USER MOD reduce.3.24.130724 H: found=0, std=0, add=733, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 739 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: S 471 THR OG1 : rot 63:sc= 1.1 USER MOD Set 1.2: S 472 GLN : amide:sc= 0.431 K(o=1.5,f=-4.4!) USER MOD Set 2.1: P 381 SER OG : rot 171:sc= -0.901 USER MOD Set 2.2: P 385 LYS NZ :NH3+ -113:sc= 0.829 (180deg=-2.51!) USER MOD Single : P 359 SER OG : rot 32:sc= 0.384 USER MOD Single : P 360 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 362 GLN : amide:sc= -0.577 K(o=-0.58,f=-2.3!) USER MOD Single : P 370 SER OG : rot 180:sc= 0 USER MOD Single : P 376 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : P 378 CYS SG : rot -118:sc= -7.71 USER MOD Single : P 379 SER OG : rot 180:sc= 0 USER MOD Single : P 382 THR OG1 : rot 176:sc= -6.75! USER MOD Single : P 383 LYS NZ :NH3+ -147:sc= 0.743 (180deg=0.19) USER MOD Single : P 388 SER OG : rot 180:sc= 0 USER MOD Single : S 455 GLN : amide:sc= -0.0747 K(o=-0.075,f=-1.9!) USER MOD Single : S 457 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 458 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 460 SER OG : rot 180:sc= 0 USER MOD Single : S 461 GLN : amide:sc= -4.38 K(o=-4.4,f=-3.2!) USER MOD Single : S 467 SER OG : rot 180:sc= 0.0266 USER MOD Single : S 468 TYR OH : rot -7:sc= 0.0581 USER MOD Single : S 479 GLN : amide:sc= -0.0801 K(o=-0.08,f=-0.73) USER MOD Single : S 488 SER OG : rot 180:sc= 0 USER MOD Single : S 489 LYS NZ :NH3+ -164:sc= -0.0116 (180deg=-0.145) USER MOD Single : S 491 ASN : amide:sc= -5.85! C(o=-5.9!,f=-20!) USER MOD Single : S 499 SER OG : rot 180:sc= 0 USER MOD Single : S 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 502 LYS NZ :NH3+ -153:sc= -0.413 (180deg=-1.52!) USER MOD Single : S 508 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 514 SER OG : rot 180:sc= 0 USER MOD Single : S 516 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN S 455 1.608 -18.668 10.558 1.00 0.00 N ATOM 2 CA GLN S 455 2.930 -17.993 10.498 1.00 0.00 C ATOM 3 C GLN S 455 3.174 -17.377 9.124 1.00 0.00 C ATOM 4 O GLN S 455 2.318 -17.445 8.241 1.00 0.00 O ATOM 5 CB GLN S 455 4.017 -19.022 10.815 1.00 0.00 C ATOM 6 CG GLN S 455 4.260 -19.212 12.302 1.00 0.00 C ATOM 7 CD GLN S 455 4.947 -20.526 12.618 1.00 0.00 C ATOM 8 OE1 GLN S 455 4.986 -21.436 11.789 1.00 0.00 O ATOM 9 NE2 GLN S 455 5.496 -20.632 13.823 1.00 0.00 N ATOM 0 HA GLN S 455 2.952 -17.184 11.228 1.00 0.00 H new ATOM 0 HB2 GLN S 455 3.738 -19.980 10.376 1.00 0.00 H new ATOM 0 HB3 GLN S 455 4.948 -18.713 10.340 1.00 0.00 H new ATOM 0 HG2 GLN S 455 4.870 -18.389 12.675 1.00 0.00 H new ATOM 0 HG3 GLN S 455 3.308 -19.168 12.830 1.00 0.00 H new ATOM 0 HE21 GLN S 455 5.440 -19.853 14.479 1.00 0.00 H new ATOM 0 HE22 GLN S 455 5.973 -21.492 14.092 1.00 0.00 H new ATOM 20 N LEU S 456 4.347 -16.777 8.949 1.00 0.00 N ATOM 21 CA LEU S 456 4.703 -16.150 7.682 1.00 0.00 C ATOM 22 C LEU S 456 3.721 -15.038 7.330 1.00 0.00 C ATOM 23 O LEU S 456 2.753 -14.798 8.052 1.00 0.00 O ATOM 24 CB LEU S 456 4.734 -17.193 6.564 1.00 0.00 C ATOM 25 CG LEU S 456 6.068 -17.921 6.396 1.00 0.00 C ATOM 26 CD1 LEU S 456 5.840 -19.347 5.914 1.00 0.00 C ATOM 27 CD2 LEU S 456 6.967 -17.168 5.428 1.00 0.00 C ATOM 0 H LEU S 456 5.067 -16.712 9.669 1.00 0.00 H new ATOM 0 HA LEU S 456 5.696 -15.712 7.788 1.00 0.00 H new ATOM 0 HB2 LEU S 456 3.956 -17.932 6.755 1.00 0.00 H new ATOM 0 HB3 LEU S 456 4.484 -16.703 5.623 1.00 0.00 H new ATOM 0 HG LEU S 456 6.564 -17.961 7.366 1.00 0.00 H new ATOM 0 HD11 LEU S 456 6.800 -19.850 5.800 1.00 0.00 H new ATOM 0 HD12 LEU S 456 5.233 -19.885 6.642 1.00 0.00 H new ATOM 0 HD13 LEU S 456 5.324 -19.328 4.954 1.00 0.00 H new ATOM 0 HD21 LEU S 456 7.912 -17.700 5.320 1.00 0.00 H new ATOM 0 HD22 LEU S 456 6.477 -17.097 4.457 1.00 0.00 H new ATOM 0 HD23 LEU S 456 7.157 -16.166 5.812 1.00 0.00 H new ATOM 39 N LYS S 457 3.978 -14.359 6.216 1.00 0.00 N ATOM 40 CA LYS S 457 3.115 -13.272 5.766 1.00 0.00 C ATOM 41 C LYS S 457 2.416 -13.636 4.460 1.00 0.00 C ATOM 42 O LYS S 457 3.030 -14.197 3.552 1.00 0.00 O ATOM 43 CB LYS S 457 3.931 -11.991 5.580 1.00 0.00 C ATOM 44 CG LYS S 457 4.979 -12.090 4.484 1.00 0.00 C ATOM 45 CD LYS S 457 6.206 -11.253 4.808 1.00 0.00 C ATOM 46 CE LYS S 457 7.217 -12.041 5.623 1.00 0.00 C ATOM 47 NZ LYS S 457 8.135 -12.832 4.758 1.00 0.00 N ATOM 0 H LYS S 457 4.777 -14.542 5.609 1.00 0.00 H new ATOM 0 HA LYS S 457 2.355 -13.105 6.529 1.00 0.00 H new ATOM 0 HB2 LYS S 457 3.253 -11.169 5.350 1.00 0.00 H new ATOM 0 HB3 LYS S 457 4.423 -11.744 6.521 1.00 0.00 H new ATOM 0 HG2 LYS S 457 5.272 -13.132 4.353 1.00 0.00 H new ATOM 0 HG3 LYS S 457 4.550 -11.758 3.538 1.00 0.00 H new ATOM 0 HD2 LYS S 457 6.670 -10.912 3.883 1.00 0.00 H new ATOM 0 HD3 LYS S 457 5.905 -10.363 5.361 1.00 0.00 H new ATOM 0 HE2 LYS S 457 7.800 -11.356 6.239 1.00 0.00 H new ATOM 0 HE3 LYS S 457 6.691 -12.712 6.303 1.00 0.00 H new ATOM 0 HZ1 LYS S 457 8.809 -13.355 5.353 1.00 0.00 H new ATOM 0 HZ2 LYS S 457 7.582 -13.504 4.189 1.00 0.00 H new ATOM 0 HZ3 LYS S 457 8.656 -12.190 4.127 1.00 0.00 H new ATOM 61 N LYS S 458 1.129 -13.314 4.372 1.00 0.00 N ATOM 62 CA LYS S 458 0.348 -13.607 3.175 1.00 0.00 C ATOM 63 C LYS S 458 -0.388 -12.369 2.692 1.00 0.00 C ATOM 64 O LYS S 458 -0.374 -12.042 1.505 1.00 0.00 O ATOM 65 CB LYS S 458 -0.646 -14.742 3.454 1.00 0.00 C ATOM 66 CG LYS S 458 -1.728 -14.892 2.394 1.00 0.00 C ATOM 67 CD LYS S 458 -3.009 -14.176 2.796 1.00 0.00 C ATOM 68 CE LYS S 458 -3.741 -14.922 3.900 1.00 0.00 C ATOM 69 NZ LYS S 458 -5.071 -14.321 4.191 1.00 0.00 N ATOM 0 H LYS S 458 0.605 -12.851 5.115 1.00 0.00 H new ATOM 0 HA LYS S 458 1.034 -13.924 2.389 1.00 0.00 H new ATOM 0 HB2 LYS S 458 -0.097 -15.680 3.534 1.00 0.00 H new ATOM 0 HB3 LYS S 458 -1.120 -14.567 4.420 1.00 0.00 H new ATOM 0 HG2 LYS S 458 -1.368 -14.491 1.447 1.00 0.00 H new ATOM 0 HG3 LYS S 458 -1.937 -15.950 2.233 1.00 0.00 H new ATOM 0 HD2 LYS S 458 -2.773 -13.166 3.132 1.00 0.00 H new ATOM 0 HD3 LYS S 458 -3.660 -14.078 1.928 1.00 0.00 H new ATOM 0 HE2 LYS S 458 -3.870 -15.965 3.609 1.00 0.00 H new ATOM 0 HE3 LYS S 458 -3.134 -14.916 4.806 1.00 0.00 H new ATOM 0 HZ1 LYS S 458 -5.537 -14.859 4.949 1.00 0.00 H new ATOM 0 HZ2 LYS S 458 -4.947 -13.334 4.493 1.00 0.00 H new ATOM 0 HZ3 LYS S 458 -5.660 -14.350 3.334 1.00 0.00 H new ATOM 83 N GLY S 459 -1.022 -11.692 3.625 1.00 0.00 N ATOM 84 CA GLY S 459 -1.760 -10.497 3.306 1.00 0.00 C ATOM 85 C GLY S 459 -2.898 -10.750 2.342 1.00 0.00 C ATOM 86 O GLY S 459 -2.781 -11.561 1.423 1.00 0.00 O ATOM 0 H GLY S 459 -1.039 -11.952 4.611 1.00 0.00 H new ATOM 0 HA2 GLY S 459 -2.157 -10.065 4.224 1.00 0.00 H new ATOM 0 HA3 GLY S 459 -1.082 -9.761 2.875 1.00 0.00 H new ATOM 90 N SER S 460 -3.996 -10.041 2.551 1.00 0.00 N ATOM 91 CA SER S 460 -5.167 -10.169 1.691 1.00 0.00 C ATOM 92 C SER S 460 -4.915 -9.472 0.357 1.00 0.00 C ATOM 93 O SER S 460 -3.823 -8.959 0.123 1.00 0.00 O ATOM 94 CB SER S 460 -6.400 -9.580 2.375 1.00 0.00 C ATOM 95 OG SER S 460 -6.563 -8.208 2.056 1.00 0.00 O ATOM 0 H SER S 460 -4.103 -9.368 3.310 1.00 0.00 H new ATOM 0 HA SER S 460 -5.350 -11.227 1.505 1.00 0.00 H new ATOM 0 HB2 SER S 460 -7.287 -10.134 2.069 1.00 0.00 H new ATOM 0 HB3 SER S 460 -6.309 -9.696 3.455 1.00 0.00 H new ATOM 0 HG SER S 460 -7.361 -7.860 2.507 1.00 0.00 H new ATOM 101 N GLN S 461 -5.917 -9.455 -0.518 1.00 0.00 N ATOM 102 CA GLN S 461 -5.760 -8.812 -1.820 1.00 0.00 C ATOM 103 C GLN S 461 -7.028 -8.078 -2.247 1.00 0.00 C ATOM 104 O GLN S 461 -8.122 -8.365 -1.762 1.00 0.00 O ATOM 105 CB GLN S 461 -5.387 -9.841 -2.889 1.00 0.00 C ATOM 106 CG GLN S 461 -4.283 -10.800 -2.471 1.00 0.00 C ATOM 107 CD GLN S 461 -4.781 -12.218 -2.280 1.00 0.00 C ATOM 108 OE1 GLN S 461 -4.757 -13.028 -3.208 1.00 0.00 O ATOM 109 NE2 GLN S 461 -5.239 -12.528 -1.073 1.00 0.00 N ATOM 0 H GLN S 461 -6.833 -9.872 -0.354 1.00 0.00 H new ATOM 0 HA GLN S 461 -4.957 -8.082 -1.719 1.00 0.00 H new ATOM 0 HB2 GLN S 461 -6.275 -10.417 -3.148 1.00 0.00 H new ATOM 0 HB3 GLN S 461 -5.074 -9.315 -3.791 1.00 0.00 H new ATOM 0 HG2 GLN S 461 -3.497 -10.794 -3.226 1.00 0.00 H new ATOM 0 HG3 GLN S 461 -3.835 -10.449 -1.542 1.00 0.00 H new ATOM 0 HE21 GLN S 461 -5.241 -11.826 -0.333 1.00 0.00 H new ATOM 0 HE22 GLN S 461 -5.589 -13.468 -0.886 1.00 0.00 H new ATOM 118 N VAL S 462 -6.860 -7.132 -3.165 1.00 0.00 N ATOM 119 CA VAL S 462 -7.973 -6.344 -3.681 1.00 0.00 C ATOM 120 C VAL S 462 -7.612 -5.700 -5.011 1.00 0.00 C ATOM 121 O VAL S 462 -6.591 -5.020 -5.120 1.00 0.00 O ATOM 122 CB VAL S 462 -8.387 -5.227 -2.705 1.00 0.00 C ATOM 123 CG1 VAL S 462 -9.355 -5.756 -1.661 1.00 0.00 C ATOM 124 CG2 VAL S 462 -7.158 -4.606 -2.056 1.00 0.00 C ATOM 0 H VAL S 462 -5.955 -6.891 -3.570 1.00 0.00 H new ATOM 0 HA VAL S 462 -8.805 -7.036 -3.810 1.00 0.00 H new ATOM 0 HB VAL S 462 -8.901 -4.447 -3.267 1.00 0.00 H new ATOM 0 HG11 VAL S 462 -9.634 -4.950 -0.982 1.00 0.00 H new ATOM 0 HG12 VAL S 462 -10.248 -6.141 -2.154 1.00 0.00 H new ATOM 0 HG13 VAL S 462 -8.879 -6.558 -1.096 1.00 0.00 H new ATOM 0 HG21 VAL S 462 -7.468 -3.818 -1.369 1.00 0.00 H new ATOM 0 HG22 VAL S 462 -6.610 -5.372 -1.507 1.00 0.00 H new ATOM 0 HG23 VAL S 462 -6.514 -4.182 -2.827 1.00 0.00 H new ATOM 134 N GLU S 463 -8.454 -5.892 -6.020 1.00 0.00 N ATOM 135 CA GLU S 463 -8.204 -5.296 -7.325 1.00 0.00 C ATOM 136 C GLU S 463 -8.167 -3.775 -7.197 1.00 0.00 C ATOM 137 O GLU S 463 -8.832 -3.205 -6.332 1.00 0.00 O ATOM 138 CB GLU S 463 -9.277 -5.736 -8.332 1.00 0.00 C ATOM 139 CG GLU S 463 -10.475 -4.801 -8.417 1.00 0.00 C ATOM 140 CD GLU S 463 -11.724 -5.498 -8.922 1.00 0.00 C ATOM 141 OE1 GLU S 463 -11.782 -6.742 -8.844 1.00 0.00 O ATOM 142 OE2 GLU S 463 -12.643 -4.797 -9.397 1.00 0.00 O ATOM 0 H GLU S 463 -9.306 -6.449 -5.961 1.00 0.00 H new ATOM 0 HA GLU S 463 -7.238 -5.639 -7.695 1.00 0.00 H new ATOM 0 HB2 GLU S 463 -8.822 -5.815 -9.319 1.00 0.00 H new ATOM 0 HB3 GLU S 463 -9.627 -6.732 -8.061 1.00 0.00 H new ATOM 0 HG2 GLU S 463 -10.672 -4.379 -7.432 1.00 0.00 H new ATOM 0 HG3 GLU S 463 -10.235 -3.968 -9.078 1.00 0.00 H new ATOM 149 N ALA S 464 -7.392 -3.120 -8.052 1.00 0.00 N ATOM 150 CA ALA S 464 -7.286 -1.669 -8.009 1.00 0.00 C ATOM 151 C ALA S 464 -8.337 -1.030 -8.906 1.00 0.00 C ATOM 152 O ALA S 464 -9.075 -1.725 -9.603 1.00 0.00 O ATOM 153 CB ALA S 464 -5.891 -1.226 -8.421 1.00 0.00 C ATOM 0 H ALA S 464 -6.832 -3.567 -8.778 1.00 0.00 H new ATOM 0 HA ALA S 464 -7.463 -1.340 -6.985 1.00 0.00 H new ATOM 0 HB1 ALA S 464 -5.829 -0.138 -8.383 1.00 0.00 H new ATOM 0 HB2 ALA S 464 -5.157 -1.655 -7.739 1.00 0.00 H new ATOM 0 HB3 ALA S 464 -5.686 -1.566 -9.436 1.00 0.00 H new ATOM 159 N LEU S 465 -8.413 0.293 -8.874 1.00 0.00 N ATOM 160 CA LEU S 465 -9.393 1.013 -9.682 1.00 0.00 C ATOM 161 C LEU S 465 -8.832 2.317 -10.251 1.00 0.00 C ATOM 162 O LEU S 465 -9.502 2.994 -11.032 1.00 0.00 O ATOM 163 CB LEU S 465 -10.628 1.315 -8.842 1.00 0.00 C ATOM 164 CG LEU S 465 -11.227 0.108 -8.119 1.00 0.00 C ATOM 165 CD1 LEU S 465 -10.382 -0.267 -6.913 1.00 0.00 C ATOM 166 CD2 LEU S 465 -12.664 0.393 -7.704 1.00 0.00 C ATOM 0 H LEU S 465 -7.813 0.888 -8.302 1.00 0.00 H new ATOM 0 HA LEU S 465 -9.655 0.372 -10.524 1.00 0.00 H new ATOM 0 HB2 LEU S 465 -10.369 2.072 -8.102 1.00 0.00 H new ATOM 0 HB3 LEU S 465 -11.391 1.749 -9.488 1.00 0.00 H new ATOM 0 HG LEU S 465 -11.232 -0.738 -8.807 1.00 0.00 H new ATOM 0 HD11 LEU S 465 -10.825 -1.128 -6.412 1.00 0.00 H new ATOM 0 HD12 LEU S 465 -9.372 -0.517 -7.240 1.00 0.00 H new ATOM 0 HD13 LEU S 465 -10.342 0.574 -6.221 1.00 0.00 H new ATOM 0 HD21 LEU S 465 -13.074 -0.477 -7.191 1.00 0.00 H new ATOM 0 HD22 LEU S 465 -12.686 1.253 -7.034 1.00 0.00 H new ATOM 0 HD23 LEU S 465 -13.263 0.608 -8.589 1.00 0.00 H new ATOM 178 N PHE S 466 -7.616 2.677 -9.858 1.00 0.00 N ATOM 179 CA PHE S 466 -7.001 3.908 -10.334 1.00 0.00 C ATOM 180 C PHE S 466 -5.499 3.759 -10.510 1.00 0.00 C ATOM 181 O PHE S 466 -4.896 2.781 -10.068 1.00 0.00 O ATOM 182 CB PHE S 466 -7.249 5.039 -9.340 1.00 0.00 C ATOM 183 CG PHE S 466 -8.685 5.234 -8.972 1.00 0.00 C ATOM 184 CD1 PHE S 466 -9.541 5.908 -9.822 1.00 0.00 C ATOM 185 CD2 PHE S 466 -9.171 4.760 -7.765 1.00 0.00 C ATOM 186 CE1 PHE S 466 -10.859 6.111 -9.474 1.00 0.00 C ATOM 187 CE2 PHE S 466 -10.489 4.954 -7.413 1.00 0.00 C ATOM 188 CZ PHE S 466 -11.333 5.635 -8.270 1.00 0.00 C ATOM 0 H PHE S 466 -7.039 2.136 -9.214 1.00 0.00 H new ATOM 0 HA PHE S 466 -7.453 4.135 -11.300 1.00 0.00 H new ATOM 0 HB2 PHE S 466 -6.678 4.841 -8.433 1.00 0.00 H new ATOM 0 HB3 PHE S 466 -6.865 5.968 -9.762 1.00 0.00 H new ATOM 0 HD1 PHE S 466 -9.174 6.279 -10.768 1.00 0.00 H new ATOM 0 HD2 PHE S 466 -8.510 4.233 -7.093 1.00 0.00 H new ATOM 0 HE1 PHE S 466 -11.519 6.642 -10.143 1.00 0.00 H new ATOM 0 HE2 PHE S 466 -10.861 4.576 -6.472 1.00 0.00 H new ATOM 0 HZ PHE S 466 -12.365 5.794 -7.996 1.00 0.00 H new ATOM 198 N SER S 467 -4.899 4.772 -11.120 1.00 0.00 N ATOM 199 CA SER S 467 -3.463 4.807 -11.320 1.00 0.00 C ATOM 200 C SER S 467 -2.855 5.757 -10.301 1.00 0.00 C ATOM 201 O SER S 467 -2.925 6.978 -10.450 1.00 0.00 O ATOM 202 CB SER S 467 -3.120 5.257 -12.743 1.00 0.00 C ATOM 203 OG SER S 467 -3.753 4.432 -13.705 1.00 0.00 O ATOM 0 H SER S 467 -5.393 5.586 -11.487 1.00 0.00 H new ATOM 0 HA SER S 467 -3.053 3.806 -11.185 1.00 0.00 H new ATOM 0 HB2 SER S 467 -3.431 6.292 -12.886 1.00 0.00 H new ATOM 0 HB3 SER S 467 -2.040 5.226 -12.887 1.00 0.00 H new ATOM 0 HG SER S 467 -3.520 4.741 -14.605 1.00 0.00 H new ATOM 209 N TYR S 468 -2.298 5.189 -9.245 1.00 0.00 N ATOM 210 CA TYR S 468 -1.716 5.976 -8.169 1.00 0.00 C ATOM 211 C TYR S 468 -0.334 6.493 -8.538 1.00 0.00 C ATOM 212 O TYR S 468 0.576 5.719 -8.829 1.00 0.00 O ATOM 213 CB TYR S 468 -1.639 5.118 -6.903 1.00 0.00 C ATOM 214 CG TYR S 468 -1.058 5.826 -5.699 1.00 0.00 C ATOM 215 CD1 TYR S 468 0.267 6.248 -5.679 1.00 0.00 C ATOM 216 CD2 TYR S 468 -1.837 6.059 -4.577 1.00 0.00 C ATOM 217 CE1 TYR S 468 0.794 6.886 -4.575 1.00 0.00 C ATOM 218 CE2 TYR S 468 -1.317 6.698 -3.470 1.00 0.00 C ATOM 219 CZ TYR S 468 -0.002 7.109 -3.473 1.00 0.00 C ATOM 220 OH TYR S 468 0.519 7.745 -2.369 1.00 0.00 O ATOM 0 H TYR S 468 -2.236 4.180 -9.109 1.00 0.00 H new ATOM 0 HA TYR S 468 -2.352 6.843 -7.992 1.00 0.00 H new ATOM 0 HB2 TYR S 468 -2.641 4.769 -6.655 1.00 0.00 H new ATOM 0 HB3 TYR S 468 -1.037 4.234 -7.114 1.00 0.00 H new ATOM 0 HD1 TYR S 468 0.893 6.074 -6.541 1.00 0.00 H new ATOM 0 HD2 TYR S 468 -2.867 5.735 -4.569 1.00 0.00 H new ATOM 0 HE1 TYR S 468 1.825 7.209 -4.575 1.00 0.00 H new ATOM 0 HE2 TYR S 468 -1.938 6.875 -2.605 1.00 0.00 H new ATOM 0 HH TYR S 468 1.484 7.868 -2.487 1.00 0.00 H new ATOM 230 N GLU S 469 -0.181 7.815 -8.501 1.00 0.00 N ATOM 231 CA GLU S 469 1.095 8.444 -8.808 1.00 0.00 C ATOM 232 C GLU S 469 2.010 8.365 -7.596 1.00 0.00 C ATOM 233 O GLU S 469 1.773 9.017 -6.580 1.00 0.00 O ATOM 234 CB GLU S 469 0.891 9.902 -9.220 1.00 0.00 C ATOM 235 CG GLU S 469 1.843 10.363 -10.309 1.00 0.00 C ATOM 236 CD GLU S 469 1.287 11.518 -11.120 1.00 0.00 C ATOM 237 OE1 GLU S 469 0.375 12.209 -10.620 1.00 0.00 O ATOM 238 OE2 GLU S 469 1.764 11.731 -12.254 1.00 0.00 O ATOM 0 H GLU S 469 -0.927 8.468 -8.261 1.00 0.00 H new ATOM 0 HA GLU S 469 1.556 7.914 -9.641 1.00 0.00 H new ATOM 0 HB2 GLU S 469 -0.134 10.033 -9.565 1.00 0.00 H new ATOM 0 HB3 GLU S 469 1.017 10.539 -8.345 1.00 0.00 H new ATOM 0 HG2 GLU S 469 2.788 10.663 -9.857 1.00 0.00 H new ATOM 0 HG3 GLU S 469 2.059 9.528 -10.975 1.00 0.00 H new ATOM 245 N ALA S 470 3.047 7.547 -7.703 1.00 0.00 N ATOM 246 CA ALA S 470 3.988 7.363 -6.609 1.00 0.00 C ATOM 247 C ALA S 470 5.062 8.444 -6.602 1.00 0.00 C ATOM 248 O ALA S 470 5.954 8.456 -7.451 1.00 0.00 O ATOM 249 CB ALA S 470 4.618 5.981 -6.691 1.00 0.00 C ATOM 0 H ALA S 470 3.258 7.000 -8.538 1.00 0.00 H new ATOM 0 HA ALA S 470 3.436 7.448 -5.673 1.00 0.00 H new ATOM 0 HB1 ALA S 470 5.321 5.852 -5.868 1.00 0.00 H new ATOM 0 HB2 ALA S 470 3.839 5.222 -6.625 1.00 0.00 H new ATOM 0 HB3 ALA S 470 5.146 5.878 -7.639 1.00 0.00 H new ATOM 255 N THR S 471 4.971 9.345 -5.631 1.00 0.00 N ATOM 256 CA THR S 471 5.935 10.431 -5.497 1.00 0.00 C ATOM 257 C THR S 471 6.965 10.097 -4.422 1.00 0.00 C ATOM 258 O THR S 471 8.115 10.528 -4.493 1.00 0.00 O ATOM 259 CB THR S 471 5.222 11.738 -5.152 1.00 0.00 C ATOM 260 OG1 THR S 471 4.097 11.494 -4.325 1.00 0.00 O ATOM 261 CG2 THR S 471 4.740 12.496 -6.370 1.00 0.00 C ATOM 0 H THR S 471 4.237 9.345 -4.923 1.00 0.00 H new ATOM 0 HA THR S 471 6.449 10.554 -6.450 1.00 0.00 H new ATOM 0 HB THR S 471 5.966 12.345 -4.637 1.00 0.00 H new ATOM 0 HG1 THR S 471 4.394 11.110 -3.474 1.00 0.00 H new ATOM 0 HG21 THR S 471 4.243 13.413 -6.055 1.00 0.00 H new ATOM 0 HG22 THR S 471 5.591 12.744 -7.004 1.00 0.00 H new ATOM 0 HG23 THR S 471 4.038 11.877 -6.929 1.00 0.00 H new ATOM 269 N GLN S 472 6.542 9.315 -3.432 1.00 0.00 N ATOM 270 CA GLN S 472 7.428 8.909 -2.347 1.00 0.00 C ATOM 271 C GLN S 472 7.857 7.452 -2.520 1.00 0.00 C ATOM 272 O GLN S 472 7.225 6.694 -3.255 1.00 0.00 O ATOM 273 CB GLN S 472 6.758 9.109 -0.980 1.00 0.00 C ATOM 274 CG GLN S 472 5.242 8.969 -0.999 1.00 0.00 C ATOM 275 CD GLN S 472 4.538 10.295 -1.207 1.00 0.00 C ATOM 276 OE1 GLN S 472 3.708 10.437 -2.104 1.00 0.00 O ATOM 277 NE2 GLN S 472 4.868 11.277 -0.375 1.00 0.00 N ATOM 0 H GLN S 472 5.592 8.951 -3.360 1.00 0.00 H new ATOM 0 HA GLN S 472 8.315 9.542 -2.386 1.00 0.00 H new ATOM 0 HB2 GLN S 472 7.169 8.384 -0.277 1.00 0.00 H new ATOM 0 HB3 GLN S 472 7.015 10.099 -0.604 1.00 0.00 H new ATOM 0 HG2 GLN S 472 4.954 8.280 -1.793 1.00 0.00 H new ATOM 0 HG3 GLN S 472 4.909 8.529 -0.059 1.00 0.00 H new ATOM 0 HE21 GLN S 472 5.562 11.115 0.355 1.00 0.00 H new ATOM 0 HE22 GLN S 472 4.428 12.192 -0.466 1.00 0.00 H new ATOM 286 N PRO S 473 8.954 7.050 -1.857 1.00 0.00 N ATOM 287 CA PRO S 473 9.485 5.683 -1.955 1.00 0.00 C ATOM 288 C PRO S 473 8.514 4.614 -1.448 1.00 0.00 C ATOM 289 O PRO S 473 7.981 3.830 -2.233 1.00 0.00 O ATOM 290 CB PRO S 473 10.746 5.718 -1.083 1.00 0.00 C ATOM 291 CG PRO S 473 10.585 6.907 -0.198 1.00 0.00 C ATOM 292 CD PRO S 473 9.774 7.900 -0.978 1.00 0.00 C ATOM 0 HA PRO S 473 9.671 5.410 -2.994 1.00 0.00 H new ATOM 0 HB2 PRO S 473 10.844 4.804 -0.498 1.00 0.00 H new ATOM 0 HB3 PRO S 473 11.644 5.803 -1.695 1.00 0.00 H new ATOM 0 HG2 PRO S 473 10.082 6.636 0.730 1.00 0.00 H new ATOM 0 HG3 PRO S 473 11.554 7.324 0.075 1.00 0.00 H new ATOM 0 HD2 PRO S 473 9.157 8.517 -0.325 1.00 0.00 H new ATOM 0 HD3 PRO S 473 10.408 8.577 -1.550 1.00 0.00 H new ATOM 300 N GLU S 474 8.308 4.570 -0.132 1.00 0.00 N ATOM 301 CA GLU S 474 7.421 3.577 0.476 1.00 0.00 C ATOM 302 C GLU S 474 6.101 3.436 -0.283 1.00 0.00 C ATOM 303 O GLU S 474 5.541 2.344 -0.366 1.00 0.00 O ATOM 304 CB GLU S 474 7.149 3.928 1.943 1.00 0.00 C ATOM 305 CG GLU S 474 6.196 5.096 2.135 1.00 0.00 C ATOM 306 CD GLU S 474 6.810 6.423 1.737 1.00 0.00 C ATOM 307 OE1 GLU S 474 8.055 6.508 1.678 1.00 0.00 O ATOM 308 OE2 GLU S 474 6.047 7.379 1.485 1.00 0.00 O ATOM 0 H GLU S 474 8.742 5.209 0.533 1.00 0.00 H new ATOM 0 HA GLU S 474 7.933 2.616 0.423 1.00 0.00 H new ATOM 0 HB2 GLU S 474 6.739 3.052 2.445 1.00 0.00 H new ATOM 0 HB3 GLU S 474 8.095 4.161 2.431 1.00 0.00 H new ATOM 0 HG2 GLU S 474 5.295 4.926 1.545 1.00 0.00 H new ATOM 0 HG3 GLU S 474 5.889 5.141 3.180 1.00 0.00 H new ATOM 315 N ASP S 475 5.604 4.542 -0.832 1.00 0.00 N ATOM 316 CA ASP S 475 4.353 4.522 -1.573 1.00 0.00 C ATOM 317 C ASP S 475 4.435 3.580 -2.768 1.00 0.00 C ATOM 318 O ASP S 475 5.245 3.775 -3.674 1.00 0.00 O ATOM 319 CB ASP S 475 4.003 5.932 -2.045 1.00 0.00 C ATOM 320 CG ASP S 475 3.162 6.692 -1.038 1.00 0.00 C ATOM 321 OD1 ASP S 475 2.890 6.139 0.050 1.00 0.00 O ATOM 322 OD2 ASP S 475 2.774 7.842 -1.336 1.00 0.00 O ATOM 0 H ASP S 475 6.049 5.458 -0.776 1.00 0.00 H new ATOM 0 HA ASP S 475 3.571 4.158 -0.907 1.00 0.00 H new ATOM 0 HB2 ASP S 475 4.922 6.486 -2.237 1.00 0.00 H new ATOM 0 HB3 ASP S 475 3.464 5.871 -2.991 1.00 0.00 H new ATOM 327 N LEU S 476 3.580 2.564 -2.767 1.00 0.00 N ATOM 328 CA LEU S 476 3.541 1.594 -3.851 1.00 0.00 C ATOM 329 C LEU S 476 2.770 2.167 -5.036 1.00 0.00 C ATOM 330 O LEU S 476 1.597 2.523 -4.912 1.00 0.00 O ATOM 331 CB LEU S 476 2.899 0.283 -3.372 1.00 0.00 C ATOM 332 CG LEU S 476 2.305 -0.602 -4.473 1.00 0.00 C ATOM 333 CD1 LEU S 476 3.341 -0.884 -5.549 1.00 0.00 C ATOM 334 CD2 LEU S 476 1.773 -1.900 -3.893 1.00 0.00 C ATOM 0 H LEU S 476 2.903 2.392 -2.024 1.00 0.00 H new ATOM 0 HA LEU S 476 4.561 1.379 -4.169 1.00 0.00 H new ATOM 0 HB2 LEU S 476 3.651 -0.293 -2.833 1.00 0.00 H new ATOM 0 HB3 LEU S 476 2.111 0.524 -2.659 1.00 0.00 H new ATOM 0 HG LEU S 476 1.472 -0.066 -4.928 1.00 0.00 H new ATOM 0 HD11 LEU S 476 2.901 -1.514 -6.322 1.00 0.00 H new ATOM 0 HD12 LEU S 476 3.671 0.056 -5.991 1.00 0.00 H new ATOM 0 HD13 LEU S 476 4.195 -1.397 -5.106 1.00 0.00 H new ATOM 0 HD21 LEU S 476 1.356 -2.512 -4.693 1.00 0.00 H new ATOM 0 HD22 LEU S 476 2.585 -2.441 -3.407 1.00 0.00 H new ATOM 0 HD23 LEU S 476 0.995 -1.680 -3.162 1.00 0.00 H new ATOM 346 N GLU S 477 3.437 2.261 -6.178 1.00 0.00 N ATOM 347 CA GLU S 477 2.820 2.796 -7.384 1.00 0.00 C ATOM 348 C GLU S 477 2.091 1.698 -8.151 1.00 0.00 C ATOM 349 O GLU S 477 2.577 0.573 -8.249 1.00 0.00 O ATOM 350 CB GLU S 477 3.880 3.428 -8.287 1.00 0.00 C ATOM 351 CG GLU S 477 3.377 4.629 -9.069 1.00 0.00 C ATOM 352 CD GLU S 477 2.696 4.235 -10.365 1.00 0.00 C ATOM 353 OE1 GLU S 477 1.479 3.957 -10.336 1.00 0.00 O ATOM 354 OE2 GLU S 477 3.380 4.205 -11.410 1.00 0.00 O ATOM 0 H GLU S 477 4.408 1.973 -6.295 1.00 0.00 H new ATOM 0 HA GLU S 477 2.099 3.557 -7.084 1.00 0.00 H new ATOM 0 HB2 GLU S 477 4.730 3.733 -7.677 1.00 0.00 H new ATOM 0 HB3 GLU S 477 4.244 2.676 -8.987 1.00 0.00 H new ATOM 0 HG2 GLU S 477 2.678 5.193 -8.452 1.00 0.00 H new ATOM 0 HG3 GLU S 477 4.214 5.292 -9.289 1.00 0.00 H new ATOM 361 N PHE S 478 0.927 2.031 -8.696 1.00 0.00 N ATOM 362 CA PHE S 478 0.146 1.060 -9.457 1.00 0.00 C ATOM 363 C PHE S 478 -0.872 1.747 -10.362 1.00 0.00 C ATOM 364 O PHE S 478 -1.269 2.887 -10.117 1.00 0.00 O ATOM 365 CB PHE S 478 -0.567 0.092 -8.512 1.00 0.00 C ATOM 366 CG PHE S 478 -1.298 0.775 -7.392 1.00 0.00 C ATOM 367 CD1 PHE S 478 -0.599 1.344 -6.340 1.00 0.00 C ATOM 368 CD2 PHE S 478 -2.680 0.846 -7.392 1.00 0.00 C ATOM 369 CE1 PHE S 478 -1.268 1.974 -5.309 1.00 0.00 C ATOM 370 CE2 PHE S 478 -3.354 1.474 -6.362 1.00 0.00 C ATOM 371 CZ PHE S 478 -2.647 2.038 -5.318 1.00 0.00 C ATOM 0 H PHE S 478 0.505 2.957 -8.627 1.00 0.00 H new ATOM 0 HA PHE S 478 0.838 0.502 -10.088 1.00 0.00 H new ATOM 0 HB2 PHE S 478 -1.275 -0.507 -9.085 1.00 0.00 H new ATOM 0 HB3 PHE S 478 0.165 -0.597 -8.090 1.00 0.00 H new ATOM 0 HD1 PHE S 478 0.480 1.294 -6.326 1.00 0.00 H new ATOM 0 HD2 PHE S 478 -3.238 0.406 -8.206 1.00 0.00 H new ATOM 0 HE1 PHE S 478 -0.712 2.417 -4.496 1.00 0.00 H new ATOM 0 HE2 PHE S 478 -4.433 1.524 -6.373 1.00 0.00 H new ATOM 0 HZ PHE S 478 -3.172 2.528 -4.511 1.00 0.00 H new ATOM 381 N GLN S 479 -1.288 1.041 -11.408 1.00 0.00 N ATOM 382 CA GLN S 479 -2.262 1.571 -12.355 1.00 0.00 C ATOM 383 C GLN S 479 -3.680 1.192 -11.940 1.00 0.00 C ATOM 384 O GLN S 479 -3.879 0.476 -10.959 1.00 0.00 O ATOM 385 CB GLN S 479 -1.973 1.045 -13.763 1.00 0.00 C ATOM 386 CG GLN S 479 -2.043 -0.468 -13.875 1.00 0.00 C ATOM 387 CD GLN S 479 -0.915 -1.045 -14.706 1.00 0.00 C ATOM 388 OE1 GLN S 479 -0.371 -0.376 -15.585 1.00 0.00 O ATOM 389 NE2 GLN S 479 -0.557 -2.295 -14.434 1.00 0.00 N ATOM 0 H GLN S 479 -0.965 0.098 -11.622 1.00 0.00 H new ATOM 0 HA GLN S 479 -2.179 2.658 -12.357 1.00 0.00 H new ATOM 0 HB2 GLN S 479 -2.686 1.486 -14.460 1.00 0.00 H new ATOM 0 HB3 GLN S 479 -0.981 1.378 -14.069 1.00 0.00 H new ATOM 0 HG2 GLN S 479 -2.013 -0.904 -12.876 1.00 0.00 H new ATOM 0 HG3 GLN S 479 -2.997 -0.752 -14.318 1.00 0.00 H new ATOM 0 HE21 GLN S 479 -1.035 -2.813 -13.697 1.00 0.00 H new ATOM 0 HE22 GLN S 479 0.196 -2.736 -14.962 1.00 0.00 H new ATOM 398 N GLU S 480 -4.665 1.672 -12.694 1.00 0.00 N ATOM 399 CA GLU S 480 -6.063 1.376 -12.400 1.00 0.00 C ATOM 400 C GLU S 480 -6.395 -0.070 -12.752 1.00 0.00 C ATOM 401 O GLU S 480 -5.746 -0.675 -13.606 1.00 0.00 O ATOM 402 CB GLU S 480 -6.983 2.332 -13.163 1.00 0.00 C ATOM 403 CG GLU S 480 -7.069 2.042 -14.653 1.00 0.00 C ATOM 404 CD GLU S 480 -6.749 3.257 -15.506 1.00 0.00 C ATOM 405 OE1 GLU S 480 -7.672 4.056 -15.770 1.00 0.00 O ATOM 406 OE2 GLU S 480 -5.575 3.407 -15.906 1.00 0.00 O ATOM 0 H GLU S 480 -4.521 2.266 -13.511 1.00 0.00 H new ATOM 0 HA GLU S 480 -6.223 1.515 -11.331 1.00 0.00 H new ATOM 0 HB2 GLU S 480 -7.983 2.279 -12.734 1.00 0.00 H new ATOM 0 HB3 GLU S 480 -6.629 3.353 -13.021 1.00 0.00 H new ATOM 0 HG2 GLU S 480 -6.379 1.236 -14.903 1.00 0.00 H new ATOM 0 HG3 GLU S 480 -8.072 1.689 -14.893 1.00 0.00 H new ATOM 413 N GLY S 481 -7.410 -0.620 -12.093 1.00 0.00 N ATOM 414 CA GLY S 481 -7.809 -1.994 -12.352 1.00 0.00 C ATOM 415 C GLY S 481 -6.634 -2.952 -12.358 1.00 0.00 C ATOM 416 O GLY S 481 -6.281 -3.500 -13.401 1.00 0.00 O ATOM 0 H GLY S 481 -7.964 -0.140 -11.384 1.00 0.00 H new ATOM 0 HA2 GLY S 481 -8.526 -2.309 -11.594 1.00 0.00 H new ATOM 0 HA3 GLY S 481 -8.319 -2.045 -13.314 1.00 0.00 H new ATOM 420 N ASP S 482 -6.021 -3.151 -11.194 1.00 0.00 N ATOM 421 CA ASP S 482 -4.875 -4.047 -11.088 1.00 0.00 C ATOM 422 C ASP S 482 -5.044 -5.049 -9.956 1.00 0.00 C ATOM 423 O ASP S 482 -5.825 -4.840 -9.032 1.00 0.00 O ATOM 424 CB ASP S 482 -3.584 -3.245 -10.898 1.00 0.00 C ATOM 425 CG ASP S 482 -2.377 -4.127 -10.637 1.00 0.00 C ATOM 426 OD1 ASP S 482 -2.170 -5.092 -11.403 1.00 0.00 O ATOM 427 OD2 ASP S 482 -1.639 -3.853 -9.668 1.00 0.00 O ATOM 0 H ASP S 482 -6.296 -2.707 -10.318 1.00 0.00 H new ATOM 0 HA ASP S 482 -4.812 -4.608 -12.020 1.00 0.00 H new ATOM 0 HB2 ASP S 482 -3.402 -2.642 -11.788 1.00 0.00 H new ATOM 0 HB3 ASP S 482 -3.710 -2.554 -10.065 1.00 0.00 H new ATOM 432 N ILE S 483 -4.295 -6.144 -10.042 1.00 0.00 N ATOM 433 CA ILE S 483 -4.346 -7.193 -9.036 1.00 0.00 C ATOM 434 C ILE S 483 -3.234 -7.020 -8.006 1.00 0.00 C ATOM 435 O ILE S 483 -2.228 -7.730 -8.037 1.00 0.00 O ATOM 436 CB ILE S 483 -4.228 -8.589 -9.675 1.00 0.00 C ATOM 437 CG1 ILE S 483 -5.189 -8.716 -10.859 1.00 0.00 C ATOM 438 CG2 ILE S 483 -4.506 -9.668 -8.642 1.00 0.00 C ATOM 439 CD1 ILE S 483 -6.636 -8.472 -10.492 1.00 0.00 C ATOM 0 H ILE S 483 -3.642 -6.326 -10.804 1.00 0.00 H new ATOM 0 HA ILE S 483 -5.313 -7.110 -8.540 1.00 0.00 H new ATOM 0 HB ILE S 483 -3.210 -8.719 -10.043 1.00 0.00 H new ATOM 0 HG12 ILE S 483 -4.895 -8.007 -11.633 1.00 0.00 H new ATOM 0 HG13 ILE S 483 -5.095 -9.714 -11.288 1.00 0.00 H new ATOM 0 HG21 ILE S 483 -4.419 -10.649 -9.108 1.00 0.00 H new ATOM 0 HG22 ILE S 483 -3.785 -9.587 -7.829 1.00 0.00 H new ATOM 0 HG23 ILE S 483 -5.514 -9.542 -8.247 1.00 0.00 H new ATOM 0 HD11 ILE S 483 -7.259 -8.579 -11.380 1.00 0.00 H new ATOM 0 HD12 ILE S 483 -6.948 -9.197 -9.740 1.00 0.00 H new ATOM 0 HD13 ILE S 483 -6.745 -7.464 -10.091 1.00 0.00 H new ATOM 451 N ILE S 484 -3.423 -6.072 -7.097 1.00 0.00 N ATOM 452 CA ILE S 484 -2.441 -5.803 -6.056 1.00 0.00 C ATOM 453 C ILE S 484 -2.559 -6.810 -4.920 1.00 0.00 C ATOM 454 O ILE S 484 -3.603 -7.432 -4.733 1.00 0.00 O ATOM 455 CB ILE S 484 -2.616 -4.384 -5.478 1.00 0.00 C ATOM 456 CG1 ILE S 484 -2.544 -3.341 -6.592 1.00 0.00 C ATOM 457 CG2 ILE S 484 -1.563 -4.101 -4.415 1.00 0.00 C ATOM 458 CD1 ILE S 484 -3.190 -2.026 -6.220 1.00 0.00 C ATOM 0 H ILE S 484 -4.250 -5.476 -7.060 1.00 0.00 H new ATOM 0 HA ILE S 484 -1.457 -5.887 -6.518 1.00 0.00 H new ATOM 0 HB ILE S 484 -3.599 -4.325 -5.010 1.00 0.00 H new ATOM 0 HG12 ILE S 484 -1.499 -3.165 -6.849 1.00 0.00 H new ATOM 0 HG13 ILE S 484 -3.030 -3.737 -7.484 1.00 0.00 H new ATOM 0 HG21 ILE S 484 -1.705 -3.095 -4.021 1.00 0.00 H new ATOM 0 HG22 ILE S 484 -1.659 -4.825 -3.606 1.00 0.00 H new ATOM 0 HG23 ILE S 484 -0.570 -4.181 -4.857 1.00 0.00 H new ATOM 0 HD11 ILE S 484 -3.104 -1.330 -7.054 1.00 0.00 H new ATOM 0 HD12 ILE S 484 -4.243 -2.190 -5.991 1.00 0.00 H new ATOM 0 HD13 ILE S 484 -2.689 -1.609 -5.346 1.00 0.00 H new ATOM 470 N LEU S 485 -1.483 -6.957 -4.159 1.00 0.00 N ATOM 471 CA LEU S 485 -1.464 -7.877 -3.034 1.00 0.00 C ATOM 472 C LEU S 485 -1.349 -7.105 -1.723 1.00 0.00 C ATOM 473 O LEU S 485 -0.315 -6.504 -1.433 1.00 0.00 O ATOM 474 CB LEU S 485 -0.304 -8.874 -3.179 1.00 0.00 C ATOM 475 CG LEU S 485 0.114 -9.615 -1.899 1.00 0.00 C ATOM 476 CD1 LEU S 485 1.094 -8.777 -1.094 1.00 0.00 C ATOM 477 CD2 LEU S 485 -1.100 -9.978 -1.053 1.00 0.00 C ATOM 0 H LEU S 485 -0.610 -6.449 -4.302 1.00 0.00 H new ATOM 0 HA LEU S 485 -2.399 -8.438 -3.024 1.00 0.00 H new ATOM 0 HB2 LEU S 485 -0.580 -9.615 -3.930 1.00 0.00 H new ATOM 0 HB3 LEU S 485 0.563 -8.338 -3.564 1.00 0.00 H new ATOM 0 HG LEU S 485 0.608 -10.541 -2.193 1.00 0.00 H new ATOM 0 HD11 LEU S 485 1.379 -9.317 -0.191 1.00 0.00 H new ATOM 0 HD12 LEU S 485 1.982 -8.579 -1.694 1.00 0.00 H new ATOM 0 HD13 LEU S 485 0.625 -7.833 -0.819 1.00 0.00 H new ATOM 0 HD21 LEU S 485 -0.774 -10.501 -0.154 1.00 0.00 H new ATOM 0 HD22 LEU S 485 -1.632 -9.069 -0.771 1.00 0.00 H new ATOM 0 HD23 LEU S 485 -1.764 -10.624 -1.628 1.00 0.00 H new ATOM 489 N VAL S 486 -2.417 -7.131 -0.935 1.00 0.00 N ATOM 490 CA VAL S 486 -2.428 -6.440 0.348 1.00 0.00 C ATOM 491 C VAL S 486 -1.674 -7.259 1.370 1.00 0.00 C ATOM 492 O VAL S 486 -2.160 -8.296 1.803 1.00 0.00 O ATOM 493 CB VAL S 486 -3.849 -6.223 0.906 1.00 0.00 C ATOM 494 CG1 VAL S 486 -3.904 -4.959 1.733 1.00 0.00 C ATOM 495 CG2 VAL S 486 -4.902 -6.195 -0.191 1.00 0.00 C ATOM 0 H VAL S 486 -3.283 -7.621 -1.161 1.00 0.00 H new ATOM 0 HA VAL S 486 -1.967 -5.468 0.173 1.00 0.00 H new ATOM 0 HB VAL S 486 -4.079 -7.075 1.546 1.00 0.00 H new ATOM 0 HG11 VAL S 486 -4.914 -4.821 2.119 1.00 0.00 H new ATOM 0 HG12 VAL S 486 -3.205 -5.038 2.565 1.00 0.00 H new ATOM 0 HG13 VAL S 486 -3.633 -4.105 1.111 1.00 0.00 H new ATOM 0 HG21 VAL S 486 -5.885 -6.040 0.253 1.00 0.00 H new ATOM 0 HG22 VAL S 486 -4.684 -5.382 -0.884 1.00 0.00 H new ATOM 0 HG23 VAL S 486 -4.892 -7.143 -0.729 1.00 0.00 H new ATOM 505 N LEU S 487 -0.501 -6.805 1.761 1.00 0.00 N ATOM 506 CA LEU S 487 0.272 -7.546 2.743 1.00 0.00 C ATOM 507 C LEU S 487 -0.226 -7.307 4.164 1.00 0.00 C ATOM 508 O LEU S 487 0.063 -8.095 5.064 1.00 0.00 O ATOM 509 CB LEU S 487 1.750 -7.194 2.646 1.00 0.00 C ATOM 510 CG LEU S 487 2.587 -8.088 1.721 1.00 0.00 C ATOM 511 CD1 LEU S 487 4.060 -7.978 2.074 1.00 0.00 C ATOM 512 CD2 LEU S 487 2.134 -9.542 1.804 1.00 0.00 C ATOM 0 H LEU S 487 -0.067 -5.946 1.424 1.00 0.00 H new ATOM 0 HA LEU S 487 0.140 -8.604 2.516 1.00 0.00 H new ATOM 0 HB2 LEU S 487 1.837 -6.163 2.302 1.00 0.00 H new ATOM 0 HB3 LEU S 487 2.181 -7.234 3.647 1.00 0.00 H new ATOM 0 HG LEU S 487 2.440 -7.745 0.697 1.00 0.00 H new ATOM 0 HD11 LEU S 487 4.642 -8.617 1.410 1.00 0.00 H new ATOM 0 HD12 LEU S 487 4.385 -6.944 1.959 1.00 0.00 H new ATOM 0 HD13 LEU S 487 4.211 -8.294 3.106 1.00 0.00 H new ATOM 0 HD21 LEU S 487 2.745 -10.152 1.138 1.00 0.00 H new ATOM 0 HD22 LEU S 487 2.245 -9.900 2.828 1.00 0.00 H new ATOM 0 HD23 LEU S 487 1.088 -9.615 1.506 1.00 0.00 H new ATOM 524 N SER S 488 -0.979 -6.229 4.363 1.00 0.00 N ATOM 525 CA SER S 488 -1.515 -5.906 5.692 1.00 0.00 C ATOM 526 C SER S 488 -2.122 -4.509 5.735 1.00 0.00 C ATOM 527 O SER S 488 -1.829 -3.665 4.890 1.00 0.00 O ATOM 528 CB SER S 488 -0.409 -5.967 6.754 1.00 0.00 C ATOM 529 OG SER S 488 -0.931 -6.357 8.012 1.00 0.00 O ATOM 0 H SER S 488 -1.233 -5.566 3.631 1.00 0.00 H new ATOM 0 HA SER S 488 -2.288 -6.646 5.900 1.00 0.00 H new ATOM 0 HB2 SER S 488 0.361 -6.673 6.442 1.00 0.00 H new ATOM 0 HB3 SER S 488 0.069 -4.992 6.842 1.00 0.00 H new ATOM 0 HG SER S 488 -0.206 -6.390 8.671 1.00 0.00 H new ATOM 535 N LYS S 489 -2.930 -4.262 6.763 1.00 0.00 N ATOM 536 CA LYS S 489 -3.537 -2.952 6.963 1.00 0.00 C ATOM 537 C LYS S 489 -2.524 -2.060 7.669 1.00 0.00 C ATOM 538 O LYS S 489 -1.906 -2.479 8.646 1.00 0.00 O ATOM 539 CB LYS S 489 -4.815 -3.069 7.795 1.00 0.00 C ATOM 540 CG LYS S 489 -5.483 -1.731 8.074 1.00 0.00 C ATOM 541 CD LYS S 489 -6.544 -1.410 7.034 1.00 0.00 C ATOM 542 CE LYS S 489 -7.655 -0.553 7.619 1.00 0.00 C ATOM 543 NZ LYS S 489 -8.530 -1.329 8.539 1.00 0.00 N ATOM 0 H LYS S 489 -3.179 -4.954 7.470 1.00 0.00 H new ATOM 0 HA LYS S 489 -3.809 -2.521 6.000 1.00 0.00 H new ATOM 0 HB2 LYS S 489 -5.520 -3.716 7.274 1.00 0.00 H new ATOM 0 HB3 LYS S 489 -4.579 -3.553 8.743 1.00 0.00 H new ATOM 0 HG2 LYS S 489 -5.937 -1.750 9.065 1.00 0.00 H new ATOM 0 HG3 LYS S 489 -4.731 -0.942 8.083 1.00 0.00 H new ATOM 0 HD2 LYS S 489 -6.085 -0.889 6.193 1.00 0.00 H new ATOM 0 HD3 LYS S 489 -6.965 -2.337 6.644 1.00 0.00 H new ATOM 0 HE2 LYS S 489 -7.219 0.289 8.157 1.00 0.00 H new ATOM 0 HE3 LYS S 489 -8.257 -0.137 6.811 1.00 0.00 H new ATOM 0 HZ1 LYS S 489 -9.413 -0.805 8.702 1.00 0.00 H new ATOM 0 HZ2 LYS S 489 -8.749 -2.252 8.114 1.00 0.00 H new ATOM 0 HZ3 LYS S 489 -8.040 -1.473 9.445 1.00 0.00 H new ATOM 557 N VAL S 490 -2.319 -0.851 7.160 1.00 0.00 N ATOM 558 CA VAL S 490 -1.329 0.043 7.756 1.00 0.00 C ATOM 559 C VAL S 490 -1.964 1.169 8.577 1.00 0.00 C ATOM 560 O VAL S 490 -1.430 1.548 9.618 1.00 0.00 O ATOM 561 CB VAL S 490 -0.375 0.608 6.679 1.00 0.00 C ATOM 562 CG1 VAL S 490 0.553 1.671 7.257 1.00 0.00 C ATOM 563 CG2 VAL S 490 0.440 -0.526 6.067 1.00 0.00 C ATOM 0 H VAL S 490 -2.813 -0.471 6.352 1.00 0.00 H new ATOM 0 HA VAL S 490 -0.746 -0.557 8.454 1.00 0.00 H new ATOM 0 HB VAL S 490 -0.979 1.081 5.905 1.00 0.00 H new ATOM 0 HG11 VAL S 490 1.210 2.046 6.472 1.00 0.00 H new ATOM 0 HG12 VAL S 490 -0.040 2.493 7.658 1.00 0.00 H new ATOM 0 HG13 VAL S 490 1.154 1.235 8.055 1.00 0.00 H new ATOM 0 HG21 VAL S 490 1.111 -0.123 5.308 1.00 0.00 H new ATOM 0 HG22 VAL S 490 1.025 -1.015 6.846 1.00 0.00 H new ATOM 0 HG23 VAL S 490 -0.232 -1.251 5.609 1.00 0.00 H new ATOM 573 N ASN S 491 -3.103 1.695 8.136 1.00 0.00 N ATOM 574 CA ASN S 491 -3.769 2.756 8.887 1.00 0.00 C ATOM 575 C ASN S 491 -5.212 2.954 8.417 1.00 0.00 C ATOM 576 O ASN S 491 -5.774 2.101 7.730 1.00 0.00 O ATOM 577 CB ASN S 491 -2.965 4.066 8.804 1.00 0.00 C ATOM 578 CG ASN S 491 -3.367 4.954 7.641 1.00 0.00 C ATOM 579 OD1 ASN S 491 -3.892 4.484 6.636 1.00 0.00 O ATOM 580 ND2 ASN S 491 -3.120 6.252 7.784 1.00 0.00 N ATOM 0 H ASN S 491 -3.578 1.411 7.279 1.00 0.00 H new ATOM 0 HA ASN S 491 -3.811 2.452 9.933 1.00 0.00 H new ATOM 0 HB2 ASN S 491 -3.092 4.620 9.734 1.00 0.00 H new ATOM 0 HB3 ASN S 491 -1.905 3.827 8.718 1.00 0.00 H new ATOM 0 HD21 ASN S 491 -3.369 6.904 7.040 1.00 0.00 H new ATOM 0 HD22 ASN S 491 -2.682 6.597 8.638 1.00 0.00 H new ATOM 587 N GLU S 492 -5.808 4.076 8.808 1.00 0.00 N ATOM 588 CA GLU S 492 -7.191 4.388 8.452 1.00 0.00 C ATOM 589 C GLU S 492 -7.425 4.314 6.944 1.00 0.00 C ATOM 590 O GLU S 492 -8.521 3.970 6.498 1.00 0.00 O ATOM 591 CB GLU S 492 -7.565 5.780 8.964 1.00 0.00 C ATOM 592 CG GLU S 492 -6.556 6.855 8.593 1.00 0.00 C ATOM 593 CD GLU S 492 -7.026 7.720 7.440 1.00 0.00 C ATOM 594 OE1 GLU S 492 -8.070 8.390 7.588 1.00 0.00 O ATOM 595 OE2 GLU S 492 -6.350 7.728 6.391 1.00 0.00 O ATOM 0 H GLU S 492 -5.352 4.790 9.376 1.00 0.00 H new ATOM 0 HA GLU S 492 -7.825 3.638 8.925 1.00 0.00 H new ATOM 0 HB2 GLU S 492 -8.541 6.055 8.564 1.00 0.00 H new ATOM 0 HB3 GLU S 492 -7.664 5.745 10.049 1.00 0.00 H new ATOM 0 HG2 GLU S 492 -6.366 7.485 9.462 1.00 0.00 H new ATOM 0 HG3 GLU S 492 -5.610 6.384 8.327 1.00 0.00 H new ATOM 602 N GLU S 493 -6.406 4.648 6.160 1.00 0.00 N ATOM 603 CA GLU S 493 -6.528 4.622 4.704 1.00 0.00 C ATOM 604 C GLU S 493 -5.198 4.274 4.042 1.00 0.00 C ATOM 605 O GLU S 493 -4.768 4.939 3.101 1.00 0.00 O ATOM 606 CB GLU S 493 -7.026 5.976 4.194 1.00 0.00 C ATOM 607 CG GLU S 493 -7.619 5.918 2.795 1.00 0.00 C ATOM 608 CD GLU S 493 -8.492 7.117 2.482 1.00 0.00 C ATOM 609 OE1 GLU S 493 -9.257 7.545 3.372 1.00 0.00 O ATOM 610 OE2 GLU S 493 -8.410 7.630 1.346 1.00 0.00 O ATOM 0 H GLU S 493 -5.491 4.939 6.504 1.00 0.00 H new ATOM 0 HA GLU S 493 -7.250 3.849 4.441 1.00 0.00 H new ATOM 0 HB2 GLU S 493 -7.778 6.360 4.883 1.00 0.00 H new ATOM 0 HB3 GLU S 493 -6.197 6.684 4.199 1.00 0.00 H new ATOM 0 HG2 GLU S 493 -6.812 5.860 2.064 1.00 0.00 H new ATOM 0 HG3 GLU S 493 -8.209 5.007 2.692 1.00 0.00 H new ATOM 617 N TRP S 494 -4.560 3.221 4.538 1.00 0.00 N ATOM 618 CA TRP S 494 -3.284 2.769 3.998 1.00 0.00 C ATOM 619 C TRP S 494 -3.020 1.324 4.397 1.00 0.00 C ATOM 620 O TRP S 494 -3.586 0.822 5.368 1.00 0.00 O ATOM 621 CB TRP S 494 -2.132 3.651 4.486 1.00 0.00 C ATOM 622 CG TRP S 494 -2.137 5.036 3.912 1.00 0.00 C ATOM 623 CD1 TRP S 494 -2.775 6.130 4.420 1.00 0.00 C ATOM 624 CD2 TRP S 494 -1.465 5.480 2.726 1.00 0.00 C ATOM 625 NE1 TRP S 494 -2.538 7.224 3.628 1.00 0.00 N ATOM 626 CE2 TRP S 494 -1.741 6.852 2.582 1.00 0.00 C ATOM 627 CE3 TRP S 494 -0.657 4.854 1.772 1.00 0.00 C ATOM 628 CZ2 TRP S 494 -1.240 7.608 1.527 1.00 0.00 C ATOM 629 CZ3 TRP S 494 -0.159 5.607 0.724 1.00 0.00 C ATOM 630 CH2 TRP S 494 -0.452 6.972 0.609 1.00 0.00 C ATOM 0 H TRP S 494 -4.908 2.662 5.317 1.00 0.00 H new ATOM 0 HA TRP S 494 -3.342 2.841 2.912 1.00 0.00 H new ATOM 0 HB2 TRP S 494 -2.176 3.719 5.573 1.00 0.00 H new ATOM 0 HB3 TRP S 494 -1.187 3.168 4.235 1.00 0.00 H new ATOM 0 HD1 TRP S 494 -3.379 6.134 5.315 1.00 0.00 H new ATOM 0 HE1 TRP S 494 -2.898 8.164 3.793 1.00 0.00 H new ATOM 0 HE3 TRP S 494 -0.426 3.802 1.852 1.00 0.00 H new ATOM 0 HZ2 TRP S 494 -1.466 8.660 1.437 1.00 0.00 H new ATOM 0 HZ3 TRP S 494 0.467 5.134 -0.019 1.00 0.00 H new ATOM 0 HH2 TRP S 494 -0.048 7.533 -0.221 1.00 0.00 H new ATOM 641 N LEU S 495 -2.162 0.660 3.639 1.00 0.00 N ATOM 642 CA LEU S 495 -1.821 -0.726 3.901 1.00 0.00 C ATOM 643 C LEU S 495 -0.508 -1.097 3.238 1.00 0.00 C ATOM 644 O LEU S 495 0.047 -0.320 2.462 1.00 0.00 O ATOM 645 CB LEU S 495 -2.937 -1.644 3.410 1.00 0.00 C ATOM 646 CG LEU S 495 -3.745 -1.118 2.221 1.00 0.00 C ATOM 647 CD1 LEU S 495 -3.474 -1.944 0.973 1.00 0.00 C ATOM 648 CD2 LEU S 495 -5.225 -1.121 2.559 1.00 0.00 C ATOM 0 H LEU S 495 -1.687 1.064 2.832 1.00 0.00 H new ATOM 0 HA LEU S 495 -1.706 -0.851 4.978 1.00 0.00 H new ATOM 0 HB2 LEU S 495 -2.500 -2.604 3.134 1.00 0.00 H new ATOM 0 HB3 LEU S 495 -3.621 -1.831 4.238 1.00 0.00 H new ATOM 0 HG LEU S 495 -3.435 -0.094 2.015 1.00 0.00 H new ATOM 0 HD11 LEU S 495 -4.060 -1.551 0.142 1.00 0.00 H new ATOM 0 HD12 LEU S 495 -2.414 -1.893 0.726 1.00 0.00 H new ATOM 0 HD13 LEU S 495 -3.754 -2.981 1.155 1.00 0.00 H new ATOM 0 HD21 LEU S 495 -5.793 -0.745 1.708 1.00 0.00 H new ATOM 0 HD22 LEU S 495 -5.544 -2.138 2.788 1.00 0.00 H new ATOM 0 HD23 LEU S 495 -5.402 -0.482 3.424 1.00 0.00 H new ATOM 660 N GLU S 496 -0.017 -2.293 3.539 1.00 0.00 N ATOM 661 CA GLU S 496 1.230 -2.753 2.956 1.00 0.00 C ATOM 662 C GLU S 496 0.978 -3.243 1.544 1.00 0.00 C ATOM 663 O GLU S 496 0.042 -4.002 1.294 1.00 0.00 O ATOM 664 CB GLU S 496 1.859 -3.857 3.806 1.00 0.00 C ATOM 665 CG GLU S 496 3.138 -4.427 3.216 1.00 0.00 C ATOM 666 CD GLU S 496 4.341 -3.533 3.446 1.00 0.00 C ATOM 667 OE1 GLU S 496 4.316 -2.372 2.987 1.00 0.00 O ATOM 668 OE2 GLU S 496 5.309 -3.996 4.084 1.00 0.00 O ATOM 0 H GLU S 496 -0.460 -2.954 4.177 1.00 0.00 H new ATOM 0 HA GLU S 496 1.932 -1.920 2.926 1.00 0.00 H new ATOM 0 HB2 GLU S 496 2.072 -3.462 4.799 1.00 0.00 H new ATOM 0 HB3 GLU S 496 1.136 -4.663 3.932 1.00 0.00 H new ATOM 0 HG2 GLU S 496 3.330 -5.406 3.654 1.00 0.00 H new ATOM 0 HG3 GLU S 496 3.003 -4.578 2.145 1.00 0.00 H new ATOM 675 N GLY S 497 1.796 -2.770 0.615 1.00 0.00 N ATOM 676 CA GLY S 497 1.615 -3.137 -0.768 1.00 0.00 C ATOM 677 C GLY S 497 2.822 -3.803 -1.400 1.00 0.00 C ATOM 678 O GLY S 497 3.859 -3.176 -1.590 1.00 0.00 O ATOM 0 H GLY S 497 2.578 -2.141 0.796 1.00 0.00 H new ATOM 0 HA2 GLY S 497 0.761 -3.811 -0.844 1.00 0.00 H new ATOM 0 HA3 GLY S 497 1.367 -2.243 -1.340 1.00 0.00 H new ATOM 682 N GLU S 498 2.666 -5.074 -1.759 1.00 0.00 N ATOM 683 CA GLU S 498 3.730 -5.828 -2.412 1.00 0.00 C ATOM 684 C GLU S 498 3.255 -6.284 -3.790 1.00 0.00 C ATOM 685 O GLU S 498 2.473 -7.229 -3.902 1.00 0.00 O ATOM 686 CB GLU S 498 4.136 -7.037 -1.565 1.00 0.00 C ATOM 687 CG GLU S 498 5.334 -7.792 -2.116 1.00 0.00 C ATOM 688 CD GLU S 498 5.116 -9.292 -2.146 1.00 0.00 C ATOM 689 OE1 GLU S 498 5.278 -9.937 -1.089 1.00 0.00 O ATOM 690 OE2 GLU S 498 4.783 -9.821 -3.227 1.00 0.00 O ATOM 0 H GLU S 498 1.808 -5.605 -1.607 1.00 0.00 H new ATOM 0 HA GLU S 498 4.603 -5.185 -2.523 1.00 0.00 H new ATOM 0 HB2 GLU S 498 4.363 -6.701 -0.553 1.00 0.00 H new ATOM 0 HB3 GLU S 498 3.289 -7.720 -1.492 1.00 0.00 H new ATOM 0 HG2 GLU S 498 5.548 -7.440 -3.125 1.00 0.00 H new ATOM 0 HG3 GLU S 498 6.211 -7.568 -1.508 1.00 0.00 H new ATOM 697 N SER S 499 3.707 -5.594 -4.833 1.00 0.00 N ATOM 698 CA SER S 499 3.301 -5.921 -6.193 1.00 0.00 C ATOM 699 C SER S 499 4.485 -5.878 -7.154 1.00 0.00 C ATOM 700 O SER S 499 5.155 -4.855 -7.292 1.00 0.00 O ATOM 701 CB SER S 499 2.218 -4.947 -6.666 1.00 0.00 C ATOM 702 OG SER S 499 1.648 -5.376 -7.891 1.00 0.00 O ATOM 0 H SER S 499 4.353 -4.808 -4.761 1.00 0.00 H new ATOM 0 HA SER S 499 2.904 -6.936 -6.187 1.00 0.00 H new ATOM 0 HB2 SER S 499 1.440 -4.867 -5.907 1.00 0.00 H new ATOM 0 HB3 SER S 499 2.647 -3.953 -6.789 1.00 0.00 H new ATOM 0 HG SER S 499 0.958 -4.739 -8.172 1.00 0.00 H new ATOM 708 N LYS S 500 4.717 -6.999 -7.823 1.00 0.00 N ATOM 709 CA LYS S 500 5.803 -7.120 -8.796 1.00 0.00 C ATOM 710 C LYS S 500 7.173 -7.030 -8.131 1.00 0.00 C ATOM 711 O LYS S 500 7.872 -6.025 -8.262 1.00 0.00 O ATOM 712 CB LYS S 500 5.675 -6.042 -9.876 1.00 0.00 C ATOM 713 CG LYS S 500 4.841 -6.476 -11.071 1.00 0.00 C ATOM 714 CD LYS S 500 3.461 -5.838 -11.051 1.00 0.00 C ATOM 715 CE LYS S 500 2.423 -6.734 -11.708 1.00 0.00 C ATOM 716 NZ LYS S 500 1.285 -5.952 -12.265 1.00 0.00 N ATOM 0 H LYS S 500 4.163 -7.848 -7.710 1.00 0.00 H new ATOM 0 HA LYS S 500 5.719 -8.104 -9.257 1.00 0.00 H new ATOM 0 HB2 LYS S 500 5.229 -5.150 -9.436 1.00 0.00 H new ATOM 0 HB3 LYS S 500 6.671 -5.764 -10.220 1.00 0.00 H new ATOM 0 HG2 LYS S 500 5.355 -6.204 -11.993 1.00 0.00 H new ATOM 0 HG3 LYS S 500 4.741 -7.561 -11.071 1.00 0.00 H new ATOM 0 HD2 LYS S 500 3.168 -5.635 -10.021 1.00 0.00 H new ATOM 0 HD3 LYS S 500 3.495 -4.879 -11.568 1.00 0.00 H new ATOM 0 HE2 LYS S 500 2.893 -7.309 -12.506 1.00 0.00 H new ATOM 0 HE3 LYS S 500 2.048 -7.450 -10.977 1.00 0.00 H new ATOM 0 HZ1 LYS S 500 0.600 -6.600 -12.704 1.00 0.00 H new ATOM 0 HZ2 LYS S 500 0.820 -5.423 -11.500 1.00 0.00 H new ATOM 0 HZ3 LYS S 500 1.639 -5.286 -12.981 1.00 0.00 H new ATOM 730 N GLY S 501 7.556 -8.098 -7.430 1.00 0.00 N ATOM 731 CA GLY S 501 8.848 -8.145 -6.762 1.00 0.00 C ATOM 732 C GLY S 501 9.251 -6.825 -6.129 1.00 0.00 C ATOM 733 O GLY S 501 10.349 -6.325 -6.369 1.00 0.00 O ATOM 0 H GLY S 501 6.989 -8.938 -7.313 1.00 0.00 H new ATOM 0 HA2 GLY S 501 8.822 -8.915 -5.991 1.00 0.00 H new ATOM 0 HA3 GLY S 501 9.610 -8.441 -7.483 1.00 0.00 H new ATOM 737 N LYS S 502 8.362 -6.262 -5.321 1.00 0.00 N ATOM 738 CA LYS S 502 8.632 -4.996 -4.654 1.00 0.00 C ATOM 739 C LYS S 502 7.719 -4.827 -3.451 1.00 0.00 C ATOM 740 O LYS S 502 6.635 -5.407 -3.397 1.00 0.00 O ATOM 741 CB LYS S 502 8.448 -3.828 -5.622 1.00 0.00 C ATOM 742 CG LYS S 502 9.716 -3.456 -6.371 1.00 0.00 C ATOM 743 CD LYS S 502 9.756 -1.971 -6.698 1.00 0.00 C ATOM 744 CE LYS S 502 11.183 -1.472 -6.846 1.00 0.00 C ATOM 745 NZ LYS S 502 12.032 -1.864 -5.687 1.00 0.00 N ATOM 0 H LYS S 502 7.448 -6.663 -5.112 1.00 0.00 H new ATOM 0 HA LYS S 502 9.667 -5.003 -4.312 1.00 0.00 H new ATOM 0 HB2 LYS S 502 7.671 -4.083 -6.343 1.00 0.00 H new ATOM 0 HB3 LYS S 502 8.095 -2.959 -5.067 1.00 0.00 H new ATOM 0 HG2 LYS S 502 10.586 -3.721 -5.770 1.00 0.00 H new ATOM 0 HG3 LYS S 502 9.778 -4.034 -7.293 1.00 0.00 H new ATOM 0 HD2 LYS S 502 9.207 -1.786 -7.621 1.00 0.00 H new ATOM 0 HD3 LYS S 502 9.253 -1.410 -5.910 1.00 0.00 H new ATOM 0 HE2 LYS S 502 11.614 -1.872 -7.764 1.00 0.00 H new ATOM 0 HE3 LYS S 502 11.180 -0.386 -6.943 1.00 0.00 H new ATOM 0 HZ1 LYS S 502 12.804 -1.176 -5.574 1.00 0.00 H new ATOM 0 HZ2 LYS S 502 11.453 -1.881 -4.823 1.00 0.00 H new ATOM 0 HZ3 LYS S 502 12.433 -2.809 -5.854 1.00 0.00 H new ATOM 759 N VAL S 503 8.161 -4.036 -2.483 1.00 0.00 N ATOM 760 CA VAL S 503 7.373 -3.807 -1.282 1.00 0.00 C ATOM 761 C VAL S 503 7.204 -2.321 -0.994 1.00 0.00 C ATOM 762 O VAL S 503 8.177 -1.588 -0.813 1.00 0.00 O ATOM 763 CB VAL S 503 7.996 -4.494 -0.055 1.00 0.00 C ATOM 764 CG1 VAL S 503 7.033 -4.464 1.124 1.00 0.00 C ATOM 765 CG2 VAL S 503 8.392 -5.925 -0.389 1.00 0.00 C ATOM 0 H VAL S 503 9.055 -3.545 -2.506 1.00 0.00 H new ATOM 0 HA VAL S 503 6.392 -4.243 -1.471 1.00 0.00 H new ATOM 0 HB VAL S 503 8.895 -3.946 0.226 1.00 0.00 H new ATOM 0 HG11 VAL S 503 7.493 -4.955 1.982 1.00 0.00 H new ATOM 0 HG12 VAL S 503 6.802 -3.430 1.379 1.00 0.00 H new ATOM 0 HG13 VAL S 503 6.114 -4.986 0.857 1.00 0.00 H new ATOM 0 HG21 VAL S 503 8.831 -6.396 0.491 1.00 0.00 H new ATOM 0 HG22 VAL S 503 7.509 -6.484 -0.697 1.00 0.00 H new ATOM 0 HG23 VAL S 503 9.120 -5.921 -1.200 1.00 0.00 H new ATOM 775 N GLY S 504 5.951 -1.900 -0.945 1.00 0.00 N ATOM 776 CA GLY S 504 5.616 -0.518 -0.669 1.00 0.00 C ATOM 777 C GLY S 504 4.298 -0.428 0.063 1.00 0.00 C ATOM 778 O GLY S 504 3.915 -1.373 0.751 1.00 0.00 O ATOM 0 H GLY S 504 5.143 -2.505 -1.095 1.00 0.00 H new ATOM 0 HA2 GLY S 504 6.403 -0.060 -0.070 1.00 0.00 H new ATOM 0 HA3 GLY S 504 5.559 0.042 -1.603 1.00 0.00 H new ATOM 782 N ILE S 505 3.590 0.685 -0.084 1.00 0.00 N ATOM 783 CA ILE S 505 2.301 0.848 0.581 1.00 0.00 C ATOM 784 C ILE S 505 1.380 1.773 -0.194 1.00 0.00 C ATOM 785 O ILE S 505 1.832 2.620 -0.961 1.00 0.00 O ATOM 786 CB ILE S 505 2.460 1.376 2.014 1.00 0.00 C ATOM 787 CG1 ILE S 505 3.531 2.468 2.077 1.00 0.00 C ATOM 788 CG2 ILE S 505 2.801 0.229 2.945 1.00 0.00 C ATOM 789 CD1 ILE S 505 3.224 3.557 3.082 1.00 0.00 C ATOM 0 H ILE S 505 3.881 1.481 -0.651 1.00 0.00 H new ATOM 0 HA ILE S 505 1.853 -0.145 0.620 1.00 0.00 H new ATOM 0 HB ILE S 505 1.517 1.820 2.333 1.00 0.00 H new ATOM 0 HG12 ILE S 505 4.489 2.012 2.328 1.00 0.00 H new ATOM 0 HG13 ILE S 505 3.640 2.916 1.089 1.00 0.00 H new ATOM 0 HG21 ILE S 505 2.913 0.606 3.961 1.00 0.00 H new ATOM 0 HG22 ILE S 505 2.001 -0.511 2.919 1.00 0.00 H new ATOM 0 HG23 ILE S 505 3.734 -0.234 2.625 1.00 0.00 H new ATOM 0 HD11 ILE S 505 4.025 4.297 3.073 1.00 0.00 H new ATOM 0 HD12 ILE S 505 2.282 4.039 2.820 1.00 0.00 H new ATOM 0 HD13 ILE S 505 3.144 3.121 4.078 1.00 0.00 H new ATOM 801 N PHE S 506 0.080 1.601 0.007 1.00 0.00 N ATOM 802 CA PHE S 506 -0.900 2.426 -0.692 1.00 0.00 C ATOM 803 C PHE S 506 -2.236 2.467 0.045 1.00 0.00 C ATOM 804 O PHE S 506 -2.531 1.603 0.870 1.00 0.00 O ATOM 805 CB PHE S 506 -1.111 1.899 -2.108 1.00 0.00 C ATOM 806 CG PHE S 506 -1.640 0.495 -2.148 1.00 0.00 C ATOM 807 CD1 PHE S 506 -0.802 -0.581 -1.905 1.00 0.00 C ATOM 808 CD2 PHE S 506 -2.974 0.251 -2.425 1.00 0.00 C ATOM 809 CE1 PHE S 506 -1.287 -1.876 -1.938 1.00 0.00 C ATOM 810 CE2 PHE S 506 -3.464 -1.041 -2.459 1.00 0.00 C ATOM 811 CZ PHE S 506 -2.620 -2.105 -2.216 1.00 0.00 C ATOM 0 H PHE S 506 -0.318 0.907 0.640 1.00 0.00 H new ATOM 0 HA PHE S 506 -0.507 3.442 -0.731 1.00 0.00 H new ATOM 0 HB2 PHE S 506 -1.805 2.556 -2.633 1.00 0.00 H new ATOM 0 HB3 PHE S 506 -0.165 1.938 -2.647 1.00 0.00 H new ATOM 0 HD1 PHE S 506 0.241 -0.407 -1.687 1.00 0.00 H new ATOM 0 HD2 PHE S 506 -3.640 1.080 -2.617 1.00 0.00 H new ATOM 0 HE1 PHE S 506 -0.624 -2.707 -1.747 1.00 0.00 H new ATOM 0 HE2 PHE S 506 -4.507 -1.218 -2.676 1.00 0.00 H new ATOM 0 HZ PHE S 506 -3.001 -3.115 -2.243 1.00 0.00 H new ATOM 821 N PRO S 507 -3.068 3.483 -0.254 1.00 0.00 N ATOM 822 CA PRO S 507 -4.382 3.651 0.367 1.00 0.00 C ATOM 823 C PRO S 507 -5.413 2.669 -0.182 1.00 0.00 C ATOM 824 O PRO S 507 -5.549 2.510 -1.396 1.00 0.00 O ATOM 825 CB PRO S 507 -4.778 5.095 0.011 1.00 0.00 C ATOM 826 CG PRO S 507 -3.580 5.699 -0.653 1.00 0.00 C ATOM 827 CD PRO S 507 -2.797 4.553 -1.220 1.00 0.00 C ATOM 0 HA PRO S 507 -4.345 3.461 1.440 1.00 0.00 H new ATOM 0 HB2 PRO S 507 -5.642 5.110 -0.654 1.00 0.00 H new ATOM 0 HB3 PRO S 507 -5.053 5.656 0.904 1.00 0.00 H new ATOM 0 HG2 PRO S 507 -3.878 6.393 -1.438 1.00 0.00 H new ATOM 0 HG3 PRO S 507 -2.982 6.264 0.062 1.00 0.00 H new ATOM 0 HD2 PRO S 507 -3.131 4.289 -2.224 1.00 0.00 H new ATOM 0 HD3 PRO S 507 -1.733 4.781 -1.287 1.00 0.00 H new ATOM 835 N LYS S 508 -6.133 2.012 0.721 1.00 0.00 N ATOM 836 CA LYS S 508 -7.149 1.043 0.342 1.00 0.00 C ATOM 837 C LYS S 508 -8.218 1.677 -0.544 1.00 0.00 C ATOM 838 O LYS S 508 -8.861 0.991 -1.338 1.00 0.00 O ATOM 839 CB LYS S 508 -7.793 0.464 1.600 1.00 0.00 C ATOM 840 CG LYS S 508 -8.271 -0.964 1.428 1.00 0.00 C ATOM 841 CD LYS S 508 -9.752 -1.105 1.750 1.00 0.00 C ATOM 842 CE LYS S 508 -9.970 -1.525 3.195 1.00 0.00 C ATOM 843 NZ LYS S 508 -11.103 -2.481 3.330 1.00 0.00 N ATOM 0 H LYS S 508 -6.029 2.136 1.728 1.00 0.00 H new ATOM 0 HA LYS S 508 -6.670 0.247 -0.228 1.00 0.00 H new ATOM 0 HB2 LYS S 508 -7.074 0.503 2.418 1.00 0.00 H new ATOM 0 HB3 LYS S 508 -8.638 1.090 1.888 1.00 0.00 H new ATOM 0 HG2 LYS S 508 -8.089 -1.288 0.403 1.00 0.00 H new ATOM 0 HG3 LYS S 508 -7.693 -1.622 2.077 1.00 0.00 H new ATOM 0 HD2 LYS S 508 -10.258 -0.157 1.565 1.00 0.00 H new ATOM 0 HD3 LYS S 508 -10.202 -1.841 1.084 1.00 0.00 H new ATOM 0 HE2 LYS S 508 -9.060 -1.984 3.581 1.00 0.00 H new ATOM 0 HE3 LYS S 508 -10.165 -0.642 3.804 1.00 0.00 H new ATOM 0 HZ1 LYS S 508 -11.219 -2.743 4.330 1.00 0.00 H new ATOM 0 HZ2 LYS S 508 -11.977 -2.035 2.985 1.00 0.00 H new ATOM 0 HZ3 LYS S 508 -10.906 -3.334 2.769 1.00 0.00 H new ATOM 857 N VAL S 509 -8.409 2.986 -0.409 1.00 0.00 N ATOM 858 CA VAL S 509 -9.404 3.693 -1.211 1.00 0.00 C ATOM 859 C VAL S 509 -9.182 3.428 -2.701 1.00 0.00 C ATOM 860 O VAL S 509 -10.110 3.521 -3.504 1.00 0.00 O ATOM 861 CB VAL S 509 -9.389 5.218 -0.940 1.00 0.00 C ATOM 862 CG1 VAL S 509 -7.967 5.729 -0.781 1.00 0.00 C ATOM 863 CG2 VAL S 509 -10.105 5.978 -2.046 1.00 0.00 C ATOM 0 H VAL S 509 -7.892 3.576 0.243 1.00 0.00 H new ATOM 0 HA VAL S 509 -10.382 3.310 -0.919 1.00 0.00 H new ATOM 0 HB VAL S 509 -9.923 5.392 -0.006 1.00 0.00 H new ATOM 0 HG11 VAL S 509 -7.985 6.802 -0.592 1.00 0.00 H new ATOM 0 HG12 VAL S 509 -7.489 5.221 0.057 1.00 0.00 H new ATOM 0 HG13 VAL S 509 -7.405 5.531 -1.694 1.00 0.00 H new ATOM 0 HG21 VAL S 509 -10.079 7.046 -1.829 1.00 0.00 H new ATOM 0 HG22 VAL S 509 -9.609 5.789 -2.998 1.00 0.00 H new ATOM 0 HG23 VAL S 509 -11.141 5.645 -2.104 1.00 0.00 H new ATOM 873 N PHE S 510 -7.946 3.087 -3.062 1.00 0.00 N ATOM 874 CA PHE S 510 -7.604 2.797 -4.450 1.00 0.00 C ATOM 875 C PHE S 510 -7.856 1.329 -4.782 1.00 0.00 C ATOM 876 O PHE S 510 -7.499 0.861 -5.864 1.00 0.00 O ATOM 877 CB PHE S 510 -6.134 3.125 -4.712 1.00 0.00 C ATOM 878 CG PHE S 510 -5.857 4.594 -4.798 1.00 0.00 C ATOM 879 CD1 PHE S 510 -5.795 5.366 -3.652 1.00 0.00 C ATOM 880 CD2 PHE S 510 -5.663 5.202 -6.025 1.00 0.00 C ATOM 881 CE1 PHE S 510 -5.547 6.721 -3.729 1.00 0.00 C ATOM 882 CE2 PHE S 510 -5.419 6.557 -6.110 1.00 0.00 C ATOM 883 CZ PHE S 510 -5.361 7.318 -4.958 1.00 0.00 C ATOM 0 H PHE S 510 -7.165 3.005 -2.411 1.00 0.00 H new ATOM 0 HA PHE S 510 -8.238 3.416 -5.085 1.00 0.00 H new ATOM 0 HB2 PHE S 510 -5.526 2.695 -3.916 1.00 0.00 H new ATOM 0 HB3 PHE S 510 -5.824 2.650 -5.643 1.00 0.00 H new ATOM 0 HD1 PHE S 510 -5.942 4.903 -2.687 1.00 0.00 H new ATOM 0 HD2 PHE S 510 -5.703 4.609 -6.927 1.00 0.00 H new ATOM 0 HE1 PHE S 510 -5.499 7.314 -2.827 1.00 0.00 H new ATOM 0 HE2 PHE S 510 -5.274 7.022 -7.074 1.00 0.00 H new ATOM 0 HZ PHE S 510 -5.170 8.379 -5.020 1.00 0.00 H new ATOM 893 N VAL S 511 -8.456 0.600 -3.845 1.00 0.00 N ATOM 894 CA VAL S 511 -8.728 -0.814 -4.044 1.00 0.00 C ATOM 895 C VAL S 511 -9.929 -1.272 -3.213 1.00 0.00 C ATOM 896 O VAL S 511 -9.814 -2.147 -2.354 1.00 0.00 O ATOM 897 CB VAL S 511 -7.490 -1.655 -3.669 1.00 0.00 C ATOM 898 CG1 VAL S 511 -6.263 -1.164 -4.416 1.00 0.00 C ATOM 899 CG2 VAL S 511 -7.236 -1.592 -2.177 1.00 0.00 C ATOM 0 H VAL S 511 -8.761 0.967 -2.944 1.00 0.00 H new ATOM 0 HA VAL S 511 -8.962 -0.961 -5.098 1.00 0.00 H new ATOM 0 HB VAL S 511 -7.687 -2.689 -3.953 1.00 0.00 H new ATOM 0 HG11 VAL S 511 -5.401 -1.770 -4.138 1.00 0.00 H new ATOM 0 HG12 VAL S 511 -6.433 -1.247 -5.489 1.00 0.00 H new ATOM 0 HG13 VAL S 511 -6.073 -0.122 -4.158 1.00 0.00 H new ATOM 0 HG21 VAL S 511 -6.359 -2.191 -1.932 1.00 0.00 H new ATOM 0 HG22 VAL S 511 -7.063 -0.557 -1.881 1.00 0.00 H new ATOM 0 HG23 VAL S 511 -8.103 -1.982 -1.644 1.00 0.00 H new ATOM 909 N GLU S 512 -11.085 -0.682 -3.476 1.00 0.00 N ATOM 910 CA GLU S 512 -12.308 -1.030 -2.752 1.00 0.00 C ATOM 911 C GLU S 512 -12.757 -2.466 -3.031 1.00 0.00 C ATOM 912 O GLU S 512 -13.884 -2.842 -2.712 1.00 0.00 O ATOM 913 CB GLU S 512 -13.427 -0.061 -3.124 1.00 0.00 C ATOM 914 CG GLU S 512 -13.832 -0.149 -4.586 1.00 0.00 C ATOM 915 CD GLU S 512 -14.902 0.857 -4.958 1.00 0.00 C ATOM 916 OE1 GLU S 512 -14.703 2.062 -4.693 1.00 0.00 O ATOM 917 OE2 GLU S 512 -15.940 0.442 -5.517 1.00 0.00 O ATOM 0 H GLU S 512 -11.207 0.041 -4.185 1.00 0.00 H new ATOM 0 HA GLU S 512 -12.087 -0.954 -1.687 1.00 0.00 H new ATOM 0 HB2 GLU S 512 -14.297 -0.264 -2.500 1.00 0.00 H new ATOM 0 HB3 GLU S 512 -13.106 0.957 -2.903 1.00 0.00 H new ATOM 0 HG2 GLU S 512 -12.954 0.012 -5.212 1.00 0.00 H new ATOM 0 HG3 GLU S 512 -14.195 -1.155 -4.798 1.00 0.00 H new ATOM 924 N ASP S 513 -11.876 -3.261 -3.620 1.00 0.00 N ATOM 925 CA ASP S 513 -12.182 -4.650 -3.936 1.00 0.00 C ATOM 926 C ASP S 513 -12.185 -5.513 -2.676 1.00 0.00 C ATOM 927 O ASP S 513 -12.220 -4.998 -1.558 1.00 0.00 O ATOM 928 CB ASP S 513 -11.170 -5.196 -4.943 1.00 0.00 C ATOM 929 CG ASP S 513 -11.818 -6.083 -5.990 1.00 0.00 C ATOM 930 OD1 ASP S 513 -12.931 -5.747 -6.447 1.00 0.00 O ATOM 931 OD2 ASP S 513 -11.212 -7.113 -6.351 1.00 0.00 O ATOM 0 H ASP S 513 -10.938 -2.966 -3.890 1.00 0.00 H new ATOM 0 HA ASP S 513 -13.179 -4.686 -4.375 1.00 0.00 H new ATOM 0 HB2 ASP S 513 -10.667 -4.364 -5.436 1.00 0.00 H new ATOM 0 HB3 ASP S 513 -10.404 -5.763 -4.414 1.00 0.00 H new ATOM 936 N SER S 514 -12.147 -6.830 -2.866 1.00 0.00 N ATOM 937 CA SER S 514 -12.146 -7.767 -1.747 1.00 0.00 C ATOM 938 C SER S 514 -11.996 -9.203 -2.241 1.00 0.00 C ATOM 939 O SER S 514 -12.980 -9.932 -2.367 1.00 0.00 O ATOM 940 CB SER S 514 -13.436 -7.628 -0.937 1.00 0.00 C ATOM 941 OG SER S 514 -13.522 -8.631 0.062 1.00 0.00 O ATOM 0 H SER S 514 -12.117 -7.272 -3.785 1.00 0.00 H new ATOM 0 HA SER S 514 -11.296 -7.530 -1.108 1.00 0.00 H new ATOM 0 HB2 SER S 514 -13.473 -6.643 -0.472 1.00 0.00 H new ATOM 0 HB3 SER S 514 -14.296 -7.698 -1.603 1.00 0.00 H new ATOM 0 HG SER S 514 -14.355 -8.519 0.567 1.00 0.00 H new ATOM 947 N ALA S 515 -10.759 -9.604 -2.523 1.00 0.00 N ATOM 948 CA ALA S 515 -10.486 -10.953 -3.005 1.00 0.00 C ATOM 949 C ALA S 515 -9.370 -11.611 -2.200 1.00 0.00 C ATOM 950 O ALA S 515 -8.731 -10.968 -1.366 1.00 0.00 O ATOM 951 CB ALA S 515 -10.125 -10.922 -4.482 1.00 0.00 C ATOM 0 H ALA S 515 -9.932 -9.015 -2.426 1.00 0.00 H new ATOM 0 HA ALA S 515 -11.390 -11.547 -2.874 1.00 0.00 H new ATOM 0 HB1 ALA S 515 -9.924 -11.936 -4.829 1.00 0.00 H new ATOM 0 HB2 ALA S 515 -10.955 -10.502 -5.051 1.00 0.00 H new ATOM 0 HB3 ALA S 515 -9.237 -10.306 -4.627 1.00 0.00 H new ATOM 957 N THR S 516 -9.142 -12.894 -2.455 1.00 0.00 N ATOM 958 CA THR S 516 -8.102 -13.640 -1.755 1.00 0.00 C ATOM 959 C THR S 516 -7.145 -14.298 -2.743 1.00 0.00 C ATOM 960 O THR S 516 -7.342 -14.121 -3.964 1.00 0.00 O ATOM 961 CB THR S 516 -8.730 -14.702 -0.851 1.00 0.00 C ATOM 962 OG1 THR S 516 -9.565 -15.568 -1.600 1.00 0.00 O ATOM 963 CG2 THR S 516 -9.563 -14.119 0.271 1.00 0.00 C ATOM 964 OXT THR S 516 -6.205 -14.985 -2.287 1.00 0.00 O ATOM 0 H THR S 516 -9.663 -13.440 -3.141 1.00 0.00 H new ATOM 0 HA THR S 516 -7.536 -12.938 -1.142 1.00 0.00 H new ATOM 0 HB THR S 516 -7.890 -15.242 -0.415 1.00 0.00 H new ATOM 0 HG1 THR S 516 -9.956 -16.241 -1.005 1.00 0.00 H new ATOM 0 HG21 THR S 516 -9.979 -14.927 0.873 1.00 0.00 H new ATOM 0 HG22 THR S 516 -8.936 -13.485 0.898 1.00 0.00 H new ATOM 0 HG23 THR S 516 -10.375 -13.525 -0.149 1.00 0.00 H new TER 972 THR S 516 ATOM 973 N SER P 359 -13.108 7.783 -18.301 1.00 0.00 N ATOM 974 CA SER P 359 -12.155 8.647 -17.557 1.00 0.00 C ATOM 975 C SER P 359 -12.625 8.882 -16.125 1.00 0.00 C ATOM 976 O SER P 359 -13.718 9.403 -15.900 1.00 0.00 O ATOM 977 CB SER P 359 -12.024 9.980 -18.295 1.00 0.00 C ATOM 978 OG SER P 359 -11.945 9.781 -19.697 1.00 0.00 O ATOM 0 HA SER P 359 -11.187 8.149 -17.507 1.00 0.00 H new ATOM 0 HB2 SER P 359 -12.880 10.614 -18.062 1.00 0.00 H new ATOM 0 HB3 SER P 359 -11.134 10.505 -17.948 1.00 0.00 H new ATOM 0 HG SER P 359 -12.465 8.988 -19.945 1.00 0.00 H new ATOM 986 N LYS P 360 -11.795 8.498 -15.162 1.00 0.00 N ATOM 987 CA LYS P 360 -12.128 8.667 -13.753 1.00 0.00 C ATOM 988 C LYS P 360 -10.977 9.314 -12.990 1.00 0.00 C ATOM 989 O LYS P 360 -9.821 8.918 -13.136 1.00 0.00 O ATOM 990 CB LYS P 360 -12.473 7.319 -13.119 1.00 0.00 C ATOM 991 CG LYS P 360 -13.950 6.964 -13.196 1.00 0.00 C ATOM 992 CD LYS P 360 -14.417 6.260 -11.932 1.00 0.00 C ATOM 993 CE LYS P 360 -15.884 5.868 -12.021 1.00 0.00 C ATOM 994 NZ LYS P 360 -16.197 4.688 -11.169 1.00 0.00 N ATOM 0 H LYS P 360 -10.886 8.067 -15.332 1.00 0.00 H new ATOM 0 HA LYS P 360 -12.996 9.324 -13.694 1.00 0.00 H new ATOM 0 HB2 LYS P 360 -11.895 6.538 -13.612 1.00 0.00 H new ATOM 0 HB3 LYS P 360 -12.166 7.331 -12.073 1.00 0.00 H new ATOM 0 HG2 LYS P 360 -14.536 7.870 -13.347 1.00 0.00 H new ATOM 0 HG3 LYS P 360 -14.127 6.322 -14.059 1.00 0.00 H new ATOM 0 HD2 LYS P 360 -13.811 5.369 -11.765 1.00 0.00 H new ATOM 0 HD3 LYS P 360 -14.266 6.914 -11.073 1.00 0.00 H new ATOM 0 HE2 LYS P 360 -16.504 6.711 -11.715 1.00 0.00 H new ATOM 0 HE3 LYS P 360 -16.138 5.645 -13.057 1.00 0.00 H new ATOM 0 HZ1 LYS P 360 -17.206 4.453 -11.258 1.00 0.00 H new ATOM 0 HZ2 LYS P 360 -15.624 3.876 -11.476 1.00 0.00 H new ATOM 0 HZ3 LYS P 360 -15.979 4.909 -10.176 1.00 0.00 H new ATOM 1008 N PRO P 361 -11.285 10.325 -12.162 1.00 0.00 N ATOM 1009 CA PRO P 361 -10.294 11.042 -11.365 1.00 0.00 C ATOM 1010 C PRO P 361 -9.973 10.301 -10.072 1.00 0.00 C ATOM 1011 O PRO P 361 -10.781 10.278 -9.145 1.00 0.00 O ATOM 1012 CB PRO P 361 -10.986 12.386 -11.062 1.00 0.00 C ATOM 1013 CG PRO P 361 -12.327 12.317 -11.733 1.00 0.00 C ATOM 1014 CD PRO P 361 -12.622 10.867 -11.924 1.00 0.00 C ATOM 0 HA PRO P 361 -9.341 11.152 -11.883 1.00 0.00 H new ATOM 0 HB2 PRO P 361 -11.094 12.537 -9.988 1.00 0.00 H new ATOM 0 HB3 PRO P 361 -10.400 13.222 -11.444 1.00 0.00 H new ATOM 0 HG2 PRO P 361 -13.093 12.793 -11.121 1.00 0.00 H new ATOM 0 HG3 PRO P 361 -12.311 12.840 -12.689 1.00 0.00 H new ATOM 0 HD2 PRO P 361 -13.093 10.425 -11.046 1.00 0.00 H new ATOM 0 HD3 PRO P 361 -13.291 10.692 -12.766 1.00 0.00 H new ATOM 1022 N GLN P 362 -8.793 9.688 -10.018 1.00 0.00 N ATOM 1023 CA GLN P 362 -8.377 8.936 -8.838 1.00 0.00 C ATOM 1024 C GLN P 362 -8.617 9.723 -7.559 1.00 0.00 C ATOM 1025 O GLN P 362 -8.681 10.953 -7.566 1.00 0.00 O ATOM 1026 CB GLN P 362 -6.890 8.564 -8.914 1.00 0.00 C ATOM 1027 CG GLN P 362 -5.969 9.765 -9.052 1.00 0.00 C ATOM 1028 CD GLN P 362 -5.771 10.186 -10.495 1.00 0.00 C ATOM 1029 OE1 GLN P 362 -6.507 11.027 -11.015 1.00 0.00 O ATOM 1030 NE2 GLN P 362 -4.774 9.605 -11.149 1.00 0.00 N ATOM 0 H GLN P 362 -8.110 9.697 -10.776 1.00 0.00 H new ATOM 0 HA GLN P 362 -8.981 8.029 -8.819 1.00 0.00 H new ATOM 0 HB2 GLN P 362 -6.617 8.008 -8.017 1.00 0.00 H new ATOM 0 HB3 GLN P 362 -6.734 7.897 -9.762 1.00 0.00 H new ATOM 0 HG2 GLN P 362 -6.381 10.601 -8.487 1.00 0.00 H new ATOM 0 HG3 GLN P 362 -5.001 9.528 -8.610 1.00 0.00 H new ATOM 0 HE21 GLN P 362 -4.190 8.914 -10.679 1.00 0.00 H new ATOM 0 HE22 GLN P 362 -4.592 9.849 -12.122 1.00 0.00 H new ATOM 1039 N PRO P 363 -8.735 9.005 -6.438 1.00 0.00 N ATOM 1040 CA PRO P 363 -8.953 9.617 -5.136 1.00 0.00 C ATOM 1041 C PRO P 363 -7.757 10.441 -4.689 1.00 0.00 C ATOM 1042 O PRO P 363 -6.657 9.911 -4.539 1.00 0.00 O ATOM 1043 CB PRO P 363 -9.146 8.436 -4.180 1.00 0.00 C ATOM 1044 CG PRO P 363 -8.754 7.201 -4.922 1.00 0.00 C ATOM 1045 CD PRO P 363 -8.653 7.540 -6.378 1.00 0.00 C ATOM 0 HA PRO P 363 -9.804 10.298 -5.161 1.00 0.00 H new ATOM 0 HB2 PRO P 363 -8.533 8.559 -3.287 1.00 0.00 H new ATOM 0 HB3 PRO P 363 -10.183 8.374 -3.849 1.00 0.00 H new ATOM 0 HG2 PRO P 363 -7.801 6.823 -4.553 1.00 0.00 H new ATOM 0 HG3 PRO P 363 -9.491 6.414 -4.766 1.00 0.00 H new ATOM 0 HD2 PRO P 363 -7.716 7.180 -6.802 1.00 0.00 H new ATOM 0 HD3 PRO P 363 -9.459 7.077 -6.947 1.00 0.00 H new ATOM 1053 N ALA P 364 -7.969 11.733 -4.453 1.00 0.00 N ATOM 1054 CA ALA P 364 -6.886 12.594 -3.995 1.00 0.00 C ATOM 1055 C ALA P 364 -6.192 11.932 -2.814 1.00 0.00 C ATOM 1056 O ALA P 364 -6.723 11.913 -1.704 1.00 0.00 O ATOM 1057 CB ALA P 364 -7.418 13.966 -3.608 1.00 0.00 C ATOM 0 H ALA P 364 -8.868 12.200 -4.570 1.00 0.00 H new ATOM 0 HA ALA P 364 -6.168 12.734 -4.803 1.00 0.00 H new ATOM 0 HB1 ALA P 364 -6.594 14.593 -3.269 1.00 0.00 H new ATOM 0 HB2 ALA P 364 -7.894 14.429 -4.472 1.00 0.00 H new ATOM 0 HB3 ALA P 364 -8.148 13.860 -2.805 1.00 0.00 H new ATOM 1063 N VAL P 365 -5.024 11.351 -3.064 1.00 0.00 N ATOM 1064 CA VAL P 365 -4.297 10.646 -2.014 1.00 0.00 C ATOM 1065 C VAL P 365 -4.189 11.495 -0.749 1.00 0.00 C ATOM 1066 O VAL P 365 -3.864 12.681 -0.806 1.00 0.00 O ATOM 1067 CB VAL P 365 -2.888 10.196 -2.452 1.00 0.00 C ATOM 1068 CG1 VAL P 365 -2.463 8.990 -1.645 1.00 0.00 C ATOM 1069 CG2 VAL P 365 -2.842 9.857 -3.932 1.00 0.00 C ATOM 0 H VAL P 365 -4.564 11.353 -3.974 1.00 0.00 H new ATOM 0 HA VAL P 365 -4.880 9.749 -1.803 1.00 0.00 H new ATOM 0 HB VAL P 365 -2.203 11.025 -2.274 1.00 0.00 H new ATOM 0 HG11 VAL P 365 -1.467 8.676 -1.958 1.00 0.00 H new ATOM 0 HG12 VAL P 365 -2.446 9.248 -0.586 1.00 0.00 H new ATOM 0 HG13 VAL P 365 -3.169 8.176 -1.809 1.00 0.00 H new ATOM 0 HG21 VAL P 365 -1.833 9.544 -4.202 1.00 0.00 H new ATOM 0 HG22 VAL P 365 -3.541 9.048 -4.142 1.00 0.00 H new ATOM 0 HG23 VAL P 365 -3.118 10.735 -4.515 1.00 0.00 H new ATOM 1079 N PRO P 366 -4.485 10.888 0.414 1.00 0.00 N ATOM 1080 CA PRO P 366 -4.449 11.573 1.709 1.00 0.00 C ATOM 1081 C PRO P 366 -3.045 11.658 2.295 1.00 0.00 C ATOM 1082 O PRO P 366 -2.105 11.062 1.768 1.00 0.00 O ATOM 1083 CB PRO P 366 -5.323 10.671 2.579 1.00 0.00 C ATOM 1084 CG PRO P 366 -5.086 9.303 2.037 1.00 0.00 C ATOM 1085 CD PRO P 366 -4.897 9.475 0.552 1.00 0.00 C ATOM 0 HA PRO P 366 -4.784 12.608 1.636 1.00 0.00 H new ATOM 0 HB2 PRO P 366 -5.042 10.738 3.630 1.00 0.00 H new ATOM 0 HB3 PRO P 366 -6.375 10.950 2.512 1.00 0.00 H new ATOM 0 HG2 PRO P 366 -4.206 8.849 2.493 1.00 0.00 H new ATOM 0 HG3 PRO P 366 -5.930 8.647 2.250 1.00 0.00 H new ATOM 0 HD2 PRO P 366 -4.138 8.796 0.163 1.00 0.00 H new ATOM 0 HD3 PRO P 366 -5.817 9.271 0.005 1.00 0.00 H new ATOM 1093 N PRO P 367 -2.888 12.383 3.417 1.00 0.00 N ATOM 1094 CA PRO P 367 -1.596 12.520 4.092 1.00 0.00 C ATOM 1095 C PRO P 367 -1.131 11.181 4.636 1.00 0.00 C ATOM 1096 O PRO P 367 -1.518 10.766 5.728 1.00 0.00 O ATOM 1097 CB PRO P 367 -1.889 13.487 5.235 1.00 0.00 C ATOM 1098 CG PRO P 367 -3.335 13.295 5.493 1.00 0.00 C ATOM 1099 CD PRO P 367 -3.951 13.102 4.138 1.00 0.00 C ATOM 0 HA PRO P 367 -0.806 12.871 3.428 1.00 0.00 H new ATOM 0 HB2 PRO P 367 -1.291 13.258 6.117 1.00 0.00 H new ATOM 0 HB3 PRO P 367 -1.665 14.517 4.956 1.00 0.00 H new ATOM 0 HG2 PRO P 367 -3.510 12.430 6.133 1.00 0.00 H new ATOM 0 HG3 PRO P 367 -3.763 14.159 6.001 1.00 0.00 H new ATOM 0 HD2 PRO P 367 -4.873 12.523 4.188 1.00 0.00 H new ATOM 0 HD3 PRO P 367 -4.196 14.052 3.662 1.00 0.00 H new ATOM 1107 N ARG P 368 -0.323 10.507 3.841 1.00 0.00 N ATOM 1108 CA ARG P 368 0.200 9.185 4.186 1.00 0.00 C ATOM 1109 C ARG P 368 0.569 9.076 5.658 1.00 0.00 C ATOM 1110 O ARG P 368 0.772 10.071 6.354 1.00 0.00 O ATOM 1111 CB ARG P 368 1.414 8.814 3.314 1.00 0.00 C ATOM 1112 CG ARG P 368 2.053 9.985 2.580 1.00 0.00 C ATOM 1113 CD ARG P 368 2.422 11.111 3.533 1.00 0.00 C ATOM 1114 NE ARG P 368 3.639 11.804 3.116 1.00 0.00 N ATOM 1115 CZ ARG P 368 4.366 12.573 3.922 1.00 0.00 C ATOM 1116 NH1 ARG P 368 4.003 12.751 5.187 1.00 0.00 N ATOM 1117 NH2 ARG P 368 5.459 13.167 3.462 1.00 0.00 N ATOM 0 H ARG P 368 -0.006 10.854 2.936 1.00 0.00 H new ATOM 0 HA ARG P 368 -0.606 8.478 3.988 1.00 0.00 H new ATOM 0 HB2 ARG P 368 2.168 8.344 3.946 1.00 0.00 H new ATOM 0 HB3 ARG P 368 1.103 8.069 2.581 1.00 0.00 H new ATOM 0 HG2 ARG P 368 2.946 9.643 2.057 1.00 0.00 H new ATOM 0 HG3 ARG P 368 1.364 10.360 1.823 1.00 0.00 H new ATOM 0 HD2 ARG P 368 1.599 11.824 3.588 1.00 0.00 H new ATOM 0 HD3 ARG P 368 2.560 10.707 4.536 1.00 0.00 H new ATOM 0 HE ARG P 368 3.949 11.692 2.151 1.00 0.00 H new ATOM 0 HH11 ARG P 368 3.163 12.297 5.545 1.00 0.00 H new ATOM 0 HH12 ARG P 368 4.564 13.342 5.800 1.00 0.00 H new ATOM 0 HH21 ARG P 368 5.741 13.034 2.491 1.00 0.00 H new ATOM 0 HH22 ARG P 368 6.017 13.757 4.079 1.00 0.00 H new ATOM 1131 N PRO P 369 0.645 7.830 6.135 1.00 0.00 N ATOM 1132 CA PRO P 369 0.973 7.502 7.526 1.00 0.00 C ATOM 1133 C PRO P 369 2.209 8.236 8.025 1.00 0.00 C ATOM 1134 O PRO P 369 2.891 8.917 7.259 1.00 0.00 O ATOM 1135 CB PRO P 369 1.215 5.998 7.461 1.00 0.00 C ATOM 1136 CG PRO P 369 0.333 5.545 6.349 1.00 0.00 C ATOM 1137 CD PRO P 369 0.406 6.624 5.326 1.00 0.00 C ATOM 0 HA PRO P 369 0.188 7.796 8.223 1.00 0.00 H new ATOM 0 HB2 PRO P 369 2.262 5.769 7.260 1.00 0.00 H new ATOM 0 HB3 PRO P 369 0.957 5.510 8.401 1.00 0.00 H new ATOM 0 HG2 PRO P 369 0.672 4.593 5.941 1.00 0.00 H new ATOM 0 HG3 PRO P 369 -0.691 5.398 6.694 1.00 0.00 H new ATOM 0 HD2 PRO P 369 1.212 6.450 4.613 1.00 0.00 H new ATOM 0 HD3 PRO P 369 -0.518 6.699 4.752 1.00 0.00 H new ATOM 1145 N SER P 370 2.493 8.098 9.316 1.00 0.00 N ATOM 1146 CA SER P 370 3.648 8.750 9.919 1.00 0.00 C ATOM 1147 C SER P 370 4.887 7.861 9.848 1.00 0.00 C ATOM 1148 O SER P 370 5.811 8.009 10.648 1.00 0.00 O ATOM 1149 CB SER P 370 3.351 9.114 11.375 1.00 0.00 C ATOM 1150 OG SER P 370 2.826 10.427 11.475 1.00 0.00 O ATOM 0 H SER P 370 1.938 7.540 9.965 1.00 0.00 H new ATOM 0 HA SER P 370 3.849 9.660 9.354 1.00 0.00 H new ATOM 0 HB2 SER P 370 2.640 8.402 11.794 1.00 0.00 H new ATOM 0 HB3 SER P 370 4.264 9.038 11.966 1.00 0.00 H new ATOM 0 HG SER P 370 2.643 10.635 12.415 1.00 0.00 H new ATOM 1156 N ALA P 371 4.902 6.936 8.889 1.00 0.00 N ATOM 1157 CA ALA P 371 6.027 6.023 8.712 1.00 0.00 C ATOM 1158 C ALA P 371 6.108 5.005 9.848 1.00 0.00 C ATOM 1159 O ALA P 371 6.104 3.801 9.615 1.00 0.00 O ATOM 1160 CB ALA P 371 7.332 6.799 8.594 1.00 0.00 C ATOM 0 H ALA P 371 4.143 6.800 8.221 1.00 0.00 H new ATOM 0 HA ALA P 371 5.863 5.472 7.786 1.00 0.00 H new ATOM 0 HB1 ALA P 371 8.159 6.102 8.463 1.00 0.00 H new ATOM 0 HB2 ALA P 371 7.281 7.468 7.735 1.00 0.00 H new ATOM 0 HB3 ALA P 371 7.491 7.384 9.500 1.00 0.00 H new ATOM 1166 N ASP P 372 6.192 5.490 11.079 1.00 0.00 N ATOM 1167 CA ASP P 372 6.281 4.606 12.237 1.00 0.00 C ATOM 1168 C ASP P 372 5.131 3.607 12.263 1.00 0.00 C ATOM 1169 O ASP P 372 5.371 2.400 12.270 1.00 0.00 O ATOM 1170 CB ASP P 372 6.310 5.417 13.533 1.00 0.00 C ATOM 1171 CG ASP P 372 7.722 5.756 13.971 1.00 0.00 C ATOM 1172 OD1 ASP P 372 8.391 4.876 14.551 1.00 0.00 O ATOM 1173 OD2 ASP P 372 8.156 6.903 13.736 1.00 0.00 O ATOM 0 H ASP P 372 6.201 6.485 11.303 1.00 0.00 H new ATOM 0 HA ASP P 372 7.212 4.045 12.154 1.00 0.00 H new ATOM 0 HB2 ASP P 372 5.744 6.338 13.395 1.00 0.00 H new ATOM 0 HB3 ASP P 372 5.813 4.853 14.322 1.00 0.00 H new ATOM 1178 N LEU P 373 3.879 4.081 12.268 1.00 0.00 N ATOM 1179 CA LEU P 373 2.764 3.140 12.283 1.00 0.00 C ATOM 1180 C LEU P 373 2.906 2.182 11.111 1.00 0.00 C ATOM 1181 O LEU P 373 2.511 1.020 11.196 1.00 0.00 O ATOM 1182 CB LEU P 373 1.382 3.832 12.331 1.00 0.00 C ATOM 1183 CG LEU P 373 0.844 4.513 11.058 1.00 0.00 C ATOM 1184 CD1 LEU P 373 0.944 3.624 9.834 1.00 0.00 C ATOM 1185 CD2 LEU P 373 -0.609 4.901 11.274 1.00 0.00 C ATOM 0 H LEU P 373 3.623 5.068 12.262 1.00 0.00 H new ATOM 0 HA LEU P 373 2.809 2.569 13.210 1.00 0.00 H new ATOM 0 HB2 LEU P 373 0.650 3.085 12.639 1.00 0.00 H new ATOM 0 HB3 LEU P 373 1.418 4.586 13.117 1.00 0.00 H new ATOM 0 HG LEU P 373 1.460 5.393 10.875 1.00 0.00 H new ATOM 0 HD11 LEU P 373 0.551 4.154 8.966 1.00 0.00 H new ATOM 0 HD12 LEU P 373 1.988 3.363 9.658 1.00 0.00 H new ATOM 0 HD13 LEU P 373 0.365 2.715 9.997 1.00 0.00 H new ATOM 0 HD21 LEU P 373 -0.994 5.383 10.376 1.00 0.00 H new ATOM 0 HD22 LEU P 373 -1.196 4.008 11.486 1.00 0.00 H new ATOM 0 HD23 LEU P 373 -0.680 5.591 12.115 1.00 0.00 H new ATOM 1197 N ILE P 374 3.546 2.655 10.037 1.00 0.00 N ATOM 1198 CA ILE P 374 3.808 1.807 8.891 1.00 0.00 C ATOM 1199 C ILE P 374 4.813 0.764 9.337 1.00 0.00 C ATOM 1200 O ILE P 374 4.627 -0.436 9.143 1.00 0.00 O ATOM 1201 CB ILE P 374 4.390 2.592 7.692 1.00 0.00 C ATOM 1202 CG1 ILE P 374 3.374 3.606 7.164 1.00 0.00 C ATOM 1203 CG2 ILE P 374 4.823 1.640 6.592 1.00 0.00 C ATOM 1204 CD1 ILE P 374 3.920 4.485 6.061 1.00 0.00 C ATOM 0 H ILE P 374 3.886 3.612 9.946 1.00 0.00 H new ATOM 0 HA ILE P 374 2.871 1.366 8.553 1.00 0.00 H new ATOM 0 HB ILE P 374 5.268 3.140 8.035 1.00 0.00 H new ATOM 0 HG12 ILE P 374 2.498 3.073 6.794 1.00 0.00 H new ATOM 0 HG13 ILE P 374 3.039 4.236 7.988 1.00 0.00 H new ATOM 0 HG21 ILE P 374 5.230 2.210 5.757 1.00 0.00 H new ATOM 0 HG22 ILE P 374 5.587 0.964 6.976 1.00 0.00 H new ATOM 0 HG23 ILE P 374 3.964 1.062 6.252 1.00 0.00 H new ATOM 0 HD11 ILE P 374 3.147 5.180 5.734 1.00 0.00 H new ATOM 0 HD12 ILE P 374 4.778 5.045 6.433 1.00 0.00 H new ATOM 0 HD13 ILE P 374 4.229 3.864 5.220 1.00 0.00 H new ATOM 1216 N LEU P 375 5.855 1.254 9.998 1.00 0.00 N ATOM 1217 CA LEU P 375 6.889 0.402 10.552 1.00 0.00 C ATOM 1218 C LEU P 375 6.260 -0.566 11.549 1.00 0.00 C ATOM 1219 O LEU P 375 6.799 -1.636 11.828 1.00 0.00 O ATOM 1220 CB LEU P 375 7.958 1.275 11.218 1.00 0.00 C ATOM 1221 CG LEU P 375 8.736 2.164 10.246 1.00 0.00 C ATOM 1222 CD1 LEU P 375 9.066 3.506 10.880 1.00 0.00 C ATOM 1223 CD2 LEU P 375 10.014 1.475 9.784 1.00 0.00 C ATOM 0 H LEU P 375 6.003 2.250 10.162 1.00 0.00 H new ATOM 0 HA LEU P 375 7.366 -0.181 9.764 1.00 0.00 H new ATOM 0 HB2 LEU P 375 7.481 1.906 11.967 1.00 0.00 H new ATOM 0 HB3 LEU P 375 8.661 0.630 11.745 1.00 0.00 H new ATOM 0 HG LEU P 375 8.101 2.339 9.377 1.00 0.00 H new ATOM 0 HD11 LEU P 375 9.619 4.119 10.168 1.00 0.00 H new ATOM 0 HD12 LEU P 375 8.142 4.015 11.156 1.00 0.00 H new ATOM 0 HD13 LEU P 375 9.673 3.348 11.771 1.00 0.00 H new ATOM 0 HD21 LEU P 375 10.550 2.127 9.094 1.00 0.00 H new ATOM 0 HD22 LEU P 375 10.645 1.263 10.647 1.00 0.00 H new ATOM 0 HD23 LEU P 375 9.763 0.542 9.280 1.00 0.00 H new ATOM 1235 N ASN P 376 5.096 -0.172 12.057 1.00 0.00 N ATOM 1236 CA ASN P 376 4.341 -0.976 13.001 1.00 0.00 C ATOM 1237 C ASN P 376 3.367 -1.896 12.264 1.00 0.00 C ATOM 1238 O ASN P 376 2.912 -2.900 12.811 1.00 0.00 O ATOM 1239 CB ASN P 376 3.564 -0.060 13.950 1.00 0.00 C ATOM 1240 CG ASN P 376 3.766 -0.426 15.406 1.00 0.00 C ATOM 1241 OD1 ASN P 376 4.589 0.170 16.101 1.00 0.00 O ATOM 1242 ND2 ASN P 376 3.013 -1.413 15.878 1.00 0.00 N ATOM 0 H ASN P 376 4.652 0.716 11.823 1.00 0.00 H new ATOM 0 HA ASN P 376 5.037 -1.590 13.572 1.00 0.00 H new ATOM 0 HB2 ASN P 376 3.878 0.972 13.791 1.00 0.00 H new ATOM 0 HB3 ASN P 376 2.502 -0.111 13.710 1.00 0.00 H new ATOM 0 HD21 ASN P 376 3.105 -1.704 16.851 1.00 0.00 H new ATOM 0 HD22 ASN P 376 2.343 -1.880 15.267 1.00 0.00 H new ATOM 1249 N ARG P 377 3.030 -1.529 11.026 1.00 0.00 N ATOM 1250 CA ARG P 377 2.086 -2.307 10.229 1.00 0.00 C ATOM 1251 C ARG P 377 2.620 -2.618 8.823 1.00 0.00 C ATOM 1252 O ARG P 377 1.858 -2.608 7.856 1.00 0.00 O ATOM 1253 CB ARG P 377 0.759 -1.548 10.118 1.00 0.00 C ATOM 1254 CG ARG P 377 0.131 -1.203 11.462 1.00 0.00 C ATOM 1255 CD ARG P 377 -0.091 0.299 11.624 1.00 0.00 C ATOM 1256 NE ARG P 377 0.453 0.794 12.887 1.00 0.00 N ATOM 1257 CZ ARG P 377 -0.175 0.696 14.056 1.00 0.00 C ATOM 1258 NH1 ARG P 377 -1.368 0.120 14.129 1.00 0.00 N ATOM 1259 NH2 ARG P 377 0.390 1.176 15.155 1.00 0.00 N ATOM 0 H ARG P 377 3.396 -0.701 10.557 1.00 0.00 H new ATOM 0 HA ARG P 377 1.938 -3.259 10.739 1.00 0.00 H new ATOM 0 HB2 ARG P 377 0.924 -0.627 9.558 1.00 0.00 H new ATOM 0 HB3 ARG P 377 0.055 -2.149 9.543 1.00 0.00 H new ATOM 0 HG2 ARG P 377 -0.822 -1.722 11.560 1.00 0.00 H new ATOM 0 HG3 ARG P 377 0.774 -1.563 12.265 1.00 0.00 H new ATOM 0 HD2 ARG P 377 0.378 0.828 10.794 1.00 0.00 H new ATOM 0 HD3 ARG P 377 -1.158 0.516 11.578 1.00 0.00 H new ATOM 0 HE ARG P 377 1.369 1.242 12.871 1.00 0.00 H new ATOM 0 HH11 ARG P 377 -1.808 -0.250 13.287 1.00 0.00 H new ATOM 0 HH12 ARG P 377 -1.845 0.047 15.028 1.00 0.00 H new ATOM 0 HH21 ARG P 377 1.307 1.621 15.105 1.00 0.00 H new ATOM 0 HH22 ARG P 377 -0.092 1.101 16.051 1.00 0.00 H new ATOM 1273 N CYS P 378 3.916 -2.912 8.707 1.00 0.00 N ATOM 1274 CA CYS P 378 4.503 -3.239 7.402 1.00 0.00 C ATOM 1275 C CYS P 378 5.763 -4.087 7.549 1.00 0.00 C ATOM 1276 O CYS P 378 6.172 -4.434 8.655 1.00 0.00 O ATOM 1277 CB CYS P 378 4.836 -1.973 6.607 1.00 0.00 C ATOM 1278 SG CYS P 378 3.475 -1.362 5.588 1.00 0.00 S ATOM 0 H CYS P 378 4.573 -2.931 9.487 1.00 0.00 H new ATOM 0 HA CYS P 378 3.753 -3.814 6.859 1.00 0.00 H new ATOM 0 HB2 CYS P 378 5.136 -1.189 7.302 1.00 0.00 H new ATOM 0 HB3 CYS P 378 5.694 -2.175 5.965 1.00 0.00 H new ATOM 0 HG CYS P 378 3.824 -1.390 4.336 1.00 0.00 H new ATOM 1284 N SER P 379 6.371 -4.412 6.409 1.00 0.00 N ATOM 1285 CA SER P 379 7.588 -5.215 6.382 1.00 0.00 C ATOM 1286 C SER P 379 8.823 -4.319 6.408 1.00 0.00 C ATOM 1287 O SER P 379 8.725 -3.106 6.233 1.00 0.00 O ATOM 1288 CB SER P 379 7.609 -6.099 5.131 1.00 0.00 C ATOM 1289 OG SER P 379 7.637 -7.474 5.479 1.00 0.00 O ATOM 0 H SER P 379 6.037 -4.129 5.488 1.00 0.00 H new ATOM 0 HA SER P 379 7.601 -5.851 7.267 1.00 0.00 H new ATOM 0 HB2 SER P 379 6.729 -5.893 4.521 1.00 0.00 H new ATOM 0 HB3 SER P 379 8.482 -5.856 4.525 1.00 0.00 H new ATOM 0 HG SER P 379 7.648 -8.018 4.664 1.00 0.00 H new ATOM 1295 N GLU P 380 9.985 -4.926 6.628 1.00 0.00 N ATOM 1296 CA GLU P 380 11.238 -4.181 6.676 1.00 0.00 C ATOM 1297 C GLU P 380 11.516 -3.495 5.341 1.00 0.00 C ATOM 1298 O GLU P 380 12.099 -2.412 5.299 1.00 0.00 O ATOM 1299 CB GLU P 380 12.397 -5.110 7.037 1.00 0.00 C ATOM 1300 CG GLU P 380 12.280 -5.718 8.424 1.00 0.00 C ATOM 1301 CD GLU P 380 12.951 -4.874 9.490 1.00 0.00 C ATOM 1302 OE1 GLU P 380 14.160 -4.593 9.350 1.00 0.00 O ATOM 1303 OE2 GLU P 380 12.268 -4.494 10.464 1.00 0.00 O ATOM 0 H GLU P 380 10.085 -5.930 6.776 1.00 0.00 H new ATOM 0 HA GLU P 380 11.145 -3.414 7.445 1.00 0.00 H new ATOM 0 HB2 GLU P 380 12.451 -5.912 6.301 1.00 0.00 H new ATOM 0 HB3 GLU P 380 13.332 -4.553 6.971 1.00 0.00 H new ATOM 0 HG2 GLU P 380 11.226 -5.842 8.674 1.00 0.00 H new ATOM 0 HG3 GLU P 380 12.726 -6.713 8.419 1.00 0.00 H new ATOM 1310 N SER P 381 11.093 -4.131 4.254 1.00 0.00 N ATOM 1311 CA SER P 381 11.297 -3.581 2.918 1.00 0.00 C ATOM 1312 C SER P 381 10.663 -2.196 2.803 1.00 0.00 C ATOM 1313 O SER P 381 11.362 -1.193 2.661 1.00 0.00 O ATOM 1314 CB SER P 381 10.710 -4.517 1.862 1.00 0.00 C ATOM 1315 OG SER P 381 11.072 -4.105 0.556 1.00 0.00 O ATOM 0 H SER P 381 10.607 -5.028 4.271 1.00 0.00 H new ATOM 0 HA SER P 381 12.369 -3.487 2.747 1.00 0.00 H new ATOM 0 HB2 SER P 381 11.063 -5.534 2.037 1.00 0.00 H new ATOM 0 HB3 SER P 381 9.624 -4.536 1.952 1.00 0.00 H new ATOM 0 HG SER P 381 10.810 -4.795 -0.089 1.00 0.00 H new ATOM 1321 N THR P 382 9.336 -2.151 2.871 1.00 0.00 N ATOM 1322 CA THR P 382 8.610 -0.888 2.785 1.00 0.00 C ATOM 1323 C THR P 382 9.034 0.054 3.909 1.00 0.00 C ATOM 1324 O THR P 382 8.860 1.269 3.814 1.00 0.00 O ATOM 1325 CB THR P 382 7.099 -1.140 2.849 1.00 0.00 C ATOM 1326 OG1 THR P 382 6.656 -1.816 1.687 1.00 0.00 O ATOM 1327 CG2 THR P 382 6.276 0.125 2.982 1.00 0.00 C ATOM 0 H THR P 382 8.742 -2.973 2.985 1.00 0.00 H new ATOM 0 HA THR P 382 8.850 -0.418 1.831 1.00 0.00 H new ATOM 0 HB THR P 382 6.950 -1.743 3.745 1.00 0.00 H new ATOM 0 HG1 THR P 382 5.705 -2.033 1.777 1.00 0.00 H new ATOM 0 HG21 THR P 382 5.217 -0.132 3.021 1.00 0.00 H new ATOM 0 HG22 THR P 382 6.557 0.647 3.897 1.00 0.00 H new ATOM 0 HG23 THR P 382 6.461 0.771 2.124 1.00 0.00 H new ATOM 1335 N LYS P 383 9.590 -0.515 4.973 1.00 0.00 N ATOM 1336 CA LYS P 383 10.038 0.267 6.117 1.00 0.00 C ATOM 1337 C LYS P 383 11.353 0.979 5.811 1.00 0.00 C ATOM 1338 O LYS P 383 11.575 2.107 6.251 1.00 0.00 O ATOM 1339 CB LYS P 383 10.207 -0.638 7.336 1.00 0.00 C ATOM 1340 CG LYS P 383 8.904 -0.901 8.070 1.00 0.00 C ATOM 1341 CD LYS P 383 8.962 -2.188 8.877 1.00 0.00 C ATOM 1342 CE LYS P 383 9.638 -1.975 10.222 1.00 0.00 C ATOM 1343 NZ LYS P 383 9.656 -3.220 11.039 1.00 0.00 N ATOM 0 H LYS P 383 9.741 -1.519 5.066 1.00 0.00 H new ATOM 0 HA LYS P 383 9.281 1.022 6.331 1.00 0.00 H new ATOM 0 HB2 LYS P 383 10.636 -1.588 7.018 1.00 0.00 H new ATOM 0 HB3 LYS P 383 10.918 -0.181 8.024 1.00 0.00 H new ATOM 0 HG2 LYS P 383 8.685 -0.065 8.734 1.00 0.00 H new ATOM 0 HG3 LYS P 383 8.087 -0.959 7.351 1.00 0.00 H new ATOM 0 HD2 LYS P 383 7.952 -2.566 9.033 1.00 0.00 H new ATOM 0 HD3 LYS P 383 9.503 -2.948 8.313 1.00 0.00 H new ATOM 0 HE2 LYS P 383 10.660 -1.630 10.064 1.00 0.00 H new ATOM 0 HE3 LYS P 383 9.117 -1.189 10.769 1.00 0.00 H new ATOM 0 HZ1 LYS P 383 9.580 -2.975 12.047 1.00 0.00 H new ATOM 0 HZ2 LYS P 383 8.854 -3.824 10.768 1.00 0.00 H new ATOM 0 HZ3 LYS P 383 10.546 -3.731 10.873 1.00 0.00 H new ATOM 1357 N ARG P 384 12.220 0.313 5.056 1.00 0.00 N ATOM 1358 CA ARG P 384 13.513 0.883 4.689 1.00 0.00 C ATOM 1359 C ARG P 384 13.345 2.264 4.063 1.00 0.00 C ATOM 1360 O ARG P 384 14.242 3.104 4.137 1.00 0.00 O ATOM 1361 CB ARG P 384 14.245 -0.044 3.718 1.00 0.00 C ATOM 1362 CG ARG P 384 14.834 -1.279 4.381 1.00 0.00 C ATOM 1363 CD ARG P 384 16.345 -1.177 4.517 1.00 0.00 C ATOM 1364 NE ARG P 384 16.827 -1.780 5.758 1.00 0.00 N ATOM 1365 CZ ARG P 384 16.782 -1.175 6.943 1.00 0.00 C ATOM 1366 NH1 ARG P 384 16.277 0.048 7.053 1.00 0.00 N ATOM 1367 NH2 ARG P 384 17.243 -1.793 8.021 1.00 0.00 N ATOM 0 H ARG P 384 12.052 -0.622 4.686 1.00 0.00 H new ATOM 0 HA ARG P 384 14.105 0.988 5.598 1.00 0.00 H new ATOM 0 HB2 ARG P 384 13.553 -0.357 2.936 1.00 0.00 H new ATOM 0 HB3 ARG P 384 15.045 0.513 3.231 1.00 0.00 H new ATOM 0 HG2 ARG P 384 14.388 -1.411 5.367 1.00 0.00 H new ATOM 0 HG3 ARG P 384 14.580 -2.163 3.796 1.00 0.00 H new ATOM 0 HD2 ARG P 384 16.819 -1.669 3.668 1.00 0.00 H new ATOM 0 HD3 ARG P 384 16.642 -0.129 4.485 1.00 0.00 H new ATOM 0 HE ARG P 384 17.221 -2.720 5.714 1.00 0.00 H new ATOM 0 HH11 ARG P 384 15.921 0.529 6.227 1.00 0.00 H new ATOM 0 HH12 ARG P 384 16.245 0.507 7.964 1.00 0.00 H new ATOM 0 HH21 ARG P 384 17.632 -2.732 7.943 1.00 0.00 H new ATOM 0 HH22 ARG P 384 17.208 -1.329 8.929 1.00 0.00 H new ATOM 1381 N LYS P 385 12.190 2.493 3.445 1.00 0.00 N ATOM 1382 CA LYS P 385 11.903 3.772 2.808 1.00 0.00 C ATOM 1383 C LYS P 385 11.610 4.845 3.852 1.00 0.00 C ATOM 1384 O LYS P 385 11.904 6.022 3.646 1.00 0.00 O ATOM 1385 CB LYS P 385 10.716 3.630 1.854 1.00 0.00 C ATOM 1386 CG LYS P 385 10.972 2.672 0.701 1.00 0.00 C ATOM 1387 CD LYS P 385 10.734 1.228 1.112 1.00 0.00 C ATOM 1388 CE LYS P 385 10.260 0.386 -0.062 1.00 0.00 C ATOM 1389 NZ LYS P 385 10.887 -0.965 -0.070 1.00 0.00 N ATOM 0 H LYS P 385 11.438 1.808 3.372 1.00 0.00 H new ATOM 0 HA LYS P 385 12.782 4.077 2.241 1.00 0.00 H new ATOM 0 HB2 LYS P 385 9.848 3.285 2.416 1.00 0.00 H new ATOM 0 HB3 LYS P 385 10.465 4.611 1.451 1.00 0.00 H new ATOM 0 HG2 LYS P 385 10.320 2.925 -0.135 1.00 0.00 H new ATOM 0 HG3 LYS P 385 11.998 2.787 0.352 1.00 0.00 H new ATOM 0 HD2 LYS P 385 11.655 0.807 1.515 1.00 0.00 H new ATOM 0 HD3 LYS P 385 9.992 1.193 1.909 1.00 0.00 H new ATOM 0 HE2 LYS P 385 9.176 0.282 -0.019 1.00 0.00 H new ATOM 0 HE3 LYS P 385 10.494 0.900 -0.994 1.00 0.00 H new ATOM 0 HZ1 LYS P 385 11.518 -1.050 -0.892 1.00 0.00 H new ATOM 0 HZ2 LYS P 385 11.436 -1.098 0.803 1.00 0.00 H new ATOM 0 HZ3 LYS P 385 10.145 -1.692 -0.126 1.00 0.00 H new ATOM 1403 N LEU P 386 11.030 4.428 4.973 1.00 0.00 N ATOM 1404 CA LEU P 386 10.699 5.352 6.055 1.00 0.00 C ATOM 1405 C LEU P 386 11.597 5.112 7.264 1.00 0.00 C ATOM 1406 O LEU P 386 11.159 5.225 8.408 1.00 0.00 O ATOM 1407 CB LEU P 386 9.228 5.205 6.459 1.00 0.00 C ATOM 1408 CG LEU P 386 8.631 3.809 6.265 1.00 0.00 C ATOM 1409 CD1 LEU P 386 7.581 3.529 7.322 1.00 0.00 C ATOM 1410 CD2 LEU P 386 8.028 3.673 4.875 1.00 0.00 C ATOM 0 H LEU P 386 10.779 3.457 5.157 1.00 0.00 H new ATOM 0 HA LEU P 386 10.864 6.367 5.693 1.00 0.00 H new ATOM 0 HB2 LEU P 386 9.127 5.482 7.508 1.00 0.00 H new ATOM 0 HB3 LEU P 386 8.638 5.918 5.883 1.00 0.00 H new ATOM 0 HG LEU P 386 9.433 3.077 6.368 1.00 0.00 H new ATOM 0 HD11 LEU P 386 7.167 2.532 7.169 1.00 0.00 H new ATOM 0 HD12 LEU P 386 8.036 3.585 8.311 1.00 0.00 H new ATOM 0 HD13 LEU P 386 6.784 4.268 7.247 1.00 0.00 H new ATOM 0 HD21 LEU P 386 7.609 2.674 4.756 1.00 0.00 H new ATOM 0 HD22 LEU P 386 7.240 4.415 4.746 1.00 0.00 H new ATOM 0 HD23 LEU P 386 8.803 3.833 4.125 1.00 0.00 H new ATOM 1422 N ALA P 387 12.857 4.781 7.002 1.00 0.00 N ATOM 1423 CA ALA P 387 13.818 4.524 8.069 1.00 0.00 C ATOM 1424 C ALA P 387 14.021 5.764 8.934 1.00 0.00 C ATOM 1425 O ALA P 387 14.285 5.661 10.131 1.00 0.00 O ATOM 1426 CB ALA P 387 15.144 4.064 7.484 1.00 0.00 C ATOM 0 H ALA P 387 13.237 4.684 6.060 1.00 0.00 H new ATOM 0 HA ALA P 387 13.418 3.732 8.702 1.00 0.00 H new ATOM 0 HB1 ALA P 387 15.852 3.876 8.291 1.00 0.00 H new ATOM 0 HB2 ALA P 387 14.992 3.148 6.914 1.00 0.00 H new ATOM 0 HB3 ALA P 387 15.540 4.838 6.827 1.00 0.00 H new ATOM 1432 N SER P 388 13.896 6.936 8.318 1.00 0.00 N ATOM 1433 CA SER P 388 14.065 8.196 9.031 1.00 0.00 C ATOM 1434 C SER P 388 13.200 9.291 8.416 1.00 0.00 C ATOM 1435 O SER P 388 13.603 10.452 8.353 1.00 0.00 O ATOM 1436 CB SER P 388 15.535 8.620 9.018 1.00 0.00 C ATOM 1437 OG SER P 388 16.002 8.794 7.691 1.00 0.00 O ATOM 0 H SER P 388 13.678 7.038 7.327 1.00 0.00 H new ATOM 0 HA SER P 388 13.747 8.046 10.063 1.00 0.00 H new ATOM 0 HB2 SER P 388 15.654 9.550 9.574 1.00 0.00 H new ATOM 0 HB3 SER P 388 16.139 7.867 9.524 1.00 0.00 H new ATOM 0 HG SER P 388 16.943 9.067 7.709 1.00 0.00 H new ATOM 1443 N ALA P 389 12.010 8.914 7.964 1.00 0.00 N ATOM 1444 CA ALA P 389 11.087 9.864 7.353 1.00 0.00 C ATOM 1445 C ALA P 389 10.388 10.708 8.413 1.00 0.00 C ATOM 1446 O ALA P 389 9.404 10.277 9.016 1.00 0.00 O ATOM 1447 CB ALA P 389 10.064 9.130 6.500 1.00 0.00 C ATOM 0 H ALA P 389 11.661 7.957 8.009 1.00 0.00 H new ATOM 0 HA ALA P 389 11.662 10.534 6.714 1.00 0.00 H new ATOM 0 HB1 ALA P 389 9.381 9.851 6.050 1.00 0.00 H new ATOM 0 HB2 ALA P 389 10.576 8.576 5.714 1.00 0.00 H new ATOM 0 HB3 ALA P 389 9.500 8.437 7.124 1.00 0.00 H new ATOM 1453 N VAL P 390 10.901 11.914 8.636 1.00 0.00 N ATOM 1454 CA VAL P 390 10.326 12.819 9.622 1.00 0.00 C ATOM 1455 C VAL P 390 10.701 14.267 9.325 1.00 0.00 C ATOM 1456 O VAL P 390 11.721 14.483 8.637 1.00 0.00 O ATOM 1457 CB VAL P 390 10.786 12.465 11.048 1.00 0.00 C ATOM 1458 CG1 VAL P 390 10.154 11.159 11.506 1.00 0.00 C ATOM 1459 CG2 VAL P 390 12.304 12.382 11.113 1.00 0.00 C ATOM 1460 OXT VAL P 390 9.971 15.172 9.781 1.00 0.00 O ATOM 0 H VAL P 390 11.715 12.286 8.146 1.00 0.00 H new ATOM 0 HA VAL P 390 9.244 12.706 9.559 1.00 0.00 H new ATOM 0 HB VAL P 390 10.458 13.256 11.722 1.00 0.00 H new ATOM 0 HG11 VAL P 390 10.491 10.926 12.516 1.00 0.00 H new ATOM 0 HG12 VAL P 390 9.069 11.258 11.500 1.00 0.00 H new ATOM 0 HG13 VAL P 390 10.449 10.356 10.831 1.00 0.00 H new ATOM 0 HG21 VAL P 390 12.612 12.131 12.128 1.00 0.00 H new ATOM 0 HG22 VAL P 390 12.656 11.612 10.426 1.00 0.00 H new ATOM 0 HG23 VAL P 390 12.733 13.343 10.831 1.00 0.00 H new TER 1470 VAL P 390