOM 1235 N ASN P 376 5.245 -0.211 12.093 1.00 0.00 N ATOM 1236 CA ASN P 376 4.507 -1.006 13.053 1.00 0.00 C ATOM 1237 C ASN P 376 3.554 -1.968 12.347 1.00 0.00 C ATOM 1238 O ASN P 376 3.111 -2.955 12.936 1.00 0.00 O ATOM 1239 CB ASN P 376 3.704 -0.077 13.968 1.00 0.00 C ATOM 1240 CG ASN P 376 3.784 -0.483 15.426 1.00 0.00 C ATOM 1241 OD1 ASN P 376 4.680 -1.226 15.827 1.00 0.00 O ATOM 1242 ND2 ASN P 376 2.844 0.002 16.228 1.00 0.00 N ATOM 0 H ASN P 376 4.780 0.659 11.834 1.00 0.00 H new ATOM 0 HA ASN P 376 5.217 -1.590 13.639 1.00 0.00 H new ATOM 0 HB2 ASN P 376 4.073 0.943 13.858 1.00 0.00 H new ATOM 0 HB3 ASN P 376 2.661 -0.075 13.652 1.00 0.00 H new ATOM 0 HD21 ASN P 376 2.846 -0.238 17.219 1.00 0.00 H new ATOM 0 HD22 ASN P 376 2.120 0.615 15.853 1.00 0.00 H new ATOM 1249 N ARG P 377 3.204 -1.655 11.096 1.00 0.00 N ATOM 1250 CA ARG P 377 2.262 -2.482 10.349 1.00 0.00 C ATOM 1251 C ARG P 377 2.714 -2.762 8.908 1.00 0.00 C ATOM 1252 O ARG P 377 1.894 -2.742 7.990 1.00 0.00 O ATOM 1253 CB ARG P 377 0.885 -1.799 10.328 1.00 0.00 C ATOM 1254 CG ARG P 377 0.485 -1.150 11.652 1.00 0.00 C ATOM 1255 CD ARG P 377 -0.115 0.235 11.445 1.00 0.00 C ATOM 1256 NE ARG P 377 -1.573 0.217 11.544 1.00 0.00 N ATOM 1257 CZ ARG P 377 -2.239 0.259 12.696 1.00 0.00 C ATOM 1258 NH1 ARG P 377 -1.584 0.315 13.849 1.00 0.00 N ATOM 1259 NH2 ARG P 377 -3.565 0.242 12.696 1.00 0.00 N ATOM 0 H ARG P 377 3.556 -0.844 10.587 1.00 0.00 H new ATOM 0 HA ARG P 377 2.211 -3.444 10.859 1.00 0.00 H new ATOM 0 HB2 ARG P 377 0.882 -1.038 9.548 1.00 0.00 H new ATOM 0 HB3 ARG P 377 0.130 -2.537 10.056 1.00 0.00 H new ATOM 0 HG2 ARG P 377 -0.237 -1.786 12.165 1.00 0.00 H new ATOM 0 HG3 ARG P 377 1.359 -1.074 12.298 1.00 0.00 H new ATOM 0 HD2 ARG P 377 0.291 0.921 12.188 1.00 0.00 H new ATOM 0 HD3 ARG P 377 0.178 0.615 10.466 1.00 0.00 H new ATOM 0 HE ARG P 377 -2.112 0.169 10.679 1.00 0.00 H new ATOM 0 HH11 ARG P 377 -0.564 0.326 13.856 1.00 0.00 H new ATOM 0 HH12 ARG P 377 -2.101 0.347 14.728 1.00 0.00 H new ATOM 0 HH21 ARG P 377 -4.074 0.197 11.813 1.00 0.00 H new ATOM 0 HH22 ARG P 377 -4.075 0.274 13.579 1.00 0.00 H new ATOM 1273 N CYS P 378 4.000 -3.054 8.701 1.00 0.00 N ATOM 1274 CA CYS P 378 4.490 -3.364 7.353 1.00 0.00 C ATOM 1275 C CYS P 378 5.590 -4.422 7.384 1.00 0.00 C ATOM 1276 O CYS P 378 6.028 -4.850 8.452 1.00 0.00 O ATOM 1277 CB CYS P 378 4.987 -2.108 6.626 1.00 0.00 C ATOM 1278 SG CYS P 378 3.660 -1.104 5.923 1.00 0.00 S ATOM 0 H CYS P 378 4.710 -3.083 9.433 1.00 0.00 H new ATOM 0 HA CYS P 378 3.642 -3.766 6.798 1.00 0.00 H new ATOM 0 HB2 CYS P 378 5.561 -1.498 7.324 1.00 0.00 H new ATOM 0 HB3 CYS P 378 5.667 -2.406 5.828 1.00 0.00 H new ATOM 0 HG CYS P 378 3.151 -0.347 6.849 1.00 0.00 H new ATOM 1284 N SER P 379 6.014 -4.853 6.196 1.00 0.00 N ATOM 1285 CA SER P 379 7.049 -5.875 6.066 1.00 0.00 C ATOM 1286 C SER P 379 8.404 -5.372 6.567 1.00 0.00 C ATOM 1287 O SER P 379 8.737 -5.533 7.741 1.00 0.00 O ATOM 1288 CB SER P 379 7.153 -6.333 4.606 1.00 0.00 C ATOM 1289 OG SER P 379 6.449 -7.545 4.400 1.00 0.00 O ATOM 0 H SER P 379 5.654 -4.507 5.307 1.00 0.00 H new ATOM 0 HA SER P 379 6.764 -6.723 6.688 1.00 0.00 H new ATOM 0 HB2 SER P 379 6.752 -5.560 3.950 1.00 0.00 H new ATOM 0 HB3 SER P 379 8.201 -6.467 4.338 1.00 0.00 H new ATOM 0 HG SER P 379 6.529 -7.815 3.461 1.00 0.00 H new ATOM 1295 N GLU P 380 9.184 -4.769 5.671 1.00 0.00 N ATOM 1296 CA GLU P 380 10.499 -4.254 6.029 1.00 0.00 C ATOM 1297 C GLU P 380 11.046 -3.362 4.921 1.00 0.00 C ATOM 1298 O GLU P 380 11.596 -2.292 5.185 1.00 0.00 O ATOM 1299 CB GLU P 380 11.467 -5.406 6.298 1.00 0.00 C ATOM 1300 CG GLU P 380 12.444 -5.130 7.432 1.00 0.00 C ATOM 1301 CD GLU P 380 12.053 -5.829 8.718 1.00 0.00 C ATOM 1302 OE1 GLU P 380 11.676 -7.018 8.658 1.00 0.00 O ATOM 1303 OE2 GLU P 380 12.125 -5.188 9.787 1.00 0.00 O ATOM 0 H GLU P 380 8.926 -4.627 4.694 1.00 0.00 H new ATOM 0 HA GLU P 380 10.397 -3.659 6.937 1.00 0.00 H new ATOM 0 HB2 GLU P 380 10.894 -6.303 6.534 1.00 0.00 H new ATOM 0 HB3 GLU P 380 12.029 -5.617 5.388 1.00 0.00 H new ATOM 0 HG2 GLU P 380 13.441 -5.454 7.135 1.00 0.00 H new ATOM 0 HG3 GLU P 380 12.497 -4.056 7.608 1.00 0.00 H new ATOM 1310 N SER P 381 10.887 -3.804 3.677 1.00 0.00 N ATOM 1311 CA SER P 381 11.359 -3.035 2.531 1.00 0.00 C ATOM 1312 C SER P 381 10.728 -1.647 2.531 1.00 0.00 C ATOM 1313 O SER P 381 11.424 -0.639 2.416 1.00 0.00 O ATOM 1314 CB SER P 381 11.033 -3.762 1.226 1.00 0.00 C ATOM 1315 OG SER P 381 12.053 -4.685 0.887 1.00 0.00 O ATOM 0 H SER P 381 10.437 -4.687 3.438 1.00 0.00 H new ATOM 0 HA SER P 381 12.441 -2.930 2.608 1.00 0.00 H new ATOM 0 HB2 SER P 381 10.083 -4.286 1.326 1.00 0.00 H new ATOM 0 HB3 SER P 381 10.913 -3.036 0.422 1.00 0.00 H new ATOM 0 HG SER P 381 11.819 -5.138 0.050 1.00 0.00 H new ATOM 1321 N THR P 382 9.408 -1.606 2.681 1.00 0.00 N ATOM 1322 CA THR P 382 8.679 -0.342 2.718 1.00 0.00 C ATOM 1323 C THR P 382 9.209 0.537 3.843 1.00 0.00 C ATOM 1324 O THR P 382 9.281 1.758 3.718 1.00 0.00 O ATOM 1325 CB THR P 382 7.182 -0.600 2.919 1.00 0.00 C ATOM 1326 OG1 THR P 382 6.615 -1.179 1.761 1.00 0.00 O ATOM 1327 CG2 THR P 382 6.389 0.651 3.243 1.00 0.00 C ATOM 0 H THR P 382 8.820 -2.434 2.779 1.00 0.00 H new ATOM 0 HA THR P 382 8.825 0.172 1.768 1.00 0.00 H new ATOM 0 HB THR P 382 7.121 -1.276 3.772 1.00 0.00 H new ATOM 0 HG1 THR P 382 5.988 -1.886 2.022 1.00 0.00 H new ATOM 0 HG21 THR P 382 5.338 0.392 3.372 1.00 0.00 H new ATOM 0 HG22 THR P 382 6.769 1.095 4.163 1.00 0.00 H new ATOM 0 HG23 THR P 382 6.489 1.367 2.427 1.00 0.00 H new ATOM 1335 N LYS P 383 9.573 -0.102 4.946 1.00 0.00 N ATOM 1336 CA LYS P 383 10.092 0.603 6.106 1.00 0.00 C ATOM 1337 C LYS P 383 11.432 1.260 5.792 1.00 0.00 C ATOM 1338 O LYS P 383 11.747 2.330 6.312 1.00 0.00 O ATOM 1339 CB LYS P 383 10.237 -0.362 7.278 1.00 0.00 C ATOM 1340 CG LYS P 383 8.915 -0.678 7.955 1.00 0.00 C ATOM 1341 CD LYS P 383 8.987 -1.959 8.774 1.00 0.00 C ATOM 1342 CE LYS P 383 10.115 -1.919 9.794 1.00 0.00 C ATOM 1343 NZ LYS P 383 10.444 -3.274 10.314 1.00 0.00 N ATOM 0 H LYS P 383 9.517 -1.114 5.060 1.00 0.00 H new ATOM 0 HA LYS P 383 9.387 1.389 6.376 1.00 0.00 H new ATOM 0 HB2 LYS P 383 10.688 -1.289 6.924 1.00 0.00 H new ATOM 0 HB3 LYS P 383 10.921 0.066 8.011 1.00 0.00 H new ATOM 0 HG2 LYS P 383 8.632 0.151 8.603 1.00 0.00 H new ATOM 0 HG3 LYS P 383 8.135 -0.773 7.200 1.00 0.00 H new ATOM 0 HD2 LYS P 383 8.038 -2.115 9.288 1.00 0.00 H new ATOM 0 HD3 LYS P 383 9.131 -2.809 8.107 1.00 0.00 H new ATOM 0 HE2 LYS P 383 11.002 -1.481 9.337 1.00 0.00 H new ATOM 0 HE3 LYS P 383 9.831 -1.271 10.623 1.00 0.00 H new ATOM 0 HZ1 LYS P 383 10.666 -3.212 11.328 1.00 0.00 H new ATOM 0 HZ2 LYS P 383 9.630 -3.906 10.176 1.00 0.00 H new ATOM 0 HZ3 LYS P 383 11.266 -3.652 9.802 1.00 0.00 H new ATOM 1357 N ARG P 384 12.217 0.615 4.932 1.00 0.00 N ATOM 1358 CA ARG P 384 13.521 1.142 4.544 1.00 0.00 C ATOM 1359 C ARG P 384 13.383 2.549 3.972 1.00 0.00 C ATOM 1360 O ARG P 384 14.298 3.366 4.072 1.00 0.00 O ATOM 1361 CB ARG P 384 14.181 0.222 3.515 1.00 0.00 C ATOM 1362 CG ARG P 384 14.309 -1.220 3.981 1.00 0.00 C ATOM 1363 CD ARG P 384 15.724 -1.541 4.436 1.00 0.00 C ATOM 1364 NE ARG P 384 16.241 -2.751 3.801 1.00 0.00 N ATOM 1365 CZ ARG P 384 16.468 -2.862 2.493 1.00 0.00 C ATOM 1366 NH1 ARG P 384 16.225 -1.842 1.682 1.00 0.00 N ATOM 1367 NH2 ARG P 384 16.939 -3.998 1.999 1.00 0.00 N ATOM 0 H ARG P 384 11.972 -0.272 4.492 1.00 0.00 H new ATOM 0 HA ARG P 384 14.150 1.187 5.433 1.00 0.00 H new ATOM 0 HB2 ARG P 384 13.601 0.247 2.593 1.00 0.00 H new ATOM 0 HB3 ARG P 384 15.173 0.608 3.278 1.00 0.00 H new ATOM 0 HG2 ARG P 384 13.614 -1.401 4.801 1.00 0.00 H new ATOM 0 HG3 ARG P 384 14.027 -1.891 3.170 1.00 0.00 H new ATOM 0 HD2 ARG P 384 16.379 -0.701 4.204 1.00 0.00 H new ATOM 0 HD3 ARG P 384 15.737 -1.666 5.519 1.00 0.00 H new ATOM 0 HE ARG P 384 16.440 -3.557 4.393 1.00 0.00 H new ATOM 0 HH11 ARG P 384 15.862 -0.966 2.059 1.00 0.00 H new ATOM 0 HH12 ARG P 384 16.401 -1.933 0.681 1.00 0.00 H new ATOM 0 HH21 ARG P 384 17.127 -4.785 2.620 1.00 0.00 H new ATOM 0 HH22 ARG P 384 17.114 -4.085 0.998 1.00 0.00 H new ATOM 1381 N LYS P 385 12.226 2.826 3.377 1.00 0.00 N ATOM 1382 CA LYS P 385 11.954 4.133 2.792 1.00 0.00 C ATOM 1383 C LYS P 385 11.534 5.140 3.866 1.00 0.00 C ATOM 1384 O LYS P 385 11.416 6.335 3.596 1.00 0.00 O ATOM 1385 CB LYS P 385 10.855 4.015 1.734 1.00 0.00 C ATOM 1386 CG LYS P 385 11.209 3.079 0.589 1.00 0.00 C ATOM 1387 CD LYS P 385 10.988 1.625 0.965 1.00 0.00 C ATOM 1388 CE LYS P 385 10.527 0.804 -0.228 1.00 0.00 C ATOM 1389 NZ LYS P 385 11.538 0.796 -1.321 1.00 0.00 N ATOM 0 H LYS P 385 11.460 2.159 3.288 1.00 0.00 H new ATOM 0 HA LYS P 385 12.871 4.492 2.324 1.00 0.00 H new ATOM 0 HB2 LYS P 385 9.940 3.663 2.210 1.00 0.00 H new ATOM 0 HB3 LYS P 385 10.643 5.005 1.330 1.00 0.00 H new ATOM 0 HG2 LYS P 385 10.604 3.326 -0.283 1.00 0.00 H new ATOM 0 HG3 LYS P 385 12.251 3.228 0.306 1.00 0.00 H new ATOM 0 HD2 LYS P 385 11.913 1.206 1.360 1.00 0.00 H new ATOM 0 HD3 LYS P 385 10.245 1.563 1.760 1.00 0.00 H new ATOM 0 HE2 LYS P 385 10.329 -0.219 0.091 1.00 0.00 H new ATOM 0 HE3 LYS P 385 9.588 1.208 -0.605 1.00 0.00 H new ATOM 0 HZ1 LYS P 385 11.216 0.171 -2.087 1.00 0.00 H new ATOM 0 HZ2 LYS P 385 11.659 1.761 -1.689 1.00 0.00 H new ATOM 0 HZ3 LYS P 385 12.446 0.450 -0.951 1.00 0.00 H new ATOM 1403 N LEU P 386 11.308 4.646 5.080 1.00 0.00 N ATOM 1404 CA LEU P 386 10.899 5.494 6.196 1.00 0.00 C ATOM 1405 C LEU P 386 11.635 5.104 7.473 1.00 0.00 C ATOM 1406 O LEU P 386 11.084 5.186 8.570 1.00 0.00 O ATOM 1407 CB LEU P 386 9.384 5.397 6.413 1.00 0.00 C ATOM 1408 CG LEU P 386 8.751 4.059 6.011 1.00 0.00 C ATOM 1409 CD1 LEU P 386 8.030 3.432 7.189 1.00 0.00 C ATOM 1410 CD2 LEU P 386 7.800 4.246 4.837 1.00 0.00 C ATOM 0 H LEU P 386 11.402 3.658 5.317 1.00 0.00 H new ATOM 0 HA LEU P 386 11.157 6.524 5.950 1.00 0.00 H new ATOM 0 HB2 LEU P 386 9.172 5.579 7.466 1.00 0.00 H new ATOM 0 HB3 LEU P 386 8.900 6.194 5.848 1.00 0.00 H new ATOM 0 HG LEU P 386 9.548 3.384 5.701 1.00 0.00 H new ATOM 0 HD11 LEU P 386 7.588 2.484 6.882 1.00 0.00 H new ATOM 0 HD12 LEU P 386 8.739 3.257 7.998 1.00 0.00 H new ATOM 0 HD13 LEU P 386 7.244 4.104 7.534 1.00 0.00 H new ATOM 0 HD21 LEU P 386 7.362 3.285 4.567 1.00 0.00 H new ATOM 0 HD22 LEU P 386 7.008 4.940 5.117 1.00 0.00 H new ATOM 0 HD23 LEU P 386 8.349 4.646 3.985 1.00 0.00 H new