USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=27 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 531 GLN : amide:sc= 0.319 K(o=1.2,f=-2.7) USER MOD Set 1.2: A 533 SER OG : rot -14:sc= 0.858 USER MOD Set 2.1: A 453 SER OG : rot -108:sc= 0.386 USER MOD Set 2.2: A 470 ASN : amide:sc= -1.68 K(o=-0.91,f=-2.4!) USER MOD Set 2.3: A 472 SER OG : rot 177:sc= 0.353 USER MOD Set 2.4: A 476 GLN : amide:sc= 0.0251 K(o=-0.91,f=-1.8) USER MOD Set 3.1: A 467 GLN : amide:sc= -2.55! C(o=-2.1!,f=-3.7!) USER MOD Set 3.2: A 510 THR OG1 : rot -38:sc= 0.43 USER MOD Set 4.1: A 455 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 469 LYS NZ :NH3+ -146:sc= 0.829 (180deg=-0.361) USER MOD Set 4.3: A 471 ASN : amide:sc= 1.53 K(o=2.4,f=-2.7) USER MOD Single : A 464 LYS NZ :NH3+ -162:sc= 0.626 (180deg=0.438) USER MOD Single : A 474 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0296) USER MOD Single : A 477 SER OG : rot 42:sc= 0.181 USER MOD Single : A 480 ASN :FLIP amide:sc= -0.0396 F(o=-1.8!,f=-0.04) USER MOD Single : A 484 LYS NZ :NH3+ -167:sc= -0.0186 (180deg=-0.183) USER MOD Single : A 486 GLN : amide:sc= -0.595 K(o=-0.6,f=-1.3) USER MOD Single : A 495 TYR OH : rot 180:sc= 0 USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 THR OG1 : rot 180:sc= -1.21 USER MOD Single : A 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 501 TYR OH : rot -163:sc= 0.902 USER MOD Single : A 507 GLN : amide:sc= -0.247 X(o=-0.25,f=-0.075) USER MOD Single : A 508 MET CE :methyl -169:sc= -0.124 (180deg=-0.37) USER MOD Single : A 520 HIS : no HE2:sc= -0.72 X(o=-0.72,f=-0.74) USER MOD Single : A 521 SER OG : rot 180:sc= 0 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 532 SER OG : rot 180:sc= 0.0159 USER MOD Single : A 536 THR OG1 : rot 180:sc= 0 USER MOD Single : A 539 SER OG : rot 180:sc= 0 USER MOD Single : A 542 THR OG1 : rot 75:sc= 0.0332 USER MOD Single : A 546 ASN :FLIP amide:sc= -2.04 F(o=-5.1!,f=-2) USER MOD Single : A 554 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 556 THR OG1 : rot 180:sc= -0.225 USER MOD Single : A 558 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0126) USER MOD Single : A 559 LYS NZ :NH3+ 140:sc= 0.499 (180deg=-0.08) USER MOD ----------------------------------------------------------------- ATOM 40 N SER A 453 10.264 3.743 -6.548 1.00 0.00 N ATOM 41 CA SER A 453 11.370 3.338 -5.678 1.00 0.00 C ATOM 42 C SER A 453 12.334 2.393 -6.418 1.00 0.00 C ATOM 43 O SER A 453 13.439 2.786 -6.750 1.00 0.00 O ATOM 44 CB SER A 453 10.809 2.678 -4.404 1.00 0.00 C ATOM 45 OG SER A 453 9.942 3.572 -3.729 1.00 0.00 O ATOM 0 HA SER A 453 11.940 4.222 -5.392 1.00 0.00 H new ATOM 0 HB2 SER A 453 10.271 1.766 -4.665 1.00 0.00 H new ATOM 0 HB3 SER A 453 11.628 2.388 -3.746 1.00 0.00 H new ATOM 0 HG SER A 453 10.376 3.895 -2.912 1.00 0.00 H new ATOM 51 N VAL A 454 11.904 1.165 -6.710 1.00 0.00 N ATOM 52 CA VAL A 454 12.772 0.173 -7.369 1.00 0.00 C ATOM 53 C VAL A 454 12.568 0.255 -8.894 1.00 0.00 C ATOM 54 O VAL A 454 11.540 -0.178 -9.415 1.00 0.00 O ATOM 55 CB VAL A 454 12.496 -1.275 -6.837 1.00 0.00 C ATOM 56 CG1 VAL A 454 13.565 -2.277 -7.330 1.00 0.00 C ATOM 57 CG2 VAL A 454 12.382 -1.287 -5.296 1.00 0.00 C ATOM 0 H VAL A 454 10.963 0.829 -6.504 1.00 0.00 H new ATOM 0 HA VAL A 454 13.811 0.402 -7.134 1.00 0.00 H new ATOM 0 HB VAL A 454 11.539 -1.598 -7.246 1.00 0.00 H new ATOM 0 HG11 VAL A 454 13.340 -3.270 -6.941 1.00 0.00 H new ATOM 0 HG12 VAL A 454 13.562 -2.305 -8.420 1.00 0.00 H new ATOM 0 HG13 VAL A 454 14.548 -1.963 -6.978 1.00 0.00 H new ATOM 0 HG21 VAL A 454 12.190 -2.304 -4.953 1.00 0.00 H new ATOM 0 HG22 VAL A 454 13.313 -0.926 -4.859 1.00 0.00 H new ATOM 0 HG23 VAL A 454 11.562 -0.639 -4.987 1.00 0.00 H new ATOM 67 N SER A 455 13.529 0.881 -9.578 1.00 0.00 N ATOM 68 CA SER A 455 13.498 1.091 -11.032 1.00 0.00 C ATOM 69 C SER A 455 14.332 0.020 -11.752 1.00 0.00 C ATOM 70 O SER A 455 15.376 -0.408 -11.240 1.00 0.00 O ATOM 71 CB SER A 455 14.043 2.503 -11.344 1.00 0.00 C ATOM 72 OG SER A 455 13.316 3.493 -10.625 1.00 0.00 O ATOM 0 H SER A 455 14.364 1.263 -9.133 1.00 0.00 H new ATOM 0 HA SER A 455 12.472 1.008 -11.389 1.00 0.00 H new ATOM 0 HB2 SER A 455 15.099 2.557 -11.080 1.00 0.00 H new ATOM 0 HB3 SER A 455 13.971 2.698 -12.414 1.00 0.00 H new ATOM 0 HG SER A 455 13.677 4.380 -10.834 1.00 0.00 H new ATOM 78 N ILE A 456 13.857 -0.406 -12.939 1.00 0.00 N ATOM 79 CA ILE A 456 14.580 -1.361 -13.791 1.00 0.00 C ATOM 80 C ILE A 456 15.705 -0.607 -14.528 1.00 0.00 C ATOM 81 O ILE A 456 15.452 0.046 -15.547 1.00 0.00 O ATOM 82 CB ILE A 456 13.629 -2.059 -14.841 1.00 0.00 C ATOM 83 CG1 ILE A 456 12.326 -2.601 -14.169 1.00 0.00 C ATOM 84 CG2 ILE A 456 14.374 -3.197 -15.586 1.00 0.00 C ATOM 85 CD1 ILE A 456 11.305 -3.179 -15.145 1.00 0.00 C ATOM 0 H ILE A 456 12.966 -0.098 -13.329 1.00 0.00 H new ATOM 0 HA ILE A 456 14.991 -2.146 -13.156 1.00 0.00 H new ATOM 0 HB ILE A 456 13.334 -1.303 -15.569 1.00 0.00 H new ATOM 0 HG12 ILE A 456 12.598 -3.372 -13.448 1.00 0.00 H new ATOM 0 HG13 ILE A 456 11.857 -1.792 -13.609 1.00 0.00 H new ATOM 0 HG21 ILE A 456 13.700 -3.664 -16.304 1.00 0.00 H new ATOM 0 HG22 ILE A 456 15.235 -2.785 -16.112 1.00 0.00 H new ATOM 0 HG23 ILE A 456 14.711 -3.943 -14.867 1.00 0.00 H new ATOM 0 HD11 ILE A 456 10.433 -3.531 -14.593 1.00 0.00 H new ATOM 0 HD12 ILE A 456 11.000 -2.407 -15.852 1.00 0.00 H new ATOM 0 HD13 ILE A 456 11.752 -4.012 -15.688 1.00 0.00 H new ATOM 97 N GLU A 457 16.923 -0.662 -13.977 1.00 0.00 N ATOM 98 CA GLU A 457 18.069 0.096 -14.500 1.00 0.00 C ATOM 99 C GLU A 457 18.679 -0.560 -15.735 1.00 0.00 C ATOM 100 O GLU A 457 18.577 -0.029 -16.846 1.00 0.00 O ATOM 101 CB GLU A 457 19.137 0.309 -13.392 1.00 0.00 C ATOM 102 CG GLU A 457 18.754 1.417 -12.405 1.00 0.00 C ATOM 103 CD GLU A 457 18.497 2.761 -13.108 1.00 0.00 C ATOM 104 OE1 GLU A 457 19.473 3.425 -13.512 1.00 0.00 O ATOM 105 OE2 GLU A 457 17.320 3.146 -13.284 1.00 0.00 O ATOM 0 H GLU A 457 17.143 -1.230 -13.159 1.00 0.00 H new ATOM 0 HA GLU A 457 17.698 1.072 -14.813 1.00 0.00 H new ATOM 0 HB2 GLU A 457 19.280 -0.624 -12.847 1.00 0.00 H new ATOM 0 HB3 GLU A 457 20.092 0.556 -13.856 1.00 0.00 H new ATOM 0 HG2 GLU A 457 17.860 1.119 -11.857 1.00 0.00 H new ATOM 0 HG3 GLU A 457 19.551 1.539 -11.672 1.00 0.00 H new ATOM 112 N GLU A 458 19.322 -1.709 -15.530 1.00 0.00 N ATOM 113 CA GLU A 458 20.051 -2.420 -16.593 1.00 0.00 C ATOM 114 C GLU A 458 19.439 -3.799 -16.745 1.00 0.00 C ATOM 115 O GLU A 458 18.833 -4.307 -15.814 1.00 0.00 O ATOM 116 CB GLU A 458 21.564 -2.556 -16.251 1.00 0.00 C ATOM 117 CG GLU A 458 22.228 -1.274 -15.729 1.00 0.00 C ATOM 118 CD GLU A 458 23.718 -1.470 -15.431 1.00 0.00 C ATOM 119 OE1 GLU A 458 24.524 -1.446 -16.383 1.00 0.00 O ATOM 120 OE2 GLU A 458 24.083 -1.669 -14.253 1.00 0.00 O ATOM 0 H GLU A 458 19.355 -2.177 -14.625 1.00 0.00 H new ATOM 0 HA GLU A 458 19.971 -1.854 -17.521 1.00 0.00 H new ATOM 0 HB2 GLU A 458 21.683 -3.340 -15.503 1.00 0.00 H new ATOM 0 HB3 GLU A 458 22.095 -2.885 -17.144 1.00 0.00 H new ATOM 0 HG2 GLU A 458 22.109 -0.480 -16.466 1.00 0.00 H new ATOM 0 HG3 GLU A 458 21.719 -0.947 -14.823 1.00 0.00 H new ATOM 127 N ILE A 459 19.566 -4.377 -17.934 1.00 0.00 N ATOM 128 CA ILE A 459 19.250 -5.789 -18.200 1.00 0.00 C ATOM 129 C ILE A 459 20.230 -6.263 -19.272 1.00 0.00 C ATOM 130 O ILE A 459 20.578 -5.490 -20.176 1.00 0.00 O ATOM 131 CB ILE A 459 17.759 -6.032 -18.701 1.00 0.00 C ATOM 132 CG1 ILE A 459 16.706 -5.476 -17.693 1.00 0.00 C ATOM 133 CG2 ILE A 459 17.489 -7.541 -18.959 1.00 0.00 C ATOM 134 CD1 ILE A 459 15.271 -5.545 -18.163 1.00 0.00 C ATOM 0 H ILE A 459 19.896 -3.876 -18.758 1.00 0.00 H new ATOM 0 HA ILE A 459 19.340 -6.344 -17.266 1.00 0.00 H new ATOM 0 HB ILE A 459 17.655 -5.487 -19.639 1.00 0.00 H new ATOM 0 HG12 ILE A 459 16.793 -6.030 -16.758 1.00 0.00 H new ATOM 0 HG13 ILE A 459 16.950 -4.437 -17.472 1.00 0.00 H new ATOM 0 HG21 ILE A 459 16.462 -7.674 -19.300 1.00 0.00 H new ATOM 0 HG22 ILE A 459 18.175 -7.908 -19.722 1.00 0.00 H new ATOM 0 HG23 ILE A 459 17.640 -8.101 -18.036 1.00 0.00 H new ATOM 0 HD11 ILE A 459 14.616 -5.135 -17.394 1.00 0.00 H new ATOM 0 HD12 ILE A 459 15.160 -4.966 -19.080 1.00 0.00 H new ATOM 0 HD13 ILE A 459 15.000 -6.583 -18.355 1.00 0.00 H new ATOM 146 N ASP A 460 20.673 -7.514 -19.156 1.00 0.00 N ATOM 147 CA ASP A 460 21.534 -8.165 -20.154 1.00 0.00 C ATOM 148 C ASP A 460 20.823 -8.236 -21.534 1.00 0.00 C ATOM 149 O ASP A 460 19.585 -8.271 -21.600 1.00 0.00 O ATOM 150 CB ASP A 460 21.914 -9.577 -19.662 1.00 0.00 C ATOM 151 CG ASP A 460 22.845 -10.329 -20.629 1.00 0.00 C ATOM 152 OD1 ASP A 460 24.053 -10.019 -20.664 1.00 0.00 O ATOM 153 OD2 ASP A 460 22.350 -11.204 -21.371 1.00 0.00 O ATOM 0 H ASP A 460 20.445 -8.113 -18.362 1.00 0.00 H new ATOM 0 HA ASP A 460 22.442 -7.575 -20.279 1.00 0.00 H new ATOM 0 HB2 ASP A 460 22.400 -9.497 -18.690 1.00 0.00 H new ATOM 0 HB3 ASP A 460 21.005 -10.160 -19.517 1.00 0.00 H new ATOM 158 N LEU A 461 21.624 -8.243 -22.611 1.00 0.00 N ATOM 159 CA LEU A 461 21.152 -8.298 -24.017 1.00 0.00 C ATOM 160 C LEU A 461 20.222 -9.513 -24.321 1.00 0.00 C ATOM 161 O LEU A 461 19.351 -9.428 -25.188 1.00 0.00 O ATOM 162 CB LEU A 461 22.396 -8.222 -24.978 1.00 0.00 C ATOM 163 CG LEU A 461 23.699 -9.044 -24.599 1.00 0.00 C ATOM 164 CD1 LEU A 461 23.520 -10.576 -24.712 1.00 0.00 C ATOM 165 CD2 LEU A 461 24.920 -8.572 -25.436 1.00 0.00 C ATOM 0 H LEU A 461 22.641 -8.210 -22.535 1.00 0.00 H new ATOM 0 HA LEU A 461 20.513 -7.433 -24.194 1.00 0.00 H new ATOM 0 HB2 LEU A 461 22.072 -8.551 -25.965 1.00 0.00 H new ATOM 0 HB3 LEU A 461 22.681 -7.174 -25.069 1.00 0.00 H new ATOM 0 HG LEU A 461 23.886 -8.835 -23.546 1.00 0.00 H new ATOM 0 HD11 LEU A 461 24.451 -11.072 -24.438 1.00 0.00 H new ATOM 0 HD12 LEU A 461 22.725 -10.900 -24.041 1.00 0.00 H new ATOM 0 HD13 LEU A 461 23.258 -10.837 -25.737 1.00 0.00 H new ATOM 0 HD21 LEU A 461 25.799 -9.152 -25.156 1.00 0.00 H new ATOM 0 HD22 LEU A 461 24.712 -8.717 -26.496 1.00 0.00 H new ATOM 0 HD23 LEU A 461 25.106 -7.515 -25.244 1.00 0.00 H new ATOM 177 N GLU A 462 20.428 -10.629 -23.595 1.00 0.00 N ATOM 178 CA GLU A 462 19.558 -11.837 -23.644 1.00 0.00 C ATOM 179 C GLU A 462 18.924 -12.125 -22.269 1.00 0.00 C ATOM 180 O GLU A 462 18.321 -13.192 -22.063 1.00 0.00 O ATOM 181 CB GLU A 462 20.368 -13.058 -24.148 1.00 0.00 C ATOM 182 CG GLU A 462 20.736 -12.980 -25.643 1.00 0.00 C ATOM 183 CD GLU A 462 21.575 -14.167 -26.129 1.00 0.00 C ATOM 184 OE1 GLU A 462 21.137 -15.329 -25.956 1.00 0.00 O ATOM 185 OE2 GLU A 462 22.660 -13.950 -26.707 1.00 0.00 O ATOM 0 H GLU A 462 21.211 -10.726 -22.948 1.00 0.00 H new ATOM 0 HA GLU A 462 18.745 -11.646 -24.345 1.00 0.00 H new ATOM 0 HB2 GLU A 462 21.283 -13.144 -23.561 1.00 0.00 H new ATOM 0 HB3 GLU A 462 19.790 -13.965 -23.972 1.00 0.00 H new ATOM 0 HG2 GLU A 462 19.820 -12.927 -26.232 1.00 0.00 H new ATOM 0 HG3 GLU A 462 21.286 -12.057 -25.826 1.00 0.00 H new ATOM 192 N GLY A 463 19.069 -11.160 -21.346 1.00 0.00 N ATOM 193 CA GLY A 463 18.448 -11.210 -20.024 1.00 0.00 C ATOM 194 C GLY A 463 18.999 -12.305 -19.126 1.00 0.00 C ATOM 195 O GLY A 463 18.242 -12.987 -18.439 1.00 0.00 O ATOM 0 H GLY A 463 19.626 -10.320 -21.503 1.00 0.00 H new ATOM 0 HA2 GLY A 463 18.585 -10.247 -19.532 1.00 0.00 H new ATOM 0 HA3 GLY A 463 17.375 -11.357 -20.143 1.00 0.00 H new ATOM 199 N LYS A 464 20.334 -12.476 -19.125 1.00 0.00 N ATOM 200 CA LYS A 464 21.011 -13.427 -18.218 1.00 0.00 C ATOM 201 C LYS A 464 21.132 -12.817 -16.809 1.00 0.00 C ATOM 202 O LYS A 464 21.577 -13.489 -15.874 1.00 0.00 O ATOM 203 CB LYS A 464 22.411 -13.839 -18.765 1.00 0.00 C ATOM 204 CG LYS A 464 22.440 -14.277 -20.258 1.00 0.00 C ATOM 205 CD LYS A 464 21.359 -15.323 -20.642 1.00 0.00 C ATOM 206 CE LYS A 464 21.505 -16.666 -19.907 1.00 0.00 C ATOM 207 NZ LYS A 464 20.469 -17.633 -20.347 1.00 0.00 N ATOM 0 H LYS A 464 20.968 -11.968 -19.742 1.00 0.00 H new ATOM 0 HA LYS A 464 20.405 -14.331 -18.160 1.00 0.00 H new ATOM 0 HB2 LYS A 464 23.094 -12.999 -18.637 1.00 0.00 H new ATOM 0 HB3 LYS A 464 22.794 -14.658 -18.156 1.00 0.00 H new ATOM 0 HG2 LYS A 464 22.313 -13.395 -20.885 1.00 0.00 H new ATOM 0 HG3 LYS A 464 23.423 -14.690 -20.484 1.00 0.00 H new ATOM 0 HD2 LYS A 464 20.374 -14.908 -20.429 1.00 0.00 H new ATOM 0 HD3 LYS A 464 21.404 -15.501 -21.716 1.00 0.00 H new ATOM 0 HE2 LYS A 464 22.496 -17.080 -20.094 1.00 0.00 H new ATOM 0 HE3 LYS A 464 21.424 -16.506 -18.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 20.388 -18.398 -19.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 19.554 -17.146 -20.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 20.737 -18.034 -21.268 1.00 0.00 H new ATOM 221 N PHE A 465 20.758 -11.526 -16.696 1.00 0.00 N ATOM 222 CA PHE A 465 20.604 -10.819 -15.427 1.00 0.00 C ATOM 223 C PHE A 465 19.673 -9.609 -15.610 1.00 0.00 C ATOM 224 O PHE A 465 19.643 -8.997 -16.685 1.00 0.00 O ATOM 225 CB PHE A 465 21.990 -10.409 -14.845 1.00 0.00 C ATOM 226 CG PHE A 465 22.748 -9.279 -15.554 1.00 0.00 C ATOM 227 CD1 PHE A 465 22.519 -7.945 -15.217 1.00 0.00 C ATOM 228 CD2 PHE A 465 23.696 -9.550 -16.545 1.00 0.00 C ATOM 229 CE1 PHE A 465 23.206 -6.915 -15.839 1.00 0.00 C ATOM 230 CE2 PHE A 465 24.387 -8.519 -17.169 1.00 0.00 C ATOM 231 CZ PHE A 465 24.139 -7.203 -16.817 1.00 0.00 C ATOM 0 H PHE A 465 20.553 -10.942 -17.507 1.00 0.00 H new ATOM 0 HA PHE A 465 20.143 -11.488 -14.701 1.00 0.00 H new ATOM 0 HB2 PHE A 465 21.845 -10.117 -13.805 1.00 0.00 H new ATOM 0 HB3 PHE A 465 22.628 -11.292 -14.842 1.00 0.00 H new ATOM 0 HD1 PHE A 465 21.791 -7.710 -14.455 1.00 0.00 H new ATOM 0 HD2 PHE A 465 23.894 -10.573 -16.829 1.00 0.00 H new ATOM 0 HE1 PHE A 465 23.013 -5.890 -15.560 1.00 0.00 H new ATOM 0 HE2 PHE A 465 25.119 -8.744 -17.930 1.00 0.00 H new ATOM 0 HZ PHE A 465 24.674 -6.403 -17.306 1.00 0.00 H new ATOM 241 N VAL A 466 18.904 -9.284 -14.554 1.00 0.00 N ATOM 242 CA VAL A 466 18.076 -8.063 -14.478 1.00 0.00 C ATOM 243 C VAL A 466 18.544 -7.236 -13.266 1.00 0.00 C ATOM 244 O VAL A 466 18.559 -7.729 -12.136 1.00 0.00 O ATOM 245 CB VAL A 466 16.531 -8.385 -14.383 1.00 0.00 C ATOM 246 CG1 VAL A 466 15.684 -7.097 -14.157 1.00 0.00 C ATOM 247 CG2 VAL A 466 16.058 -9.145 -15.653 1.00 0.00 C ATOM 0 H VAL A 466 18.839 -9.867 -13.720 1.00 0.00 H new ATOM 0 HA VAL A 466 18.206 -7.493 -15.398 1.00 0.00 H new ATOM 0 HB VAL A 466 16.378 -9.026 -13.515 1.00 0.00 H new ATOM 0 HG11 VAL A 466 14.628 -7.362 -14.097 1.00 0.00 H new ATOM 0 HG12 VAL A 466 15.991 -6.618 -13.227 1.00 0.00 H new ATOM 0 HG13 VAL A 466 15.839 -6.409 -14.988 1.00 0.00 H new ATOM 0 HG21 VAL A 466 14.992 -9.360 -15.573 1.00 0.00 H new ATOM 0 HG22 VAL A 466 16.239 -8.529 -16.534 1.00 0.00 H new ATOM 0 HG23 VAL A 466 16.611 -10.080 -15.744 1.00 0.00 H new ATOM 257 N GLN A 467 18.926 -5.993 -13.543 1.00 0.00 N ATOM 258 CA GLN A 467 19.516 -5.054 -12.577 1.00 0.00 C ATOM 259 C GLN A 467 18.435 -4.017 -12.171 1.00 0.00 C ATOM 260 O GLN A 467 17.993 -3.209 -13.000 1.00 0.00 O ATOM 261 CB GLN A 467 20.749 -4.350 -13.241 1.00 0.00 C ATOM 262 CG GLN A 467 21.858 -3.781 -12.310 1.00 0.00 C ATOM 263 CD GLN A 467 21.353 -3.116 -11.043 1.00 0.00 C ATOM 264 OE1 GLN A 467 21.213 -3.772 -10.014 1.00 0.00 O ATOM 265 NE2 GLN A 467 21.024 -1.831 -11.117 1.00 0.00 N ATOM 0 H GLN A 467 18.833 -5.592 -14.476 1.00 0.00 H new ATOM 0 HA GLN A 467 19.856 -5.577 -11.683 1.00 0.00 H new ATOM 0 HB2 GLN A 467 21.217 -5.065 -13.918 1.00 0.00 H new ATOM 0 HB3 GLN A 467 20.375 -3.530 -13.853 1.00 0.00 H new ATOM 0 HG2 GLN A 467 22.531 -4.593 -12.033 1.00 0.00 H new ATOM 0 HG3 GLN A 467 22.447 -3.057 -12.872 1.00 0.00 H new ATOM 0 HE21 GLN A 467 21.155 -1.320 -11.990 1.00 0.00 H new ATOM 0 HE22 GLN A 467 20.640 -1.355 -10.301 1.00 0.00 H new ATOM 274 N LEU A 468 18.036 -4.058 -10.892 1.00 0.00 N ATOM 275 CA LEU A 468 17.099 -3.106 -10.265 1.00 0.00 C ATOM 276 C LEU A 468 17.866 -2.170 -9.299 1.00 0.00 C ATOM 277 O LEU A 468 18.972 -2.493 -8.873 1.00 0.00 O ATOM 278 CB LEU A 468 16.005 -3.883 -9.486 1.00 0.00 C ATOM 279 CG LEU A 468 15.187 -4.951 -10.282 1.00 0.00 C ATOM 280 CD1 LEU A 468 14.111 -5.592 -9.384 1.00 0.00 C ATOM 281 CD2 LEU A 468 14.566 -4.363 -11.569 1.00 0.00 C ATOM 0 H LEU A 468 18.364 -4.774 -10.244 1.00 0.00 H new ATOM 0 HA LEU A 468 16.627 -2.505 -11.043 1.00 0.00 H new ATOM 0 HB2 LEU A 468 16.481 -4.382 -8.642 1.00 0.00 H new ATOM 0 HB3 LEU A 468 15.303 -3.158 -9.074 1.00 0.00 H new ATOM 0 HG LEU A 468 15.881 -5.731 -10.594 1.00 0.00 H new ATOM 0 HD11 LEU A 468 13.553 -6.332 -9.957 1.00 0.00 H new ATOM 0 HD12 LEU A 468 14.589 -6.077 -8.533 1.00 0.00 H new ATOM 0 HD13 LEU A 468 13.429 -4.821 -9.026 1.00 0.00 H new ATOM 0 HD21 LEU A 468 14.007 -5.140 -12.091 1.00 0.00 H new ATOM 0 HD22 LEU A 468 13.894 -3.545 -11.308 1.00 0.00 H new ATOM 0 HD23 LEU A 468 15.358 -3.989 -12.217 1.00 0.00 H new ATOM 293 N LYS A 469 17.257 -1.028 -8.941 1.00 0.00 N ATOM 294 CA LYS A 469 17.902 -0.004 -8.084 1.00 0.00 C ATOM 295 C LYS A 469 16.835 0.738 -7.271 1.00 0.00 C ATOM 296 O LYS A 469 15.834 1.183 -7.831 1.00 0.00 O ATOM 297 CB LYS A 469 18.718 0.959 -9.003 1.00 0.00 C ATOM 298 CG LYS A 469 19.535 2.096 -8.337 1.00 0.00 C ATOM 299 CD LYS A 469 18.716 3.376 -8.043 1.00 0.00 C ATOM 300 CE LYS A 469 19.559 4.511 -7.441 1.00 0.00 C ATOM 301 NZ LYS A 469 18.746 5.723 -7.197 1.00 0.00 N ATOM 0 H LYS A 469 16.310 -0.784 -9.232 1.00 0.00 H new ATOM 0 HA LYS A 469 18.585 -0.464 -7.370 1.00 0.00 H new ATOM 0 HB2 LYS A 469 19.409 0.353 -9.589 1.00 0.00 H new ATOM 0 HB3 LYS A 469 18.022 1.418 -9.705 1.00 0.00 H new ATOM 0 HG2 LYS A 469 19.958 1.726 -7.403 1.00 0.00 H new ATOM 0 HG3 LYS A 469 20.372 2.355 -8.985 1.00 0.00 H new ATOM 0 HD2 LYS A 469 18.256 3.725 -8.967 1.00 0.00 H new ATOM 0 HD3 LYS A 469 17.906 3.131 -7.356 1.00 0.00 H new ATOM 0 HE2 LYS A 469 20.005 4.176 -6.504 1.00 0.00 H new ATOM 0 HE3 LYS A 469 20.380 4.753 -8.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 469 19.329 6.570 -7.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 469 17.936 5.734 -7.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 469 18.401 5.718 -6.216 1.00 0.00 H new ATOM 315 N ASN A 470 17.075 0.889 -5.956 1.00 0.00 N ATOM 316 CA ASN A 470 16.163 1.607 -5.043 1.00 0.00 C ATOM 317 C ASN A 470 16.453 3.125 -5.064 1.00 0.00 C ATOM 318 O ASN A 470 17.597 3.552 -4.924 1.00 0.00 O ATOM 319 CB ASN A 470 16.284 1.069 -3.595 1.00 0.00 C ATOM 320 CG ASN A 470 15.300 1.729 -2.626 1.00 0.00 C ATOM 321 OD1 ASN A 470 14.190 2.102 -3.010 1.00 0.00 O ATOM 322 ND2 ASN A 470 15.693 1.880 -1.364 1.00 0.00 N ATOM 0 H ASN A 470 17.906 0.518 -5.495 1.00 0.00 H new ATOM 0 HA ASN A 470 15.145 1.436 -5.392 1.00 0.00 H new ATOM 0 HB2 ASN A 470 16.115 -0.008 -3.598 1.00 0.00 H new ATOM 0 HB3 ASN A 470 17.301 1.231 -3.237 1.00 0.00 H new ATOM 0 HD21 ASN A 470 15.069 2.315 -0.684 1.00 0.00 H new ATOM 0 HD22 ASN A 470 16.618 1.561 -1.076 1.00 0.00 H new ATOM 329 N ASN A 471 15.380 3.918 -5.205 1.00 0.00 N ATOM 330 CA ASN A 471 15.420 5.397 -5.280 1.00 0.00 C ATOM 331 C ASN A 471 14.771 6.024 -4.035 1.00 0.00 C ATOM 332 O ASN A 471 14.708 7.255 -3.930 1.00 0.00 O ATOM 333 CB ASN A 471 14.697 5.892 -6.565 1.00 0.00 C ATOM 334 CG ASN A 471 15.453 5.559 -7.851 1.00 0.00 C ATOM 335 OD1 ASN A 471 16.248 6.359 -8.345 1.00 0.00 O ATOM 336 ND2 ASN A 471 15.238 4.365 -8.382 1.00 0.00 N ATOM 0 H ASN A 471 14.433 3.544 -5.272 1.00 0.00 H new ATOM 0 HA ASN A 471 16.464 5.708 -5.319 1.00 0.00 H new ATOM 0 HB2 ASN A 471 13.704 5.445 -6.610 1.00 0.00 H new ATOM 0 HB3 ASN A 471 14.558 6.971 -6.502 1.00 0.00 H new ATOM 0 HD21 ASN A 471 15.738 4.084 -9.226 1.00 0.00 H new ATOM 0 HD22 ASN A 471 14.572 3.726 -7.947 1.00 0.00 H new ATOM 343 N SER A 472 14.281 5.177 -3.103 1.00 0.00 N ATOM 344 CA SER A 472 13.730 5.639 -1.813 1.00 0.00 C ATOM 345 C SER A 472 14.825 6.319 -0.966 1.00 0.00 C ATOM 346 O SER A 472 15.992 5.928 -1.032 1.00 0.00 O ATOM 347 CB SER A 472 13.110 4.459 -1.018 1.00 0.00 C ATOM 348 OG SER A 472 12.062 3.827 -1.730 1.00 0.00 O ATOM 0 H SER A 472 14.257 4.164 -3.223 1.00 0.00 H new ATOM 0 HA SER A 472 12.946 6.364 -2.029 1.00 0.00 H new ATOM 0 HB2 SER A 472 13.886 3.728 -0.792 1.00 0.00 H new ATOM 0 HB3 SER A 472 12.730 4.825 -0.064 1.00 0.00 H new ATOM 0 HG SER A 472 11.730 3.063 -1.213 1.00 0.00 H new ATOM 354 N ASP A 473 14.420 7.324 -0.165 1.00 0.00 N ATOM 355 CA ASP A 473 15.310 8.045 0.776 1.00 0.00 C ATOM 356 C ASP A 473 15.737 7.153 1.955 1.00 0.00 C ATOM 357 O ASP A 473 16.646 7.501 2.717 1.00 0.00 O ATOM 358 CB ASP A 473 14.588 9.311 1.307 1.00 0.00 C ATOM 359 CG ASP A 473 14.265 10.316 0.190 1.00 0.00 C ATOM 360 OD1 ASP A 473 15.127 11.155 -0.134 1.00 0.00 O ATOM 361 OD2 ASP A 473 13.162 10.249 -0.388 1.00 0.00 O ATOM 0 H ASP A 473 13.458 7.664 -0.150 1.00 0.00 H new ATOM 0 HA ASP A 473 16.212 8.331 0.234 1.00 0.00 H new ATOM 0 HB2 ASP A 473 13.664 9.017 1.805 1.00 0.00 H new ATOM 0 HB3 ASP A 473 15.214 9.795 2.057 1.00 0.00 H new ATOM 366 N LYS A 474 15.078 5.998 2.071 1.00 0.00 N ATOM 367 CA LYS A 474 15.274 5.016 3.140 1.00 0.00 C ATOM 368 C LYS A 474 15.351 3.614 2.517 1.00 0.00 C ATOM 369 O LYS A 474 15.194 3.451 1.294 1.00 0.00 O ATOM 370 CB LYS A 474 14.114 5.090 4.189 1.00 0.00 C ATOM 371 CG LYS A 474 12.702 4.640 3.704 1.00 0.00 C ATOM 372 CD LYS A 474 12.080 5.575 2.632 1.00 0.00 C ATOM 373 CE LYS A 474 10.700 5.101 2.151 1.00 0.00 C ATOM 374 NZ LYS A 474 9.695 5.124 3.241 1.00 0.00 N ATOM 0 H LYS A 474 14.367 5.710 1.398 1.00 0.00 H new ATOM 0 HA LYS A 474 16.204 5.236 3.665 1.00 0.00 H new ATOM 0 HB2 LYS A 474 14.391 4.477 5.046 1.00 0.00 H new ATOM 0 HB3 LYS A 474 14.041 6.118 4.543 1.00 0.00 H new ATOM 0 HG2 LYS A 474 12.773 3.632 3.296 1.00 0.00 H new ATOM 0 HG3 LYS A 474 12.032 4.591 4.562 1.00 0.00 H new ATOM 0 HD2 LYS A 474 11.990 6.581 3.043 1.00 0.00 H new ATOM 0 HD3 LYS A 474 12.754 5.639 1.778 1.00 0.00 H new ATOM 0 HE2 LYS A 474 10.363 5.738 1.333 1.00 0.00 H new ATOM 0 HE3 LYS A 474 10.782 4.089 1.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 8.757 4.895 2.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 9.951 4.422 3.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 9.671 6.071 3.671 1.00 0.00 H new ATOM 388 N ASP A 475 15.607 2.617 3.363 1.00 0.00 N ATOM 389 CA ASP A 475 15.639 1.203 2.965 1.00 0.00 C ATOM 390 C ASP A 475 14.230 0.759 2.531 1.00 0.00 C ATOM 391 O ASP A 475 13.296 0.789 3.336 1.00 0.00 O ATOM 392 CB ASP A 475 16.144 0.335 4.148 1.00 0.00 C ATOM 393 CG ASP A 475 17.540 0.742 4.640 1.00 0.00 C ATOM 394 OD1 ASP A 475 17.656 1.783 5.328 1.00 0.00 O ATOM 395 OD2 ASP A 475 18.523 0.033 4.346 1.00 0.00 O ATOM 0 H ASP A 475 15.800 2.765 4.353 1.00 0.00 H new ATOM 0 HA ASP A 475 16.322 1.075 2.125 1.00 0.00 H new ATOM 0 HB2 ASP A 475 15.437 0.411 4.974 1.00 0.00 H new ATOM 0 HB3 ASP A 475 16.164 -0.711 3.841 1.00 0.00 H new ATOM 400 N GLN A 476 14.084 0.418 1.241 1.00 0.00 N ATOM 401 CA GLN A 476 12.842 -0.127 0.679 1.00 0.00 C ATOM 402 C GLN A 476 12.669 -1.591 1.109 1.00 0.00 C ATOM 403 O GLN A 476 13.408 -2.465 0.650 1.00 0.00 O ATOM 404 CB GLN A 476 12.865 -0.024 -0.874 1.00 0.00 C ATOM 405 CG GLN A 476 11.622 -0.595 -1.595 1.00 0.00 C ATOM 406 CD GLN A 476 10.309 0.093 -1.219 1.00 0.00 C ATOM 407 OE1 GLN A 476 10.280 1.286 -0.902 1.00 0.00 O ATOM 408 NE2 GLN A 476 9.217 -0.664 -1.240 1.00 0.00 N ATOM 0 H GLN A 476 14.832 0.514 0.554 1.00 0.00 H new ATOM 0 HA GLN A 476 12.000 0.454 1.056 1.00 0.00 H new ATOM 0 HB2 GLN A 476 12.974 1.025 -1.150 1.00 0.00 H new ATOM 0 HB3 GLN A 476 13.749 -0.544 -1.243 1.00 0.00 H new ATOM 0 HG2 GLN A 476 11.769 -0.509 -2.672 1.00 0.00 H new ATOM 0 HG3 GLN A 476 11.540 -1.658 -1.368 1.00 0.00 H new ATOM 0 HE21 GLN A 476 9.282 -1.646 -1.508 1.00 0.00 H new ATOM 0 HE22 GLN A 476 8.314 -0.263 -0.988 1.00 0.00 H new ATOM 417 N SER A 477 11.707 -1.836 2.012 1.00 0.00 N ATOM 418 CA SER A 477 11.316 -3.197 2.396 1.00 0.00 C ATOM 419 C SER A 477 10.724 -3.924 1.166 1.00 0.00 C ATOM 420 O SER A 477 9.607 -3.619 0.726 1.00 0.00 O ATOM 421 CB SER A 477 10.316 -3.141 3.579 1.00 0.00 C ATOM 422 OG SER A 477 9.222 -2.270 3.306 1.00 0.00 O ATOM 0 H SER A 477 11.184 -1.103 2.491 1.00 0.00 H new ATOM 0 HA SER A 477 12.186 -3.761 2.732 1.00 0.00 H new ATOM 0 HB2 SER A 477 9.940 -4.143 3.785 1.00 0.00 H new ATOM 0 HB3 SER A 477 10.834 -2.804 4.477 1.00 0.00 H new ATOM 0 HG SER A 477 8.921 -2.403 2.383 1.00 0.00 H new ATOM 428 N LEU A 478 11.521 -4.839 0.590 1.00 0.00 N ATOM 429 CA LEU A 478 11.192 -5.544 -0.662 1.00 0.00 C ATOM 430 C LEU A 478 10.507 -6.888 -0.324 1.00 0.00 C ATOM 431 O LEU A 478 10.246 -7.180 0.849 1.00 0.00 O ATOM 432 CB LEU A 478 12.512 -5.760 -1.491 1.00 0.00 C ATOM 433 CG LEU A 478 12.361 -5.726 -3.044 1.00 0.00 C ATOM 434 CD1 LEU A 478 11.928 -4.325 -3.501 1.00 0.00 C ATOM 435 CD2 LEU A 478 13.654 -6.175 -3.769 1.00 0.00 C ATOM 0 H LEU A 478 12.421 -5.113 0.984 1.00 0.00 H new ATOM 0 HA LEU A 478 10.502 -4.955 -1.266 1.00 0.00 H new ATOM 0 HB2 LEU A 478 13.230 -4.993 -1.199 1.00 0.00 H new ATOM 0 HB3 LEU A 478 12.941 -6.722 -1.209 1.00 0.00 H new ATOM 0 HG LEU A 478 11.586 -6.442 -3.318 1.00 0.00 H new ATOM 0 HD11 LEU A 478 11.825 -4.312 -4.586 1.00 0.00 H new ATOM 0 HD12 LEU A 478 10.972 -4.072 -3.043 1.00 0.00 H new ATOM 0 HD13 LEU A 478 12.679 -3.595 -3.199 1.00 0.00 H new ATOM 0 HD21 LEU A 478 13.499 -6.134 -4.847 1.00 0.00 H new ATOM 0 HD22 LEU A 478 14.474 -5.511 -3.495 1.00 0.00 H new ATOM 0 HD23 LEU A 478 13.900 -7.196 -3.476 1.00 0.00 H new ATOM 447 N GLY A 479 10.202 -7.693 -1.349 1.00 0.00 N ATOM 448 CA GLY A 479 9.696 -9.049 -1.141 1.00 0.00 C ATOM 449 C GLY A 479 8.513 -9.364 -2.016 1.00 0.00 C ATOM 450 O GLY A 479 8.608 -10.173 -2.935 1.00 0.00 O ATOM 0 H GLY A 479 10.298 -7.426 -2.329 1.00 0.00 H new ATOM 0 HA2 GLY A 479 10.493 -9.765 -1.341 1.00 0.00 H new ATOM 0 HA3 GLY A 479 9.413 -9.171 -0.095 1.00 0.00 H new ATOM 454 N ASN A 480 7.400 -8.668 -1.755 1.00 0.00 N ATOM 455 CA ASN A 480 6.129 -8.850 -2.501 1.00 0.00 C ATOM 456 C ASN A 480 6.252 -8.367 -3.967 1.00 0.00 C ATOM 457 O ASN A 480 5.355 -8.610 -4.789 1.00 0.00 O ATOM 458 CB ASN A 480 4.969 -8.131 -1.770 1.00 0.00 C ATOM 459 CG ASN A 480 4.573 -8.731 -0.408 1.00 0.00 C ATOM 460 OD1 ASN A 480 5.526 -9.274 0.352 1.00 0.00 O flip ATOM 461 ND2 ASN A 480 3.402 -8.690 -0.029 1.00 0.00 N flip ATOM 0 H ASN A 480 7.345 -7.960 -1.022 1.00 0.00 H new ATOM 0 HA ASN A 480 5.908 -9.917 -2.534 1.00 0.00 H new ATOM 0 HB2 ASN A 480 5.247 -7.088 -1.621 1.00 0.00 H new ATOM 0 HB3 ASN A 480 4.093 -8.138 -2.419 1.00 0.00 H new ATOM 0 HD21 ASN A 480 2.688 -8.271 -0.624 1.00 0.00 H new ATOM 0 HD22 ASN A 480 3.146 -9.075 0.880 1.00 0.00 H new ATOM 468 N TRP A 481 7.357 -7.659 -4.253 1.00 0.00 N ATOM 469 CA TRP A 481 7.737 -7.245 -5.607 1.00 0.00 C ATOM 470 C TRP A 481 8.108 -8.489 -6.437 1.00 0.00 C ATOM 471 O TRP A 481 8.729 -9.431 -5.914 1.00 0.00 O ATOM 472 CB TRP A 481 8.938 -6.262 -5.551 1.00 0.00 C ATOM 473 CG TRP A 481 8.656 -4.965 -4.813 1.00 0.00 C ATOM 474 CD1 TRP A 481 8.323 -4.817 -3.494 1.00 0.00 C ATOM 475 CD2 TRP A 481 8.713 -3.636 -5.353 1.00 0.00 C ATOM 476 NE1 TRP A 481 8.168 -3.492 -3.188 1.00 0.00 N ATOM 477 CE2 TRP A 481 8.395 -2.744 -4.309 1.00 0.00 C ATOM 478 CE3 TRP A 481 8.994 -3.118 -6.620 1.00 0.00 C ATOM 479 CZ2 TRP A 481 8.355 -1.367 -4.491 1.00 0.00 C ATOM 480 CZ3 TRP A 481 8.950 -1.749 -6.801 1.00 0.00 C ATOM 481 CH2 TRP A 481 8.633 -0.885 -5.741 1.00 0.00 C ATOM 0 H TRP A 481 8.018 -7.356 -3.538 1.00 0.00 H new ATOM 0 HA TRP A 481 6.895 -6.736 -6.076 1.00 0.00 H new ATOM 0 HB2 TRP A 481 9.779 -6.763 -5.071 1.00 0.00 H new ATOM 0 HB3 TRP A 481 9.246 -6.026 -6.570 1.00 0.00 H new ATOM 0 HD1 TRP A 481 8.200 -5.630 -2.794 1.00 0.00 H new ATOM 0 HE1 TRP A 481 7.922 -3.122 -2.270 1.00 0.00 H new ATOM 0 HE3 TRP A 481 9.241 -3.775 -7.441 1.00 0.00 H new ATOM 0 HZ2 TRP A 481 8.113 -0.701 -3.676 1.00 0.00 H new ATOM 0 HZ3 TRP A 481 9.163 -1.336 -7.776 1.00 0.00 H new ATOM 0 HH2 TRP A 481 8.608 0.181 -5.915 1.00 0.00 H new ATOM 492 N ARG A 482 7.724 -8.483 -7.718 1.00 0.00 N ATOM 493 CA ARG A 482 7.954 -9.609 -8.628 1.00 0.00 C ATOM 494 C ARG A 482 8.284 -9.105 -10.045 1.00 0.00 C ATOM 495 O ARG A 482 7.607 -8.224 -10.584 1.00 0.00 O ATOM 496 CB ARG A 482 6.729 -10.580 -8.625 1.00 0.00 C ATOM 497 CG ARG A 482 5.355 -9.918 -8.872 1.00 0.00 C ATOM 498 CD ARG A 482 4.189 -10.920 -8.772 1.00 0.00 C ATOM 499 NE ARG A 482 2.865 -10.260 -8.867 1.00 0.00 N ATOM 500 CZ ARG A 482 1.955 -10.194 -7.875 1.00 0.00 C ATOM 501 NH1 ARG A 482 2.222 -10.664 -6.664 1.00 0.00 N ATOM 502 NH2 ARG A 482 0.779 -9.637 -8.098 1.00 0.00 N ATOM 0 H ARG A 482 7.244 -7.695 -8.153 1.00 0.00 H new ATOM 0 HA ARG A 482 8.817 -10.173 -8.274 1.00 0.00 H new ATOM 0 HB2 ARG A 482 6.889 -11.341 -9.389 1.00 0.00 H new ATOM 0 HB3 ARG A 482 6.698 -11.094 -7.665 1.00 0.00 H new ATOM 0 HG2 ARG A 482 5.205 -9.118 -8.147 1.00 0.00 H new ATOM 0 HG3 ARG A 482 5.350 -9.457 -9.860 1.00 0.00 H new ATOM 0 HD2 ARG A 482 4.281 -11.660 -9.567 1.00 0.00 H new ATOM 0 HD3 ARG A 482 4.256 -11.458 -7.826 1.00 0.00 H new ATOM 0 HE ARG A 482 2.623 -9.820 -9.755 1.00 0.00 H new ATOM 0 HH11 ARG A 482 3.130 -11.085 -6.469 1.00 0.00 H new ATOM 0 HH12 ARG A 482 1.519 -10.604 -5.927 1.00 0.00 H new ATOM 0 HH21 ARG A 482 0.561 -9.258 -9.019 1.00 0.00 H new ATOM 0 HH22 ARG A 482 0.089 -9.586 -7.349 1.00 0.00 H new ATOM 516 N ILE A 483 9.359 -9.667 -10.617 1.00 0.00 N ATOM 517 CA ILE A 483 9.826 -9.346 -11.963 1.00 0.00 C ATOM 518 C ILE A 483 9.122 -10.250 -12.996 1.00 0.00 C ATOM 519 O ILE A 483 9.351 -11.459 -13.028 1.00 0.00 O ATOM 520 CB ILE A 483 11.383 -9.551 -12.091 1.00 0.00 C ATOM 521 CG1 ILE A 483 12.148 -8.763 -10.985 1.00 0.00 C ATOM 522 CG2 ILE A 483 11.874 -9.148 -13.503 1.00 0.00 C ATOM 523 CD1 ILE A 483 13.661 -8.912 -11.041 1.00 0.00 C ATOM 0 H ILE A 483 9.933 -10.367 -10.146 1.00 0.00 H new ATOM 0 HA ILE A 483 9.589 -8.299 -12.154 1.00 0.00 H new ATOM 0 HB ILE A 483 11.596 -10.610 -11.948 1.00 0.00 H new ATOM 0 HG12 ILE A 483 11.896 -7.706 -11.068 1.00 0.00 H new ATOM 0 HG13 ILE A 483 11.798 -9.098 -10.009 1.00 0.00 H new ATOM 0 HG21 ILE A 483 12.952 -9.297 -13.570 1.00 0.00 H new ATOM 0 HG22 ILE A 483 11.375 -9.764 -14.251 1.00 0.00 H new ATOM 0 HG23 ILE A 483 11.641 -8.099 -13.683 1.00 0.00 H new ATOM 0 HD11 ILE A 483 14.114 -8.332 -10.237 1.00 0.00 H new ATOM 0 HD12 ILE A 483 13.928 -9.962 -10.925 1.00 0.00 H new ATOM 0 HD13 ILE A 483 14.027 -8.549 -12.001 1.00 0.00 H new ATOM 535 N LYS A 484 8.246 -9.653 -13.798 1.00 0.00 N ATOM 536 CA LYS A 484 7.705 -10.277 -15.015 1.00 0.00 C ATOM 537 C LYS A 484 8.704 -10.085 -16.169 1.00 0.00 C ATOM 538 O LYS A 484 9.446 -9.099 -16.191 1.00 0.00 O ATOM 539 CB LYS A 484 6.345 -9.633 -15.394 1.00 0.00 C ATOM 540 CG LYS A 484 5.246 -9.778 -14.322 1.00 0.00 C ATOM 541 CD LYS A 484 3.901 -9.157 -14.771 1.00 0.00 C ATOM 542 CE LYS A 484 2.747 -9.461 -13.797 1.00 0.00 C ATOM 543 NZ LYS A 484 2.449 -10.912 -13.733 1.00 0.00 N ATOM 0 H LYS A 484 7.885 -8.715 -13.626 1.00 0.00 H new ATOM 0 HA LYS A 484 7.550 -11.340 -14.831 1.00 0.00 H new ATOM 0 HB2 LYS A 484 6.503 -8.573 -15.593 1.00 0.00 H new ATOM 0 HB3 LYS A 484 5.991 -10.082 -16.322 1.00 0.00 H new ATOM 0 HG2 LYS A 484 5.099 -10.834 -14.097 1.00 0.00 H new ATOM 0 HG3 LYS A 484 5.575 -9.298 -13.400 1.00 0.00 H new ATOM 0 HD2 LYS A 484 4.018 -8.077 -14.863 1.00 0.00 H new ATOM 0 HD3 LYS A 484 3.644 -9.535 -15.760 1.00 0.00 H new ATOM 0 HE2 LYS A 484 3.006 -9.099 -12.802 1.00 0.00 H new ATOM 0 HE3 LYS A 484 1.854 -8.920 -14.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 1.540 -11.059 -13.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 2.394 -11.298 -14.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 3.203 -11.399 -13.208 1.00 0.00 H new ATOM 557 N ARG A 485 8.710 -11.032 -17.107 1.00 0.00 N ATOM 558 CA ARG A 485 9.482 -10.928 -18.354 1.00 0.00 C ATOM 559 C ARG A 485 8.682 -11.586 -19.484 1.00 0.00 C ATOM 560 O ARG A 485 8.570 -12.816 -19.545 1.00 0.00 O ATOM 561 CB ARG A 485 10.882 -11.586 -18.209 1.00 0.00 C ATOM 562 CG ARG A 485 11.720 -11.616 -19.518 1.00 0.00 C ATOM 563 CD ARG A 485 13.077 -12.315 -19.338 1.00 0.00 C ATOM 564 NE ARG A 485 13.786 -12.497 -20.621 1.00 0.00 N ATOM 565 CZ ARG A 485 15.042 -12.953 -20.756 1.00 0.00 C ATOM 566 NH1 ARG A 485 15.788 -13.239 -19.704 1.00 0.00 N ATOM 567 NH2 ARG A 485 15.538 -13.156 -21.960 1.00 0.00 N ATOM 0 H ARG A 485 8.178 -11.899 -17.027 1.00 0.00 H new ATOM 0 HA ARG A 485 9.648 -9.876 -18.587 1.00 0.00 H new ATOM 0 HB2 ARG A 485 11.444 -11.049 -17.445 1.00 0.00 H new ATOM 0 HB3 ARG A 485 10.754 -12.608 -17.851 1.00 0.00 H new ATOM 0 HG2 ARG A 485 11.153 -12.127 -20.296 1.00 0.00 H new ATOM 0 HG3 ARG A 485 11.885 -10.595 -19.863 1.00 0.00 H new ATOM 0 HD2 ARG A 485 13.699 -11.729 -18.661 1.00 0.00 H new ATOM 0 HD3 ARG A 485 12.924 -13.287 -18.869 1.00 0.00 H new ATOM 0 HE ARG A 485 13.281 -12.257 -21.474 1.00 0.00 H new ATOM 0 HH11 ARG A 485 15.413 -13.115 -18.764 1.00 0.00 H new ATOM 0 HH12 ARG A 485 16.739 -13.584 -19.832 1.00 0.00 H new ATOM 0 HH21 ARG A 485 14.968 -12.967 -22.785 1.00 0.00 H new ATOM 0 HH22 ARG A 485 16.491 -13.502 -22.067 1.00 0.00 H new ATOM 581 N GLN A 486 8.095 -10.741 -20.341 1.00 0.00 N ATOM 582 CA GLN A 486 7.310 -11.164 -21.510 1.00 0.00 C ATOM 583 C GLN A 486 8.214 -11.067 -22.759 1.00 0.00 C ATOM 584 O GLN A 486 8.549 -9.972 -23.203 1.00 0.00 O ATOM 585 CB GLN A 486 6.034 -10.264 -21.622 1.00 0.00 C ATOM 586 CG GLN A 486 4.932 -10.770 -22.595 1.00 0.00 C ATOM 587 CD GLN A 486 5.231 -10.558 -24.083 1.00 0.00 C ATOM 588 OE1 GLN A 486 5.883 -9.590 -24.467 1.00 0.00 O ATOM 589 NE2 GLN A 486 4.751 -11.456 -24.925 1.00 0.00 N ATOM 0 H GLN A 486 8.153 -9.728 -20.241 1.00 0.00 H new ATOM 0 HA GLN A 486 6.971 -12.196 -21.415 1.00 0.00 H new ATOM 0 HB2 GLN A 486 5.596 -10.162 -20.629 1.00 0.00 H new ATOM 0 HB3 GLN A 486 6.342 -9.268 -21.939 1.00 0.00 H new ATOM 0 HG2 GLN A 486 4.775 -11.834 -22.420 1.00 0.00 H new ATOM 0 HG3 GLN A 486 3.996 -10.266 -22.353 1.00 0.00 H new ATOM 0 HE21 GLN A 486 4.213 -12.248 -24.574 1.00 0.00 H new ATOM 0 HE22 GLN A 486 4.918 -11.357 -25.926 1.00 0.00 H new ATOM 598 N VAL A 487 8.610 -12.228 -23.294 1.00 0.00 N ATOM 599 CA VAL A 487 9.519 -12.344 -24.453 1.00 0.00 C ATOM 600 C VAL A 487 8.734 -12.202 -25.786 1.00 0.00 C ATOM 601 O VAL A 487 7.513 -12.391 -25.806 1.00 0.00 O ATOM 602 CB VAL A 487 10.310 -13.717 -24.386 1.00 0.00 C ATOM 603 CG1 VAL A 487 11.390 -13.827 -25.492 1.00 0.00 C ATOM 604 CG2 VAL A 487 10.949 -13.913 -22.984 1.00 0.00 C ATOM 0 H VAL A 487 8.306 -13.132 -22.932 1.00 0.00 H new ATOM 0 HA VAL A 487 10.245 -11.532 -24.416 1.00 0.00 H new ATOM 0 HB VAL A 487 9.585 -14.512 -24.561 1.00 0.00 H new ATOM 0 HG11 VAL A 487 11.904 -14.784 -25.405 1.00 0.00 H new ATOM 0 HG12 VAL A 487 10.916 -13.758 -26.471 1.00 0.00 H new ATOM 0 HG13 VAL A 487 12.110 -13.017 -25.379 1.00 0.00 H new ATOM 0 HG21 VAL A 487 11.487 -14.861 -22.959 1.00 0.00 H new ATOM 0 HG22 VAL A 487 11.642 -13.096 -22.783 1.00 0.00 H new ATOM 0 HG23 VAL A 487 10.167 -13.920 -22.225 1.00 0.00 H new ATOM 614 N LEU A 488 9.463 -11.880 -26.885 1.00 0.00 N ATOM 615 CA LEU A 488 8.911 -11.735 -28.266 1.00 0.00 C ATOM 616 C LEU A 488 8.065 -12.941 -28.723 1.00 0.00 C ATOM 617 O LEU A 488 7.177 -12.816 -29.575 1.00 0.00 O ATOM 618 CB LEU A 488 10.097 -11.491 -29.260 1.00 0.00 C ATOM 619 CG LEU A 488 11.220 -12.618 -29.356 1.00 0.00 C ATOM 620 CD1 LEU A 488 10.862 -13.781 -30.315 1.00 0.00 C ATOM 621 CD2 LEU A 488 12.596 -12.028 -29.736 1.00 0.00 C ATOM 0 H LEU A 488 10.468 -11.710 -26.841 1.00 0.00 H new ATOM 0 HA LEU A 488 8.231 -10.884 -28.258 1.00 0.00 H new ATOM 0 HB2 LEU A 488 9.677 -11.349 -30.256 1.00 0.00 H new ATOM 0 HB3 LEU A 488 10.582 -10.555 -28.982 1.00 0.00 H new ATOM 0 HG LEU A 488 11.276 -13.040 -28.353 1.00 0.00 H new ATOM 0 HD11 LEU A 488 11.675 -14.507 -30.326 1.00 0.00 H new ATOM 0 HD12 LEU A 488 9.947 -14.266 -29.974 1.00 0.00 H new ATOM 0 HD13 LEU A 488 10.711 -13.390 -31.321 1.00 0.00 H new ATOM 0 HD21 LEU A 488 13.333 -12.829 -29.791 1.00 0.00 H new ATOM 0 HD22 LEU A 488 12.525 -11.534 -30.705 1.00 0.00 H new ATOM 0 HD23 LEU A 488 12.903 -11.304 -28.981 1.00 0.00 H new ATOM 633 N GLU A 489 8.372 -14.115 -28.151 1.00 0.00 N ATOM 634 CA GLU A 489 7.755 -15.401 -28.526 1.00 0.00 C ATOM 635 C GLU A 489 6.336 -15.546 -27.920 1.00 0.00 C ATOM 636 O GLU A 489 5.582 -16.452 -28.292 1.00 0.00 O ATOM 637 CB GLU A 489 8.699 -16.554 -28.072 1.00 0.00 C ATOM 638 CG GLU A 489 8.355 -17.947 -28.633 1.00 0.00 C ATOM 639 CD GLU A 489 8.344 -17.992 -30.170 1.00 0.00 C ATOM 640 OE1 GLU A 489 9.429 -17.942 -30.786 1.00 0.00 O ATOM 641 OE2 GLU A 489 7.252 -18.062 -30.773 1.00 0.00 O ATOM 0 H GLU A 489 9.063 -14.201 -27.406 1.00 0.00 H new ATOM 0 HA GLU A 489 7.629 -15.445 -29.608 1.00 0.00 H new ATOM 0 HB2 GLU A 489 9.718 -16.304 -28.366 1.00 0.00 H new ATOM 0 HB3 GLU A 489 8.685 -16.605 -26.983 1.00 0.00 H new ATOM 0 HG2 GLU A 489 9.079 -18.671 -28.259 1.00 0.00 H new ATOM 0 HG3 GLU A 489 7.377 -18.251 -28.259 1.00 0.00 H new ATOM 648 N GLY A 490 5.977 -14.627 -27.000 1.00 0.00 N ATOM 649 CA GLY A 490 4.691 -14.679 -26.291 1.00 0.00 C ATOM 650 C GLY A 490 4.789 -15.470 -24.989 1.00 0.00 C ATOM 651 O GLY A 490 3.793 -15.651 -24.281 1.00 0.00 O ATOM 0 H GLY A 490 6.566 -13.838 -26.733 1.00 0.00 H new ATOM 0 HA2 GLY A 490 4.355 -13.665 -26.075 1.00 0.00 H new ATOM 0 HA3 GLY A 490 3.939 -15.134 -26.936 1.00 0.00 H new ATOM 655 N GLU A 491 6.017 -15.944 -24.690 1.00 0.00 N ATOM 656 CA GLU A 491 6.344 -16.655 -23.449 1.00 0.00 C ATOM 657 C GLU A 491 6.543 -15.639 -22.321 1.00 0.00 C ATOM 658 O GLU A 491 6.990 -14.517 -22.570 1.00 0.00 O ATOM 659 CB GLU A 491 7.629 -17.508 -23.636 1.00 0.00 C ATOM 660 CG GLU A 491 7.536 -18.547 -24.766 1.00 0.00 C ATOM 661 CD GLU A 491 8.827 -19.361 -24.940 1.00 0.00 C ATOM 662 OE1 GLU A 491 9.830 -18.792 -25.420 1.00 0.00 O ATOM 663 OE2 GLU A 491 8.857 -20.558 -24.578 1.00 0.00 O ATOM 0 H GLU A 491 6.815 -15.839 -25.316 1.00 0.00 H new ATOM 0 HA GLU A 491 5.523 -17.325 -23.192 1.00 0.00 H new ATOM 0 HB2 GLU A 491 8.468 -16.842 -23.838 1.00 0.00 H new ATOM 0 HB3 GLU A 491 7.849 -18.023 -22.701 1.00 0.00 H new ATOM 0 HG2 GLU A 491 6.709 -19.227 -24.560 1.00 0.00 H new ATOM 0 HG3 GLU A 491 7.305 -18.038 -25.702 1.00 0.00 H new ATOM 670 N GLU A 492 6.203 -16.031 -21.092 1.00 0.00 N ATOM 671 CA GLU A 492 6.394 -15.187 -19.907 1.00 0.00 C ATOM 672 C GLU A 492 6.930 -16.026 -18.744 1.00 0.00 C ATOM 673 O GLU A 492 6.769 -17.256 -18.715 1.00 0.00 O ATOM 674 CB GLU A 492 5.069 -14.487 -19.487 1.00 0.00 C ATOM 675 CG GLU A 492 3.964 -15.444 -18.980 1.00 0.00 C ATOM 676 CD GLU A 492 2.771 -14.717 -18.342 1.00 0.00 C ATOM 677 OE1 GLU A 492 2.845 -14.379 -17.147 1.00 0.00 O ATOM 678 OE2 GLU A 492 1.757 -14.478 -19.027 1.00 0.00 O ATOM 0 H GLU A 492 5.788 -16.940 -20.888 1.00 0.00 H new ATOM 0 HA GLU A 492 7.119 -14.414 -20.162 1.00 0.00 H new ATOM 0 HB2 GLU A 492 5.290 -13.762 -18.704 1.00 0.00 H new ATOM 0 HB3 GLU A 492 4.683 -13.928 -20.340 1.00 0.00 H new ATOM 0 HG2 GLU A 492 3.607 -16.049 -19.814 1.00 0.00 H new ATOM 0 HG3 GLU A 492 4.395 -16.129 -18.250 1.00 0.00 H new ATOM 685 N ILE A 493 7.580 -15.336 -17.808 1.00 0.00 N ATOM 686 CA ILE A 493 7.978 -15.878 -16.498 1.00 0.00 C ATOM 687 C ILE A 493 7.669 -14.826 -15.425 1.00 0.00 C ATOM 688 O ILE A 493 7.440 -13.643 -15.743 1.00 0.00 O ATOM 689 CB ILE A 493 9.512 -16.255 -16.436 1.00 0.00 C ATOM 690 CG1 ILE A 493 10.385 -15.019 -16.816 1.00 0.00 C ATOM 691 CG2 ILE A 493 9.840 -17.489 -17.324 1.00 0.00 C ATOM 692 CD1 ILE A 493 11.872 -15.238 -16.723 1.00 0.00 C ATOM 0 H ILE A 493 7.853 -14.362 -17.937 1.00 0.00 H new ATOM 0 HA ILE A 493 7.416 -16.796 -16.328 1.00 0.00 H new ATOM 0 HB ILE A 493 9.752 -16.540 -15.412 1.00 0.00 H new ATOM 0 HG12 ILE A 493 10.140 -14.719 -17.835 1.00 0.00 H new ATOM 0 HG13 ILE A 493 10.114 -14.188 -16.165 1.00 0.00 H new ATOM 0 HG21 ILE A 493 10.904 -17.715 -17.254 1.00 0.00 H new ATOM 0 HG22 ILE A 493 9.263 -18.348 -16.981 1.00 0.00 H new ATOM 0 HG23 ILE A 493 9.583 -17.270 -18.360 1.00 0.00 H new ATOM 0 HD11 ILE A 493 12.393 -14.323 -17.006 1.00 0.00 H new ATOM 0 HD12 ILE A 493 12.137 -15.505 -15.700 1.00 0.00 H new ATOM 0 HD13 ILE A 493 12.164 -16.045 -17.395 1.00 0.00 H new ATOM 704 N ALA A 494 7.651 -15.264 -14.167 1.00 0.00 N ATOM 705 CA ALA A 494 7.537 -14.378 -13.010 1.00 0.00 C ATOM 706 C ALA A 494 8.524 -14.819 -11.923 1.00 0.00 C ATOM 707 O ALA A 494 8.321 -15.842 -11.259 1.00 0.00 O ATOM 708 CB ALA A 494 6.097 -14.388 -12.475 1.00 0.00 C ATOM 0 H ALA A 494 7.716 -16.252 -13.920 1.00 0.00 H new ATOM 0 HA ALA A 494 7.781 -13.359 -13.311 1.00 0.00 H new ATOM 0 HB1 ALA A 494 6.024 -13.724 -11.613 1.00 0.00 H new ATOM 0 HB2 ALA A 494 5.417 -14.046 -13.255 1.00 0.00 H new ATOM 0 HB3 ALA A 494 5.827 -15.401 -12.177 1.00 0.00 H new ATOM 714 N TYR A 495 9.609 -14.045 -11.773 1.00 0.00 N ATOM 715 CA TYR A 495 10.504 -14.130 -10.619 1.00 0.00 C ATOM 716 C TYR A 495 9.866 -13.328 -9.487 1.00 0.00 C ATOM 717 O TYR A 495 9.261 -12.296 -9.745 1.00 0.00 O ATOM 718 CB TYR A 495 11.922 -13.569 -10.953 1.00 0.00 C ATOM 719 CG TYR A 495 12.919 -13.676 -9.782 1.00 0.00 C ATOM 720 CD1 TYR A 495 13.580 -14.878 -9.517 1.00 0.00 C ATOM 721 CD2 TYR A 495 13.186 -12.589 -8.934 1.00 0.00 C ATOM 722 CE1 TYR A 495 14.450 -15.001 -8.454 1.00 0.00 C ATOM 723 CE2 TYR A 495 14.059 -12.708 -7.871 1.00 0.00 C ATOM 724 CZ TYR A 495 14.694 -13.916 -7.638 1.00 0.00 C ATOM 725 OH TYR A 495 15.565 -14.037 -6.579 1.00 0.00 O ATOM 0 H TYR A 495 9.888 -13.340 -12.455 1.00 0.00 H new ATOM 0 HA TYR A 495 10.638 -15.172 -10.330 1.00 0.00 H new ATOM 0 HB2 TYR A 495 12.324 -14.107 -11.812 1.00 0.00 H new ATOM 0 HB3 TYR A 495 11.830 -12.523 -11.247 1.00 0.00 H new ATOM 0 HD1 TYR A 495 13.406 -15.729 -10.158 1.00 0.00 H new ATOM 0 HD2 TYR A 495 12.699 -11.642 -9.117 1.00 0.00 H new ATOM 0 HE1 TYR A 495 14.939 -15.944 -8.261 1.00 0.00 H new ATOM 0 HE2 TYR A 495 14.246 -11.863 -7.225 1.00 0.00 H new ATOM 0 HH TYR A 495 15.626 -13.181 -6.106 1.00 0.00 H new ATOM 735 N LYS A 496 9.985 -13.806 -8.252 1.00 0.00 N ATOM 736 CA LYS A 496 9.469 -13.100 -7.068 1.00 0.00 C ATOM 737 C LYS A 496 10.561 -13.052 -5.995 1.00 0.00 C ATOM 738 O LYS A 496 11.362 -13.989 -5.868 1.00 0.00 O ATOM 739 CB LYS A 496 8.154 -13.749 -6.520 1.00 0.00 C ATOM 740 CG LYS A 496 8.238 -15.244 -6.108 1.00 0.00 C ATOM 741 CD LYS A 496 8.290 -16.210 -7.320 1.00 0.00 C ATOM 742 CE LYS A 496 8.455 -17.680 -6.906 1.00 0.00 C ATOM 743 NZ LYS A 496 8.589 -18.569 -8.086 1.00 0.00 N ATOM 0 H LYS A 496 10.441 -14.693 -8.036 1.00 0.00 H new ATOM 0 HA LYS A 496 9.206 -12.083 -7.358 1.00 0.00 H new ATOM 0 HB2 LYS A 496 7.825 -13.175 -5.654 1.00 0.00 H new ATOM 0 HB3 LYS A 496 7.381 -13.648 -7.282 1.00 0.00 H new ATOM 0 HG2 LYS A 496 9.125 -15.395 -5.493 1.00 0.00 H new ATOM 0 HG3 LYS A 496 7.375 -15.493 -5.490 1.00 0.00 H new ATOM 0 HD2 LYS A 496 7.376 -16.103 -7.903 1.00 0.00 H new ATOM 0 HD3 LYS A 496 9.118 -15.926 -7.970 1.00 0.00 H new ATOM 0 HE2 LYS A 496 9.335 -17.783 -6.271 1.00 0.00 H new ATOM 0 HE3 LYS A 496 7.595 -17.990 -6.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 8.699 -19.553 -7.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 7.738 -18.489 -8.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 9.424 -18.289 -8.639 1.00 0.00 H new ATOM 757 N PHE A 497 10.602 -11.941 -5.253 1.00 0.00 N ATOM 758 CA PHE A 497 11.595 -11.702 -4.193 1.00 0.00 C ATOM 759 C PHE A 497 11.147 -12.345 -2.870 1.00 0.00 C ATOM 760 O PHE A 497 9.975 -12.704 -2.698 1.00 0.00 O ATOM 761 CB PHE A 497 11.834 -10.174 -4.023 1.00 0.00 C ATOM 762 CG PHE A 497 12.618 -9.562 -5.177 1.00 0.00 C ATOM 763 CD1 PHE A 497 14.004 -9.702 -5.235 1.00 0.00 C ATOM 764 CD2 PHE A 497 11.981 -8.863 -6.206 1.00 0.00 C ATOM 765 CE1 PHE A 497 14.729 -9.165 -6.280 1.00 0.00 C ATOM 766 CE2 PHE A 497 12.708 -8.331 -7.249 1.00 0.00 C ATOM 767 CZ PHE A 497 14.084 -8.482 -7.284 1.00 0.00 C ATOM 0 H PHE A 497 9.941 -11.173 -5.370 1.00 0.00 H new ATOM 0 HA PHE A 497 12.537 -12.168 -4.482 1.00 0.00 H new ATOM 0 HB2 PHE A 497 10.872 -9.669 -3.936 1.00 0.00 H new ATOM 0 HB3 PHE A 497 12.372 -9.997 -3.092 1.00 0.00 H new ATOM 0 HD1 PHE A 497 14.518 -10.238 -4.451 1.00 0.00 H new ATOM 0 HD2 PHE A 497 10.908 -8.738 -6.184 1.00 0.00 H new ATOM 0 HE1 PHE A 497 15.802 -9.281 -6.309 1.00 0.00 H new ATOM 0 HE2 PHE A 497 12.204 -7.796 -8.040 1.00 0.00 H new ATOM 0 HZ PHE A 497 14.652 -8.063 -8.101 1.00 0.00 H new ATOM 777 N THR A 498 12.109 -12.496 -1.952 1.00 0.00 N ATOM 778 CA THR A 498 11.866 -13.049 -0.616 1.00 0.00 C ATOM 779 C THR A 498 11.262 -11.946 0.279 1.00 0.00 C ATOM 780 O THR A 498 11.784 -10.828 0.281 1.00 0.00 O ATOM 781 CB THR A 498 13.203 -13.596 0.001 1.00 0.00 C ATOM 782 OG1 THR A 498 14.156 -12.533 0.172 1.00 0.00 O ATOM 783 CG2 THR A 498 13.829 -14.686 -0.893 1.00 0.00 C ATOM 0 H THR A 498 13.082 -12.237 -2.116 1.00 0.00 H new ATOM 0 HA THR A 498 11.166 -13.881 -0.685 1.00 0.00 H new ATOM 0 HB THR A 498 12.956 -14.029 0.970 1.00 0.00 H new ATOM 0 HG1 THR A 498 14.981 -12.893 0.559 1.00 0.00 H new ATOM 0 HG21 THR A 498 14.753 -15.044 -0.438 1.00 0.00 H new ATOM 0 HG22 THR A 498 13.131 -15.516 -0.997 1.00 0.00 H new ATOM 0 HG23 THR A 498 14.047 -14.269 -1.876 1.00 0.00 H new ATOM 791 N PRO A 499 10.147 -12.223 1.044 1.00 0.00 N ATOM 792 CA PRO A 499 9.435 -11.187 1.862 1.00 0.00 C ATOM 793 C PRO A 499 10.322 -10.549 2.960 1.00 0.00 C ATOM 794 O PRO A 499 10.002 -9.477 3.487 1.00 0.00 O ATOM 795 CB PRO A 499 8.231 -11.966 2.463 1.00 0.00 C ATOM 796 CG PRO A 499 8.648 -13.408 2.420 1.00 0.00 C ATOM 797 CD PRO A 499 9.485 -13.554 1.171 1.00 0.00 C ATOM 0 HA PRO A 499 9.135 -10.331 1.258 1.00 0.00 H new ATOM 0 HB2 PRO A 499 8.022 -11.645 3.483 1.00 0.00 H new ATOM 0 HB3 PRO A 499 7.323 -11.799 1.884 1.00 0.00 H new ATOM 0 HG2 PRO A 499 9.220 -13.677 3.308 1.00 0.00 H new ATOM 0 HG3 PRO A 499 7.780 -14.066 2.389 1.00 0.00 H new ATOM 0 HD2 PRO A 499 10.214 -14.358 1.267 1.00 0.00 H new ATOM 0 HD3 PRO A 499 8.871 -13.783 0.300 1.00 0.00 H new ATOM 805 N LYS A 500 11.439 -11.217 3.272 1.00 0.00 N ATOM 806 CA LYS A 500 12.402 -10.768 4.286 1.00 0.00 C ATOM 807 C LYS A 500 13.450 -9.791 3.694 1.00 0.00 C ATOM 808 O LYS A 500 14.094 -9.054 4.448 1.00 0.00 O ATOM 809 CB LYS A 500 13.114 -11.999 4.898 1.00 0.00 C ATOM 810 CG LYS A 500 13.957 -12.826 3.890 1.00 0.00 C ATOM 811 CD LYS A 500 14.647 -14.042 4.547 1.00 0.00 C ATOM 812 CE LYS A 500 15.608 -13.642 5.686 1.00 0.00 C ATOM 813 NZ LYS A 500 16.131 -14.819 6.411 1.00 0.00 N ATOM 0 H LYS A 500 11.703 -12.094 2.823 1.00 0.00 H new ATOM 0 HA LYS A 500 11.853 -10.230 5.059 1.00 0.00 H new ATOM 0 HB2 LYS A 500 13.765 -11.662 5.705 1.00 0.00 H new ATOM 0 HB3 LYS A 500 12.364 -12.651 5.345 1.00 0.00 H new ATOM 0 HG2 LYS A 500 13.313 -13.172 3.082 1.00 0.00 H new ATOM 0 HG3 LYS A 500 14.714 -12.182 3.441 1.00 0.00 H new ATOM 0 HD2 LYS A 500 13.887 -14.717 4.940 1.00 0.00 H new ATOM 0 HD3 LYS A 500 15.201 -14.594 3.787 1.00 0.00 H new ATOM 0 HE2 LYS A 500 16.440 -13.071 5.274 1.00 0.00 H new ATOM 0 HE3 LYS A 500 15.088 -12.987 6.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 16.772 -14.504 7.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 15.340 -15.350 6.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 16.650 -15.432 5.750 1.00 0.00 H new ATOM 827 N TYR A 501 13.629 -9.813 2.352 1.00 0.00 N ATOM 828 CA TYR A 501 14.633 -8.982 1.658 1.00 0.00 C ATOM 829 C TYR A 501 14.271 -7.497 1.788 1.00 0.00 C ATOM 830 O TYR A 501 13.107 -7.119 1.655 1.00 0.00 O ATOM 831 CB TYR A 501 14.744 -9.377 0.150 1.00 0.00 C ATOM 832 CG TYR A 501 15.904 -8.691 -0.599 1.00 0.00 C ATOM 833 CD1 TYR A 501 15.757 -7.417 -1.153 1.00 0.00 C ATOM 834 CD2 TYR A 501 17.156 -9.298 -0.714 1.00 0.00 C ATOM 835 CE1 TYR A 501 16.799 -6.776 -1.780 1.00 0.00 C ATOM 836 CE2 TYR A 501 18.199 -8.657 -1.355 1.00 0.00 C ATOM 837 CZ TYR A 501 18.015 -7.394 -1.880 1.00 0.00 C ATOM 838 OH TYR A 501 19.062 -6.736 -2.484 1.00 0.00 O ATOM 0 H TYR A 501 13.083 -10.405 1.726 1.00 0.00 H new ATOM 0 HA TYR A 501 15.601 -9.157 2.128 1.00 0.00 H new ATOM 0 HB2 TYR A 501 14.868 -10.457 0.077 1.00 0.00 H new ATOM 0 HB3 TYR A 501 13.807 -9.129 -0.349 1.00 0.00 H new ATOM 0 HD1 TYR A 501 14.799 -6.922 -1.087 1.00 0.00 H new ATOM 0 HD2 TYR A 501 17.311 -10.282 -0.296 1.00 0.00 H new ATOM 0 HE1 TYR A 501 16.658 -5.788 -2.192 1.00 0.00 H new ATOM 0 HE2 TYR A 501 19.158 -9.145 -1.445 1.00 0.00 H new ATOM 0 HH TYR A 501 19.762 -7.381 -2.719 1.00 0.00 H new ATOM 848 N ILE A 502 15.288 -6.666 2.064 1.00 0.00 N ATOM 849 CA ILE A 502 15.159 -5.200 2.112 1.00 0.00 C ATOM 850 C ILE A 502 16.292 -4.569 1.276 1.00 0.00 C ATOM 851 O ILE A 502 17.479 -4.811 1.524 1.00 0.00 O ATOM 852 CB ILE A 502 15.183 -4.649 3.594 1.00 0.00 C ATOM 853 CG1 ILE A 502 13.976 -5.223 4.413 1.00 0.00 C ATOM 854 CG2 ILE A 502 15.196 -3.100 3.627 1.00 0.00 C ATOM 855 CD1 ILE A 502 13.856 -4.709 5.842 1.00 0.00 C ATOM 0 H ILE A 502 16.233 -6.996 2.262 1.00 0.00 H new ATOM 0 HA ILE A 502 14.191 -4.925 1.693 1.00 0.00 H new ATOM 0 HB ILE A 502 16.107 -4.988 4.062 1.00 0.00 H new ATOM 0 HG12 ILE A 502 13.054 -4.989 3.882 1.00 0.00 H new ATOM 0 HG13 ILE A 502 14.061 -6.309 4.441 1.00 0.00 H new ATOM 0 HG21 ILE A 502 15.212 -2.758 4.662 1.00 0.00 H new ATOM 0 HG22 ILE A 502 16.082 -2.732 3.109 1.00 0.00 H new ATOM 0 HG23 ILE A 502 14.303 -2.718 3.133 1.00 0.00 H new ATOM 0 HD11 ILE A 502 12.991 -5.166 6.322 1.00 0.00 H new ATOM 0 HD12 ILE A 502 14.757 -4.967 6.398 1.00 0.00 H new ATOM 0 HD13 ILE A 502 13.734 -3.626 5.830 1.00 0.00 H new ATOM 867 N LEU A 503 15.887 -3.779 0.275 1.00 0.00 N ATOM 868 CA LEU A 503 16.796 -3.064 -0.642 1.00 0.00 C ATOM 869 C LEU A 503 17.145 -1.701 -0.004 1.00 0.00 C ATOM 870 O LEU A 503 16.248 -0.974 0.409 1.00 0.00 O ATOM 871 CB LEU A 503 16.104 -2.885 -2.042 1.00 0.00 C ATOM 872 CG LEU A 503 17.018 -2.986 -3.318 1.00 0.00 C ATOM 873 CD1 LEU A 503 16.212 -2.682 -4.600 1.00 0.00 C ATOM 874 CD2 LEU A 503 18.278 -2.099 -3.221 1.00 0.00 C ATOM 0 H LEU A 503 14.901 -3.613 0.072 1.00 0.00 H new ATOM 0 HA LEU A 503 17.714 -3.630 -0.801 1.00 0.00 H new ATOM 0 HB2 LEU A 503 15.320 -3.637 -2.129 1.00 0.00 H new ATOM 0 HB3 LEU A 503 15.615 -1.911 -2.054 1.00 0.00 H new ATOM 0 HG LEU A 503 17.372 -4.016 -3.372 1.00 0.00 H new ATOM 0 HD11 LEU A 503 16.867 -2.758 -5.468 1.00 0.00 H new ATOM 0 HD12 LEU A 503 15.397 -3.399 -4.696 1.00 0.00 H new ATOM 0 HD13 LEU A 503 15.803 -1.673 -4.542 1.00 0.00 H new ATOM 0 HD21 LEU A 503 18.871 -2.209 -4.129 1.00 0.00 H new ATOM 0 HD22 LEU A 503 17.981 -1.057 -3.105 1.00 0.00 H new ATOM 0 HD23 LEU A 503 18.873 -2.405 -2.360 1.00 0.00 H new ATOM 886 N ARG A 504 18.442 -1.359 0.046 1.00 0.00 N ATOM 887 CA ARG A 504 18.932 -0.129 0.717 1.00 0.00 C ATOM 888 C ARG A 504 18.766 1.102 -0.200 1.00 0.00 C ATOM 889 O ARG A 504 18.733 0.966 -1.432 1.00 0.00 O ATOM 890 CB ARG A 504 20.425 -0.264 1.139 1.00 0.00 C ATOM 891 CG ARG A 504 20.746 -1.344 2.198 1.00 0.00 C ATOM 892 CD ARG A 504 20.568 -2.782 1.694 1.00 0.00 C ATOM 893 NE ARG A 504 21.038 -3.763 2.684 1.00 0.00 N ATOM 894 CZ ARG A 504 22.120 -4.529 2.546 1.00 0.00 C ATOM 895 NH1 ARG A 504 22.841 -4.488 1.430 1.00 0.00 N ATOM 896 NH2 ARG A 504 22.479 -5.347 3.528 1.00 0.00 N ATOM 0 H ARG A 504 19.183 -1.920 -0.374 1.00 0.00 H new ATOM 0 HA ARG A 504 18.329 0.008 1.614 1.00 0.00 H new ATOM 0 HB2 ARG A 504 21.014 -0.475 0.247 1.00 0.00 H new ATOM 0 HB3 ARG A 504 20.760 0.700 1.522 1.00 0.00 H new ATOM 0 HG2 ARG A 504 21.774 -1.213 2.536 1.00 0.00 H new ATOM 0 HG3 ARG A 504 20.103 -1.191 3.065 1.00 0.00 H new ATOM 0 HD2 ARG A 504 19.516 -2.963 1.472 1.00 0.00 H new ATOM 0 HD3 ARG A 504 21.118 -2.912 0.762 1.00 0.00 H new ATOM 0 HE ARG A 504 20.495 -3.865 3.541 1.00 0.00 H new ATOM 0 HH11 ARG A 504 22.568 -3.866 0.669 1.00 0.00 H new ATOM 0 HH12 ARG A 504 23.667 -5.078 1.335 1.00 0.00 H new ATOM 0 HH21 ARG A 504 21.927 -5.388 4.385 1.00 0.00 H new ATOM 0 HH22 ARG A 504 23.306 -5.935 3.426 1.00 0.00 H new ATOM 910 N ALA A 505 18.671 2.297 0.423 1.00 0.00 N ATOM 911 CA ALA A 505 18.521 3.586 -0.286 1.00 0.00 C ATOM 912 C ALA A 505 19.734 3.866 -1.195 1.00 0.00 C ATOM 913 O ALA A 505 20.865 3.946 -0.711 1.00 0.00 O ATOM 914 CB ALA A 505 18.348 4.726 0.729 1.00 0.00 C ATOM 0 H ALA A 505 18.696 2.394 1.438 1.00 0.00 H new ATOM 0 HA ALA A 505 17.633 3.526 -0.916 1.00 0.00 H new ATOM 0 HB1 ALA A 505 18.238 5.672 0.199 1.00 0.00 H new ATOM 0 HB2 ALA A 505 17.459 4.543 1.333 1.00 0.00 H new ATOM 0 HB3 ALA A 505 19.224 4.773 1.376 1.00 0.00 H new ATOM 920 N GLY A 506 19.485 3.958 -2.516 1.00 0.00 N ATOM 921 CA GLY A 506 20.535 4.232 -3.507 1.00 0.00 C ATOM 922 C GLY A 506 21.225 2.973 -4.032 1.00 0.00 C ATOM 923 O GLY A 506 21.797 2.989 -5.130 1.00 0.00 O ATOM 0 H GLY A 506 18.556 3.845 -2.921 1.00 0.00 H new ATOM 0 HA2 GLY A 506 20.098 4.774 -4.346 1.00 0.00 H new ATOM 0 HA3 GLY A 506 21.283 4.886 -3.060 1.00 0.00 H new ATOM 927 N GLN A 507 21.159 1.877 -3.250 1.00 0.00 N ATOM 928 CA GLN A 507 21.783 0.588 -3.604 1.00 0.00 C ATOM 929 C GLN A 507 20.971 -0.146 -4.679 1.00 0.00 C ATOM 930 O GLN A 507 19.874 0.282 -5.065 1.00 0.00 O ATOM 931 CB GLN A 507 21.967 -0.301 -2.338 1.00 0.00 C ATOM 932 CG GLN A 507 23.089 0.168 -1.388 1.00 0.00 C ATOM 933 CD GLN A 507 24.485 0.078 -2.022 1.00 0.00 C ATOM 934 OE1 GLN A 507 25.148 -0.952 -1.935 1.00 0.00 O ATOM 935 NE2 GLN A 507 24.928 1.150 -2.669 1.00 0.00 N ATOM 0 H GLN A 507 20.671 1.861 -2.355 1.00 0.00 H new ATOM 0 HA GLN A 507 22.769 0.795 -4.020 1.00 0.00 H new ATOM 0 HB2 GLN A 507 21.027 -0.326 -1.786 1.00 0.00 H new ATOM 0 HB3 GLN A 507 22.178 -1.323 -2.654 1.00 0.00 H new ATOM 0 HG2 GLN A 507 22.897 1.198 -1.088 1.00 0.00 H new ATOM 0 HG3 GLN A 507 23.067 -0.437 -0.482 1.00 0.00 H new ATOM 0 HE21 GLN A 507 24.350 1.989 -2.721 1.00 0.00 H new ATOM 0 HE22 GLN A 507 25.846 1.134 -3.114 1.00 0.00 H new ATOM 944 N MET A 508 21.535 -1.264 -5.155 1.00 0.00 N ATOM 945 CA MET A 508 20.980 -2.050 -6.267 1.00 0.00 C ATOM 946 C MET A 508 20.768 -3.518 -5.838 1.00 0.00 C ATOM 947 O MET A 508 21.167 -3.927 -4.737 1.00 0.00 O ATOM 948 CB MET A 508 21.945 -1.981 -7.486 1.00 0.00 C ATOM 949 CG MET A 508 22.342 -0.570 -7.951 1.00 0.00 C ATOM 950 SD MET A 508 23.271 -0.574 -9.509 1.00 0.00 S ATOM 951 CE MET A 508 24.598 -1.742 -9.174 1.00 0.00 C ATOM 0 H MET A 508 22.398 -1.653 -4.776 1.00 0.00 H new ATOM 0 HA MET A 508 20.014 -1.632 -6.549 1.00 0.00 H new ATOM 0 HB2 MET A 508 22.854 -2.529 -7.237 1.00 0.00 H new ATOM 0 HB3 MET A 508 21.479 -2.500 -8.323 1.00 0.00 H new ATOM 0 HG2 MET A 508 21.442 0.033 -8.072 1.00 0.00 H new ATOM 0 HG3 MET A 508 22.943 -0.094 -7.177 1.00 0.00 H new ATOM 0 HE1 MET A 508 25.341 -1.687 -9.970 1.00 0.00 H new ATOM 0 HE2 MET A 508 25.068 -1.496 -8.222 1.00 0.00 H new ATOM 0 HE3 MET A 508 24.191 -2.752 -9.127 1.00 0.00 H new ATOM 961 N VAL A 509 20.119 -4.280 -6.730 1.00 0.00 N ATOM 962 CA VAL A 509 19.958 -5.739 -6.622 1.00 0.00 C ATOM 963 C VAL A 509 19.901 -6.313 -8.046 1.00 0.00 C ATOM 964 O VAL A 509 19.130 -5.839 -8.880 1.00 0.00 O ATOM 965 CB VAL A 509 18.679 -6.162 -5.788 1.00 0.00 C ATOM 966 CG1 VAL A 509 17.359 -5.580 -6.368 1.00 0.00 C ATOM 967 CG2 VAL A 509 18.604 -7.703 -5.638 1.00 0.00 C ATOM 0 H VAL A 509 19.681 -3.891 -7.565 1.00 0.00 H new ATOM 0 HA VAL A 509 20.808 -6.145 -6.074 1.00 0.00 H new ATOM 0 HB VAL A 509 18.790 -5.726 -4.795 1.00 0.00 H new ATOM 0 HG11 VAL A 509 16.518 -5.904 -5.755 1.00 0.00 H new ATOM 0 HG12 VAL A 509 17.410 -4.491 -6.367 1.00 0.00 H new ATOM 0 HG13 VAL A 509 17.222 -5.936 -7.389 1.00 0.00 H new ATOM 0 HG21 VAL A 509 17.718 -7.970 -5.062 1.00 0.00 H new ATOM 0 HG22 VAL A 509 18.547 -8.162 -6.625 1.00 0.00 H new ATOM 0 HG23 VAL A 509 19.494 -8.062 -5.122 1.00 0.00 H new ATOM 977 N THR A 510 20.747 -7.304 -8.336 1.00 0.00 N ATOM 978 CA THR A 510 20.873 -7.880 -9.677 1.00 0.00 C ATOM 979 C THR A 510 20.577 -9.389 -9.620 1.00 0.00 C ATOM 980 O THR A 510 21.315 -10.137 -8.978 1.00 0.00 O ATOM 981 CB THR A 510 22.311 -7.625 -10.240 1.00 0.00 C ATOM 982 OG1 THR A 510 22.727 -6.274 -9.963 1.00 0.00 O ATOM 983 CG2 THR A 510 22.377 -7.861 -11.756 1.00 0.00 C ATOM 0 H THR A 510 21.365 -7.731 -7.646 1.00 0.00 H new ATOM 0 HA THR A 510 20.154 -7.403 -10.343 1.00 0.00 H new ATOM 0 HB THR A 510 22.978 -8.331 -9.745 1.00 0.00 H new ATOM 0 HG1 THR A 510 21.961 -5.670 -10.059 1.00 0.00 H new ATOM 0 HG21 THR A 510 23.391 -7.674 -12.110 1.00 0.00 H new ATOM 0 HG22 THR A 510 22.100 -8.892 -11.976 1.00 0.00 H new ATOM 0 HG23 THR A 510 21.687 -7.185 -12.260 1.00 0.00 H new ATOM 991 N VAL A 511 19.474 -9.811 -10.263 1.00 0.00 N ATOM 992 CA VAL A 511 19.067 -11.224 -10.326 1.00 0.00 C ATOM 993 C VAL A 511 19.592 -11.865 -11.623 1.00 0.00 C ATOM 994 O VAL A 511 19.019 -11.680 -12.701 1.00 0.00 O ATOM 995 CB VAL A 511 17.503 -11.396 -10.222 1.00 0.00 C ATOM 996 CG1 VAL A 511 17.106 -12.906 -10.223 1.00 0.00 C ATOM 997 CG2 VAL A 511 16.952 -10.659 -8.972 1.00 0.00 C ATOM 0 H VAL A 511 18.840 -9.181 -10.754 1.00 0.00 H new ATOM 0 HA VAL A 511 19.505 -11.732 -9.467 1.00 0.00 H new ATOM 0 HB VAL A 511 17.048 -10.940 -11.101 1.00 0.00 H new ATOM 0 HG11 VAL A 511 16.022 -12.997 -10.150 1.00 0.00 H new ATOM 0 HG12 VAL A 511 17.448 -13.372 -11.147 1.00 0.00 H new ATOM 0 HG13 VAL A 511 17.570 -13.405 -9.372 1.00 0.00 H new ATOM 0 HG21 VAL A 511 15.871 -10.790 -8.919 1.00 0.00 H new ATOM 0 HG22 VAL A 511 17.412 -11.072 -8.074 1.00 0.00 H new ATOM 0 HG23 VAL A 511 17.185 -9.597 -9.044 1.00 0.00 H new ATOM 1007 N TRP A 512 20.710 -12.582 -11.489 1.00 0.00 N ATOM 1008 CA TRP A 512 21.351 -13.338 -12.571 1.00 0.00 C ATOM 1009 C TRP A 512 20.654 -14.688 -12.814 1.00 0.00 C ATOM 1010 O TRP A 512 19.711 -15.059 -12.109 1.00 0.00 O ATOM 1011 CB TRP A 512 22.844 -13.559 -12.228 1.00 0.00 C ATOM 1012 CG TRP A 512 23.701 -12.310 -12.277 1.00 0.00 C ATOM 1013 CD1 TRP A 512 23.620 -11.221 -11.463 1.00 0.00 C ATOM 1014 CD2 TRP A 512 24.776 -12.039 -13.190 1.00 0.00 C ATOM 1015 NE1 TRP A 512 24.580 -10.305 -11.800 1.00 0.00 N ATOM 1016 CE2 TRP A 512 25.300 -10.779 -12.855 1.00 0.00 C ATOM 1017 CE3 TRP A 512 25.347 -12.747 -14.251 1.00 0.00 C ATOM 1018 CZ2 TRP A 512 26.360 -10.203 -13.549 1.00 0.00 C ATOM 1019 CZ3 TRP A 512 26.401 -12.179 -14.940 1.00 0.00 C ATOM 1020 CH2 TRP A 512 26.901 -10.918 -14.585 1.00 0.00 C ATOM 0 H TRP A 512 21.209 -12.656 -10.602 1.00 0.00 H new ATOM 0 HA TRP A 512 21.265 -12.759 -13.490 1.00 0.00 H new ATOM 0 HB2 TRP A 512 22.912 -13.990 -11.229 1.00 0.00 H new ATOM 0 HB3 TRP A 512 23.256 -14.293 -12.921 1.00 0.00 H new ATOM 0 HD1 TRP A 512 22.902 -11.098 -10.666 1.00 0.00 H new ATOM 0 HE1 TRP A 512 24.732 -9.410 -11.335 1.00 0.00 H new ATOM 0 HE3 TRP A 512 24.971 -13.721 -14.527 1.00 0.00 H new ATOM 0 HZ2 TRP A 512 26.742 -9.229 -13.281 1.00 0.00 H new ATOM 0 HZ3 TRP A 512 26.847 -12.715 -15.765 1.00 0.00 H new ATOM 0 HH2 TRP A 512 27.729 -10.502 -15.139 1.00 0.00 H new ATOM 1031 N ALA A 513 21.143 -15.409 -13.841 1.00 0.00 N ATOM 1032 CA ALA A 513 20.650 -16.744 -14.226 1.00 0.00 C ATOM 1033 C ALA A 513 21.562 -17.836 -13.669 1.00 0.00 C ATOM 1034 O ALA A 513 22.751 -17.593 -13.410 1.00 0.00 O ATOM 1035 CB ALA A 513 20.566 -16.847 -15.764 1.00 0.00 C ATOM 0 H ALA A 513 21.902 -15.075 -14.435 1.00 0.00 H new ATOM 0 HA ALA A 513 19.654 -16.885 -13.805 1.00 0.00 H new ATOM 0 HB1 ALA A 513 20.201 -17.835 -16.043 1.00 0.00 H new ATOM 0 HB2 ALA A 513 19.882 -16.087 -16.143 1.00 0.00 H new ATOM 0 HB3 ALA A 513 21.555 -16.691 -16.194 1.00 0.00 H new ATOM 1041 N ALA A 514 20.999 -19.046 -13.515 1.00 0.00 N ATOM 1042 CA ALA A 514 21.750 -20.250 -13.091 1.00 0.00 C ATOM 1043 C ALA A 514 22.846 -20.613 -14.114 1.00 0.00 C ATOM 1044 O ALA A 514 23.953 -21.027 -13.753 1.00 0.00 O ATOM 1045 CB ALA A 514 20.782 -21.429 -12.918 1.00 0.00 C ATOM 0 H ALA A 514 20.008 -19.222 -13.680 1.00 0.00 H new ATOM 0 HA ALA A 514 22.236 -20.034 -12.139 1.00 0.00 H new ATOM 0 HB1 ALA A 514 21.338 -22.313 -12.606 1.00 0.00 H new ATOM 0 HB2 ALA A 514 20.039 -21.181 -12.160 1.00 0.00 H new ATOM 0 HB3 ALA A 514 20.281 -21.631 -13.865 1.00 0.00 H new ATOM 1051 N GLY A 515 22.520 -20.405 -15.406 1.00 0.00 N ATOM 1052 CA GLY A 515 23.411 -20.743 -16.522 1.00 0.00 C ATOM 1053 C GLY A 515 24.369 -19.619 -16.897 1.00 0.00 C ATOM 1054 O GLY A 515 25.027 -19.685 -17.938 1.00 0.00 O ATOM 0 H GLY A 515 21.632 -19.998 -15.699 1.00 0.00 H new ATOM 0 HA2 GLY A 515 23.988 -21.629 -16.260 1.00 0.00 H new ATOM 0 HA3 GLY A 515 22.808 -21.001 -17.393 1.00 0.00 H new ATOM 1058 N ALA A 516 24.426 -18.574 -16.047 1.00 0.00 N ATOM 1059 CA ALA A 516 25.382 -17.458 -16.197 1.00 0.00 C ATOM 1060 C ALA A 516 26.772 -17.848 -15.637 1.00 0.00 C ATOM 1061 O ALA A 516 27.775 -17.186 -15.931 1.00 0.00 O ATOM 1062 CB ALA A 516 24.835 -16.197 -15.504 1.00 0.00 C ATOM 0 H ALA A 516 23.812 -18.480 -15.238 1.00 0.00 H new ATOM 0 HA ALA A 516 25.504 -17.239 -17.258 1.00 0.00 H new ATOM 0 HB1 ALA A 516 25.547 -15.380 -15.620 1.00 0.00 H new ATOM 0 HB2 ALA A 516 23.884 -15.917 -15.957 1.00 0.00 H new ATOM 0 HB3 ALA A 516 24.686 -16.400 -14.444 1.00 0.00 H new ATOM 1068 N GLY A 517 26.805 -18.926 -14.813 1.00 0.00 N ATOM 1069 CA GLY A 517 28.047 -19.433 -14.208 1.00 0.00 C ATOM 1070 C GLY A 517 28.606 -18.526 -13.113 1.00 0.00 C ATOM 1071 O GLY A 517 29.777 -18.641 -12.731 1.00 0.00 O ATOM 0 H GLY A 517 25.974 -19.459 -14.556 1.00 0.00 H new ATOM 0 HA2 GLY A 517 27.861 -20.422 -13.789 1.00 0.00 H new ATOM 0 HA3 GLY A 517 28.799 -19.554 -14.988 1.00 0.00 H new ATOM 1075 N VAL A 518 27.740 -17.651 -12.586 1.00 0.00 N ATOM 1076 CA VAL A 518 28.101 -16.601 -11.620 1.00 0.00 C ATOM 1077 C VAL A 518 27.880 -17.098 -10.175 1.00 0.00 C ATOM 1078 O VAL A 518 27.011 -17.949 -9.923 1.00 0.00 O ATOM 1079 CB VAL A 518 27.245 -15.304 -11.909 1.00 0.00 C ATOM 1080 CG1 VAL A 518 25.730 -15.597 -11.788 1.00 0.00 C ATOM 1081 CG2 VAL A 518 27.670 -14.104 -11.014 1.00 0.00 C ATOM 0 H VAL A 518 26.748 -17.652 -12.823 1.00 0.00 H new ATOM 0 HA VAL A 518 29.158 -16.357 -11.730 1.00 0.00 H new ATOM 0 HB VAL A 518 27.447 -15.010 -12.939 1.00 0.00 H new ATOM 0 HG11 VAL A 518 25.166 -14.687 -11.992 1.00 0.00 H new ATOM 0 HG12 VAL A 518 25.450 -16.367 -12.507 1.00 0.00 H new ATOM 0 HG13 VAL A 518 25.506 -15.944 -10.779 1.00 0.00 H new ATOM 0 HG21 VAL A 518 27.053 -13.237 -11.250 1.00 0.00 H new ATOM 0 HG22 VAL A 518 27.538 -14.368 -9.965 1.00 0.00 H new ATOM 0 HG23 VAL A 518 28.717 -13.865 -11.199 1.00 0.00 H new ATOM 1091 N ALA A 519 28.696 -16.582 -9.243 1.00 0.00 N ATOM 1092 CA ALA A 519 28.579 -16.874 -7.809 1.00 0.00 C ATOM 1093 C ALA A 519 27.426 -16.068 -7.184 1.00 0.00 C ATOM 1094 O ALA A 519 27.325 -14.845 -7.394 1.00 0.00 O ATOM 1095 CB ALA A 519 29.906 -16.552 -7.099 1.00 0.00 C ATOM 0 H ALA A 519 29.461 -15.946 -9.467 1.00 0.00 H new ATOM 0 HA ALA A 519 28.359 -17.934 -7.684 1.00 0.00 H new ATOM 0 HB1 ALA A 519 29.812 -16.771 -6.035 1.00 0.00 H new ATOM 0 HB2 ALA A 519 30.704 -17.160 -7.526 1.00 0.00 H new ATOM 0 HB3 ALA A 519 30.143 -15.497 -7.233 1.00 0.00 H new ATOM 1101 N HIS A 520 26.555 -16.763 -6.433 1.00 0.00 N ATOM 1102 CA HIS A 520 25.493 -16.122 -5.649 1.00 0.00 C ATOM 1103 C HIS A 520 26.138 -15.312 -4.512 1.00 0.00 C ATOM 1104 O HIS A 520 26.758 -15.889 -3.608 1.00 0.00 O ATOM 1105 CB HIS A 520 24.495 -17.177 -5.090 1.00 0.00 C ATOM 1106 CG HIS A 520 23.282 -16.583 -4.401 1.00 0.00 C ATOM 1107 ND1 HIS A 520 22.670 -17.127 -3.297 1.00 0.00 N ATOM 1108 CD2 HIS A 520 22.563 -15.475 -4.704 1.00 0.00 C ATOM 1109 CE1 HIS A 520 21.625 -16.355 -2.980 1.00 0.00 C ATOM 1110 NE2 HIS A 520 21.516 -15.339 -3.804 1.00 0.00 N ATOM 0 H HIS A 520 26.569 -17.780 -6.354 1.00 0.00 H new ATOM 0 HA HIS A 520 24.922 -15.452 -6.292 1.00 0.00 H new ATOM 0 HB2 HIS A 520 24.158 -17.812 -5.910 1.00 0.00 H new ATOM 0 HB3 HIS A 520 25.021 -17.820 -4.384 1.00 0.00 H new ATOM 0 HD1 HIS A 520 22.962 -17.972 -2.805 1.00 0.00 H new ATOM 0 HD2 HIS A 520 22.773 -14.801 -5.521 1.00 0.00 H new ATOM 0 HE1 HIS A 520 20.957 -16.543 -2.153 1.00 0.00 H new ATOM 1118 N SER A 521 26.008 -13.978 -4.585 1.00 0.00 N ATOM 1119 CA SER A 521 26.618 -13.045 -3.615 1.00 0.00 C ATOM 1120 C SER A 521 25.529 -12.119 -3.021 1.00 0.00 C ATOM 1121 O SER A 521 25.496 -10.920 -3.327 1.00 0.00 O ATOM 1122 CB SER A 521 27.740 -12.228 -4.321 1.00 0.00 C ATOM 1123 OG SER A 521 28.613 -13.077 -5.045 1.00 0.00 O ATOM 0 H SER A 521 25.476 -13.511 -5.319 1.00 0.00 H new ATOM 0 HA SER A 521 27.066 -13.602 -2.792 1.00 0.00 H new ATOM 0 HB2 SER A 521 27.293 -11.500 -4.998 1.00 0.00 H new ATOM 0 HB3 SER A 521 28.307 -11.667 -3.578 1.00 0.00 H new ATOM 0 HG SER A 521 29.307 -12.539 -5.480 1.00 0.00 H new ATOM 1129 N PRO A 522 24.592 -12.663 -2.169 1.00 0.00 N ATOM 1130 CA PRO A 522 23.479 -11.864 -1.605 1.00 0.00 C ATOM 1131 C PRO A 522 23.990 -10.820 -0.566 1.00 0.00 C ATOM 1132 O PRO A 522 25.005 -11.067 0.102 1.00 0.00 O ATOM 1133 CB PRO A 522 22.565 -12.938 -0.959 1.00 0.00 C ATOM 1134 CG PRO A 522 23.501 -14.043 -0.583 1.00 0.00 C ATOM 1135 CD PRO A 522 24.552 -14.070 -1.673 1.00 0.00 C ATOM 0 HA PRO A 522 22.958 -11.266 -2.352 1.00 0.00 H new ATOM 0 HB2 PRO A 522 22.044 -12.544 -0.086 1.00 0.00 H new ATOM 0 HB3 PRO A 522 21.802 -13.283 -1.657 1.00 0.00 H new ATOM 0 HG2 PRO A 522 23.952 -13.861 0.393 1.00 0.00 H new ATOM 0 HG3 PRO A 522 22.977 -14.997 -0.519 1.00 0.00 H new ATOM 0 HD2 PRO A 522 25.521 -14.385 -1.286 1.00 0.00 H new ATOM 0 HD3 PRO A 522 24.285 -14.766 -2.468 1.00 0.00 H new ATOM 1143 N PRO A 523 23.302 -9.647 -0.390 1.00 0.00 N ATOM 1144 CA PRO A 523 22.023 -9.300 -1.068 1.00 0.00 C ATOM 1145 C PRO A 523 22.192 -8.645 -2.466 1.00 0.00 C ATOM 1146 O PRO A 523 21.204 -8.477 -3.190 1.00 0.00 O ATOM 1147 CB PRO A 523 21.399 -8.321 -0.050 1.00 0.00 C ATOM 1148 CG PRO A 523 22.568 -7.577 0.513 1.00 0.00 C ATOM 1149 CD PRO A 523 23.730 -8.558 0.535 1.00 0.00 C ATOM 0 HA PRO A 523 21.421 -10.179 -1.297 1.00 0.00 H new ATOM 0 HB2 PRO A 523 20.692 -7.645 -0.530 1.00 0.00 H new ATOM 0 HB3 PRO A 523 20.853 -8.852 0.730 1.00 0.00 H new ATOM 0 HG2 PRO A 523 22.806 -6.707 -0.099 1.00 0.00 H new ATOM 0 HG3 PRO A 523 22.349 -7.211 1.516 1.00 0.00 H new ATOM 0 HD2 PRO A 523 24.654 -8.089 0.198 1.00 0.00 H new ATOM 0 HD3 PRO A 523 23.913 -8.937 1.540 1.00 0.00 H new ATOM 1157 N SER A 524 23.445 -8.313 -2.835 1.00 0.00 N ATOM 1158 CA SER A 524 23.759 -7.558 -4.065 1.00 0.00 C ATOM 1159 C SER A 524 23.439 -8.382 -5.331 1.00 0.00 C ATOM 1160 O SER A 524 22.605 -7.995 -6.147 1.00 0.00 O ATOM 1161 CB SER A 524 25.250 -7.158 -4.054 1.00 0.00 C ATOM 1162 OG SER A 524 25.593 -6.455 -2.872 1.00 0.00 O ATOM 0 H SER A 524 24.269 -8.561 -2.288 1.00 0.00 H new ATOM 0 HA SER A 524 23.137 -6.663 -4.088 1.00 0.00 H new ATOM 0 HB2 SER A 524 25.868 -8.052 -4.138 1.00 0.00 H new ATOM 0 HB3 SER A 524 25.467 -6.537 -4.923 1.00 0.00 H new ATOM 0 HG SER A 524 26.544 -6.218 -2.896 1.00 0.00 H new ATOM 1168 N THR A 525 24.110 -9.537 -5.461 1.00 0.00 N ATOM 1169 CA THR A 525 23.985 -10.430 -6.616 1.00 0.00 C ATOM 1170 C THR A 525 23.148 -11.655 -6.219 1.00 0.00 C ATOM 1171 O THR A 525 23.667 -12.611 -5.636 1.00 0.00 O ATOM 1172 CB THR A 525 25.402 -10.861 -7.139 1.00 0.00 C ATOM 1173 OG1 THR A 525 26.161 -9.686 -7.480 1.00 0.00 O ATOM 1174 CG2 THR A 525 25.339 -11.803 -8.362 1.00 0.00 C ATOM 0 H THR A 525 24.763 -9.879 -4.755 1.00 0.00 H new ATOM 0 HA THR A 525 23.482 -9.904 -7.427 1.00 0.00 H new ATOM 0 HB THR A 525 25.883 -11.417 -6.334 1.00 0.00 H new ATOM 0 HG1 THR A 525 27.047 -9.952 -7.805 1.00 0.00 H new ATOM 0 HG21 THR A 525 26.351 -12.063 -8.674 1.00 0.00 H new ATOM 0 HG22 THR A 525 24.797 -12.710 -8.095 1.00 0.00 H new ATOM 0 HG23 THR A 525 24.825 -11.301 -9.182 1.00 0.00 H new ATOM 1182 N LEU A 526 21.832 -11.579 -6.472 1.00 0.00 N ATOM 1183 CA LEU A 526 20.930 -12.734 -6.358 1.00 0.00 C ATOM 1184 C LEU A 526 21.044 -13.562 -7.646 1.00 0.00 C ATOM 1185 O LEU A 526 21.257 -13.002 -8.714 1.00 0.00 O ATOM 1186 CB LEU A 526 19.459 -12.282 -6.107 1.00 0.00 C ATOM 1187 CG LEU A 526 19.208 -11.447 -4.806 1.00 0.00 C ATOM 1188 CD1 LEU A 526 17.702 -11.132 -4.622 1.00 0.00 C ATOM 1189 CD2 LEU A 526 19.798 -12.144 -3.556 1.00 0.00 C ATOM 0 H LEU A 526 21.366 -10.719 -6.760 1.00 0.00 H new ATOM 0 HA LEU A 526 21.220 -13.342 -5.501 1.00 0.00 H new ATOM 0 HB2 LEU A 526 19.131 -11.692 -6.962 1.00 0.00 H new ATOM 0 HB3 LEU A 526 18.828 -13.170 -6.072 1.00 0.00 H new ATOM 0 HG LEU A 526 19.732 -10.498 -4.922 1.00 0.00 H new ATOM 0 HD11 LEU A 526 17.560 -10.552 -3.710 1.00 0.00 H new ATOM 0 HD12 LEU A 526 17.343 -10.559 -5.477 1.00 0.00 H new ATOM 0 HD13 LEU A 526 17.142 -12.064 -4.549 1.00 0.00 H new ATOM 0 HD21 LEU A 526 19.604 -11.534 -2.674 1.00 0.00 H new ATOM 0 HD22 LEU A 526 19.333 -13.122 -3.431 1.00 0.00 H new ATOM 0 HD23 LEU A 526 20.874 -12.267 -3.682 1.00 0.00 H new ATOM 1201 N VAL A 527 20.968 -14.893 -7.540 1.00 0.00 N ATOM 1202 CA VAL A 527 21.013 -15.800 -8.708 1.00 0.00 C ATOM 1203 C VAL A 527 19.783 -16.713 -8.663 1.00 0.00 C ATOM 1204 O VAL A 527 19.469 -17.292 -7.612 1.00 0.00 O ATOM 1205 CB VAL A 527 22.337 -16.667 -8.754 1.00 0.00 C ATOM 1206 CG1 VAL A 527 22.354 -17.631 -9.977 1.00 0.00 C ATOM 1207 CG2 VAL A 527 23.591 -15.757 -8.751 1.00 0.00 C ATOM 0 H VAL A 527 20.874 -15.378 -6.648 1.00 0.00 H new ATOM 0 HA VAL A 527 21.009 -15.192 -9.613 1.00 0.00 H new ATOM 0 HB VAL A 527 22.356 -17.282 -7.854 1.00 0.00 H new ATOM 0 HG11 VAL A 527 23.279 -18.208 -9.973 1.00 0.00 H new ATOM 0 HG12 VAL A 527 21.503 -18.309 -9.918 1.00 0.00 H new ATOM 0 HG13 VAL A 527 22.292 -17.051 -10.898 1.00 0.00 H new ATOM 0 HG21 VAL A 527 24.489 -16.374 -8.783 1.00 0.00 H new ATOM 0 HG22 VAL A 527 23.569 -15.104 -9.623 1.00 0.00 H new ATOM 0 HG23 VAL A 527 23.599 -15.152 -7.845 1.00 0.00 H new ATOM 1217 N TRP A 528 19.082 -16.812 -9.804 1.00 0.00 N ATOM 1218 CA TRP A 528 17.924 -17.692 -9.955 1.00 0.00 C ATOM 1219 C TRP A 528 18.429 -19.142 -10.076 1.00 0.00 C ATOM 1220 O TRP A 528 18.813 -19.586 -11.163 1.00 0.00 O ATOM 1221 CB TRP A 528 17.074 -17.275 -11.192 1.00 0.00 C ATOM 1222 CG TRP A 528 15.659 -17.830 -11.218 1.00 0.00 C ATOM 1223 CD1 TRP A 528 15.146 -18.893 -10.514 1.00 0.00 C ATOM 1224 CD2 TRP A 528 14.576 -17.327 -12.004 1.00 0.00 C ATOM 1225 NE1 TRP A 528 13.825 -19.070 -10.822 1.00 0.00 N ATOM 1226 CE2 TRP A 528 13.451 -18.120 -11.734 1.00 0.00 C ATOM 1227 CE3 TRP A 528 14.460 -16.281 -12.913 1.00 0.00 C ATOM 1228 CZ2 TRP A 528 12.224 -17.886 -12.331 1.00 0.00 C ATOM 1229 CZ3 TRP A 528 13.246 -16.050 -13.509 1.00 0.00 C ATOM 1230 CH2 TRP A 528 12.140 -16.852 -13.222 1.00 0.00 C ATOM 0 H TRP A 528 19.307 -16.281 -10.646 1.00 0.00 H new ATOM 0 HA TRP A 528 17.274 -17.611 -9.084 1.00 0.00 H new ATOM 0 HB2 TRP A 528 17.022 -16.187 -11.227 1.00 0.00 H new ATOM 0 HB3 TRP A 528 17.591 -17.599 -12.095 1.00 0.00 H new ATOM 0 HD1 TRP A 528 15.705 -19.501 -9.818 1.00 0.00 H new ATOM 0 HE1 TRP A 528 13.218 -19.792 -10.435 1.00 0.00 H new ATOM 0 HE3 TRP A 528 15.312 -15.660 -13.146 1.00 0.00 H new ATOM 0 HZ2 TRP A 528 11.364 -18.498 -12.101 1.00 0.00 H new ATOM 0 HZ3 TRP A 528 13.144 -15.235 -14.211 1.00 0.00 H new ATOM 0 HH2 TRP A 528 11.199 -16.652 -13.713 1.00 0.00 H new ATOM 1241 N LYS A 529 18.454 -19.842 -8.931 1.00 0.00 N ATOM 1242 CA LYS A 529 18.945 -21.224 -8.828 1.00 0.00 C ATOM 1243 C LYS A 529 18.041 -22.186 -9.631 1.00 0.00 C ATOM 1244 O LYS A 529 16.822 -22.207 -9.431 1.00 0.00 O ATOM 1245 CB LYS A 529 19.015 -21.646 -7.328 1.00 0.00 C ATOM 1246 CG LYS A 529 19.473 -23.106 -7.070 1.00 0.00 C ATOM 1247 CD LYS A 529 20.875 -23.416 -7.657 1.00 0.00 C ATOM 1248 CE LYS A 529 21.287 -24.889 -7.473 1.00 0.00 C ATOM 1249 NZ LYS A 529 22.565 -25.208 -8.161 1.00 0.00 N ATOM 0 H LYS A 529 18.131 -19.460 -8.042 1.00 0.00 H new ATOM 0 HA LYS A 529 19.947 -21.278 -9.254 1.00 0.00 H new ATOM 0 HB2 LYS A 529 19.697 -20.972 -6.810 1.00 0.00 H new ATOM 0 HB3 LYS A 529 18.030 -21.508 -6.882 1.00 0.00 H new ATOM 0 HG2 LYS A 529 19.486 -23.292 -5.996 1.00 0.00 H new ATOM 0 HG3 LYS A 529 18.744 -23.791 -7.503 1.00 0.00 H new ATOM 0 HD2 LYS A 529 20.881 -23.172 -8.719 1.00 0.00 H new ATOM 0 HD3 LYS A 529 21.614 -22.774 -7.178 1.00 0.00 H new ATOM 0 HE2 LYS A 529 21.386 -25.106 -6.409 1.00 0.00 H new ATOM 0 HE3 LYS A 529 20.498 -25.535 -7.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 529 22.801 -26.209 -8.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 529 22.465 -25.027 -9.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 529 23.325 -24.611 -7.776 1.00 0.00 H new ATOM 1263 N GLY A 530 18.661 -22.939 -10.560 1.00 0.00 N ATOM 1264 CA GLY A 530 17.981 -23.993 -11.317 1.00 0.00 C ATOM 1265 C GLY A 530 17.439 -23.539 -12.670 1.00 0.00 C ATOM 1266 O GLY A 530 17.316 -24.353 -13.593 1.00 0.00 O ATOM 0 H GLY A 530 19.646 -22.829 -10.802 1.00 0.00 H new ATOM 0 HA2 GLY A 530 18.676 -24.818 -11.474 1.00 0.00 H new ATOM 0 HA3 GLY A 530 17.156 -24.380 -10.719 1.00 0.00 H new ATOM 1270 N GLN A 531 17.115 -22.240 -12.806 1.00 0.00 N ATOM 1271 CA GLN A 531 16.511 -21.688 -14.041 1.00 0.00 C ATOM 1272 C GLN A 531 17.608 -20.923 -14.820 1.00 0.00 C ATOM 1273 O GLN A 531 17.957 -19.783 -14.487 1.00 0.00 O ATOM 1274 CB GLN A 531 15.265 -20.809 -13.670 1.00 0.00 C ATOM 1275 CG GLN A 531 14.121 -20.801 -14.719 1.00 0.00 C ATOM 1276 CD GLN A 531 14.324 -19.822 -15.870 1.00 0.00 C ATOM 1277 OE1 GLN A 531 14.960 -20.138 -16.874 1.00 0.00 O ATOM 1278 NE2 GLN A 531 13.755 -18.631 -15.742 1.00 0.00 N ATOM 0 H GLN A 531 17.261 -21.546 -12.073 1.00 0.00 H new ATOM 0 HA GLN A 531 16.138 -22.476 -14.696 1.00 0.00 H new ATOM 0 HB2 GLN A 531 14.862 -21.162 -12.721 1.00 0.00 H new ATOM 0 HB3 GLN A 531 15.599 -19.783 -13.513 1.00 0.00 H new ATOM 0 HG2 GLN A 531 14.014 -21.806 -15.128 1.00 0.00 H new ATOM 0 HG3 GLN A 531 13.185 -20.560 -14.215 1.00 0.00 H new ATOM 0 HE21 GLN A 531 13.235 -18.403 -14.895 1.00 0.00 H new ATOM 0 HE22 GLN A 531 13.838 -17.943 -16.491 1.00 0.00 H new ATOM 1287 N SER A 532 18.170 -21.603 -15.840 1.00 0.00 N ATOM 1288 CA SER A 532 19.402 -21.183 -16.536 1.00 0.00 C ATOM 1289 C SER A 532 19.144 -20.177 -17.666 1.00 0.00 C ATOM 1290 O SER A 532 19.980 -19.297 -17.919 1.00 0.00 O ATOM 1291 CB SER A 532 20.118 -22.432 -17.082 1.00 0.00 C ATOM 1292 OG SER A 532 19.235 -23.233 -17.848 1.00 0.00 O ATOM 0 H SER A 532 17.776 -22.469 -16.207 1.00 0.00 H new ATOM 0 HA SER A 532 20.032 -20.668 -15.811 1.00 0.00 H new ATOM 0 HB2 SER A 532 20.965 -22.129 -17.697 1.00 0.00 H new ATOM 0 HB3 SER A 532 20.518 -23.017 -16.254 1.00 0.00 H new ATOM 0 HG SER A 532 19.715 -24.019 -18.184 1.00 0.00 H new ATOM 1298 N SER A 533 17.996 -20.315 -18.351 1.00 0.00 N ATOM 1299 CA SER A 533 17.665 -19.484 -19.527 1.00 0.00 C ATOM 1300 C SER A 533 17.245 -18.061 -19.107 1.00 0.00 C ATOM 1301 O SER A 533 17.485 -17.096 -19.849 1.00 0.00 O ATOM 1302 CB SER A 533 16.547 -20.161 -20.364 1.00 0.00 C ATOM 1303 OG SER A 533 15.351 -20.313 -19.624 1.00 0.00 O ATOM 0 H SER A 533 17.277 -20.997 -18.111 1.00 0.00 H new ATOM 0 HA SER A 533 18.560 -19.396 -20.143 1.00 0.00 H new ATOM 0 HB2 SER A 533 16.349 -19.565 -21.255 1.00 0.00 H new ATOM 0 HB3 SER A 533 16.890 -21.138 -20.704 1.00 0.00 H new ATOM 0 HG SER A 533 15.534 -20.163 -18.673 1.00 0.00 H new ATOM 1309 N TRP A 534 16.676 -17.964 -17.878 1.00 0.00 N ATOM 1310 CA TRP A 534 15.991 -16.758 -17.353 1.00 0.00 C ATOM 1311 C TRP A 534 14.817 -16.397 -18.296 1.00 0.00 C ATOM 1312 O TRP A 534 14.445 -15.234 -18.431 1.00 0.00 O ATOM 1313 CB TRP A 534 16.984 -15.554 -17.128 1.00 0.00 C ATOM 1314 CG TRP A 534 16.813 -14.809 -15.813 1.00 0.00 C ATOM 1315 CD1 TRP A 534 17.559 -14.987 -14.687 1.00 0.00 C ATOM 1316 CD2 TRP A 534 15.841 -13.796 -15.475 1.00 0.00 C ATOM 1317 NE1 TRP A 534 17.140 -14.152 -13.692 1.00 0.00 N ATOM 1318 CE2 TRP A 534 16.084 -13.416 -14.141 1.00 0.00 C ATOM 1319 CE3 TRP A 534 14.798 -13.175 -16.161 1.00 0.00 C ATOM 1320 CZ2 TRP A 534 15.327 -12.455 -13.483 1.00 0.00 C ATOM 1321 CZ3 TRP A 534 14.043 -12.222 -15.510 1.00 0.00 C ATOM 1322 CH2 TRP A 534 14.311 -11.871 -14.181 1.00 0.00 C ATOM 0 H TRP A 534 16.682 -18.737 -17.213 1.00 0.00 H new ATOM 0 HA TRP A 534 15.589 -16.979 -16.364 1.00 0.00 H new ATOM 0 HB2 TRP A 534 18.005 -15.931 -17.183 1.00 0.00 H new ATOM 0 HB3 TRP A 534 16.862 -14.845 -17.947 1.00 0.00 H new ATOM 0 HD1 TRP A 534 18.371 -15.693 -14.594 1.00 0.00 H new ATOM 0 HE1 TRP A 534 17.551 -14.089 -12.761 1.00 0.00 H new ATOM 0 HE3 TRP A 534 14.585 -13.436 -17.187 1.00 0.00 H new ATOM 0 HZ2 TRP A 534 15.535 -12.181 -12.459 1.00 0.00 H new ATOM 0 HZ3 TRP A 534 13.232 -11.738 -16.034 1.00 0.00 H new ATOM 0 HH2 TRP A 534 13.700 -11.122 -13.699 1.00 0.00 H new ATOM 1333 N GLY A 535 14.203 -17.441 -18.911 1.00 0.00 N ATOM 1334 CA GLY A 535 13.187 -17.254 -19.947 1.00 0.00 C ATOM 1335 C GLY A 535 13.811 -16.719 -21.230 1.00 0.00 C ATOM 1336 O GLY A 535 13.663 -15.534 -21.536 1.00 0.00 O ATOM 0 H GLY A 535 14.404 -18.418 -18.697 1.00 0.00 H new ATOM 0 HA2 GLY A 535 12.688 -18.202 -20.148 1.00 0.00 H new ATOM 0 HA3 GLY A 535 12.424 -16.561 -19.593 1.00 0.00 H new ATOM 1340 N THR A 536 14.482 -17.618 -21.984 1.00 0.00 N ATOM 1341 CA THR A 536 15.372 -17.263 -23.123 1.00 0.00 C ATOM 1342 C THR A 536 14.698 -16.334 -24.166 1.00 0.00 C ATOM 1343 O THR A 536 13.496 -16.452 -24.451 1.00 0.00 O ATOM 1344 CB THR A 536 15.915 -18.552 -23.843 1.00 0.00 C ATOM 1345 OG1 THR A 536 16.810 -18.195 -24.914 1.00 0.00 O ATOM 1346 CG2 THR A 536 14.784 -19.444 -24.393 1.00 0.00 C ATOM 0 H THR A 536 14.423 -18.623 -21.821 1.00 0.00 H new ATOM 0 HA THR A 536 16.201 -16.709 -22.683 1.00 0.00 H new ATOM 0 HB THR A 536 16.452 -19.126 -23.088 1.00 0.00 H new ATOM 0 HG1 THR A 536 17.140 -19.009 -25.350 1.00 0.00 H new ATOM 0 HG21 THR A 536 15.215 -20.319 -24.880 1.00 0.00 H new ATOM 0 HG22 THR A 536 14.142 -19.764 -23.573 1.00 0.00 H new ATOM 0 HG23 THR A 536 14.195 -18.880 -25.116 1.00 0.00 H new ATOM 1354 N GLY A 537 15.501 -15.406 -24.710 1.00 0.00 N ATOM 1355 CA GLY A 537 15.045 -14.413 -25.675 1.00 0.00 C ATOM 1356 C GLY A 537 15.988 -13.223 -25.705 1.00 0.00 C ATOM 1357 O GLY A 537 16.357 -12.707 -24.648 1.00 0.00 O ATOM 0 H GLY A 537 16.493 -15.330 -24.485 1.00 0.00 H new ATOM 0 HA2 GLY A 537 14.986 -14.862 -26.666 1.00 0.00 H new ATOM 0 HA3 GLY A 537 14.040 -14.081 -25.415 1.00 0.00 H new ATOM 1361 N GLU A 538 16.391 -12.805 -26.912 1.00 0.00 N ATOM 1362 CA GLU A 538 17.292 -11.655 -27.106 1.00 0.00 C ATOM 1363 C GLU A 538 16.508 -10.326 -27.111 1.00 0.00 C ATOM 1364 O GLU A 538 17.096 -9.246 -26.998 1.00 0.00 O ATOM 1365 CB GLU A 538 18.092 -11.830 -28.424 1.00 0.00 C ATOM 1366 CG GLU A 538 17.238 -11.827 -29.705 1.00 0.00 C ATOM 1367 CD GLU A 538 18.064 -12.087 -30.977 1.00 0.00 C ATOM 1368 OE1 GLU A 538 18.804 -11.180 -31.417 1.00 0.00 O ATOM 1369 OE2 GLU A 538 17.981 -13.203 -31.538 1.00 0.00 O ATOM 0 H GLU A 538 16.103 -13.252 -27.782 1.00 0.00 H new ATOM 0 HA GLU A 538 17.991 -11.618 -26.271 1.00 0.00 H new ATOM 0 HB2 GLU A 538 18.829 -11.030 -28.494 1.00 0.00 H new ATOM 0 HB3 GLU A 538 18.644 -12.768 -28.375 1.00 0.00 H new ATOM 0 HG2 GLU A 538 16.462 -12.588 -29.620 1.00 0.00 H new ATOM 0 HG3 GLU A 538 16.733 -10.865 -29.796 1.00 0.00 H new ATOM 1376 N SER A 539 15.176 -10.416 -27.275 1.00 0.00 N ATOM 1377 CA SER A 539 14.280 -9.250 -27.249 1.00 0.00 C ATOM 1378 C SER A 539 13.009 -9.587 -26.445 1.00 0.00 C ATOM 1379 O SER A 539 12.401 -10.652 -26.632 1.00 0.00 O ATOM 1380 CB SER A 539 13.923 -8.807 -28.681 1.00 0.00 C ATOM 1381 OG SER A 539 15.085 -8.599 -29.477 1.00 0.00 O ATOM 0 H SER A 539 14.692 -11.300 -27.429 1.00 0.00 H new ATOM 0 HA SER A 539 14.792 -8.420 -26.762 1.00 0.00 H new ATOM 0 HB2 SER A 539 13.293 -9.564 -29.149 1.00 0.00 H new ATOM 0 HB3 SER A 539 13.340 -7.887 -28.642 1.00 0.00 H new ATOM 0 HG SER A 539 14.819 -8.321 -30.378 1.00 0.00 H new ATOM 1387 N PHE A 540 12.643 -8.671 -25.535 1.00 0.00 N ATOM 1388 CA PHE A 540 11.562 -8.850 -24.556 1.00 0.00 C ATOM 1389 C PHE A 540 11.228 -7.513 -23.881 1.00 0.00 C ATOM 1390 O PHE A 540 11.875 -6.503 -24.139 1.00 0.00 O ATOM 1391 CB PHE A 540 11.960 -9.914 -23.486 1.00 0.00 C ATOM 1392 CG PHE A 540 13.323 -9.698 -22.834 1.00 0.00 C ATOM 1393 CD1 PHE A 540 13.478 -8.923 -21.685 1.00 0.00 C ATOM 1394 CD2 PHE A 540 14.465 -10.273 -23.393 1.00 0.00 C ATOM 1395 CE1 PHE A 540 14.726 -8.739 -21.118 1.00 0.00 C ATOM 1396 CE2 PHE A 540 15.702 -10.092 -22.831 1.00 0.00 C ATOM 1397 CZ PHE A 540 15.838 -9.324 -21.695 1.00 0.00 C ATOM 0 H PHE A 540 13.102 -7.764 -25.459 1.00 0.00 H new ATOM 0 HA PHE A 540 10.676 -9.207 -25.082 1.00 0.00 H new ATOM 0 HB2 PHE A 540 11.199 -9.924 -22.706 1.00 0.00 H new ATOM 0 HB3 PHE A 540 11.950 -10.898 -23.954 1.00 0.00 H new ATOM 0 HD1 PHE A 540 12.613 -8.461 -21.232 1.00 0.00 H new ATOM 0 HD2 PHE A 540 14.372 -10.873 -24.286 1.00 0.00 H new ATOM 0 HE1 PHE A 540 14.832 -8.139 -20.226 1.00 0.00 H new ATOM 0 HE2 PHE A 540 16.571 -10.552 -23.279 1.00 0.00 H new ATOM 0 HZ PHE A 540 16.814 -9.179 -21.255 1.00 0.00 H new ATOM 1407 N ARG A 541 10.208 -7.534 -23.015 1.00 0.00 N ATOM 1408 CA ARG A 541 9.879 -6.434 -22.102 1.00 0.00 C ATOM 1409 C ARG A 541 9.743 -6.994 -20.682 1.00 0.00 C ATOM 1410 O ARG A 541 8.860 -7.813 -20.403 1.00 0.00 O ATOM 1411 CB ARG A 541 8.592 -5.646 -22.531 1.00 0.00 C ATOM 1412 CG ARG A 541 7.419 -6.505 -23.093 1.00 0.00 C ATOM 1413 CD ARG A 541 7.515 -6.713 -24.620 1.00 0.00 C ATOM 1414 NE ARG A 541 7.561 -5.421 -25.328 1.00 0.00 N ATOM 1415 CZ ARG A 541 7.618 -5.247 -26.651 1.00 0.00 C ATOM 1416 NH1 ARG A 541 7.628 -6.274 -27.485 1.00 0.00 N ATOM 1417 NH2 ARG A 541 7.663 -4.014 -27.128 1.00 0.00 N ATOM 0 H ARG A 541 9.577 -8.331 -22.928 1.00 0.00 H new ATOM 0 HA ARG A 541 10.691 -5.707 -22.138 1.00 0.00 H new ATOM 0 HB2 ARG A 541 8.227 -5.089 -21.668 1.00 0.00 H new ATOM 0 HB3 ARG A 541 8.874 -4.913 -23.287 1.00 0.00 H new ATOM 0 HG2 ARG A 541 7.414 -7.476 -22.597 1.00 0.00 H new ATOM 0 HG3 ARG A 541 6.472 -6.021 -22.855 1.00 0.00 H new ATOM 0 HD2 ARG A 541 8.407 -7.293 -24.856 1.00 0.00 H new ATOM 0 HD3 ARG A 541 6.658 -7.291 -24.966 1.00 0.00 H new ATOM 0 HE ARG A 541 7.548 -4.579 -24.752 1.00 0.00 H new ATOM 0 HH11 ARG A 541 7.592 -7.226 -27.122 1.00 0.00 H new ATOM 0 HH12 ARG A 541 7.672 -6.113 -28.491 1.00 0.00 H new ATOM 0 HH21 ARG A 541 7.654 -3.219 -26.489 1.00 0.00 H new ATOM 0 HH22 ARG A 541 7.707 -3.858 -28.135 1.00 0.00 H new ATOM 1431 N THR A 542 10.657 -6.565 -19.812 1.00 0.00 N ATOM 1432 CA THR A 542 10.631 -6.876 -18.389 1.00 0.00 C ATOM 1433 C THR A 542 9.758 -5.839 -17.664 1.00 0.00 C ATOM 1434 O THR A 542 9.974 -4.633 -17.809 1.00 0.00 O ATOM 1435 CB THR A 542 12.082 -6.876 -17.816 1.00 0.00 C ATOM 1436 OG1 THR A 542 12.857 -7.906 -18.457 1.00 0.00 O ATOM 1437 CG2 THR A 542 12.129 -7.068 -16.292 1.00 0.00 C ATOM 0 H THR A 542 11.448 -5.982 -20.084 1.00 0.00 H new ATOM 0 HA THR A 542 10.206 -7.868 -18.235 1.00 0.00 H new ATOM 0 HB THR A 542 12.504 -5.893 -18.025 1.00 0.00 H new ATOM 0 HG1 THR A 542 13.093 -7.621 -19.364 1.00 0.00 H new ATOM 0 HG21 THR A 542 13.166 -7.059 -15.956 1.00 0.00 H new ATOM 0 HG22 THR A 542 11.583 -6.259 -15.806 1.00 0.00 H new ATOM 0 HG23 THR A 542 11.672 -8.022 -16.031 1.00 0.00 H new ATOM 1445 N VAL A 543 8.761 -6.329 -16.919 1.00 0.00 N ATOM 1446 CA VAL A 543 7.816 -5.501 -16.160 1.00 0.00 C ATOM 1447 C VAL A 543 8.009 -5.782 -14.661 1.00 0.00 C ATOM 1448 O VAL A 543 7.817 -6.910 -14.224 1.00 0.00 O ATOM 1449 CB VAL A 543 6.324 -5.832 -16.574 1.00 0.00 C ATOM 1450 CG1 VAL A 543 5.310 -4.899 -15.857 1.00 0.00 C ATOM 1451 CG2 VAL A 543 6.142 -5.792 -18.116 1.00 0.00 C ATOM 0 H VAL A 543 8.585 -7.329 -16.825 1.00 0.00 H new ATOM 0 HA VAL A 543 8.006 -4.450 -16.376 1.00 0.00 H new ATOM 0 HB VAL A 543 6.114 -6.850 -16.245 1.00 0.00 H new ATOM 0 HG11 VAL A 543 4.297 -5.156 -16.166 1.00 0.00 H new ATOM 0 HG12 VAL A 543 5.402 -5.022 -14.778 1.00 0.00 H new ATOM 0 HG13 VAL A 543 5.518 -3.863 -16.123 1.00 0.00 H new ATOM 0 HG21 VAL A 543 5.107 -6.024 -18.366 1.00 0.00 H new ATOM 0 HG22 VAL A 543 6.391 -4.797 -18.486 1.00 0.00 H new ATOM 0 HG23 VAL A 543 6.800 -6.527 -18.579 1.00 0.00 H new ATOM 1461 N LEU A 544 8.400 -4.770 -13.881 1.00 0.00 N ATOM 1462 CA LEU A 544 8.513 -4.896 -12.418 1.00 0.00 C ATOM 1463 C LEU A 544 7.156 -4.547 -11.787 1.00 0.00 C ATOM 1464 O LEU A 544 6.524 -3.550 -12.145 1.00 0.00 O ATOM 1465 CB LEU A 544 9.642 -3.992 -11.856 1.00 0.00 C ATOM 1466 CG LEU A 544 9.939 -4.112 -10.319 1.00 0.00 C ATOM 1467 CD1 LEU A 544 10.162 -5.579 -9.881 1.00 0.00 C ATOM 1468 CD2 LEU A 544 11.141 -3.234 -9.932 1.00 0.00 C ATOM 0 H LEU A 544 8.646 -3.847 -14.238 1.00 0.00 H new ATOM 0 HA LEU A 544 8.779 -5.922 -12.165 1.00 0.00 H new ATOM 0 HB2 LEU A 544 10.560 -4.216 -12.399 1.00 0.00 H new ATOM 0 HB3 LEU A 544 9.388 -2.955 -12.074 1.00 0.00 H new ATOM 0 HG LEU A 544 9.058 -3.752 -9.788 1.00 0.00 H new ATOM 0 HD11 LEU A 544 10.364 -5.612 -8.810 1.00 0.00 H new ATOM 0 HD12 LEU A 544 9.269 -6.164 -10.100 1.00 0.00 H new ATOM 0 HD13 LEU A 544 11.011 -5.996 -10.424 1.00 0.00 H new ATOM 0 HD21 LEU A 544 11.332 -3.330 -8.863 1.00 0.00 H new ATOM 0 HD22 LEU A 544 12.021 -3.556 -10.488 1.00 0.00 H new ATOM 0 HD23 LEU A 544 10.923 -2.193 -10.170 1.00 0.00 H new ATOM 1480 N VAL A 545 6.716 -5.405 -10.873 1.00 0.00 N ATOM 1481 CA VAL A 545 5.463 -5.266 -10.131 1.00 0.00 C ATOM 1482 C VAL A 545 5.805 -5.081 -8.648 1.00 0.00 C ATOM 1483 O VAL A 545 6.763 -5.688 -8.170 1.00 0.00 O ATOM 1484 CB VAL A 545 4.573 -6.549 -10.364 1.00 0.00 C ATOM 1485 CG1 VAL A 545 3.362 -6.619 -9.409 1.00 0.00 C ATOM 1486 CG2 VAL A 545 4.114 -6.633 -11.842 1.00 0.00 C ATOM 0 H VAL A 545 7.237 -6.244 -10.618 1.00 0.00 H new ATOM 0 HA VAL A 545 4.896 -4.401 -10.475 1.00 0.00 H new ATOM 0 HB VAL A 545 5.199 -7.412 -10.137 1.00 0.00 H new ATOM 0 HG11 VAL A 545 2.787 -7.522 -9.616 1.00 0.00 H new ATOM 0 HG12 VAL A 545 3.713 -6.641 -8.377 1.00 0.00 H new ATOM 0 HG13 VAL A 545 2.730 -5.744 -9.559 1.00 0.00 H new ATOM 0 HG21 VAL A 545 3.502 -7.524 -11.983 1.00 0.00 H new ATOM 0 HG22 VAL A 545 3.529 -5.748 -12.092 1.00 0.00 H new ATOM 0 HG23 VAL A 545 4.988 -6.687 -12.492 1.00 0.00 H new ATOM 1496 N ASN A 546 5.038 -4.235 -7.930 1.00 0.00 N ATOM 1497 CA ASN A 546 5.272 -3.960 -6.495 1.00 0.00 C ATOM 1498 C ASN A 546 4.361 -4.824 -5.603 1.00 0.00 C ATOM 1499 O ASN A 546 3.714 -5.761 -6.090 1.00 0.00 O ATOM 1500 CB ASN A 546 5.131 -2.435 -6.186 1.00 0.00 C ATOM 1501 CG ASN A 546 3.779 -1.753 -6.491 1.00 0.00 C ATOM 1502 OD1 ASN A 546 2.636 -2.417 -6.295 1.00 0.00 O flip ATOM 1503 ND2 ASN A 546 3.762 -0.574 -6.834 1.00 0.00 N flip ATOM 0 H ASN A 546 4.246 -3.727 -8.323 1.00 0.00 H new ATOM 0 HA ASN A 546 6.299 -4.240 -6.259 1.00 0.00 H new ATOM 0 HB2 ASN A 546 5.348 -2.288 -5.128 1.00 0.00 H new ATOM 0 HB3 ASN A 546 5.904 -1.908 -6.746 1.00 0.00 H new ATOM 0 HD21 ASN A 546 4.638 -0.073 -6.982 1.00 0.00 H new ATOM 0 HD22 ASN A 546 2.872 -0.096 -6.971 1.00 0.00 H new ATOM 1510 N ALA A 547 4.295 -4.471 -4.297 1.00 0.00 N ATOM 1511 CA ALA A 547 3.541 -5.231 -3.276 1.00 0.00 C ATOM 1512 C ALA A 547 2.023 -5.292 -3.557 1.00 0.00 C ATOM 1513 O ALA A 547 1.388 -6.319 -3.315 1.00 0.00 O ATOM 1514 CB ALA A 547 3.810 -4.641 -1.884 1.00 0.00 C ATOM 0 H ALA A 547 4.766 -3.647 -3.922 1.00 0.00 H new ATOM 0 HA ALA A 547 3.898 -6.260 -3.317 1.00 0.00 H new ATOM 0 HB1 ALA A 547 3.252 -5.204 -1.136 1.00 0.00 H new ATOM 0 HB2 ALA A 547 4.876 -4.701 -1.663 1.00 0.00 H new ATOM 0 HB3 ALA A 547 3.493 -3.598 -1.863 1.00 0.00 H new ATOM 1520 N ASP A 548 1.456 -4.188 -4.082 1.00 0.00 N ATOM 1521 CA ASP A 548 0.001 -4.073 -4.378 1.00 0.00 C ATOM 1522 C ASP A 548 -0.419 -4.848 -5.641 1.00 0.00 C ATOM 1523 O ASP A 548 -1.605 -4.849 -5.996 1.00 0.00 O ATOM 1524 CB ASP A 548 -0.399 -2.584 -4.526 1.00 0.00 C ATOM 1525 CG ASP A 548 -0.275 -1.735 -3.247 1.00 0.00 C ATOM 1526 OD1 ASP A 548 0.141 -2.244 -2.175 1.00 0.00 O ATOM 1527 OD2 ASP A 548 -0.566 -0.524 -3.315 1.00 0.00 O ATOM 0 H ASP A 548 1.986 -3.349 -4.315 1.00 0.00 H new ATOM 0 HA ASP A 548 -0.524 -4.521 -3.534 1.00 0.00 H new ATOM 0 HB2 ASP A 548 0.221 -2.134 -5.301 1.00 0.00 H new ATOM 0 HB3 ASP A 548 -1.431 -2.536 -4.875 1.00 0.00 H new ATOM 1532 N GLY A 549 0.554 -5.496 -6.312 1.00 0.00 N ATOM 1533 CA GLY A 549 0.273 -6.305 -7.497 1.00 0.00 C ATOM 1534 C GLY A 549 0.064 -5.481 -8.767 1.00 0.00 C ATOM 1535 O GLY A 549 -0.428 -6.007 -9.770 1.00 0.00 O ATOM 0 H GLY A 549 1.539 -5.470 -6.047 1.00 0.00 H new ATOM 0 HA2 GLY A 549 1.098 -6.999 -7.656 1.00 0.00 H new ATOM 0 HA3 GLY A 549 -0.618 -6.906 -7.313 1.00 0.00 H new ATOM 1539 N GLU A 550 0.478 -4.199 -8.728 1.00 0.00 N ATOM 1540 CA GLU A 550 0.373 -3.278 -9.878 1.00 0.00 C ATOM 1541 C GLU A 550 1.726 -3.232 -10.620 1.00 0.00 C ATOM 1542 O GLU A 550 2.792 -3.396 -9.997 1.00 0.00 O ATOM 1543 CB GLU A 550 -0.045 -1.850 -9.392 1.00 0.00 C ATOM 1544 CG GLU A 550 1.104 -1.008 -8.795 1.00 0.00 C ATOM 1545 CD GLU A 550 0.633 0.132 -7.883 1.00 0.00 C ATOM 1546 OE1 GLU A 550 0.353 1.232 -8.390 1.00 0.00 O ATOM 1547 OE2 GLU A 550 0.556 -0.071 -6.646 1.00 0.00 O ATOM 0 H GLU A 550 0.894 -3.773 -7.900 1.00 0.00 H new ATOM 0 HA GLU A 550 -0.394 -3.637 -10.564 1.00 0.00 H new ATOM 0 HB2 GLU A 550 -0.476 -1.307 -10.233 1.00 0.00 H new ATOM 0 HB3 GLU A 550 -0.830 -1.952 -8.642 1.00 0.00 H new ATOM 0 HG2 GLU A 550 1.765 -1.664 -8.228 1.00 0.00 H new ATOM 0 HG3 GLU A 550 1.694 -0.588 -9.609 1.00 0.00 H new ATOM 1554 N GLU A 551 1.667 -2.999 -11.937 1.00 0.00 N ATOM 1555 CA GLU A 551 2.848 -2.875 -12.809 1.00 0.00 C ATOM 1556 C GLU A 551 3.488 -1.492 -12.604 1.00 0.00 C ATOM 1557 O GLU A 551 3.096 -0.511 -13.257 1.00 0.00 O ATOM 1558 CB GLU A 551 2.415 -3.079 -14.284 1.00 0.00 C ATOM 1559 CG GLU A 551 1.700 -4.412 -14.543 1.00 0.00 C ATOM 1560 CD GLU A 551 1.159 -4.543 -15.969 1.00 0.00 C ATOM 1561 OE1 GLU A 551 0.123 -3.916 -16.284 1.00 0.00 O ATOM 1562 OE2 GLU A 551 1.765 -5.260 -16.784 1.00 0.00 O ATOM 0 H GLU A 551 0.785 -2.889 -12.437 1.00 0.00 H new ATOM 0 HA GLU A 551 3.587 -3.636 -12.558 1.00 0.00 H new ATOM 0 HB2 GLU A 551 1.755 -2.262 -14.575 1.00 0.00 H new ATOM 0 HB3 GLU A 551 3.296 -3.020 -14.923 1.00 0.00 H new ATOM 0 HG2 GLU A 551 2.392 -5.231 -14.348 1.00 0.00 H new ATOM 0 HG3 GLU A 551 0.875 -4.517 -13.838 1.00 0.00 H new ATOM 1569 N VAL A 552 4.430 -1.423 -11.650 1.00 0.00 N ATOM 1570 CA VAL A 552 5.047 -0.161 -11.219 1.00 0.00 C ATOM 1571 C VAL A 552 6.084 0.342 -12.250 1.00 0.00 C ATOM 1572 O VAL A 552 6.232 1.551 -12.448 1.00 0.00 O ATOM 1573 CB VAL A 552 5.693 -0.305 -9.786 1.00 0.00 C ATOM 1574 CG1 VAL A 552 6.839 -1.353 -9.759 1.00 0.00 C ATOM 1575 CG2 VAL A 552 6.168 1.066 -9.232 1.00 0.00 C ATOM 0 H VAL A 552 4.785 -2.242 -11.156 1.00 0.00 H new ATOM 0 HA VAL A 552 4.257 0.587 -11.157 1.00 0.00 H new ATOM 0 HB VAL A 552 4.908 -0.675 -9.126 1.00 0.00 H new ATOM 0 HG11 VAL A 552 7.251 -1.416 -8.752 1.00 0.00 H new ATOM 0 HG12 VAL A 552 6.448 -2.327 -10.052 1.00 0.00 H new ATOM 0 HG13 VAL A 552 7.623 -1.053 -10.454 1.00 0.00 H new ATOM 0 HG21 VAL A 552 6.607 0.927 -8.244 1.00 0.00 H new ATOM 0 HG22 VAL A 552 6.914 1.491 -9.904 1.00 0.00 H new ATOM 0 HG23 VAL A 552 5.317 1.743 -9.159 1.00 0.00 H new ATOM 1585 N ALA A 553 6.769 -0.599 -12.925 1.00 0.00 N ATOM 1586 CA ALA A 553 7.836 -0.288 -13.902 1.00 0.00 C ATOM 1587 C ALA A 553 7.778 -1.272 -15.086 1.00 0.00 C ATOM 1588 O ALA A 553 7.235 -2.372 -14.957 1.00 0.00 O ATOM 1589 CB ALA A 553 9.222 -0.318 -13.215 1.00 0.00 C ATOM 0 H ALA A 553 6.600 -1.598 -12.810 1.00 0.00 H new ATOM 0 HA ALA A 553 7.677 0.718 -14.291 1.00 0.00 H new ATOM 0 HB1 ALA A 553 9.996 -0.087 -13.947 1.00 0.00 H new ATOM 0 HB2 ALA A 553 9.247 0.421 -12.415 1.00 0.00 H new ATOM 0 HB3 ALA A 553 9.400 -1.309 -12.799 1.00 0.00 H new ATOM 1595 N MET A 554 8.343 -0.854 -16.231 1.00 0.00 N ATOM 1596 CA MET A 554 8.389 -1.658 -17.472 1.00 0.00 C ATOM 1597 C MET A 554 9.543 -1.160 -18.359 1.00 0.00 C ATOM 1598 O MET A 554 9.842 0.041 -18.362 1.00 0.00 O ATOM 1599 CB MET A 554 7.026 -1.570 -18.221 1.00 0.00 C ATOM 1600 CG MET A 554 6.930 -2.397 -19.511 1.00 0.00 C ATOM 1601 SD MET A 554 5.262 -2.389 -20.212 1.00 0.00 S ATOM 1602 CE MET A 554 5.426 -3.585 -21.534 1.00 0.00 C ATOM 0 H MET A 554 8.786 0.060 -16.326 1.00 0.00 H new ATOM 0 HA MET A 554 8.566 -2.705 -17.224 1.00 0.00 H new ATOM 0 HB2 MET A 554 6.236 -1.893 -17.543 1.00 0.00 H new ATOM 0 HB3 MET A 554 6.831 -0.525 -18.464 1.00 0.00 H new ATOM 0 HG2 MET A 554 7.632 -2.002 -20.246 1.00 0.00 H new ATOM 0 HG3 MET A 554 7.229 -3.424 -19.304 1.00 0.00 H new ATOM 0 HE1 MET A 554 4.474 -3.684 -22.055 1.00 0.00 H new ATOM 0 HE2 MET A 554 6.190 -3.250 -22.235 1.00 0.00 H new ATOM 0 HE3 MET A 554 5.714 -4.550 -21.118 1.00 0.00 H new ATOM 1612 N ARG A 555 10.184 -2.084 -19.105 1.00 0.00 N ATOM 1613 CA ARG A 555 11.371 -1.767 -19.917 1.00 0.00 C ATOM 1614 C ARG A 555 11.587 -2.831 -21.021 1.00 0.00 C ATOM 1615 O ARG A 555 11.813 -4.008 -20.712 1.00 0.00 O ATOM 1616 CB ARG A 555 12.619 -1.674 -18.989 1.00 0.00 C ATOM 1617 CG ARG A 555 13.889 -1.140 -19.680 1.00 0.00 C ATOM 1618 CD ARG A 555 15.066 -0.971 -18.706 1.00 0.00 C ATOM 1619 NE ARG A 555 16.224 -0.339 -19.361 1.00 0.00 N ATOM 1620 CZ ARG A 555 17.380 -0.941 -19.656 1.00 0.00 C ATOM 1621 NH1 ARG A 555 17.581 -2.233 -19.387 1.00 0.00 N ATOM 1622 NH2 ARG A 555 18.345 -0.242 -20.229 1.00 0.00 N ATOM 0 H ARG A 555 9.895 -3.061 -19.160 1.00 0.00 H new ATOM 0 HA ARG A 555 11.218 -0.808 -20.411 1.00 0.00 H new ATOM 0 HB2 ARG A 555 12.381 -1.028 -18.144 1.00 0.00 H new ATOM 0 HB3 ARG A 555 12.830 -2.664 -18.584 1.00 0.00 H new ATOM 0 HG2 ARG A 555 14.178 -1.823 -20.478 1.00 0.00 H new ATOM 0 HG3 ARG A 555 13.668 -0.180 -20.147 1.00 0.00 H new ATOM 0 HD2 ARG A 555 14.752 -0.365 -17.856 1.00 0.00 H new ATOM 0 HD3 ARG A 555 15.356 -1.945 -18.313 1.00 0.00 H new ATOM 0 HE ARG A 555 16.136 0.646 -19.612 1.00 0.00 H new ATOM 0 HH11 ARG A 555 16.843 -2.783 -18.947 1.00 0.00 H new ATOM 0 HH12 ARG A 555 18.472 -2.670 -19.622 1.00 0.00 H new ATOM 0 HH21 ARG A 555 18.203 0.746 -20.441 1.00 0.00 H new ATOM 0 HH22 ARG A 555 19.232 -0.690 -20.459 1.00 0.00 H new ATOM 1636 N THR A 556 11.520 -2.398 -22.302 1.00 0.00 N ATOM 1637 CA THR A 556 11.737 -3.272 -23.473 1.00 0.00 C ATOM 1638 C THR A 556 13.236 -3.305 -23.849 1.00 0.00 C ATOM 1639 O THR A 556 13.823 -2.281 -24.207 1.00 0.00 O ATOM 1640 CB THR A 556 10.875 -2.819 -24.705 1.00 0.00 C ATOM 1641 OG1 THR A 556 9.482 -2.826 -24.339 1.00 0.00 O ATOM 1642 CG2 THR A 556 11.078 -3.736 -25.935 1.00 0.00 C ATOM 0 H THR A 556 11.313 -1.430 -22.550 1.00 0.00 H new ATOM 0 HA THR A 556 11.416 -4.277 -23.198 1.00 0.00 H new ATOM 0 HB THR A 556 11.200 -1.816 -24.981 1.00 0.00 H new ATOM 0 HG1 THR A 556 8.941 -2.542 -25.105 1.00 0.00 H new ATOM 0 HG21 THR A 556 10.460 -3.381 -26.760 1.00 0.00 H new ATOM 0 HG22 THR A 556 12.126 -3.718 -26.233 1.00 0.00 H new ATOM 0 HG23 THR A 556 10.790 -4.756 -25.680 1.00 0.00 H new ATOM 1650 N VAL A 557 13.836 -4.497 -23.740 1.00 0.00 N ATOM 1651 CA VAL A 557 15.241 -4.756 -24.081 1.00 0.00 C ATOM 1652 C VAL A 557 15.320 -5.456 -25.445 1.00 0.00 C ATOM 1653 O VAL A 557 14.589 -6.412 -25.703 1.00 0.00 O ATOM 1654 CB VAL A 557 15.919 -5.630 -22.963 1.00 0.00 C ATOM 1655 CG1 VAL A 557 17.375 -6.054 -23.329 1.00 0.00 C ATOM 1656 CG2 VAL A 557 15.877 -4.873 -21.617 1.00 0.00 C ATOM 0 H VAL A 557 13.347 -5.327 -23.405 1.00 0.00 H new ATOM 0 HA VAL A 557 15.778 -3.810 -24.143 1.00 0.00 H new ATOM 0 HB VAL A 557 15.351 -6.556 -22.874 1.00 0.00 H new ATOM 0 HG11 VAL A 557 17.793 -6.655 -22.521 1.00 0.00 H new ATOM 0 HG12 VAL A 557 17.363 -6.640 -24.248 1.00 0.00 H new ATOM 0 HG13 VAL A 557 17.988 -5.164 -23.473 1.00 0.00 H new ATOM 0 HG21 VAL A 557 16.347 -5.480 -20.843 1.00 0.00 H new ATOM 0 HG22 VAL A 557 16.413 -3.929 -21.714 1.00 0.00 H new ATOM 0 HG23 VAL A 557 14.841 -4.675 -21.343 1.00 0.00 H new ATOM 1666 N LYS A 558 16.202 -4.940 -26.308 1.00 0.00 N ATOM 1667 CA LYS A 558 16.442 -5.441 -27.672 1.00 0.00 C ATOM 1668 C LYS A 558 17.965 -5.596 -27.858 1.00 0.00 C ATOM 1669 O LYS A 558 18.681 -4.593 -27.758 1.00 0.00 O ATOM 1670 CB LYS A 558 15.885 -4.415 -28.716 1.00 0.00 C ATOM 1671 CG LYS A 558 14.381 -4.053 -28.592 1.00 0.00 C ATOM 1672 CD LYS A 558 13.434 -5.203 -28.988 1.00 0.00 C ATOM 1673 CE LYS A 558 13.655 -5.683 -30.439 1.00 0.00 C ATOM 1674 NZ LYS A 558 13.469 -4.600 -31.436 1.00 0.00 N ATOM 0 H LYS A 558 16.787 -4.139 -26.073 1.00 0.00 H new ATOM 0 HA LYS A 558 15.941 -6.397 -27.820 1.00 0.00 H new ATOM 0 HB2 LYS A 558 16.466 -3.496 -28.635 1.00 0.00 H new ATOM 0 HB3 LYS A 558 16.059 -4.815 -29.715 1.00 0.00 H new ATOM 0 HG2 LYS A 558 14.171 -3.758 -27.564 1.00 0.00 H new ATOM 0 HG3 LYS A 558 14.171 -3.188 -29.221 1.00 0.00 H new ATOM 0 HD2 LYS A 558 13.581 -6.041 -28.306 1.00 0.00 H new ATOM 0 HD3 LYS A 558 12.401 -4.874 -28.871 1.00 0.00 H new ATOM 0 HE2 LYS A 558 14.662 -6.089 -30.533 1.00 0.00 H new ATOM 0 HE3 LYS A 558 12.962 -6.495 -30.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 558 13.596 -4.985 -32.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 558 12.511 -4.205 -31.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 558 14.170 -3.850 -31.269 1.00 0.00 H new ATOM 1688 N LYS A 559 18.465 -6.831 -28.102 1.00 0.00 N ATOM 1689 CA LYS A 559 19.906 -7.061 -28.360 1.00 0.00 C ATOM 1690 C LYS A 559 20.295 -6.417 -29.705 1.00 0.00 C ATOM 1691 O LYS A 559 20.051 -6.984 -30.772 1.00 0.00 O ATOM 1692 CB LYS A 559 20.268 -8.581 -28.356 1.00 0.00 C ATOM 1693 CG LYS A 559 21.779 -8.872 -28.590 1.00 0.00 C ATOM 1694 CD LYS A 559 22.158 -10.368 -28.427 1.00 0.00 C ATOM 1695 CE LYS A 559 21.571 -11.279 -29.523 1.00 0.00 C ATOM 1696 NZ LYS A 559 21.925 -12.708 -29.324 1.00 0.00 N ATOM 0 H LYS A 559 17.896 -7.677 -28.125 1.00 0.00 H new ATOM 0 HA LYS A 559 20.473 -6.597 -27.552 1.00 0.00 H new ATOM 0 HB2 LYS A 559 19.969 -9.013 -27.401 1.00 0.00 H new ATOM 0 HB3 LYS A 559 19.687 -9.084 -29.129 1.00 0.00 H new ATOM 0 HG2 LYS A 559 22.052 -8.544 -29.593 1.00 0.00 H new ATOM 0 HG3 LYS A 559 22.367 -8.279 -27.890 1.00 0.00 H new ATOM 0 HD2 LYS A 559 23.244 -10.461 -28.433 1.00 0.00 H new ATOM 0 HD3 LYS A 559 21.813 -10.717 -27.454 1.00 0.00 H new ATOM 0 HE2 LYS A 559 20.486 -11.175 -29.535 1.00 0.00 H new ATOM 0 HE3 LYS A 559 21.934 -10.950 -30.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 559 21.104 -13.304 -29.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 559 22.718 -12.959 -29.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 559 22.201 -12.862 -28.333 1.00 0.00 H new