USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 835 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: A 469 LYS NZ :NH3+ -178:sc= 0.957 (180deg=0.675) USER MOD Set 1.2: A 471 ASN : amide:sc= -0.243 K(o=0.71,f=-0.24) USER MOD Set 2.1: A 467 GLN : amide:sc= -0.0177 X(o=0.23,f=-0.019) USER MOD Set 2.2: A 510 THR OG1 : rot 79:sc= 0.247 USER MOD Single : A 453 SER OG : rot 26:sc= 0.091 USER MOD Single : A 455 SER OG : rot 180:sc= 0 USER MOD Single : A 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 470 ASN : amide:sc= -1.09 K(o=-1.1,f=-5!) USER MOD Single : A 472 SER OG : rot 180:sc= 0 USER MOD Single : A 474 LYS NZ :NH3+ 146:sc= 0.551 (180deg=0.122) USER MOD Single : A 476 GLN : amide:sc=-0.00868 K(o=-0.0087,f=-0.96) USER MOD Single : A 477 SER OG : rot 180:sc= 0 USER MOD Single : A 480 ASN : amide:sc= -0.263 X(o=-0.26,f=0) USER MOD Single : A 484 LYS NZ :NH3+ -146:sc= 0.668 (180deg=0.175) USER MOD Single : A 486 GLN : amide:sc= -1.89! C(o=-1.9!,f=-4.7!) USER MOD Single : A 495 TYR OH : rot 165:sc= 0 USER MOD Single : A 496 LYS NZ :NH3+ 166:sc= 0.696 (180deg=0.566) USER MOD Single : A 498 THR OG1 : rot 180:sc= -0.495 USER MOD Single : A 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 501 TYR OH : rot 25:sc= 0.0333 USER MOD Single : A 507 GLN : amide:sc= -0.011 K(o=-0.011,f=-0.55) USER MOD Single : A 508 MET CE :methyl 155:sc= -0.439 (180deg=-1.24) USER MOD Single : A 520 HIS : no HE2:sc= -1.27 X(o=-1.3,f=-1.7) USER MOD Single : A 521 SER OG : rot 71:sc= 0.119 USER MOD Single : A 524 SER OG : rot 180:sc= 0 USER MOD Single : A 525 THR OG1 : rot 180:sc= 0 USER MOD Single : A 529 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0207) USER MOD Single : A 531 GLN : amide:sc= 0.0311 K(o=0.031,f=-2.5!) USER MOD Single : A 532 SER OG : rot 180:sc= 0 USER MOD Single : A 533 SER OG : rot 180:sc= 0 USER MOD Single : A 536 THR OG1 : rot 180:sc= 0.0216 USER MOD Single : A 539 SER OG : rot 180:sc= 0 USER MOD Single : A 542 THR OG1 : rot 100:sc= 0.514 USER MOD Single : A 546 ASN :FLIP amide:sc= -5.66! C(o=-7.9!,f=-5.7!) USER MOD Single : A 554 MET CE :methyl 168:sc= -0.0171 (180deg=-0.2) USER MOD Single : A 556 THR OG1 : rot 180:sc= 0 USER MOD Single : A 558 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 559 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 40 N SER A 453 8.920 3.113 -5.810 1.00 0.00 N ATOM 41 CA SER A 453 9.858 2.884 -4.685 1.00 0.00 C ATOM 42 C SER A 453 11.127 2.167 -5.177 1.00 0.00 C ATOM 43 O SER A 453 12.237 2.452 -4.729 1.00 0.00 O ATOM 44 CB SER A 453 9.156 2.067 -3.581 1.00 0.00 C ATOM 45 OG SER A 453 7.986 2.735 -3.137 1.00 0.00 O ATOM 0 HA SER A 453 10.159 3.846 -4.270 1.00 0.00 H new ATOM 0 HB2 SER A 453 8.896 1.079 -3.961 1.00 0.00 H new ATOM 0 HB3 SER A 453 9.837 1.917 -2.743 1.00 0.00 H new ATOM 0 HG SER A 453 7.644 3.308 -3.855 1.00 0.00 H new ATOM 51 N VAL A 454 10.923 1.229 -6.113 1.00 0.00 N ATOM 52 CA VAL A 454 11.991 0.538 -6.850 1.00 0.00 C ATOM 53 C VAL A 454 11.779 0.828 -8.355 1.00 0.00 C ATOM 54 O VAL A 454 10.634 1.001 -8.803 1.00 0.00 O ATOM 55 CB VAL A 454 11.968 -1.026 -6.586 1.00 0.00 C ATOM 56 CG1 VAL A 454 13.176 -1.740 -7.222 1.00 0.00 C ATOM 57 CG2 VAL A 454 11.867 -1.358 -5.079 1.00 0.00 C ATOM 0 H VAL A 454 9.989 0.923 -6.385 1.00 0.00 H new ATOM 0 HA VAL A 454 12.962 0.901 -6.513 1.00 0.00 H new ATOM 0 HB VAL A 454 11.068 -1.404 -7.071 1.00 0.00 H new ATOM 0 HG11 VAL A 454 13.117 -2.809 -7.015 1.00 0.00 H new ATOM 0 HG12 VAL A 454 13.168 -1.578 -8.300 1.00 0.00 H new ATOM 0 HG13 VAL A 454 14.098 -1.339 -6.802 1.00 0.00 H new ATOM 0 HG21 VAL A 454 11.854 -2.440 -4.945 1.00 0.00 H new ATOM 0 HG22 VAL A 454 12.726 -0.937 -4.555 1.00 0.00 H new ATOM 0 HG23 VAL A 454 10.950 -0.931 -4.673 1.00 0.00 H new ATOM 67 N SER A 455 12.880 0.905 -9.117 1.00 0.00 N ATOM 68 CA SER A 455 12.855 1.097 -10.581 1.00 0.00 C ATOM 69 C SER A 455 13.977 0.260 -11.220 1.00 0.00 C ATOM 70 O SER A 455 15.026 0.053 -10.602 1.00 0.00 O ATOM 71 CB SER A 455 13.026 2.598 -10.934 1.00 0.00 C ATOM 72 OG SER A 455 12.050 3.402 -10.282 1.00 0.00 O ATOM 0 H SER A 455 13.823 0.836 -8.734 1.00 0.00 H new ATOM 0 HA SER A 455 11.893 0.767 -10.973 1.00 0.00 H new ATOM 0 HB2 SER A 455 14.023 2.929 -10.645 1.00 0.00 H new ATOM 0 HB3 SER A 455 12.946 2.730 -12.013 1.00 0.00 H new ATOM 0 HG SER A 455 12.186 4.342 -10.524 1.00 0.00 H new ATOM 78 N ILE A 456 13.748 -0.224 -12.451 1.00 0.00 N ATOM 79 CA ILE A 456 14.743 -1.019 -13.191 1.00 0.00 C ATOM 80 C ILE A 456 15.920 -0.112 -13.603 1.00 0.00 C ATOM 81 O ILE A 456 15.703 1.003 -14.099 1.00 0.00 O ATOM 82 CB ILE A 456 14.107 -1.700 -14.464 1.00 0.00 C ATOM 83 CG1 ILE A 456 12.824 -2.512 -14.076 1.00 0.00 C ATOM 84 CG2 ILE A 456 15.138 -2.606 -15.184 1.00 0.00 C ATOM 85 CD1 ILE A 456 12.069 -3.129 -15.251 1.00 0.00 C ATOM 0 H ILE A 456 12.876 -0.077 -12.959 1.00 0.00 H new ATOM 0 HA ILE A 456 15.103 -1.814 -12.538 1.00 0.00 H new ATOM 0 HB ILE A 456 13.814 -0.912 -15.157 1.00 0.00 H new ATOM 0 HG12 ILE A 456 13.111 -3.309 -13.390 1.00 0.00 H new ATOM 0 HG13 ILE A 456 12.146 -1.853 -13.534 1.00 0.00 H new ATOM 0 HG21 ILE A 456 14.673 -3.063 -16.058 1.00 0.00 H new ATOM 0 HG22 ILE A 456 15.992 -2.006 -15.499 1.00 0.00 H new ATOM 0 HG23 ILE A 456 15.475 -3.387 -14.502 1.00 0.00 H new ATOM 0 HD11 ILE A 456 11.198 -3.670 -14.880 1.00 0.00 H new ATOM 0 HD12 ILE A 456 11.745 -2.340 -15.930 1.00 0.00 H new ATOM 0 HD13 ILE A 456 12.725 -3.818 -15.783 1.00 0.00 H new ATOM 97 N GLU A 457 17.153 -0.582 -13.360 1.00 0.00 N ATOM 98 CA GLU A 457 18.378 0.162 -13.701 1.00 0.00 C ATOM 99 C GLU A 457 18.907 -0.284 -15.078 1.00 0.00 C ATOM 100 O GLU A 457 18.902 0.493 -16.041 1.00 0.00 O ATOM 101 CB GLU A 457 19.457 -0.036 -12.602 1.00 0.00 C ATOM 102 CG GLU A 457 20.786 0.716 -12.847 1.00 0.00 C ATOM 103 CD GLU A 457 20.630 2.246 -12.926 1.00 0.00 C ATOM 104 OE1 GLU A 457 20.701 2.914 -11.877 1.00 0.00 O ATOM 105 OE2 GLU A 457 20.449 2.789 -14.041 1.00 0.00 O ATOM 0 H GLU A 457 17.330 -1.486 -12.923 1.00 0.00 H new ATOM 0 HA GLU A 457 18.140 1.224 -13.754 1.00 0.00 H new ATOM 0 HB2 GLU A 457 19.044 0.288 -11.647 1.00 0.00 H new ATOM 0 HB3 GLU A 457 19.671 -1.101 -12.512 1.00 0.00 H new ATOM 0 HG2 GLU A 457 21.483 0.472 -12.046 1.00 0.00 H new ATOM 0 HG3 GLU A 457 21.230 0.357 -13.776 1.00 0.00 H new ATOM 112 N GLU A 458 19.352 -1.548 -15.163 1.00 0.00 N ATOM 113 CA GLU A 458 19.946 -2.124 -16.390 1.00 0.00 C ATOM 114 C GLU A 458 19.335 -3.501 -16.644 1.00 0.00 C ATOM 115 O GLU A 458 18.811 -4.136 -15.727 1.00 0.00 O ATOM 116 CB GLU A 458 21.497 -2.269 -16.271 1.00 0.00 C ATOM 117 CG GLU A 458 22.251 -0.994 -15.855 1.00 0.00 C ATOM 118 CD GLU A 458 23.755 -1.226 -15.656 1.00 0.00 C ATOM 119 OE1 GLU A 458 24.142 -1.775 -14.603 1.00 0.00 O ATOM 120 OE2 GLU A 458 24.553 -0.868 -16.549 1.00 0.00 O ATOM 0 H GLU A 458 19.312 -2.204 -14.383 1.00 0.00 H new ATOM 0 HA GLU A 458 19.732 -1.447 -17.217 1.00 0.00 H new ATOM 0 HB2 GLU A 458 21.717 -3.053 -15.546 1.00 0.00 H new ATOM 0 HB3 GLU A 458 21.888 -2.604 -17.232 1.00 0.00 H new ATOM 0 HG2 GLU A 458 22.105 -0.227 -16.616 1.00 0.00 H new ATOM 0 HG3 GLU A 458 21.822 -0.610 -14.929 1.00 0.00 H new ATOM 127 N ILE A 459 19.387 -3.945 -17.905 1.00 0.00 N ATOM 128 CA ILE A 459 19.015 -5.313 -18.311 1.00 0.00 C ATOM 129 C ILE A 459 19.995 -5.754 -19.399 1.00 0.00 C ATOM 130 O ILE A 459 20.361 -4.948 -20.266 1.00 0.00 O ATOM 131 CB ILE A 459 17.535 -5.397 -18.861 1.00 0.00 C ATOM 132 CG1 ILE A 459 16.506 -4.906 -17.796 1.00 0.00 C ATOM 133 CG2 ILE A 459 17.174 -6.836 -19.337 1.00 0.00 C ATOM 134 CD1 ILE A 459 15.102 -4.725 -18.313 1.00 0.00 C ATOM 0 H ILE A 459 19.691 -3.361 -18.684 1.00 0.00 H new ATOM 0 HA ILE A 459 19.063 -5.965 -17.439 1.00 0.00 H new ATOM 0 HB ILE A 459 17.482 -4.735 -19.725 1.00 0.00 H new ATOM 0 HG12 ILE A 459 16.486 -5.621 -16.973 1.00 0.00 H new ATOM 0 HG13 ILE A 459 16.853 -3.957 -17.386 1.00 0.00 H new ATOM 0 HG21 ILE A 459 16.149 -6.850 -19.707 1.00 0.00 H new ATOM 0 HG22 ILE A 459 17.853 -7.136 -20.136 1.00 0.00 H new ATOM 0 HG23 ILE A 459 17.268 -7.530 -18.502 1.00 0.00 H new ATOM 0 HD11 ILE A 459 14.458 -4.382 -17.504 1.00 0.00 H new ATOM 0 HD12 ILE A 459 15.102 -3.986 -19.115 1.00 0.00 H new ATOM 0 HD13 ILE A 459 14.730 -5.675 -18.695 1.00 0.00 H new ATOM 146 N ASP A 460 20.422 -7.020 -19.336 1.00 0.00 N ATOM 147 CA ASP A 460 21.323 -7.605 -20.336 1.00 0.00 C ATOM 148 C ASP A 460 20.577 -7.801 -21.677 1.00 0.00 C ATOM 149 O ASP A 460 19.386 -8.140 -21.683 1.00 0.00 O ATOM 150 CB ASP A 460 21.892 -8.940 -19.810 1.00 0.00 C ATOM 151 CG ASP A 460 22.994 -9.515 -20.711 1.00 0.00 C ATOM 152 OD1 ASP A 460 24.147 -9.060 -20.605 1.00 0.00 O ATOM 153 OD2 ASP A 460 22.703 -10.398 -21.531 1.00 0.00 O ATOM 0 H ASP A 460 20.154 -7.666 -18.594 1.00 0.00 H new ATOM 0 HA ASP A 460 22.157 -6.926 -20.514 1.00 0.00 H new ATOM 0 HB2 ASP A 460 22.291 -8.789 -18.807 1.00 0.00 H new ATOM 0 HB3 ASP A 460 21.083 -9.666 -19.725 1.00 0.00 H new ATOM 158 N LEU A 461 21.298 -7.587 -22.798 1.00 0.00 N ATOM 159 CA LEU A 461 20.722 -7.636 -24.162 1.00 0.00 C ATOM 160 C LEU A 461 20.359 -9.085 -24.589 1.00 0.00 C ATOM 161 O LEU A 461 19.418 -9.282 -25.359 1.00 0.00 O ATOM 162 CB LEU A 461 21.667 -6.891 -25.177 1.00 0.00 C ATOM 163 CG LEU A 461 23.211 -7.219 -25.122 1.00 0.00 C ATOM 164 CD1 LEU A 461 23.579 -8.533 -25.840 1.00 0.00 C ATOM 165 CD2 LEU A 461 24.062 -6.043 -25.665 1.00 0.00 C ATOM 0 H LEU A 461 22.296 -7.375 -22.785 1.00 0.00 H new ATOM 0 HA LEU A 461 19.773 -7.100 -24.163 1.00 0.00 H new ATOM 0 HB2 LEU A 461 21.314 -7.109 -26.185 1.00 0.00 H new ATOM 0 HB3 LEU A 461 21.547 -5.819 -25.022 1.00 0.00 H new ATOM 0 HG LEU A 461 23.446 -7.361 -24.067 1.00 0.00 H new ATOM 0 HD11 LEU A 461 24.654 -8.700 -25.765 1.00 0.00 H new ATOM 0 HD12 LEU A 461 23.050 -9.363 -25.373 1.00 0.00 H new ATOM 0 HD13 LEU A 461 23.294 -8.466 -26.890 1.00 0.00 H new ATOM 0 HD21 LEU A 461 25.119 -6.304 -25.612 1.00 0.00 H new ATOM 0 HD22 LEU A 461 23.789 -5.844 -26.701 1.00 0.00 H new ATOM 0 HD23 LEU A 461 23.878 -5.153 -25.064 1.00 0.00 H new ATOM 177 N GLU A 462 21.102 -10.090 -24.070 1.00 0.00 N ATOM 178 CA GLU A 462 20.749 -11.529 -24.233 1.00 0.00 C ATOM 179 C GLU A 462 19.695 -11.919 -23.181 1.00 0.00 C ATOM 180 O GLU A 462 18.830 -12.772 -23.425 1.00 0.00 O ATOM 181 CB GLU A 462 22.010 -12.429 -24.063 1.00 0.00 C ATOM 182 CG GLU A 462 23.173 -12.077 -25.002 1.00 0.00 C ATOM 183 CD GLU A 462 24.436 -12.907 -24.728 1.00 0.00 C ATOM 184 OE1 GLU A 462 25.236 -12.524 -23.844 1.00 0.00 O ATOM 185 OE2 GLU A 462 24.637 -13.940 -25.398 1.00 0.00 O ATOM 0 H GLU A 462 21.954 -9.935 -23.532 1.00 0.00 H new ATOM 0 HA GLU A 462 20.348 -11.679 -25.235 1.00 0.00 H new ATOM 0 HB2 GLU A 462 22.357 -12.356 -23.032 1.00 0.00 H new ATOM 0 HB3 GLU A 462 21.725 -13.468 -24.231 1.00 0.00 H new ATOM 0 HG2 GLU A 462 22.859 -12.232 -26.034 1.00 0.00 H new ATOM 0 HG3 GLU A 462 23.410 -11.018 -24.897 1.00 0.00 H new ATOM 192 N GLY A 463 19.784 -11.252 -22.015 1.00 0.00 N ATOM 193 CA GLY A 463 18.894 -11.490 -20.882 1.00 0.00 C ATOM 194 C GLY A 463 19.504 -12.423 -19.843 1.00 0.00 C ATOM 195 O GLY A 463 18.808 -13.280 -19.287 1.00 0.00 O ATOM 0 H GLY A 463 20.483 -10.530 -21.840 1.00 0.00 H new ATOM 0 HA2 GLY A 463 18.649 -10.538 -20.411 1.00 0.00 H new ATOM 0 HA3 GLY A 463 17.958 -11.917 -21.243 1.00 0.00 H new ATOM 199 N LYS A 464 20.809 -12.234 -19.562 1.00 0.00 N ATOM 200 CA LYS A 464 21.563 -13.037 -18.576 1.00 0.00 C ATOM 201 C LYS A 464 21.213 -12.611 -17.145 1.00 0.00 C ATOM 202 O LYS A 464 21.302 -13.418 -16.208 1.00 0.00 O ATOM 203 CB LYS A 464 23.089 -12.894 -18.827 1.00 0.00 C ATOM 204 CG LYS A 464 23.558 -13.394 -20.218 1.00 0.00 C ATOM 205 CD LYS A 464 23.436 -14.929 -20.406 1.00 0.00 C ATOM 206 CE LYS A 464 24.317 -15.736 -19.424 1.00 0.00 C ATOM 207 NZ LYS A 464 24.328 -17.189 -19.744 1.00 0.00 N ATOM 0 H LYS A 464 21.374 -11.516 -20.015 1.00 0.00 H new ATOM 0 HA LYS A 464 21.283 -14.084 -18.696 1.00 0.00 H new ATOM 0 HB2 LYS A 464 23.366 -11.845 -18.719 1.00 0.00 H new ATOM 0 HB3 LYS A 464 23.625 -13.447 -18.056 1.00 0.00 H new ATOM 0 HG2 LYS A 464 22.972 -12.895 -20.990 1.00 0.00 H new ATOM 0 HG3 LYS A 464 24.597 -13.101 -20.368 1.00 0.00 H new ATOM 0 HD2 LYS A 464 22.395 -15.223 -20.275 1.00 0.00 H new ATOM 0 HD3 LYS A 464 23.713 -15.186 -21.428 1.00 0.00 H new ATOM 0 HE2 LYS A 464 25.337 -15.351 -19.453 1.00 0.00 H new ATOM 0 HE3 LYS A 464 23.951 -15.592 -18.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 24.931 -17.690 -19.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 23.359 -17.563 -19.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 24.702 -17.330 -20.704 1.00 0.00 H new ATOM 221 N PHE A 465 20.804 -11.335 -16.999 1.00 0.00 N ATOM 222 CA PHE A 465 20.499 -10.743 -15.694 1.00 0.00 C ATOM 223 C PHE A 465 19.595 -9.506 -15.837 1.00 0.00 C ATOM 224 O PHE A 465 19.437 -8.944 -16.934 1.00 0.00 O ATOM 225 CB PHE A 465 21.817 -10.394 -14.942 1.00 0.00 C ATOM 226 CG PHE A 465 22.621 -9.217 -15.500 1.00 0.00 C ATOM 227 CD1 PHE A 465 23.508 -9.389 -16.563 1.00 0.00 C ATOM 228 CD2 PHE A 465 22.484 -7.936 -14.963 1.00 0.00 C ATOM 229 CE1 PHE A 465 24.230 -8.322 -17.066 1.00 0.00 C ATOM 230 CE2 PHE A 465 23.203 -6.868 -15.470 1.00 0.00 C ATOM 231 CZ PHE A 465 24.077 -7.062 -16.522 1.00 0.00 C ATOM 0 H PHE A 465 20.678 -10.694 -17.782 1.00 0.00 H new ATOM 0 HA PHE A 465 19.949 -11.477 -15.105 1.00 0.00 H new ATOM 0 HB2 PHE A 465 21.572 -10.179 -13.902 1.00 0.00 H new ATOM 0 HB3 PHE A 465 22.456 -11.277 -14.943 1.00 0.00 H new ATOM 0 HD1 PHE A 465 23.633 -10.369 -16.999 1.00 0.00 H new ATOM 0 HD2 PHE A 465 21.806 -7.776 -14.138 1.00 0.00 H new ATOM 0 HE1 PHE A 465 24.915 -8.475 -17.887 1.00 0.00 H new ATOM 0 HE2 PHE A 465 23.081 -5.883 -15.043 1.00 0.00 H new ATOM 0 HZ PHE A 465 24.640 -6.230 -16.918 1.00 0.00 H new ATOM 241 N VAL A 466 18.989 -9.119 -14.704 1.00 0.00 N ATOM 242 CA VAL A 466 18.246 -7.865 -14.535 1.00 0.00 C ATOM 243 C VAL A 466 18.893 -7.100 -13.370 1.00 0.00 C ATOM 244 O VAL A 466 18.878 -7.580 -12.234 1.00 0.00 O ATOM 245 CB VAL A 466 16.714 -8.099 -14.214 1.00 0.00 C ATOM 246 CG1 VAL A 466 15.938 -6.748 -14.147 1.00 0.00 C ATOM 247 CG2 VAL A 466 16.075 -9.072 -15.233 1.00 0.00 C ATOM 0 H VAL A 466 19.004 -9.687 -13.857 1.00 0.00 H new ATOM 0 HA VAL A 466 18.291 -7.307 -15.470 1.00 0.00 H new ATOM 0 HB VAL A 466 16.645 -8.562 -13.230 1.00 0.00 H new ATOM 0 HG11 VAL A 466 14.889 -6.942 -13.925 1.00 0.00 H new ATOM 0 HG12 VAL A 466 16.365 -6.122 -13.364 1.00 0.00 H new ATOM 0 HG13 VAL A 466 16.017 -6.235 -15.105 1.00 0.00 H new ATOM 0 HG21 VAL A 466 15.022 -9.215 -14.989 1.00 0.00 H new ATOM 0 HG22 VAL A 466 16.161 -8.656 -16.237 1.00 0.00 H new ATOM 0 HG23 VAL A 466 16.590 -10.032 -15.192 1.00 0.00 H new ATOM 257 N GLN A 467 19.483 -5.940 -13.664 1.00 0.00 N ATOM 258 CA GLN A 467 19.986 -5.019 -12.639 1.00 0.00 C ATOM 259 C GLN A 467 18.817 -4.129 -12.194 1.00 0.00 C ATOM 260 O GLN A 467 18.345 -3.272 -12.945 1.00 0.00 O ATOM 261 CB GLN A 467 21.149 -4.157 -13.196 1.00 0.00 C ATOM 262 CG GLN A 467 21.730 -3.127 -12.205 1.00 0.00 C ATOM 263 CD GLN A 467 22.465 -3.777 -11.039 1.00 0.00 C ATOM 264 OE1 GLN A 467 21.871 -4.071 -9.999 1.00 0.00 O ATOM 265 NE2 GLN A 467 23.758 -4.024 -11.207 1.00 0.00 N ATOM 0 H GLN A 467 19.626 -5.611 -14.619 1.00 0.00 H new ATOM 0 HA GLN A 467 20.378 -5.580 -11.790 1.00 0.00 H new ATOM 0 HB2 GLN A 467 21.951 -4.821 -13.519 1.00 0.00 H new ATOM 0 HB3 GLN A 467 20.797 -3.628 -14.082 1.00 0.00 H new ATOM 0 HG2 GLN A 467 22.414 -2.465 -12.736 1.00 0.00 H new ATOM 0 HG3 GLN A 467 20.922 -2.506 -11.818 1.00 0.00 H new ATOM 0 HE21 GLN A 467 24.217 -3.767 -12.081 1.00 0.00 H new ATOM 0 HE22 GLN A 467 24.293 -4.471 -10.462 1.00 0.00 H new ATOM 274 N LEU A 468 18.327 -4.387 -10.991 1.00 0.00 N ATOM 275 CA LEU A 468 17.188 -3.682 -10.405 1.00 0.00 C ATOM 276 C LEU A 468 17.703 -2.715 -9.333 1.00 0.00 C ATOM 277 O LEU A 468 18.481 -3.122 -8.495 1.00 0.00 O ATOM 278 CB LEU A 468 16.216 -4.718 -9.782 1.00 0.00 C ATOM 279 CG LEU A 468 14.853 -4.138 -9.332 1.00 0.00 C ATOM 280 CD1 LEU A 468 14.050 -3.624 -10.545 1.00 0.00 C ATOM 281 CD2 LEU A 468 14.051 -5.148 -8.479 1.00 0.00 C ATOM 0 H LEU A 468 18.715 -5.106 -10.380 1.00 0.00 H new ATOM 0 HA LEU A 468 16.655 -3.116 -11.169 1.00 0.00 H new ATOM 0 HB2 LEU A 468 16.036 -5.510 -10.509 1.00 0.00 H new ATOM 0 HB3 LEU A 468 16.701 -5.179 -8.922 1.00 0.00 H new ATOM 0 HG LEU A 468 15.048 -3.283 -8.685 1.00 0.00 H new ATOM 0 HD11 LEU A 468 13.096 -3.221 -10.205 1.00 0.00 H new ATOM 0 HD12 LEU A 468 14.615 -2.841 -11.050 1.00 0.00 H new ATOM 0 HD13 LEU A 468 13.871 -4.446 -11.237 1.00 0.00 H new ATOM 0 HD21 LEU A 468 13.101 -4.702 -8.184 1.00 0.00 H new ATOM 0 HD22 LEU A 468 13.863 -6.049 -9.063 1.00 0.00 H new ATOM 0 HD23 LEU A 468 14.623 -5.407 -7.588 1.00 0.00 H new ATOM 293 N LYS A 469 17.254 -1.453 -9.346 1.00 0.00 N ATOM 294 CA LYS A 469 17.737 -0.413 -8.400 1.00 0.00 C ATOM 295 C LYS A 469 16.624 0.028 -7.453 1.00 0.00 C ATOM 296 O LYS A 469 15.491 0.211 -7.873 1.00 0.00 O ATOM 297 CB LYS A 469 18.251 0.835 -9.168 1.00 0.00 C ATOM 298 CG LYS A 469 18.747 1.988 -8.251 1.00 0.00 C ATOM 299 CD LYS A 469 19.043 3.283 -9.018 1.00 0.00 C ATOM 300 CE LYS A 469 19.522 4.415 -8.096 1.00 0.00 C ATOM 301 NZ LYS A 469 18.505 4.786 -7.078 1.00 0.00 N ATOM 0 H LYS A 469 16.551 -1.116 -10.004 1.00 0.00 H new ATOM 0 HA LYS A 469 18.551 -0.855 -7.825 1.00 0.00 H new ATOM 0 HB2 LYS A 469 19.066 0.533 -9.826 1.00 0.00 H new ATOM 0 HB3 LYS A 469 17.450 1.211 -9.805 1.00 0.00 H new ATOM 0 HG2 LYS A 469 17.993 2.188 -7.489 1.00 0.00 H new ATOM 0 HG3 LYS A 469 19.649 1.667 -7.730 1.00 0.00 H new ATOM 0 HD2 LYS A 469 19.803 3.088 -9.774 1.00 0.00 H new ATOM 0 HD3 LYS A 469 18.144 3.603 -9.545 1.00 0.00 H new ATOM 0 HE2 LYS A 469 20.439 4.107 -7.594 1.00 0.00 H new ATOM 0 HE3 LYS A 469 19.766 5.291 -8.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 469 18.862 5.576 -6.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 469 17.626 5.073 -7.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 469 18.315 3.969 -6.464 1.00 0.00 H new ATOM 315 N ASN A 470 16.983 0.278 -6.188 1.00 0.00 N ATOM 316 CA ASN A 470 16.061 0.874 -5.207 1.00 0.00 C ATOM 317 C ASN A 470 16.185 2.399 -5.289 1.00 0.00 C ATOM 318 O ASN A 470 17.290 2.948 -5.212 1.00 0.00 O ATOM 319 CB ASN A 470 16.344 0.407 -3.760 1.00 0.00 C ATOM 320 CG ASN A 470 15.402 1.052 -2.735 1.00 0.00 C ATOM 321 OD1 ASN A 470 14.259 1.385 -3.048 1.00 0.00 O ATOM 322 ND2 ASN A 470 15.867 1.224 -1.511 1.00 0.00 N ATOM 0 H ASN A 470 17.911 0.076 -5.816 1.00 0.00 H new ATOM 0 HA ASN A 470 15.051 0.547 -5.452 1.00 0.00 H new ATOM 0 HB2 ASN A 470 16.245 -0.677 -3.707 1.00 0.00 H new ATOM 0 HB3 ASN A 470 17.375 0.646 -3.500 1.00 0.00 H new ATOM 0 HD21 ASN A 470 15.274 1.643 -0.794 1.00 0.00 H new ATOM 0 HD22 ASN A 470 16.819 0.938 -1.282 1.00 0.00 H new ATOM 329 N ASN A 471 15.036 3.065 -5.426 1.00 0.00 N ATOM 330 CA ASN A 471 14.946 4.523 -5.608 1.00 0.00 C ATOM 331 C ASN A 471 14.192 5.182 -4.431 1.00 0.00 C ATOM 332 O ASN A 471 13.832 6.362 -4.499 1.00 0.00 O ATOM 333 CB ASN A 471 14.281 4.815 -6.980 1.00 0.00 C ATOM 334 CG ASN A 471 15.197 4.449 -8.161 1.00 0.00 C ATOM 335 OD1 ASN A 471 15.897 5.299 -8.705 1.00 0.00 O ATOM 336 ND2 ASN A 471 15.274 3.168 -8.499 1.00 0.00 N ATOM 0 H ASN A 471 14.126 2.603 -5.414 1.00 0.00 H new ATOM 0 HA ASN A 471 15.944 4.962 -5.610 1.00 0.00 H new ATOM 0 HB2 ASN A 471 13.350 4.253 -7.057 1.00 0.00 H new ATOM 0 HB3 ASN A 471 14.021 5.872 -7.038 1.00 0.00 H new ATOM 0 HD21 ASN A 471 15.925 2.870 -9.225 1.00 0.00 H new ATOM 0 HD22 ASN A 471 14.682 2.481 -8.032 1.00 0.00 H new ATOM 343 N SER A 472 13.981 4.409 -3.343 1.00 0.00 N ATOM 344 CA SER A 472 13.426 4.918 -2.068 1.00 0.00 C ATOM 345 C SER A 472 14.499 5.707 -1.294 1.00 0.00 C ATOM 346 O SER A 472 15.694 5.531 -1.535 1.00 0.00 O ATOM 347 CB SER A 472 12.900 3.740 -1.212 1.00 0.00 C ATOM 348 OG SER A 472 12.286 4.185 -0.008 1.00 0.00 O ATOM 0 H SER A 472 14.191 3.411 -3.324 1.00 0.00 H new ATOM 0 HA SER A 472 12.596 5.590 -2.288 1.00 0.00 H new ATOM 0 HB2 SER A 472 12.181 3.163 -1.793 1.00 0.00 H new ATOM 0 HB3 SER A 472 13.726 3.070 -0.971 1.00 0.00 H new ATOM 0 HG SER A 472 11.967 3.411 0.502 1.00 0.00 H new ATOM 354 N ASP A 473 14.058 6.555 -0.350 1.00 0.00 N ATOM 355 CA ASP A 473 14.954 7.425 0.450 1.00 0.00 C ATOM 356 C ASP A 473 15.475 6.701 1.722 1.00 0.00 C ATOM 357 O ASP A 473 16.230 7.283 2.511 1.00 0.00 O ATOM 358 CB ASP A 473 14.212 8.738 0.823 1.00 0.00 C ATOM 359 CG ASP A 473 12.966 8.511 1.703 1.00 0.00 C ATOM 360 OD1 ASP A 473 11.927 8.058 1.176 1.00 0.00 O ATOM 361 OD2 ASP A 473 13.018 8.781 2.920 1.00 0.00 O ATOM 0 H ASP A 473 13.071 6.661 -0.115 1.00 0.00 H new ATOM 0 HA ASP A 473 15.826 7.667 -0.157 1.00 0.00 H new ATOM 0 HB2 ASP A 473 14.902 9.400 1.347 1.00 0.00 H new ATOM 0 HB3 ASP A 473 13.913 9.250 -0.092 1.00 0.00 H new ATOM 366 N LYS A 474 15.057 5.435 1.903 1.00 0.00 N ATOM 367 CA LYS A 474 15.480 4.561 3.022 1.00 0.00 C ATOM 368 C LYS A 474 15.508 3.095 2.542 1.00 0.00 C ATOM 369 O LYS A 474 15.254 2.818 1.355 1.00 0.00 O ATOM 370 CB LYS A 474 14.563 4.709 4.286 1.00 0.00 C ATOM 371 CG LYS A 474 13.065 4.325 4.097 1.00 0.00 C ATOM 372 CD LYS A 474 12.244 5.426 3.390 1.00 0.00 C ATOM 373 CE LYS A 474 10.782 5.038 3.128 1.00 0.00 C ATOM 374 NZ LYS A 474 10.010 6.195 2.606 1.00 0.00 N ATOM 0 H LYS A 474 14.404 4.979 1.266 1.00 0.00 H new ATOM 0 HA LYS A 474 16.479 4.873 3.328 1.00 0.00 H new ATOM 0 HB2 LYS A 474 14.977 4.092 5.084 1.00 0.00 H new ATOM 0 HB3 LYS A 474 14.611 5.744 4.625 1.00 0.00 H new ATOM 0 HG2 LYS A 474 13.002 3.404 3.517 1.00 0.00 H new ATOM 0 HG3 LYS A 474 12.623 4.119 5.072 1.00 0.00 H new ATOM 0 HD2 LYS A 474 12.267 6.330 3.999 1.00 0.00 H new ATOM 0 HD3 LYS A 474 12.721 5.669 2.441 1.00 0.00 H new ATOM 0 HE2 LYS A 474 10.743 4.217 2.412 1.00 0.00 H new ATOM 0 HE3 LYS A 474 10.326 4.679 4.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 9.293 5.858 1.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 9.541 6.684 3.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 10.655 6.854 2.125 1.00 0.00 H new ATOM 388 N ASP A 475 15.894 2.175 3.456 1.00 0.00 N ATOM 389 CA ASP A 475 15.827 0.715 3.219 1.00 0.00 C ATOM 390 C ASP A 475 14.399 0.316 2.778 1.00 0.00 C ATOM 391 O ASP A 475 13.470 0.298 3.600 1.00 0.00 O ATOM 392 CB ASP A 475 16.197 -0.074 4.513 1.00 0.00 C ATOM 393 CG ASP A 475 17.588 0.227 5.078 1.00 0.00 C ATOM 394 OD1 ASP A 475 17.766 1.303 5.681 1.00 0.00 O ATOM 395 OD2 ASP A 475 18.509 -0.603 4.929 1.00 0.00 O ATOM 0 H ASP A 475 16.259 2.423 4.375 1.00 0.00 H new ATOM 0 HA ASP A 475 16.541 0.467 2.434 1.00 0.00 H new ATOM 0 HB2 ASP A 475 15.454 0.146 5.280 1.00 0.00 H new ATOM 0 HB3 ASP A 475 16.130 -1.141 4.302 1.00 0.00 H new ATOM 400 N GLN A 476 14.237 0.043 1.475 1.00 0.00 N ATOM 401 CA GLN A 476 12.965 -0.414 0.900 1.00 0.00 C ATOM 402 C GLN A 476 12.823 -1.908 1.208 1.00 0.00 C ATOM 403 O GLN A 476 13.605 -2.728 0.706 1.00 0.00 O ATOM 404 CB GLN A 476 12.931 -0.139 -0.634 1.00 0.00 C ATOM 405 CG GLN A 476 11.533 -0.166 -1.310 1.00 0.00 C ATOM 406 CD GLN A 476 10.908 -1.558 -1.488 1.00 0.00 C ATOM 407 OE1 GLN A 476 11.609 -2.545 -1.690 1.00 0.00 O ATOM 408 NE2 GLN A 476 9.584 -1.646 -1.410 1.00 0.00 N ATOM 0 H GLN A 476 14.987 0.133 0.789 1.00 0.00 H new ATOM 0 HA GLN A 476 12.127 0.130 1.337 1.00 0.00 H new ATOM 0 HB2 GLN A 476 13.380 0.838 -0.816 1.00 0.00 H new ATOM 0 HB3 GLN A 476 13.563 -0.877 -1.127 1.00 0.00 H new ATOM 0 HG2 GLN A 476 10.852 0.446 -0.719 1.00 0.00 H new ATOM 0 HG3 GLN A 476 11.614 0.304 -2.290 1.00 0.00 H new ATOM 0 HE21 GLN A 476 9.026 -0.809 -1.241 1.00 0.00 H new ATOM 0 HE22 GLN A 476 9.126 -2.551 -1.519 1.00 0.00 H new ATOM 417 N SER A 477 11.849 -2.237 2.066 1.00 0.00 N ATOM 418 CA SER A 477 11.563 -3.613 2.464 1.00 0.00 C ATOM 419 C SER A 477 10.981 -4.388 1.264 1.00 0.00 C ATOM 420 O SER A 477 9.793 -4.278 0.952 1.00 0.00 O ATOM 421 CB SER A 477 10.609 -3.605 3.680 1.00 0.00 C ATOM 422 OG SER A 477 10.390 -4.910 4.183 1.00 0.00 O ATOM 0 H SER A 477 11.236 -1.549 2.504 1.00 0.00 H new ATOM 0 HA SER A 477 12.478 -4.123 2.766 1.00 0.00 H new ATOM 0 HB2 SER A 477 11.028 -2.977 4.467 1.00 0.00 H new ATOM 0 HB3 SER A 477 9.656 -3.162 3.392 1.00 0.00 H new ATOM 0 HG SER A 477 9.784 -4.867 4.952 1.00 0.00 H new ATOM 428 N LEU A 478 11.854 -5.147 0.587 1.00 0.00 N ATOM 429 CA LEU A 478 11.528 -5.863 -0.659 1.00 0.00 C ATOM 430 C LEU A 478 10.910 -7.240 -0.298 1.00 0.00 C ATOM 431 O LEU A 478 10.831 -7.595 0.889 1.00 0.00 O ATOM 432 CB LEU A 478 12.839 -5.990 -1.510 1.00 0.00 C ATOM 433 CG LEU A 478 12.674 -6.238 -3.045 1.00 0.00 C ATOM 434 CD1 LEU A 478 11.893 -5.093 -3.725 1.00 0.00 C ATOM 435 CD2 LEU A 478 14.046 -6.451 -3.729 1.00 0.00 C ATOM 0 H LEU A 478 12.818 -5.284 0.891 1.00 0.00 H new ATOM 0 HA LEU A 478 10.792 -5.325 -1.257 1.00 0.00 H new ATOM 0 HB2 LEU A 478 13.418 -5.077 -1.376 1.00 0.00 H new ATOM 0 HB3 LEU A 478 13.431 -6.807 -1.098 1.00 0.00 H new ATOM 0 HG LEU A 478 12.092 -7.152 -3.164 1.00 0.00 H new ATOM 0 HD11 LEU A 478 11.798 -5.300 -4.791 1.00 0.00 H new ATOM 0 HD12 LEU A 478 10.901 -5.015 -3.281 1.00 0.00 H new ATOM 0 HD13 LEU A 478 12.428 -4.154 -3.584 1.00 0.00 H new ATOM 0 HD21 LEU A 478 13.898 -6.621 -4.795 1.00 0.00 H new ATOM 0 HD22 LEU A 478 14.666 -5.566 -3.585 1.00 0.00 H new ATOM 0 HD23 LEU A 478 14.542 -7.316 -3.289 1.00 0.00 H new ATOM 447 N GLY A 479 10.438 -7.996 -1.299 1.00 0.00 N ATOM 448 CA GLY A 479 9.892 -9.337 -1.054 1.00 0.00 C ATOM 449 C GLY A 479 8.599 -9.579 -1.785 1.00 0.00 C ATOM 450 O GLY A 479 8.478 -10.514 -2.584 1.00 0.00 O ATOM 0 H GLY A 479 10.423 -7.705 -2.277 1.00 0.00 H new ATOM 0 HA2 GLY A 479 10.624 -10.085 -1.361 1.00 0.00 H new ATOM 0 HA3 GLY A 479 9.730 -9.469 0.016 1.00 0.00 H new ATOM 454 N ASN A 480 7.634 -8.701 -1.521 1.00 0.00 N ATOM 455 CA ASN A 480 6.303 -8.749 -2.147 1.00 0.00 C ATOM 456 C ASN A 480 6.361 -8.380 -3.650 1.00 0.00 C ATOM 457 O ASN A 480 5.399 -8.599 -4.395 1.00 0.00 O ATOM 458 CB ASN A 480 5.353 -7.807 -1.383 1.00 0.00 C ATOM 459 CG ASN A 480 5.172 -8.139 0.107 1.00 0.00 C ATOM 460 OD1 ASN A 480 5.008 -7.241 0.931 1.00 0.00 O ATOM 461 ND2 ASN A 480 5.158 -9.417 0.467 1.00 0.00 N ATOM 0 H ASN A 480 7.748 -7.929 -0.864 1.00 0.00 H new ATOM 0 HA ASN A 480 5.927 -9.770 -2.090 1.00 0.00 H new ATOM 0 HB2 ASN A 480 5.728 -6.787 -1.470 1.00 0.00 H new ATOM 0 HB3 ASN A 480 4.376 -7.829 -1.866 1.00 0.00 H new ATOM 0 HD21 ASN A 480 5.009 -9.670 1.444 1.00 0.00 H new ATOM 0 HD22 ASN A 480 5.296 -10.146 -0.233 1.00 0.00 H new ATOM 468 N TRP A 481 7.507 -7.816 -4.069 1.00 0.00 N ATOM 469 CA TRP A 481 7.770 -7.418 -5.457 1.00 0.00 C ATOM 470 C TRP A 481 8.210 -8.640 -6.286 1.00 0.00 C ATOM 471 O TRP A 481 8.623 -9.673 -5.731 1.00 0.00 O ATOM 472 CB TRP A 481 8.853 -6.312 -5.486 1.00 0.00 C ATOM 473 CG TRP A 481 8.449 -5.009 -4.807 1.00 0.00 C ATOM 474 CD1 TRP A 481 8.062 -4.828 -3.501 1.00 0.00 C ATOM 475 CD2 TRP A 481 8.425 -3.704 -5.405 1.00 0.00 C ATOM 476 NE1 TRP A 481 7.804 -3.505 -3.265 1.00 0.00 N ATOM 477 CE2 TRP A 481 8.021 -2.795 -4.412 1.00 0.00 C ATOM 478 CE3 TRP A 481 8.705 -3.221 -6.687 1.00 0.00 C ATOM 479 CZ2 TRP A 481 7.891 -1.433 -4.658 1.00 0.00 C ATOM 480 CZ3 TRP A 481 8.569 -1.867 -6.934 1.00 0.00 C ATOM 481 CH2 TRP A 481 8.168 -0.984 -5.922 1.00 0.00 C ATOM 0 H TRP A 481 8.287 -7.622 -3.441 1.00 0.00 H new ATOM 0 HA TRP A 481 6.856 -7.021 -5.898 1.00 0.00 H new ATOM 0 HB2 TRP A 481 9.754 -6.692 -5.006 1.00 0.00 H new ATOM 0 HB3 TRP A 481 9.110 -6.101 -6.524 1.00 0.00 H new ATOM 0 HD1 TRP A 481 7.974 -5.616 -2.767 1.00 0.00 H new ATOM 0 HE1 TRP A 481 7.498 -3.112 -2.375 1.00 0.00 H new ATOM 0 HE3 TRP A 481 9.022 -3.893 -7.470 1.00 0.00 H new ATOM 0 HZ2 TRP A 481 7.582 -0.752 -3.879 1.00 0.00 H new ATOM 0 HZ3 TRP A 481 8.775 -1.484 -7.923 1.00 0.00 H new ATOM 0 HH2 TRP A 481 8.076 0.069 -6.143 1.00 0.00 H new ATOM 492 N ARG A 482 8.132 -8.496 -7.621 1.00 0.00 N ATOM 493 CA ARG A 482 8.386 -9.590 -8.576 1.00 0.00 C ATOM 494 C ARG A 482 8.773 -9.026 -9.960 1.00 0.00 C ATOM 495 O ARG A 482 8.064 -8.181 -10.516 1.00 0.00 O ATOM 496 CB ARG A 482 7.137 -10.526 -8.673 1.00 0.00 C ATOM 497 CG ARG A 482 5.782 -9.783 -8.751 1.00 0.00 C ATOM 498 CD ARG A 482 4.575 -10.729 -8.850 1.00 0.00 C ATOM 499 NE ARG A 482 3.295 -10.009 -8.684 1.00 0.00 N ATOM 500 CZ ARG A 482 2.182 -10.213 -9.412 1.00 0.00 C ATOM 501 NH1 ARG A 482 2.167 -11.062 -10.434 1.00 0.00 N ATOM 502 NH2 ARG A 482 1.075 -9.560 -9.102 1.00 0.00 N ATOM 0 H ARG A 482 7.890 -7.613 -8.070 1.00 0.00 H new ATOM 0 HA ARG A 482 9.226 -10.183 -8.214 1.00 0.00 H new ATOM 0 HB2 ARG A 482 7.241 -11.159 -9.554 1.00 0.00 H new ATOM 0 HB3 ARG A 482 7.125 -11.186 -7.806 1.00 0.00 H new ATOM 0 HG2 ARG A 482 5.670 -9.153 -7.869 1.00 0.00 H new ATOM 0 HG3 ARG A 482 5.788 -9.121 -9.617 1.00 0.00 H new ATOM 0 HD2 ARG A 482 4.586 -11.231 -9.817 1.00 0.00 H new ATOM 0 HD3 ARG A 482 4.657 -11.504 -8.087 1.00 0.00 H new ATOM 0 HE ARG A 482 3.252 -9.297 -7.955 1.00 0.00 H new ATOM 0 HH11 ARG A 482 3.012 -11.577 -10.682 1.00 0.00 H new ATOM 0 HH12 ARG A 482 1.310 -11.199 -10.971 1.00 0.00 H new ATOM 0 HH21 ARG A 482 1.070 -8.909 -8.317 1.00 0.00 H new ATOM 0 HH22 ARG A 482 0.226 -9.708 -9.648 1.00 0.00 H new ATOM 516 N ILE A 483 9.909 -9.503 -10.507 1.00 0.00 N ATOM 517 CA ILE A 483 10.389 -9.104 -11.842 1.00 0.00 C ATOM 518 C ILE A 483 9.883 -10.109 -12.895 1.00 0.00 C ATOM 519 O ILE A 483 10.327 -11.261 -12.912 1.00 0.00 O ATOM 520 CB ILE A 483 11.963 -9.045 -11.921 1.00 0.00 C ATOM 521 CG1 ILE A 483 12.568 -8.164 -10.786 1.00 0.00 C ATOM 522 CG2 ILE A 483 12.424 -8.536 -13.315 1.00 0.00 C ATOM 523 CD1 ILE A 483 14.094 -8.114 -10.785 1.00 0.00 C ATOM 0 H ILE A 483 10.517 -10.173 -10.036 1.00 0.00 H new ATOM 0 HA ILE A 483 10.001 -8.104 -12.037 1.00 0.00 H new ATOM 0 HB ILE A 483 12.335 -10.060 -11.780 1.00 0.00 H new ATOM 0 HG12 ILE A 483 12.182 -7.149 -10.883 1.00 0.00 H new ATOM 0 HG13 ILE A 483 12.227 -8.545 -9.823 1.00 0.00 H new ATOM 0 HG21 ILE A 483 13.513 -8.503 -13.348 1.00 0.00 H new ATOM 0 HG22 ILE A 483 12.058 -9.211 -14.088 1.00 0.00 H new ATOM 0 HG23 ILE A 483 12.025 -7.536 -13.488 1.00 0.00 H new ATOM 0 HD11 ILE A 483 14.437 -7.481 -9.966 1.00 0.00 H new ATOM 0 HD12 ILE A 483 14.491 -9.121 -10.656 1.00 0.00 H new ATOM 0 HD13 ILE A 483 14.445 -7.704 -11.732 1.00 0.00 H new ATOM 535 N LYS A 484 8.947 -9.672 -13.747 1.00 0.00 N ATOM 536 CA LYS A 484 8.494 -10.446 -14.915 1.00 0.00 C ATOM 537 C LYS A 484 9.463 -10.272 -16.095 1.00 0.00 C ATOM 538 O LYS A 484 10.320 -9.389 -16.086 1.00 0.00 O ATOM 539 CB LYS A 484 7.083 -9.997 -15.372 1.00 0.00 C ATOM 540 CG LYS A 484 5.961 -10.180 -14.336 1.00 0.00 C ATOM 541 CD LYS A 484 4.602 -9.695 -14.887 1.00 0.00 C ATOM 542 CE LYS A 484 3.437 -9.898 -13.905 1.00 0.00 C ATOM 543 NZ LYS A 484 2.184 -9.308 -14.438 1.00 0.00 N ATOM 0 H LYS A 484 8.480 -8.770 -13.648 1.00 0.00 H new ATOM 0 HA LYS A 484 8.463 -11.492 -14.611 1.00 0.00 H new ATOM 0 HB2 LYS A 484 7.128 -8.944 -15.650 1.00 0.00 H new ATOM 0 HB3 LYS A 484 6.818 -10.553 -16.271 1.00 0.00 H new ATOM 0 HG2 LYS A 484 5.888 -11.231 -14.058 1.00 0.00 H new ATOM 0 HG3 LYS A 484 6.207 -9.627 -13.430 1.00 0.00 H new ATOM 0 HD2 LYS A 484 4.677 -8.637 -15.137 1.00 0.00 H new ATOM 0 HD3 LYS A 484 4.383 -10.226 -15.813 1.00 0.00 H new ATOM 0 HE2 LYS A 484 3.293 -10.963 -13.721 1.00 0.00 H new ATOM 0 HE3 LYS A 484 3.680 -9.439 -12.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 1.616 -8.932 -13.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 2.416 -8.538 -15.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 1.641 -10.040 -14.939 1.00 0.00 H new ATOM 557 N ARG A 485 9.293 -11.128 -17.108 1.00 0.00 N ATOM 558 CA ARG A 485 9.894 -10.962 -18.433 1.00 0.00 C ATOM 559 C ARG A 485 8.984 -11.641 -19.458 1.00 0.00 C ATOM 560 O ARG A 485 8.736 -12.846 -19.372 1.00 0.00 O ATOM 561 CB ARG A 485 11.333 -11.542 -18.498 1.00 0.00 C ATOM 562 CG ARG A 485 11.978 -11.481 -19.908 1.00 0.00 C ATOM 563 CD ARG A 485 13.479 -11.808 -19.900 1.00 0.00 C ATOM 564 NE ARG A 485 14.262 -10.771 -19.197 1.00 0.00 N ATOM 565 CZ ARG A 485 15.555 -10.861 -18.848 1.00 0.00 C ATOM 566 NH1 ARG A 485 16.241 -11.972 -19.035 1.00 0.00 N ATOM 567 NH2 ARG A 485 16.158 -9.817 -18.310 1.00 0.00 N ATOM 0 H ARG A 485 8.723 -11.970 -17.027 1.00 0.00 H new ATOM 0 HA ARG A 485 9.984 -9.898 -18.653 1.00 0.00 H new ATOM 0 HB2 ARG A 485 11.965 -10.996 -17.797 1.00 0.00 H new ATOM 0 HB3 ARG A 485 11.310 -12.580 -18.165 1.00 0.00 H new ATOM 0 HG2 ARG A 485 11.464 -12.181 -20.567 1.00 0.00 H new ATOM 0 HG3 ARG A 485 11.832 -10.485 -20.325 1.00 0.00 H new ATOM 0 HD2 ARG A 485 13.638 -12.773 -19.418 1.00 0.00 H new ATOM 0 HD3 ARG A 485 13.836 -11.901 -20.926 1.00 0.00 H new ATOM 0 HE ARG A 485 13.776 -9.908 -18.955 1.00 0.00 H new ATOM 0 HH11 ARG A 485 15.790 -12.786 -19.453 1.00 0.00 H new ATOM 0 HH12 ARG A 485 17.223 -12.017 -18.762 1.00 0.00 H new ATOM 0 HH21 ARG A 485 15.642 -8.950 -18.162 1.00 0.00 H new ATOM 0 HH22 ARG A 485 17.140 -9.878 -18.042 1.00 0.00 H new ATOM 581 N GLN A 486 8.471 -10.831 -20.389 1.00 0.00 N ATOM 582 CA GLN A 486 7.615 -11.260 -21.497 1.00 0.00 C ATOM 583 C GLN A 486 8.484 -11.421 -22.752 1.00 0.00 C ATOM 584 O GLN A 486 8.854 -10.419 -23.369 1.00 0.00 O ATOM 585 CB GLN A 486 6.527 -10.168 -21.730 1.00 0.00 C ATOM 586 CG GLN A 486 5.574 -9.924 -20.536 1.00 0.00 C ATOM 587 CD GLN A 486 4.384 -10.879 -20.507 1.00 0.00 C ATOM 588 OE1 GLN A 486 4.447 -11.984 -21.036 1.00 0.00 O ATOM 589 NE2 GLN A 486 3.300 -10.467 -19.876 1.00 0.00 N ATOM 0 H GLN A 486 8.646 -9.826 -20.391 1.00 0.00 H new ATOM 0 HA GLN A 486 7.131 -12.210 -21.272 1.00 0.00 H new ATOM 0 HB2 GLN A 486 7.024 -9.229 -21.976 1.00 0.00 H new ATOM 0 HB3 GLN A 486 5.931 -10.450 -22.598 1.00 0.00 H new ATOM 0 HG2 GLN A 486 6.134 -10.025 -19.607 1.00 0.00 H new ATOM 0 HG3 GLN A 486 5.207 -8.899 -20.577 1.00 0.00 H new ATOM 0 HE21 GLN A 486 3.280 -9.542 -19.447 1.00 0.00 H new ATOM 0 HE22 GLN A 486 2.482 -11.074 -19.818 1.00 0.00 H new ATOM 598 N VAL A 487 8.823 -12.671 -23.108 1.00 0.00 N ATOM 599 CA VAL A 487 9.649 -12.980 -24.299 1.00 0.00 C ATOM 600 C VAL A 487 8.799 -12.815 -25.585 1.00 0.00 C ATOM 601 O VAL A 487 7.568 -12.884 -25.517 1.00 0.00 O ATOM 602 CB VAL A 487 10.266 -14.433 -24.182 1.00 0.00 C ATOM 603 CG1 VAL A 487 11.240 -14.757 -25.350 1.00 0.00 C ATOM 604 CG2 VAL A 487 10.971 -14.605 -22.809 1.00 0.00 C ATOM 0 H VAL A 487 8.536 -13.497 -22.584 1.00 0.00 H new ATOM 0 HA VAL A 487 10.482 -12.279 -24.355 1.00 0.00 H new ATOM 0 HB VAL A 487 9.444 -15.146 -24.252 1.00 0.00 H new ATOM 0 HG11 VAL A 487 11.637 -15.764 -25.224 1.00 0.00 H new ATOM 0 HG12 VAL A 487 10.706 -14.693 -26.298 1.00 0.00 H new ATOM 0 HG13 VAL A 487 12.062 -14.041 -25.348 1.00 0.00 H new ATOM 0 HG21 VAL A 487 11.392 -15.608 -22.739 1.00 0.00 H new ATOM 0 HG22 VAL A 487 11.770 -13.869 -22.715 1.00 0.00 H new ATOM 0 HG23 VAL A 487 10.247 -14.459 -22.007 1.00 0.00 H new ATOM 614 N LEU A 488 9.468 -12.581 -26.740 1.00 0.00 N ATOM 615 CA LEU A 488 8.815 -12.339 -28.057 1.00 0.00 C ATOM 616 C LEU A 488 7.832 -13.453 -28.478 1.00 0.00 C ATOM 617 O LEU A 488 6.913 -13.211 -29.266 1.00 0.00 O ATOM 618 CB LEU A 488 9.915 -12.104 -29.147 1.00 0.00 C ATOM 619 CG LEU A 488 11.028 -13.222 -29.324 1.00 0.00 C ATOM 620 CD1 LEU A 488 10.559 -14.430 -30.168 1.00 0.00 C ATOM 621 CD2 LEU A 488 12.335 -12.634 -29.907 1.00 0.00 C ATOM 0 H LEU A 488 10.487 -12.554 -26.788 1.00 0.00 H new ATOM 0 HA LEU A 488 8.201 -11.445 -27.954 1.00 0.00 H new ATOM 0 HB2 LEU A 488 9.414 -11.974 -30.106 1.00 0.00 H new ATOM 0 HB3 LEU A 488 10.417 -11.164 -28.920 1.00 0.00 H new ATOM 0 HG LEU A 488 11.226 -13.597 -28.320 1.00 0.00 H new ATOM 0 HD11 LEU A 488 11.369 -15.155 -30.248 1.00 0.00 H new ATOM 0 HD12 LEU A 488 9.700 -14.898 -29.687 1.00 0.00 H new ATOM 0 HD13 LEU A 488 10.277 -14.090 -31.164 1.00 0.00 H new ATOM 0 HD21 LEU A 488 13.075 -13.427 -30.015 1.00 0.00 H new ATOM 0 HD22 LEU A 488 12.132 -12.192 -30.883 1.00 0.00 H new ATOM 0 HD23 LEU A 488 12.721 -11.867 -29.235 1.00 0.00 H new ATOM 633 N GLU A 489 8.055 -14.673 -27.967 1.00 0.00 N ATOM 634 CA GLU A 489 7.201 -15.840 -28.265 1.00 0.00 C ATOM 635 C GLU A 489 5.997 -15.912 -27.303 1.00 0.00 C ATOM 636 O GLU A 489 4.984 -16.557 -27.613 1.00 0.00 O ATOM 637 CB GLU A 489 8.045 -17.140 -28.229 1.00 0.00 C ATOM 638 CG GLU A 489 8.750 -17.438 -26.888 1.00 0.00 C ATOM 639 CD GLU A 489 9.660 -18.679 -26.955 1.00 0.00 C ATOM 640 OE1 GLU A 489 9.133 -19.811 -26.905 1.00 0.00 O ATOM 641 OE2 GLU A 489 10.900 -18.530 -27.087 1.00 0.00 O ATOM 0 H GLU A 489 8.829 -14.882 -27.337 1.00 0.00 H new ATOM 0 HA GLU A 489 6.795 -15.728 -29.270 1.00 0.00 H new ATOM 0 HB2 GLU A 489 7.396 -17.981 -28.473 1.00 0.00 H new ATOM 0 HB3 GLU A 489 8.801 -17.083 -29.012 1.00 0.00 H new ATOM 0 HG2 GLU A 489 9.344 -16.573 -26.595 1.00 0.00 H new ATOM 0 HG3 GLU A 489 7.998 -17.586 -26.113 1.00 0.00 H new ATOM 648 N GLY A 490 6.125 -15.246 -26.137 1.00 0.00 N ATOM 649 CA GLY A 490 5.019 -15.089 -25.175 1.00 0.00 C ATOM 650 C GLY A 490 5.275 -15.736 -23.817 1.00 0.00 C ATOM 651 O GLY A 490 4.335 -15.900 -23.035 1.00 0.00 O ATOM 0 H GLY A 490 6.995 -14.804 -25.838 1.00 0.00 H new ATOM 0 HA2 GLY A 490 4.828 -14.026 -25.028 1.00 0.00 H new ATOM 0 HA3 GLY A 490 4.114 -15.519 -25.605 1.00 0.00 H new ATOM 655 N GLU A 491 6.536 -16.112 -23.524 1.00 0.00 N ATOM 656 CA GLU A 491 6.895 -16.727 -22.230 1.00 0.00 C ATOM 657 C GLU A 491 6.959 -15.653 -21.127 1.00 0.00 C ATOM 658 O GLU A 491 7.846 -14.797 -21.138 1.00 0.00 O ATOM 659 CB GLU A 491 8.236 -17.496 -22.329 1.00 0.00 C ATOM 660 CG GLU A 491 8.232 -18.647 -23.346 1.00 0.00 C ATOM 661 CD GLU A 491 9.539 -19.450 -23.318 1.00 0.00 C ATOM 662 OE1 GLU A 491 10.601 -18.887 -23.671 1.00 0.00 O ATOM 663 OE2 GLU A 491 9.520 -20.640 -22.921 1.00 0.00 O ATOM 0 H GLU A 491 7.322 -16.001 -24.165 1.00 0.00 H new ATOM 0 HA GLU A 491 6.120 -17.447 -21.968 1.00 0.00 H new ATOM 0 HB2 GLU A 491 9.025 -16.793 -22.596 1.00 0.00 H new ATOM 0 HB3 GLU A 491 8.485 -17.896 -21.346 1.00 0.00 H new ATOM 0 HG2 GLU A 491 7.394 -19.312 -23.136 1.00 0.00 H new ATOM 0 HG3 GLU A 491 8.076 -18.245 -24.347 1.00 0.00 H new ATOM 670 N GLU A 492 5.979 -15.699 -20.206 1.00 0.00 N ATOM 671 CA GLU A 492 5.883 -14.784 -19.052 1.00 0.00 C ATOM 672 C GLU A 492 6.392 -15.493 -17.778 1.00 0.00 C ATOM 673 O GLU A 492 5.680 -16.294 -17.163 1.00 0.00 O ATOM 674 CB GLU A 492 4.418 -14.273 -18.873 1.00 0.00 C ATOM 675 CG GLU A 492 3.333 -15.367 -18.907 1.00 0.00 C ATOM 676 CD GLU A 492 1.926 -14.834 -18.607 1.00 0.00 C ATOM 677 OE1 GLU A 492 1.576 -14.703 -17.417 1.00 0.00 O ATOM 678 OE2 GLU A 492 1.166 -14.546 -19.552 1.00 0.00 O ATOM 0 H GLU A 492 5.222 -16.381 -20.242 1.00 0.00 H new ATOM 0 HA GLU A 492 6.512 -13.913 -19.235 1.00 0.00 H new ATOM 0 HB2 GLU A 492 4.348 -13.744 -17.923 1.00 0.00 H new ATOM 0 HB3 GLU A 492 4.205 -13.548 -19.658 1.00 0.00 H new ATOM 0 HG2 GLU A 492 3.333 -15.839 -19.889 1.00 0.00 H new ATOM 0 HG3 GLU A 492 3.584 -16.141 -18.181 1.00 0.00 H new ATOM 685 N ILE A 493 7.651 -15.226 -17.411 1.00 0.00 N ATOM 686 CA ILE A 493 8.261 -15.754 -16.168 1.00 0.00 C ATOM 687 C ILE A 493 8.450 -14.602 -15.168 1.00 0.00 C ATOM 688 O ILE A 493 8.826 -13.504 -15.566 1.00 0.00 O ATOM 689 CB ILE A 493 9.622 -16.484 -16.455 1.00 0.00 C ATOM 690 CG1 ILE A 493 10.648 -15.526 -17.142 1.00 0.00 C ATOM 691 CG2 ILE A 493 9.388 -17.761 -17.307 1.00 0.00 C ATOM 692 CD1 ILE A 493 12.026 -16.120 -17.306 1.00 0.00 C ATOM 0 H ILE A 493 8.280 -14.640 -17.960 1.00 0.00 H new ATOM 0 HA ILE A 493 7.591 -16.498 -15.738 1.00 0.00 H new ATOM 0 HB ILE A 493 10.050 -16.787 -15.499 1.00 0.00 H new ATOM 0 HG12 ILE A 493 10.266 -15.244 -18.123 1.00 0.00 H new ATOM 0 HG13 ILE A 493 10.725 -14.611 -16.555 1.00 0.00 H new ATOM 0 HG21 ILE A 493 10.342 -18.253 -17.495 1.00 0.00 H new ATOM 0 HG22 ILE A 493 8.729 -18.442 -16.768 1.00 0.00 H new ATOM 0 HG23 ILE A 493 8.928 -17.486 -18.256 1.00 0.00 H new ATOM 0 HD11 ILE A 493 12.680 -15.394 -17.790 1.00 0.00 H new ATOM 0 HD12 ILE A 493 12.431 -16.376 -16.327 1.00 0.00 H new ATOM 0 HD13 ILE A 493 11.964 -17.019 -17.920 1.00 0.00 H new ATOM 704 N ALA A 494 8.174 -14.851 -13.874 1.00 0.00 N ATOM 705 CA ALA A 494 8.202 -13.804 -12.833 1.00 0.00 C ATOM 706 C ALA A 494 8.922 -14.300 -11.569 1.00 0.00 C ATOM 707 O ALA A 494 8.428 -15.198 -10.880 1.00 0.00 O ATOM 708 CB ALA A 494 6.771 -13.353 -12.504 1.00 0.00 C ATOM 0 H ALA A 494 7.927 -15.776 -13.522 1.00 0.00 H new ATOM 0 HA ALA A 494 8.760 -12.950 -13.217 1.00 0.00 H new ATOM 0 HB1 ALA A 494 6.801 -12.581 -11.735 1.00 0.00 H new ATOM 0 HB2 ALA A 494 6.300 -12.953 -13.402 1.00 0.00 H new ATOM 0 HB3 ALA A 494 6.196 -14.205 -12.141 1.00 0.00 H new ATOM 714 N TYR A 495 10.092 -13.703 -11.281 1.00 0.00 N ATOM 715 CA TYR A 495 10.873 -13.981 -10.066 1.00 0.00 C ATOM 716 C TYR A 495 10.333 -13.160 -8.887 1.00 0.00 C ATOM 717 O TYR A 495 10.450 -11.933 -8.889 1.00 0.00 O ATOM 718 CB TYR A 495 12.377 -13.654 -10.284 1.00 0.00 C ATOM 719 CG TYR A 495 13.264 -13.872 -9.037 1.00 0.00 C ATOM 720 CD1 TYR A 495 13.510 -15.159 -8.546 1.00 0.00 C ATOM 721 CD2 TYR A 495 13.840 -12.799 -8.347 1.00 0.00 C ATOM 722 CE1 TYR A 495 14.298 -15.366 -7.431 1.00 0.00 C ATOM 723 CE2 TYR A 495 14.630 -13.004 -7.230 1.00 0.00 C ATOM 724 CZ TYR A 495 14.855 -14.287 -6.776 1.00 0.00 C ATOM 725 OH TYR A 495 15.644 -14.492 -5.663 1.00 0.00 O ATOM 0 H TYR A 495 10.524 -13.009 -11.891 1.00 0.00 H new ATOM 0 HA TYR A 495 10.777 -15.043 -9.841 1.00 0.00 H new ATOM 0 HB2 TYR A 495 12.757 -14.272 -11.098 1.00 0.00 H new ATOM 0 HB3 TYR A 495 12.468 -12.616 -10.603 1.00 0.00 H new ATOM 0 HD1 TYR A 495 13.074 -16.009 -9.050 1.00 0.00 H new ATOM 0 HD2 TYR A 495 13.664 -11.791 -8.693 1.00 0.00 H new ATOM 0 HE1 TYR A 495 14.478 -16.369 -7.073 1.00 0.00 H new ATOM 0 HE2 TYR A 495 15.069 -12.162 -6.715 1.00 0.00 H new ATOM 0 HH TYR A 495 16.148 -13.675 -5.464 1.00 0.00 H new ATOM 735 N LYS A 496 9.754 -13.842 -7.889 1.00 0.00 N ATOM 736 CA LYS A 496 9.342 -13.212 -6.620 1.00 0.00 C ATOM 737 C LYS A 496 10.547 -13.163 -5.668 1.00 0.00 C ATOM 738 O LYS A 496 11.391 -14.071 -5.667 1.00 0.00 O ATOM 739 CB LYS A 496 8.154 -13.974 -5.937 1.00 0.00 C ATOM 740 CG LYS A 496 6.774 -13.868 -6.648 1.00 0.00 C ATOM 741 CD LYS A 496 6.690 -14.648 -7.982 1.00 0.00 C ATOM 742 CE LYS A 496 6.897 -16.163 -7.805 1.00 0.00 C ATOM 743 NZ LYS A 496 6.778 -16.888 -9.088 1.00 0.00 N ATOM 0 H LYS A 496 9.557 -14.842 -7.935 1.00 0.00 H new ATOM 0 HA LYS A 496 8.992 -12.204 -6.843 1.00 0.00 H new ATOM 0 HB2 LYS A 496 8.421 -15.028 -5.861 1.00 0.00 H new ATOM 0 HB3 LYS A 496 8.045 -13.599 -4.919 1.00 0.00 H new ATOM 0 HG2 LYS A 496 6.001 -14.237 -5.974 1.00 0.00 H new ATOM 0 HG3 LYS A 496 6.555 -12.817 -6.839 1.00 0.00 H new ATOM 0 HD2 LYS A 496 5.717 -14.471 -8.440 1.00 0.00 H new ATOM 0 HD3 LYS A 496 7.442 -14.262 -8.671 1.00 0.00 H new ATOM 0 HE2 LYS A 496 7.881 -16.347 -7.374 1.00 0.00 H new ATOM 0 HE3 LYS A 496 6.162 -16.550 -7.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 7.151 -17.852 -8.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 5.778 -16.934 -9.369 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 7.321 -16.388 -9.821 1.00 0.00 H new ATOM 757 N PHE A 497 10.617 -12.098 -4.866 1.00 0.00 N ATOM 758 CA PHE A 497 11.657 -11.923 -3.841 1.00 0.00 C ATOM 759 C PHE A 497 11.182 -12.523 -2.503 1.00 0.00 C ATOM 760 O PHE A 497 10.010 -12.890 -2.357 1.00 0.00 O ATOM 761 CB PHE A 497 11.984 -10.414 -3.695 1.00 0.00 C ATOM 762 CG PHE A 497 12.648 -9.799 -4.923 1.00 0.00 C ATOM 763 CD1 PHE A 497 14.021 -9.936 -5.129 1.00 0.00 C ATOM 764 CD2 PHE A 497 11.909 -9.087 -5.872 1.00 0.00 C ATOM 765 CE1 PHE A 497 14.631 -9.383 -6.237 1.00 0.00 C ATOM 766 CE2 PHE A 497 12.521 -8.535 -6.981 1.00 0.00 C ATOM 767 CZ PHE A 497 13.882 -8.684 -7.162 1.00 0.00 C ATOM 0 H PHE A 497 9.951 -11.326 -4.907 1.00 0.00 H new ATOM 0 HA PHE A 497 12.565 -12.447 -4.140 1.00 0.00 H new ATOM 0 HB2 PHE A 497 11.062 -9.872 -3.484 1.00 0.00 H new ATOM 0 HB3 PHE A 497 12.638 -10.277 -2.834 1.00 0.00 H new ATOM 0 HD1 PHE A 497 14.615 -10.482 -4.411 1.00 0.00 H new ATOM 0 HD2 PHE A 497 10.844 -8.967 -5.736 1.00 0.00 H new ATOM 0 HE1 PHE A 497 15.695 -9.497 -6.380 1.00 0.00 H new ATOM 0 HE2 PHE A 497 11.936 -7.988 -7.705 1.00 0.00 H new ATOM 0 HZ PHE A 497 14.361 -8.253 -8.029 1.00 0.00 H new ATOM 777 N THR A 498 12.103 -12.631 -1.537 1.00 0.00 N ATOM 778 CA THR A 498 11.801 -13.124 -0.183 1.00 0.00 C ATOM 779 C THR A 498 11.388 -11.928 0.717 1.00 0.00 C ATOM 780 O THR A 498 12.048 -10.890 0.669 1.00 0.00 O ATOM 781 CB THR A 498 13.044 -13.868 0.416 1.00 0.00 C ATOM 782 OG1 THR A 498 14.165 -12.971 0.502 1.00 0.00 O ATOM 783 CG2 THR A 498 13.429 -15.094 -0.440 1.00 0.00 C ATOM 0 H THR A 498 13.082 -12.379 -1.671 1.00 0.00 H new ATOM 0 HA THR A 498 10.976 -13.835 -0.230 1.00 0.00 H new ATOM 0 HB THR A 498 12.776 -14.214 1.414 1.00 0.00 H new ATOM 0 HG1 THR A 498 14.935 -13.445 0.879 1.00 0.00 H new ATOM 0 HG21 THR A 498 14.294 -15.589 0.001 1.00 0.00 H new ATOM 0 HG22 THR A 498 12.591 -15.791 -0.475 1.00 0.00 H new ATOM 0 HG23 THR A 498 13.673 -14.769 -1.451 1.00 0.00 H new ATOM 791 N PRO A 499 10.260 -12.024 1.509 1.00 0.00 N ATOM 792 CA PRO A 499 9.779 -10.915 2.403 1.00 0.00 C ATOM 793 C PRO A 499 10.802 -10.449 3.468 1.00 0.00 C ATOM 794 O PRO A 499 10.638 -9.379 4.070 1.00 0.00 O ATOM 795 CB PRO A 499 8.509 -11.514 3.068 1.00 0.00 C ATOM 796 CG PRO A 499 8.058 -12.574 2.109 1.00 0.00 C ATOM 797 CD PRO A 499 9.325 -13.180 1.554 1.00 0.00 C ATOM 0 HA PRO A 499 9.599 -10.007 1.827 1.00 0.00 H new ATOM 0 HB2 PRO A 499 8.733 -11.933 4.049 1.00 0.00 H new ATOM 0 HB3 PRO A 499 7.740 -10.755 3.214 1.00 0.00 H new ATOM 0 HG2 PRO A 499 7.451 -13.326 2.612 1.00 0.00 H new ATOM 0 HG3 PRO A 499 7.445 -12.149 1.314 1.00 0.00 H new ATOM 0 HD2 PRO A 499 9.703 -13.979 2.192 1.00 0.00 H new ATOM 0 HD3 PRO A 499 9.167 -13.609 0.565 1.00 0.00 H new ATOM 805 N LYS A 500 11.840 -11.271 3.704 1.00 0.00 N ATOM 806 CA LYS A 500 12.939 -10.941 4.634 1.00 0.00 C ATOM 807 C LYS A 500 13.958 -9.982 3.980 1.00 0.00 C ATOM 808 O LYS A 500 14.674 -9.258 4.681 1.00 0.00 O ATOM 809 CB LYS A 500 13.658 -12.240 5.095 1.00 0.00 C ATOM 810 CG LYS A 500 14.377 -13.023 3.965 1.00 0.00 C ATOM 811 CD LYS A 500 15.072 -14.312 4.461 1.00 0.00 C ATOM 812 CE LYS A 500 14.085 -15.347 5.040 1.00 0.00 C ATOM 813 NZ LYS A 500 14.783 -16.547 5.554 1.00 0.00 N ATOM 0 H LYS A 500 11.942 -12.182 3.257 1.00 0.00 H new ATOM 0 HA LYS A 500 12.506 -10.440 5.500 1.00 0.00 H new ATOM 0 HB2 LYS A 500 14.390 -11.981 5.860 1.00 0.00 H new ATOM 0 HB3 LYS A 500 12.925 -12.897 5.563 1.00 0.00 H new ATOM 0 HG2 LYS A 500 13.651 -13.283 3.194 1.00 0.00 H new ATOM 0 HG3 LYS A 500 15.119 -12.375 3.499 1.00 0.00 H new ATOM 0 HD2 LYS A 500 15.619 -14.764 3.634 1.00 0.00 H new ATOM 0 HD3 LYS A 500 15.805 -14.052 5.224 1.00 0.00 H new ATOM 0 HE2 LYS A 500 13.509 -14.889 5.844 1.00 0.00 H new ATOM 0 HE3 LYS A 500 13.375 -15.643 4.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 14.085 -17.218 5.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 15.312 -16.999 4.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 15.442 -16.269 6.308 1.00 0.00 H new ATOM 827 N TYR A 501 14.012 -9.994 2.636 1.00 0.00 N ATOM 828 CA TYR A 501 14.999 -9.233 1.858 1.00 0.00 C ATOM 829 C TYR A 501 14.641 -7.736 1.863 1.00 0.00 C ATOM 830 O TYR A 501 13.500 -7.368 1.606 1.00 0.00 O ATOM 831 CB TYR A 501 15.077 -9.772 0.402 1.00 0.00 C ATOM 832 CG TYR A 501 16.266 -9.210 -0.383 1.00 0.00 C ATOM 833 CD1 TYR A 501 17.526 -9.810 -0.304 1.00 0.00 C ATOM 834 CD2 TYR A 501 16.144 -8.061 -1.167 1.00 0.00 C ATOM 835 CE1 TYR A 501 18.604 -9.287 -0.980 1.00 0.00 C ATOM 836 CE2 TYR A 501 17.221 -7.539 -1.837 1.00 0.00 C ATOM 837 CZ TYR A 501 18.446 -8.156 -1.743 1.00 0.00 C ATOM 838 OH TYR A 501 19.521 -7.635 -2.410 1.00 0.00 O ATOM 0 H TYR A 501 13.368 -10.535 2.059 1.00 0.00 H new ATOM 0 HA TYR A 501 15.978 -9.357 2.321 1.00 0.00 H new ATOM 0 HB2 TYR A 501 15.147 -10.859 0.427 1.00 0.00 H new ATOM 0 HB3 TYR A 501 14.154 -9.524 -0.121 1.00 0.00 H new ATOM 0 HD1 TYR A 501 17.655 -10.698 0.297 1.00 0.00 H new ATOM 0 HD2 TYR A 501 15.183 -7.574 -1.247 1.00 0.00 H new ATOM 0 HE1 TYR A 501 19.571 -9.764 -0.911 1.00 0.00 H new ATOM 0 HE2 TYR A 501 17.107 -6.647 -2.436 1.00 0.00 H new ATOM 0 HH TYR A 501 20.176 -8.344 -2.580 1.00 0.00 H new ATOM 848 N ILE A 502 15.629 -6.882 2.173 1.00 0.00 N ATOM 849 CA ILE A 502 15.454 -5.418 2.220 1.00 0.00 C ATOM 850 C ILE A 502 16.633 -4.744 1.501 1.00 0.00 C ATOM 851 O ILE A 502 17.789 -4.946 1.882 1.00 0.00 O ATOM 852 CB ILE A 502 15.379 -4.877 3.698 1.00 0.00 C ATOM 853 CG1 ILE A 502 14.267 -5.599 4.526 1.00 0.00 C ATOM 854 CG2 ILE A 502 15.164 -3.347 3.705 1.00 0.00 C ATOM 855 CD1 ILE A 502 14.129 -5.115 5.960 1.00 0.00 C ATOM 0 H ILE A 502 16.576 -7.186 2.399 1.00 0.00 H new ATOM 0 HA ILE A 502 14.511 -5.181 1.727 1.00 0.00 H new ATOM 0 HB ILE A 502 16.333 -5.097 4.178 1.00 0.00 H new ATOM 0 HG12 ILE A 502 13.311 -5.467 4.019 1.00 0.00 H new ATOM 0 HG13 ILE A 502 14.477 -6.668 4.536 1.00 0.00 H new ATOM 0 HG21 ILE A 502 15.115 -2.991 4.734 1.00 0.00 H new ATOM 0 HG22 ILE A 502 15.994 -2.861 3.192 1.00 0.00 H new ATOM 0 HG23 ILE A 502 14.232 -3.108 3.194 1.00 0.00 H new ATOM 0 HD11 ILE A 502 13.334 -5.672 6.457 1.00 0.00 H new ATOM 0 HD12 ILE A 502 15.069 -5.273 6.489 1.00 0.00 H new ATOM 0 HD13 ILE A 502 13.885 -4.053 5.964 1.00 0.00 H new ATOM 867 N LEU A 503 16.325 -3.908 0.505 1.00 0.00 N ATOM 868 CA LEU A 503 17.339 -3.253 -0.352 1.00 0.00 C ATOM 869 C LEU A 503 17.522 -1.788 0.116 1.00 0.00 C ATOM 870 O LEU A 503 16.542 -1.089 0.356 1.00 0.00 O ATOM 871 CB LEU A 503 16.896 -3.345 -1.859 1.00 0.00 C ATOM 872 CG LEU A 503 18.033 -3.358 -2.945 1.00 0.00 C ATOM 873 CD1 LEU A 503 18.818 -2.051 -2.999 1.00 0.00 C ATOM 874 CD2 LEU A 503 18.994 -4.535 -2.732 1.00 0.00 C ATOM 0 H LEU A 503 15.365 -3.661 0.263 1.00 0.00 H new ATOM 0 HA LEU A 503 18.301 -3.758 -0.265 1.00 0.00 H new ATOM 0 HB2 LEU A 503 16.302 -4.251 -1.981 1.00 0.00 H new ATOM 0 HB3 LEU A 503 16.238 -2.502 -2.069 1.00 0.00 H new ATOM 0 HG LEU A 503 17.529 -3.476 -3.904 1.00 0.00 H new ATOM 0 HD11 LEU A 503 19.588 -2.121 -3.767 1.00 0.00 H new ATOM 0 HD12 LEU A 503 18.142 -1.230 -3.237 1.00 0.00 H new ATOM 0 HD13 LEU A 503 19.286 -1.867 -2.032 1.00 0.00 H new ATOM 0 HD21 LEU A 503 19.768 -4.516 -3.499 1.00 0.00 H new ATOM 0 HD22 LEU A 503 19.456 -4.454 -1.748 1.00 0.00 H new ATOM 0 HD23 LEU A 503 18.442 -5.472 -2.798 1.00 0.00 H new ATOM 886 N ARG A 504 18.790 -1.342 0.222 1.00 0.00 N ATOM 887 CA ARG A 504 19.147 0.006 0.732 1.00 0.00 C ATOM 888 C ARG A 504 18.908 1.106 -0.318 1.00 0.00 C ATOM 889 O ARG A 504 18.941 0.845 -1.528 1.00 0.00 O ATOM 890 CB ARG A 504 20.635 0.055 1.209 1.00 0.00 C ATOM 891 CG ARG A 504 20.906 -0.584 2.587 1.00 0.00 C ATOM 892 CD ARG A 504 20.640 -2.093 2.628 1.00 0.00 C ATOM 893 NE ARG A 504 20.752 -2.631 3.988 1.00 0.00 N ATOM 894 CZ ARG A 504 20.808 -3.928 4.297 1.00 0.00 C ATOM 895 NH1 ARG A 504 20.759 -4.863 3.350 1.00 0.00 N ATOM 896 NH2 ARG A 504 20.899 -4.286 5.568 1.00 0.00 N ATOM 0 H ARG A 504 19.599 -1.904 -0.043 1.00 0.00 H new ATOM 0 HA ARG A 504 18.491 0.197 1.582 1.00 0.00 H new ATOM 0 HB2 ARG A 504 21.254 -0.447 0.466 1.00 0.00 H new ATOM 0 HB3 ARG A 504 20.955 1.096 1.240 1.00 0.00 H new ATOM 0 HG2 ARG A 504 21.943 -0.399 2.866 1.00 0.00 H new ATOM 0 HG3 ARG A 504 20.282 -0.093 3.334 1.00 0.00 H new ATOM 0 HD2 ARG A 504 19.643 -2.297 2.238 1.00 0.00 H new ATOM 0 HD3 ARG A 504 21.348 -2.604 1.976 1.00 0.00 H new ATOM 0 HE ARG A 504 20.790 -1.962 4.757 1.00 0.00 H new ATOM 0 HH11 ARG A 504 20.677 -4.592 2.370 1.00 0.00 H new ATOM 0 HH12 ARG A 504 20.803 -5.850 3.605 1.00 0.00 H new ATOM 0 HH21 ARG A 504 20.926 -3.574 6.298 1.00 0.00 H new ATOM 0 HH22 ARG A 504 20.943 -5.274 5.818 1.00 0.00 H new ATOM 910 N ALA A 505 18.678 2.339 0.178 1.00 0.00 N ATOM 911 CA ALA A 505 18.531 3.547 -0.651 1.00 0.00 C ATOM 912 C ALA A 505 19.808 3.788 -1.479 1.00 0.00 C ATOM 913 O ALA A 505 20.920 3.703 -0.940 1.00 0.00 O ATOM 914 CB ALA A 505 18.247 4.756 0.250 1.00 0.00 C ATOM 0 H ALA A 505 18.589 2.523 1.177 1.00 0.00 H new ATOM 0 HA ALA A 505 17.697 3.408 -1.339 1.00 0.00 H new ATOM 0 HB1 ALA A 505 18.138 5.650 -0.364 1.00 0.00 H new ATOM 0 HB2 ALA A 505 17.327 4.585 0.809 1.00 0.00 H new ATOM 0 HB3 ALA A 505 19.074 4.893 0.947 1.00 0.00 H new ATOM 920 N GLY A 506 19.636 4.029 -2.792 1.00 0.00 N ATOM 921 CA GLY A 506 20.752 4.252 -3.720 1.00 0.00 C ATOM 922 C GLY A 506 21.263 2.959 -4.341 1.00 0.00 C ATOM 923 O GLY A 506 21.516 2.901 -5.550 1.00 0.00 O ATOM 0 H GLY A 506 18.719 4.074 -3.236 1.00 0.00 H new ATOM 0 HA2 GLY A 506 20.432 4.929 -4.512 1.00 0.00 H new ATOM 0 HA3 GLY A 506 21.568 4.744 -3.190 1.00 0.00 H new ATOM 927 N GLN A 507 21.376 1.913 -3.497 1.00 0.00 N ATOM 928 CA GLN A 507 21.895 0.589 -3.879 1.00 0.00 C ATOM 929 C GLN A 507 20.971 -0.134 -4.883 1.00 0.00 C ATOM 930 O GLN A 507 19.890 0.357 -5.247 1.00 0.00 O ATOM 931 CB GLN A 507 22.109 -0.278 -2.596 1.00 0.00 C ATOM 932 CG GLN A 507 23.268 0.190 -1.689 1.00 0.00 C ATOM 933 CD GLN A 507 24.654 0.017 -2.333 1.00 0.00 C ATOM 934 OE1 GLN A 507 24.878 -0.902 -3.128 1.00 0.00 O ATOM 935 NE2 GLN A 507 25.587 0.894 -1.998 1.00 0.00 N ATOM 0 H GLN A 507 21.104 1.968 -2.515 1.00 0.00 H new ATOM 0 HA GLN A 507 22.850 0.734 -4.384 1.00 0.00 H new ATOM 0 HB2 GLN A 507 21.187 -0.277 -2.015 1.00 0.00 H new ATOM 0 HB3 GLN A 507 22.294 -1.309 -2.897 1.00 0.00 H new ATOM 0 HG2 GLN A 507 23.121 1.240 -1.437 1.00 0.00 H new ATOM 0 HG3 GLN A 507 23.237 -0.370 -0.754 1.00 0.00 H new ATOM 0 HE21 GLN A 507 25.371 1.642 -1.339 1.00 0.00 H new ATOM 0 HE22 GLN A 507 26.522 0.822 -2.399 1.00 0.00 H new ATOM 944 N MET A 508 21.413 -1.334 -5.294 1.00 0.00 N ATOM 945 CA MET A 508 20.751 -2.135 -6.330 1.00 0.00 C ATOM 946 C MET A 508 21.028 -3.640 -6.140 1.00 0.00 C ATOM 947 O MET A 508 22.068 -4.037 -5.600 1.00 0.00 O ATOM 948 CB MET A 508 21.208 -1.641 -7.732 1.00 0.00 C ATOM 949 CG MET A 508 22.725 -1.526 -7.916 1.00 0.00 C ATOM 950 SD MET A 508 23.177 -0.794 -9.504 1.00 0.00 S ATOM 951 CE MET A 508 22.356 0.800 -9.424 1.00 0.00 C ATOM 0 H MET A 508 22.248 -1.777 -4.911 1.00 0.00 H new ATOM 0 HA MET A 508 19.672 -2.004 -6.246 1.00 0.00 H new ATOM 0 HB2 MET A 508 20.816 -2.323 -8.486 1.00 0.00 H new ATOM 0 HB3 MET A 508 20.759 -0.666 -7.921 1.00 0.00 H new ATOM 0 HG2 MET A 508 23.140 -0.921 -7.110 1.00 0.00 H new ATOM 0 HG3 MET A 508 23.173 -2.516 -7.836 1.00 0.00 H new ATOM 0 HE1 MET A 508 22.872 1.508 -10.072 1.00 0.00 H new ATOM 0 HE2 MET A 508 21.322 0.694 -9.753 1.00 0.00 H new ATOM 0 HE3 MET A 508 22.374 1.168 -8.398 1.00 0.00 H new ATOM 961 N VAL A 509 20.051 -4.450 -6.574 1.00 0.00 N ATOM 962 CA VAL A 509 20.096 -5.914 -6.556 1.00 0.00 C ATOM 963 C VAL A 509 20.159 -6.428 -8.008 1.00 0.00 C ATOM 964 O VAL A 509 19.266 -6.163 -8.818 1.00 0.00 O ATOM 965 CB VAL A 509 18.854 -6.530 -5.787 1.00 0.00 C ATOM 966 CG1 VAL A 509 17.492 -5.954 -6.276 1.00 0.00 C ATOM 967 CG2 VAL A 509 18.873 -8.074 -5.856 1.00 0.00 C ATOM 0 H VAL A 509 19.179 -4.088 -6.960 1.00 0.00 H new ATOM 0 HA VAL A 509 20.987 -6.234 -6.016 1.00 0.00 H new ATOM 0 HB VAL A 509 18.951 -6.232 -4.743 1.00 0.00 H new ATOM 0 HG11 VAL A 509 16.680 -6.413 -5.713 1.00 0.00 H new ATOM 0 HG12 VAL A 509 17.476 -4.875 -6.121 1.00 0.00 H new ATOM 0 HG13 VAL A 509 17.366 -6.170 -7.337 1.00 0.00 H new ATOM 0 HG21 VAL A 509 18.011 -8.473 -5.321 1.00 0.00 H new ATOM 0 HG22 VAL A 509 18.833 -8.392 -6.898 1.00 0.00 H new ATOM 0 HG23 VAL A 509 19.789 -8.447 -5.398 1.00 0.00 H new ATOM 977 N THR A 510 21.244 -7.132 -8.336 1.00 0.00 N ATOM 978 CA THR A 510 21.464 -7.698 -9.667 1.00 0.00 C ATOM 979 C THR A 510 20.989 -9.165 -9.674 1.00 0.00 C ATOM 980 O THR A 510 21.679 -10.046 -9.148 1.00 0.00 O ATOM 981 CB THR A 510 22.984 -7.604 -10.057 1.00 0.00 C ATOM 982 OG1 THR A 510 23.555 -6.391 -9.535 1.00 0.00 O ATOM 983 CG2 THR A 510 23.185 -7.626 -11.577 1.00 0.00 C ATOM 0 H THR A 510 22.000 -7.327 -7.680 1.00 0.00 H new ATOM 0 HA THR A 510 20.894 -7.132 -10.404 1.00 0.00 H new ATOM 0 HB THR A 510 23.480 -8.474 -9.627 1.00 0.00 H new ATOM 0 HG1 THR A 510 23.755 -6.507 -8.583 1.00 0.00 H new ATOM 0 HG21 THR A 510 24.249 -7.559 -11.804 1.00 0.00 H new ATOM 0 HG22 THR A 510 22.785 -8.555 -11.984 1.00 0.00 H new ATOM 0 HG23 THR A 510 22.664 -6.780 -12.025 1.00 0.00 H new ATOM 991 N VAL A 511 19.775 -9.402 -10.201 1.00 0.00 N ATOM 992 CA VAL A 511 19.178 -10.748 -10.276 1.00 0.00 C ATOM 993 C VAL A 511 19.644 -11.461 -11.563 1.00 0.00 C ATOM 994 O VAL A 511 19.108 -11.227 -12.650 1.00 0.00 O ATOM 995 CB VAL A 511 17.603 -10.696 -10.211 1.00 0.00 C ATOM 996 CG1 VAL A 511 16.980 -12.128 -10.243 1.00 0.00 C ATOM 997 CG2 VAL A 511 17.134 -9.895 -8.964 1.00 0.00 C ATOM 0 H VAL A 511 19.181 -8.668 -10.586 1.00 0.00 H new ATOM 0 HA VAL A 511 19.519 -11.314 -9.409 1.00 0.00 H new ATOM 0 HB VAL A 511 17.246 -10.175 -11.099 1.00 0.00 H new ATOM 0 HG11 VAL A 511 15.894 -12.053 -10.197 1.00 0.00 H new ATOM 0 HG12 VAL A 511 17.270 -12.630 -11.166 1.00 0.00 H new ATOM 0 HG13 VAL A 511 17.341 -12.701 -9.389 1.00 0.00 H new ATOM 0 HG21 VAL A 511 16.045 -9.870 -8.936 1.00 0.00 H new ATOM 0 HG22 VAL A 511 17.509 -10.376 -8.061 1.00 0.00 H new ATOM 0 HG23 VAL A 511 17.519 -8.877 -9.020 1.00 0.00 H new ATOM 1007 N TRP A 512 20.669 -12.303 -11.416 1.00 0.00 N ATOM 1008 CA TRP A 512 21.224 -13.133 -12.495 1.00 0.00 C ATOM 1009 C TRP A 512 20.427 -14.432 -12.676 1.00 0.00 C ATOM 1010 O TRP A 512 19.524 -14.746 -11.895 1.00 0.00 O ATOM 1011 CB TRP A 512 22.704 -13.470 -12.185 1.00 0.00 C ATOM 1012 CG TRP A 512 23.653 -12.293 -12.259 1.00 0.00 C ATOM 1013 CD1 TRP A 512 23.776 -11.274 -11.363 1.00 0.00 C ATOM 1014 CD2 TRP A 512 24.622 -12.034 -13.285 1.00 0.00 C ATOM 1015 NE1 TRP A 512 24.759 -10.411 -11.760 1.00 0.00 N ATOM 1016 CE2 TRP A 512 25.287 -10.846 -12.939 1.00 0.00 C ATOM 1017 CE3 TRP A 512 24.984 -12.692 -14.462 1.00 0.00 C ATOM 1018 CZ2 TRP A 512 26.297 -10.299 -13.724 1.00 0.00 C ATOM 1019 CZ3 TRP A 512 25.986 -12.152 -15.244 1.00 0.00 C ATOM 1020 CH2 TRP A 512 26.634 -10.963 -14.872 1.00 0.00 C ATOM 0 H TRP A 512 21.149 -12.432 -10.525 1.00 0.00 H new ATOM 0 HA TRP A 512 21.157 -12.565 -13.423 1.00 0.00 H new ATOM 0 HB2 TRP A 512 22.762 -13.903 -11.186 1.00 0.00 H new ATOM 0 HB3 TRP A 512 23.042 -14.235 -12.884 1.00 0.00 H new ATOM 0 HD1 TRP A 512 23.182 -11.164 -10.468 1.00 0.00 H new ATOM 0 HE1 TRP A 512 25.051 -9.575 -11.254 1.00 0.00 H new ATOM 0 HE3 TRP A 512 24.490 -13.606 -14.755 1.00 0.00 H new ATOM 0 HZ2 TRP A 512 26.796 -9.385 -13.438 1.00 0.00 H new ATOM 0 HZ3 TRP A 512 26.276 -12.652 -16.156 1.00 0.00 H new ATOM 0 HH2 TRP A 512 27.414 -10.565 -15.504 1.00 0.00 H new ATOM 1031 N ALA A 513 20.774 -15.165 -13.745 1.00 0.00 N ATOM 1032 CA ALA A 513 20.257 -16.517 -14.016 1.00 0.00 C ATOM 1033 C ALA A 513 21.165 -17.567 -13.365 1.00 0.00 C ATOM 1034 O ALA A 513 22.364 -17.321 -13.164 1.00 0.00 O ATOM 1035 CB ALA A 513 20.177 -16.753 -15.536 1.00 0.00 C ATOM 0 H ALA A 513 21.428 -14.833 -14.454 1.00 0.00 H new ATOM 0 HA ALA A 513 19.257 -16.607 -13.592 1.00 0.00 H new ATOM 0 HB1 ALA A 513 19.794 -17.755 -15.729 1.00 0.00 H new ATOM 0 HB2 ALA A 513 19.510 -16.017 -15.984 1.00 0.00 H new ATOM 0 HB3 ALA A 513 21.171 -16.654 -15.972 1.00 0.00 H new ATOM 1041 N ALA A 514 20.590 -18.743 -13.051 1.00 0.00 N ATOM 1042 CA ALA A 514 21.363 -19.912 -12.577 1.00 0.00 C ATOM 1043 C ALA A 514 22.267 -20.453 -13.705 1.00 0.00 C ATOM 1044 O ALA A 514 23.351 -20.993 -13.451 1.00 0.00 O ATOM 1045 CB ALA A 514 20.413 -21.002 -12.054 1.00 0.00 C ATOM 0 H ALA A 514 19.586 -18.912 -13.117 1.00 0.00 H new ATOM 0 HA ALA A 514 22.005 -19.600 -11.753 1.00 0.00 H new ATOM 0 HB1 ALA A 514 20.995 -21.856 -11.708 1.00 0.00 H new ATOM 0 HB2 ALA A 514 19.824 -20.605 -11.227 1.00 0.00 H new ATOM 0 HB3 ALA A 514 19.745 -21.318 -12.856 1.00 0.00 H new ATOM 1051 N GLY A 515 21.817 -20.249 -14.963 1.00 0.00 N ATOM 1052 CA GLY A 515 22.573 -20.654 -16.152 1.00 0.00 C ATOM 1053 C GLY A 515 23.762 -19.749 -16.470 1.00 0.00 C ATOM 1054 O GLY A 515 24.557 -20.057 -17.364 1.00 0.00 O ATOM 0 H GLY A 515 20.925 -19.802 -15.174 1.00 0.00 H new ATOM 0 HA2 GLY A 515 22.933 -21.673 -16.012 1.00 0.00 H new ATOM 0 HA3 GLY A 515 21.901 -20.669 -17.010 1.00 0.00 H new ATOM 1058 N ALA A 516 23.869 -18.614 -15.750 1.00 0.00 N ATOM 1059 CA ALA A 516 25.029 -17.706 -15.838 1.00 0.00 C ATOM 1060 C ALA A 516 26.255 -18.309 -15.109 1.00 0.00 C ATOM 1061 O ALA A 516 27.398 -17.901 -15.361 1.00 0.00 O ATOM 1062 CB ALA A 516 24.667 -16.325 -15.263 1.00 0.00 C ATOM 0 H ALA A 516 23.154 -18.302 -15.092 1.00 0.00 H new ATOM 0 HA ALA A 516 25.296 -17.581 -16.888 1.00 0.00 H new ATOM 0 HB1 ALA A 516 25.531 -15.664 -15.333 1.00 0.00 H new ATOM 0 HB2 ALA A 516 23.838 -15.901 -15.830 1.00 0.00 H new ATOM 0 HB3 ALA A 516 24.375 -16.431 -14.218 1.00 0.00 H new ATOM 1068 N GLY A 517 25.997 -19.290 -14.207 1.00 0.00 N ATOM 1069 CA GLY A 517 27.057 -20.002 -13.470 1.00 0.00 C ATOM 1070 C GLY A 517 27.760 -19.131 -12.430 1.00 0.00 C ATOM 1071 O GLY A 517 28.899 -19.410 -12.035 1.00 0.00 O ATOM 0 H GLY A 517 25.054 -19.603 -13.976 1.00 0.00 H new ATOM 0 HA2 GLY A 517 26.624 -20.870 -12.974 1.00 0.00 H new ATOM 0 HA3 GLY A 517 27.795 -20.376 -14.180 1.00 0.00 H new ATOM 1075 N VAL A 518 27.064 -18.069 -11.993 1.00 0.00 N ATOM 1076 CA VAL A 518 27.575 -17.085 -11.026 1.00 0.00 C ATOM 1077 C VAL A 518 27.159 -17.488 -9.593 1.00 0.00 C ATOM 1078 O VAL A 518 26.054 -18.023 -9.383 1.00 0.00 O ATOM 1079 CB VAL A 518 27.061 -15.633 -11.390 1.00 0.00 C ATOM 1080 CG1 VAL A 518 25.516 -15.566 -11.436 1.00 0.00 C ATOM 1081 CG2 VAL A 518 27.644 -14.551 -10.436 1.00 0.00 C ATOM 0 H VAL A 518 26.115 -17.867 -12.307 1.00 0.00 H new ATOM 0 HA VAL A 518 28.664 -17.071 -11.072 1.00 0.00 H new ATOM 0 HB VAL A 518 27.429 -15.413 -12.392 1.00 0.00 H new ATOM 0 HG11 VAL A 518 25.203 -14.553 -11.689 1.00 0.00 H new ATOM 0 HG12 VAL A 518 25.144 -16.260 -12.190 1.00 0.00 H new ATOM 0 HG13 VAL A 518 25.111 -15.838 -10.461 1.00 0.00 H new ATOM 0 HG21 VAL A 518 27.264 -13.570 -10.723 1.00 0.00 H new ATOM 0 HG22 VAL A 518 27.345 -14.770 -9.411 1.00 0.00 H new ATOM 0 HG23 VAL A 518 28.732 -14.553 -10.505 1.00 0.00 H new ATOM 1091 N ALA A 519 28.072 -17.263 -8.627 1.00 0.00 N ATOM 1092 CA ALA A 519 27.839 -17.552 -7.206 1.00 0.00 C ATOM 1093 C ALA A 519 26.800 -16.578 -6.625 1.00 0.00 C ATOM 1094 O ALA A 519 26.932 -15.353 -6.786 1.00 0.00 O ATOM 1095 CB ALA A 519 29.162 -17.458 -6.420 1.00 0.00 C ATOM 0 H ALA A 519 28.995 -16.873 -8.816 1.00 0.00 H new ATOM 0 HA ALA A 519 27.450 -18.566 -7.115 1.00 0.00 H new ATOM 0 HB1 ALA A 519 28.976 -17.674 -5.368 1.00 0.00 H new ATOM 0 HB2 ALA A 519 29.874 -18.180 -6.819 1.00 0.00 H new ATOM 0 HB3 ALA A 519 29.572 -16.453 -6.517 1.00 0.00 H new ATOM 1101 N HIS A 520 25.758 -17.133 -5.984 1.00 0.00 N ATOM 1102 CA HIS A 520 24.744 -16.337 -5.275 1.00 0.00 C ATOM 1103 C HIS A 520 25.405 -15.634 -4.073 1.00 0.00 C ATOM 1104 O HIS A 520 25.807 -16.290 -3.102 1.00 0.00 O ATOM 1105 CB HIS A 520 23.577 -17.257 -4.829 1.00 0.00 C ATOM 1106 CG HIS A 520 22.424 -16.556 -4.147 1.00 0.00 C ATOM 1107 ND1 HIS A 520 21.636 -17.140 -3.179 1.00 0.00 N ATOM 1108 CD2 HIS A 520 21.909 -15.315 -4.337 1.00 0.00 C ATOM 1109 CE1 HIS A 520 20.691 -16.259 -2.828 1.00 0.00 C ATOM 1110 NE2 HIS A 520 20.814 -15.135 -3.502 1.00 0.00 N ATOM 0 H HIS A 520 25.596 -18.139 -5.943 1.00 0.00 H new ATOM 0 HA HIS A 520 24.332 -15.573 -5.934 1.00 0.00 H new ATOM 0 HB2 HIS A 520 23.195 -17.781 -5.705 1.00 0.00 H new ATOM 0 HB3 HIS A 520 23.972 -18.014 -4.152 1.00 0.00 H new ATOM 0 HD1 HIS A 520 21.752 -18.079 -2.797 1.00 0.00 H new ATOM 0 HD2 HIS A 520 22.292 -14.581 -5.030 1.00 0.00 H new ATOM 0 HE1 HIS A 520 19.927 -16.446 -2.088 1.00 0.00 H new ATOM 1118 N SER A 521 25.537 -14.301 -4.169 1.00 0.00 N ATOM 1119 CA SER A 521 26.258 -13.486 -3.179 1.00 0.00 C ATOM 1120 C SER A 521 25.440 -12.212 -2.846 1.00 0.00 C ATOM 1121 O SER A 521 25.678 -11.150 -3.436 1.00 0.00 O ATOM 1122 CB SER A 521 27.666 -13.134 -3.730 1.00 0.00 C ATOM 1123 OG SER A 521 28.367 -14.300 -4.140 1.00 0.00 O ATOM 0 H SER A 521 25.145 -13.757 -4.938 1.00 0.00 H new ATOM 0 HA SER A 521 26.384 -14.049 -2.254 1.00 0.00 H new ATOM 0 HB2 SER A 521 27.568 -12.451 -4.574 1.00 0.00 H new ATOM 0 HB3 SER A 521 28.239 -12.613 -2.963 1.00 0.00 H new ATOM 0 HG SER A 521 27.956 -14.660 -4.954 1.00 0.00 H new ATOM 1129 N PRO A 522 24.394 -12.319 -1.953 1.00 0.00 N ATOM 1130 CA PRO A 522 23.612 -11.144 -1.478 1.00 0.00 C ATOM 1131 C PRO A 522 24.501 -10.075 -0.775 1.00 0.00 C ATOM 1132 O PRO A 522 25.564 -10.419 -0.245 1.00 0.00 O ATOM 1133 CB PRO A 522 22.578 -11.769 -0.491 1.00 0.00 C ATOM 1134 CG PRO A 522 22.465 -13.195 -0.928 1.00 0.00 C ATOM 1135 CD PRO A 522 23.856 -13.584 -1.378 1.00 0.00 C ATOM 0 HA PRO A 522 23.146 -10.602 -2.301 1.00 0.00 H new ATOM 0 HB2 PRO A 522 22.919 -11.695 0.542 1.00 0.00 H new ATOM 0 HB3 PRO A 522 21.616 -11.259 -0.546 1.00 0.00 H new ATOM 0 HG2 PRO A 522 22.123 -13.831 -0.111 1.00 0.00 H new ATOM 0 HG3 PRO A 522 21.744 -13.302 -1.739 1.00 0.00 H new ATOM 0 HD2 PRO A 522 24.464 -13.939 -0.546 1.00 0.00 H new ATOM 0 HD3 PRO A 522 23.831 -14.384 -2.118 1.00 0.00 H new ATOM 1143 N PRO A 523 24.104 -8.760 -0.755 1.00 0.00 N ATOM 1144 CA PRO A 523 22.855 -8.236 -1.384 1.00 0.00 C ATOM 1145 C PRO A 523 23.000 -7.902 -2.893 1.00 0.00 C ATOM 1146 O PRO A 523 21.999 -7.799 -3.610 1.00 0.00 O ATOM 1147 CB PRO A 523 22.600 -6.960 -0.551 1.00 0.00 C ATOM 1148 CG PRO A 523 23.974 -6.445 -0.225 1.00 0.00 C ATOM 1149 CD PRO A 523 24.856 -7.673 -0.056 1.00 0.00 C ATOM 0 HA PRO A 523 22.046 -8.966 -1.372 1.00 0.00 H new ATOM 0 HB2 PRO A 523 22.024 -6.226 -1.115 1.00 0.00 H new ATOM 0 HB3 PRO A 523 22.034 -7.183 0.354 1.00 0.00 H new ATOM 0 HG2 PRO A 523 24.349 -5.803 -1.022 1.00 0.00 H new ATOM 0 HG3 PRO A 523 23.960 -5.847 0.686 1.00 0.00 H new ATOM 0 HD2 PRO A 523 25.840 -7.521 -0.499 1.00 0.00 H new ATOM 0 HD3 PRO A 523 25.013 -7.910 0.996 1.00 0.00 H new ATOM 1157 N SER A 524 24.254 -7.765 -3.354 1.00 0.00 N ATOM 1158 CA SER A 524 24.571 -7.235 -4.692 1.00 0.00 C ATOM 1159 C SER A 524 24.205 -8.224 -5.819 1.00 0.00 C ATOM 1160 O SER A 524 23.723 -7.811 -6.870 1.00 0.00 O ATOM 1161 CB SER A 524 26.072 -6.871 -4.754 1.00 0.00 C ATOM 1162 OG SER A 524 26.426 -5.978 -3.704 1.00 0.00 O ATOM 0 H SER A 524 25.078 -8.019 -2.809 1.00 0.00 H new ATOM 0 HA SER A 524 23.966 -6.343 -4.853 1.00 0.00 H new ATOM 0 HB2 SER A 524 26.673 -7.778 -4.682 1.00 0.00 H new ATOM 0 HB3 SER A 524 26.299 -6.413 -5.717 1.00 0.00 H new ATOM 0 HG SER A 524 27.381 -5.764 -3.764 1.00 0.00 H new ATOM 1168 N THR A 525 24.440 -9.529 -5.589 1.00 0.00 N ATOM 1169 CA THR A 525 24.208 -10.579 -6.601 1.00 0.00 C ATOM 1170 C THR A 525 23.202 -11.621 -6.080 1.00 0.00 C ATOM 1171 O THR A 525 23.556 -12.512 -5.306 1.00 0.00 O ATOM 1172 CB THR A 525 25.561 -11.265 -7.012 1.00 0.00 C ATOM 1173 OG1 THR A 525 26.476 -10.264 -7.494 1.00 0.00 O ATOM 1174 CG2 THR A 525 25.376 -12.349 -8.097 1.00 0.00 C ATOM 0 H THR A 525 24.794 -9.885 -4.701 1.00 0.00 H new ATOM 0 HA THR A 525 23.784 -10.110 -7.489 1.00 0.00 H new ATOM 0 HB THR A 525 25.956 -11.758 -6.124 1.00 0.00 H new ATOM 0 HG1 THR A 525 27.321 -10.689 -7.749 1.00 0.00 H new ATOM 0 HG21 THR A 525 26.343 -12.788 -8.341 1.00 0.00 H new ATOM 0 HG22 THR A 525 24.708 -13.126 -7.725 1.00 0.00 H new ATOM 0 HG23 THR A 525 24.946 -11.899 -8.992 1.00 0.00 H new ATOM 1182 N LEU A 526 21.927 -11.466 -6.469 1.00 0.00 N ATOM 1183 CA LEU A 526 20.905 -12.516 -6.294 1.00 0.00 C ATOM 1184 C LEU A 526 20.849 -13.354 -7.571 1.00 0.00 C ATOM 1185 O LEU A 526 21.076 -12.841 -8.656 1.00 0.00 O ATOM 1186 CB LEU A 526 19.508 -11.925 -5.916 1.00 0.00 C ATOM 1187 CG LEU A 526 19.236 -11.783 -4.379 1.00 0.00 C ATOM 1188 CD1 LEU A 526 20.307 -10.915 -3.674 1.00 0.00 C ATOM 1189 CD2 LEU A 526 17.800 -11.267 -4.114 1.00 0.00 C ATOM 0 H LEU A 526 21.575 -10.617 -6.911 1.00 0.00 H new ATOM 0 HA LEU A 526 21.185 -13.153 -5.455 1.00 0.00 H new ATOM 0 HB2 LEU A 526 19.410 -10.943 -6.378 1.00 0.00 H new ATOM 0 HB3 LEU A 526 18.734 -12.559 -6.348 1.00 0.00 H new ATOM 0 HG LEU A 526 19.313 -12.778 -3.940 1.00 0.00 H new ATOM 0 HD11 LEU A 526 20.077 -10.845 -2.611 1.00 0.00 H new ATOM 0 HD12 LEU A 526 21.288 -11.372 -3.803 1.00 0.00 H new ATOM 0 HD13 LEU A 526 20.311 -9.916 -4.111 1.00 0.00 H new ATOM 0 HD21 LEU A 526 17.638 -11.178 -3.040 1.00 0.00 H new ATOM 0 HD22 LEU A 526 17.672 -10.291 -4.583 1.00 0.00 H new ATOM 0 HD23 LEU A 526 17.078 -11.968 -4.533 1.00 0.00 H new ATOM 1201 N VAL A 527 20.596 -14.658 -7.428 1.00 0.00 N ATOM 1202 CA VAL A 527 20.562 -15.601 -8.556 1.00 0.00 C ATOM 1203 C VAL A 527 19.242 -16.378 -8.500 1.00 0.00 C ATOM 1204 O VAL A 527 18.894 -16.944 -7.453 1.00 0.00 O ATOM 1205 CB VAL A 527 21.791 -16.592 -8.524 1.00 0.00 C ATOM 1206 CG1 VAL A 527 21.719 -17.636 -9.669 1.00 0.00 C ATOM 1207 CG2 VAL A 527 23.135 -15.815 -8.571 1.00 0.00 C ATOM 0 H VAL A 527 20.408 -15.093 -6.525 1.00 0.00 H new ATOM 0 HA VAL A 527 20.630 -15.042 -9.489 1.00 0.00 H new ATOM 0 HB VAL A 527 21.742 -17.136 -7.581 1.00 0.00 H new ATOM 0 HG11 VAL A 527 22.582 -18.299 -9.612 1.00 0.00 H new ATOM 0 HG12 VAL A 527 20.805 -18.222 -9.571 1.00 0.00 H new ATOM 0 HG13 VAL A 527 21.719 -17.122 -10.630 1.00 0.00 H new ATOM 0 HG21 VAL A 527 23.965 -16.521 -8.548 1.00 0.00 H new ATOM 0 HG22 VAL A 527 23.184 -15.228 -9.488 1.00 0.00 H new ATOM 0 HG23 VAL A 527 23.201 -15.150 -7.710 1.00 0.00 H new ATOM 1217 N TRP A 528 18.500 -16.369 -9.623 1.00 0.00 N ATOM 1218 CA TRP A 528 17.268 -17.147 -9.778 1.00 0.00 C ATOM 1219 C TRP A 528 17.654 -18.631 -9.933 1.00 0.00 C ATOM 1220 O TRP A 528 18.027 -19.076 -11.024 1.00 0.00 O ATOM 1221 CB TRP A 528 16.434 -16.633 -10.994 1.00 0.00 C ATOM 1222 CG TRP A 528 15.004 -17.158 -11.070 1.00 0.00 C ATOM 1223 CD1 TRP A 528 14.429 -18.157 -10.323 1.00 0.00 C ATOM 1224 CD2 TRP A 528 13.971 -16.694 -11.950 1.00 0.00 C ATOM 1225 NE1 TRP A 528 13.123 -18.331 -10.684 1.00 0.00 N ATOM 1226 CE2 TRP A 528 12.814 -17.448 -11.677 1.00 0.00 C ATOM 1227 CE3 TRP A 528 13.913 -15.715 -12.941 1.00 0.00 C ATOM 1228 CZ2 TRP A 528 11.622 -17.252 -12.355 1.00 0.00 C ATOM 1229 CZ3 TRP A 528 12.726 -15.522 -13.616 1.00 0.00 C ATOM 1230 CH2 TRP A 528 11.595 -16.285 -13.319 1.00 0.00 C ATOM 0 H TRP A 528 18.743 -15.819 -10.447 1.00 0.00 H new ATOM 0 HA TRP A 528 16.635 -17.030 -8.899 1.00 0.00 H new ATOM 0 HB2 TRP A 528 16.403 -15.544 -10.958 1.00 0.00 H new ATOM 0 HB3 TRP A 528 16.954 -16.907 -11.912 1.00 0.00 H new ATOM 0 HD1 TRP A 528 14.938 -18.725 -9.558 1.00 0.00 H new ATOM 0 HE1 TRP A 528 12.482 -19.012 -10.277 1.00 0.00 H new ATOM 0 HE3 TRP A 528 14.782 -15.118 -13.176 1.00 0.00 H new ATOM 0 HZ2 TRP A 528 10.746 -17.842 -12.130 1.00 0.00 H new ATOM 0 HZ3 TRP A 528 12.670 -14.768 -14.387 1.00 0.00 H new ATOM 0 HH2 TRP A 528 10.679 -16.107 -13.863 1.00 0.00 H new ATOM 1241 N LYS A 529 17.592 -19.358 -8.803 1.00 0.00 N ATOM 1242 CA LYS A 529 17.944 -20.787 -8.718 1.00 0.00 C ATOM 1243 C LYS A 529 16.962 -21.638 -9.554 1.00 0.00 C ATOM 1244 O LYS A 529 15.739 -21.468 -9.438 1.00 0.00 O ATOM 1245 CB LYS A 529 17.913 -21.237 -7.228 1.00 0.00 C ATOM 1246 CG LYS A 529 18.501 -22.639 -6.941 1.00 0.00 C ATOM 1247 CD LYS A 529 20.037 -22.700 -7.154 1.00 0.00 C ATOM 1248 CE LYS A 529 20.643 -24.057 -6.743 1.00 0.00 C ATOM 1249 NZ LYS A 529 20.046 -25.194 -7.493 1.00 0.00 N ATOM 0 H LYS A 529 17.292 -18.964 -7.911 1.00 0.00 H new ATOM 0 HA LYS A 529 18.947 -20.932 -9.120 1.00 0.00 H new ATOM 0 HB2 LYS A 529 18.460 -20.505 -6.634 1.00 0.00 H new ATOM 0 HB3 LYS A 529 16.879 -21.219 -6.883 1.00 0.00 H new ATOM 0 HG2 LYS A 529 18.269 -22.922 -5.914 1.00 0.00 H new ATOM 0 HG3 LYS A 529 18.019 -23.370 -7.590 1.00 0.00 H new ATOM 0 HD2 LYS A 529 20.262 -22.510 -8.203 1.00 0.00 H new ATOM 0 HD3 LYS A 529 20.511 -21.906 -6.577 1.00 0.00 H new ATOM 0 HE2 LYS A 529 21.719 -24.038 -6.913 1.00 0.00 H new ATOM 0 HE3 LYS A 529 20.492 -24.211 -5.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 529 20.520 -26.078 -7.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 529 19.032 -25.262 -7.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 529 20.167 -25.038 -8.514 1.00 0.00 H new ATOM 1263 N GLY A 530 17.511 -22.522 -10.405 1.00 0.00 N ATOM 1264 CA GLY A 530 16.716 -23.424 -11.247 1.00 0.00 C ATOM 1265 C GLY A 530 16.475 -22.871 -12.645 1.00 0.00 C ATOM 1266 O GLY A 530 16.642 -23.585 -13.640 1.00 0.00 O ATOM 0 H GLY A 530 18.518 -22.629 -10.526 1.00 0.00 H new ATOM 0 HA2 GLY A 530 17.226 -24.384 -11.325 1.00 0.00 H new ATOM 0 HA3 GLY A 530 15.756 -23.611 -10.765 1.00 0.00 H new ATOM 1270 N GLN A 531 16.093 -21.586 -12.722 1.00 0.00 N ATOM 1271 CA GLN A 531 15.862 -20.894 -14.000 1.00 0.00 C ATOM 1272 C GLN A 531 17.217 -20.564 -14.655 1.00 0.00 C ATOM 1273 O GLN A 531 17.909 -19.616 -14.257 1.00 0.00 O ATOM 1274 CB GLN A 531 15.005 -19.621 -13.773 1.00 0.00 C ATOM 1275 CG GLN A 531 14.734 -18.738 -15.013 1.00 0.00 C ATOM 1276 CD GLN A 531 14.027 -19.459 -16.159 1.00 0.00 C ATOM 1277 OE1 GLN A 531 14.674 -19.984 -17.062 1.00 0.00 O ATOM 1278 NE2 GLN A 531 12.700 -19.505 -16.124 1.00 0.00 N ATOM 0 H GLN A 531 15.936 -20.999 -11.903 1.00 0.00 H new ATOM 0 HA GLN A 531 15.306 -21.542 -14.677 1.00 0.00 H new ATOM 0 HB2 GLN A 531 14.045 -19.926 -13.356 1.00 0.00 H new ATOM 0 HB3 GLN A 531 15.499 -19.008 -13.020 1.00 0.00 H new ATOM 0 HG2 GLN A 531 14.130 -17.883 -14.710 1.00 0.00 H new ATOM 0 HG3 GLN A 531 15.683 -18.344 -15.378 1.00 0.00 H new ATOM 0 HE21 GLN A 531 12.194 -19.058 -15.359 1.00 0.00 H new ATOM 0 HE22 GLN A 531 12.187 -19.987 -16.862 1.00 0.00 H new ATOM 1287 N SER A 532 17.595 -21.393 -15.635 1.00 0.00 N ATOM 1288 CA SER A 532 18.850 -21.257 -16.369 1.00 0.00 C ATOM 1289 C SER A 532 18.770 -20.114 -17.392 1.00 0.00 C ATOM 1290 O SER A 532 19.692 -19.316 -17.496 1.00 0.00 O ATOM 1291 CB SER A 532 19.184 -22.581 -17.091 1.00 0.00 C ATOM 1292 OG SER A 532 19.329 -23.652 -16.174 1.00 0.00 O ATOM 0 H SER A 532 17.029 -22.185 -15.941 1.00 0.00 H new ATOM 0 HA SER A 532 19.639 -21.023 -15.654 1.00 0.00 H new ATOM 0 HB2 SER A 532 18.394 -22.816 -17.805 1.00 0.00 H new ATOM 0 HB3 SER A 532 20.105 -22.463 -17.662 1.00 0.00 H new ATOM 0 HG SER A 532 19.538 -24.475 -16.663 1.00 0.00 H new ATOM 1298 N SER A 533 17.646 -20.034 -18.119 1.00 0.00 N ATOM 1299 CA SER A 533 17.539 -19.210 -19.342 1.00 0.00 C ATOM 1300 C SER A 533 17.174 -17.738 -19.051 1.00 0.00 C ATOM 1301 O SER A 533 17.533 -16.860 -19.829 1.00 0.00 O ATOM 1302 CB SER A 533 16.481 -19.846 -20.283 1.00 0.00 C ATOM 1303 OG SER A 533 16.759 -21.227 -20.514 1.00 0.00 O ATOM 0 H SER A 533 16.789 -20.533 -17.882 1.00 0.00 H new ATOM 0 HA SER A 533 18.520 -19.194 -19.817 1.00 0.00 H new ATOM 0 HB2 SER A 533 15.489 -19.741 -19.843 1.00 0.00 H new ATOM 0 HB3 SER A 533 16.467 -19.311 -21.233 1.00 0.00 H new ATOM 0 HG SER A 533 16.077 -21.603 -21.108 1.00 0.00 H new ATOM 1309 N TRP A 534 16.434 -17.493 -17.946 1.00 0.00 N ATOM 1310 CA TRP A 534 15.891 -16.146 -17.584 1.00 0.00 C ATOM 1311 C TRP A 534 15.094 -15.539 -18.774 1.00 0.00 C ATOM 1312 O TRP A 534 14.986 -14.335 -18.883 1.00 0.00 O ATOM 1313 CB TRP A 534 17.031 -15.162 -17.102 1.00 0.00 C ATOM 1314 CG TRP A 534 16.736 -14.318 -15.849 1.00 0.00 C ATOM 1315 CD1 TRP A 534 17.583 -14.156 -14.789 1.00 0.00 C ATOM 1316 CD2 TRP A 534 15.557 -13.525 -15.514 1.00 0.00 C ATOM 1317 NE1 TRP A 534 17.035 -13.349 -13.838 1.00 0.00 N ATOM 1318 CE2 TRP A 534 15.799 -12.946 -14.250 1.00 0.00 C ATOM 1319 CE3 TRP A 534 14.332 -13.244 -16.139 1.00 0.00 C ATOM 1320 CZ2 TRP A 534 14.873 -12.124 -13.608 1.00 0.00 C ATOM 1321 CZ3 TRP A 534 13.417 -12.427 -15.502 1.00 0.00 C ATOM 1322 CH2 TRP A 534 13.692 -11.874 -14.250 1.00 0.00 C ATOM 0 H TRP A 534 16.191 -18.220 -17.273 1.00 0.00 H new ATOM 0 HA TRP A 534 15.208 -16.281 -16.745 1.00 0.00 H new ATOM 0 HB2 TRP A 534 17.929 -15.750 -16.912 1.00 0.00 H new ATOM 0 HB3 TRP A 534 17.263 -14.483 -17.922 1.00 0.00 H new ATOM 0 HD1 TRP A 534 18.561 -14.609 -14.715 1.00 0.00 H new ATOM 0 HE1 TRP A 534 17.479 -13.088 -12.958 1.00 0.00 H new ATOM 0 HE3 TRP A 534 14.106 -13.662 -17.109 1.00 0.00 H new ATOM 0 HZ2 TRP A 534 15.082 -11.700 -12.637 1.00 0.00 H new ATOM 0 HZ3 TRP A 534 12.473 -12.213 -15.981 1.00 0.00 H new ATOM 0 HH2 TRP A 534 12.958 -11.237 -13.780 1.00 0.00 H new ATOM 1333 N GLY A 535 14.530 -16.396 -19.643 1.00 0.00 N ATOM 1334 CA GLY A 535 13.841 -15.943 -20.852 1.00 0.00 C ATOM 1335 C GLY A 535 14.764 -15.214 -21.831 1.00 0.00 C ATOM 1336 O GLY A 535 14.542 -14.035 -22.145 1.00 0.00 O ATOM 0 H GLY A 535 14.541 -17.409 -19.525 1.00 0.00 H new ATOM 0 HA2 GLY A 535 13.396 -16.803 -21.353 1.00 0.00 H new ATOM 0 HA3 GLY A 535 13.023 -15.280 -20.570 1.00 0.00 H new ATOM 1340 N THR A 536 15.822 -15.916 -22.275 1.00 0.00 N ATOM 1341 CA THR A 536 16.748 -15.414 -23.301 1.00 0.00 C ATOM 1342 C THR A 536 16.017 -15.234 -24.648 1.00 0.00 C ATOM 1343 O THR A 536 15.448 -16.194 -25.189 1.00 0.00 O ATOM 1344 CB THR A 536 17.987 -16.369 -23.481 1.00 0.00 C ATOM 1345 OG1 THR A 536 17.569 -17.744 -23.387 1.00 0.00 O ATOM 1346 CG2 THR A 536 19.111 -16.096 -22.457 1.00 0.00 C ATOM 0 H THR A 536 16.057 -16.847 -21.931 1.00 0.00 H new ATOM 0 HA THR A 536 17.117 -14.445 -22.964 1.00 0.00 H new ATOM 0 HB THR A 536 18.397 -16.168 -24.470 1.00 0.00 H new ATOM 0 HG1 THR A 536 18.346 -18.331 -23.502 1.00 0.00 H new ATOM 0 HG21 THR A 536 19.937 -16.785 -22.631 1.00 0.00 H new ATOM 0 HG22 THR A 536 19.464 -15.071 -22.569 1.00 0.00 H new ATOM 0 HG23 THR A 536 18.726 -16.239 -21.447 1.00 0.00 H new ATOM 1354 N GLY A 537 16.043 -13.998 -25.164 1.00 0.00 N ATOM 1355 CA GLY A 537 15.393 -13.656 -26.419 1.00 0.00 C ATOM 1356 C GLY A 537 16.043 -12.456 -27.078 1.00 0.00 C ATOM 1357 O GLY A 537 16.663 -11.632 -26.401 1.00 0.00 O ATOM 0 H GLY A 537 16.517 -13.213 -24.717 1.00 0.00 H new ATOM 0 HA2 GLY A 537 15.435 -14.510 -27.095 1.00 0.00 H new ATOM 0 HA3 GLY A 537 14.339 -13.445 -26.237 1.00 0.00 H new ATOM 1361 N GLU A 538 15.905 -12.357 -28.414 1.00 0.00 N ATOM 1362 CA GLU A 538 16.422 -11.209 -29.186 1.00 0.00 C ATOM 1363 C GLU A 538 15.469 -9.992 -29.054 1.00 0.00 C ATOM 1364 O GLU A 538 15.795 -8.879 -29.474 1.00 0.00 O ATOM 1365 CB GLU A 538 16.618 -11.604 -30.675 1.00 0.00 C ATOM 1366 CG GLU A 538 17.404 -10.570 -31.518 1.00 0.00 C ATOM 1367 CD GLU A 538 17.677 -11.029 -32.959 1.00 0.00 C ATOM 1368 OE1 GLU A 538 16.831 -10.788 -33.846 1.00 0.00 O ATOM 1369 OE2 GLU A 538 18.735 -11.645 -33.211 1.00 0.00 O ATOM 0 H GLU A 538 15.437 -13.062 -28.984 1.00 0.00 H new ATOM 0 HA GLU A 538 17.392 -10.923 -28.780 1.00 0.00 H new ATOM 0 HB2 GLU A 538 17.140 -12.560 -30.718 1.00 0.00 H new ATOM 0 HB3 GLU A 538 15.639 -11.754 -31.129 1.00 0.00 H new ATOM 0 HG2 GLU A 538 16.845 -9.635 -31.544 1.00 0.00 H new ATOM 0 HG3 GLU A 538 18.354 -10.360 -31.027 1.00 0.00 H new ATOM 1376 N SER A 539 14.274 -10.232 -28.491 1.00 0.00 N ATOM 1377 CA SER A 539 13.294 -9.188 -28.155 1.00 0.00 C ATOM 1378 C SER A 539 12.449 -9.669 -26.962 1.00 0.00 C ATOM 1379 O SER A 539 11.967 -10.810 -26.956 1.00 0.00 O ATOM 1380 CB SER A 539 12.370 -8.862 -29.363 1.00 0.00 C ATOM 1381 OG SER A 539 13.118 -8.516 -30.522 1.00 0.00 O ATOM 0 H SER A 539 13.957 -11.172 -28.253 1.00 0.00 H new ATOM 0 HA SER A 539 13.830 -8.275 -27.897 1.00 0.00 H new ATOM 0 HB2 SER A 539 11.739 -9.724 -29.581 1.00 0.00 H new ATOM 0 HB3 SER A 539 11.705 -8.039 -29.100 1.00 0.00 H new ATOM 0 HG SER A 539 12.505 -8.319 -31.261 1.00 0.00 H new ATOM 1387 N PHE A 540 12.318 -8.808 -25.946 1.00 0.00 N ATOM 1388 CA PHE A 540 11.433 -9.023 -24.793 1.00 0.00 C ATOM 1389 C PHE A 540 11.163 -7.695 -24.075 1.00 0.00 C ATOM 1390 O PHE A 540 11.767 -6.670 -24.398 1.00 0.00 O ATOM 1391 CB PHE A 540 12.005 -10.103 -23.807 1.00 0.00 C ATOM 1392 CG PHE A 540 13.464 -9.937 -23.363 1.00 0.00 C ATOM 1393 CD1 PHE A 540 13.856 -8.918 -22.490 1.00 0.00 C ATOM 1394 CD2 PHE A 540 14.446 -10.832 -23.800 1.00 0.00 C ATOM 1395 CE1 PHE A 540 15.171 -8.800 -22.077 1.00 0.00 C ATOM 1396 CE2 PHE A 540 15.759 -10.710 -23.388 1.00 0.00 C ATOM 1397 CZ PHE A 540 16.122 -9.695 -22.526 1.00 0.00 C ATOM 0 H PHE A 540 12.832 -7.928 -25.900 1.00 0.00 H new ATOM 0 HA PHE A 540 10.486 -9.412 -25.166 1.00 0.00 H new ATOM 0 HB2 PHE A 540 11.378 -10.113 -22.915 1.00 0.00 H new ATOM 0 HB3 PHE A 540 11.904 -11.080 -24.279 1.00 0.00 H new ATOM 0 HD1 PHE A 540 13.121 -8.212 -22.132 1.00 0.00 H new ATOM 0 HD2 PHE A 540 14.173 -11.633 -24.471 1.00 0.00 H new ATOM 0 HE1 PHE A 540 15.455 -8.006 -21.402 1.00 0.00 H new ATOM 0 HE2 PHE A 540 16.502 -11.410 -23.741 1.00 0.00 H new ATOM 0 HZ PHE A 540 17.148 -9.601 -22.203 1.00 0.00 H new ATOM 1407 N ARG A 541 10.235 -7.726 -23.110 1.00 0.00 N ATOM 1408 CA ARG A 541 9.967 -6.602 -22.200 1.00 0.00 C ATOM 1409 C ARG A 541 9.984 -7.126 -20.753 1.00 0.00 C ATOM 1410 O ARG A 541 9.111 -7.899 -20.338 1.00 0.00 O ATOM 1411 CB ARG A 541 8.621 -5.887 -22.553 1.00 0.00 C ATOM 1412 CG ARG A 541 7.392 -6.814 -22.634 1.00 0.00 C ATOM 1413 CD ARG A 541 6.065 -6.072 -22.852 1.00 0.00 C ATOM 1414 NE ARG A 541 6.013 -5.372 -24.152 1.00 0.00 N ATOM 1415 CZ ARG A 541 5.082 -5.573 -25.105 1.00 0.00 C ATOM 1416 NH1 ARG A 541 4.192 -6.556 -24.999 1.00 0.00 N ATOM 1417 NH2 ARG A 541 5.073 -4.810 -26.182 1.00 0.00 N ATOM 0 H ARG A 541 9.643 -8.538 -22.936 1.00 0.00 H new ATOM 0 HA ARG A 541 10.745 -5.847 -22.312 1.00 0.00 H new ATOM 0 HB2 ARG A 541 8.428 -5.118 -21.805 1.00 0.00 H new ATOM 0 HB3 ARG A 541 8.737 -5.378 -23.510 1.00 0.00 H new ATOM 0 HG2 ARG A 541 7.538 -7.524 -23.448 1.00 0.00 H new ATOM 0 HG3 ARG A 541 7.326 -7.394 -21.714 1.00 0.00 H new ATOM 0 HD2 ARG A 541 5.241 -6.783 -22.793 1.00 0.00 H new ATOM 0 HD3 ARG A 541 5.920 -5.350 -22.048 1.00 0.00 H new ATOM 0 HE ARG A 541 6.739 -4.682 -24.343 1.00 0.00 H new ATOM 0 HH11 ARG A 541 4.207 -7.172 -24.186 1.00 0.00 H new ATOM 0 HH12 ARG A 541 3.494 -6.693 -25.730 1.00 0.00 H new ATOM 0 HH21 ARG A 541 5.769 -4.072 -26.290 1.00 0.00 H new ATOM 0 HH22 ARG A 541 4.370 -4.958 -26.906 1.00 0.00 H new ATOM 1431 N THR A 542 11.024 -6.744 -20.008 1.00 0.00 N ATOM 1432 CA THR A 542 11.197 -7.147 -18.614 1.00 0.00 C ATOM 1433 C THR A 542 10.457 -6.139 -17.717 1.00 0.00 C ATOM 1434 O THR A 542 10.725 -4.934 -17.780 1.00 0.00 O ATOM 1435 CB THR A 542 12.707 -7.207 -18.252 1.00 0.00 C ATOM 1436 OG1 THR A 542 13.420 -7.976 -19.236 1.00 0.00 O ATOM 1437 CG2 THR A 542 12.964 -7.804 -16.860 1.00 0.00 C ATOM 0 H THR A 542 11.771 -6.144 -20.358 1.00 0.00 H new ATOM 0 HA THR A 542 10.781 -8.143 -18.460 1.00 0.00 H new ATOM 0 HB THR A 542 13.066 -6.178 -18.239 1.00 0.00 H new ATOM 0 HG1 THR A 542 13.864 -7.370 -19.866 1.00 0.00 H new ATOM 0 HG21 THR A 542 14.036 -7.820 -16.663 1.00 0.00 H new ATOM 0 HG22 THR A 542 12.466 -7.195 -16.105 1.00 0.00 H new ATOM 0 HG23 THR A 542 12.573 -8.821 -16.822 1.00 0.00 H new ATOM 1445 N VAL A 543 9.519 -6.647 -16.916 1.00 0.00 N ATOM 1446 CA VAL A 543 8.574 -5.835 -16.132 1.00 0.00 C ATOM 1447 C VAL A 543 8.927 -5.912 -14.633 1.00 0.00 C ATOM 1448 O VAL A 543 9.371 -6.950 -14.156 1.00 0.00 O ATOM 1449 CB VAL A 543 7.099 -6.356 -16.362 1.00 0.00 C ATOM 1450 CG1 VAL A 543 6.057 -5.464 -15.650 1.00 0.00 C ATOM 1451 CG2 VAL A 543 6.780 -6.498 -17.875 1.00 0.00 C ATOM 0 H VAL A 543 9.389 -7.651 -16.789 1.00 0.00 H new ATOM 0 HA VAL A 543 8.643 -4.798 -16.460 1.00 0.00 H new ATOM 0 HB VAL A 543 7.034 -7.348 -15.914 1.00 0.00 H new ATOM 0 HG11 VAL A 543 5.057 -5.856 -15.833 1.00 0.00 H new ATOM 0 HG12 VAL A 543 6.254 -5.459 -14.578 1.00 0.00 H new ATOM 0 HG13 VAL A 543 6.124 -4.447 -16.036 1.00 0.00 H new ATOM 0 HG21 VAL A 543 5.759 -6.858 -17.999 1.00 0.00 H new ATOM 0 HG22 VAL A 543 6.885 -5.528 -18.361 1.00 0.00 H new ATOM 0 HG23 VAL A 543 7.472 -7.208 -18.328 1.00 0.00 H new ATOM 1461 N LEU A 544 8.747 -4.799 -13.915 1.00 0.00 N ATOM 1462 CA LEU A 544 8.805 -4.749 -12.447 1.00 0.00 C ATOM 1463 C LEU A 544 7.382 -4.541 -11.909 1.00 0.00 C ATOM 1464 O LEU A 544 6.697 -3.579 -12.282 1.00 0.00 O ATOM 1465 CB LEU A 544 9.729 -3.606 -11.967 1.00 0.00 C ATOM 1466 CG LEU A 544 9.859 -3.428 -10.417 1.00 0.00 C ATOM 1467 CD1 LEU A 544 10.483 -4.675 -9.745 1.00 0.00 C ATOM 1468 CD2 LEU A 544 10.626 -2.131 -10.091 1.00 0.00 C ATOM 0 H LEU A 544 8.554 -3.893 -14.342 1.00 0.00 H new ATOM 0 HA LEU A 544 9.216 -5.686 -12.071 1.00 0.00 H new ATOM 0 HB2 LEU A 544 10.725 -3.775 -12.377 1.00 0.00 H new ATOM 0 HB3 LEU A 544 9.364 -2.670 -12.390 1.00 0.00 H new ATOM 0 HG LEU A 544 8.858 -3.333 -9.995 1.00 0.00 H new ATOM 0 HD11 LEU A 544 10.556 -4.511 -8.670 1.00 0.00 H new ATOM 0 HD12 LEU A 544 9.855 -5.545 -9.938 1.00 0.00 H new ATOM 0 HD13 LEU A 544 11.478 -4.849 -10.154 1.00 0.00 H new ATOM 0 HD21 LEU A 544 10.709 -2.019 -9.010 1.00 0.00 H new ATOM 0 HD22 LEU A 544 11.623 -2.178 -10.529 1.00 0.00 H new ATOM 0 HD23 LEU A 544 10.089 -1.277 -10.504 1.00 0.00 H new ATOM 1480 N VAL A 545 6.948 -5.467 -11.053 1.00 0.00 N ATOM 1481 CA VAL A 545 5.653 -5.416 -10.362 1.00 0.00 C ATOM 1482 C VAL A 545 5.906 -5.303 -8.854 1.00 0.00 C ATOM 1483 O VAL A 545 6.870 -5.878 -8.338 1.00 0.00 O ATOM 1484 CB VAL A 545 4.796 -6.701 -10.668 1.00 0.00 C ATOM 1485 CG1 VAL A 545 3.428 -6.679 -9.933 1.00 0.00 C ATOM 1486 CG2 VAL A 545 4.613 -6.890 -12.190 1.00 0.00 C ATOM 0 H VAL A 545 7.497 -6.293 -10.814 1.00 0.00 H new ATOM 0 HA VAL A 545 5.093 -4.551 -10.717 1.00 0.00 H new ATOM 0 HB VAL A 545 5.347 -7.559 -10.283 1.00 0.00 H new ATOM 0 HG11 VAL A 545 2.871 -7.585 -10.174 1.00 0.00 H new ATOM 0 HG12 VAL A 545 3.594 -6.630 -8.857 1.00 0.00 H new ATOM 0 HG13 VAL A 545 2.857 -5.807 -10.252 1.00 0.00 H new ATOM 0 HG21 VAL A 545 4.018 -7.784 -12.377 1.00 0.00 H new ATOM 0 HG22 VAL A 545 4.103 -6.021 -12.606 1.00 0.00 H new ATOM 0 HG23 VAL A 545 5.589 -6.999 -12.663 1.00 0.00 H new ATOM 1496 N ASN A 546 5.037 -4.559 -8.168 1.00 0.00 N ATOM 1497 CA ASN A 546 5.082 -4.385 -6.706 1.00 0.00 C ATOM 1498 C ASN A 546 4.018 -5.254 -6.000 1.00 0.00 C ATOM 1499 O ASN A 546 3.319 -6.049 -6.638 1.00 0.00 O ATOM 1500 CB ASN A 546 4.913 -2.880 -6.346 1.00 0.00 C ATOM 1501 CG ASN A 546 3.741 -2.215 -7.046 1.00 0.00 C ATOM 1502 OD1 ASN A 546 2.541 -2.559 -6.644 1.00 0.00 O flip ATOM 1503 ND2 ASN A 546 3.917 -1.443 -7.981 1.00 0.00 N flip ATOM 0 H ASN A 546 4.271 -4.052 -8.612 1.00 0.00 H new ATOM 0 HA ASN A 546 6.055 -4.721 -6.348 1.00 0.00 H new ATOM 0 HB2 ASN A 546 4.783 -2.785 -5.268 1.00 0.00 H new ATOM 0 HB3 ASN A 546 5.829 -2.348 -6.604 1.00 0.00 H new ATOM 0 HD21 ASN A 546 4.864 -1.197 -8.268 1.00 0.00 H new ATOM 0 HD22 ASN A 546 3.116 -1.047 -8.473 1.00 0.00 H new ATOM 1510 N ALA A 547 3.891 -5.042 -4.674 1.00 0.00 N ATOM 1511 CA ALA A 547 3.010 -5.821 -3.773 1.00 0.00 C ATOM 1512 C ALA A 547 1.514 -5.756 -4.157 1.00 0.00 C ATOM 1513 O ALA A 547 0.787 -6.746 -4.007 1.00 0.00 O ATOM 1514 CB ALA A 547 3.199 -5.313 -2.343 1.00 0.00 C ATOM 0 H ALA A 547 4.408 -4.310 -4.187 1.00 0.00 H new ATOM 0 HA ALA A 547 3.300 -6.868 -3.864 1.00 0.00 H new ATOM 0 HB1 ALA A 547 2.556 -5.878 -1.668 1.00 0.00 H new ATOM 0 HB2 ALA A 547 4.240 -5.442 -2.046 1.00 0.00 H new ATOM 0 HB3 ALA A 547 2.936 -4.256 -2.295 1.00 0.00 H new ATOM 1520 N ASP A 548 1.069 -4.566 -4.609 1.00 0.00 N ATOM 1521 CA ASP A 548 -0.323 -4.324 -5.072 1.00 0.00 C ATOM 1522 C ASP A 548 -0.733 -5.298 -6.198 1.00 0.00 C ATOM 1523 O ASP A 548 -1.868 -5.797 -6.226 1.00 0.00 O ATOM 1524 CB ASP A 548 -0.457 -2.857 -5.568 1.00 0.00 C ATOM 1525 CG ASP A 548 -1.814 -2.528 -6.237 1.00 0.00 C ATOM 1526 OD1 ASP A 548 -1.935 -2.692 -7.472 1.00 0.00 O ATOM 1527 OD2 ASP A 548 -2.750 -2.090 -5.539 1.00 0.00 O ATOM 0 H ASP A 548 1.663 -3.739 -4.665 1.00 0.00 H new ATOM 0 HA ASP A 548 -0.992 -4.496 -4.229 1.00 0.00 H new ATOM 0 HB2 ASP A 548 -0.311 -2.186 -4.722 1.00 0.00 H new ATOM 0 HB3 ASP A 548 0.344 -2.652 -6.279 1.00 0.00 H new ATOM 1532 N GLY A 549 0.214 -5.566 -7.111 1.00 0.00 N ATOM 1533 CA GLY A 549 -0.039 -6.382 -8.298 1.00 0.00 C ATOM 1534 C GLY A 549 0.009 -5.569 -9.587 1.00 0.00 C ATOM 1535 O GLY A 549 -0.040 -6.140 -10.676 1.00 0.00 O ATOM 0 H GLY A 549 1.172 -5.222 -7.043 1.00 0.00 H new ATOM 0 HA2 GLY A 549 0.700 -7.182 -8.349 1.00 0.00 H new ATOM 0 HA3 GLY A 549 -1.016 -6.856 -8.207 1.00 0.00 H new ATOM 1539 N GLU A 550 0.109 -4.228 -9.466 1.00 0.00 N ATOM 1540 CA GLU A 550 0.275 -3.328 -10.630 1.00 0.00 C ATOM 1541 C GLU A 550 1.704 -3.442 -11.194 1.00 0.00 C ATOM 1542 O GLU A 550 2.681 -3.569 -10.435 1.00 0.00 O ATOM 1543 CB GLU A 550 -0.032 -1.844 -10.257 1.00 0.00 C ATOM 1544 CG GLU A 550 0.888 -1.264 -9.172 1.00 0.00 C ATOM 1545 CD GLU A 550 0.769 0.247 -8.960 1.00 0.00 C ATOM 1546 OE1 GLU A 550 1.453 1.014 -9.679 1.00 0.00 O ATOM 1547 OE2 GLU A 550 0.004 0.681 -8.069 1.00 0.00 O ATOM 0 H GLU A 550 0.078 -3.742 -8.570 1.00 0.00 H new ATOM 0 HA GLU A 550 -0.440 -3.639 -11.392 1.00 0.00 H new ATOM 0 HB2 GLU A 550 0.052 -1.231 -11.154 1.00 0.00 H new ATOM 0 HB3 GLU A 550 -1.065 -1.773 -9.917 1.00 0.00 H new ATOM 0 HG2 GLU A 550 0.673 -1.766 -8.229 1.00 0.00 H new ATOM 0 HG3 GLU A 550 1.921 -1.499 -9.429 1.00 0.00 H new ATOM 1554 N GLU A 551 1.804 -3.403 -12.529 1.00 0.00 N ATOM 1555 CA GLU A 551 3.081 -3.407 -13.251 1.00 0.00 C ATOM 1556 C GLU A 551 3.609 -1.962 -13.323 1.00 0.00 C ATOM 1557 O GLU A 551 3.381 -1.251 -14.315 1.00 0.00 O ATOM 1558 CB GLU A 551 2.882 -4.017 -14.667 1.00 0.00 C ATOM 1559 CG GLU A 551 2.219 -5.412 -14.678 1.00 0.00 C ATOM 1560 CD GLU A 551 2.185 -6.055 -16.074 1.00 0.00 C ATOM 1561 OE1 GLU A 551 1.476 -5.534 -16.959 1.00 0.00 O ATOM 1562 OE2 GLU A 551 2.879 -7.074 -16.295 1.00 0.00 O ATOM 0 H GLU A 551 0.991 -3.367 -13.144 1.00 0.00 H new ATOM 0 HA GLU A 551 3.815 -4.021 -12.730 1.00 0.00 H new ATOM 0 HB2 GLU A 551 2.273 -3.335 -15.260 1.00 0.00 H new ATOM 0 HB3 GLU A 551 3.853 -4.086 -15.158 1.00 0.00 H new ATOM 0 HG2 GLU A 551 2.758 -6.069 -13.995 1.00 0.00 H new ATOM 0 HG3 GLU A 551 1.200 -5.326 -14.300 1.00 0.00 H new ATOM 1569 N VAL A 552 4.268 -1.533 -12.226 1.00 0.00 N ATOM 1570 CA VAL A 552 4.686 -0.135 -12.015 1.00 0.00 C ATOM 1571 C VAL A 552 5.730 0.326 -13.053 1.00 0.00 C ATOM 1572 O VAL A 552 5.660 1.455 -13.559 1.00 0.00 O ATOM 1573 CB VAL A 552 5.227 0.087 -10.547 1.00 0.00 C ATOM 1574 CG1 VAL A 552 6.420 -0.853 -10.201 1.00 0.00 C ATOM 1575 CG2 VAL A 552 5.592 1.576 -10.298 1.00 0.00 C ATOM 0 H VAL A 552 4.526 -2.153 -11.458 1.00 0.00 H new ATOM 0 HA VAL A 552 3.797 0.480 -12.152 1.00 0.00 H new ATOM 0 HB VAL A 552 4.414 -0.178 -9.872 1.00 0.00 H new ATOM 0 HG11 VAL A 552 6.753 -0.659 -9.181 1.00 0.00 H new ATOM 0 HG12 VAL A 552 6.101 -1.892 -10.287 1.00 0.00 H new ATOM 0 HG13 VAL A 552 7.242 -0.667 -10.892 1.00 0.00 H new ATOM 0 HG21 VAL A 552 5.961 1.695 -9.279 1.00 0.00 H new ATOM 0 HG22 VAL A 552 6.365 1.884 -11.002 1.00 0.00 H new ATOM 0 HG23 VAL A 552 4.706 2.196 -10.438 1.00 0.00 H new ATOM 1585 N ALA A 553 6.670 -0.566 -13.386 1.00 0.00 N ATOM 1586 CA ALA A 553 7.785 -0.263 -14.294 1.00 0.00 C ATOM 1587 C ALA A 553 7.912 -1.362 -15.354 1.00 0.00 C ATOM 1588 O ALA A 553 7.483 -2.497 -15.133 1.00 0.00 O ATOM 1589 CB ALA A 553 9.095 -0.104 -13.490 1.00 0.00 C ATOM 0 H ALA A 553 6.680 -1.523 -13.032 1.00 0.00 H new ATOM 0 HA ALA A 553 7.588 0.679 -14.806 1.00 0.00 H new ATOM 0 HB1 ALA A 553 9.915 0.120 -14.172 1.00 0.00 H new ATOM 0 HB2 ALA A 553 8.986 0.710 -12.774 1.00 0.00 H new ATOM 0 HB3 ALA A 553 9.309 -1.030 -12.957 1.00 0.00 H new ATOM 1595 N MET A 554 8.487 -0.996 -16.507 1.00 0.00 N ATOM 1596 CA MET A 554 8.752 -1.923 -17.618 1.00 0.00 C ATOM 1597 C MET A 554 9.803 -1.314 -18.554 1.00 0.00 C ATOM 1598 O MET A 554 9.735 -0.126 -18.892 1.00 0.00 O ATOM 1599 CB MET A 554 7.448 -2.253 -18.409 1.00 0.00 C ATOM 1600 CG MET A 554 7.642 -3.198 -19.614 1.00 0.00 C ATOM 1601 SD MET A 554 6.096 -3.628 -20.452 1.00 0.00 S ATOM 1602 CE MET A 554 5.527 -2.038 -21.061 1.00 0.00 C ATOM 0 H MET A 554 8.785 -0.039 -16.698 1.00 0.00 H new ATOM 0 HA MET A 554 9.130 -2.857 -17.203 1.00 0.00 H new ATOM 0 HB2 MET A 554 6.729 -2.703 -17.725 1.00 0.00 H new ATOM 0 HB3 MET A 554 7.009 -1.320 -18.764 1.00 0.00 H new ATOM 0 HG2 MET A 554 8.315 -2.727 -20.330 1.00 0.00 H new ATOM 0 HG3 MET A 554 8.128 -4.112 -19.274 1.00 0.00 H new ATOM 0 HE1 MET A 554 4.711 -2.190 -21.767 1.00 0.00 H new ATOM 0 HE2 MET A 554 5.176 -1.433 -20.225 1.00 0.00 H new ATOM 0 HE3 MET A 554 6.348 -1.525 -21.561 1.00 0.00 H new ATOM 1612 N ARG A 555 10.768 -2.145 -18.963 1.00 0.00 N ATOM 1613 CA ARG A 555 11.789 -1.792 -19.951 1.00 0.00 C ATOM 1614 C ARG A 555 11.820 -2.867 -21.050 1.00 0.00 C ATOM 1615 O ARG A 555 12.150 -4.035 -20.784 1.00 0.00 O ATOM 1616 CB ARG A 555 13.174 -1.649 -19.268 1.00 0.00 C ATOM 1617 CG ARG A 555 14.342 -1.376 -20.247 1.00 0.00 C ATOM 1618 CD ARG A 555 15.700 -1.265 -19.537 1.00 0.00 C ATOM 1619 NE ARG A 555 16.823 -1.176 -20.480 1.00 0.00 N ATOM 1620 CZ ARG A 555 18.074 -0.824 -20.159 1.00 0.00 C ATOM 1621 NH1 ARG A 555 18.389 -0.436 -18.925 1.00 0.00 N ATOM 1622 NH2 ARG A 555 19.006 -0.835 -21.089 1.00 0.00 N ATOM 0 H ARG A 555 10.861 -3.097 -18.610 1.00 0.00 H new ATOM 0 HA ARG A 555 11.545 -0.832 -20.405 1.00 0.00 H new ATOM 0 HB2 ARG A 555 13.126 -0.837 -18.542 1.00 0.00 H new ATOM 0 HB3 ARG A 555 13.388 -2.562 -18.711 1.00 0.00 H new ATOM 0 HG2 ARG A 555 14.387 -2.178 -20.984 1.00 0.00 H new ATOM 0 HG3 ARG A 555 14.145 -0.453 -20.792 1.00 0.00 H new ATOM 0 HD2 ARG A 555 15.699 -0.385 -18.894 1.00 0.00 H new ATOM 0 HD3 ARG A 555 15.840 -2.132 -18.891 1.00 0.00 H new ATOM 0 HE ARG A 555 16.634 -1.400 -21.457 1.00 0.00 H new ATOM 0 HH11 ARG A 555 17.670 -0.403 -18.202 1.00 0.00 H new ATOM 0 HH12 ARG A 555 19.349 -0.172 -18.703 1.00 0.00 H new ATOM 0 HH21 ARG A 555 18.771 -1.110 -22.043 1.00 0.00 H new ATOM 0 HH22 ARG A 555 19.963 -0.569 -20.856 1.00 0.00 H new ATOM 1636 N THR A 556 11.441 -2.466 -22.272 1.00 0.00 N ATOM 1637 CA THR A 556 11.476 -3.336 -23.447 1.00 0.00 C ATOM 1638 C THR A 556 12.908 -3.377 -24.010 1.00 0.00 C ATOM 1639 O THR A 556 13.432 -2.355 -24.463 1.00 0.00 O ATOM 1640 CB THR A 556 10.465 -2.858 -24.543 1.00 0.00 C ATOM 1641 OG1 THR A 556 9.155 -2.707 -23.960 1.00 0.00 O ATOM 1642 CG2 THR A 556 10.390 -3.860 -25.718 1.00 0.00 C ATOM 0 H THR A 556 11.101 -1.525 -22.469 1.00 0.00 H new ATOM 0 HA THR A 556 11.176 -4.340 -23.146 1.00 0.00 H new ATOM 0 HB THR A 556 10.816 -1.902 -24.931 1.00 0.00 H new ATOM 0 HG1 THR A 556 8.524 -2.406 -24.647 1.00 0.00 H new ATOM 0 HG21 THR A 556 9.679 -3.497 -26.461 1.00 0.00 H new ATOM 0 HG22 THR A 556 11.374 -3.958 -26.176 1.00 0.00 H new ATOM 0 HG23 THR A 556 10.063 -4.832 -25.347 1.00 0.00 H new ATOM 1650 N VAL A 557 13.543 -4.558 -23.927 1.00 0.00 N ATOM 1651 CA VAL A 557 14.924 -4.781 -24.372 1.00 0.00 C ATOM 1652 C VAL A 557 14.944 -5.751 -25.557 1.00 0.00 C ATOM 1653 O VAL A 557 14.591 -6.929 -25.421 1.00 0.00 O ATOM 1654 CB VAL A 557 15.823 -5.347 -23.208 1.00 0.00 C ATOM 1655 CG1 VAL A 557 17.289 -5.611 -23.674 1.00 0.00 C ATOM 1656 CG2 VAL A 557 15.786 -4.401 -21.988 1.00 0.00 C ATOM 0 H VAL A 557 13.103 -5.395 -23.543 1.00 0.00 H new ATOM 0 HA VAL A 557 15.333 -3.818 -24.679 1.00 0.00 H new ATOM 0 HB VAL A 557 15.409 -6.311 -22.911 1.00 0.00 H new ATOM 0 HG11 VAL A 557 17.872 -6.000 -22.839 1.00 0.00 H new ATOM 0 HG12 VAL A 557 17.287 -6.338 -24.486 1.00 0.00 H new ATOM 0 HG13 VAL A 557 17.733 -4.679 -24.023 1.00 0.00 H new ATOM 0 HG21 VAL A 557 16.412 -4.807 -21.194 1.00 0.00 H new ATOM 0 HG22 VAL A 557 16.159 -3.419 -22.278 1.00 0.00 H new ATOM 0 HG23 VAL A 557 14.761 -4.309 -21.630 1.00 0.00 H new ATOM 1666 N LYS A 558 15.318 -5.225 -26.725 1.00 0.00 N ATOM 1667 CA LYS A 558 15.686 -6.031 -27.887 1.00 0.00 C ATOM 1668 C LYS A 558 17.221 -6.093 -27.917 1.00 0.00 C ATOM 1669 O LYS A 558 17.877 -5.072 -27.666 1.00 0.00 O ATOM 1670 CB LYS A 558 15.139 -5.436 -29.223 1.00 0.00 C ATOM 1671 CG LYS A 558 13.596 -5.236 -29.295 1.00 0.00 C ATOM 1672 CD LYS A 558 13.105 -3.903 -28.675 1.00 0.00 C ATOM 1673 CE LYS A 558 13.676 -2.671 -29.406 1.00 0.00 C ATOM 1674 NZ LYS A 558 13.128 -1.399 -28.885 1.00 0.00 N ATOM 0 H LYS A 558 15.374 -4.220 -26.891 1.00 0.00 H new ATOM 0 HA LYS A 558 15.245 -7.024 -27.798 1.00 0.00 H new ATOM 0 HB2 LYS A 558 15.619 -4.473 -29.393 1.00 0.00 H new ATOM 0 HB3 LYS A 558 15.440 -6.091 -30.041 1.00 0.00 H new ATOM 0 HG2 LYS A 558 13.283 -5.277 -30.338 1.00 0.00 H new ATOM 0 HG3 LYS A 558 13.108 -6.065 -28.783 1.00 0.00 H new ATOM 0 HD2 LYS A 558 12.016 -3.869 -28.708 1.00 0.00 H new ATOM 0 HD3 LYS A 558 13.394 -3.865 -27.625 1.00 0.00 H new ATOM 0 HE2 LYS A 558 14.761 -2.664 -29.306 1.00 0.00 H new ATOM 0 HE3 LYS A 558 13.455 -2.749 -30.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 558 13.543 -0.602 -29.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 558 12.095 -1.391 -29.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 558 13.361 -1.308 -27.875 1.00 0.00 H new ATOM 1688 N LYS A 559 17.778 -7.281 -28.202 1.00 0.00 N ATOM 1689 CA LYS A 559 19.231 -7.512 -28.254 1.00 0.00 C ATOM 1690 C LYS A 559 19.899 -6.554 -29.265 1.00 0.00 C ATOM 1691 O LYS A 559 19.851 -6.777 -30.479 1.00 0.00 O ATOM 1692 CB LYS A 559 19.529 -8.998 -28.616 1.00 0.00 C ATOM 1693 CG LYS A 559 21.031 -9.362 -28.586 1.00 0.00 C ATOM 1694 CD LYS A 559 21.327 -10.796 -29.068 1.00 0.00 C ATOM 1695 CE LYS A 559 22.834 -11.109 -29.096 1.00 0.00 C ATOM 1696 NZ LYS A 559 23.118 -12.387 -29.788 1.00 0.00 N ATOM 0 H LYS A 559 17.228 -8.116 -28.405 1.00 0.00 H new ATOM 0 HA LYS A 559 19.651 -7.308 -27.269 1.00 0.00 H new ATOM 0 HB2 LYS A 559 18.995 -9.645 -27.920 1.00 0.00 H new ATOM 0 HB3 LYS A 559 19.135 -9.205 -29.611 1.00 0.00 H new ATOM 0 HG2 LYS A 559 21.580 -8.657 -29.210 1.00 0.00 H new ATOM 0 HG3 LYS A 559 21.405 -9.245 -27.569 1.00 0.00 H new ATOM 0 HD2 LYS A 559 20.824 -11.507 -28.413 1.00 0.00 H new ATOM 0 HD3 LYS A 559 20.912 -10.933 -30.067 1.00 0.00 H new ATOM 0 HE2 LYS A 559 23.364 -10.299 -29.597 1.00 0.00 H new ATOM 0 HE3 LYS A 559 23.214 -11.156 -28.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 559 24.143 -12.563 -29.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 559 22.633 -13.164 -29.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 559 22.778 -12.333 -30.769 1.00 0.00 H new