USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=24 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 532 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 533 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 467 GLN : amide:sc= -0.282 K(o=0.15,f=-0.59) USER MOD Set 2.2: A 510 THR OG1 : rot 77:sc= 0.431 USER MOD Set 3.1: A 455 SER OG : rot 180:sc= 0.458 USER MOD Set 3.2: A 471 ASN : amide:sc= 0.512 X(o=0.97,f=0.81) USER MOD Set 4.1: A 453 SER OG : rot 49:sc= 0.522 USER MOD Set 4.2: A 470 ASN : amide:sc= -0.595 X(o=2.3,f=2) USER MOD Set 4.3: A 472 SER OG : rot 92:sc= 0.931 USER MOD Set 4.4: A 474 LYS NZ :NH3+ -134:sc= 0.6 (180deg=-0.478) USER MOD Set 4.5: A 476 GLN : amide:sc= 0.82 K(o=2.3,f=-2.4) USER MOD Single : A 464 LYS NZ :NH3+ 174:sc= 0.532 (180deg=0.397) USER MOD Single : A 469 LYS NZ :NH3+ -178:sc= 0.83 (180deg=0.828) USER MOD Single : A 477 SER OG : rot 39:sc= 0.105 USER MOD Single : A 480 ASN : amide:sc= -1.92! K(o=-1.9!,f=-0.075) USER MOD Single : A 484 LYS NZ :NH3+ 149:sc= 0.751 (180deg=0.314) USER MOD Single : A 486 GLN : amide:sc= -0.642 K(o=-0.64,f=0) USER MOD Single : A 495 TYR OH : rot 30:sc= 0 USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 THR OG1 : rot -110:sc= -1.41 USER MOD Single : A 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 501 TYR OH : rot 25:sc= 0.513 USER MOD Single : A 507 GLN : amide:sc= -0.106 X(o=-0.11,f=-0.036) USER MOD Single : A 508 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 520 HIS : no HE2:sc= -1.81 K(o=-1.8,f=-4.5!) 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 531 GLN : amide:sc= 0.252 K(o=0.25,f=-5.9!) USER MOD Single : A 536 THR OG1 : rot -121:sc= -0.557 USER MOD Single : A 539 SER OG : rot -104:sc= 0.00105 USER MOD Single : A 542 THR OG1 : rot 100:sc= 0.161 USER MOD Single : A 546 ASN : amide:sc= -2.11 K(o=-2.1,f=-4.3!) USER MOD Single : A 554 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 556 THR OG1 : rot 130:sc= 0.343 USER MOD Single : A 558 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0159) USER MOD Single : A 559 LYS NZ :NH3+ -142:sc= 0.71 (180deg=-0.6) USER MOD ----------------------------------------------------------------- ATOM 40 N SER A 453 9.059 2.626 -6.079 1.00 0.00 N ATOM 41 CA SER A 453 10.151 2.659 -5.084 1.00 0.00 C ATOM 42 C SER A 453 11.459 2.214 -5.770 1.00 0.00 C ATOM 43 O SER A 453 12.503 2.848 -5.620 1.00 0.00 O ATOM 44 CB SER A 453 9.855 1.748 -3.869 1.00 0.00 C ATOM 45 OG SER A 453 10.924 1.766 -2.953 1.00 0.00 O ATOM 0 HA SER A 453 10.244 3.678 -4.707 1.00 0.00 H new ATOM 0 HB2 SER A 453 8.942 2.080 -3.375 1.00 0.00 H new ATOM 0 HB3 SER A 453 9.680 0.727 -4.209 1.00 0.00 H new ATOM 0 HG SER A 453 11.179 2.694 -2.766 1.00 0.00 H new ATOM 51 N VAL A 454 11.374 1.102 -6.531 1.00 0.00 N ATOM 52 CA VAL A 454 12.515 0.505 -7.251 1.00 0.00 C ATOM 53 C VAL A 454 12.249 0.608 -8.767 1.00 0.00 C ATOM 54 O VAL A 454 11.104 0.444 -9.204 1.00 0.00 O ATOM 55 CB VAL A 454 12.724 -1.005 -6.840 1.00 0.00 C ATOM 56 CG1 VAL A 454 14.044 -1.572 -7.411 1.00 0.00 C ATOM 57 CG2 VAL A 454 12.648 -1.206 -5.302 1.00 0.00 C ATOM 0 H VAL A 454 10.502 0.590 -6.663 1.00 0.00 H new ATOM 0 HA VAL A 454 13.424 1.047 -6.989 1.00 0.00 H new ATOM 0 HB VAL A 454 11.901 -1.568 -7.281 1.00 0.00 H new ATOM 0 HG11 VAL A 454 14.154 -2.613 -7.108 1.00 0.00 H new ATOM 0 HG12 VAL A 454 14.026 -1.511 -8.499 1.00 0.00 H new ATOM 0 HG13 VAL A 454 14.884 -0.992 -7.029 1.00 0.00 H new ATOM 0 HG21 VAL A 454 12.797 -2.259 -5.065 1.00 0.00 H new ATOM 0 HG22 VAL A 454 13.424 -0.612 -4.819 1.00 0.00 H new ATOM 0 HG23 VAL A 454 11.670 -0.888 -4.941 1.00 0.00 H new ATOM 67 N SER A 455 13.296 0.877 -9.562 1.00 0.00 N ATOM 68 CA SER A 455 13.195 0.967 -11.033 1.00 0.00 C ATOM 69 C SER A 455 14.149 -0.027 -11.701 1.00 0.00 C ATOM 70 O SER A 455 15.063 -0.555 -11.056 1.00 0.00 O ATOM 71 CB SER A 455 13.502 2.405 -11.497 1.00 0.00 C ATOM 72 OG SER A 455 14.770 2.852 -11.031 1.00 0.00 O ATOM 0 H SER A 455 14.238 1.039 -9.206 1.00 0.00 H new ATOM 0 HA SER A 455 12.177 0.713 -11.329 1.00 0.00 H new ATOM 0 HB2 SER A 455 13.479 2.448 -12.586 1.00 0.00 H new ATOM 0 HB3 SER A 455 12.724 3.077 -11.135 1.00 0.00 H new ATOM 0 HG SER A 455 14.931 3.766 -11.346 1.00 0.00 H new ATOM 78 N ILE A 456 13.929 -0.264 -13.004 1.00 0.00 N ATOM 79 CA ILE A 456 14.767 -1.158 -13.812 1.00 0.00 C ATOM 80 C ILE A 456 15.988 -0.372 -14.328 1.00 0.00 C ATOM 81 O ILE A 456 15.888 0.388 -15.305 1.00 0.00 O ATOM 82 CB ILE A 456 13.950 -1.782 -15.003 1.00 0.00 C ATOM 83 CG1 ILE A 456 12.618 -2.415 -14.480 1.00 0.00 C ATOM 84 CG2 ILE A 456 14.800 -2.828 -15.760 1.00 0.00 C ATOM 85 CD1 ILE A 456 11.695 -2.963 -15.556 1.00 0.00 C ATOM 0 H ILE A 456 13.163 0.161 -13.526 1.00 0.00 H new ATOM 0 HA ILE A 456 15.109 -1.986 -13.191 1.00 0.00 H new ATOM 0 HB ILE A 456 13.697 -0.986 -15.703 1.00 0.00 H new ATOM 0 HG12 ILE A 456 12.864 -3.222 -13.790 1.00 0.00 H new ATOM 0 HG13 ILE A 456 12.076 -1.661 -13.909 1.00 0.00 H new ATOM 0 HG21 ILE A 456 14.216 -3.247 -16.579 1.00 0.00 H new ATOM 0 HG22 ILE A 456 15.695 -2.350 -16.159 1.00 0.00 H new ATOM 0 HG23 ILE A 456 15.090 -3.626 -15.076 1.00 0.00 H new ATOM 0 HD11 ILE A 456 10.801 -3.379 -15.091 1.00 0.00 H new ATOM 0 HD12 ILE A 456 11.410 -2.159 -16.235 1.00 0.00 H new ATOM 0 HD13 ILE A 456 12.211 -3.744 -16.114 1.00 0.00 H new ATOM 97 N GLU A 457 17.120 -0.541 -13.627 1.00 0.00 N ATOM 98 CA GLU A 457 18.363 0.212 -13.885 1.00 0.00 C ATOM 99 C GLU A 457 19.000 -0.198 -15.224 1.00 0.00 C ATOM 100 O GLU A 457 19.188 0.632 -16.123 1.00 0.00 O ATOM 101 CB GLU A 457 19.376 -0.012 -12.728 1.00 0.00 C ATOM 102 CG GLU A 457 20.730 0.725 -12.884 1.00 0.00 C ATOM 103 CD GLU A 457 20.600 2.257 -12.931 1.00 0.00 C ATOM 104 OE1 GLU A 457 20.334 2.818 -14.020 1.00 0.00 O ATOM 105 OE2 GLU A 457 20.747 2.913 -11.883 1.00 0.00 O ATOM 0 H GLU A 457 17.202 -1.208 -12.860 1.00 0.00 H new ATOM 0 HA GLU A 457 18.106 1.270 -13.941 1.00 0.00 H new ATOM 0 HB2 GLU A 457 18.913 0.307 -11.794 1.00 0.00 H new ATOM 0 HB3 GLU A 457 19.571 -1.081 -12.639 1.00 0.00 H new ATOM 0 HG2 GLU A 457 21.381 0.450 -12.054 1.00 0.00 H new ATOM 0 HG3 GLU A 457 21.217 0.383 -13.797 1.00 0.00 H new ATOM 112 N GLU A 458 19.340 -1.497 -15.333 1.00 0.00 N ATOM 113 CA GLU A 458 19.966 -2.089 -16.530 1.00 0.00 C ATOM 114 C GLU A 458 19.304 -3.441 -16.818 1.00 0.00 C ATOM 115 O GLU A 458 18.664 -4.034 -15.937 1.00 0.00 O ATOM 116 CB GLU A 458 21.499 -2.298 -16.332 1.00 0.00 C ATOM 117 CG GLU A 458 22.289 -1.049 -15.920 1.00 0.00 C ATOM 118 CD GLU A 458 23.780 -1.338 -15.709 1.00 0.00 C ATOM 119 OE1 GLU A 458 24.174 -1.708 -14.581 1.00 0.00 O ATOM 120 OE2 GLU A 458 24.568 -1.198 -16.679 1.00 0.00 O ATOM 0 H GLU A 458 19.186 -2.172 -14.584 1.00 0.00 H new ATOM 0 HA GLU A 458 19.825 -1.404 -17.366 1.00 0.00 H new ATOM 0 HB2 GLU A 458 21.648 -3.067 -15.574 1.00 0.00 H new ATOM 0 HB3 GLU A 458 21.919 -2.681 -17.262 1.00 0.00 H new ATOM 0 HG2 GLU A 458 22.176 -0.283 -16.687 1.00 0.00 H new ATOM 0 HG3 GLU A 458 21.867 -0.644 -15.000 1.00 0.00 H new ATOM 127 N ILE A 459 19.451 -3.914 -18.061 1.00 0.00 N ATOM 128 CA ILE A 459 19.037 -5.262 -18.479 1.00 0.00 C ATOM 129 C ILE A 459 20.118 -5.813 -19.414 1.00 0.00 C ATOM 130 O ILE A 459 20.690 -5.060 -20.215 1.00 0.00 O ATOM 131 CB ILE A 459 17.642 -5.279 -19.225 1.00 0.00 C ATOM 132 CG1 ILE A 459 16.532 -4.611 -18.364 1.00 0.00 C ATOM 133 CG2 ILE A 459 17.226 -6.728 -19.609 1.00 0.00 C ATOM 134 CD1 ILE A 459 15.207 -4.429 -19.059 1.00 0.00 C ATOM 0 H ILE A 459 19.865 -3.366 -18.815 1.00 0.00 H new ATOM 0 HA ILE A 459 18.919 -5.874 -17.585 1.00 0.00 H new ATOM 0 HB ILE A 459 17.759 -4.701 -20.141 1.00 0.00 H new ATOM 0 HG12 ILE A 459 16.376 -5.214 -17.469 1.00 0.00 H new ATOM 0 HG13 ILE A 459 16.888 -3.635 -18.033 1.00 0.00 H new ATOM 0 HG21 ILE A 459 16.263 -6.707 -20.120 1.00 0.00 H new ATOM 0 HG22 ILE A 459 17.978 -7.160 -20.269 1.00 0.00 H new ATOM 0 HG23 ILE A 459 17.145 -7.334 -18.707 1.00 0.00 H new ATOM 0 HD11 ILE A 459 14.500 -3.956 -18.377 1.00 0.00 H new ATOM 0 HD12 ILE A 459 15.341 -3.798 -19.938 1.00 0.00 H new ATOM 0 HD13 ILE A 459 14.820 -5.401 -19.365 1.00 0.00 H new ATOM 146 N ASP A 460 20.404 -7.108 -19.283 1.00 0.00 N ATOM 147 CA ASP A 460 21.342 -7.816 -20.163 1.00 0.00 C ATOM 148 C ASP A 460 20.805 -7.897 -21.604 1.00 0.00 C ATOM 149 O ASP A 460 19.589 -7.970 -21.823 1.00 0.00 O ATOM 150 CB ASP A 460 21.609 -9.223 -19.592 1.00 0.00 C ATOM 151 CG ASP A 460 22.673 -10.012 -20.375 1.00 0.00 C ATOM 152 OD1 ASP A 460 23.878 -9.783 -20.161 1.00 0.00 O ATOM 153 OD2 ASP A 460 22.306 -10.864 -21.202 1.00 0.00 O ATOM 0 H ASP A 460 19.992 -7.700 -18.562 1.00 0.00 H new ATOM 0 HA ASP A 460 22.279 -7.260 -20.202 1.00 0.00 H new ATOM 0 HB2 ASP A 460 21.928 -9.131 -18.554 1.00 0.00 H new ATOM 0 HB3 ASP A 460 20.677 -9.788 -19.590 1.00 0.00 H new ATOM 158 N LEU A 461 21.740 -7.890 -22.563 1.00 0.00 N ATOM 159 CA LEU A 461 21.445 -7.908 -24.011 1.00 0.00 C ATOM 160 C LEU A 461 20.730 -9.217 -24.445 1.00 0.00 C ATOM 161 O LEU A 461 19.869 -9.187 -25.335 1.00 0.00 O ATOM 162 CB LEU A 461 22.730 -7.594 -24.878 1.00 0.00 C ATOM 163 CG LEU A 461 24.153 -7.665 -24.201 1.00 0.00 C ATOM 164 CD1 LEU A 461 24.476 -9.059 -23.620 1.00 0.00 C ATOM 165 CD2 LEU A 461 25.253 -7.198 -25.192 1.00 0.00 C ATOM 0 H LEU A 461 22.739 -7.871 -22.357 1.00 0.00 H new ATOM 0 HA LEU A 461 20.740 -7.100 -24.206 1.00 0.00 H new ATOM 0 HB2 LEU A 461 22.733 -8.285 -25.721 1.00 0.00 H new ATOM 0 HB3 LEU A 461 22.612 -6.591 -25.288 1.00 0.00 H new ATOM 0 HG LEU A 461 24.134 -6.981 -23.352 1.00 0.00 H new ATOM 0 HD11 LEU A 461 25.468 -9.044 -23.168 1.00 0.00 H new ATOM 0 HD12 LEU A 461 23.736 -9.318 -22.863 1.00 0.00 H new ATOM 0 HD13 LEU A 461 24.452 -9.800 -24.419 1.00 0.00 H new ATOM 0 HD21 LEU A 461 26.227 -7.254 -24.707 1.00 0.00 H new ATOM 0 HD22 LEU A 461 25.248 -7.842 -26.071 1.00 0.00 H new ATOM 0 HD23 LEU A 461 25.057 -6.169 -25.495 1.00 0.00 H new ATOM 177 N GLU A 462 21.094 -10.362 -23.834 1.00 0.00 N ATOM 178 CA GLU A 462 20.311 -11.618 -23.966 1.00 0.00 C ATOM 179 C GLU A 462 19.161 -11.634 -22.950 1.00 0.00 C ATOM 180 O GLU A 462 18.103 -12.200 -23.216 1.00 0.00 O ATOM 181 CB GLU A 462 21.183 -12.890 -23.747 1.00 0.00 C ATOM 182 CG GLU A 462 22.170 -13.222 -24.879 1.00 0.00 C ATOM 183 CD GLU A 462 23.334 -12.237 -25.000 1.00 0.00 C ATOM 184 OE1 GLU A 462 24.269 -12.315 -24.178 1.00 0.00 O ATOM 185 OE2 GLU A 462 23.316 -11.374 -25.916 1.00 0.00 O ATOM 0 H GLU A 462 21.922 -10.448 -23.245 1.00 0.00 H new ATOM 0 HA GLU A 462 19.925 -11.639 -24.985 1.00 0.00 H new ATOM 0 HB2 GLU A 462 21.747 -12.767 -22.822 1.00 0.00 H new ATOM 0 HB3 GLU A 462 20.520 -13.743 -23.605 1.00 0.00 H new ATOM 0 HG2 GLU A 462 22.570 -14.223 -24.716 1.00 0.00 H new ATOM 0 HG3 GLU A 462 21.628 -13.245 -25.824 1.00 0.00 H new ATOM 192 N GLY A 463 19.385 -10.995 -21.795 1.00 0.00 N ATOM 193 CA GLY A 463 18.445 -11.026 -20.674 1.00 0.00 C ATOM 194 C GLY A 463 18.808 -12.097 -19.648 1.00 0.00 C ATOM 195 O GLY A 463 17.924 -12.721 -19.057 1.00 0.00 O ATOM 0 H GLY A 463 20.223 -10.443 -21.614 1.00 0.00 H new ATOM 0 HA2 GLY A 463 18.429 -10.050 -20.188 1.00 0.00 H new ATOM 0 HA3 GLY A 463 17.439 -11.212 -21.050 1.00 0.00 H new ATOM 199 N LYS A 464 20.127 -12.295 -19.433 1.00 0.00 N ATOM 200 CA LYS A 464 20.652 -13.245 -18.432 1.00 0.00 C ATOM 201 C LYS A 464 20.429 -12.706 -17.010 1.00 0.00 C ATOM 202 O LYS A 464 20.459 -13.470 -16.040 1.00 0.00 O ATOM 203 CB LYS A 464 22.165 -13.514 -18.659 1.00 0.00 C ATOM 204 CG LYS A 464 22.517 -14.139 -20.030 1.00 0.00 C ATOM 205 CD LYS A 464 24.015 -14.520 -20.148 1.00 0.00 C ATOM 206 CE LYS A 464 24.972 -13.317 -20.034 1.00 0.00 C ATOM 207 NZ LYS A 464 24.813 -12.351 -21.155 1.00 0.00 N ATOM 0 H LYS A 464 20.855 -11.801 -19.948 1.00 0.00 H new ATOM 0 HA LYS A 464 20.111 -14.184 -18.548 1.00 0.00 H new ATOM 0 HB2 LYS A 464 22.706 -12.573 -18.555 1.00 0.00 H new ATOM 0 HB3 LYS A 464 22.524 -14.177 -17.871 1.00 0.00 H new ATOM 0 HG2 LYS A 464 21.907 -15.029 -20.186 1.00 0.00 H new ATOM 0 HG3 LYS A 464 22.262 -13.435 -20.822 1.00 0.00 H new ATOM 0 HD2 LYS A 464 24.259 -15.242 -19.369 1.00 0.00 H new ATOM 0 HD3 LYS A 464 24.180 -15.015 -21.105 1.00 0.00 H new ATOM 0 HE2 LYS A 464 24.794 -12.804 -19.089 1.00 0.00 H new ATOM 0 HE3 LYS A 464 26.001 -13.677 -20.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 25.404 -11.514 -20.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 25.107 -12.801 -22.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 23.816 -12.062 -21.226 1.00 0.00 H new ATOM 221 N PHE A 465 20.228 -11.377 -16.903 1.00 0.00 N ATOM 222 CA PHE A 465 19.976 -10.713 -15.621 1.00 0.00 C ATOM 223 C PHE A 465 19.126 -9.443 -15.800 1.00 0.00 C ATOM 224 O PHE A 465 19.007 -8.891 -16.908 1.00 0.00 O ATOM 225 CB PHE A 465 21.312 -10.409 -14.884 1.00 0.00 C ATOM 226 CG PHE A 465 22.169 -9.266 -15.436 1.00 0.00 C ATOM 227 CD1 PHE A 465 23.123 -9.491 -16.425 1.00 0.00 C ATOM 228 CD2 PHE A 465 22.013 -7.959 -14.967 1.00 0.00 C ATOM 229 CE1 PHE A 465 23.902 -8.455 -16.917 1.00 0.00 C ATOM 230 CE2 PHE A 465 22.789 -6.923 -15.461 1.00 0.00 C ATOM 231 CZ PHE A 465 23.728 -7.172 -16.443 1.00 0.00 C ATOM 0 H PHE A 465 20.237 -10.742 -17.702 1.00 0.00 H new ATOM 0 HA PHE A 465 19.400 -11.397 -14.998 1.00 0.00 H new ATOM 0 HB2 PHE A 465 21.081 -10.186 -13.843 1.00 0.00 H new ATOM 0 HB3 PHE A 465 21.915 -11.317 -14.889 1.00 0.00 H new ATOM 0 HD1 PHE A 465 23.258 -10.489 -16.815 1.00 0.00 H new ATOM 0 HD2 PHE A 465 21.275 -7.753 -14.206 1.00 0.00 H new ATOM 0 HE1 PHE A 465 24.647 -8.653 -17.673 1.00 0.00 H new ATOM 0 HE2 PHE A 465 22.660 -5.921 -15.079 1.00 0.00 H new ATOM 0 HZ PHE A 465 24.325 -6.363 -16.839 1.00 0.00 H new ATOM 241 N VAL A 466 18.540 -9.005 -14.674 1.00 0.00 N ATOM 242 CA VAL A 466 17.782 -7.760 -14.543 1.00 0.00 C ATOM 243 C VAL A 466 18.388 -6.969 -13.369 1.00 0.00 C ATOM 244 O VAL A 466 18.318 -7.412 -12.216 1.00 0.00 O ATOM 245 CB VAL A 466 16.248 -8.013 -14.259 1.00 0.00 C ATOM 246 CG1 VAL A 466 15.457 -6.676 -14.226 1.00 0.00 C ATOM 247 CG2 VAL A 466 15.639 -9.008 -15.277 1.00 0.00 C ATOM 0 H VAL A 466 18.585 -9.531 -13.801 1.00 0.00 H new ATOM 0 HA VAL A 466 17.847 -7.212 -15.483 1.00 0.00 H new ATOM 0 HB VAL A 466 16.166 -8.470 -13.273 1.00 0.00 H new ATOM 0 HG11 VAL A 466 14.405 -6.881 -14.029 1.00 0.00 H new ATOM 0 HG12 VAL A 466 15.856 -6.036 -13.439 1.00 0.00 H new ATOM 0 HG13 VAL A 466 15.555 -6.172 -15.187 1.00 0.00 H new ATOM 0 HG21 VAL A 466 14.583 -9.159 -15.052 1.00 0.00 H new ATOM 0 HG22 VAL A 466 15.741 -8.606 -16.285 1.00 0.00 H new ATOM 0 HG23 VAL A 466 16.163 -9.961 -15.212 1.00 0.00 H new ATOM 257 N GLN A 467 19.009 -5.825 -13.677 1.00 0.00 N ATOM 258 CA GLN A 467 19.536 -4.906 -12.659 1.00 0.00 C ATOM 259 C GLN A 467 18.412 -3.946 -12.235 1.00 0.00 C ATOM 260 O GLN A 467 17.864 -3.219 -13.068 1.00 0.00 O ATOM 261 CB GLN A 467 20.743 -4.107 -13.228 1.00 0.00 C ATOM 262 CG GLN A 467 21.401 -3.114 -12.246 1.00 0.00 C ATOM 263 CD GLN A 467 22.162 -3.800 -11.121 1.00 0.00 C ATOM 264 OE1 GLN A 467 21.598 -4.109 -10.068 1.00 0.00 O ATOM 265 NE2 GLN A 467 23.445 -4.058 -11.339 1.00 0.00 N ATOM 0 H GLN A 467 19.161 -5.510 -14.635 1.00 0.00 H new ATOM 0 HA GLN A 467 19.882 -5.472 -11.794 1.00 0.00 H new ATOM 0 HB2 GLN A 467 21.500 -4.815 -13.564 1.00 0.00 H new ATOM 0 HB3 GLN A 467 20.410 -3.556 -14.107 1.00 0.00 H new ATOM 0 HG2 GLN A 467 22.084 -2.467 -12.797 1.00 0.00 H new ATOM 0 HG3 GLN A 467 20.631 -2.473 -11.817 1.00 0.00 H new ATOM 0 HE21 GLN A 467 23.877 -3.787 -12.223 1.00 0.00 H new ATOM 0 HE22 GLN A 467 24.000 -4.527 -10.623 1.00 0.00 H new ATOM 274 N LEU A 468 18.050 -3.988 -10.947 1.00 0.00 N ATOM 275 CA LEU A 468 17.061 -3.085 -10.340 1.00 0.00 C ATOM 276 C LEU A 468 17.771 -2.191 -9.327 1.00 0.00 C ATOM 277 O LEU A 468 18.530 -2.699 -8.516 1.00 0.00 O ATOM 278 CB LEU A 468 15.960 -3.887 -9.614 1.00 0.00 C ATOM 279 CG LEU A 468 15.130 -4.882 -10.467 1.00 0.00 C ATOM 280 CD1 LEU A 468 14.091 -5.595 -9.587 1.00 0.00 C ATOM 281 CD2 LEU A 468 14.463 -4.178 -11.667 1.00 0.00 C ATOM 0 H LEU A 468 18.441 -4.660 -10.286 1.00 0.00 H new ATOM 0 HA LEU A 468 16.598 -2.488 -11.126 1.00 0.00 H new ATOM 0 HB2 LEU A 468 16.428 -4.445 -8.803 1.00 0.00 H new ATOM 0 HB3 LEU A 468 15.271 -3.177 -9.156 1.00 0.00 H new ATOM 0 HG LEU A 468 15.808 -5.632 -10.875 1.00 0.00 H new ATOM 0 HD11 LEU A 468 13.514 -6.291 -10.196 1.00 0.00 H new ATOM 0 HD12 LEU A 468 14.600 -6.143 -8.794 1.00 0.00 H new ATOM 0 HD13 LEU A 468 13.421 -4.858 -9.146 1.00 0.00 H new ATOM 0 HD21 LEU A 468 13.890 -4.905 -12.243 1.00 0.00 H new ATOM 0 HD22 LEU A 468 13.797 -3.395 -11.305 1.00 0.00 H new ATOM 0 HD23 LEU A 468 15.231 -3.736 -12.302 1.00 0.00 H new ATOM 293 N LYS A 469 17.496 -0.885 -9.352 1.00 0.00 N ATOM 294 CA LYS A 469 18.140 0.092 -8.454 1.00 0.00 C ATOM 295 C LYS A 469 17.070 0.722 -7.554 1.00 0.00 C ATOM 296 O LYS A 469 16.025 1.167 -8.040 1.00 0.00 O ATOM 297 CB LYS A 469 18.896 1.143 -9.322 1.00 0.00 C ATOM 298 CG LYS A 469 19.887 2.092 -8.593 1.00 0.00 C ATOM 299 CD LYS A 469 19.222 3.346 -7.964 1.00 0.00 C ATOM 300 CE LYS A 469 18.466 4.212 -8.997 1.00 0.00 C ATOM 301 NZ LYS A 469 19.347 4.698 -10.093 1.00 0.00 N ATOM 0 H LYS A 469 16.821 -0.469 -9.994 1.00 0.00 H new ATOM 0 HA LYS A 469 18.872 -0.384 -7.802 1.00 0.00 H new ATOM 0 HB2 LYS A 469 19.449 0.608 -10.094 1.00 0.00 H new ATOM 0 HB3 LYS A 469 18.153 1.758 -9.830 1.00 0.00 H new ATOM 0 HG2 LYS A 469 20.397 1.533 -7.808 1.00 0.00 H new ATOM 0 HG3 LYS A 469 20.650 2.416 -9.301 1.00 0.00 H new ATOM 0 HD2 LYS A 469 18.528 3.030 -7.186 1.00 0.00 H new ATOM 0 HD3 LYS A 469 19.988 3.953 -7.481 1.00 0.00 H new ATOM 0 HE2 LYS A 469 17.649 3.631 -9.424 1.00 0.00 H new ATOM 0 HE3 LYS A 469 18.018 5.067 -8.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 469 18.798 5.301 -10.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 469 20.132 5.248 -9.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 469 19.728 3.885 -10.618 1.00 0.00 H new ATOM 315 N ASN A 470 17.352 0.752 -6.238 1.00 0.00 N ATOM 316 CA ASN A 470 16.432 1.307 -5.221 1.00 0.00 C ATOM 317 C ASN A 470 16.521 2.841 -5.187 1.00 0.00 C ATOM 318 O ASN A 470 17.598 3.408 -4.976 1.00 0.00 O ATOM 319 CB ASN A 470 16.731 0.733 -3.804 1.00 0.00 C ATOM 320 CG ASN A 470 15.707 1.171 -2.745 1.00 0.00 C ATOM 321 OD1 ASN A 470 14.538 1.410 -3.054 1.00 0.00 O ATOM 322 ND2 ASN A 470 16.142 1.290 -1.496 1.00 0.00 N ATOM 0 H ASN A 470 18.223 0.393 -5.847 1.00 0.00 H new ATOM 0 HA ASN A 470 15.422 1.012 -5.504 1.00 0.00 H new ATOM 0 HB2 ASN A 470 16.747 -0.356 -3.856 1.00 0.00 H new ATOM 0 HB3 ASN A 470 17.726 1.052 -3.492 1.00 0.00 H new ATOM 0 HD21 ASN A 470 15.502 1.587 -0.759 1.00 0.00 H new ATOM 0 HD22 ASN A 470 17.116 1.084 -1.273 1.00 0.00 H new ATOM 329 N ASN A 471 15.360 3.490 -5.360 1.00 0.00 N ATOM 330 CA ASN A 471 15.232 4.961 -5.429 1.00 0.00 C ATOM 331 C ASN A 471 14.692 5.525 -4.097 1.00 0.00 C ATOM 332 O ASN A 471 14.258 6.677 -4.033 1.00 0.00 O ATOM 333 CB ASN A 471 14.286 5.343 -6.604 1.00 0.00 C ATOM 334 CG ASN A 471 14.699 4.709 -7.929 1.00 0.00 C ATOM 335 OD1 ASN A 471 15.444 5.292 -8.715 1.00 0.00 O ATOM 336 ND2 ASN A 471 14.213 3.501 -8.179 1.00 0.00 N ATOM 0 H ASN A 471 14.468 3.005 -5.458 1.00 0.00 H new ATOM 0 HA ASN A 471 16.216 5.395 -5.603 1.00 0.00 H new ATOM 0 HB2 ASN A 471 13.269 5.034 -6.360 1.00 0.00 H new ATOM 0 HB3 ASN A 471 14.272 6.427 -6.715 1.00 0.00 H new ATOM 0 HD21 ASN A 471 14.454 3.024 -9.048 1.00 0.00 H new ATOM 0 HD22 ASN A 471 13.598 3.049 -7.503 1.00 0.00 H new ATOM 343 N SER A 472 14.733 4.706 -3.031 1.00 0.00 N ATOM 344 CA SER A 472 14.246 5.102 -1.695 1.00 0.00 C ATOM 345 C SER A 472 15.342 5.823 -0.890 1.00 0.00 C ATOM 346 O SER A 472 16.531 5.529 -1.039 1.00 0.00 O ATOM 347 CB SER A 472 13.753 3.863 -0.920 1.00 0.00 C ATOM 348 OG SER A 472 12.706 3.211 -1.601 1.00 0.00 O ATOM 0 H SER A 472 15.102 3.756 -3.069 1.00 0.00 H new ATOM 0 HA SER A 472 13.416 5.795 -1.833 1.00 0.00 H new ATOM 0 HB2 SER A 472 14.582 3.170 -0.775 1.00 0.00 H new ATOM 0 HB3 SER A 472 13.412 4.164 0.071 1.00 0.00 H new ATOM 0 HG SER A 472 13.077 2.513 -2.181 1.00 0.00 H new ATOM 354 N ASP A 473 14.905 6.747 -0.013 1.00 0.00 N ATOM 355 CA ASP A 473 15.791 7.502 0.908 1.00 0.00 C ATOM 356 C ASP A 473 16.208 6.617 2.098 1.00 0.00 C ATOM 357 O ASP A 473 17.130 6.952 2.853 1.00 0.00 O ATOM 358 CB ASP A 473 15.051 8.762 1.423 1.00 0.00 C ATOM 359 CG ASP A 473 14.570 9.688 0.291 1.00 0.00 C ATOM 360 OD1 ASP A 473 13.509 9.406 -0.313 1.00 0.00 O ATOM 361 OD2 ASP A 473 15.252 10.685 -0.017 1.00 0.00 O ATOM 0 H ASP A 473 13.920 6.996 0.081 1.00 0.00 H new ATOM 0 HA ASP A 473 16.688 7.803 0.367 1.00 0.00 H new ATOM 0 HB2 ASP A 473 14.193 8.453 2.020 1.00 0.00 H new ATOM 0 HB3 ASP A 473 15.714 9.321 2.083 1.00 0.00 H new ATOM 366 N LYS A 474 15.501 5.488 2.248 1.00 0.00 N ATOM 367 CA LYS A 474 15.746 4.482 3.292 1.00 0.00 C ATOM 368 C LYS A 474 15.837 3.088 2.639 1.00 0.00 C ATOM 369 O LYS A 474 15.656 2.947 1.421 1.00 0.00 O ATOM 370 CB LYS A 474 14.619 4.524 4.377 1.00 0.00 C ATOM 371 CG LYS A 474 13.266 3.853 4.006 1.00 0.00 C ATOM 372 CD LYS A 474 12.563 4.456 2.768 1.00 0.00 C ATOM 373 CE LYS A 474 11.254 3.726 2.424 1.00 0.00 C ATOM 374 NZ LYS A 474 11.451 2.267 2.190 1.00 0.00 N ATOM 0 H LYS A 474 14.725 5.243 1.633 1.00 0.00 H new ATOM 0 HA LYS A 474 16.689 4.702 3.793 1.00 0.00 H new ATOM 0 HB2 LYS A 474 14.999 4.047 5.280 1.00 0.00 H new ATOM 0 HB3 LYS A 474 14.424 5.567 4.625 1.00 0.00 H new ATOM 0 HG2 LYS A 474 13.439 2.792 3.827 1.00 0.00 H new ATOM 0 HG3 LYS A 474 12.593 3.927 4.861 1.00 0.00 H new ATOM 0 HD2 LYS A 474 12.351 5.509 2.951 1.00 0.00 H new ATOM 0 HD3 LYS A 474 13.237 4.410 1.913 1.00 0.00 H new ATOM 0 HE2 LYS A 474 10.541 3.866 3.236 1.00 0.00 H new ATOM 0 HE3 LYS A 474 10.815 4.176 1.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 10.941 1.981 1.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 12.465 2.068 2.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 11.085 1.732 3.003 1.00 0.00 H new ATOM 388 N ASP A 475 16.145 2.075 3.447 1.00 0.00 N ATOM 389 CA ASP A 475 16.121 0.668 3.025 1.00 0.00 C ATOM 390 C ASP A 475 14.662 0.243 2.695 1.00 0.00 C ATOM 391 O ASP A 475 13.771 0.301 3.548 1.00 0.00 O ATOM 392 CB ASP A 475 16.763 -0.225 4.132 1.00 0.00 C ATOM 393 CG ASP A 475 16.014 -0.177 5.481 1.00 0.00 C ATOM 394 OD1 ASP A 475 16.157 0.823 6.217 1.00 0.00 O ATOM 395 OD2 ASP A 475 15.261 -1.123 5.802 1.00 0.00 O ATOM 0 H ASP A 475 16.421 2.204 4.421 1.00 0.00 H new ATOM 0 HA ASP A 475 16.711 0.538 2.118 1.00 0.00 H new ATOM 0 HB2 ASP A 475 16.795 -1.256 3.781 1.00 0.00 H new ATOM 0 HB3 ASP A 475 17.795 0.091 4.288 1.00 0.00 H new ATOM 400 N GLN A 476 14.416 -0.098 1.420 1.00 0.00 N ATOM 401 CA GLN A 476 13.103 -0.569 0.955 1.00 0.00 C ATOM 402 C GLN A 476 12.934 -2.070 1.254 1.00 0.00 C ATOM 403 O GLN A 476 13.652 -2.899 0.694 1.00 0.00 O ATOM 404 CB GLN A 476 12.923 -0.304 -0.567 1.00 0.00 C ATOM 405 CG GLN A 476 11.594 -0.835 -1.160 1.00 0.00 C ATOM 406 CD GLN A 476 10.340 -0.245 -0.504 1.00 0.00 C ATOM 407 OE1 GLN A 476 10.329 0.915 -0.065 1.00 0.00 O ATOM 408 NE2 GLN A 476 9.285 -1.044 -0.411 1.00 0.00 N ATOM 0 H GLN A 476 15.121 -0.055 0.684 1.00 0.00 H new ATOM 0 HA GLN A 476 12.336 -0.012 1.493 1.00 0.00 H new ATOM 0 HB2 GLN A 476 12.982 0.770 -0.745 1.00 0.00 H new ATOM 0 HB3 GLN A 476 13.754 -0.762 -1.103 1.00 0.00 H new ATOM 0 HG2 GLN A 476 11.571 -0.616 -2.227 1.00 0.00 H new ATOM 0 HG3 GLN A 476 11.570 -1.920 -1.057 1.00 0.00 H new ATOM 0 HE21 GLN A 476 9.329 -1.993 -0.783 1.00 0.00 H new ATOM 0 HE22 GLN A 476 8.430 -0.710 0.033 1.00 0.00 H new ATOM 417 N SER A 477 11.991 -2.397 2.151 1.00 0.00 N ATOM 418 CA SER A 477 11.607 -3.782 2.443 1.00 0.00 C ATOM 419 C SER A 477 10.919 -4.414 1.211 1.00 0.00 C ATOM 420 O SER A 477 9.804 -4.029 0.829 1.00 0.00 O ATOM 421 CB SER A 477 10.711 -3.829 3.703 1.00 0.00 C ATOM 422 OG SER A 477 9.601 -2.947 3.600 1.00 0.00 O ATOM 0 H SER A 477 11.474 -1.705 2.694 1.00 0.00 H new ATOM 0 HA SER A 477 12.498 -4.373 2.655 1.00 0.00 H new ATOM 0 HB2 SER A 477 10.352 -4.847 3.855 1.00 0.00 H new ATOM 0 HB3 SER A 477 11.303 -3.566 4.579 1.00 0.00 H new ATOM 0 HG SER A 477 9.255 -2.962 2.683 1.00 0.00 H new ATOM 428 N LEU A 478 11.628 -5.365 0.592 1.00 0.00 N ATOM 429 CA LEU A 478 11.226 -6.028 -0.663 1.00 0.00 C ATOM 430 C LEU A 478 10.674 -7.441 -0.336 1.00 0.00 C ATOM 431 O LEU A 478 10.755 -7.895 0.812 1.00 0.00 O ATOM 432 CB LEU A 478 12.473 -6.087 -1.616 1.00 0.00 C ATOM 433 CG LEU A 478 12.233 -5.698 -3.106 1.00 0.00 C ATOM 434 CD1 LEU A 478 11.736 -4.240 -3.225 1.00 0.00 C ATOM 435 CD2 LEU A 478 13.506 -5.923 -3.960 1.00 0.00 C ATOM 0 H LEU A 478 12.518 -5.706 0.955 1.00 0.00 H new ATOM 0 HA LEU A 478 10.436 -5.473 -1.169 1.00 0.00 H new ATOM 0 HB2 LEU A 478 13.242 -5.428 -1.212 1.00 0.00 H new ATOM 0 HB3 LEU A 478 12.875 -7.100 -1.589 1.00 0.00 H new ATOM 0 HG LEU A 478 11.454 -6.352 -3.497 1.00 0.00 H new ATOM 0 HD11 LEU A 478 11.576 -3.995 -4.275 1.00 0.00 H new ATOM 0 HD12 LEU A 478 10.798 -4.130 -2.680 1.00 0.00 H new ATOM 0 HD13 LEU A 478 12.482 -3.566 -2.804 1.00 0.00 H new ATOM 0 HD21 LEU A 478 13.305 -5.642 -4.994 1.00 0.00 H new ATOM 0 HD22 LEU A 478 14.319 -5.311 -3.569 1.00 0.00 H new ATOM 0 HD23 LEU A 478 13.791 -6.974 -3.918 1.00 0.00 H new ATOM 447 N GLY A 479 10.106 -8.125 -1.339 1.00 0.00 N ATOM 448 CA GLY A 479 9.579 -9.485 -1.142 1.00 0.00 C ATOM 449 C GLY A 479 8.351 -9.766 -1.974 1.00 0.00 C ATOM 450 O GLY A 479 8.357 -10.626 -2.859 1.00 0.00 O ATOM 0 H GLY A 479 10.000 -7.764 -2.287 1.00 0.00 H new ATOM 0 HA2 GLY A 479 10.354 -10.209 -1.392 1.00 0.00 H new ATOM 0 HA3 GLY A 479 9.338 -9.627 -0.088 1.00 0.00 H new ATOM 454 N ASN A 480 7.288 -9.009 -1.697 1.00 0.00 N ATOM 455 CA ASN A 480 6.008 -9.109 -2.430 1.00 0.00 C ATOM 456 C ASN A 480 6.149 -8.556 -3.870 1.00 0.00 C ATOM 457 O ASN A 480 5.252 -8.730 -4.707 1.00 0.00 O ATOM 458 CB ASN A 480 4.890 -8.373 -1.658 1.00 0.00 C ATOM 459 CG ASN A 480 4.501 -8.989 -0.300 1.00 0.00 C ATOM 460 OD1 ASN A 480 3.335 -8.938 0.095 1.00 0.00 O ATOM 461 ND2 ASN A 480 5.453 -9.544 0.441 1.00 0.00 N ATOM 0 H ASN A 480 7.282 -8.306 -0.958 1.00 0.00 H new ATOM 0 HA ASN A 480 5.735 -10.162 -2.507 1.00 0.00 H new ATOM 0 HB2 ASN A 480 5.205 -7.343 -1.492 1.00 0.00 H new ATOM 0 HB3 ASN A 480 4.001 -8.337 -2.288 1.00 0.00 H new ATOM 0 HD21 ASN A 480 5.224 -9.937 1.354 1.00 0.00 H new ATOM 0 HD22 ASN A 480 6.413 -9.577 0.097 1.00 0.00 H new ATOM 468 N TRP A 481 7.278 -7.863 -4.123 1.00 0.00 N ATOM 469 CA TRP A 481 7.666 -7.378 -5.454 1.00 0.00 C ATOM 470 C TRP A 481 8.043 -8.571 -6.347 1.00 0.00 C ATOM 471 O TRP A 481 8.589 -9.571 -5.858 1.00 0.00 O ATOM 472 CB TRP A 481 8.854 -6.389 -5.332 1.00 0.00 C ATOM 473 CG TRP A 481 8.501 -5.076 -4.660 1.00 0.00 C ATOM 474 CD1 TRP A 481 8.016 -4.892 -3.394 1.00 0.00 C ATOM 475 CD2 TRP A 481 8.624 -3.767 -5.230 1.00 0.00 C ATOM 476 NE1 TRP A 481 7.821 -3.559 -3.156 1.00 0.00 N ATOM 477 CE2 TRP A 481 8.185 -2.847 -4.264 1.00 0.00 C ATOM 478 CE3 TRP A 481 9.062 -3.288 -6.469 1.00 0.00 C ATOM 479 CZ2 TRP A 481 8.162 -1.478 -4.497 1.00 0.00 C ATOM 480 CZ3 TRP A 481 9.041 -1.928 -6.701 1.00 0.00 C ATOM 481 CH2 TRP A 481 8.594 -1.036 -5.721 1.00 0.00 C ATOM 0 H TRP A 481 7.952 -7.624 -3.396 1.00 0.00 H new ATOM 0 HA TRP A 481 6.826 -6.852 -5.908 1.00 0.00 H new ATOM 0 HB2 TRP A 481 9.655 -6.868 -4.770 1.00 0.00 H new ATOM 0 HB3 TRP A 481 9.244 -6.181 -6.329 1.00 0.00 H new ATOM 0 HD1 TRP A 481 7.816 -5.683 -2.686 1.00 0.00 H new ATOM 0 HE1 TRP A 481 7.461 -3.160 -2.289 1.00 0.00 H new ATOM 0 HE3 TRP A 481 9.410 -3.970 -7.230 1.00 0.00 H new ATOM 0 HZ2 TRP A 481 7.817 -0.787 -3.742 1.00 0.00 H new ATOM 0 HZ3 TRP A 481 9.375 -1.546 -7.654 1.00 0.00 H new ATOM 0 HH2 TRP A 481 8.589 0.023 -5.933 1.00 0.00 H new ATOM 492 N ARG A 482 7.752 -8.452 -7.652 1.00 0.00 N ATOM 493 CA ARG A 482 7.924 -9.545 -8.621 1.00 0.00 C ATOM 494 C ARG A 482 8.278 -8.994 -10.020 1.00 0.00 C ATOM 495 O ARG A 482 7.571 -8.145 -10.564 1.00 0.00 O ATOM 496 CB ARG A 482 6.642 -10.444 -8.642 1.00 0.00 C ATOM 497 CG ARG A 482 5.293 -9.677 -8.575 1.00 0.00 C ATOM 498 CD ARG A 482 4.074 -10.613 -8.438 1.00 0.00 C ATOM 499 NE ARG A 482 2.810 -9.872 -8.204 1.00 0.00 N ATOM 500 CZ ARG A 482 1.623 -10.158 -8.777 1.00 0.00 C ATOM 501 NH1 ARG A 482 1.527 -11.068 -9.745 1.00 0.00 N ATOM 502 NH2 ARG A 482 0.542 -9.494 -8.399 1.00 0.00 N ATOM 0 H ARG A 482 7.390 -7.593 -8.066 1.00 0.00 H new ATOM 0 HA ARG A 482 8.763 -10.169 -8.312 1.00 0.00 H new ATOM 0 HB2 ARG A 482 6.655 -11.045 -9.551 1.00 0.00 H new ATOM 0 HB3 ARG A 482 6.690 -11.136 -7.801 1.00 0.00 H new ATOM 0 HG2 ARG A 482 5.314 -8.990 -7.729 1.00 0.00 H new ATOM 0 HG3 ARG A 482 5.180 -9.072 -9.475 1.00 0.00 H new ATOM 0 HD2 ARG A 482 3.977 -11.213 -9.343 1.00 0.00 H new ATOM 0 HD3 ARG A 482 4.243 -11.306 -7.613 1.00 0.00 H new ATOM 0 HE ARG A 482 2.841 -9.083 -7.558 1.00 0.00 H new ATOM 0 HH11 ARG A 482 2.360 -11.562 -10.065 1.00 0.00 H new ATOM 0 HH12 ARG A 482 0.620 -11.271 -10.166 1.00 0.00 H new ATOM 0 HH21 ARG A 482 0.611 -8.773 -7.680 1.00 0.00 H new ATOM 0 HH22 ARG A 482 -0.360 -9.703 -8.826 1.00 0.00 H new ATOM 516 N ILE A 483 9.401 -9.484 -10.579 1.00 0.00 N ATOM 517 CA ILE A 483 9.863 -9.124 -11.923 1.00 0.00 C ATOM 518 C ILE A 483 9.208 -10.059 -12.950 1.00 0.00 C ATOM 519 O ILE A 483 9.430 -11.274 -12.904 1.00 0.00 O ATOM 520 CB ILE A 483 11.421 -9.264 -12.071 1.00 0.00 C ATOM 521 CG1 ILE A 483 12.179 -8.645 -10.864 1.00 0.00 C ATOM 522 CG2 ILE A 483 11.907 -8.646 -13.412 1.00 0.00 C ATOM 523 CD1 ILE A 483 13.684 -8.898 -10.878 1.00 0.00 C ATOM 0 H ILE A 483 10.014 -10.145 -10.103 1.00 0.00 H new ATOM 0 HA ILE A 483 9.587 -8.083 -12.093 1.00 0.00 H new ATOM 0 HB ILE A 483 11.651 -10.329 -12.081 1.00 0.00 H new ATOM 0 HG12 ILE A 483 12.002 -7.570 -10.850 1.00 0.00 H new ATOM 0 HG13 ILE A 483 11.762 -9.048 -9.941 1.00 0.00 H new ATOM 0 HG21 ILE A 483 12.989 -8.755 -13.492 1.00 0.00 H new ATOM 0 HG22 ILE A 483 11.428 -9.161 -14.245 1.00 0.00 H new ATOM 0 HG23 ILE A 483 11.646 -7.588 -13.441 1.00 0.00 H new ATOM 0 HD11 ILE A 483 14.139 -8.434 -10.003 1.00 0.00 H new ATOM 0 HD12 ILE A 483 13.873 -9.971 -10.859 1.00 0.00 H new ATOM 0 HD13 ILE A 483 14.117 -8.470 -11.782 1.00 0.00 H new ATOM 535 N LYS A 484 8.405 -9.496 -13.853 1.00 0.00 N ATOM 536 CA LYS A 484 7.903 -10.210 -15.030 1.00 0.00 C ATOM 537 C LYS A 484 8.946 -10.149 -16.162 1.00 0.00 C ATOM 538 O LYS A 484 9.747 -9.208 -16.242 1.00 0.00 O ATOM 539 CB LYS A 484 6.556 -9.601 -15.494 1.00 0.00 C ATOM 540 CG LYS A 484 5.421 -9.725 -14.456 1.00 0.00 C ATOM 541 CD LYS A 484 4.119 -9.031 -14.913 1.00 0.00 C ATOM 542 CE LYS A 484 2.963 -9.213 -13.907 1.00 0.00 C ATOM 543 NZ LYS A 484 1.748 -8.448 -14.293 1.00 0.00 N ATOM 0 H LYS A 484 8.083 -8.530 -13.790 1.00 0.00 H new ATOM 0 HA LYS A 484 7.732 -11.254 -14.768 1.00 0.00 H new ATOM 0 HB2 LYS A 484 6.707 -8.547 -15.728 1.00 0.00 H new ATOM 0 HB3 LYS A 484 6.246 -10.091 -16.417 1.00 0.00 H new ATOM 0 HG2 LYS A 484 5.219 -10.780 -14.268 1.00 0.00 H new ATOM 0 HG3 LYS A 484 5.748 -9.290 -13.512 1.00 0.00 H new ATOM 0 HD2 LYS A 484 4.309 -7.967 -15.053 1.00 0.00 H new ATOM 0 HD3 LYS A 484 3.819 -9.432 -15.881 1.00 0.00 H new ATOM 0 HE2 LYS A 484 2.714 -10.271 -13.832 1.00 0.00 H new ATOM 0 HE3 LYS A 484 3.292 -8.892 -12.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 0.901 -8.953 -13.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 1.780 -7.504 -13.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 1.713 -8.352 -15.328 1.00 0.00 H new ATOM 557 N ARG A 485 8.921 -11.168 -17.017 1.00 0.00 N ATOM 558 CA ARG A 485 9.794 -11.286 -18.186 1.00 0.00 C ATOM 559 C ARG A 485 9.036 -12.086 -19.254 1.00 0.00 C ATOM 560 O ARG A 485 8.869 -13.297 -19.122 1.00 0.00 O ATOM 561 CB ARG A 485 11.132 -11.977 -17.790 1.00 0.00 C ATOM 562 CG ARG A 485 12.037 -12.405 -18.970 1.00 0.00 C ATOM 563 CD ARG A 485 12.520 -11.234 -19.845 1.00 0.00 C ATOM 564 NE ARG A 485 13.442 -10.325 -19.137 1.00 0.00 N ATOM 565 CZ ARG A 485 14.768 -10.513 -19.007 1.00 0.00 C ATOM 566 NH1 ARG A 485 15.342 -11.623 -19.440 1.00 0.00 N ATOM 567 NH2 ARG A 485 15.511 -9.574 -18.439 1.00 0.00 N ATOM 0 H ARG A 485 8.279 -11.954 -16.916 1.00 0.00 H new ATOM 0 HA ARG A 485 10.051 -10.304 -18.583 1.00 0.00 H new ATOM 0 HB2 ARG A 485 11.696 -11.298 -17.151 1.00 0.00 H new ATOM 0 HB3 ARG A 485 10.902 -12.859 -17.193 1.00 0.00 H new ATOM 0 HG2 ARG A 485 12.905 -12.933 -18.576 1.00 0.00 H new ATOM 0 HG3 ARG A 485 11.491 -13.112 -19.595 1.00 0.00 H new ATOM 0 HD2 ARG A 485 13.018 -11.631 -20.730 1.00 0.00 H new ATOM 0 HD3 ARG A 485 11.656 -10.667 -20.193 1.00 0.00 H new ATOM 0 HE ARG A 485 13.043 -9.488 -18.713 1.00 0.00 H new ATOM 0 HH11 ARG A 485 14.778 -12.351 -19.879 1.00 0.00 H new ATOM 0 HH12 ARG A 485 16.348 -11.751 -19.335 1.00 0.00 H new ATOM 0 HH21 ARG A 485 15.077 -8.714 -18.103 1.00 0.00 H new ATOM 0 HH22 ARG A 485 16.517 -9.711 -18.338 1.00 0.00 H new ATOM 581 N GLN A 486 8.542 -11.385 -20.284 1.00 0.00 N ATOM 582 CA GLN A 486 7.772 -11.979 -21.384 1.00 0.00 C ATOM 583 C GLN A 486 8.538 -11.804 -22.702 1.00 0.00 C ATOM 584 O GLN A 486 8.569 -10.708 -23.263 1.00 0.00 O ATOM 585 CB GLN A 486 6.373 -11.317 -21.463 1.00 0.00 C ATOM 586 CG GLN A 486 5.450 -11.888 -22.563 1.00 0.00 C ATOM 587 CD GLN A 486 4.111 -11.169 -22.712 1.00 0.00 C ATOM 588 OE1 GLN A 486 3.103 -11.784 -23.056 1.00 0.00 O ATOM 589 NE2 GLN A 486 4.081 -9.861 -22.470 1.00 0.00 N ATOM 0 H GLN A 486 8.668 -10.377 -20.377 1.00 0.00 H new ATOM 0 HA GLN A 486 7.636 -13.045 -21.203 1.00 0.00 H new ATOM 0 HB2 GLN A 486 5.878 -11.429 -20.498 1.00 0.00 H new ATOM 0 HB3 GLN A 486 6.501 -10.248 -21.634 1.00 0.00 H new ATOM 0 HG2 GLN A 486 5.976 -11.847 -23.517 1.00 0.00 H new ATOM 0 HG3 GLN A 486 5.260 -12.940 -22.348 1.00 0.00 H new ATOM 0 HE21 GLN A 486 4.932 -9.375 -22.186 1.00 0.00 H new ATOM 0 HE22 GLN A 486 3.207 -9.344 -22.568 1.00 0.00 H new ATOM 598 N VAL A 487 9.167 -12.893 -23.178 1.00 0.00 N ATOM 599 CA VAL A 487 9.942 -12.897 -24.426 1.00 0.00 C ATOM 600 C VAL A 487 9.010 -13.146 -25.619 1.00 0.00 C ATOM 601 O VAL A 487 7.943 -13.759 -25.478 1.00 0.00 O ATOM 602 CB VAL A 487 11.088 -13.990 -24.423 1.00 0.00 C ATOM 603 CG1 VAL A 487 12.137 -13.749 -25.544 1.00 0.00 C ATOM 604 CG2 VAL A 487 11.783 -14.071 -23.044 1.00 0.00 C ATOM 0 H VAL A 487 9.151 -13.796 -22.705 1.00 0.00 H new ATOM 0 HA VAL A 487 10.416 -11.919 -24.511 1.00 0.00 H new ATOM 0 HB VAL A 487 10.605 -14.946 -24.626 1.00 0.00 H new ATOM 0 HG11 VAL A 487 12.901 -14.525 -25.500 1.00 0.00 H new ATOM 0 HG12 VAL A 487 11.645 -13.780 -26.516 1.00 0.00 H new ATOM 0 HG13 VAL A 487 12.602 -12.773 -25.404 1.00 0.00 H new ATOM 0 HG21 VAL A 487 12.565 -14.830 -23.074 1.00 0.00 H new ATOM 0 HG22 VAL A 487 12.225 -13.105 -22.802 1.00 0.00 H new ATOM 0 HG23 VAL A 487 11.050 -14.335 -22.282 1.00 0.00 H new ATOM 614 N LEU A 488 9.446 -12.661 -26.777 1.00 0.00 N ATOM 615 CA LEU A 488 8.846 -12.938 -28.081 1.00 0.00 C ATOM 616 C LEU A 488 8.709 -14.459 -28.325 1.00 0.00 C ATOM 617 O LEU A 488 7.679 -14.939 -28.833 1.00 0.00 O ATOM 618 CB LEU A 488 9.743 -12.314 -29.175 1.00 0.00 C ATOM 619 CG LEU A 488 9.390 -12.692 -30.636 1.00 0.00 C ATOM 620 CD1 LEU A 488 7.993 -12.170 -31.049 1.00 0.00 C ATOM 621 CD2 LEU A 488 10.486 -12.228 -31.624 1.00 0.00 C ATOM 0 H LEU A 488 10.255 -12.043 -26.837 1.00 0.00 H new ATOM 0 HA LEU A 488 7.846 -12.505 -28.111 1.00 0.00 H new ATOM 0 HB2 LEU A 488 9.698 -11.229 -29.080 1.00 0.00 H new ATOM 0 HB3 LEU A 488 10.775 -12.608 -28.983 1.00 0.00 H new ATOM 0 HG LEU A 488 9.349 -13.780 -30.682 1.00 0.00 H new ATOM 0 HD11 LEU A 488 7.787 -12.458 -32.080 1.00 0.00 H new ATOM 0 HD12 LEU A 488 7.235 -12.600 -30.394 1.00 0.00 H new ATOM 0 HD13 LEU A 488 7.971 -11.084 -30.964 1.00 0.00 H new ATOM 0 HD21 LEU A 488 10.204 -12.510 -32.638 1.00 0.00 H new ATOM 0 HD22 LEU A 488 10.594 -11.145 -31.565 1.00 0.00 H new ATOM 0 HD23 LEU A 488 11.433 -12.702 -31.365 1.00 0.00 H new ATOM 633 N GLU A 489 9.772 -15.202 -27.968 1.00 0.00 N ATOM 634 CA GLU A 489 9.843 -16.668 -28.140 1.00 0.00 C ATOM 635 C GLU A 489 8.763 -17.398 -27.317 1.00 0.00 C ATOM 636 O GLU A 489 8.368 -18.522 -27.659 1.00 0.00 O ATOM 637 CB GLU A 489 11.269 -17.197 -27.790 1.00 0.00 C ATOM 638 CG GLU A 489 12.353 -16.907 -28.857 1.00 0.00 C ATOM 639 CD GLU A 489 12.766 -15.424 -28.975 1.00 0.00 C ATOM 640 OE1 GLU A 489 12.159 -14.679 -29.765 1.00 0.00 O ATOM 641 OE2 GLU A 489 13.713 -15.010 -28.287 1.00 0.00 O ATOM 0 H GLU A 489 10.612 -14.802 -27.549 1.00 0.00 H new ATOM 0 HA GLU A 489 9.645 -16.884 -29.190 1.00 0.00 H new ATOM 0 HB2 GLU A 489 11.583 -16.754 -26.845 1.00 0.00 H new ATOM 0 HB3 GLU A 489 11.213 -18.274 -27.634 1.00 0.00 H new ATOM 0 HG2 GLU A 489 13.239 -17.499 -28.625 1.00 0.00 H new ATOM 0 HG3 GLU A 489 11.988 -17.246 -29.827 1.00 0.00 H new ATOM 648 N GLY A 490 8.277 -16.759 -26.238 1.00 0.00 N ATOM 649 CA GLY A 490 7.147 -17.300 -25.477 1.00 0.00 C ATOM 650 C GLY A 490 7.314 -17.296 -23.962 1.00 0.00 C ATOM 651 O GLY A 490 6.301 -17.337 -23.256 1.00 0.00 O ATOM 0 H GLY A 490 8.647 -15.878 -25.880 1.00 0.00 H new ATOM 0 HA2 GLY A 490 6.255 -16.727 -25.728 1.00 0.00 H new ATOM 0 HA3 GLY A 490 6.970 -18.325 -25.803 1.00 0.00 H new ATOM 655 N GLU A 491 8.572 -17.268 -23.450 1.00 0.00 N ATOM 656 CA GLU A 491 8.829 -17.324 -21.988 1.00 0.00 C ATOM 657 C GLU A 491 8.164 -16.133 -21.259 1.00 0.00 C ATOM 658 O GLU A 491 8.698 -15.031 -21.261 1.00 0.00 O ATOM 659 CB GLU A 491 10.351 -17.336 -21.652 1.00 0.00 C ATOM 660 CG GLU A 491 11.131 -18.586 -22.089 1.00 0.00 C ATOM 661 CD GLU A 491 12.589 -18.582 -21.588 1.00 0.00 C ATOM 662 OE1 GLU A 491 12.829 -18.921 -20.396 1.00 0.00 O ATOM 663 OE2 GLU A 491 13.503 -18.250 -22.374 1.00 0.00 O ATOM 0 H GLU A 491 9.415 -17.208 -24.021 1.00 0.00 H new ATOM 0 HA GLU A 491 8.392 -18.260 -21.640 1.00 0.00 H new ATOM 0 HB2 GLU A 491 10.812 -16.464 -22.117 1.00 0.00 H new ATOM 0 HB3 GLU A 491 10.465 -17.220 -20.574 1.00 0.00 H new ATOM 0 HG2 GLU A 491 10.624 -19.475 -21.714 1.00 0.00 H new ATOM 0 HG3 GLU A 491 11.125 -18.651 -23.177 1.00 0.00 H new ATOM 670 N GLU A 492 6.997 -16.393 -20.646 1.00 0.00 N ATOM 671 CA GLU A 492 6.218 -15.395 -19.896 1.00 0.00 C ATOM 672 C GLU A 492 6.221 -15.797 -18.407 1.00 0.00 C ATOM 673 O GLU A 492 5.294 -16.421 -17.888 1.00 0.00 O ATOM 674 CB GLU A 492 4.786 -15.261 -20.503 1.00 0.00 C ATOM 675 CG GLU A 492 4.041 -16.597 -20.712 1.00 0.00 C ATOM 676 CD GLU A 492 2.663 -16.419 -21.372 1.00 0.00 C ATOM 677 OE1 GLU A 492 1.693 -16.074 -20.660 1.00 0.00 O ATOM 678 OE2 GLU A 492 2.544 -16.620 -22.605 1.00 0.00 O ATOM 0 H GLU A 492 6.563 -17.316 -20.658 1.00 0.00 H new ATOM 0 HA GLU A 492 6.666 -14.404 -19.974 1.00 0.00 H new ATOM 0 HB2 GLU A 492 4.188 -14.627 -19.849 1.00 0.00 H new ATOM 0 HB3 GLU A 492 4.860 -14.749 -21.463 1.00 0.00 H new ATOM 0 HG2 GLU A 492 4.652 -17.255 -21.330 1.00 0.00 H new ATOM 0 HG3 GLU A 492 3.915 -17.091 -19.749 1.00 0.00 H new ATOM 685 N ILE A 493 7.332 -15.445 -17.751 1.00 0.00 N ATOM 686 CA ILE A 493 7.677 -15.895 -16.385 1.00 0.00 C ATOM 687 C ILE A 493 7.655 -14.712 -15.399 1.00 0.00 C ATOM 688 O ILE A 493 7.571 -13.548 -15.810 1.00 0.00 O ATOM 689 CB ILE A 493 9.094 -16.584 -16.393 1.00 0.00 C ATOM 690 CG1 ILE A 493 10.190 -15.582 -16.890 1.00 0.00 C ATOM 691 CG2 ILE A 493 9.072 -17.868 -17.258 1.00 0.00 C ATOM 692 CD1 ILE A 493 11.583 -16.157 -17.042 1.00 0.00 C ATOM 0 H ILE A 493 8.035 -14.827 -18.157 1.00 0.00 H new ATOM 0 HA ILE A 493 6.933 -16.620 -16.056 1.00 0.00 H new ATOM 0 HB ILE A 493 9.344 -16.874 -15.373 1.00 0.00 H new ATOM 0 HG12 ILE A 493 9.877 -15.177 -17.852 1.00 0.00 H new ATOM 0 HG13 ILE A 493 10.236 -14.746 -16.192 1.00 0.00 H new ATOM 0 HG21 ILE A 493 10.060 -18.329 -17.251 1.00 0.00 H new ATOM 0 HG22 ILE A 493 8.342 -18.568 -16.852 1.00 0.00 H new ATOM 0 HG23 ILE A 493 8.799 -17.612 -18.282 1.00 0.00 H new ATOM 0 HD11 ILE A 493 12.262 -15.379 -17.391 1.00 0.00 H new ATOM 0 HD12 ILE A 493 11.928 -16.535 -16.079 1.00 0.00 H new ATOM 0 HD13 ILE A 493 11.563 -16.972 -17.765 1.00 0.00 H new ATOM 704 N ALA A 494 7.741 -15.028 -14.097 1.00 0.00 N ATOM 705 CA ALA A 494 7.697 -14.029 -13.019 1.00 0.00 C ATOM 706 C ALA A 494 8.458 -14.538 -11.785 1.00 0.00 C ATOM 707 O ALA A 494 8.073 -15.548 -11.186 1.00 0.00 O ATOM 708 CB ALA A 494 6.237 -13.702 -12.667 1.00 0.00 C ATOM 0 H ALA A 494 7.843 -15.986 -13.762 1.00 0.00 H new ATOM 0 HA ALA A 494 8.183 -13.115 -13.361 1.00 0.00 H new ATOM 0 HB1 ALA A 494 6.213 -12.961 -11.868 1.00 0.00 H new ATOM 0 HB2 ALA A 494 5.731 -13.304 -13.546 1.00 0.00 H new ATOM 0 HB3 ALA A 494 5.730 -14.609 -12.337 1.00 0.00 H new ATOM 714 N TYR A 495 9.550 -13.841 -11.427 1.00 0.00 N ATOM 715 CA TYR A 495 10.324 -14.111 -10.200 1.00 0.00 C ATOM 716 C TYR A 495 9.925 -13.117 -9.103 1.00 0.00 C ATOM 717 O TYR A 495 10.160 -11.916 -9.241 1.00 0.00 O ATOM 718 CB TYR A 495 11.853 -14.013 -10.464 1.00 0.00 C ATOM 719 CG TYR A 495 12.707 -14.167 -9.187 1.00 0.00 C ATOM 720 CD1 TYR A 495 12.713 -15.369 -8.472 1.00 0.00 C ATOM 721 CD2 TYR A 495 13.489 -13.115 -8.689 1.00 0.00 C ATOM 722 CE1 TYR A 495 13.452 -15.514 -7.312 1.00 0.00 C ATOM 723 CE2 TYR A 495 14.225 -13.258 -7.524 1.00 0.00 C ATOM 724 CZ TYR A 495 14.210 -14.461 -6.846 1.00 0.00 C ATOM 725 OH TYR A 495 14.942 -14.604 -5.685 1.00 0.00 O ATOM 0 H TYR A 495 9.923 -13.071 -11.982 1.00 0.00 H new ATOM 0 HA TYR A 495 10.098 -15.127 -9.875 1.00 0.00 H new ATOM 0 HB2 TYR A 495 12.141 -14.783 -11.180 1.00 0.00 H new ATOM 0 HB3 TYR A 495 12.074 -13.051 -10.926 1.00 0.00 H new ATOM 0 HD1 TYR A 495 12.128 -16.202 -8.833 1.00 0.00 H new ATOM 0 HD2 TYR A 495 13.518 -12.177 -9.223 1.00 0.00 H new ATOM 0 HE1 TYR A 495 13.435 -16.450 -6.773 1.00 0.00 H new ATOM 0 HE2 TYR A 495 14.809 -12.431 -7.147 1.00 0.00 H new ATOM 0 HH TYR A 495 15.211 -15.541 -5.581 1.00 0.00 H new ATOM 735 N LYS A 496 9.331 -13.622 -8.016 1.00 0.00 N ATOM 736 CA LYS A 496 9.058 -12.817 -6.819 1.00 0.00 C ATOM 737 C LYS A 496 10.245 -12.909 -5.846 1.00 0.00 C ATOM 738 O LYS A 496 10.928 -13.940 -5.770 1.00 0.00 O ATOM 739 CB LYS A 496 7.732 -13.263 -6.144 1.00 0.00 C ATOM 740 CG LYS A 496 7.690 -14.738 -5.685 1.00 0.00 C ATOM 741 CD LYS A 496 6.352 -15.120 -5.006 1.00 0.00 C ATOM 742 CE LYS A 496 6.046 -14.280 -3.747 1.00 0.00 C ATOM 743 NZ LYS A 496 4.742 -14.655 -3.142 1.00 0.00 N ATOM 0 H LYS A 496 9.028 -14.593 -7.940 1.00 0.00 H new ATOM 0 HA LYS A 496 8.937 -11.774 -7.113 1.00 0.00 H new ATOM 0 HB2 LYS A 496 7.551 -12.625 -5.279 1.00 0.00 H new ATOM 0 HB3 LYS A 496 6.913 -13.093 -6.842 1.00 0.00 H new ATOM 0 HG2 LYS A 496 7.852 -15.386 -6.546 1.00 0.00 H new ATOM 0 HG3 LYS A 496 8.509 -14.920 -4.990 1.00 0.00 H new ATOM 0 HD2 LYS A 496 5.540 -14.997 -5.723 1.00 0.00 H new ATOM 0 HD3 LYS A 496 6.379 -16.175 -4.733 1.00 0.00 H new ATOM 0 HE2 LYS A 496 6.841 -14.419 -3.014 1.00 0.00 H new ATOM 0 HE3 LYS A 496 6.035 -13.222 -4.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 4.570 -14.071 -2.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 3.981 -14.499 -3.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 4.761 -15.658 -2.870 1.00 0.00 H new ATOM 757 N PHE A 497 10.474 -11.820 -5.107 1.00 0.00 N ATOM 758 CA PHE A 497 11.555 -11.718 -4.113 1.00 0.00 C ATOM 759 C PHE A 497 11.178 -12.458 -2.815 1.00 0.00 C ATOM 760 O PHE A 497 10.033 -12.896 -2.642 1.00 0.00 O ATOM 761 CB PHE A 497 11.846 -10.216 -3.842 1.00 0.00 C ATOM 762 CG PHE A 497 12.528 -9.506 -5.007 1.00 0.00 C ATOM 763 CD1 PHE A 497 13.912 -9.527 -5.129 1.00 0.00 C ATOM 764 CD2 PHE A 497 11.791 -8.838 -5.986 1.00 0.00 C ATOM 765 CE1 PHE A 497 14.543 -8.904 -6.186 1.00 0.00 C ATOM 766 CE2 PHE A 497 12.422 -8.215 -7.045 1.00 0.00 C ATOM 767 CZ PHE A 497 13.799 -8.248 -7.143 1.00 0.00 C ATOM 0 H PHE A 497 9.910 -10.973 -5.180 1.00 0.00 H new ATOM 0 HA PHE A 497 12.456 -12.193 -4.502 1.00 0.00 H new ATOM 0 HB2 PHE A 497 10.908 -9.708 -3.616 1.00 0.00 H new ATOM 0 HB3 PHE A 497 12.476 -10.131 -2.957 1.00 0.00 H new ATOM 0 HD1 PHE A 497 14.503 -10.039 -4.384 1.00 0.00 H new ATOM 0 HD2 PHE A 497 10.714 -8.808 -5.915 1.00 0.00 H new ATOM 0 HE1 PHE A 497 15.620 -8.930 -6.264 1.00 0.00 H new ATOM 0 HE2 PHE A 497 11.839 -7.702 -7.796 1.00 0.00 H new ATOM 0 HZ PHE A 497 14.293 -7.760 -7.970 1.00 0.00 H new ATOM 777 N THR A 498 12.161 -12.621 -1.919 1.00 0.00 N ATOM 778 CA THR A 498 11.951 -13.254 -0.610 1.00 0.00 C ATOM 779 C THR A 498 11.384 -12.198 0.374 1.00 0.00 C ATOM 780 O THR A 498 11.893 -11.072 0.397 1.00 0.00 O ATOM 781 CB THR A 498 13.284 -13.877 -0.066 1.00 0.00 C ATOM 782 OG1 THR A 498 14.247 -12.852 0.209 1.00 0.00 O ATOM 783 CG2 THR A 498 13.900 -14.871 -1.073 1.00 0.00 C ATOM 0 H THR A 498 13.122 -12.319 -2.081 1.00 0.00 H new ATOM 0 HA THR A 498 11.235 -14.070 -0.713 1.00 0.00 H new ATOM 0 HB THR A 498 13.032 -14.409 0.851 1.00 0.00 H new ATOM 0 HG1 THR A 498 14.975 -12.904 -0.445 1.00 0.00 H new ATOM 0 HG21 THR A 498 14.822 -15.282 -0.661 1.00 0.00 H new ATOM 0 HG22 THR A 498 13.195 -15.680 -1.263 1.00 0.00 H new ATOM 0 HG23 THR A 498 14.119 -14.354 -2.007 1.00 0.00 H new ATOM 791 N PRO A 499 10.300 -12.518 1.166 1.00 0.00 N ATOM 792 CA PRO A 499 9.638 -11.549 2.103 1.00 0.00 C ATOM 793 C PRO A 499 10.606 -10.851 3.087 1.00 0.00 C ATOM 794 O PRO A 499 10.346 -9.736 3.560 1.00 0.00 O ATOM 795 CB PRO A 499 8.621 -12.436 2.867 1.00 0.00 C ATOM 796 CG PRO A 499 8.308 -13.543 1.909 1.00 0.00 C ATOM 797 CD PRO A 499 9.608 -13.835 1.190 1.00 0.00 C ATOM 0 HA PRO A 499 9.193 -10.718 1.556 1.00 0.00 H new ATOM 0 HB2 PRO A 499 9.045 -12.820 3.795 1.00 0.00 H new ATOM 0 HB3 PRO A 499 7.725 -11.875 3.134 1.00 0.00 H new ATOM 0 HG2 PRO A 499 7.943 -14.426 2.435 1.00 0.00 H new ATOM 0 HG3 PRO A 499 7.529 -13.246 1.207 1.00 0.00 H new ATOM 0 HD2 PRO A 499 10.196 -14.587 1.716 1.00 0.00 H new ATOM 0 HD3 PRO A 499 9.433 -14.214 0.183 1.00 0.00 H new ATOM 805 N LYS A 500 11.723 -11.535 3.376 1.00 0.00 N ATOM 806 CA LYS A 500 12.744 -11.062 4.325 1.00 0.00 C ATOM 807 C LYS A 500 13.771 -10.111 3.657 1.00 0.00 C ATOM 808 O LYS A 500 14.443 -9.343 4.362 1.00 0.00 O ATOM 809 CB LYS A 500 13.473 -12.279 4.948 1.00 0.00 C ATOM 810 CG LYS A 500 14.282 -13.119 3.936 1.00 0.00 C ATOM 811 CD LYS A 500 15.016 -14.305 4.593 1.00 0.00 C ATOM 812 CE LYS A 500 15.896 -15.084 3.599 1.00 0.00 C ATOM 813 NZ LYS A 500 16.620 -16.196 4.266 1.00 0.00 N ATOM 0 H LYS A 500 11.945 -12.437 2.956 1.00 0.00 H new ATOM 0 HA LYS A 500 12.237 -10.492 5.103 1.00 0.00 H new ATOM 0 HB2 LYS A 500 14.146 -11.924 5.729 1.00 0.00 H new ATOM 0 HB3 LYS A 500 12.736 -12.922 5.430 1.00 0.00 H new ATOM 0 HG2 LYS A 500 13.610 -13.496 3.165 1.00 0.00 H new ATOM 0 HG3 LYS A 500 15.010 -12.478 3.439 1.00 0.00 H new ATOM 0 HD2 LYS A 500 15.637 -13.935 5.409 1.00 0.00 H new ATOM 0 HD3 LYS A 500 14.283 -14.982 5.031 1.00 0.00 H new ATOM 0 HE2 LYS A 500 15.275 -15.483 2.797 1.00 0.00 H new ATOM 0 HE3 LYS A 500 16.614 -14.406 3.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 17.203 -16.699 3.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 17.231 -15.812 5.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 15.933 -16.856 4.684 1.00 0.00 H new ATOM 827 N TYR A 501 13.898 -10.187 2.308 1.00 0.00 N ATOM 828 CA TYR A 501 14.873 -9.383 1.538 1.00 0.00 C ATOM 829 C TYR A 501 14.550 -7.891 1.662 1.00 0.00 C ATOM 830 O TYR A 501 13.387 -7.491 1.594 1.00 0.00 O ATOM 831 CB TYR A 501 14.896 -9.796 0.034 1.00 0.00 C ATOM 832 CG TYR A 501 15.963 -9.054 -0.790 1.00 0.00 C ATOM 833 CD1 TYR A 501 17.291 -9.485 -0.803 1.00 0.00 C ATOM 834 CD2 TYR A 501 15.656 -7.895 -1.512 1.00 0.00 C ATOM 835 CE1 TYR A 501 18.264 -8.780 -1.491 1.00 0.00 C ATOM 836 CE2 TYR A 501 16.630 -7.188 -2.183 1.00 0.00 C ATOM 837 CZ TYR A 501 17.926 -7.639 -2.179 1.00 0.00 C ATOM 838 OH TYR A 501 18.897 -6.915 -2.831 1.00 0.00 O ATOM 0 H TYR A 501 13.329 -10.805 1.729 1.00 0.00 H new ATOM 0 HA TYR A 501 15.861 -9.575 1.957 1.00 0.00 H new ATOM 0 HB2 TYR A 501 15.074 -10.869 -0.037 1.00 0.00 H new ATOM 0 HB3 TYR A 501 13.915 -9.606 -0.402 1.00 0.00 H new ATOM 0 HD1 TYR A 501 17.564 -10.383 -0.268 1.00 0.00 H new ATOM 0 HD2 TYR A 501 14.634 -7.547 -1.544 1.00 0.00 H new ATOM 0 HE1 TYR A 501 19.287 -9.126 -1.487 1.00 0.00 H new ATOM 0 HE2 TYR A 501 16.374 -6.281 -2.711 1.00 0.00 H new ATOM 0 HH TYR A 501 19.651 -7.501 -3.049 1.00 0.00 H new ATOM 848 N ILE A 502 15.592 -7.077 1.862 1.00 0.00 N ATOM 849 CA ILE A 502 15.478 -5.614 1.898 1.00 0.00 C ATOM 850 C ILE A 502 16.572 -5.005 1.006 1.00 0.00 C ATOM 851 O ILE A 502 17.754 -5.327 1.152 1.00 0.00 O ATOM 852 CB ILE A 502 15.583 -5.061 3.372 1.00 0.00 C ATOM 853 CG1 ILE A 502 14.431 -5.634 4.269 1.00 0.00 C ATOM 854 CG2 ILE A 502 15.595 -3.517 3.401 1.00 0.00 C ATOM 855 CD1 ILE A 502 14.367 -5.084 5.684 1.00 0.00 C ATOM 0 H ILE A 502 16.543 -7.416 2.004 1.00 0.00 H new ATOM 0 HA ILE A 502 14.497 -5.327 1.520 1.00 0.00 H new ATOM 0 HB ILE A 502 16.533 -5.401 3.784 1.00 0.00 H new ATOM 0 HG12 ILE A 502 13.479 -5.435 3.777 1.00 0.00 H new ATOM 0 HG13 ILE A 502 14.542 -6.717 4.324 1.00 0.00 H new ATOM 0 HG21 ILE A 502 15.668 -3.173 4.433 1.00 0.00 H new ATOM 0 HG22 ILE A 502 16.450 -3.149 2.834 1.00 0.00 H new ATOM 0 HG23 ILE A 502 14.675 -3.138 2.956 1.00 0.00 H new ATOM 0 HD11 ILE A 502 13.536 -5.546 6.217 1.00 0.00 H new ATOM 0 HD12 ILE A 502 15.299 -5.306 6.203 1.00 0.00 H new ATOM 0 HD13 ILE A 502 14.220 -4.005 5.648 1.00 0.00 H new ATOM 867 N LEU A 503 16.151 -4.154 0.063 1.00 0.00 N ATOM 868 CA LEU A 503 17.055 -3.430 -0.846 1.00 0.00 C ATOM 869 C LEU A 503 17.425 -2.090 -0.174 1.00 0.00 C ATOM 870 O LEU A 503 16.546 -1.273 0.076 1.00 0.00 O ATOM 871 CB LEU A 503 16.366 -3.202 -2.239 1.00 0.00 C ATOM 872 CG LEU A 503 17.273 -3.355 -3.510 1.00 0.00 C ATOM 873 CD1 LEU A 503 16.511 -2.969 -4.799 1.00 0.00 C ATOM 874 CD2 LEU A 503 18.599 -2.575 -3.384 1.00 0.00 C ATOM 0 H LEU A 503 15.165 -3.945 -0.094 1.00 0.00 H new ATOM 0 HA LEU A 503 17.959 -4.010 -1.030 1.00 0.00 H new ATOM 0 HB2 LEU A 503 15.537 -3.904 -2.327 1.00 0.00 H new ATOM 0 HB3 LEU A 503 15.937 -2.200 -2.246 1.00 0.00 H new ATOM 0 HG LEU A 503 17.535 -4.411 -3.582 1.00 0.00 H new ATOM 0 HD11 LEU A 503 17.169 -3.087 -5.660 1.00 0.00 H new ATOM 0 HD12 LEU A 503 15.642 -3.616 -4.916 1.00 0.00 H new ATOM 0 HD13 LEU A 503 16.184 -1.931 -4.731 1.00 0.00 H new ATOM 0 HD21 LEU A 503 19.190 -2.714 -4.289 1.00 0.00 H new ATOM 0 HD22 LEU A 503 18.386 -1.515 -3.249 1.00 0.00 H new ATOM 0 HD23 LEU A 503 19.159 -2.945 -2.525 1.00 0.00 H new ATOM 886 N ARG A 504 18.721 -1.879 0.118 1.00 0.00 N ATOM 887 CA ARG A 504 19.200 -0.681 0.855 1.00 0.00 C ATOM 888 C ARG A 504 19.148 0.596 -0.029 1.00 0.00 C ATOM 889 O ARG A 504 19.088 0.507 -1.263 1.00 0.00 O ATOM 890 CB ARG A 504 20.633 -0.904 1.416 1.00 0.00 C ATOM 891 CG ARG A 504 20.764 -1.920 2.586 1.00 0.00 C ATOM 892 CD ARG A 504 20.505 -3.390 2.187 1.00 0.00 C ATOM 893 NE ARG A 504 20.902 -4.329 3.259 1.00 0.00 N ATOM 894 CZ ARG A 504 20.734 -5.664 3.233 1.00 0.00 C ATOM 895 NH1 ARG A 504 20.054 -6.258 2.269 1.00 0.00 N ATOM 896 NH2 ARG A 504 21.240 -6.396 4.213 1.00 0.00 N ATOM 0 H ARG A 504 19.466 -2.525 -0.145 1.00 0.00 H new ATOM 0 HA ARG A 504 18.524 -0.528 1.696 1.00 0.00 H new ATOM 0 HB2 ARG A 504 21.272 -1.239 0.599 1.00 0.00 H new ATOM 0 HB3 ARG A 504 21.022 0.057 1.752 1.00 0.00 H new ATOM 0 HG2 ARG A 504 21.766 -1.842 3.008 1.00 0.00 H new ATOM 0 HG3 ARG A 504 20.064 -1.641 3.373 1.00 0.00 H new ATOM 0 HD2 ARG A 504 19.447 -3.524 1.960 1.00 0.00 H new ATOM 0 HD3 ARG A 504 21.058 -3.622 1.277 1.00 0.00 H new ATOM 0 HE ARG A 504 21.341 -3.930 4.089 1.00 0.00 H new ATOM 0 HH11 ARG A 504 19.641 -5.703 1.520 1.00 0.00 H new ATOM 0 HH12 ARG A 504 19.942 -7.272 2.274 1.00 0.00 H new ATOM 0 HH21 ARG A 504 21.749 -5.947 4.974 1.00 0.00 H new ATOM 0 HH22 ARG A 504 21.121 -7.409 4.207 1.00 0.00 H new ATOM 910 N ALA A 505 19.169 1.779 0.625 1.00 0.00 N ATOM 911 CA ALA A 505 18.981 3.093 -0.043 1.00 0.00 C ATOM 912 C ALA A 505 20.113 3.406 -1.042 1.00 0.00 C ATOM 913 O ALA A 505 21.285 3.456 -0.659 1.00 0.00 O ATOM 914 CB ALA A 505 18.884 4.205 1.007 1.00 0.00 C ATOM 0 H ALA A 505 19.317 1.853 1.632 1.00 0.00 H new ATOM 0 HA ALA A 505 18.052 3.041 -0.610 1.00 0.00 H new ATOM 0 HB1 ALA A 505 18.746 5.165 0.509 1.00 0.00 H new ATOM 0 HB2 ALA A 505 18.036 4.012 1.664 1.00 0.00 H new ATOM 0 HB3 ALA A 505 19.801 4.230 1.596 1.00 0.00 H new ATOM 920 N GLY A 506 19.741 3.583 -2.328 1.00 0.00 N ATOM 921 CA GLY A 506 20.705 3.917 -3.385 1.00 0.00 C ATOM 922 C GLY A 506 21.490 2.719 -3.913 1.00 0.00 C ATOM 923 O GLY A 506 22.295 2.863 -4.840 1.00 0.00 O ATOM 0 H GLY A 506 18.778 3.499 -2.654 1.00 0.00 H new ATOM 0 HA2 GLY A 506 20.172 4.383 -4.214 1.00 0.00 H new ATOM 0 HA3 GLY A 506 21.407 4.657 -3.001 1.00 0.00 H new ATOM 927 N GLN A 507 21.267 1.536 -3.313 1.00 0.00 N ATOM 928 CA GLN A 507 21.876 0.276 -3.760 1.00 0.00 C ATOM 929 C GLN A 507 21.063 -0.321 -4.917 1.00 0.00 C ATOM 930 O GLN A 507 20.098 0.287 -5.393 1.00 0.00 O ATOM 931 CB GLN A 507 21.983 -0.722 -2.566 1.00 0.00 C ATOM 932 CG GLN A 507 22.957 -0.289 -1.455 1.00 0.00 C ATOM 933 CD GLN A 507 24.417 -0.233 -1.911 1.00 0.00 C ATOM 934 OE1 GLN A 507 25.151 -1.217 -1.808 1.00 0.00 O ATOM 935 NE2 GLN A 507 24.844 0.912 -2.426 1.00 0.00 N ATOM 0 H GLN A 507 20.657 1.430 -2.502 1.00 0.00 H new ATOM 0 HA GLN A 507 22.884 0.473 -4.124 1.00 0.00 H new ATOM 0 HB2 GLN A 507 20.992 -0.856 -2.131 1.00 0.00 H new ATOM 0 HB3 GLN A 507 22.297 -1.693 -2.948 1.00 0.00 H new ATOM 0 HG2 GLN A 507 22.662 0.693 -1.086 1.00 0.00 H new ATOM 0 HG3 GLN A 507 22.872 -0.982 -0.618 1.00 0.00 H new ATOM 0 HE21 GLN A 507 24.210 1.708 -2.497 1.00 0.00 H new ATOM 0 HE22 GLN A 507 25.807 0.997 -2.752 1.00 0.00 H new ATOM 944 N MET A 508 21.464 -1.518 -5.366 1.00 0.00 N ATOM 945 CA MET A 508 20.848 -2.191 -6.514 1.00 0.00 C ATOM 946 C MET A 508 20.926 -3.722 -6.358 1.00 0.00 C ATOM 947 O MET A 508 21.952 -4.258 -5.911 1.00 0.00 O ATOM 948 CB MET A 508 21.520 -1.703 -7.836 1.00 0.00 C ATOM 949 CG MET A 508 23.042 -1.828 -7.860 1.00 0.00 C ATOM 950 SD MET A 508 23.788 -1.213 -9.393 1.00 0.00 S ATOM 951 CE MET A 508 25.519 -1.607 -9.128 1.00 0.00 C ATOM 0 H MET A 508 22.226 -2.047 -4.942 1.00 0.00 H new ATOM 0 HA MET A 508 19.791 -1.930 -6.558 1.00 0.00 H new ATOM 0 HB2 MET A 508 21.109 -2.273 -8.669 1.00 0.00 H new ATOM 0 HB3 MET A 508 21.252 -0.659 -8.001 1.00 0.00 H new ATOM 0 HG2 MET A 508 23.458 -1.278 -7.016 1.00 0.00 H new ATOM 0 HG3 MET A 508 23.316 -2.874 -7.725 1.00 0.00 H new ATOM 0 HE1 MET A 508 26.102 -1.286 -9.991 1.00 0.00 H new ATOM 0 HE2 MET A 508 25.877 -1.092 -8.237 1.00 0.00 H new ATOM 0 HE3 MET A 508 25.631 -2.683 -8.995 1.00 0.00 H new ATOM 961 N VAL A 509 19.817 -4.417 -6.688 1.00 0.00 N ATOM 962 CA VAL A 509 19.754 -5.885 -6.700 1.00 0.00 C ATOM 963 C VAL A 509 19.880 -6.370 -8.154 1.00 0.00 C ATOM 964 O VAL A 509 19.019 -6.100 -9.004 1.00 0.00 O ATOM 965 CB VAL A 509 18.444 -6.455 -6.007 1.00 0.00 C ATOM 966 CG1 VAL A 509 17.133 -5.964 -6.669 1.00 0.00 C ATOM 967 CG2 VAL A 509 18.489 -8.002 -5.923 1.00 0.00 C ATOM 0 H VAL A 509 18.940 -3.970 -6.954 1.00 0.00 H new ATOM 0 HA VAL A 509 20.584 -6.270 -6.107 1.00 0.00 H new ATOM 0 HB VAL A 509 18.435 -6.052 -4.994 1.00 0.00 H new ATOM 0 HG11 VAL A 509 16.278 -6.392 -6.145 1.00 0.00 H new ATOM 0 HG12 VAL A 509 17.084 -4.876 -6.616 1.00 0.00 H new ATOM 0 HG13 VAL A 509 17.113 -6.277 -7.713 1.00 0.00 H new ATOM 0 HG21 VAL A 509 17.580 -8.367 -5.444 1.00 0.00 H new ATOM 0 HG22 VAL A 509 18.563 -8.419 -6.927 1.00 0.00 H new ATOM 0 HG23 VAL A 509 19.356 -8.310 -5.338 1.00 0.00 H new ATOM 977 N THR A 510 21.005 -7.026 -8.450 1.00 0.00 N ATOM 978 CA THR A 510 21.257 -7.616 -9.759 1.00 0.00 C ATOM 979 C THR A 510 20.742 -9.061 -9.737 1.00 0.00 C ATOM 980 O THR A 510 21.401 -9.961 -9.199 1.00 0.00 O ATOM 981 CB THR A 510 22.786 -7.560 -10.121 1.00 0.00 C ATOM 982 OG1 THR A 510 23.375 -6.375 -9.560 1.00 0.00 O ATOM 983 CG2 THR A 510 23.008 -7.540 -11.640 1.00 0.00 C ATOM 0 H THR A 510 21.766 -7.161 -7.784 1.00 0.00 H new ATOM 0 HA THR A 510 20.733 -7.050 -10.529 1.00 0.00 H new ATOM 0 HB THR A 510 23.253 -8.455 -9.709 1.00 0.00 H new ATOM 0 HG1 THR A 510 23.518 -6.504 -8.599 1.00 0.00 H new ATOM 0 HG21 THR A 510 24.077 -7.501 -11.851 1.00 0.00 H new ATOM 0 HG22 THR A 510 22.583 -8.442 -12.082 1.00 0.00 H new ATOM 0 HG23 THR A 510 22.522 -6.663 -12.067 1.00 0.00 H new ATOM 991 N VAL A 511 19.513 -9.253 -10.229 1.00 0.00 N ATOM 992 CA VAL A 511 18.860 -10.568 -10.262 1.00 0.00 C ATOM 993 C VAL A 511 19.310 -11.340 -11.506 1.00 0.00 C ATOM 994 O VAL A 511 18.914 -11.006 -12.614 1.00 0.00 O ATOM 995 CB VAL A 511 17.294 -10.443 -10.220 1.00 0.00 C ATOM 996 CG1 VAL A 511 16.606 -11.839 -10.261 1.00 0.00 C ATOM 997 CG2 VAL A 511 16.846 -9.630 -8.979 1.00 0.00 C ATOM 0 H VAL A 511 18.942 -8.501 -10.616 1.00 0.00 H new ATOM 0 HA VAL A 511 19.161 -11.118 -9.371 1.00 0.00 H new ATOM 0 HB VAL A 511 16.977 -9.904 -11.113 1.00 0.00 H new ATOM 0 HG11 VAL A 511 15.524 -11.712 -10.230 1.00 0.00 H new ATOM 0 HG12 VAL A 511 16.885 -12.355 -11.180 1.00 0.00 H new ATOM 0 HG13 VAL A 511 16.927 -12.428 -9.402 1.00 0.00 H new ATOM 0 HG21 VAL A 511 15.759 -9.554 -8.967 1.00 0.00 H new ATOM 0 HG22 VAL A 511 17.185 -10.133 -8.073 1.00 0.00 H new ATOM 0 HG23 VAL A 511 17.279 -8.631 -9.023 1.00 0.00 H new ATOM 1007 N TRP A 512 20.156 -12.360 -11.304 1.00 0.00 N ATOM 1008 CA TRP A 512 20.742 -13.160 -12.404 1.00 0.00 C ATOM 1009 C TRP A 512 19.995 -14.487 -12.620 1.00 0.00 C ATOM 1010 O TRP A 512 19.102 -14.852 -11.854 1.00 0.00 O ATOM 1011 CB TRP A 512 22.231 -13.458 -12.115 1.00 0.00 C ATOM 1012 CG TRP A 512 23.183 -12.291 -12.287 1.00 0.00 C ATOM 1013 CD1 TRP A 512 23.352 -11.236 -11.450 1.00 0.00 C ATOM 1014 CD2 TRP A 512 24.118 -12.092 -13.364 1.00 0.00 C ATOM 1015 NE1 TRP A 512 24.334 -10.412 -11.924 1.00 0.00 N ATOM 1016 CE2 TRP A 512 24.813 -10.905 -13.097 1.00 0.00 C ATOM 1017 CE3 TRP A 512 24.431 -12.810 -14.522 1.00 0.00 C ATOM 1018 CZ2 TRP A 512 25.802 -10.407 -13.941 1.00 0.00 C ATOM 1019 CZ3 TRP A 512 25.408 -12.319 -15.366 1.00 0.00 C ATOM 1020 CH2 TRP A 512 26.092 -11.130 -15.068 1.00 0.00 C ATOM 0 H TRP A 512 20.457 -12.658 -10.376 1.00 0.00 H new ATOM 0 HA TRP A 512 20.648 -12.566 -13.313 1.00 0.00 H new ATOM 0 HB2 TRP A 512 22.317 -13.825 -11.092 1.00 0.00 H new ATOM 0 HB3 TRP A 512 22.554 -14.266 -12.771 1.00 0.00 H new ATOM 0 HD1 TRP A 512 22.792 -11.072 -10.541 1.00 0.00 H new ATOM 0 HE1 TRP A 512 24.658 -9.559 -11.468 1.00 0.00 H new ATOM 0 HE3 TRP A 512 23.918 -13.732 -14.753 1.00 0.00 H new ATOM 0 HZ2 TRP A 512 26.320 -9.487 -13.716 1.00 0.00 H new ATOM 0 HZ3 TRP A 512 25.650 -12.859 -16.270 1.00 0.00 H new ATOM 0 HH2 TRP A 512 26.861 -10.779 -15.740 1.00 0.00 H new ATOM 1031 N ALA A 513 20.379 -15.180 -13.706 1.00 0.00 N ATOM 1032 CA ALA A 513 19.953 -16.555 -14.004 1.00 0.00 C ATOM 1033 C ALA A 513 20.942 -17.553 -13.390 1.00 0.00 C ATOM 1034 O ALA A 513 22.144 -17.261 -13.283 1.00 0.00 O ATOM 1035 CB ALA A 513 19.878 -16.753 -15.524 1.00 0.00 C ATOM 0 H ALA A 513 21.005 -14.792 -14.412 1.00 0.00 H new ATOM 0 HA ALA A 513 18.967 -16.728 -13.573 1.00 0.00 H new ATOM 0 HB1 ALA A 513 19.562 -17.773 -15.743 1.00 0.00 H new ATOM 0 HB2 ALA A 513 19.159 -16.052 -15.947 1.00 0.00 H new ATOM 0 HB3 ALA A 513 20.860 -16.575 -15.963 1.00 0.00 H new ATOM 1041 N ALA A 514 20.434 -18.733 -12.981 1.00 0.00 N ATOM 1042 CA ALA A 514 21.275 -19.831 -12.461 1.00 0.00 C ATOM 1043 C ALA A 514 22.213 -20.366 -13.561 1.00 0.00 C ATOM 1044 O ALA A 514 23.398 -20.633 -13.315 1.00 0.00 O ATOM 1045 CB ALA A 514 20.386 -20.951 -11.890 1.00 0.00 C ATOM 0 H ALA A 514 19.438 -18.951 -13.001 1.00 0.00 H new ATOM 0 HA ALA A 514 21.899 -19.446 -11.655 1.00 0.00 H new ATOM 0 HB1 ALA A 514 21.015 -21.756 -11.509 1.00 0.00 H new ATOM 0 HB2 ALA A 514 19.775 -20.553 -11.080 1.00 0.00 H new ATOM 0 HB3 ALA A 514 19.738 -21.338 -12.677 1.00 0.00 H new ATOM 1051 N GLY A 515 21.679 -20.450 -14.793 1.00 0.00 N ATOM 1052 CA GLY A 515 22.436 -20.961 -15.947 1.00 0.00 C ATOM 1053 C GLY A 515 23.402 -19.949 -16.565 1.00 0.00 C ATOM 1054 O GLY A 515 24.102 -20.274 -17.533 1.00 0.00 O ATOM 0 H GLY A 515 20.724 -20.169 -15.014 1.00 0.00 H new ATOM 0 HA2 GLY A 515 23.000 -21.841 -15.636 1.00 0.00 H new ATOM 0 HA3 GLY A 515 21.732 -21.288 -16.712 1.00 0.00 H new ATOM 1058 N ALA A 516 23.432 -18.718 -16.010 1.00 0.00 N ATOM 1059 CA ALA A 516 24.393 -17.671 -16.411 1.00 0.00 C ATOM 1060 C ALA A 516 25.834 -18.041 -15.966 1.00 0.00 C ATOM 1061 O ALA A 516 26.817 -17.624 -16.598 1.00 0.00 O ATOM 1062 CB ALA A 516 23.979 -16.310 -15.821 1.00 0.00 C ATOM 0 H ALA A 516 22.791 -18.424 -15.273 1.00 0.00 H new ATOM 0 HA ALA A 516 24.383 -17.598 -17.498 1.00 0.00 H new ATOM 0 HB1 ALA A 516 24.697 -15.548 -16.125 1.00 0.00 H new ATOM 0 HB2 ALA A 516 22.988 -16.041 -16.186 1.00 0.00 H new ATOM 0 HB3 ALA A 516 23.959 -16.376 -14.733 1.00 0.00 H new ATOM 1068 N GLY A 517 25.938 -18.852 -14.890 1.00 0.00 N ATOM 1069 CA GLY A 517 27.237 -19.299 -14.362 1.00 0.00 C ATOM 1070 C GLY A 517 27.906 -18.252 -13.477 1.00 0.00 C ATOM 1071 O GLY A 517 29.132 -18.076 -13.508 1.00 0.00 O ATOM 0 H GLY A 517 25.134 -19.208 -14.373 1.00 0.00 H new ATOM 0 HA2 GLY A 517 27.096 -20.216 -13.789 1.00 0.00 H new ATOM 0 HA3 GLY A 517 27.898 -19.542 -15.194 1.00 0.00 H new ATOM 1075 N VAL A 518 27.079 -17.560 -12.686 1.00 0.00 N ATOM 1076 CA VAL A 518 27.495 -16.444 -11.815 1.00 0.00 C ATOM 1077 C VAL A 518 27.414 -16.864 -10.329 1.00 0.00 C ATOM 1078 O VAL A 518 26.603 -17.727 -9.961 1.00 0.00 O ATOM 1079 CB VAL A 518 26.591 -15.184 -12.095 1.00 0.00 C ATOM 1080 CG1 VAL A 518 25.098 -15.519 -11.879 1.00 0.00 C ATOM 1081 CG2 VAL A 518 27.024 -13.941 -11.264 1.00 0.00 C ATOM 0 H VAL A 518 26.081 -17.760 -12.629 1.00 0.00 H new ATOM 0 HA VAL A 518 28.530 -16.184 -12.035 1.00 0.00 H new ATOM 0 HB VAL A 518 26.732 -14.916 -13.142 1.00 0.00 H new ATOM 0 HG11 VAL A 518 24.494 -14.634 -12.078 1.00 0.00 H new ATOM 0 HG12 VAL A 518 24.803 -16.320 -12.557 1.00 0.00 H new ATOM 0 HG13 VAL A 518 24.942 -15.840 -10.849 1.00 0.00 H new ATOM 0 HG21 VAL A 518 26.368 -13.102 -11.496 1.00 0.00 H new ATOM 0 HG22 VAL A 518 26.956 -14.172 -10.201 1.00 0.00 H new ATOM 0 HG23 VAL A 518 28.052 -13.677 -11.513 1.00 0.00 H new ATOM 1091 N ALA A 519 28.281 -16.260 -9.495 1.00 0.00 N ATOM 1092 CA ALA A 519 28.312 -16.495 -8.046 1.00 0.00 C ATOM 1093 C ALA A 519 27.187 -15.711 -7.343 1.00 0.00 C ATOM 1094 O ALA A 519 27.084 -14.488 -7.494 1.00 0.00 O ATOM 1095 CB ALA A 519 29.685 -16.104 -7.486 1.00 0.00 C ATOM 0 H ALA A 519 28.983 -15.592 -9.813 1.00 0.00 H new ATOM 0 HA ALA A 519 28.147 -17.555 -7.856 1.00 0.00 H new ATOM 0 HB1 ALA A 519 29.703 -16.280 -6.410 1.00 0.00 H new ATOM 0 HB2 ALA A 519 30.458 -16.705 -7.965 1.00 0.00 H new ATOM 0 HB3 ALA A 519 29.871 -15.048 -7.684 1.00 0.00 H new ATOM 1101 N HIS A 520 26.342 -16.432 -6.590 1.00 0.00 N ATOM 1102 CA HIS A 520 25.237 -15.836 -5.822 1.00 0.00 C ATOM 1103 C HIS A 520 25.817 -15.088 -4.602 1.00 0.00 C ATOM 1104 O HIS A 520 26.341 -15.719 -3.674 1.00 0.00 O ATOM 1105 CB HIS A 520 24.245 -16.960 -5.393 1.00 0.00 C ATOM 1106 CG HIS A 520 22.876 -16.494 -4.937 1.00 0.00 C ATOM 1107 ND1 HIS A 520 21.714 -17.192 -5.190 1.00 0.00 N ATOM 1108 CD2 HIS A 520 22.501 -15.408 -4.219 1.00 0.00 C ATOM 1109 CE1 HIS A 520 20.699 -16.520 -4.637 1.00 0.00 C ATOM 1110 NE2 HIS A 520 21.126 -15.428 -4.037 1.00 0.00 N ATOM 0 H HIS A 520 26.405 -17.446 -6.496 1.00 0.00 H new ATOM 0 HA HIS A 520 24.688 -15.118 -6.431 1.00 0.00 H new ATOM 0 HB2 HIS A 520 24.114 -17.643 -6.232 1.00 0.00 H new ATOM 0 HB3 HIS A 520 24.701 -17.532 -4.585 1.00 0.00 H new ATOM 0 HD1 HIS A 520 21.642 -18.068 -5.708 1.00 0.00 H new ATOM 0 HD2 HIS A 520 23.169 -14.645 -3.846 1.00 0.00 H new ATOM 0 HE1 HIS A 520 19.666 -16.831 -4.677 1.00 0.00 H new ATOM 1118 N SER A 521 25.728 -13.744 -4.621 1.00 0.00 N ATOM 1119 CA SER A 521 26.346 -12.873 -3.597 1.00 0.00 C ATOM 1120 C SER A 521 25.296 -11.876 -3.036 1.00 0.00 C ATOM 1121 O SER A 521 25.182 -10.752 -3.535 1.00 0.00 O ATOM 1122 CB SER A 521 27.549 -12.118 -4.221 1.00 0.00 C ATOM 1123 OG SER A 521 28.423 -13.014 -4.897 1.00 0.00 O ATOM 0 H SER A 521 25.226 -13.230 -5.345 1.00 0.00 H new ATOM 0 HA SER A 521 26.706 -13.483 -2.769 1.00 0.00 H new ATOM 0 HB2 SER A 521 27.186 -11.364 -4.919 1.00 0.00 H new ATOM 0 HB3 SER A 521 28.097 -11.592 -3.439 1.00 0.00 H new ATOM 0 HG SER A 521 29.172 -12.512 -5.282 1.00 0.00 H new ATOM 1129 N PRO A 522 24.474 -12.291 -2.015 1.00 0.00 N ATOM 1130 CA PRO A 522 23.460 -11.399 -1.389 1.00 0.00 C ATOM 1131 C PRO A 522 24.108 -10.168 -0.683 1.00 0.00 C ATOM 1132 O PRO A 522 25.229 -10.276 -0.175 1.00 0.00 O ATOM 1133 CB PRO A 522 22.724 -12.324 -0.373 1.00 0.00 C ATOM 1134 CG PRO A 522 23.052 -13.720 -0.812 1.00 0.00 C ATOM 1135 CD PRO A 522 24.439 -13.650 -1.403 1.00 0.00 C ATOM 0 HA PRO A 522 22.786 -10.963 -2.127 1.00 0.00 H new ATOM 0 HB2 PRO A 522 23.064 -12.140 0.646 1.00 0.00 H new ATOM 0 HB3 PRO A 522 21.648 -12.148 -0.387 1.00 0.00 H new ATOM 0 HG2 PRO A 522 23.020 -14.412 0.029 1.00 0.00 H new ATOM 0 HG3 PRO A 522 22.331 -14.078 -1.547 1.00 0.00 H new ATOM 0 HD2 PRO A 522 25.209 -13.769 -0.641 1.00 0.00 H new ATOM 0 HD3 PRO A 522 24.601 -14.431 -2.145 1.00 0.00 H new ATOM 1143 N PRO A 523 23.430 -8.972 -0.640 1.00 0.00 N ATOM 1144 CA PRO A 523 22.107 -8.726 -1.278 1.00 0.00 C ATOM 1145 C PRO A 523 22.200 -8.312 -2.776 1.00 0.00 C ATOM 1146 O PRO A 523 21.227 -8.445 -3.526 1.00 0.00 O ATOM 1147 CB PRO A 523 21.550 -7.575 -0.408 1.00 0.00 C ATOM 1148 CG PRO A 523 22.761 -6.768 -0.039 1.00 0.00 C ATOM 1149 CD PRO A 523 23.902 -7.763 0.106 1.00 0.00 C ATOM 0 HA PRO A 523 21.485 -9.620 -1.308 1.00 0.00 H new ATOM 0 HB2 PRO A 523 20.825 -6.975 -0.959 1.00 0.00 H new ATOM 0 HB3 PRO A 523 21.041 -7.956 0.477 1.00 0.00 H new ATOM 0 HG2 PRO A 523 22.985 -6.027 -0.807 1.00 0.00 H new ATOM 0 HG3 PRO A 523 22.598 -6.223 0.891 1.00 0.00 H new ATOM 0 HD2 PRO A 523 24.828 -7.371 -0.315 1.00 0.00 H new ATOM 0 HD3 PRO A 523 24.100 -7.993 1.153 1.00 0.00 H new ATOM 1157 N SER A 524 23.399 -7.869 -3.197 1.00 0.00 N ATOM 1158 CA SER A 524 23.613 -7.161 -4.481 1.00 0.00 C ATOM 1159 C SER A 524 23.541 -8.093 -5.710 1.00 0.00 C ATOM 1160 O SER A 524 23.436 -7.612 -6.837 1.00 0.00 O ATOM 1161 CB SER A 524 24.978 -6.437 -4.435 1.00 0.00 C ATOM 1162 OG SER A 524 25.077 -5.617 -3.276 1.00 0.00 O ATOM 0 H SER A 524 24.255 -7.991 -2.655 1.00 0.00 H new ATOM 0 HA SER A 524 22.802 -6.442 -4.599 1.00 0.00 H new ATOM 0 HB2 SER A 524 25.784 -7.171 -4.437 1.00 0.00 H new ATOM 0 HB3 SER A 524 25.101 -5.826 -5.329 1.00 0.00 H new ATOM 0 HG SER A 524 25.949 -5.169 -3.265 1.00 0.00 H new ATOM 1168 N THR A 525 23.614 -9.416 -5.488 1.00 0.00 N ATOM 1169 CA THR A 525 23.507 -10.422 -6.556 1.00 0.00 C ATOM 1170 C THR A 525 22.576 -11.538 -6.078 1.00 0.00 C ATOM 1171 O THR A 525 22.992 -12.424 -5.320 1.00 0.00 O ATOM 1172 CB THR A 525 24.911 -11.001 -6.959 1.00 0.00 C ATOM 1173 OG1 THR A 525 25.789 -9.935 -7.355 1.00 0.00 O ATOM 1174 CG2 THR A 525 24.814 -12.032 -8.105 1.00 0.00 C ATOM 0 H THR A 525 23.749 -9.818 -4.560 1.00 0.00 H new ATOM 0 HA THR A 525 23.098 -9.949 -7.449 1.00 0.00 H new ATOM 0 HB THR A 525 25.309 -11.511 -6.082 1.00 0.00 H new ATOM 0 HG1 THR A 525 26.662 -10.305 -7.603 1.00 0.00 H new ATOM 0 HG21 THR A 525 25.810 -12.402 -8.347 1.00 0.00 H new ATOM 0 HG22 THR A 525 24.183 -12.864 -7.793 1.00 0.00 H new ATOM 0 HG23 THR A 525 24.380 -11.558 -8.985 1.00 0.00 H new ATOM 1182 N LEU A 526 21.299 -11.455 -6.476 1.00 0.00 N ATOM 1183 CA LEU A 526 20.289 -12.461 -6.125 1.00 0.00 C ATOM 1184 C LEU A 526 20.007 -13.318 -7.372 1.00 0.00 C ATOM 1185 O LEU A 526 19.329 -12.881 -8.298 1.00 0.00 O ATOM 1186 CB LEU A 526 19.004 -11.748 -5.616 1.00 0.00 C ATOM 1187 CG LEU A 526 17.910 -12.659 -4.975 1.00 0.00 C ATOM 1188 CD1 LEU A 526 18.442 -13.389 -3.718 1.00 0.00 C ATOM 1189 CD2 LEU A 526 16.634 -11.844 -4.655 1.00 0.00 C ATOM 0 H LEU A 526 20.939 -10.691 -7.048 1.00 0.00 H new ATOM 0 HA LEU A 526 20.645 -13.111 -5.326 1.00 0.00 H new ATOM 0 HB2 LEU A 526 19.298 -10.999 -4.881 1.00 0.00 H new ATOM 0 HB3 LEU A 526 18.555 -11.214 -6.454 1.00 0.00 H new ATOM 0 HG LEU A 526 17.646 -13.425 -5.705 1.00 0.00 H new ATOM 0 HD11 LEU A 526 17.653 -14.014 -3.299 1.00 0.00 H new ATOM 0 HD12 LEU A 526 19.292 -14.014 -3.992 1.00 0.00 H new ATOM 0 HD13 LEU A 526 18.756 -12.655 -2.976 1.00 0.00 H new ATOM 0 HD21 LEU A 526 15.886 -12.499 -4.209 1.00 0.00 H new ATOM 0 HD22 LEU A 526 16.879 -11.044 -3.956 1.00 0.00 H new ATOM 0 HD23 LEU A 526 16.237 -11.413 -5.574 1.00 0.00 H new ATOM 1201 N VAL A 527 20.537 -14.543 -7.388 1.00 0.00 N ATOM 1202 CA VAL A 527 20.467 -15.433 -8.561 1.00 0.00 C ATOM 1203 C VAL A 527 19.243 -16.354 -8.451 1.00 0.00 C ATOM 1204 O VAL A 527 19.123 -17.106 -7.471 1.00 0.00 O ATOM 1205 CB VAL A 527 21.784 -16.282 -8.694 1.00 0.00 C ATOM 1206 CG1 VAL A 527 21.735 -17.242 -9.907 1.00 0.00 C ATOM 1207 CG2 VAL A 527 23.022 -15.357 -8.766 1.00 0.00 C ATOM 0 H VAL A 527 21.027 -14.950 -6.592 1.00 0.00 H new ATOM 0 HA VAL A 527 20.366 -14.820 -9.457 1.00 0.00 H new ATOM 0 HB VAL A 527 21.867 -16.902 -7.801 1.00 0.00 H new ATOM 0 HG11 VAL A 527 22.665 -17.808 -9.961 1.00 0.00 H new ATOM 0 HG12 VAL A 527 20.897 -17.930 -9.793 1.00 0.00 H new ATOM 0 HG13 VAL A 527 21.609 -16.665 -10.823 1.00 0.00 H new ATOM 0 HG21 VAL A 527 23.924 -15.962 -8.858 1.00 0.00 H new ATOM 0 HG22 VAL A 527 22.936 -14.701 -9.632 1.00 0.00 H new ATOM 0 HG23 VAL A 527 23.080 -14.755 -7.859 1.00 0.00 H new ATOM 1217 N TRP A 528 18.327 -16.273 -9.443 1.00 0.00 N ATOM 1218 CA TRP A 528 17.140 -17.143 -9.518 1.00 0.00 C ATOM 1219 C TRP A 528 17.585 -18.588 -9.821 1.00 0.00 C ATOM 1220 O TRP A 528 17.867 -18.943 -10.970 1.00 0.00 O ATOM 1221 CB TRP A 528 16.113 -16.625 -10.572 1.00 0.00 C ATOM 1222 CG TRP A 528 14.777 -17.378 -10.612 1.00 0.00 C ATOM 1223 CD1 TRP A 528 14.313 -18.335 -9.732 1.00 0.00 C ATOM 1224 CD2 TRP A 528 13.720 -17.199 -11.574 1.00 0.00 C ATOM 1225 NE1 TRP A 528 13.063 -18.755 -10.102 1.00 0.00 N ATOM 1226 CE2 TRP A 528 12.671 -18.072 -11.217 1.00 0.00 C ATOM 1227 CE3 TRP A 528 13.553 -16.379 -12.690 1.00 0.00 C ATOM 1228 CZ2 TRP A 528 11.491 -18.161 -11.952 1.00 0.00 C ATOM 1229 CZ3 TRP A 528 12.376 -16.470 -13.412 1.00 0.00 C ATOM 1230 CH2 TRP A 528 11.357 -17.343 -13.035 1.00 0.00 C ATOM 0 H TRP A 528 18.393 -15.604 -10.210 1.00 0.00 H new ATOM 0 HA TRP A 528 16.629 -17.126 -8.555 1.00 0.00 H new ATOM 0 HB2 TRP A 528 15.912 -15.573 -10.372 1.00 0.00 H new ATOM 0 HB3 TRP A 528 16.572 -16.680 -11.559 1.00 0.00 H new ATOM 0 HD1 TRP A 528 14.858 -18.700 -8.874 1.00 0.00 H new ATOM 0 HE1 TRP A 528 12.512 -19.466 -9.621 1.00 0.00 H new ATOM 0 HE3 TRP A 528 14.327 -15.686 -12.985 1.00 0.00 H new ATOM 0 HZ2 TRP A 528 10.710 -18.853 -11.674 1.00 0.00 H new ATOM 0 HZ3 TRP A 528 12.244 -15.851 -14.287 1.00 0.00 H new ATOM 0 HH2 TRP A 528 10.444 -17.372 -13.611 1.00 0.00 H new ATOM 1241 N LYS A 529 17.677 -19.386 -8.748 1.00 0.00 N ATOM 1242 CA LYS A 529 17.954 -20.824 -8.810 1.00 0.00 C ATOM 1243 C LYS A 529 16.752 -21.552 -9.438 1.00 0.00 C ATOM 1244 O LYS A 529 15.613 -21.364 -8.987 1.00 0.00 O ATOM 1245 CB LYS A 529 18.231 -21.350 -7.371 1.00 0.00 C ATOM 1246 CG LYS A 529 18.569 -22.854 -7.261 1.00 0.00 C ATOM 1247 CD LYS A 529 19.897 -23.219 -7.962 1.00 0.00 C ATOM 1248 CE LYS A 529 20.270 -24.702 -7.795 1.00 0.00 C ATOM 1249 NZ LYS A 529 21.587 -25.018 -8.405 1.00 0.00 N ATOM 0 H LYS A 529 17.558 -19.041 -7.795 1.00 0.00 H new ATOM 0 HA LYS A 529 18.831 -21.013 -9.429 1.00 0.00 H new ATOM 0 HB2 LYS A 529 19.057 -20.779 -6.948 1.00 0.00 H new ATOM 0 HB3 LYS A 529 17.355 -21.147 -6.755 1.00 0.00 H new ATOM 0 HG2 LYS A 529 18.630 -23.133 -6.209 1.00 0.00 H new ATOM 0 HG3 LYS A 529 17.759 -23.437 -7.699 1.00 0.00 H new ATOM 0 HD2 LYS A 529 19.818 -22.986 -9.024 1.00 0.00 H new ATOM 0 HD3 LYS A 529 20.698 -22.600 -7.558 1.00 0.00 H new ATOM 0 HE2 LYS A 529 20.292 -24.953 -6.734 1.00 0.00 H new ATOM 0 HE3 LYS A 529 19.500 -25.323 -8.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 529 21.799 -26.027 -8.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 529 21.559 -24.804 -9.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 529 22.326 -24.445 -7.951 1.00 0.00 H new ATOM 1263 N GLY A 530 17.006 -22.354 -10.483 1.00 0.00 N ATOM 1264 CA GLY A 530 15.961 -23.129 -11.156 1.00 0.00 C ATOM 1265 C GLY A 530 15.692 -22.653 -12.575 1.00 0.00 C ATOM 1266 O GLY A 530 15.218 -23.429 -13.412 1.00 0.00 O ATOM 0 H GLY A 530 17.937 -22.481 -10.881 1.00 0.00 H new ATOM 0 HA2 GLY A 530 16.253 -24.179 -11.180 1.00 0.00 H new ATOM 0 HA3 GLY A 530 15.040 -23.067 -10.577 1.00 0.00 H new ATOM 1270 N GLN A 531 15.991 -21.368 -12.857 1.00 0.00 N ATOM 1271 CA GLN A 531 15.852 -20.793 -14.214 1.00 0.00 C ATOM 1272 C GLN A 531 17.245 -20.559 -14.820 1.00 0.00 C ATOM 1273 O GLN A 531 18.017 -19.737 -14.324 1.00 0.00 O ATOM 1274 CB GLN A 531 15.000 -19.479 -14.191 1.00 0.00 C ATOM 1275 CG GLN A 531 13.685 -19.552 -15.013 1.00 0.00 C ATOM 1276 CD GLN A 531 13.870 -19.542 -16.538 1.00 0.00 C ATOM 1277 OE1 GLN A 531 14.899 -19.959 -17.078 1.00 0.00 O ATOM 1278 NE2 GLN A 531 12.847 -19.109 -17.254 1.00 0.00 N ATOM 0 H GLN A 531 16.332 -20.705 -12.161 1.00 0.00 H new ATOM 0 HA GLN A 531 15.316 -21.502 -14.845 1.00 0.00 H new ATOM 0 HB2 GLN A 531 14.755 -19.238 -13.157 1.00 0.00 H new ATOM 0 HB3 GLN A 531 15.608 -18.659 -14.574 1.00 0.00 H new ATOM 0 HG2 GLN A 531 13.149 -20.459 -14.733 1.00 0.00 H new ATOM 0 HG3 GLN A 531 13.052 -18.709 -14.733 1.00 0.00 H new ATOM 0 HE21 GLN A 531 12.006 -18.769 -16.788 1.00 0.00 H new ATOM 0 HE22 GLN A 531 12.898 -19.115 -18.273 1.00 0.00 H new ATOM 1287 N SER A 532 17.545 -21.306 -15.887 1.00 0.00 N ATOM 1288 CA SER A 532 18.821 -21.231 -16.596 1.00 0.00 C ATOM 1289 C SER A 532 18.867 -20.017 -17.541 1.00 0.00 C ATOM 1290 O SER A 532 19.936 -19.429 -17.758 1.00 0.00 O ATOM 1291 CB SER A 532 19.047 -22.544 -17.378 1.00 0.00 C ATOM 1292 OG SER A 532 17.981 -22.800 -18.278 1.00 0.00 O ATOM 0 H SER A 532 16.899 -21.987 -16.286 1.00 0.00 H new ATOM 0 HA SER A 532 19.621 -21.102 -15.867 1.00 0.00 H new ATOM 0 HB2 SER A 532 19.985 -22.484 -17.930 1.00 0.00 H new ATOM 0 HB3 SER A 532 19.142 -23.374 -16.678 1.00 0.00 H new ATOM 0 HG SER A 532 18.153 -23.636 -18.759 1.00 0.00 H new ATOM 1298 N SER A 533 17.700 -19.648 -18.095 1.00 0.00 N ATOM 1299 CA SER A 533 17.598 -18.594 -19.119 1.00 0.00 C ATOM 1300 C SER A 533 17.184 -17.230 -18.529 1.00 0.00 C ATOM 1301 O SER A 533 17.648 -16.197 -19.006 1.00 0.00 O ATOM 1302 CB SER A 533 16.572 -19.034 -20.189 1.00 0.00 C ATOM 1303 OG SER A 533 16.960 -20.257 -20.797 1.00 0.00 O ATOM 0 H SER A 533 16.805 -20.069 -17.847 1.00 0.00 H new ATOM 0 HA SER A 533 18.586 -18.461 -19.561 1.00 0.00 H new ATOM 0 HB2 SER A 533 15.590 -19.148 -19.730 1.00 0.00 H new ATOM 0 HB3 SER A 533 16.480 -18.259 -20.950 1.00 0.00 H new ATOM 0 HG SER A 533 16.294 -20.514 -21.468 1.00 0.00 H new ATOM 1309 N TRP A 534 16.339 -17.238 -17.465 1.00 0.00 N ATOM 1310 CA TRP A 534 15.705 -15.996 -16.920 1.00 0.00 C ATOM 1311 C TRP A 534 14.976 -15.234 -18.058 1.00 0.00 C ATOM 1312 O TRP A 534 14.877 -14.004 -18.049 1.00 0.00 O ATOM 1313 CB TRP A 534 16.790 -15.113 -16.221 1.00 0.00 C ATOM 1314 CG TRP A 534 16.367 -14.022 -15.228 1.00 0.00 C ATOM 1315 CD1 TRP A 534 17.249 -13.289 -14.493 1.00 0.00 C ATOM 1316 CD2 TRP A 534 15.047 -13.535 -14.847 1.00 0.00 C ATOM 1317 NE1 TRP A 534 16.594 -12.412 -13.689 1.00 0.00 N ATOM 1318 CE2 TRP A 534 15.249 -12.533 -13.881 1.00 0.00 C ATOM 1319 CE3 TRP A 534 13.728 -13.837 -15.205 1.00 0.00 C ATOM 1320 CZ2 TRP A 534 14.197 -11.845 -13.284 1.00 0.00 C ATOM 1321 CZ3 TRP A 534 12.687 -13.151 -14.618 1.00 0.00 C ATOM 1322 CH2 TRP A 534 12.925 -12.170 -13.663 1.00 0.00 C ATOM 0 H TRP A 534 16.078 -18.087 -16.964 1.00 0.00 H new ATOM 0 HA TRP A 534 14.958 -16.257 -16.170 1.00 0.00 H new ATOM 0 HB2 TRP A 534 17.466 -15.786 -15.694 1.00 0.00 H new ATOM 0 HB3 TRP A 534 17.370 -14.629 -17.007 1.00 0.00 H new ATOM 0 HD1 TRP A 534 18.323 -13.391 -14.543 1.00 0.00 H new ATOM 0 HE1 TRP A 534 17.040 -11.762 -13.041 1.00 0.00 H new ATOM 0 HE3 TRP A 534 13.527 -14.604 -15.938 1.00 0.00 H new ATOM 0 HZ2 TRP A 534 14.380 -11.079 -12.545 1.00 0.00 H new ATOM 0 HZ3 TRP A 534 11.671 -13.379 -14.904 1.00 0.00 H new ATOM 0 HH2 TRP A 534 12.090 -11.655 -13.212 1.00 0.00 H new ATOM 1333 N GLY A 535 14.439 -16.003 -19.021 1.00 0.00 N ATOM 1334 CA GLY A 535 13.811 -15.439 -20.203 1.00 0.00 C ATOM 1335 C GLY A 535 14.798 -14.726 -21.119 1.00 0.00 C ATOM 1336 O GLY A 535 14.634 -13.532 -21.412 1.00 0.00 O ATOM 0 H GLY A 535 14.433 -17.023 -18.992 1.00 0.00 H new ATOM 0 HA2 GLY A 535 13.317 -16.235 -20.760 1.00 0.00 H new ATOM 0 HA3 GLY A 535 13.036 -14.737 -19.896 1.00 0.00 H new ATOM 1340 N THR A 536 15.850 -15.451 -21.543 1.00 0.00 N ATOM 1341 CA THR A 536 16.778 -14.967 -22.586 1.00 0.00 C ATOM 1342 C THR A 536 16.103 -15.022 -23.968 1.00 0.00 C ATOM 1343 O THR A 536 15.173 -15.812 -24.195 1.00 0.00 O ATOM 1344 CB THR A 536 18.133 -15.768 -22.619 1.00 0.00 C ATOM 1345 OG1 THR A 536 17.879 -17.171 -22.445 1.00 0.00 O ATOM 1346 CG2 THR A 536 19.147 -15.279 -21.563 1.00 0.00 C ATOM 0 H THR A 536 16.080 -16.376 -21.179 1.00 0.00 H new ATOM 0 HA THR A 536 17.022 -13.935 -22.334 1.00 0.00 H new ATOM 0 HB THR A 536 18.583 -15.589 -23.596 1.00 0.00 H new ATOM 0 HG1 THR A 536 18.358 -17.495 -21.654 1.00 0.00 H new ATOM 0 HG21 THR A 536 20.061 -15.869 -21.635 1.00 0.00 H new ATOM 0 HG22 THR A 536 19.379 -14.229 -21.740 1.00 0.00 H new ATOM 0 HG23 THR A 536 18.719 -15.393 -20.567 1.00 0.00 H new ATOM 1354 N GLY A 537 16.566 -14.155 -24.876 1.00 0.00 N ATOM 1355 CA GLY A 537 16.069 -14.120 -26.240 1.00 0.00 C ATOM 1356 C GLY A 537 16.462 -12.857 -26.984 1.00 0.00 C ATOM 1357 O GLY A 537 17.411 -12.161 -26.591 1.00 0.00 O ATOM 0 H GLY A 537 17.291 -13.465 -24.679 1.00 0.00 H new ATOM 0 HA2 GLY A 537 16.449 -14.987 -26.781 1.00 0.00 H new ATOM 0 HA3 GLY A 537 14.982 -14.204 -26.227 1.00 0.00 H new ATOM 1361 N GLU A 538 15.736 -12.583 -28.082 1.00 0.00 N ATOM 1362 CA GLU A 538 15.943 -11.389 -28.911 1.00 0.00 C ATOM 1363 C GLU A 538 15.288 -10.163 -28.255 1.00 0.00 C ATOM 1364 O GLU A 538 15.972 -9.205 -27.891 1.00 0.00 O ATOM 1365 CB GLU A 538 15.330 -11.608 -30.324 1.00 0.00 C ATOM 1366 CG GLU A 538 15.345 -10.359 -31.233 1.00 0.00 C ATOM 1367 CD GLU A 538 14.536 -10.537 -32.525 1.00 0.00 C ATOM 1368 OE1 GLU A 538 13.313 -10.273 -32.512 1.00 0.00 O ATOM 1369 OE2 GLU A 538 15.119 -10.929 -33.565 1.00 0.00 O ATOM 0 H GLU A 538 14.987 -13.188 -28.418 1.00 0.00 H new ATOM 0 HA GLU A 538 17.015 -11.215 -29.004 1.00 0.00 H new ATOM 0 HB2 GLU A 538 15.875 -12.410 -30.822 1.00 0.00 H new ATOM 0 HB3 GLU A 538 14.300 -11.946 -30.210 1.00 0.00 H new ATOM 0 HG2 GLU A 538 14.947 -9.510 -30.678 1.00 0.00 H new ATOM 0 HG3 GLU A 538 16.377 -10.117 -31.489 1.00 0.00 H new ATOM 1376 N SER A 539 13.955 -10.236 -28.096 1.00 0.00 N ATOM 1377 CA SER A 539 13.109 -9.109 -27.674 1.00 0.00 C ATOM 1378 C SER A 539 12.160 -9.569 -26.562 1.00 0.00 C ATOM 1379 O SER A 539 11.474 -10.578 -26.711 1.00 0.00 O ATOM 1380 CB SER A 539 12.338 -8.550 -28.897 1.00 0.00 C ATOM 1381 OG SER A 539 11.700 -9.582 -29.636 1.00 0.00 O ATOM 0 H SER A 539 13.428 -11.094 -28.260 1.00 0.00 H new ATOM 0 HA SER A 539 13.726 -8.304 -27.275 1.00 0.00 H new ATOM 0 HB2 SER A 539 11.592 -7.831 -28.559 1.00 0.00 H new ATOM 0 HB3 SER A 539 13.028 -8.011 -29.546 1.00 0.00 H new ATOM 0 HG SER A 539 12.208 -9.760 -30.455 1.00 0.00 H new ATOM 1387 N PHE A 540 12.146 -8.826 -25.439 1.00 0.00 N ATOM 1388 CA PHE A 540 11.448 -9.238 -24.208 1.00 0.00 C ATOM 1389 C PHE A 540 11.015 -8.023 -23.357 1.00 0.00 C ATOM 1390 O PHE A 540 11.791 -7.084 -23.136 1.00 0.00 O ATOM 1391 CB PHE A 540 12.343 -10.216 -23.383 1.00 0.00 C ATOM 1392 CG PHE A 540 13.826 -9.839 -23.332 1.00 0.00 C ATOM 1393 CD1 PHE A 540 14.315 -8.911 -22.413 1.00 0.00 C ATOM 1394 CD2 PHE A 540 14.730 -10.402 -24.234 1.00 0.00 C ATOM 1395 CE1 PHE A 540 15.653 -8.566 -22.396 1.00 0.00 C ATOM 1396 CE2 PHE A 540 16.063 -10.058 -24.213 1.00 0.00 C ATOM 1397 CZ PHE A 540 16.527 -9.137 -23.299 1.00 0.00 C ATOM 0 H PHE A 540 12.618 -7.925 -25.360 1.00 0.00 H new ATOM 0 HA PHE A 540 10.536 -9.761 -24.498 1.00 0.00 H new ATOM 0 HB2 PHE A 540 11.960 -10.265 -22.364 1.00 0.00 H new ATOM 0 HB3 PHE A 540 12.251 -11.216 -23.807 1.00 0.00 H new ATOM 0 HD1 PHE A 540 13.639 -8.456 -21.705 1.00 0.00 H new ATOM 0 HD2 PHE A 540 14.378 -11.119 -24.961 1.00 0.00 H new ATOM 0 HE1 PHE A 540 16.016 -7.848 -21.675 1.00 0.00 H new ATOM 0 HE2 PHE A 540 16.747 -10.511 -24.915 1.00 0.00 H new ATOM 0 HZ PHE A 540 17.572 -8.863 -23.289 1.00 0.00 H new ATOM 1407 N ARG A 541 9.751 -8.080 -22.900 1.00 0.00 N ATOM 1408 CA ARG A 541 9.157 -7.125 -21.961 1.00 0.00 C ATOM 1409 C ARG A 541 9.630 -7.477 -20.544 1.00 0.00 C ATOM 1410 O ARG A 541 9.121 -8.430 -19.934 1.00 0.00 O ATOM 1411 CB ARG A 541 7.594 -7.178 -22.021 1.00 0.00 C ATOM 1412 CG ARG A 541 6.911 -6.559 -23.269 1.00 0.00 C ATOM 1413 CD ARG A 541 7.311 -7.207 -24.612 1.00 0.00 C ATOM 1414 NE ARG A 541 6.462 -6.756 -25.738 1.00 0.00 N ATOM 1415 CZ ARG A 541 6.397 -5.506 -26.236 1.00 0.00 C ATOM 1416 NH1 ARG A 541 7.101 -4.508 -25.720 1.00 0.00 N ATOM 1417 NH2 ARG A 541 5.588 -5.257 -27.248 1.00 0.00 N ATOM 0 H ARG A 541 9.101 -8.813 -23.184 1.00 0.00 H new ATOM 0 HA ARG A 541 9.471 -6.117 -22.230 1.00 0.00 H new ATOM 0 HB2 ARG A 541 7.288 -8.222 -21.952 1.00 0.00 H new ATOM 0 HB3 ARG A 541 7.205 -6.673 -21.137 1.00 0.00 H new ATOM 0 HG2 ARG A 541 5.830 -6.637 -23.151 1.00 0.00 H new ATOM 0 HG3 ARG A 541 7.151 -5.497 -23.308 1.00 0.00 H new ATOM 0 HD2 ARG A 541 8.352 -6.970 -24.830 1.00 0.00 H new ATOM 0 HD3 ARG A 541 7.243 -8.291 -24.522 1.00 0.00 H new ATOM 0 HE ARG A 541 5.869 -7.459 -26.179 1.00 0.00 H new ATOM 0 HH11 ARG A 541 7.714 -4.676 -24.922 1.00 0.00 H new ATOM 0 HH12 ARG A 541 7.029 -3.573 -26.121 1.00 0.00 H new ATOM 0 HH21 ARG A 541 5.021 -6.007 -27.644 1.00 0.00 H new ATOM 0 HH22 ARG A 541 5.529 -4.315 -27.634 1.00 0.00 H new ATOM 1431 N THR A 542 10.641 -6.757 -20.044 1.00 0.00 N ATOM 1432 CA THR A 542 11.080 -6.893 -18.654 1.00 0.00 C ATOM 1433 C THR A 542 10.321 -5.861 -17.814 1.00 0.00 C ATOM 1434 O THR A 542 10.492 -4.656 -18.007 1.00 0.00 O ATOM 1435 CB THR A 542 12.612 -6.686 -18.507 1.00 0.00 C ATOM 1436 OG1 THR A 542 13.311 -7.533 -19.434 1.00 0.00 O ATOM 1437 CG2 THR A 542 13.104 -6.962 -17.074 1.00 0.00 C ATOM 0 H THR A 542 11.170 -6.073 -20.585 1.00 0.00 H new ATOM 0 HA THR A 542 10.865 -7.905 -18.310 1.00 0.00 H new ATOM 0 HB THR A 542 12.822 -5.640 -18.728 1.00 0.00 H new ATOM 0 HG1 THR A 542 13.579 -7.009 -20.217 1.00 0.00 H new ATOM 0 HG21 THR A 542 14.181 -6.804 -17.022 1.00 0.00 H new ATOM 0 HG22 THR A 542 12.604 -6.285 -16.381 1.00 0.00 H new ATOM 0 HG23 THR A 542 12.875 -7.993 -16.803 1.00 0.00 H new ATOM 1445 N VAL A 543 9.451 -6.343 -16.923 1.00 0.00 N ATOM 1446 CA VAL A 543 8.554 -5.505 -16.116 1.00 0.00 C ATOM 1447 C VAL A 543 8.846 -5.720 -14.619 1.00 0.00 C ATOM 1448 O VAL A 543 9.132 -6.837 -14.207 1.00 0.00 O ATOM 1449 CB VAL A 543 7.049 -5.864 -16.425 1.00 0.00 C ATOM 1450 CG1 VAL A 543 6.085 -4.923 -15.691 1.00 0.00 C ATOM 1451 CG2 VAL A 543 6.758 -5.870 -17.949 1.00 0.00 C ATOM 0 H VAL A 543 9.347 -7.341 -16.738 1.00 0.00 H new ATOM 0 HA VAL A 543 8.726 -4.459 -16.369 1.00 0.00 H new ATOM 0 HB VAL A 543 6.882 -6.875 -16.053 1.00 0.00 H new ATOM 0 HG11 VAL A 543 5.057 -5.199 -15.927 1.00 0.00 H new ATOM 0 HG12 VAL A 543 6.245 -5.004 -14.616 1.00 0.00 H new ATOM 0 HG13 VAL A 543 6.267 -3.896 -16.008 1.00 0.00 H new ATOM 0 HG21 VAL A 543 5.711 -6.122 -18.119 1.00 0.00 H new ATOM 0 HG22 VAL A 543 6.966 -4.883 -18.363 1.00 0.00 H new ATOM 0 HG23 VAL A 543 7.393 -6.609 -18.438 1.00 0.00 H new ATOM 1461 N LEU A 544 8.797 -4.645 -13.817 1.00 0.00 N ATOM 1462 CA LEU A 544 8.865 -4.724 -12.350 1.00 0.00 C ATOM 1463 C LEU A 544 7.485 -4.379 -11.763 1.00 0.00 C ATOM 1464 O LEU A 544 6.877 -3.357 -12.117 1.00 0.00 O ATOM 1465 CB LEU A 544 9.969 -3.790 -11.787 1.00 0.00 C ATOM 1466 CG LEU A 544 10.152 -3.794 -10.231 1.00 0.00 C ATOM 1467 CD1 LEU A 544 10.375 -5.225 -9.676 1.00 0.00 C ATOM 1468 CD2 LEU A 544 11.285 -2.839 -9.816 1.00 0.00 C ATOM 0 H LEU A 544 8.709 -3.692 -14.170 1.00 0.00 H new ATOM 0 HA LEU A 544 9.132 -5.739 -12.058 1.00 0.00 H new ATOM 0 HB2 LEU A 544 10.919 -4.068 -12.244 1.00 0.00 H new ATOM 0 HB3 LEU A 544 9.749 -2.770 -12.103 1.00 0.00 H new ATOM 0 HG LEU A 544 9.225 -3.430 -9.787 1.00 0.00 H new ATOM 0 HD11 LEU A 544 10.497 -5.181 -8.594 1.00 0.00 H new ATOM 0 HD12 LEU A 544 9.514 -5.848 -9.919 1.00 0.00 H new ATOM 0 HD13 LEU A 544 11.271 -5.654 -10.125 1.00 0.00 H new ATOM 0 HD21 LEU A 544 11.396 -2.856 -8.732 1.00 0.00 H new ATOM 0 HD22 LEU A 544 12.218 -3.157 -10.282 1.00 0.00 H new ATOM 0 HD23 LEU A 544 11.044 -1.827 -10.140 1.00 0.00 H new ATOM 1480 N VAL A 545 6.996 -5.260 -10.883 1.00 0.00 N ATOM 1481 CA VAL A 545 5.698 -5.142 -10.197 1.00 0.00 C ATOM 1482 C VAL A 545 5.948 -5.046 -8.683 1.00 0.00 C ATOM 1483 O VAL A 545 6.933 -5.597 -8.184 1.00 0.00 O ATOM 1484 CB VAL A 545 4.807 -6.394 -10.544 1.00 0.00 C ATOM 1485 CG1 VAL A 545 3.476 -6.426 -9.759 1.00 0.00 C ATOM 1486 CG2 VAL A 545 4.557 -6.477 -12.065 1.00 0.00 C ATOM 0 H VAL A 545 7.506 -6.102 -10.618 1.00 0.00 H new ATOM 0 HA VAL A 545 5.171 -4.247 -10.526 1.00 0.00 H new ATOM 0 HB VAL A 545 5.367 -7.275 -10.229 1.00 0.00 H new ATOM 0 HG11 VAL A 545 2.908 -7.312 -10.042 1.00 0.00 H new ATOM 0 HG12 VAL A 545 3.685 -6.456 -8.690 1.00 0.00 H new ATOM 0 HG13 VAL A 545 2.895 -5.533 -9.991 1.00 0.00 H new ATOM 0 HG21 VAL A 545 3.940 -7.348 -12.285 1.00 0.00 H new ATOM 0 HG22 VAL A 545 4.044 -5.575 -12.399 1.00 0.00 H new ATOM 0 HG23 VAL A 545 5.510 -6.567 -12.586 1.00 0.00 H new ATOM 1496 N ASN A 546 5.061 -4.339 -7.958 1.00 0.00 N ATOM 1497 CA ASN A 546 5.198 -4.127 -6.497 1.00 0.00 C ATOM 1498 C ASN A 546 4.229 -5.036 -5.707 1.00 0.00 C ATOM 1499 O ASN A 546 3.561 -5.899 -6.291 1.00 0.00 O ATOM 1500 CB ASN A 546 4.977 -2.628 -6.148 1.00 0.00 C ATOM 1501 CG ASN A 546 3.514 -2.176 -6.186 1.00 0.00 C ATOM 1502 OD1 ASN A 546 2.896 -1.967 -5.152 1.00 0.00 O ATOM 1503 ND2 ASN A 546 2.937 -2.087 -7.366 1.00 0.00 N ATOM 0 H ASN A 546 4.233 -3.900 -8.361 1.00 0.00 H new ATOM 0 HA ASN A 546 6.211 -4.401 -6.203 1.00 0.00 H new ATOM 0 HB2 ASN A 546 5.377 -2.437 -5.152 1.00 0.00 H new ATOM 0 HB3 ASN A 546 5.551 -2.017 -6.845 1.00 0.00 H new ATOM 0 HD21 ASN A 546 1.950 -1.838 -7.434 1.00 0.00 H new ATOM 0 HD22 ASN A 546 3.477 -2.267 -8.213 1.00 0.00 H new ATOM 1510 N ALA A 547 4.151 -4.803 -4.379 1.00 0.00 N ATOM 1511 CA ALA A 547 3.316 -5.595 -3.447 1.00 0.00 C ATOM 1512 C ALA A 547 1.806 -5.537 -3.775 1.00 0.00 C ATOM 1513 O ALA A 547 1.071 -6.505 -3.528 1.00 0.00 O ATOM 1514 CB ALA A 547 3.555 -5.106 -2.013 1.00 0.00 C ATOM 0 H ALA A 547 4.669 -4.054 -3.919 1.00 0.00 H new ATOM 0 HA ALA A 547 3.616 -6.637 -3.556 1.00 0.00 H new ATOM 0 HB1 ALA A 547 2.942 -5.687 -1.324 1.00 0.00 H new ATOM 0 HB2 ALA A 547 4.607 -5.231 -1.757 1.00 0.00 H new ATOM 0 HB3 ALA A 547 3.286 -4.052 -1.938 1.00 0.00 H new ATOM 1520 N ASP A 548 1.357 -4.385 -4.302 1.00 0.00 N ATOM 1521 CA ASP A 548 -0.054 -4.152 -4.680 1.00 0.00 C ATOM 1522 C ASP A 548 -0.486 -5.057 -5.850 1.00 0.00 C ATOM 1523 O ASP A 548 -1.632 -5.527 -5.894 1.00 0.00 O ATOM 1524 CB ASP A 548 -0.254 -2.664 -5.047 1.00 0.00 C ATOM 1525 CG ASP A 548 -1.670 -2.337 -5.562 1.00 0.00 C ATOM 1526 OD1 ASP A 548 -2.607 -2.239 -4.744 1.00 0.00 O ATOM 1527 OD2 ASP A 548 -1.852 -2.184 -6.787 1.00 0.00 O ATOM 0 H ASP A 548 1.963 -3.584 -4.480 1.00 0.00 H new ATOM 0 HA ASP A 548 -0.682 -4.403 -3.825 1.00 0.00 H new ATOM 0 HB2 ASP A 548 -0.046 -2.052 -4.170 1.00 0.00 H new ATOM 0 HB3 ASP A 548 0.473 -2.386 -5.810 1.00 0.00 H new ATOM 1532 N GLY A 549 0.447 -5.295 -6.791 1.00 0.00 N ATOM 1533 CA GLY A 549 0.179 -6.128 -7.970 1.00 0.00 C ATOM 1534 C GLY A 549 0.144 -5.338 -9.276 1.00 0.00 C ATOM 1535 O GLY A 549 0.071 -5.939 -10.354 1.00 0.00 O ATOM 0 H GLY A 549 1.395 -4.919 -6.754 1.00 0.00 H new ATOM 0 HA2 GLY A 549 0.945 -6.900 -8.042 1.00 0.00 H new ATOM 0 HA3 GLY A 549 -0.775 -6.637 -7.836 1.00 0.00 H new ATOM 1539 N GLU A 550 0.190 -3.996 -9.189 1.00 0.00 N ATOM 1540 CA GLU A 550 0.317 -3.129 -10.379 1.00 0.00 C ATOM 1541 C GLU A 550 1.792 -3.009 -10.813 1.00 0.00 C ATOM 1542 O GLU A 550 2.715 -3.133 -9.987 1.00 0.00 O ATOM 1543 CB GLU A 550 -0.295 -1.724 -10.112 1.00 0.00 C ATOM 1544 CG GLU A 550 0.379 -0.914 -8.987 1.00 0.00 C ATOM 1545 CD GLU A 550 -0.249 0.471 -8.746 1.00 0.00 C ATOM 1546 OE1 GLU A 550 -1.402 0.537 -8.277 1.00 0.00 O ATOM 1547 OE2 GLU A 550 0.420 1.495 -8.997 1.00 0.00 O ATOM 0 H GLU A 550 0.141 -3.486 -8.307 1.00 0.00 H new ATOM 0 HA GLU A 550 -0.242 -3.591 -11.193 1.00 0.00 H new ATOM 0 HB2 GLU A 550 -0.247 -1.144 -11.034 1.00 0.00 H new ATOM 0 HB3 GLU A 550 -1.350 -1.846 -9.867 1.00 0.00 H new ATOM 0 HG2 GLU A 550 0.331 -1.488 -8.062 1.00 0.00 H new ATOM 0 HG3 GLU A 550 1.434 -0.786 -9.229 1.00 0.00 H new ATOM 1554 N GLU A 551 1.994 -2.783 -12.122 1.00 0.00 N ATOM 1555 CA GLU A 551 3.327 -2.657 -12.742 1.00 0.00 C ATOM 1556 C GLU A 551 3.871 -1.238 -12.495 1.00 0.00 C ATOM 1557 O GLU A 551 3.307 -0.250 -12.986 1.00 0.00 O ATOM 1558 CB GLU A 551 3.255 -2.956 -14.268 1.00 0.00 C ATOM 1559 CG GLU A 551 2.805 -4.386 -14.663 1.00 0.00 C ATOM 1560 CD GLU A 551 1.388 -4.777 -14.227 1.00 0.00 C ATOM 1561 OE1 GLU A 551 0.418 -4.156 -14.715 1.00 0.00 O ATOM 1562 OE2 GLU A 551 1.243 -5.710 -13.408 1.00 0.00 O ATOM 0 H GLU A 551 1.228 -2.681 -12.788 1.00 0.00 H new ATOM 0 HA GLU A 551 4.001 -3.385 -12.290 1.00 0.00 H new ATOM 0 HB2 GLU A 551 2.570 -2.242 -14.725 1.00 0.00 H new ATOM 0 HB3 GLU A 551 4.239 -2.775 -14.700 1.00 0.00 H new ATOM 0 HG2 GLU A 551 2.872 -4.483 -15.747 1.00 0.00 H new ATOM 0 HG3 GLU A 551 3.508 -5.100 -14.235 1.00 0.00 H new ATOM 1569 N VAL A 552 4.948 -1.146 -11.700 1.00 0.00 N ATOM 1570 CA VAL A 552 5.546 0.143 -11.322 1.00 0.00 C ATOM 1571 C VAL A 552 6.616 0.598 -12.328 1.00 0.00 C ATOM 1572 O VAL A 552 6.862 1.799 -12.469 1.00 0.00 O ATOM 1573 CB VAL A 552 6.154 0.100 -9.877 1.00 0.00 C ATOM 1574 CG1 VAL A 552 5.040 -0.025 -8.819 1.00 0.00 C ATOM 1575 CG2 VAL A 552 7.208 -1.031 -9.726 1.00 0.00 C ATOM 0 H VAL A 552 5.425 -1.956 -11.304 1.00 0.00 H new ATOM 0 HA VAL A 552 4.735 0.871 -11.334 1.00 0.00 H new ATOM 0 HB VAL A 552 6.675 1.043 -9.711 1.00 0.00 H new ATOM 0 HG11 VAL A 552 5.485 -0.053 -7.824 1.00 0.00 H new ATOM 0 HG12 VAL A 552 4.370 0.832 -8.893 1.00 0.00 H new ATOM 0 HG13 VAL A 552 4.477 -0.942 -8.991 1.00 0.00 H new ATOM 0 HG21 VAL A 552 7.604 -1.026 -8.711 1.00 0.00 H new ATOM 0 HG22 VAL A 552 6.740 -1.994 -9.928 1.00 0.00 H new ATOM 0 HG23 VAL A 552 8.021 -0.868 -10.433 1.00 0.00 H new ATOM 1585 N ALA A 553 7.231 -0.365 -13.031 1.00 0.00 N ATOM 1586 CA ALA A 553 8.291 -0.101 -14.015 1.00 0.00 C ATOM 1587 C ALA A 553 8.178 -1.096 -15.178 1.00 0.00 C ATOM 1588 O ALA A 553 7.730 -2.223 -14.980 1.00 0.00 O ATOM 1589 CB ALA A 553 9.680 -0.176 -13.345 1.00 0.00 C ATOM 0 H ALA A 553 7.005 -1.355 -12.932 1.00 0.00 H new ATOM 0 HA ALA A 553 8.170 0.907 -14.412 1.00 0.00 H new ATOM 0 HB1 ALA A 553 10.453 0.022 -14.087 1.00 0.00 H new ATOM 0 HB2 ALA A 553 9.741 0.567 -12.550 1.00 0.00 H new ATOM 0 HB3 ALA A 553 9.828 -1.170 -12.924 1.00 0.00 H new ATOM 1595 N MET A 554 8.571 -0.662 -16.383 1.00 0.00 N ATOM 1596 CA MET A 554 8.552 -1.498 -17.597 1.00 0.00 C ATOM 1597 C MET A 554 9.641 -1.018 -18.569 1.00 0.00 C ATOM 1598 O MET A 554 9.798 0.193 -18.787 1.00 0.00 O ATOM 1599 CB MET A 554 7.155 -1.454 -18.282 1.00 0.00 C ATOM 1600 CG MET A 554 7.027 -2.300 -19.562 1.00 0.00 C ATOM 1601 SD MET A 554 5.418 -2.116 -20.361 1.00 0.00 S ATOM 1602 CE MET A 554 5.645 -3.093 -21.846 1.00 0.00 C ATOM 0 H MET A 554 8.914 0.285 -16.547 1.00 0.00 H new ATOM 0 HA MET A 554 8.752 -2.531 -17.313 1.00 0.00 H new ATOM 0 HB2 MET A 554 6.406 -1.792 -17.566 1.00 0.00 H new ATOM 0 HB3 MET A 554 6.919 -0.418 -18.525 1.00 0.00 H new ATOM 0 HG2 MET A 554 7.811 -2.012 -20.263 1.00 0.00 H new ATOM 0 HG3 MET A 554 7.188 -3.350 -19.316 1.00 0.00 H new ATOM 0 HE1 MET A 554 4.731 -3.071 -22.439 1.00 0.00 H new ATOM 0 HE2 MET A 554 6.467 -2.680 -22.431 1.00 0.00 H new ATOM 0 HE3 MET A 554 5.876 -4.123 -21.572 1.00 0.00 H new ATOM 1612 N ARG A 555 10.370 -1.978 -19.155 1.00 0.00 N ATOM 1613 CA ARG A 555 11.467 -1.706 -20.088 1.00 0.00 C ATOM 1614 C ARG A 555 11.661 -2.927 -21.009 1.00 0.00 C ATOM 1615 O ARG A 555 12.075 -4.005 -20.555 1.00 0.00 O ATOM 1616 CB ARG A 555 12.762 -1.370 -19.303 1.00 0.00 C ATOM 1617 CG ARG A 555 13.999 -1.058 -20.176 1.00 0.00 C ATOM 1618 CD ARG A 555 15.228 -0.701 -19.326 1.00 0.00 C ATOM 1619 NE ARG A 555 16.461 -0.605 -20.128 1.00 0.00 N ATOM 1620 CZ ARG A 555 17.671 -0.311 -19.634 1.00 0.00 C ATOM 1621 NH1 ARG A 555 17.824 0.001 -18.357 1.00 0.00 N ATOM 1622 NH2 ARG A 555 18.720 -0.303 -20.430 1.00 0.00 N ATOM 0 H ARG A 555 10.212 -2.972 -18.992 1.00 0.00 H new ATOM 0 HA ARG A 555 11.226 -0.842 -20.707 1.00 0.00 H new ATOM 0 HB2 ARG A 555 12.566 -0.512 -18.660 1.00 0.00 H new ATOM 0 HB3 ARG A 555 13.000 -2.210 -18.650 1.00 0.00 H new ATOM 0 HG2 ARG A 555 14.229 -1.921 -20.801 1.00 0.00 H new ATOM 0 HG3 ARG A 555 13.770 -0.230 -20.847 1.00 0.00 H new ATOM 0 HD2 ARG A 555 15.053 0.249 -18.820 1.00 0.00 H new ATOM 0 HD3 ARG A 555 15.361 -1.455 -18.550 1.00 0.00 H new ATOM 0 HE ARG A 555 16.388 -0.775 -21.131 1.00 0.00 H new ATOM 0 HH11 ARG A 555 17.015 0.020 -17.736 1.00 0.00 H new ATOM 0 HH12 ARG A 555 18.751 0.223 -17.994 1.00 0.00 H new ATOM 0 HH21 ARG A 555 18.610 -0.520 -21.421 1.00 0.00 H new ATOM 0 HH22 ARG A 555 19.642 -0.079 -20.056 1.00 0.00 H new ATOM 1636 N THR A 556 11.324 -2.757 -22.295 1.00 0.00 N ATOM 1637 CA THR A 556 11.448 -3.810 -23.312 1.00 0.00 C ATOM 1638 C THR A 556 12.775 -3.662 -24.079 1.00 0.00 C ATOM 1639 O THR A 556 12.997 -2.649 -24.750 1.00 0.00 O ATOM 1640 CB THR A 556 10.246 -3.770 -24.310 1.00 0.00 C ATOM 1641 OG1 THR A 556 9.009 -3.910 -23.587 1.00 0.00 O ATOM 1642 CG2 THR A 556 10.355 -4.869 -25.389 1.00 0.00 C ATOM 0 H THR A 556 10.955 -1.879 -22.661 1.00 0.00 H new ATOM 0 HA THR A 556 11.439 -4.773 -22.801 1.00 0.00 H new ATOM 0 HB THR A 556 10.269 -2.807 -24.820 1.00 0.00 H new ATOM 0 HG1 THR A 556 8.389 -3.201 -23.859 1.00 0.00 H new ATOM 0 HG21 THR A 556 9.499 -4.805 -26.061 1.00 0.00 H new ATOM 0 HG22 THR A 556 11.275 -4.731 -25.958 1.00 0.00 H new ATOM 0 HG23 THR A 556 10.368 -5.848 -24.911 1.00 0.00 H new ATOM 1650 N VAL A 557 13.646 -4.680 -23.967 1.00 0.00 N ATOM 1651 CA VAL A 557 14.950 -4.716 -24.654 1.00 0.00 C ATOM 1652 C VAL A 557 14.893 -5.730 -25.803 1.00 0.00 C ATOM 1653 O VAL A 557 14.478 -6.877 -25.602 1.00 0.00 O ATOM 1654 CB VAL A 557 16.125 -5.067 -23.663 1.00 0.00 C ATOM 1655 CG1 VAL A 557 17.499 -5.171 -24.394 1.00 0.00 C ATOM 1656 CG2 VAL A 557 16.181 -4.034 -22.517 1.00 0.00 C ATOM 0 H VAL A 557 13.465 -5.505 -23.395 1.00 0.00 H new ATOM 0 HA VAL A 557 15.154 -3.722 -25.053 1.00 0.00 H new ATOM 0 HB VAL A 557 15.920 -6.050 -23.240 1.00 0.00 H new ATOM 0 HG11 VAL A 557 18.278 -5.414 -23.671 1.00 0.00 H new ATOM 0 HG12 VAL A 557 17.450 -5.953 -25.152 1.00 0.00 H new ATOM 0 HG13 VAL A 557 17.731 -4.218 -24.870 1.00 0.00 H new ATOM 0 HG21 VAL A 557 16.996 -4.287 -21.839 1.00 0.00 H new ATOM 0 HG22 VAL A 557 16.348 -3.040 -22.931 1.00 0.00 H new ATOM 0 HG23 VAL A 557 15.238 -4.045 -21.971 1.00 0.00 H new ATOM 1666 N LYS A 558 15.291 -5.274 -27.004 1.00 0.00 N ATOM 1667 CA LYS A 558 15.400 -6.105 -28.211 1.00 0.00 C ATOM 1668 C LYS A 558 16.853 -6.129 -28.686 1.00 0.00 C ATOM 1669 O LYS A 558 17.648 -5.239 -28.336 1.00 0.00 O ATOM 1670 CB LYS A 558 14.432 -5.652 -29.359 1.00 0.00 C ATOM 1671 CG LYS A 558 14.388 -4.140 -29.676 1.00 0.00 C ATOM 1672 CD LYS A 558 13.525 -3.339 -28.668 1.00 0.00 C ATOM 1673 CE LYS A 558 13.375 -1.864 -29.055 1.00 0.00 C ATOM 1674 NZ LYS A 558 14.687 -1.163 -29.147 1.00 0.00 N ATOM 0 H LYS A 558 15.550 -4.300 -27.163 1.00 0.00 H new ATOM 0 HA LYS A 558 15.088 -7.115 -27.945 1.00 0.00 H new ATOM 0 HB2 LYS A 558 14.713 -6.182 -30.269 1.00 0.00 H new ATOM 0 HB3 LYS A 558 13.423 -5.975 -29.100 1.00 0.00 H new ATOM 0 HG2 LYS A 558 15.403 -3.743 -29.673 1.00 0.00 H new ATOM 0 HG3 LYS A 558 13.992 -3.996 -30.681 1.00 0.00 H new ATOM 0 HD2 LYS A 558 12.537 -3.794 -28.600 1.00 0.00 H new ATOM 0 HD3 LYS A 558 13.975 -3.406 -27.678 1.00 0.00 H new ATOM 0 HE2 LYS A 558 12.861 -1.793 -30.013 1.00 0.00 H new ATOM 0 HE3 LYS A 558 12.748 -1.360 -28.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 558 14.530 -0.161 -29.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 558 15.183 -1.235 -28.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 558 15.264 -1.603 -29.891 1.00 0.00 H new ATOM 1688 N LYS A 559 17.191 -7.180 -29.461 1.00 0.00 N ATOM 1689 CA LYS A 559 18.573 -7.455 -29.903 1.00 0.00 C ATOM 1690 C LYS A 559 19.126 -6.319 -30.787 1.00 0.00 C ATOM 1691 O LYS A 559 18.825 -6.229 -31.985 1.00 0.00 O ATOM 1692 CB LYS A 559 18.672 -8.820 -30.636 1.00 0.00 C ATOM 1693 CG LYS A 559 20.118 -9.340 -30.838 1.00 0.00 C ATOM 1694 CD LYS A 559 20.856 -9.610 -29.506 1.00 0.00 C ATOM 1695 CE LYS A 559 20.124 -10.629 -28.602 1.00 0.00 C ATOM 1696 NZ LYS A 559 20.873 -10.904 -27.353 1.00 0.00 N ATOM 0 H LYS A 559 16.512 -7.863 -29.798 1.00 0.00 H new ATOM 0 HA LYS A 559 19.190 -7.508 -29.006 1.00 0.00 H new ATOM 0 HB2 LYS A 559 18.108 -9.563 -30.071 1.00 0.00 H new ATOM 0 HB3 LYS A 559 18.193 -8.730 -31.611 1.00 0.00 H new ATOM 0 HG2 LYS A 559 20.089 -10.259 -31.423 1.00 0.00 H new ATOM 0 HG3 LYS A 559 20.683 -8.610 -31.418 1.00 0.00 H new ATOM 0 HD2 LYS A 559 21.859 -9.979 -29.722 1.00 0.00 H new ATOM 0 HD3 LYS A 559 20.972 -8.671 -28.965 1.00 0.00 H new ATOM 0 HE2 LYS A 559 19.134 -10.247 -28.354 1.00 0.00 H new ATOM 0 HE3 LYS A 559 19.979 -11.560 -29.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 559 20.787 -11.912 -27.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 559 21.876 -10.665 -27.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 559 20.483 -10.328 -26.580 1.00 0.00 H new