USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 835 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 531 GLN : amide:sc= 0 K(o=0.0076,f=-1.5) USER MOD Set 1.2: A 533 SER OG : rot 180:sc= 0.00762 USER MOD Set 2.1: A 467 GLN : amide:sc= -0.644 K(o=-0.095,f=-0.96!) USER MOD Set 2.2: A 510 THR OG1 : rot -140:sc= 0.549 USER MOD Single : A 453 SER OG : rot 28:sc= 0.0507 USER MOD Single : A 455 SER OG : rot 180:sc= -0.0476 USER MOD Single : A 464 LYS NZ :NH3+ 167:sc= 1.68 (180deg=1.36) USER MOD Single : A 469 LYS NZ :NH3+ -176:sc= 0.89 (180deg=0.877) USER MOD Single : A 470 ASN : amide:sc= -2.11! C(o=-2.1!,f=-7.7!) USER MOD Single : A 471 ASN : amide:sc= -0.417 K(o=-0.42,f=-4.6!) USER MOD Single : A 472 SER OG : rot -119:sc= 0.0603 USER MOD Single : A 474 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 476 GLN : amide:sc= -0.294 X(o=-0.29,f=-0.15) USER MOD Single : A 477 SER OG : rot 30:sc= 0.0725 USER MOD Single : A 480 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 484 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0276) USER MOD Single : A 486 GLN : amide:sc= 0.214 K(o=0.21,f=-5.1!) USER MOD Single : A 495 TYR OH : rot 180:sc= 0 USER MOD Single : A 496 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0356) USER MOD Single : A 498 THR OG1 : rot 180:sc= -0.271 USER MOD Single : A 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 501 TYR OH : rot -158:sc= 0.134 USER MOD Single : A 507 GLN : amide:sc= 0.0215 X(o=0.022,f=-0.045) USER MOD Single : A 508 MET CE :methyl 164:sc= -0.0752 (180deg=-0.441) USER MOD Single : A 520 HIS : no HE2:sc= -0.157 X(o=-0.16,f=-0.3) USER MOD Single : A 521 SER OG : rot 180:sc= 0 USER MOD Single : A 524 SER OG : rot 180:sc= 0 USER MOD Single : A 525 THR OG1 : rot 180:sc= 0 USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 532 SER OG : rot 180:sc= 0 USER MOD Single : A 536 THR OG1 : rot 27:sc= 0.352 USER MOD Single : A 539 SER OG : rot 180:sc= 0 USER MOD Single : A 542 THR OG1 : rot -170:sc= 0 USER MOD Single : A 546 ASN :FLIP amide:sc= -3.28! C(o=-3.8!,f=-3.3!) USER MOD Single : A 554 MET CE :methyl 141:sc= -0.15 (180deg=-0.579) USER MOD Single : A 556 THR OG1 : rot 180:sc= 0 USER MOD Single : A 558 LYS NZ :NH3+ 170:sc= -0.919 (180deg=-1.24) USER MOD Single : A 559 LYS NZ :NH3+ 173:sc= 0.964 (180deg=0.943) USER MOD ----------------------------------------------------------------- ATOM 40 N SER A 453 10.034 2.902 -6.187 1.00 0.00 N ATOM 41 CA SER A 453 10.993 2.785 -5.065 1.00 0.00 C ATOM 42 C SER A 453 12.178 1.869 -5.424 1.00 0.00 C ATOM 43 O SER A 453 13.299 2.067 -4.946 1.00 0.00 O ATOM 44 CB SER A 453 10.266 2.278 -3.812 1.00 0.00 C ATOM 45 OG SER A 453 9.264 3.200 -3.421 1.00 0.00 O ATOM 0 HA SER A 453 11.404 3.774 -4.861 1.00 0.00 H new ATOM 0 HB2 SER A 453 9.817 1.305 -4.012 1.00 0.00 H new ATOM 0 HB3 SER A 453 10.980 2.139 -3.000 1.00 0.00 H new ATOM 0 HG SER A 453 8.947 3.691 -4.207 1.00 0.00 H new ATOM 51 N VAL A 454 11.899 0.852 -6.250 1.00 0.00 N ATOM 52 CA VAL A 454 12.916 0.097 -6.991 1.00 0.00 C ATOM 53 C VAL A 454 12.527 0.199 -8.474 1.00 0.00 C ATOM 54 O VAL A 454 11.339 0.089 -8.815 1.00 0.00 O ATOM 55 CB VAL A 454 13.014 -1.421 -6.566 1.00 0.00 C ATOM 56 CG1 VAL A 454 14.272 -2.096 -7.171 1.00 0.00 C ATOM 57 CG2 VAL A 454 12.954 -1.592 -5.028 1.00 0.00 C ATOM 0 H VAL A 454 10.948 0.527 -6.424 1.00 0.00 H new ATOM 0 HA VAL A 454 13.898 0.519 -6.779 1.00 0.00 H new ATOM 0 HB VAL A 454 12.142 -1.931 -6.976 1.00 0.00 H new ATOM 0 HG11 VAL A 454 14.310 -3.140 -6.860 1.00 0.00 H new ATOM 0 HG12 VAL A 454 14.226 -2.043 -8.259 1.00 0.00 H new ATOM 0 HG13 VAL A 454 15.166 -1.580 -6.821 1.00 0.00 H new ATOM 0 HG21 VAL A 454 13.024 -2.650 -4.777 1.00 0.00 H new ATOM 0 HG22 VAL A 454 13.784 -1.054 -4.569 1.00 0.00 H new ATOM 0 HG23 VAL A 454 12.011 -1.192 -4.654 1.00 0.00 H new ATOM 67 N SER A 455 13.517 0.427 -9.336 1.00 0.00 N ATOM 68 CA SER A 455 13.328 0.561 -10.788 1.00 0.00 C ATOM 69 C SER A 455 14.329 -0.347 -11.514 1.00 0.00 C ATOM 70 O SER A 455 15.225 -0.924 -10.888 1.00 0.00 O ATOM 71 CB SER A 455 13.500 2.041 -11.212 1.00 0.00 C ATOM 72 OG SER A 455 13.209 2.231 -12.589 1.00 0.00 O ATOM 0 H SER A 455 14.490 0.526 -9.045 1.00 0.00 H new ATOM 0 HA SER A 455 12.319 0.253 -11.060 1.00 0.00 H new ATOM 0 HB2 SER A 455 12.843 2.670 -10.611 1.00 0.00 H new ATOM 0 HB3 SER A 455 14.522 2.361 -11.009 1.00 0.00 H new ATOM 0 HG SER A 455 13.326 3.176 -12.821 1.00 0.00 H new ATOM 78 N ILE A 456 14.158 -0.481 -12.836 1.00 0.00 N ATOM 79 CA ILE A 456 15.044 -1.299 -13.679 1.00 0.00 C ATOM 80 C ILE A 456 16.245 -0.453 -14.154 1.00 0.00 C ATOM 81 O ILE A 456 16.064 0.550 -14.856 1.00 0.00 O ATOM 82 CB ILE A 456 14.266 -1.888 -14.912 1.00 0.00 C ATOM 83 CG1 ILE A 456 13.006 -2.690 -14.441 1.00 0.00 C ATOM 84 CG2 ILE A 456 15.198 -2.769 -15.782 1.00 0.00 C ATOM 85 CD1 ILE A 456 12.121 -3.215 -15.567 1.00 0.00 C ATOM 0 H ILE A 456 13.404 -0.027 -13.351 1.00 0.00 H new ATOM 0 HA ILE A 456 15.410 -2.136 -13.084 1.00 0.00 H new ATOM 0 HB ILE A 456 13.923 -1.057 -15.528 1.00 0.00 H new ATOM 0 HG12 ILE A 456 13.336 -3.533 -13.835 1.00 0.00 H new ATOM 0 HG13 ILE A 456 12.406 -2.049 -13.796 1.00 0.00 H new ATOM 0 HG21 ILE A 456 14.638 -3.165 -16.629 1.00 0.00 H new ATOM 0 HG22 ILE A 456 16.031 -2.168 -16.147 1.00 0.00 H new ATOM 0 HG23 ILE A 456 15.582 -3.594 -15.183 1.00 0.00 H new ATOM 0 HD11 ILE A 456 11.275 -3.756 -15.143 1.00 0.00 H new ATOM 0 HD12 ILE A 456 11.755 -2.378 -16.162 1.00 0.00 H new ATOM 0 HD13 ILE A 456 12.700 -3.886 -16.202 1.00 0.00 H new ATOM 97 N GLU A 457 17.460 -0.864 -13.746 1.00 0.00 N ATOM 98 CA GLU A 457 18.712 -0.176 -14.108 1.00 0.00 C ATOM 99 C GLU A 457 19.211 -0.653 -15.486 1.00 0.00 C ATOM 100 O GLU A 457 19.329 0.142 -16.423 1.00 0.00 O ATOM 101 CB GLU A 457 19.802 -0.425 -13.022 1.00 0.00 C ATOM 102 CG GLU A 457 21.165 0.265 -13.274 1.00 0.00 C ATOM 103 CD GLU A 457 21.108 1.806 -13.222 1.00 0.00 C ATOM 104 OE1 GLU A 457 20.687 2.441 -14.221 1.00 0.00 O ATOM 105 OE2 GLU A 457 21.476 2.393 -12.182 1.00 0.00 O ATOM 0 H GLU A 457 17.601 -1.684 -13.155 1.00 0.00 H new ATOM 0 HA GLU A 457 18.514 0.894 -14.163 1.00 0.00 H new ATOM 0 HB2 GLU A 457 19.416 -0.087 -12.060 1.00 0.00 H new ATOM 0 HB3 GLU A 457 19.968 -1.499 -12.939 1.00 0.00 H new ATOM 0 HG2 GLU A 457 21.881 -0.087 -12.532 1.00 0.00 H new ATOM 0 HG3 GLU A 457 21.541 -0.042 -14.250 1.00 0.00 H new ATOM 112 N GLU A 458 19.522 -1.965 -15.586 1.00 0.00 N ATOM 113 CA GLU A 458 20.057 -2.594 -16.815 1.00 0.00 C ATOM 114 C GLU A 458 19.425 -3.981 -17.003 1.00 0.00 C ATOM 115 O GLU A 458 18.919 -4.576 -16.045 1.00 0.00 O ATOM 116 CB GLU A 458 21.614 -2.739 -16.765 1.00 0.00 C ATOM 117 CG GLU A 458 22.381 -1.441 -16.432 1.00 0.00 C ATOM 118 CD GLU A 458 23.894 -1.503 -16.719 1.00 0.00 C ATOM 119 OE1 GLU A 458 24.276 -1.872 -17.852 1.00 0.00 O ATOM 120 OE2 GLU A 458 24.705 -1.138 -15.838 1.00 0.00 O ATOM 0 H GLU A 458 19.408 -2.620 -14.813 1.00 0.00 H new ATOM 0 HA GLU A 458 19.805 -1.946 -17.654 1.00 0.00 H new ATOM 0 HB2 GLU A 458 21.870 -3.495 -16.022 1.00 0.00 H new ATOM 0 HB3 GLU A 458 21.960 -3.110 -17.730 1.00 0.00 H new ATOM 0 HG2 GLU A 458 21.948 -0.621 -17.005 1.00 0.00 H new ATOM 0 HG3 GLU A 458 22.233 -1.206 -15.378 1.00 0.00 H new ATOM 127 N ILE A 459 19.442 -4.485 -18.251 1.00 0.00 N ATOM 128 CA ILE A 459 19.017 -5.862 -18.584 1.00 0.00 C ATOM 129 C ILE A 459 19.957 -6.406 -19.669 1.00 0.00 C ATOM 130 O ILE A 459 20.353 -5.666 -20.572 1.00 0.00 O ATOM 131 CB ILE A 459 17.523 -5.957 -19.105 1.00 0.00 C ATOM 132 CG1 ILE A 459 16.530 -5.247 -18.139 1.00 0.00 C ATOM 133 CG2 ILE A 459 17.103 -7.438 -19.310 1.00 0.00 C ATOM 134 CD1 ILE A 459 15.107 -5.121 -18.654 1.00 0.00 C ATOM 0 H ILE A 459 19.752 -3.948 -19.061 1.00 0.00 H new ATOM 0 HA ILE A 459 19.066 -6.447 -17.666 1.00 0.00 H new ATOM 0 HB ILE A 459 17.483 -5.443 -20.065 1.00 0.00 H new ATOM 0 HG12 ILE A 459 16.511 -5.794 -17.196 1.00 0.00 H new ATOM 0 HG13 ILE A 459 16.910 -4.249 -17.921 1.00 0.00 H new ATOM 0 HG21 ILE A 459 16.074 -7.478 -19.668 1.00 0.00 H new ATOM 0 HG22 ILE A 459 17.761 -7.905 -20.043 1.00 0.00 H new ATOM 0 HG23 ILE A 459 17.179 -7.972 -18.363 1.00 0.00 H new ATOM 0 HD11 ILE A 459 14.494 -4.613 -17.909 1.00 0.00 H new ATOM 0 HD12 ILE A 459 15.105 -4.545 -19.580 1.00 0.00 H new ATOM 0 HD13 ILE A 459 14.699 -6.114 -18.843 1.00 0.00 H new ATOM 146 N ASP A 460 20.321 -7.689 -19.554 1.00 0.00 N ATOM 147 CA ASP A 460 21.167 -8.381 -20.540 1.00 0.00 C ATOM 148 C ASP A 460 20.362 -8.773 -21.807 1.00 0.00 C ATOM 149 O ASP A 460 19.165 -9.066 -21.721 1.00 0.00 O ATOM 150 CB ASP A 460 21.802 -9.620 -19.886 1.00 0.00 C ATOM 151 CG ASP A 460 22.731 -10.396 -20.835 1.00 0.00 C ATOM 152 OD1 ASP A 460 23.750 -9.836 -21.288 1.00 0.00 O ATOM 153 OD2 ASP A 460 22.428 -11.551 -21.148 1.00 0.00 O ATOM 0 H ASP A 460 20.037 -8.280 -18.773 1.00 0.00 H new ATOM 0 HA ASP A 460 21.955 -7.700 -20.862 1.00 0.00 H new ATOM 0 HB2 ASP A 460 22.368 -9.310 -19.007 1.00 0.00 H new ATOM 0 HB3 ASP A 460 21.011 -10.285 -19.538 1.00 0.00 H new ATOM 158 N LEU A 461 21.053 -8.795 -22.967 1.00 0.00 N ATOM 159 CA LEU A 461 20.441 -9.074 -24.289 1.00 0.00 C ATOM 160 C LEU A 461 20.137 -10.580 -24.504 1.00 0.00 C ATOM 161 O LEU A 461 19.254 -10.938 -25.296 1.00 0.00 O ATOM 162 CB LEU A 461 21.323 -8.459 -25.430 1.00 0.00 C ATOM 163 CG LEU A 461 22.886 -8.669 -25.365 1.00 0.00 C ATOM 164 CD1 LEU A 461 23.321 -10.133 -25.585 1.00 0.00 C ATOM 165 CD2 LEU A 461 23.618 -7.729 -26.354 1.00 0.00 C ATOM 0 H LEU A 461 22.057 -8.619 -23.015 1.00 0.00 H new ATOM 0 HA LEU A 461 19.467 -8.586 -24.320 1.00 0.00 H new ATOM 0 HB2 LEU A 461 20.972 -8.867 -26.378 1.00 0.00 H new ATOM 0 HB3 LEU A 461 21.133 -7.386 -25.455 1.00 0.00 H new ATOM 0 HG LEU A 461 23.178 -8.411 -24.347 1.00 0.00 H new ATOM 0 HD11 LEU A 461 24.407 -10.202 -25.527 1.00 0.00 H new ATOM 0 HD12 LEU A 461 22.875 -10.764 -24.816 1.00 0.00 H new ATOM 0 HD13 LEU A 461 22.988 -10.468 -26.567 1.00 0.00 H new ATOM 0 HD21 LEU A 461 24.693 -7.896 -26.287 1.00 0.00 H new ATOM 0 HD22 LEU A 461 23.281 -7.936 -27.370 1.00 0.00 H new ATOM 0 HD23 LEU A 461 23.396 -6.692 -26.102 1.00 0.00 H new ATOM 177 N GLU A 462 20.898 -11.451 -23.815 1.00 0.00 N ATOM 178 CA GLU A 462 20.590 -12.898 -23.716 1.00 0.00 C ATOM 179 C GLU A 462 19.622 -13.152 -22.547 1.00 0.00 C ATOM 180 O GLU A 462 19.037 -14.241 -22.434 1.00 0.00 O ATOM 181 CB GLU A 462 21.893 -13.730 -23.528 1.00 0.00 C ATOM 182 CG GLU A 462 22.743 -13.898 -24.799 1.00 0.00 C ATOM 183 CD GLU A 462 22.009 -14.691 -25.898 1.00 0.00 C ATOM 184 OE1 GLU A 462 21.881 -15.930 -25.768 1.00 0.00 O ATOM 185 OE2 GLU A 462 21.534 -14.083 -26.881 1.00 0.00 O ATOM 0 H GLU A 462 21.742 -11.177 -23.311 1.00 0.00 H new ATOM 0 HA GLU A 462 20.116 -13.214 -24.645 1.00 0.00 H new ATOM 0 HB2 GLU A 462 22.503 -13.254 -22.761 1.00 0.00 H new ATOM 0 HB3 GLU A 462 21.625 -14.718 -23.154 1.00 0.00 H new ATOM 0 HG2 GLU A 462 23.014 -12.915 -25.184 1.00 0.00 H new ATOM 0 HG3 GLU A 462 23.672 -14.408 -24.546 1.00 0.00 H new ATOM 192 N GLY A 463 19.485 -12.133 -21.682 1.00 0.00 N ATOM 193 CA GLY A 463 18.581 -12.166 -20.549 1.00 0.00 C ATOM 194 C GLY A 463 19.128 -12.973 -19.385 1.00 0.00 C ATOM 195 O GLY A 463 18.362 -13.499 -18.590 1.00 0.00 O ATOM 0 H GLY A 463 20.009 -11.261 -21.761 1.00 0.00 H new ATOM 0 HA2 GLY A 463 18.383 -11.147 -20.218 1.00 0.00 H new ATOM 0 HA3 GLY A 463 17.627 -12.590 -20.863 1.00 0.00 H new ATOM 199 N LYS A 464 20.466 -13.031 -19.260 1.00 0.00 N ATOM 200 CA LYS A 464 21.146 -13.832 -18.222 1.00 0.00 C ATOM 201 C LYS A 464 20.996 -13.183 -16.837 1.00 0.00 C ATOM 202 O LYS A 464 21.194 -13.846 -15.811 1.00 0.00 O ATOM 203 CB LYS A 464 22.648 -14.007 -18.576 1.00 0.00 C ATOM 204 CG LYS A 464 22.917 -14.681 -19.944 1.00 0.00 C ATOM 205 CD LYS A 464 22.411 -16.148 -20.035 1.00 0.00 C ATOM 206 CE LYS A 464 23.132 -17.091 -19.054 1.00 0.00 C ATOM 207 NZ LYS A 464 22.774 -18.513 -19.276 1.00 0.00 N ATOM 0 H LYS A 464 21.106 -12.526 -19.873 1.00 0.00 H new ATOM 0 HA LYS A 464 20.674 -14.814 -18.188 1.00 0.00 H new ATOM 0 HB2 LYS A 464 23.125 -13.027 -18.569 1.00 0.00 H new ATOM 0 HB3 LYS A 464 23.125 -14.599 -17.795 1.00 0.00 H new ATOM 0 HG2 LYS A 464 22.439 -14.093 -20.728 1.00 0.00 H new ATOM 0 HG3 LYS A 464 23.989 -14.664 -20.142 1.00 0.00 H new ATOM 0 HD2 LYS A 464 21.340 -16.171 -19.833 1.00 0.00 H new ATOM 0 HD3 LYS A 464 22.551 -16.513 -21.052 1.00 0.00 H new ATOM 0 HE2 LYS A 464 24.210 -16.969 -19.161 1.00 0.00 H new ATOM 0 HE3 LYS A 464 22.880 -16.810 -18.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 23.435 -19.123 -18.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 21.805 -18.684 -18.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 22.830 -18.731 -20.291 1.00 0.00 H new ATOM 221 N PHE A 465 20.647 -11.881 -16.824 1.00 0.00 N ATOM 222 CA PHE A 465 20.432 -11.127 -15.589 1.00 0.00 C ATOM 223 C PHE A 465 19.551 -9.887 -15.835 1.00 0.00 C ATOM 224 O PHE A 465 19.458 -9.384 -16.967 1.00 0.00 O ATOM 225 CB PHE A 465 21.795 -10.746 -14.939 1.00 0.00 C ATOM 226 CG PHE A 465 22.598 -9.625 -15.602 1.00 0.00 C ATOM 227 CD1 PHE A 465 23.479 -9.891 -16.653 1.00 0.00 C ATOM 228 CD2 PHE A 465 22.476 -8.302 -15.169 1.00 0.00 C ATOM 229 CE1 PHE A 465 24.215 -8.873 -17.240 1.00 0.00 C ATOM 230 CE2 PHE A 465 23.212 -7.286 -15.756 1.00 0.00 C ATOM 231 CZ PHE A 465 24.075 -7.570 -16.795 1.00 0.00 C ATOM 0 H PHE A 465 20.508 -11.330 -17.671 1.00 0.00 H new ATOM 0 HA PHE A 465 19.894 -11.765 -14.888 1.00 0.00 H new ATOM 0 HB2 PHE A 465 21.607 -10.460 -13.904 1.00 0.00 H new ATOM 0 HB3 PHE A 465 22.419 -11.639 -14.915 1.00 0.00 H new ATOM 0 HD1 PHE A 465 23.588 -10.903 -17.013 1.00 0.00 H new ATOM 0 HD2 PHE A 465 21.796 -8.068 -14.363 1.00 0.00 H new ATOM 0 HE1 PHE A 465 24.898 -9.097 -18.046 1.00 0.00 H new ATOM 0 HE2 PHE A 465 23.111 -6.271 -15.401 1.00 0.00 H new ATOM 0 HZ PHE A 465 24.640 -6.776 -17.260 1.00 0.00 H new ATOM 241 N VAL A 466 18.886 -9.429 -14.756 1.00 0.00 N ATOM 242 CA VAL A 466 18.154 -8.151 -14.705 1.00 0.00 C ATOM 243 C VAL A 466 18.706 -7.339 -13.520 1.00 0.00 C ATOM 244 O VAL A 466 18.542 -7.732 -12.355 1.00 0.00 O ATOM 245 CB VAL A 466 16.590 -8.341 -14.547 1.00 0.00 C ATOM 246 CG1 VAL A 466 15.851 -6.970 -14.488 1.00 0.00 C ATOM 247 CG2 VAL A 466 16.012 -9.233 -15.674 1.00 0.00 C ATOM 0 H VAL A 466 18.843 -9.948 -13.879 1.00 0.00 H new ATOM 0 HA VAL A 466 18.304 -7.631 -15.651 1.00 0.00 H new ATOM 0 HB VAL A 466 16.421 -8.850 -13.598 1.00 0.00 H new ATOM 0 HG11 VAL A 466 14.780 -7.139 -14.379 1.00 0.00 H new ATOM 0 HG12 VAL A 466 16.216 -6.396 -13.636 1.00 0.00 H new ATOM 0 HG13 VAL A 466 16.040 -6.415 -15.407 1.00 0.00 H new ATOM 0 HG21 VAL A 466 14.936 -9.343 -15.535 1.00 0.00 H new ATOM 0 HG22 VAL A 466 16.208 -8.770 -16.641 1.00 0.00 H new ATOM 0 HG23 VAL A 466 16.484 -10.215 -15.639 1.00 0.00 H new ATOM 257 N GLN A 467 19.399 -6.241 -13.833 1.00 0.00 N ATOM 258 CA GLN A 467 19.947 -5.315 -12.835 1.00 0.00 C ATOM 259 C GLN A 467 18.903 -4.246 -12.472 1.00 0.00 C ATOM 260 O GLN A 467 18.321 -3.604 -13.350 1.00 0.00 O ATOM 261 CB GLN A 467 21.264 -4.687 -13.371 1.00 0.00 C ATOM 262 CG GLN A 467 21.901 -3.605 -12.468 1.00 0.00 C ATOM 263 CD GLN A 467 23.409 -3.466 -12.664 1.00 0.00 C ATOM 264 OE1 GLN A 467 24.200 -4.162 -12.025 1.00 0.00 O ATOM 265 NE2 GLN A 467 23.814 -2.576 -13.541 1.00 0.00 N ATOM 0 H GLN A 467 19.598 -5.966 -14.795 1.00 0.00 H new ATOM 0 HA GLN A 467 20.185 -5.858 -11.920 1.00 0.00 H new ATOM 0 HB2 GLN A 467 21.992 -5.485 -13.521 1.00 0.00 H new ATOM 0 HB3 GLN A 467 21.065 -4.248 -14.349 1.00 0.00 H new ATOM 0 HG2 GLN A 467 21.425 -2.646 -12.671 1.00 0.00 H new ATOM 0 HG3 GLN A 467 21.698 -3.847 -11.425 1.00 0.00 H new ATOM 0 HE21 GLN A 467 23.131 -2.017 -14.053 1.00 0.00 H new ATOM 0 HE22 GLN A 467 24.811 -2.444 -13.711 1.00 0.00 H new ATOM 274 N LEU A 468 18.665 -4.083 -11.168 1.00 0.00 N ATOM 275 CA LEU A 468 17.731 -3.090 -10.609 1.00 0.00 C ATOM 276 C LEU A 468 18.513 -2.045 -9.802 1.00 0.00 C ATOM 277 O LEU A 468 19.661 -2.284 -9.415 1.00 0.00 O ATOM 278 CB LEU A 468 16.687 -3.771 -9.683 1.00 0.00 C ATOM 279 CG LEU A 468 15.836 -4.920 -10.296 1.00 0.00 C ATOM 280 CD1 LEU A 468 14.832 -5.459 -9.261 1.00 0.00 C ATOM 281 CD2 LEU A 468 15.129 -4.478 -11.594 1.00 0.00 C ATOM 0 H LEU A 468 19.124 -4.647 -10.453 1.00 0.00 H new ATOM 0 HA LEU A 468 17.207 -2.610 -11.435 1.00 0.00 H new ATOM 0 HB2 LEU A 468 17.213 -4.167 -8.814 1.00 0.00 H new ATOM 0 HB3 LEU A 468 16.005 -3.002 -9.320 1.00 0.00 H new ATOM 0 HG LEU A 468 16.513 -5.731 -10.566 1.00 0.00 H new ATOM 0 HD11 LEU A 468 14.245 -6.262 -9.707 1.00 0.00 H new ATOM 0 HD12 LEU A 468 15.372 -5.842 -8.395 1.00 0.00 H new ATOM 0 HD13 LEU A 468 14.167 -4.655 -8.947 1.00 0.00 H new ATOM 0 HD21 LEU A 468 14.545 -5.308 -11.991 1.00 0.00 H new ATOM 0 HD22 LEU A 468 14.467 -3.639 -11.380 1.00 0.00 H new ATOM 0 HD23 LEU A 468 15.874 -4.174 -12.329 1.00 0.00 H new ATOM 293 N LYS A 469 17.863 -0.900 -9.542 1.00 0.00 N ATOM 294 CA LYS A 469 18.433 0.212 -8.764 1.00 0.00 C ATOM 295 C LYS A 469 17.300 0.909 -7.995 1.00 0.00 C ATOM 296 O LYS A 469 16.254 1.233 -8.567 1.00 0.00 O ATOM 297 CB LYS A 469 19.196 1.175 -9.722 1.00 0.00 C ATOM 298 CG LYS A 469 19.856 2.441 -9.097 1.00 0.00 C ATOM 299 CD LYS A 469 18.933 3.692 -9.098 1.00 0.00 C ATOM 300 CE LYS A 469 18.443 4.084 -10.510 1.00 0.00 C ATOM 301 NZ LYS A 469 19.566 4.430 -11.423 1.00 0.00 N ATOM 0 H LYS A 469 16.915 -0.718 -9.870 1.00 0.00 H new ATOM 0 HA LYS A 469 19.156 -0.148 -8.032 1.00 0.00 H new ATOM 0 HB2 LYS A 469 19.976 0.602 -10.223 1.00 0.00 H new ATOM 0 HB3 LYS A 469 18.499 1.505 -10.492 1.00 0.00 H new ATOM 0 HG2 LYS A 469 20.150 2.218 -8.071 1.00 0.00 H new ATOM 0 HG3 LYS A 469 20.768 2.673 -9.646 1.00 0.00 H new ATOM 0 HD2 LYS A 469 18.070 3.499 -8.461 1.00 0.00 H new ATOM 0 HD3 LYS A 469 19.471 4.533 -8.660 1.00 0.00 H new ATOM 0 HE2 LYS A 469 17.873 3.259 -10.936 1.00 0.00 H new ATOM 0 HE3 LYS A 469 17.765 4.934 -10.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 469 19.185 4.751 -12.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 469 20.136 5.190 -11.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 469 20.163 3.591 -11.573 1.00 0.00 H new ATOM 315 N ASN A 470 17.547 1.136 -6.702 1.00 0.00 N ATOM 316 CA ASN A 470 16.598 1.747 -5.756 1.00 0.00 C ATOM 317 C ASN A 470 16.518 3.280 -5.961 1.00 0.00 C ATOM 318 O ASN A 470 17.544 3.956 -5.946 1.00 0.00 O ATOM 319 CB ASN A 470 17.062 1.428 -4.304 1.00 0.00 C ATOM 320 CG ASN A 470 16.149 2.012 -3.226 1.00 0.00 C ATOM 321 OD1 ASN A 470 16.266 3.182 -2.880 1.00 0.00 O ATOM 322 ND2 ASN A 470 15.262 1.202 -2.663 1.00 0.00 N ATOM 0 H ASN A 470 18.438 0.894 -6.268 1.00 0.00 H new ATOM 0 HA ASN A 470 15.605 1.334 -5.932 1.00 0.00 H new ATOM 0 HB2 ASN A 470 17.113 0.347 -4.178 1.00 0.00 H new ATOM 0 HB3 ASN A 470 18.071 1.814 -4.161 1.00 0.00 H new ATOM 0 HD21 ASN A 470 14.654 1.548 -1.921 1.00 0.00 H new ATOM 0 HD22 ASN A 470 15.188 0.233 -2.972 1.00 0.00 H new ATOM 329 N ASN A 471 15.286 3.813 -6.136 1.00 0.00 N ATOM 330 CA ASN A 471 15.011 5.278 -6.185 1.00 0.00 C ATOM 331 C ASN A 471 14.209 5.739 -4.942 1.00 0.00 C ATOM 332 O ASN A 471 13.702 6.871 -4.901 1.00 0.00 O ATOM 333 CB ASN A 471 14.232 5.648 -7.484 1.00 0.00 C ATOM 334 CG ASN A 471 15.047 5.500 -8.770 1.00 0.00 C ATOM 335 OD1 ASN A 471 16.268 5.664 -8.770 1.00 0.00 O ATOM 336 ND2 ASN A 471 14.371 5.221 -9.878 1.00 0.00 N ATOM 0 H ASN A 471 14.449 3.241 -6.248 1.00 0.00 H new ATOM 0 HA ASN A 471 15.971 5.794 -6.187 1.00 0.00 H new ATOM 0 HB2 ASN A 471 13.346 5.017 -7.555 1.00 0.00 H new ATOM 0 HB3 ASN A 471 13.884 6.678 -7.404 1.00 0.00 H new ATOM 0 HD21 ASN A 471 14.863 5.136 -10.768 1.00 0.00 H new ATOM 0 HD22 ASN A 471 13.360 5.092 -9.840 1.00 0.00 H new ATOM 343 N SER A 472 14.111 4.859 -3.928 1.00 0.00 N ATOM 344 CA SER A 472 13.374 5.126 -2.674 1.00 0.00 C ATOM 345 C SER A 472 14.218 6.007 -1.735 1.00 0.00 C ATOM 346 O SER A 472 15.443 5.904 -1.733 1.00 0.00 O ATOM 347 CB SER A 472 13.042 3.791 -1.971 1.00 0.00 C ATOM 348 OG SER A 472 12.218 3.982 -0.841 1.00 0.00 O ATOM 0 H SER A 472 14.543 3.936 -3.954 1.00 0.00 H new ATOM 0 HA SER A 472 12.450 5.651 -2.915 1.00 0.00 H new ATOM 0 HB2 SER A 472 12.544 3.124 -2.675 1.00 0.00 H new ATOM 0 HB3 SER A 472 13.967 3.301 -1.667 1.00 0.00 H new ATOM 0 HG SER A 472 12.686 3.670 -0.038 1.00 0.00 H new ATOM 354 N ASP A 473 13.545 6.854 -0.930 1.00 0.00 N ATOM 355 CA ASP A 473 14.207 7.731 0.070 1.00 0.00 C ATOM 356 C ASP A 473 14.373 7.002 1.419 1.00 0.00 C ATOM 357 O ASP A 473 15.039 7.508 2.331 1.00 0.00 O ATOM 358 CB ASP A 473 13.398 9.043 0.269 1.00 0.00 C ATOM 359 CG ASP A 473 13.235 9.848 -1.034 1.00 0.00 C ATOM 360 OD1 ASP A 473 14.224 10.454 -1.495 1.00 0.00 O ATOM 361 OD2 ASP A 473 12.129 9.856 -1.616 1.00 0.00 O ATOM 0 H ASP A 473 12.530 6.953 -0.951 1.00 0.00 H new ATOM 0 HA ASP A 473 15.197 7.983 -0.310 1.00 0.00 H new ATOM 0 HB2 ASP A 473 12.412 8.800 0.666 1.00 0.00 H new ATOM 0 HB3 ASP A 473 13.898 9.663 1.013 1.00 0.00 H new ATOM 366 N LYS A 474 13.769 5.804 1.524 1.00 0.00 N ATOM 367 CA LYS A 474 13.804 4.965 2.740 1.00 0.00 C ATOM 368 C LYS A 474 14.079 3.503 2.346 1.00 0.00 C ATOM 369 O LYS A 474 14.098 3.176 1.149 1.00 0.00 O ATOM 370 CB LYS A 474 12.471 5.084 3.554 1.00 0.00 C ATOM 371 CG LYS A 474 11.193 4.483 2.907 1.00 0.00 C ATOM 372 CD LYS A 474 10.716 5.245 1.650 1.00 0.00 C ATOM 373 CE LYS A 474 9.459 4.630 1.006 1.00 0.00 C ATOM 374 NZ LYS A 474 8.245 4.825 1.846 1.00 0.00 N ATOM 0 H LYS A 474 13.237 5.386 0.761 1.00 0.00 H new ATOM 0 HA LYS A 474 14.608 5.319 3.386 1.00 0.00 H new ATOM 0 HB2 LYS A 474 12.620 4.602 4.520 1.00 0.00 H new ATOM 0 HB3 LYS A 474 12.287 6.140 3.750 1.00 0.00 H new ATOM 0 HG2 LYS A 474 11.386 3.444 2.640 1.00 0.00 H new ATOM 0 HG3 LYS A 474 10.391 4.479 3.645 1.00 0.00 H new ATOM 0 HD2 LYS A 474 10.509 6.281 1.918 1.00 0.00 H new ATOM 0 HD3 LYS A 474 11.521 5.261 0.916 1.00 0.00 H new ATOM 0 HE2 LYS A 474 9.297 5.080 0.026 1.00 0.00 H new ATOM 0 HE3 LYS A 474 9.620 3.564 0.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 7.424 4.396 1.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 8.387 4.374 2.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 8.075 5.842 1.979 1.00 0.00 H new ATOM 388 N ASP A 475 14.296 2.630 3.348 1.00 0.00 N ATOM 389 CA ASP A 475 14.492 1.184 3.115 1.00 0.00 C ATOM 390 C ASP A 475 13.192 0.572 2.563 1.00 0.00 C ATOM 391 O ASP A 475 12.093 0.994 2.938 1.00 0.00 O ATOM 392 CB ASP A 475 14.960 0.467 4.421 1.00 0.00 C ATOM 393 CG ASP A 475 13.906 0.450 5.543 1.00 0.00 C ATOM 394 OD1 ASP A 475 13.677 1.503 6.182 1.00 0.00 O ATOM 395 OD2 ASP A 475 13.309 -0.615 5.803 1.00 0.00 O ATOM 0 H ASP A 475 14.340 2.901 4.330 1.00 0.00 H new ATOM 0 HA ASP A 475 15.280 1.042 2.376 1.00 0.00 H new ATOM 0 HB2 ASP A 475 15.235 -0.560 4.180 1.00 0.00 H new ATOM 0 HB3 ASP A 475 15.860 0.959 4.790 1.00 0.00 H new ATOM 400 N GLN A 476 13.328 -0.389 1.646 1.00 0.00 N ATOM 401 CA GLN A 476 12.199 -0.991 0.933 1.00 0.00 C ATOM 402 C GLN A 476 12.208 -2.517 1.114 1.00 0.00 C ATOM 403 O GLN A 476 13.125 -3.199 0.639 1.00 0.00 O ATOM 404 CB GLN A 476 12.248 -0.615 -0.580 1.00 0.00 C ATOM 405 CG GLN A 476 11.055 -1.160 -1.394 1.00 0.00 C ATOM 406 CD GLN A 476 9.690 -0.664 -0.901 1.00 0.00 C ATOM 407 OE1 GLN A 476 9.549 0.482 -0.466 1.00 0.00 O ATOM 408 NE2 GLN A 476 8.700 -1.549 -0.899 1.00 0.00 N ATOM 0 H GLN A 476 14.233 -0.774 1.375 1.00 0.00 H new ATOM 0 HA GLN A 476 11.272 -0.600 1.352 1.00 0.00 H new ATOM 0 HB2 GLN A 476 12.275 0.471 -0.675 1.00 0.00 H new ATOM 0 HB3 GLN A 476 13.174 -0.996 -1.010 1.00 0.00 H new ATOM 0 HG2 GLN A 476 11.179 -0.874 -2.438 1.00 0.00 H new ATOM 0 HG3 GLN A 476 11.070 -2.249 -1.358 1.00 0.00 H new ATOM 0 HE21 GLN A 476 8.854 -2.488 -1.267 1.00 0.00 H new ATOM 0 HE22 GLN A 476 7.785 -1.290 -0.529 1.00 0.00 H new ATOM 417 N SER A 477 11.191 -3.033 1.812 1.00 0.00 N ATOM 418 CA SER A 477 10.997 -4.472 2.011 1.00 0.00 C ATOM 419 C SER A 477 10.566 -5.149 0.698 1.00 0.00 C ATOM 420 O SER A 477 9.540 -4.793 0.098 1.00 0.00 O ATOM 421 CB SER A 477 9.962 -4.707 3.132 1.00 0.00 C ATOM 422 OG SER A 477 8.749 -4.011 2.885 1.00 0.00 O ATOM 0 H SER A 477 10.475 -2.459 2.258 1.00 0.00 H new ATOM 0 HA SER A 477 11.942 -4.922 2.315 1.00 0.00 H new ATOM 0 HB2 SER A 477 9.757 -5.774 3.220 1.00 0.00 H new ATOM 0 HB3 SER A 477 10.379 -4.383 4.085 1.00 0.00 H new ATOM 0 HG SER A 477 8.613 -3.923 1.918 1.00 0.00 H new ATOM 428 N LEU A 478 11.394 -6.095 0.237 1.00 0.00 N ATOM 429 CA LEU A 478 11.129 -6.914 -0.959 1.00 0.00 C ATOM 430 C LEU A 478 10.599 -8.299 -0.527 1.00 0.00 C ATOM 431 O LEU A 478 10.695 -8.681 0.646 1.00 0.00 O ATOM 432 CB LEU A 478 12.420 -7.021 -1.845 1.00 0.00 C ATOM 433 CG LEU A 478 12.534 -6.014 -3.049 1.00 0.00 C ATOM 434 CD1 LEU A 478 12.307 -4.555 -2.613 1.00 0.00 C ATOM 435 CD2 LEU A 478 13.881 -6.171 -3.793 1.00 0.00 C ATOM 0 H LEU A 478 12.281 -6.318 0.689 1.00 0.00 H new ATOM 0 HA LEU A 478 10.363 -6.439 -1.571 1.00 0.00 H new ATOM 0 HB2 LEU A 478 13.288 -6.881 -1.201 1.00 0.00 H new ATOM 0 HB3 LEU A 478 12.478 -8.035 -2.242 1.00 0.00 H new ATOM 0 HG LEU A 478 11.735 -6.267 -3.746 1.00 0.00 H new ATOM 0 HD11 LEU A 478 12.396 -3.899 -3.479 1.00 0.00 H new ATOM 0 HD12 LEU A 478 11.311 -4.455 -2.182 1.00 0.00 H new ATOM 0 HD13 LEU A 478 13.054 -4.277 -1.869 1.00 0.00 H new ATOM 0 HD21 LEU A 478 13.926 -5.460 -4.618 1.00 0.00 H new ATOM 0 HD22 LEU A 478 14.702 -5.978 -3.103 1.00 0.00 H new ATOM 0 HD23 LEU A 478 13.965 -7.185 -4.183 1.00 0.00 H new ATOM 447 N GLY A 479 10.030 -9.031 -1.490 1.00 0.00 N ATOM 448 CA GLY A 479 9.391 -10.325 -1.236 1.00 0.00 C ATOM 449 C GLY A 479 8.183 -10.494 -2.123 1.00 0.00 C ATOM 450 O GLY A 479 8.093 -11.424 -2.926 1.00 0.00 O ATOM 0 H GLY A 479 10.000 -8.742 -2.468 1.00 0.00 H new ATOM 0 HA2 GLY A 479 10.101 -11.131 -1.419 1.00 0.00 H new ATOM 0 HA3 GLY A 479 9.095 -10.393 -0.189 1.00 0.00 H new ATOM 454 N ASN A 480 7.261 -9.544 -1.980 1.00 0.00 N ATOM 455 CA ASN A 480 6.055 -9.433 -2.818 1.00 0.00 C ATOM 456 C ASN A 480 6.377 -8.744 -4.165 1.00 0.00 C ATOM 457 O ASN A 480 5.559 -8.762 -5.092 1.00 0.00 O ATOM 458 CB ASN A 480 4.964 -8.655 -2.048 1.00 0.00 C ATOM 459 CG ASN A 480 4.280 -9.416 -0.903 1.00 0.00 C ATOM 460 OD1 ASN A 480 4.963 -10.362 -0.279 1.00 0.00 O flip ATOM 461 ND2 ASN A 480 3.124 -9.141 -0.579 1.00 0.00 N flip ATOM 0 H ASN A 480 7.326 -8.815 -1.269 1.00 0.00 H new ATOM 0 HA ASN A 480 5.687 -10.434 -3.043 1.00 0.00 H new ATOM 0 HB2 ASN A 480 5.411 -7.748 -1.640 1.00 0.00 H new ATOM 0 HB3 ASN A 480 4.199 -8.341 -2.758 1.00 0.00 H new ATOM 0 HD21 ASN A 480 2.616 -8.408 -1.074 1.00 0.00 H new ATOM 0 HD22 ASN A 480 2.674 -9.646 0.184 1.00 0.00 H new ATOM 468 N TRP A 481 7.568 -8.117 -4.241 1.00 0.00 N ATOM 469 CA TRP A 481 8.083 -7.509 -5.479 1.00 0.00 C ATOM 470 C TRP A 481 8.499 -8.620 -6.447 1.00 0.00 C ATOM 471 O TRP A 481 9.071 -9.616 -6.013 1.00 0.00 O ATOM 472 CB TRP A 481 9.277 -6.578 -5.164 1.00 0.00 C ATOM 473 CG TRP A 481 8.892 -5.305 -4.442 1.00 0.00 C ATOM 474 CD1 TRP A 481 8.316 -5.183 -3.203 1.00 0.00 C ATOM 475 CD2 TRP A 481 9.047 -3.971 -4.940 1.00 0.00 C ATOM 476 NE1 TRP A 481 8.131 -3.861 -2.904 1.00 0.00 N ATOM 477 CE2 TRP A 481 8.564 -3.098 -3.956 1.00 0.00 C ATOM 478 CE3 TRP A 481 9.560 -3.435 -6.126 1.00 0.00 C ATOM 479 CZ2 TRP A 481 8.575 -1.718 -4.118 1.00 0.00 C ATOM 480 CZ3 TRP A 481 9.556 -2.066 -6.290 1.00 0.00 C ATOM 481 CH2 TRP A 481 9.072 -1.219 -5.288 1.00 0.00 C ATOM 0 H TRP A 481 8.198 -8.019 -3.445 1.00 0.00 H new ATOM 0 HA TRP A 481 7.303 -6.906 -5.943 1.00 0.00 H new ATOM 0 HB2 TRP A 481 9.999 -7.124 -4.557 1.00 0.00 H new ATOM 0 HB3 TRP A 481 9.777 -6.317 -6.097 1.00 0.00 H new ATOM 0 HD1 TRP A 481 8.048 -6.008 -2.559 1.00 0.00 H new ATOM 0 HE1 TRP A 481 7.734 -3.501 -2.036 1.00 0.00 H new ATOM 0 HE3 TRP A 481 9.951 -4.081 -6.898 1.00 0.00 H new ATOM 0 HZ2 TRP A 481 8.203 -1.062 -3.345 1.00 0.00 H new ATOM 0 HZ3 TRP A 481 9.933 -1.640 -7.208 1.00 0.00 H new ATOM 0 HH2 TRP A 481 9.092 -0.150 -5.442 1.00 0.00 H new ATOM 492 N ARG A 482 8.212 -8.438 -7.744 1.00 0.00 N ATOM 493 CA ARG A 482 8.376 -9.493 -8.759 1.00 0.00 C ATOM 494 C ARG A 482 8.785 -8.907 -10.122 1.00 0.00 C ATOM 495 O ARG A 482 8.231 -7.896 -10.570 1.00 0.00 O ATOM 496 CB ARG A 482 7.063 -10.327 -8.870 1.00 0.00 C ATOM 497 CG ARG A 482 5.769 -9.490 -8.993 1.00 0.00 C ATOM 498 CD ARG A 482 4.499 -10.357 -8.914 1.00 0.00 C ATOM 499 NE ARG A 482 3.258 -9.563 -8.848 1.00 0.00 N ATOM 500 CZ ARG A 482 2.651 -9.163 -7.715 1.00 0.00 C ATOM 501 NH1 ARG A 482 3.200 -9.371 -6.526 1.00 0.00 N ATOM 502 NH2 ARG A 482 1.481 -8.565 -7.785 1.00 0.00 N ATOM 0 H ARG A 482 7.860 -7.558 -8.120 1.00 0.00 H new ATOM 0 HA ARG A 482 9.184 -10.154 -8.444 1.00 0.00 H new ATOM 0 HB2 ARG A 482 7.138 -10.982 -9.738 1.00 0.00 H new ATOM 0 HB3 ARG A 482 6.982 -10.968 -7.992 1.00 0.00 H new ATOM 0 HG2 ARG A 482 5.746 -8.743 -8.199 1.00 0.00 H new ATOM 0 HG3 ARG A 482 5.778 -8.949 -9.939 1.00 0.00 H new ATOM 0 HD2 ARG A 482 4.458 -11.011 -9.785 1.00 0.00 H new ATOM 0 HD3 ARG A 482 4.559 -10.999 -8.035 1.00 0.00 H new ATOM 0 HE ARG A 482 2.825 -9.295 -9.732 1.00 0.00 H new ATOM 0 HH11 ARG A 482 4.101 -9.843 -6.456 1.00 0.00 H new ATOM 0 HH12 ARG A 482 2.721 -9.059 -5.681 1.00 0.00 H new ATOM 0 HH21 ARG A 482 1.042 -8.408 -8.692 1.00 0.00 H new ATOM 0 HH22 ARG A 482 1.013 -8.258 -6.932 1.00 0.00 H new ATOM 516 N ILE A 483 9.765 -9.562 -10.765 1.00 0.00 N ATOM 517 CA ILE A 483 10.271 -9.183 -12.088 1.00 0.00 C ATOM 518 C ILE A 483 9.634 -10.098 -13.154 1.00 0.00 C ATOM 519 O ILE A 483 9.970 -11.286 -13.246 1.00 0.00 O ATOM 520 CB ILE A 483 11.835 -9.303 -12.157 1.00 0.00 C ATOM 521 CG1 ILE A 483 12.513 -8.535 -10.983 1.00 0.00 C ATOM 522 CG2 ILE A 483 12.362 -8.799 -13.517 1.00 0.00 C ATOM 523 CD1 ILE A 483 14.028 -8.634 -10.957 1.00 0.00 C ATOM 0 H ILE A 483 10.232 -10.380 -10.373 1.00 0.00 H new ATOM 0 HA ILE A 483 10.004 -8.143 -12.275 1.00 0.00 H new ATOM 0 HB ILE A 483 12.093 -10.357 -12.058 1.00 0.00 H new ATOM 0 HG12 ILE A 483 12.231 -7.484 -11.043 1.00 0.00 H new ATOM 0 HG13 ILE A 483 12.120 -8.917 -10.041 1.00 0.00 H new ATOM 0 HG21 ILE A 483 13.448 -8.891 -13.543 1.00 0.00 H new ATOM 0 HG22 ILE A 483 11.928 -9.396 -14.319 1.00 0.00 H new ATOM 0 HG23 ILE A 483 12.083 -7.754 -13.651 1.00 0.00 H new ATOM 0 HD11 ILE A 483 14.415 -8.071 -10.108 1.00 0.00 H new ATOM 0 HD12 ILE A 483 14.323 -9.679 -10.864 1.00 0.00 H new ATOM 0 HD13 ILE A 483 14.435 -8.223 -11.881 1.00 0.00 H new ATOM 535 N LYS A 484 8.690 -9.535 -13.911 1.00 0.00 N ATOM 536 CA LYS A 484 7.978 -10.217 -14.998 1.00 0.00 C ATOM 537 C LYS A 484 8.688 -9.972 -16.342 1.00 0.00 C ATOM 538 O LYS A 484 8.550 -8.892 -16.919 1.00 0.00 O ATOM 539 CB LYS A 484 6.520 -9.677 -15.081 1.00 0.00 C ATOM 540 CG LYS A 484 5.688 -9.844 -13.793 1.00 0.00 C ATOM 541 CD LYS A 484 4.335 -9.103 -13.876 1.00 0.00 C ATOM 542 CE LYS A 484 3.433 -9.360 -12.656 1.00 0.00 C ATOM 543 NZ LYS A 484 2.949 -10.762 -12.609 1.00 0.00 N ATOM 0 H LYS A 484 8.391 -8.568 -13.783 1.00 0.00 H new ATOM 0 HA LYS A 484 7.967 -11.288 -14.793 1.00 0.00 H new ATOM 0 HB2 LYS A 484 6.555 -8.618 -15.338 1.00 0.00 H new ATOM 0 HB3 LYS A 484 6.006 -10.186 -15.896 1.00 0.00 H new ATOM 0 HG2 LYS A 484 5.510 -10.904 -13.612 1.00 0.00 H new ATOM 0 HG3 LYS A 484 6.256 -9.466 -12.943 1.00 0.00 H new ATOM 0 HD2 LYS A 484 4.518 -8.032 -13.966 1.00 0.00 H new ATOM 0 HD3 LYS A 484 3.811 -9.414 -14.780 1.00 0.00 H new ATOM 0 HE2 LYS A 484 3.985 -9.136 -11.743 1.00 0.00 H new ATOM 0 HE3 LYS A 484 2.580 -8.683 -12.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 2.253 -10.863 -11.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 2.503 -11.006 -13.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 3.751 -11.401 -12.435 1.00 0.00 H new ATOM 557 N ARG A 485 9.455 -10.957 -16.843 1.00 0.00 N ATOM 558 CA ARG A 485 10.082 -10.840 -18.172 1.00 0.00 C ATOM 559 C ARG A 485 9.085 -11.343 -19.223 1.00 0.00 C ATOM 560 O ARG A 485 8.946 -12.555 -19.425 1.00 0.00 O ATOM 561 CB ARG A 485 11.429 -11.608 -18.286 1.00 0.00 C ATOM 562 CG ARG A 485 12.172 -11.341 -19.627 1.00 0.00 C ATOM 563 CD ARG A 485 13.342 -12.300 -19.893 1.00 0.00 C ATOM 564 NE ARG A 485 14.381 -12.250 -18.855 1.00 0.00 N ATOM 565 CZ ARG A 485 15.455 -11.448 -18.857 1.00 0.00 C ATOM 566 NH1 ARG A 485 15.628 -10.538 -19.808 1.00 0.00 N ATOM 567 NH2 ARG A 485 16.370 -11.584 -17.912 1.00 0.00 N ATOM 0 H ARG A 485 9.654 -11.831 -16.356 1.00 0.00 H new ATOM 0 HA ARG A 485 10.325 -9.791 -18.338 1.00 0.00 H new ATOM 0 HB2 ARG A 485 12.075 -11.322 -17.456 1.00 0.00 H new ATOM 0 HB3 ARG A 485 11.240 -12.677 -18.189 1.00 0.00 H new ATOM 0 HG2 ARG A 485 11.459 -11.418 -20.448 1.00 0.00 H new ATOM 0 HG3 ARG A 485 12.547 -10.318 -19.625 1.00 0.00 H new ATOM 0 HD2 ARG A 485 12.959 -13.318 -19.966 1.00 0.00 H new ATOM 0 HD3 ARG A 485 13.789 -12.058 -20.857 1.00 0.00 H new ATOM 0 HE ARG A 485 14.275 -12.882 -18.062 1.00 0.00 H new ATOM 0 HH11 ARG A 485 14.938 -10.441 -20.553 1.00 0.00 H new ATOM 0 HH12 ARG A 485 16.451 -9.936 -19.794 1.00 0.00 H new ATOM 0 HH21 ARG A 485 16.255 -12.295 -17.190 1.00 0.00 H new ATOM 0 HH22 ARG A 485 17.191 -10.978 -17.906 1.00 0.00 H new ATOM 581 N GLN A 486 8.347 -10.405 -19.836 1.00 0.00 N ATOM 582 CA GLN A 486 7.375 -10.719 -20.890 1.00 0.00 C ATOM 583 C GLN A 486 8.117 -10.724 -22.240 1.00 0.00 C ATOM 584 O GLN A 486 8.391 -9.667 -22.804 1.00 0.00 O ATOM 585 CB GLN A 486 6.213 -9.671 -20.859 1.00 0.00 C ATOM 586 CG GLN A 486 4.905 -10.040 -21.616 1.00 0.00 C ATOM 587 CD GLN A 486 5.024 -10.107 -23.142 1.00 0.00 C ATOM 588 OE1 GLN A 486 4.865 -9.103 -23.831 1.00 0.00 O ATOM 589 NE2 GLN A 486 5.294 -11.285 -23.678 1.00 0.00 N ATOM 0 H GLN A 486 8.408 -9.411 -19.615 1.00 0.00 H new ATOM 0 HA GLN A 486 6.927 -11.701 -20.736 1.00 0.00 H new ATOM 0 HB2 GLN A 486 5.958 -9.480 -19.817 1.00 0.00 H new ATOM 0 HB3 GLN A 486 6.590 -8.735 -21.272 1.00 0.00 H new ATOM 0 HG2 GLN A 486 4.556 -11.007 -21.253 1.00 0.00 H new ATOM 0 HG3 GLN A 486 4.139 -9.308 -21.360 1.00 0.00 H new ATOM 0 HE21 GLN A 486 5.421 -12.101 -23.079 1.00 0.00 H new ATOM 0 HE22 GLN A 486 5.376 -11.378 -24.690 1.00 0.00 H new ATOM 598 N VAL A 487 8.439 -11.923 -22.736 1.00 0.00 N ATOM 599 CA VAL A 487 9.064 -12.115 -24.051 1.00 0.00 C ATOM 600 C VAL A 487 7.967 -12.371 -25.092 1.00 0.00 C ATOM 601 O VAL A 487 7.199 -13.328 -24.949 1.00 0.00 O ATOM 602 CB VAL A 487 10.087 -13.313 -24.066 1.00 0.00 C ATOM 603 CG1 VAL A 487 10.786 -13.435 -25.438 1.00 0.00 C ATOM 604 CG2 VAL A 487 11.116 -13.197 -22.908 1.00 0.00 C ATOM 0 H VAL A 487 8.272 -12.795 -22.233 1.00 0.00 H new ATOM 0 HA VAL A 487 9.623 -11.209 -24.287 1.00 0.00 H new ATOM 0 HB VAL A 487 9.522 -14.231 -23.904 1.00 0.00 H new ATOM 0 HG11 VAL A 487 11.486 -14.270 -25.417 1.00 0.00 H new ATOM 0 HG12 VAL A 487 10.039 -13.607 -26.213 1.00 0.00 H new ATOM 0 HG13 VAL A 487 11.327 -12.514 -25.654 1.00 0.00 H new ATOM 0 HG21 VAL A 487 11.806 -14.040 -22.949 1.00 0.00 H new ATOM 0 HG22 VAL A 487 11.674 -12.266 -23.009 1.00 0.00 H new ATOM 0 HG23 VAL A 487 10.591 -13.204 -21.953 1.00 0.00 H new ATOM 614 N LEU A 488 7.907 -11.520 -26.126 1.00 0.00 N ATOM 615 CA LEU A 488 6.866 -11.586 -27.179 1.00 0.00 C ATOM 616 C LEU A 488 6.881 -12.924 -27.945 1.00 0.00 C ATOM 617 O LEU A 488 5.852 -13.377 -28.446 1.00 0.00 O ATOM 618 CB LEU A 488 7.029 -10.367 -28.136 1.00 0.00 C ATOM 619 CG LEU A 488 8.411 -10.185 -28.867 1.00 0.00 C ATOM 620 CD1 LEU A 488 8.490 -10.947 -30.201 1.00 0.00 C ATOM 621 CD2 LEU A 488 8.741 -8.690 -29.081 1.00 0.00 C ATOM 0 H LEU A 488 8.577 -10.763 -26.262 1.00 0.00 H new ATOM 0 HA LEU A 488 5.888 -11.537 -26.700 1.00 0.00 H new ATOM 0 HB2 LEU A 488 6.253 -10.435 -28.899 1.00 0.00 H new ATOM 0 HB3 LEU A 488 6.833 -9.462 -27.561 1.00 0.00 H new ATOM 0 HG LEU A 488 9.160 -10.620 -28.206 1.00 0.00 H new ATOM 0 HD11 LEU A 488 9.466 -10.782 -30.657 1.00 0.00 H new ATOM 0 HD12 LEU A 488 8.349 -12.013 -30.020 1.00 0.00 H new ATOM 0 HD13 LEU A 488 7.711 -10.587 -30.872 1.00 0.00 H new ATOM 0 HD21 LEU A 488 9.702 -8.598 -29.588 1.00 0.00 H new ATOM 0 HD22 LEU A 488 7.964 -8.229 -29.690 1.00 0.00 H new ATOM 0 HD23 LEU A 488 8.791 -8.187 -28.115 1.00 0.00 H new ATOM 633 N GLU A 489 8.071 -13.540 -28.008 1.00 0.00 N ATOM 634 CA GLU A 489 8.310 -14.833 -28.681 1.00 0.00 C ATOM 635 C GLU A 489 7.550 -16.001 -28.010 1.00 0.00 C ATOM 636 O GLU A 489 7.397 -17.070 -28.615 1.00 0.00 O ATOM 637 CB GLU A 489 9.844 -15.075 -28.725 1.00 0.00 C ATOM 638 CG GLU A 489 10.608 -14.043 -29.604 1.00 0.00 C ATOM 639 CD GLU A 489 12.059 -13.800 -29.165 1.00 0.00 C ATOM 640 OE1 GLU A 489 12.943 -14.630 -29.478 1.00 0.00 O ATOM 641 OE2 GLU A 489 12.324 -12.776 -28.514 1.00 0.00 O ATOM 0 H GLU A 489 8.913 -13.149 -27.585 1.00 0.00 H new ATOM 0 HA GLU A 489 7.916 -14.791 -29.696 1.00 0.00 H new ATOM 0 HB2 GLU A 489 10.239 -15.039 -27.710 1.00 0.00 H new ATOM 0 HB3 GLU A 489 10.035 -16.078 -29.106 1.00 0.00 H new ATOM 0 HG2 GLU A 489 10.605 -14.389 -30.638 1.00 0.00 H new ATOM 0 HG3 GLU A 489 10.070 -13.095 -29.584 1.00 0.00 H new ATOM 648 N GLY A 490 7.067 -15.785 -26.774 1.00 0.00 N ATOM 649 CA GLY A 490 6.134 -16.724 -26.132 1.00 0.00 C ATOM 650 C GLY A 490 6.584 -17.226 -24.768 1.00 0.00 C ATOM 651 O GLY A 490 6.207 -18.335 -24.366 1.00 0.00 O ATOM 0 H GLY A 490 7.306 -14.974 -26.204 1.00 0.00 H new ATOM 0 HA2 GLY A 490 5.165 -16.237 -26.024 1.00 0.00 H new ATOM 0 HA3 GLY A 490 5.989 -17.580 -26.791 1.00 0.00 H new ATOM 655 N GLU A 491 7.391 -16.429 -24.043 1.00 0.00 N ATOM 656 CA GLU A 491 7.793 -16.753 -22.659 1.00 0.00 C ATOM 657 C GLU A 491 7.535 -15.554 -21.746 1.00 0.00 C ATOM 658 O GLU A 491 8.333 -14.624 -21.687 1.00 0.00 O ATOM 659 CB GLU A 491 9.290 -17.168 -22.579 1.00 0.00 C ATOM 660 CG GLU A 491 9.646 -18.471 -23.319 1.00 0.00 C ATOM 661 CD GLU A 491 11.122 -18.882 -23.163 1.00 0.00 C ATOM 662 OE1 GLU A 491 11.574 -19.092 -22.009 1.00 0.00 O ATOM 663 OE2 GLU A 491 11.829 -19.015 -24.183 1.00 0.00 O ATOM 0 H GLU A 491 7.779 -15.553 -24.393 1.00 0.00 H new ATOM 0 HA GLU A 491 7.193 -17.600 -22.327 1.00 0.00 H new ATOM 0 HB2 GLU A 491 9.898 -16.360 -22.986 1.00 0.00 H new ATOM 0 HB3 GLU A 491 9.565 -17.277 -21.530 1.00 0.00 H new ATOM 0 HG2 GLU A 491 9.012 -19.276 -22.947 1.00 0.00 H new ATOM 0 HG3 GLU A 491 9.420 -18.351 -24.379 1.00 0.00 H new ATOM 670 N GLU A 492 6.418 -15.587 -21.022 1.00 0.00 N ATOM 671 CA GLU A 492 6.089 -14.568 -20.019 1.00 0.00 C ATOM 672 C GLU A 492 6.268 -15.205 -18.630 1.00 0.00 C ATOM 673 O GLU A 492 5.427 -15.973 -18.153 1.00 0.00 O ATOM 674 CB GLU A 492 4.672 -13.926 -20.253 1.00 0.00 C ATOM 675 CG GLU A 492 3.427 -14.836 -20.108 1.00 0.00 C ATOM 676 CD GLU A 492 3.334 -15.980 -21.140 1.00 0.00 C ATOM 677 OE1 GLU A 492 2.792 -15.760 -22.237 1.00 0.00 O ATOM 678 OE2 GLU A 492 3.812 -17.099 -20.852 1.00 0.00 O ATOM 0 H GLU A 492 5.714 -16.319 -21.112 1.00 0.00 H new ATOM 0 HA GLU A 492 6.768 -13.719 -20.104 1.00 0.00 H new ATOM 0 HB2 GLU A 492 4.562 -13.096 -19.555 1.00 0.00 H new ATOM 0 HB3 GLU A 492 4.660 -13.501 -21.257 1.00 0.00 H new ATOM 0 HG2 GLU A 492 3.426 -15.268 -19.107 1.00 0.00 H new ATOM 0 HG3 GLU A 492 2.532 -14.219 -20.190 1.00 0.00 H new ATOM 685 N ILE A 493 7.448 -14.961 -18.033 1.00 0.00 N ATOM 686 CA ILE A 493 7.808 -15.498 -16.703 1.00 0.00 C ATOM 687 C ILE A 493 7.785 -14.374 -15.654 1.00 0.00 C ATOM 688 O ILE A 493 7.728 -13.191 -16.000 1.00 0.00 O ATOM 689 CB ILE A 493 9.228 -16.179 -16.705 1.00 0.00 C ATOM 690 CG1 ILE A 493 10.332 -15.152 -17.097 1.00 0.00 C ATOM 691 CG2 ILE A 493 9.260 -17.421 -17.635 1.00 0.00 C ATOM 692 CD1 ILE A 493 11.749 -15.666 -16.973 1.00 0.00 C ATOM 0 H ILE A 493 8.179 -14.388 -18.455 1.00 0.00 H new ATOM 0 HA ILE A 493 7.069 -16.259 -16.452 1.00 0.00 H new ATOM 0 HB ILE A 493 9.434 -16.526 -15.692 1.00 0.00 H new ATOM 0 HG12 ILE A 493 10.164 -14.835 -18.126 1.00 0.00 H new ATOM 0 HG13 ILE A 493 10.225 -14.267 -16.469 1.00 0.00 H new ATOM 0 HG21 ILE A 493 10.254 -17.867 -17.613 1.00 0.00 H new ATOM 0 HG22 ILE A 493 8.527 -18.151 -17.292 1.00 0.00 H new ATOM 0 HG23 ILE A 493 9.021 -17.118 -18.654 1.00 0.00 H new ATOM 0 HD11 ILE A 493 12.447 -14.882 -17.267 1.00 0.00 H new ATOM 0 HD12 ILE A 493 11.942 -15.955 -15.940 1.00 0.00 H new ATOM 0 HD13 ILE A 493 11.880 -16.531 -17.623 1.00 0.00 H new ATOM 704 N ALA A 494 7.855 -14.764 -14.375 1.00 0.00 N ATOM 705 CA ALA A 494 7.854 -13.838 -13.242 1.00 0.00 C ATOM 706 C ALA A 494 8.512 -14.504 -12.032 1.00 0.00 C ATOM 707 O ALA A 494 8.194 -15.656 -11.699 1.00 0.00 O ATOM 708 CB ALA A 494 6.421 -13.395 -12.909 1.00 0.00 C ATOM 0 H ALA A 494 7.915 -15.744 -14.098 1.00 0.00 H new ATOM 0 HA ALA A 494 8.426 -12.949 -13.508 1.00 0.00 H new ATOM 0 HB1 ALA A 494 6.440 -12.707 -12.064 1.00 0.00 H new ATOM 0 HB2 ALA A 494 5.984 -12.896 -13.774 1.00 0.00 H new ATOM 0 HB3 ALA A 494 5.821 -14.268 -12.653 1.00 0.00 H new ATOM 714 N TYR A 495 9.433 -13.778 -11.387 1.00 0.00 N ATOM 715 CA TYR A 495 10.109 -14.230 -10.164 1.00 0.00 C ATOM 716 C TYR A 495 9.937 -13.182 -9.071 1.00 0.00 C ATOM 717 O TYR A 495 10.416 -12.048 -9.214 1.00 0.00 O ATOM 718 CB TYR A 495 11.616 -14.484 -10.424 1.00 0.00 C ATOM 719 CG TYR A 495 12.410 -14.952 -9.186 1.00 0.00 C ATOM 720 CD1 TYR A 495 12.020 -16.097 -8.471 1.00 0.00 C ATOM 721 CD2 TYR A 495 13.544 -14.265 -8.738 1.00 0.00 C ATOM 722 CE1 TYR A 495 12.725 -16.523 -7.360 1.00 0.00 C ATOM 723 CE2 TYR A 495 14.251 -14.692 -7.628 1.00 0.00 C ATOM 724 CZ TYR A 495 13.843 -15.822 -6.946 1.00 0.00 C ATOM 725 OH TYR A 495 14.551 -16.248 -5.839 1.00 0.00 O ATOM 0 H TYR A 495 9.732 -12.855 -11.701 1.00 0.00 H new ATOM 0 HA TYR A 495 9.658 -15.169 -9.844 1.00 0.00 H new ATOM 0 HB2 TYR A 495 11.715 -15.235 -11.208 1.00 0.00 H new ATOM 0 HB3 TYR A 495 12.066 -13.566 -10.803 1.00 0.00 H new ATOM 0 HD1 TYR A 495 11.154 -16.655 -8.795 1.00 0.00 H new ATOM 0 HD2 TYR A 495 13.874 -13.384 -9.269 1.00 0.00 H new ATOM 0 HE1 TYR A 495 12.404 -17.400 -6.818 1.00 0.00 H new ATOM 0 HE2 TYR A 495 15.120 -14.143 -7.296 1.00 0.00 H new ATOM 0 HH TYR A 495 15.309 -15.646 -5.684 1.00 0.00 H new ATOM 735 N LYS A 496 9.242 -13.556 -7.984 1.00 0.00 N ATOM 736 CA LYS A 496 9.147 -12.712 -6.797 1.00 0.00 C ATOM 737 C LYS A 496 10.428 -12.841 -5.966 1.00 0.00 C ATOM 738 O LYS A 496 11.160 -13.831 -6.074 1.00 0.00 O ATOM 739 CB LYS A 496 7.896 -13.045 -5.933 1.00 0.00 C ATOM 740 CG LYS A 496 7.949 -14.391 -5.177 1.00 0.00 C ATOM 741 CD LYS A 496 6.795 -14.543 -4.161 1.00 0.00 C ATOM 742 CE LYS A 496 6.915 -15.829 -3.327 1.00 0.00 C ATOM 743 NZ LYS A 496 6.883 -17.051 -4.177 1.00 0.00 N ATOM 0 H LYS A 496 8.739 -14.440 -7.910 1.00 0.00 H new ATOM 0 HA LYS A 496 9.033 -11.681 -7.131 1.00 0.00 H new ATOM 0 HB2 LYS A 496 7.755 -12.245 -5.206 1.00 0.00 H new ATOM 0 HB3 LYS A 496 7.019 -13.046 -6.580 1.00 0.00 H new ATOM 0 HG2 LYS A 496 7.907 -15.210 -5.895 1.00 0.00 H new ATOM 0 HG3 LYS A 496 8.902 -14.474 -4.655 1.00 0.00 H new ATOM 0 HD2 LYS A 496 6.785 -13.680 -3.495 1.00 0.00 H new ATOM 0 HD3 LYS A 496 5.844 -14.546 -4.693 1.00 0.00 H new ATOM 0 HE2 LYS A 496 7.845 -15.807 -2.759 1.00 0.00 H new ATOM 0 HE3 LYS A 496 6.101 -15.869 -2.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 6.881 -17.896 -3.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 6.024 -17.044 -4.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 7.722 -17.068 -4.792 1.00 0.00 H new ATOM 757 N PHE A 497 10.681 -11.831 -5.143 1.00 0.00 N ATOM 758 CA PHE A 497 11.840 -11.783 -4.249 1.00 0.00 C ATOM 759 C PHE A 497 11.580 -12.594 -2.973 1.00 0.00 C ATOM 760 O PHE A 497 10.471 -13.093 -2.741 1.00 0.00 O ATOM 761 CB PHE A 497 12.180 -10.300 -3.930 1.00 0.00 C ATOM 762 CG PHE A 497 12.889 -9.580 -5.075 1.00 0.00 C ATOM 763 CD1 PHE A 497 14.269 -9.693 -5.231 1.00 0.00 C ATOM 764 CD2 PHE A 497 12.186 -8.814 -6.010 1.00 0.00 C ATOM 765 CE1 PHE A 497 14.925 -9.054 -6.267 1.00 0.00 C ATOM 766 CE2 PHE A 497 12.843 -8.177 -7.049 1.00 0.00 C ATOM 767 CZ PHE A 497 14.212 -8.305 -7.179 1.00 0.00 C ATOM 0 H PHE A 497 10.081 -11.009 -5.074 1.00 0.00 H new ATOM 0 HA PHE A 497 12.699 -12.237 -4.743 1.00 0.00 H new ATOM 0 HB2 PHE A 497 11.260 -9.767 -3.690 1.00 0.00 H new ATOM 0 HB3 PHE A 497 12.810 -10.263 -3.042 1.00 0.00 H new ATOM 0 HD1 PHE A 497 14.836 -10.289 -4.531 1.00 0.00 H new ATOM 0 HD2 PHE A 497 11.114 -8.718 -5.920 1.00 0.00 H new ATOM 0 HE1 PHE A 497 15.997 -9.142 -6.362 1.00 0.00 H new ATOM 0 HE2 PHE A 497 12.286 -7.581 -7.757 1.00 0.00 H new ATOM 0 HZ PHE A 497 14.724 -7.818 -7.996 1.00 0.00 H new ATOM 777 N THR A 498 12.630 -12.764 -2.173 1.00 0.00 N ATOM 778 CA THR A 498 12.540 -13.428 -0.875 1.00 0.00 C ATOM 779 C THR A 498 12.032 -12.414 0.178 1.00 0.00 C ATOM 780 O THR A 498 12.553 -11.299 0.228 1.00 0.00 O ATOM 781 CB THR A 498 13.935 -14.019 -0.496 1.00 0.00 C ATOM 782 OG1 THR A 498 14.931 -12.979 -0.462 1.00 0.00 O ATOM 783 CG2 THR A 498 14.381 -15.093 -1.513 1.00 0.00 C ATOM 0 H THR A 498 13.570 -12.444 -2.407 1.00 0.00 H new ATOM 0 HA THR A 498 11.831 -14.255 -0.914 1.00 0.00 H new ATOM 0 HB THR A 498 13.837 -14.474 0.490 1.00 0.00 H new ATOM 0 HG1 THR A 498 15.799 -13.365 -0.221 1.00 0.00 H new ATOM 0 HG21 THR A 498 15.355 -15.486 -1.223 1.00 0.00 H new ATOM 0 HG22 THR A 498 13.653 -15.904 -1.529 1.00 0.00 H new ATOM 0 HG23 THR A 498 14.450 -14.648 -2.506 1.00 0.00 H new ATOM 791 N PRO A 499 10.961 -12.756 0.981 1.00 0.00 N ATOM 792 CA PRO A 499 10.373 -11.839 2.005 1.00 0.00 C ATOM 793 C PRO A 499 11.403 -11.307 3.032 1.00 0.00 C ATOM 794 O PRO A 499 11.249 -10.195 3.556 1.00 0.00 O ATOM 795 CB PRO A 499 9.267 -12.701 2.684 1.00 0.00 C ATOM 796 CG PRO A 499 9.563 -14.117 2.286 1.00 0.00 C ATOM 797 CD PRO A 499 10.197 -14.034 0.919 1.00 0.00 C ATOM 0 HA PRO A 499 9.987 -10.928 1.547 1.00 0.00 H new ATOM 0 HB2 PRO A 499 9.289 -12.585 3.768 1.00 0.00 H new ATOM 0 HB3 PRO A 499 8.274 -12.399 2.351 1.00 0.00 H new ATOM 0 HG2 PRO A 499 10.235 -14.592 3.001 1.00 0.00 H new ATOM 0 HG3 PRO A 499 8.652 -14.715 2.259 1.00 0.00 H new ATOM 0 HD2 PRO A 499 10.849 -14.885 0.724 1.00 0.00 H new ATOM 0 HD3 PRO A 499 9.448 -14.019 0.127 1.00 0.00 H new ATOM 805 N LYS A 500 12.451 -12.107 3.294 1.00 0.00 N ATOM 806 CA LYS A 500 13.536 -11.742 4.228 1.00 0.00 C ATOM 807 C LYS A 500 14.415 -10.583 3.692 1.00 0.00 C ATOM 808 O LYS A 500 15.112 -9.917 4.471 1.00 0.00 O ATOM 809 CB LYS A 500 14.420 -12.981 4.509 1.00 0.00 C ATOM 810 CG LYS A 500 15.149 -13.550 3.265 1.00 0.00 C ATOM 811 CD LYS A 500 16.041 -14.769 3.589 1.00 0.00 C ATOM 812 CE LYS A 500 17.181 -14.437 4.573 1.00 0.00 C ATOM 813 NZ LYS A 500 18.071 -15.601 4.806 1.00 0.00 N ATOM 0 H LYS A 500 12.572 -13.025 2.866 1.00 0.00 H new ATOM 0 HA LYS A 500 13.069 -11.395 5.150 1.00 0.00 H new ATOM 0 HB2 LYS A 500 15.164 -12.717 5.261 1.00 0.00 H new ATOM 0 HB3 LYS A 500 13.797 -13.765 4.939 1.00 0.00 H new ATOM 0 HG2 LYS A 500 14.409 -13.837 2.518 1.00 0.00 H new ATOM 0 HG3 LYS A 500 15.763 -12.766 2.821 1.00 0.00 H new ATOM 0 HD2 LYS A 500 15.424 -15.562 4.011 1.00 0.00 H new ATOM 0 HD3 LYS A 500 16.468 -15.156 2.664 1.00 0.00 H new ATOM 0 HE2 LYS A 500 17.767 -13.605 4.182 1.00 0.00 H new ATOM 0 HE3 LYS A 500 16.757 -14.109 5.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 18.823 -15.335 5.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 17.518 -16.387 5.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 18.497 -15.898 3.905 1.00 0.00 H new ATOM 827 N TYR A 501 14.389 -10.371 2.359 1.00 0.00 N ATOM 828 CA TYR A 501 15.230 -9.371 1.682 1.00 0.00 C ATOM 829 C TYR A 501 14.625 -7.970 1.858 1.00 0.00 C ATOM 830 O TYR A 501 13.438 -7.759 1.601 1.00 0.00 O ATOM 831 CB TYR A 501 15.373 -9.711 0.167 1.00 0.00 C ATOM 832 CG TYR A 501 16.398 -8.843 -0.585 1.00 0.00 C ATOM 833 CD1 TYR A 501 16.058 -7.595 -1.118 1.00 0.00 C ATOM 834 CD2 TYR A 501 17.721 -9.258 -0.722 1.00 0.00 C ATOM 835 CE1 TYR A 501 16.991 -6.812 -1.763 1.00 0.00 C ATOM 836 CE2 TYR A 501 18.651 -8.476 -1.374 1.00 0.00 C ATOM 837 CZ TYR A 501 18.286 -7.251 -1.881 1.00 0.00 C ATOM 838 OH TYR A 501 19.223 -6.464 -2.510 1.00 0.00 O ATOM 0 H TYR A 501 13.782 -10.891 1.725 1.00 0.00 H new ATOM 0 HA TYR A 501 16.222 -9.387 2.133 1.00 0.00 H new ATOM 0 HB2 TYR A 501 15.659 -10.758 0.067 1.00 0.00 H new ATOM 0 HB3 TYR A 501 14.400 -9.600 -0.311 1.00 0.00 H new ATOM 0 HD1 TYR A 501 15.043 -7.238 -1.022 1.00 0.00 H new ATOM 0 HD2 TYR A 501 18.024 -10.209 -0.310 1.00 0.00 H new ATOM 0 HE1 TYR A 501 16.704 -5.856 -2.174 1.00 0.00 H new ATOM 0 HE2 TYR A 501 19.667 -8.826 -1.487 1.00 0.00 H new ATOM 0 HH TYR A 501 19.962 -7.025 -2.827 1.00 0.00 H new ATOM 848 N ILE A 502 15.461 -7.019 2.298 1.00 0.00 N ATOM 849 CA ILE A 502 15.127 -5.583 2.325 1.00 0.00 C ATOM 850 C ILE A 502 16.225 -4.816 1.581 1.00 0.00 C ATOM 851 O ILE A 502 17.405 -4.886 1.947 1.00 0.00 O ATOM 852 CB ILE A 502 14.963 -5.030 3.798 1.00 0.00 C ATOM 853 CG1 ILE A 502 13.784 -5.769 4.515 1.00 0.00 C ATOM 854 CG2 ILE A 502 14.770 -3.481 3.829 1.00 0.00 C ATOM 855 CD1 ILE A 502 13.463 -5.283 5.916 1.00 0.00 C ATOM 0 H ILE A 502 16.397 -7.224 2.649 1.00 0.00 H new ATOM 0 HA ILE A 502 14.164 -5.441 1.835 1.00 0.00 H new ATOM 0 HB ILE A 502 15.887 -5.234 4.340 1.00 0.00 H new ATOM 0 HG12 ILE A 502 12.889 -5.669 3.901 1.00 0.00 H new ATOM 0 HG13 ILE A 502 14.021 -6.832 4.563 1.00 0.00 H new ATOM 0 HG21 ILE A 502 14.662 -3.148 4.861 1.00 0.00 H new ATOM 0 HG22 ILE A 502 15.638 -2.997 3.381 1.00 0.00 H new ATOM 0 HG23 ILE A 502 13.875 -3.214 3.266 1.00 0.00 H new ATOM 0 HD11 ILE A 502 12.632 -5.861 6.320 1.00 0.00 H new ATOM 0 HD12 ILE A 502 14.338 -5.409 6.554 1.00 0.00 H new ATOM 0 HD13 ILE A 502 13.188 -4.229 5.881 1.00 0.00 H new ATOM 867 N LEU A 503 15.822 -4.116 0.513 1.00 0.00 N ATOM 868 CA LEU A 503 16.726 -3.286 -0.304 1.00 0.00 C ATOM 869 C LEU A 503 16.883 -1.908 0.349 1.00 0.00 C ATOM 870 O LEU A 503 15.915 -1.339 0.832 1.00 0.00 O ATOM 871 CB LEU A 503 16.188 -3.147 -1.757 1.00 0.00 C ATOM 872 CG LEU A 503 17.103 -2.351 -2.746 1.00 0.00 C ATOM 873 CD1 LEU A 503 18.529 -2.941 -2.814 1.00 0.00 C ATOM 874 CD2 LEU A 503 16.469 -2.263 -4.145 1.00 0.00 C ATOM 0 H LEU A 503 14.856 -4.107 0.187 1.00 0.00 H new ATOM 0 HA LEU A 503 17.701 -3.770 -0.356 1.00 0.00 H new ATOM 0 HB2 LEU A 503 16.028 -4.146 -2.163 1.00 0.00 H new ATOM 0 HB3 LEU A 503 15.214 -2.659 -1.719 1.00 0.00 H new ATOM 0 HG LEU A 503 17.193 -1.337 -2.355 1.00 0.00 H new ATOM 0 HD11 LEU A 503 19.131 -2.359 -3.512 1.00 0.00 H new ATOM 0 HD12 LEU A 503 18.985 -2.906 -1.825 1.00 0.00 H new ATOM 0 HD13 LEU A 503 18.479 -3.975 -3.154 1.00 0.00 H new ATOM 0 HD21 LEU A 503 17.129 -1.704 -4.809 1.00 0.00 H new ATOM 0 HD22 LEU A 503 16.321 -3.268 -4.541 1.00 0.00 H new ATOM 0 HD23 LEU A 503 15.507 -1.755 -4.077 1.00 0.00 H new ATOM 886 N ARG A 504 18.112 -1.386 0.356 1.00 0.00 N ATOM 887 CA ARG A 504 18.447 -0.119 1.029 1.00 0.00 C ATOM 888 C ARG A 504 18.285 1.066 0.061 1.00 0.00 C ATOM 889 O ARG A 504 18.380 0.898 -1.164 1.00 0.00 O ATOM 890 CB ARG A 504 19.894 -0.174 1.603 1.00 0.00 C ATOM 891 CG ARG A 504 20.109 -1.145 2.794 1.00 0.00 C ATOM 892 CD ARG A 504 19.968 -2.632 2.424 1.00 0.00 C ATOM 893 NE ARG A 504 20.257 -3.533 3.555 1.00 0.00 N ATOM 894 CZ ARG A 504 21.389 -4.241 3.708 1.00 0.00 C ATOM 895 NH1 ARG A 504 22.391 -4.127 2.835 1.00 0.00 N ATOM 896 NH2 ARG A 504 21.513 -5.060 4.744 1.00 0.00 N ATOM 0 H ARG A 504 18.908 -1.828 -0.105 1.00 0.00 H new ATOM 0 HA ARG A 504 17.756 0.026 1.860 1.00 0.00 H new ATOM 0 HB2 ARG A 504 20.573 -0.458 0.799 1.00 0.00 H new ATOM 0 HB3 ARG A 504 20.178 0.829 1.920 1.00 0.00 H new ATOM 0 HG2 ARG A 504 21.102 -0.978 3.211 1.00 0.00 H new ATOM 0 HG3 ARG A 504 19.390 -0.907 3.578 1.00 0.00 H new ATOM 0 HD2 ARG A 504 18.955 -2.818 2.067 1.00 0.00 H new ATOM 0 HD3 ARG A 504 20.644 -2.862 1.600 1.00 0.00 H new ATOM 0 HE ARG A 504 19.543 -3.626 4.277 1.00 0.00 H new ATOM 0 HH11 ARG A 504 22.304 -3.496 2.038 1.00 0.00 H new ATOM 0 HH12 ARG A 504 23.244 -4.671 2.964 1.00 0.00 H new ATOM 0 HH21 ARG A 504 20.752 -5.149 5.418 1.00 0.00 H new ATOM 0 HH22 ARG A 504 22.369 -5.601 4.867 1.00 0.00 H new ATOM 910 N ALA A 505 18.041 2.259 0.627 1.00 0.00 N ATOM 911 CA ALA A 505 17.807 3.488 -0.143 1.00 0.00 C ATOM 912 C ALA A 505 19.104 4.013 -0.784 1.00 0.00 C ATOM 913 O ALA A 505 20.138 4.136 -0.107 1.00 0.00 O ATOM 914 CB ALA A 505 17.168 4.549 0.751 1.00 0.00 C ATOM 0 H ALA A 505 18.001 2.397 1.637 1.00 0.00 H new ATOM 0 HA ALA A 505 17.121 3.254 -0.957 1.00 0.00 H new ATOM 0 HB1 ALA A 505 16.998 5.457 0.173 1.00 0.00 H new ATOM 0 HB2 ALA A 505 16.217 4.178 1.133 1.00 0.00 H new ATOM 0 HB3 ALA A 505 17.833 4.770 1.586 1.00 0.00 H new ATOM 920 N GLY A 506 19.032 4.309 -2.096 1.00 0.00 N ATOM 921 CA GLY A 506 20.188 4.775 -2.866 1.00 0.00 C ATOM 922 C GLY A 506 21.175 3.657 -3.200 1.00 0.00 C ATOM 923 O GLY A 506 22.350 3.920 -3.489 1.00 0.00 O ATOM 0 H GLY A 506 18.175 4.231 -2.643 1.00 0.00 H new ATOM 0 HA2 GLY A 506 19.840 5.233 -3.792 1.00 0.00 H new ATOM 0 HA3 GLY A 506 20.705 5.551 -2.301 1.00 0.00 H new ATOM 927 N GLN A 507 20.696 2.403 -3.142 1.00 0.00 N ATOM 928 CA GLN A 507 21.487 1.197 -3.463 1.00 0.00 C ATOM 929 C GLN A 507 20.908 0.497 -4.703 1.00 0.00 C ATOM 930 O GLN A 507 20.173 1.114 -5.481 1.00 0.00 O ATOM 931 CB GLN A 507 21.523 0.268 -2.215 1.00 0.00 C ATOM 932 CG GLN A 507 22.317 0.840 -1.020 1.00 0.00 C ATOM 933 CD GLN A 507 23.815 0.967 -1.308 1.00 0.00 C ATOM 934 OE1 GLN A 507 24.586 0.040 -1.058 1.00 0.00 O ATOM 935 NE2 GLN A 507 24.241 2.099 -1.849 1.00 0.00 N ATOM 0 H GLN A 507 19.736 2.193 -2.868 1.00 0.00 H new ATOM 0 HA GLN A 507 22.513 1.470 -3.708 1.00 0.00 H new ATOM 0 HB2 GLN A 507 20.500 0.069 -1.895 1.00 0.00 H new ATOM 0 HB3 GLN A 507 21.959 -0.689 -2.501 1.00 0.00 H new ATOM 0 HG2 GLN A 507 21.917 1.820 -0.760 1.00 0.00 H new ATOM 0 HG3 GLN A 507 22.172 0.197 -0.152 1.00 0.00 H new ATOM 0 HE21 GLN A 507 23.580 2.851 -2.046 1.00 0.00 H new ATOM 0 HE22 GLN A 507 25.230 2.219 -2.069 1.00 0.00 H new ATOM 944 N MET A 508 21.277 -0.785 -4.905 1.00 0.00 N ATOM 945 CA MET A 508 20.861 -1.574 -6.082 1.00 0.00 C ATOM 946 C MET A 508 20.867 -3.081 -5.766 1.00 0.00 C ATOM 947 O MET A 508 21.415 -3.510 -4.744 1.00 0.00 O ATOM 948 CB MET A 508 21.790 -1.254 -7.287 1.00 0.00 C ATOM 949 CG MET A 508 23.287 -1.452 -7.017 1.00 0.00 C ATOM 950 SD MET A 508 24.310 -1.161 -8.480 1.00 0.00 S ATOM 951 CE MET A 508 23.931 0.554 -8.860 1.00 0.00 C ATOM 0 H MET A 508 21.871 -1.302 -4.257 1.00 0.00 H new ATOM 0 HA MET A 508 19.840 -1.298 -6.345 1.00 0.00 H new ATOM 0 HB2 MET A 508 21.501 -1.884 -8.128 1.00 0.00 H new ATOM 0 HB3 MET A 508 21.624 -0.221 -7.591 1.00 0.00 H new ATOM 0 HG2 MET A 508 23.600 -0.777 -6.221 1.00 0.00 H new ATOM 0 HG3 MET A 508 23.455 -2.467 -6.658 1.00 0.00 H new ATOM 0 HE1 MET A 508 24.682 0.950 -9.543 1.00 0.00 H new ATOM 0 HE2 MET A 508 22.948 0.615 -9.327 1.00 0.00 H new ATOM 0 HE3 MET A 508 23.933 1.139 -7.941 1.00 0.00 H new ATOM 961 N VAL A 509 20.241 -3.867 -6.658 1.00 0.00 N ATOM 962 CA VAL A 509 20.168 -5.338 -6.557 1.00 0.00 C ATOM 963 C VAL A 509 20.126 -5.940 -7.968 1.00 0.00 C ATOM 964 O VAL A 509 19.285 -5.560 -8.783 1.00 0.00 O ATOM 965 CB VAL A 509 18.928 -5.828 -5.703 1.00 0.00 C ATOM 966 CG1 VAL A 509 17.588 -5.210 -6.188 1.00 0.00 C ATOM 967 CG2 VAL A 509 18.857 -7.380 -5.655 1.00 0.00 C ATOM 0 H VAL A 509 19.765 -3.496 -7.480 1.00 0.00 H new ATOM 0 HA VAL A 509 21.059 -5.683 -6.032 1.00 0.00 H new ATOM 0 HB VAL A 509 19.083 -5.467 -4.686 1.00 0.00 H new ATOM 0 HG11 VAL A 509 16.771 -5.580 -5.568 1.00 0.00 H new ATOM 0 HG12 VAL A 509 17.639 -4.124 -6.111 1.00 0.00 H new ATOM 0 HG13 VAL A 509 17.412 -5.492 -7.226 1.00 0.00 H new ATOM 0 HG21 VAL A 509 17.996 -7.687 -5.062 1.00 0.00 H new ATOM 0 HG22 VAL A 509 18.758 -7.771 -6.668 1.00 0.00 H new ATOM 0 HG23 VAL A 509 19.768 -7.772 -5.202 1.00 0.00 H new ATOM 977 N THR A 510 21.042 -6.870 -8.251 1.00 0.00 N ATOM 978 CA THR A 510 21.157 -7.506 -9.566 1.00 0.00 C ATOM 979 C THR A 510 20.865 -9.010 -9.442 1.00 0.00 C ATOM 980 O THR A 510 21.628 -9.743 -8.805 1.00 0.00 O ATOM 981 CB THR A 510 22.587 -7.261 -10.152 1.00 0.00 C ATOM 982 OG1 THR A 510 22.891 -5.855 -10.099 1.00 0.00 O ATOM 983 CG2 THR A 510 22.729 -7.759 -11.605 1.00 0.00 C ATOM 0 H THR A 510 21.727 -7.204 -7.573 1.00 0.00 H new ATOM 0 HA THR A 510 20.428 -7.068 -10.248 1.00 0.00 H new ATOM 0 HB THR A 510 23.288 -7.832 -9.543 1.00 0.00 H new ATOM 0 HG1 THR A 510 23.361 -5.591 -10.918 1.00 0.00 H new ATOM 0 HG21 THR A 510 23.741 -7.563 -11.960 1.00 0.00 H new ATOM 0 HG22 THR A 510 22.532 -8.830 -11.643 1.00 0.00 H new ATOM 0 HG23 THR A 510 22.014 -7.236 -12.240 1.00 0.00 H new ATOM 991 N VAL A 511 19.731 -9.453 -10.017 1.00 0.00 N ATOM 992 CA VAL A 511 19.366 -10.877 -10.073 1.00 0.00 C ATOM 993 C VAL A 511 19.956 -11.510 -11.338 1.00 0.00 C ATOM 994 O VAL A 511 19.930 -10.906 -12.408 1.00 0.00 O ATOM 995 CB VAL A 511 17.806 -11.105 -10.014 1.00 0.00 C ATOM 996 CG1 VAL A 511 17.226 -10.580 -8.677 1.00 0.00 C ATOM 997 CG2 VAL A 511 17.077 -10.470 -11.229 1.00 0.00 C ATOM 0 H VAL A 511 19.046 -8.835 -10.453 1.00 0.00 H new ATOM 0 HA VAL A 511 19.785 -11.360 -9.190 1.00 0.00 H new ATOM 0 HB VAL A 511 17.632 -12.180 -10.066 1.00 0.00 H new ATOM 0 HG11 VAL A 511 16.149 -10.747 -8.657 1.00 0.00 H new ATOM 0 HG12 VAL A 511 17.691 -11.110 -7.846 1.00 0.00 H new ATOM 0 HG13 VAL A 511 17.429 -9.513 -8.586 1.00 0.00 H new ATOM 0 HG21 VAL A 511 16.005 -10.652 -11.146 1.00 0.00 H new ATOM 0 HG22 VAL A 511 17.263 -9.396 -11.244 1.00 0.00 H new ATOM 0 HG23 VAL A 511 17.450 -10.916 -12.151 1.00 0.00 H new ATOM 1007 N TRP A 512 20.507 -12.721 -11.191 1.00 0.00 N ATOM 1008 CA TRP A 512 21.147 -13.480 -12.277 1.00 0.00 C ATOM 1009 C TRP A 512 20.455 -14.836 -12.442 1.00 0.00 C ATOM 1010 O TRP A 512 19.563 -15.199 -11.665 1.00 0.00 O ATOM 1011 CB TRP A 512 22.651 -13.693 -11.971 1.00 0.00 C ATOM 1012 CG TRP A 512 23.537 -12.473 -12.118 1.00 0.00 C ATOM 1013 CD1 TRP A 512 23.562 -11.364 -11.324 1.00 0.00 C ATOM 1014 CD2 TRP A 512 24.551 -12.265 -13.117 1.00 0.00 C ATOM 1015 NE1 TRP A 512 24.522 -10.492 -11.761 1.00 0.00 N ATOM 1016 CE2 TRP A 512 25.139 -11.015 -12.860 1.00 0.00 C ATOM 1017 CE3 TRP A 512 25.014 -13.018 -14.200 1.00 0.00 C ATOM 1018 CZ2 TRP A 512 26.167 -10.498 -13.642 1.00 0.00 C ATOM 1019 CZ3 TRP A 512 26.033 -12.506 -14.981 1.00 0.00 C ATOM 1020 CH2 TRP A 512 26.603 -11.255 -14.698 1.00 0.00 C ATOM 0 H TRP A 512 20.522 -13.212 -10.297 1.00 0.00 H new ATOM 0 HA TRP A 512 21.053 -12.913 -13.203 1.00 0.00 H new ATOM 0 HB2 TRP A 512 22.745 -14.065 -10.951 1.00 0.00 H new ATOM 0 HB3 TRP A 512 23.029 -14.474 -12.631 1.00 0.00 H new ATOM 0 HD1 TRP A 512 22.917 -11.198 -10.473 1.00 0.00 H new ATOM 0 HE1 TRP A 512 24.742 -9.593 -11.333 1.00 0.00 H new ATOM 0 HE3 TRP A 512 24.583 -13.983 -14.423 1.00 0.00 H new ATOM 0 HZ2 TRP A 512 26.605 -9.535 -13.425 1.00 0.00 H new ATOM 0 HZ3 TRP A 512 26.396 -13.078 -15.822 1.00 0.00 H new ATOM 0 HH2 TRP A 512 27.400 -10.882 -15.324 1.00 0.00 H new ATOM 1031 N ALA A 513 20.875 -15.573 -13.479 1.00 0.00 N ATOM 1032 CA ALA A 513 20.429 -16.950 -13.736 1.00 0.00 C ATOM 1033 C ALA A 513 21.368 -17.946 -13.040 1.00 0.00 C ATOM 1034 O ALA A 513 22.568 -17.681 -12.907 1.00 0.00 O ATOM 1035 CB ALA A 513 20.382 -17.206 -15.255 1.00 0.00 C ATOM 0 H ALA A 513 21.541 -15.227 -14.170 1.00 0.00 H new ATOM 0 HA ALA A 513 19.427 -17.088 -13.331 1.00 0.00 H new ATOM 0 HB1 ALA A 513 20.051 -18.228 -15.442 1.00 0.00 H new ATOM 0 HB2 ALA A 513 19.686 -16.508 -15.720 1.00 0.00 H new ATOM 0 HB3 ALA A 513 21.376 -17.063 -15.679 1.00 0.00 H new ATOM 1041 N ALA A 514 20.811 -19.086 -12.587 1.00 0.00 N ATOM 1042 CA ALA A 514 21.594 -20.209 -12.014 1.00 0.00 C ATOM 1043 C ALA A 514 22.620 -20.737 -13.031 1.00 0.00 C ATOM 1044 O ALA A 514 23.791 -20.971 -12.706 1.00 0.00 O ATOM 1045 CB ALA A 514 20.652 -21.338 -11.561 1.00 0.00 C ATOM 0 H ALA A 514 19.806 -19.259 -12.606 1.00 0.00 H new ATOM 0 HA ALA A 514 22.139 -19.839 -11.146 1.00 0.00 H new ATOM 0 HB1 ALA A 514 21.239 -22.156 -11.143 1.00 0.00 H new ATOM 0 HB2 ALA A 514 19.967 -20.958 -10.803 1.00 0.00 H new ATOM 0 HB3 ALA A 514 20.082 -21.701 -12.416 1.00 0.00 H new ATOM 1051 N GLY A 515 22.168 -20.852 -14.289 1.00 0.00 N ATOM 1052 CA GLY A 515 23.003 -21.333 -15.396 1.00 0.00 C ATOM 1053 C GLY A 515 23.783 -20.226 -16.104 1.00 0.00 C ATOM 1054 O GLY A 515 24.115 -20.349 -17.287 1.00 0.00 O ATOM 0 H GLY A 515 21.215 -20.614 -14.565 1.00 0.00 H new ATOM 0 HA2 GLY A 515 23.706 -22.073 -15.014 1.00 0.00 H new ATOM 0 HA3 GLY A 515 22.369 -21.841 -16.123 1.00 0.00 H new ATOM 1058 N ALA A 516 24.030 -19.112 -15.390 1.00 0.00 N ATOM 1059 CA ALA A 516 24.931 -18.037 -15.852 1.00 0.00 C ATOM 1060 C ALA A 516 26.385 -18.327 -15.414 1.00 0.00 C ATOM 1061 O ALA A 516 27.327 -17.690 -15.908 1.00 0.00 O ATOM 1062 CB ALA A 516 24.453 -16.670 -15.322 1.00 0.00 C ATOM 0 H ALA A 516 23.612 -18.931 -14.478 1.00 0.00 H new ATOM 0 HA ALA A 516 24.907 -18.003 -16.941 1.00 0.00 H new ATOM 0 HB1 ALA A 516 25.128 -15.888 -15.671 1.00 0.00 H new ATOM 0 HB2 ALA A 516 23.446 -16.470 -15.687 1.00 0.00 H new ATOM 0 HB3 ALA A 516 24.447 -16.684 -14.232 1.00 0.00 H new ATOM 1068 N GLY A 517 26.546 -19.303 -14.487 1.00 0.00 N ATOM 1069 CA GLY A 517 27.847 -19.619 -13.884 1.00 0.00 C ATOM 1070 C GLY A 517 28.328 -18.524 -12.937 1.00 0.00 C ATOM 1071 O GLY A 517 29.537 -18.297 -12.784 1.00 0.00 O ATOM 0 H GLY A 517 25.780 -19.883 -14.145 1.00 0.00 H new ATOM 0 HA2 GLY A 517 27.773 -20.560 -13.340 1.00 0.00 H new ATOM 0 HA3 GLY A 517 28.585 -19.764 -14.673 1.00 0.00 H new ATOM 1075 N VAL A 518 27.355 -17.857 -12.300 1.00 0.00 N ATOM 1076 CA VAL A 518 27.577 -16.678 -11.445 1.00 0.00 C ATOM 1077 C VAL A 518 27.729 -17.089 -9.966 1.00 0.00 C ATOM 1078 O VAL A 518 27.096 -18.052 -9.506 1.00 0.00 O ATOM 1079 CB VAL A 518 26.383 -15.662 -11.614 1.00 0.00 C ATOM 1080 CG1 VAL A 518 25.029 -16.333 -11.277 1.00 0.00 C ATOM 1081 CG2 VAL A 518 26.597 -14.366 -10.784 1.00 0.00 C ATOM 0 H VAL A 518 26.373 -18.125 -12.365 1.00 0.00 H new ATOM 0 HA VAL A 518 28.503 -16.195 -11.755 1.00 0.00 H new ATOM 0 HB VAL A 518 26.358 -15.365 -12.662 1.00 0.00 H new ATOM 0 HG11 VAL A 518 24.223 -15.610 -11.402 1.00 0.00 H new ATOM 0 HG12 VAL A 518 24.865 -17.178 -11.946 1.00 0.00 H new ATOM 0 HG13 VAL A 518 25.044 -16.685 -10.245 1.00 0.00 H new ATOM 0 HG21 VAL A 518 25.750 -13.696 -10.931 1.00 0.00 H new ATOM 0 HG22 VAL A 518 26.679 -14.620 -9.727 1.00 0.00 H new ATOM 0 HG23 VAL A 518 27.512 -13.872 -11.111 1.00 0.00 H new ATOM 1091 N ALA A 519 28.594 -16.363 -9.237 1.00 0.00 N ATOM 1092 CA ALA A 519 28.742 -16.513 -7.784 1.00 0.00 C ATOM 1093 C ALA A 519 27.613 -15.743 -7.071 1.00 0.00 C ATOM 1094 O ALA A 519 27.406 -14.554 -7.345 1.00 0.00 O ATOM 1095 CB ALA A 519 30.124 -15.997 -7.346 1.00 0.00 C ATOM 0 H ALA A 519 29.209 -15.657 -9.641 1.00 0.00 H new ATOM 0 HA ALA A 519 28.669 -17.566 -7.512 1.00 0.00 H new ATOM 0 HB1 ALA A 519 30.229 -16.110 -6.267 1.00 0.00 H new ATOM 0 HB2 ALA A 519 30.903 -16.571 -7.849 1.00 0.00 H new ATOM 0 HB3 ALA A 519 30.220 -14.944 -7.611 1.00 0.00 H new ATOM 1101 N HIS A 520 26.868 -16.430 -6.188 1.00 0.00 N ATOM 1102 CA HIS A 520 25.800 -15.797 -5.392 1.00 0.00 C ATOM 1103 C HIS A 520 26.441 -14.930 -4.295 1.00 0.00 C ATOM 1104 O HIS A 520 27.170 -15.446 -3.439 1.00 0.00 O ATOM 1105 CB HIS A 520 24.870 -16.877 -4.768 1.00 0.00 C ATOM 1106 CG HIS A 520 23.621 -16.332 -4.110 1.00 0.00 C ATOM 1107 ND1 HIS A 520 23.075 -16.839 -2.952 1.00 0.00 N ATOM 1108 CD2 HIS A 520 22.784 -15.334 -4.499 1.00 0.00 C ATOM 1109 CE1 HIS A 520 21.955 -16.154 -2.687 1.00 0.00 C ATOM 1110 NE2 HIS A 520 21.735 -15.229 -3.594 1.00 0.00 N ATOM 0 H HIS A 520 26.986 -17.427 -6.007 1.00 0.00 H new ATOM 0 HA HIS A 520 25.189 -15.167 -6.038 1.00 0.00 H new ATOM 0 HB2 HIS A 520 24.576 -17.579 -5.548 1.00 0.00 H new ATOM 0 HB3 HIS A 520 25.437 -17.442 -4.028 1.00 0.00 H new ATOM 0 HD1 HIS A 520 23.457 -17.603 -2.394 1.00 0.00 H new ATOM 0 HD2 HIS A 520 22.914 -14.718 -5.376 1.00 0.00 H new ATOM 0 HE1 HIS A 520 21.315 -16.338 -1.837 1.00 0.00 H new ATOM 1118 N SER A 521 26.190 -13.610 -4.348 1.00 0.00 N ATOM 1119 CA SER A 521 26.769 -12.639 -3.397 1.00 0.00 C ATOM 1120 C SER A 521 25.698 -11.602 -2.966 1.00 0.00 C ATOM 1121 O SER A 521 25.725 -10.452 -3.424 1.00 0.00 O ATOM 1122 CB SER A 521 28.010 -11.953 -4.034 1.00 0.00 C ATOM 1123 OG SER A 521 28.970 -12.918 -4.449 1.00 0.00 O ATOM 0 H SER A 521 25.582 -13.185 -5.048 1.00 0.00 H new ATOM 0 HA SER A 521 27.097 -13.162 -2.499 1.00 0.00 H new ATOM 0 HB2 SER A 521 27.699 -11.353 -4.889 1.00 0.00 H new ATOM 0 HB3 SER A 521 28.462 -11.271 -3.314 1.00 0.00 H new ATOM 0 HG SER A 521 29.741 -12.462 -4.848 1.00 0.00 H new ATOM 1129 N PRO A 522 24.704 -12.010 -2.104 1.00 0.00 N ATOM 1130 CA PRO A 522 23.642 -11.094 -1.611 1.00 0.00 C ATOM 1131 C PRO A 522 24.226 -9.982 -0.693 1.00 0.00 C ATOM 1132 O PRO A 522 25.212 -10.235 0.010 1.00 0.00 O ATOM 1133 CB PRO A 522 22.678 -12.045 -0.844 1.00 0.00 C ATOM 1134 CG PRO A 522 23.522 -13.217 -0.443 1.00 0.00 C ATOM 1135 CD PRO A 522 24.535 -13.387 -1.553 1.00 0.00 C ATOM 0 HA PRO A 522 23.141 -10.548 -2.411 1.00 0.00 H new ATOM 0 HB2 PRO A 522 22.249 -11.552 0.028 1.00 0.00 H new ATOM 0 HB3 PRO A 522 21.846 -12.356 -1.476 1.00 0.00 H new ATOM 0 HG2 PRO A 522 24.014 -13.037 0.513 1.00 0.00 H new ATOM 0 HG3 PRO A 522 22.915 -14.115 -0.325 1.00 0.00 H new ATOM 0 HD2 PRO A 522 25.477 -13.784 -1.176 1.00 0.00 H new ATOM 0 HD3 PRO A 522 24.179 -14.081 -2.315 1.00 0.00 H new ATOM 1143 N PRO A 523 23.642 -8.733 -0.656 1.00 0.00 N ATOM 1144 CA PRO A 523 22.390 -8.346 -1.371 1.00 0.00 C ATOM 1145 C PRO A 523 22.601 -7.916 -2.849 1.00 0.00 C ATOM 1146 O PRO A 523 21.642 -7.840 -3.621 1.00 0.00 O ATOM 1147 CB PRO A 523 21.902 -7.158 -0.509 1.00 0.00 C ATOM 1148 CG PRO A 523 23.162 -6.475 -0.065 1.00 0.00 C ATOM 1149 CD PRO A 523 24.182 -7.585 0.136 1.00 0.00 C ATOM 0 HA PRO A 523 21.692 -9.178 -1.461 1.00 0.00 H new ATOM 0 HB2 PRO A 523 21.267 -6.484 -1.084 1.00 0.00 H new ATOM 0 HB3 PRO A 523 21.314 -7.500 0.343 1.00 0.00 H new ATOM 0 HG2 PRO A 523 23.504 -5.760 -0.813 1.00 0.00 H new ATOM 0 HG3 PRO A 523 23.001 -5.919 0.858 1.00 0.00 H new ATOM 0 HD2 PRO A 523 25.169 -7.287 -0.218 1.00 0.00 H new ATOM 0 HD3 PRO A 523 24.286 -7.843 1.190 1.00 0.00 H new ATOM 1157 N SER A 524 23.872 -7.672 -3.214 1.00 0.00 N ATOM 1158 CA SER A 524 24.258 -7.073 -4.508 1.00 0.00 C ATOM 1159 C SER A 524 23.966 -8.008 -5.700 1.00 0.00 C ATOM 1160 O SER A 524 23.659 -7.549 -6.805 1.00 0.00 O ATOM 1161 CB SER A 524 25.763 -6.725 -4.467 1.00 0.00 C ATOM 1162 OG SER A 524 26.083 -5.952 -3.319 1.00 0.00 O ATOM 0 H SER A 524 24.669 -7.886 -2.615 1.00 0.00 H new ATOM 0 HA SER A 524 23.660 -6.174 -4.656 1.00 0.00 H new ATOM 0 HB2 SER A 524 26.351 -7.643 -4.465 1.00 0.00 H new ATOM 0 HB3 SER A 524 26.036 -6.174 -5.367 1.00 0.00 H new ATOM 0 HG SER A 524 27.042 -5.748 -3.319 1.00 0.00 H new ATOM 1168 N THR A 525 24.077 -9.325 -5.457 1.00 0.00 N ATOM 1169 CA THR A 525 23.919 -10.357 -6.487 1.00 0.00 C ATOM 1170 C THR A 525 23.047 -11.504 -5.954 1.00 0.00 C ATOM 1171 O THR A 525 23.521 -12.357 -5.195 1.00 0.00 O ATOM 1172 CB THR A 525 25.321 -10.896 -6.946 1.00 0.00 C ATOM 1173 OG1 THR A 525 26.130 -9.800 -7.398 1.00 0.00 O ATOM 1174 CG2 THR A 525 25.218 -11.941 -8.073 1.00 0.00 C ATOM 0 H THR A 525 24.281 -9.703 -4.532 1.00 0.00 H new ATOM 0 HA THR A 525 23.424 -9.916 -7.352 1.00 0.00 H new ATOM 0 HB THR A 525 25.774 -11.386 -6.084 1.00 0.00 H new ATOM 0 HG1 THR A 525 27.006 -10.135 -7.683 1.00 0.00 H new ATOM 0 HG21 THR A 525 26.217 -12.278 -8.349 1.00 0.00 H new ATOM 0 HG22 THR A 525 24.631 -12.792 -7.728 1.00 0.00 H new ATOM 0 HG23 THR A 525 24.733 -11.494 -8.941 1.00 0.00 H new ATOM 1182 N LEU A 526 21.756 -11.466 -6.308 1.00 0.00 N ATOM 1183 CA LEU A 526 20.823 -12.580 -6.080 1.00 0.00 C ATOM 1184 C LEU A 526 20.837 -13.492 -7.317 1.00 0.00 C ATOM 1185 O LEU A 526 21.108 -13.027 -8.424 1.00 0.00 O ATOM 1186 CB LEU A 526 19.387 -12.058 -5.793 1.00 0.00 C ATOM 1187 CG LEU A 526 19.226 -11.141 -4.540 1.00 0.00 C ATOM 1188 CD1 LEU A 526 17.754 -10.720 -4.341 1.00 0.00 C ATOM 1189 CD2 LEU A 526 19.799 -11.813 -3.268 1.00 0.00 C ATOM 0 H LEU A 526 21.327 -10.660 -6.762 1.00 0.00 H new ATOM 0 HA LEU A 526 21.140 -13.145 -5.203 1.00 0.00 H new ATOM 0 HB2 LEU A 526 19.041 -11.507 -6.668 1.00 0.00 H new ATOM 0 HB3 LEU A 526 18.727 -12.917 -5.676 1.00 0.00 H new ATOM 0 HG LEU A 526 19.807 -10.236 -4.718 1.00 0.00 H new ATOM 0 HD11 LEU A 526 17.674 -10.082 -3.461 1.00 0.00 H new ATOM 0 HD12 LEU A 526 17.410 -10.172 -5.219 1.00 0.00 H new ATOM 0 HD13 LEU A 526 17.137 -11.608 -4.203 1.00 0.00 H new ATOM 0 HD21 LEU A 526 19.670 -11.147 -2.415 1.00 0.00 H new ATOM 0 HD22 LEU A 526 19.271 -12.748 -3.081 1.00 0.00 H new ATOM 0 HD23 LEU A 526 20.860 -12.018 -3.411 1.00 0.00 H new ATOM 1201 N VAL A 527 20.595 -14.800 -7.124 1.00 0.00 N ATOM 1202 CA VAL A 527 20.606 -15.797 -8.219 1.00 0.00 C ATOM 1203 C VAL A 527 19.312 -16.635 -8.173 1.00 0.00 C ATOM 1204 O VAL A 527 19.016 -17.266 -7.151 1.00 0.00 O ATOM 1205 CB VAL A 527 21.876 -16.732 -8.125 1.00 0.00 C ATOM 1206 CG1 VAL A 527 21.878 -17.822 -9.227 1.00 0.00 C ATOM 1207 CG2 VAL A 527 23.183 -15.898 -8.177 1.00 0.00 C ATOM 0 H VAL A 527 20.386 -15.199 -6.209 1.00 0.00 H new ATOM 0 HA VAL A 527 20.655 -15.267 -9.170 1.00 0.00 H new ATOM 0 HB VAL A 527 21.828 -17.242 -7.163 1.00 0.00 H new ATOM 0 HG11 VAL A 527 22.769 -18.442 -9.124 1.00 0.00 H new ATOM 0 HG12 VAL A 527 20.989 -18.445 -9.125 1.00 0.00 H new ATOM 0 HG13 VAL A 527 21.877 -17.347 -10.208 1.00 0.00 H new ATOM 0 HG21 VAL A 527 24.043 -16.565 -8.111 1.00 0.00 H new ATOM 0 HG22 VAL A 527 23.224 -15.345 -9.115 1.00 0.00 H new ATOM 0 HG23 VAL A 527 23.201 -15.198 -7.342 1.00 0.00 H new ATOM 1217 N TRP A 528 18.529 -16.604 -9.278 1.00 0.00 N ATOM 1218 CA TRP A 528 17.326 -17.441 -9.442 1.00 0.00 C ATOM 1219 C TRP A 528 17.768 -18.880 -9.759 1.00 0.00 C ATOM 1220 O TRP A 528 18.283 -19.156 -10.848 1.00 0.00 O ATOM 1221 CB TRP A 528 16.391 -16.884 -10.564 1.00 0.00 C ATOM 1222 CG TRP A 528 15.025 -17.563 -10.685 1.00 0.00 C ATOM 1223 CD1 TRP A 528 14.494 -18.555 -9.900 1.00 0.00 C ATOM 1224 CD2 TRP A 528 14.006 -17.255 -11.655 1.00 0.00 C ATOM 1225 NE1 TRP A 528 13.235 -18.883 -10.328 1.00 0.00 N ATOM 1226 CE2 TRP A 528 12.907 -18.099 -11.401 1.00 0.00 C ATOM 1227 CE3 TRP A 528 13.923 -16.351 -12.711 1.00 0.00 C ATOM 1228 CZ2 TRP A 528 11.741 -18.055 -12.163 1.00 0.00 C ATOM 1229 CZ3 TRP A 528 12.771 -16.305 -13.471 1.00 0.00 C ATOM 1230 CH2 TRP A 528 11.691 -17.152 -13.195 1.00 0.00 C ATOM 0 H TRP A 528 18.717 -15.998 -10.077 1.00 0.00 H new ATOM 0 HA TRP A 528 16.751 -17.428 -8.516 1.00 0.00 H new ATOM 0 HB2 TRP A 528 16.233 -15.820 -10.386 1.00 0.00 H new ATOM 0 HB3 TRP A 528 16.907 -16.974 -11.520 1.00 0.00 H new ATOM 0 HD1 TRP A 528 14.998 -19.013 -9.062 1.00 0.00 H new ATOM 0 HE1 TRP A 528 12.637 -19.598 -9.913 1.00 0.00 H new ATOM 0 HE3 TRP A 528 14.750 -15.693 -12.933 1.00 0.00 H new ATOM 0 HZ2 TRP A 528 10.907 -18.708 -11.949 1.00 0.00 H new ATOM 0 HZ3 TRP A 528 12.702 -15.605 -14.291 1.00 0.00 H new ATOM 0 HH2 TRP A 528 10.802 -17.094 -13.806 1.00 0.00 H new ATOM 1241 N LYS A 529 17.566 -19.775 -8.781 1.00 0.00 N ATOM 1242 CA LYS A 529 17.920 -21.198 -8.884 1.00 0.00 C ATOM 1243 C LYS A 529 16.946 -21.931 -9.834 1.00 0.00 C ATOM 1244 O LYS A 529 15.731 -21.706 -9.780 1.00 0.00 O ATOM 1245 CB LYS A 529 17.908 -21.835 -7.467 1.00 0.00 C ATOM 1246 CG LYS A 529 18.346 -23.316 -7.397 1.00 0.00 C ATOM 1247 CD LYS A 529 19.782 -23.542 -7.922 1.00 0.00 C ATOM 1248 CE LYS A 529 20.225 -25.011 -7.830 1.00 0.00 C ATOM 1249 NZ LYS A 529 21.594 -25.210 -8.367 1.00 0.00 N ATOM 0 H LYS A 529 17.147 -19.527 -7.885 1.00 0.00 H new ATOM 0 HA LYS A 529 18.922 -21.293 -9.303 1.00 0.00 H new ATOM 0 HB2 LYS A 529 18.562 -21.250 -6.820 1.00 0.00 H new ATOM 0 HB3 LYS A 529 16.900 -21.753 -7.060 1.00 0.00 H new ATOM 0 HG2 LYS A 529 18.283 -23.660 -6.365 1.00 0.00 H new ATOM 0 HG3 LYS A 529 17.652 -23.923 -7.978 1.00 0.00 H new ATOM 0 HD2 LYS A 529 19.840 -23.214 -8.960 1.00 0.00 H new ATOM 0 HD3 LYS A 529 20.474 -22.922 -7.352 1.00 0.00 H new ATOM 0 HE2 LYS A 529 20.192 -25.336 -6.790 1.00 0.00 H new ATOM 0 HE3 LYS A 529 19.524 -25.637 -8.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 529 21.856 -26.213 -8.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 529 21.620 -24.924 -9.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 529 22.267 -24.632 -7.824 1.00 0.00 H new ATOM 1263 N GLY A 530 17.502 -22.785 -10.715 1.00 0.00 N ATOM 1264 CA GLY A 530 16.714 -23.573 -11.668 1.00 0.00 C ATOM 1265 C GLY A 530 16.686 -22.961 -13.065 1.00 0.00 C ATOM 1266 O GLY A 530 16.749 -23.684 -14.067 1.00 0.00 O ATOM 0 H GLY A 530 18.507 -22.944 -10.782 1.00 0.00 H new ATOM 0 HA2 GLY A 530 17.126 -24.581 -11.727 1.00 0.00 H new ATOM 0 HA3 GLY A 530 15.693 -23.667 -11.298 1.00 0.00 H new ATOM 1270 N GLN A 531 16.590 -21.625 -13.134 1.00 0.00 N ATOM 1271 CA GLN A 531 16.588 -20.886 -14.410 1.00 0.00 C ATOM 1272 C GLN A 531 18.023 -20.694 -14.922 1.00 0.00 C ATOM 1273 O GLN A 531 18.804 -19.951 -14.334 1.00 0.00 O ATOM 1274 CB GLN A 531 15.853 -19.517 -14.252 1.00 0.00 C ATOM 1275 CG GLN A 531 14.343 -19.563 -14.586 1.00 0.00 C ATOM 1276 CD GLN A 531 14.035 -19.560 -16.092 1.00 0.00 C ATOM 1277 OE1 GLN A 531 14.822 -20.039 -16.915 1.00 0.00 O ATOM 1278 NE2 GLN A 531 12.880 -19.021 -16.465 1.00 0.00 N ATOM 0 H GLN A 531 16.512 -21.026 -12.312 1.00 0.00 H new ATOM 0 HA GLN A 531 16.044 -21.472 -15.151 1.00 0.00 H new ATOM 0 HB2 GLN A 531 15.976 -19.168 -13.227 1.00 0.00 H new ATOM 0 HB3 GLN A 531 16.334 -18.783 -14.898 1.00 0.00 H new ATOM 0 HG2 GLN A 531 13.910 -20.458 -14.139 1.00 0.00 H new ATOM 0 HG3 GLN A 531 13.853 -18.706 -14.124 1.00 0.00 H new ATOM 0 HE21 GLN A 531 12.249 -18.633 -15.764 1.00 0.00 H new ATOM 0 HE22 GLN A 531 12.624 -18.996 -17.452 1.00 0.00 H new ATOM 1287 N SER A 532 18.358 -21.407 -16.005 1.00 0.00 N ATOM 1288 CA SER A 532 19.639 -21.259 -16.703 1.00 0.00 C ATOM 1289 C SER A 532 19.576 -20.084 -17.687 1.00 0.00 C ATOM 1290 O SER A 532 20.548 -19.337 -17.859 1.00 0.00 O ATOM 1291 CB SER A 532 19.989 -22.564 -17.454 1.00 0.00 C ATOM 1292 OG SER A 532 19.016 -22.880 -18.434 1.00 0.00 O ATOM 0 H SER A 532 17.744 -22.106 -16.423 1.00 0.00 H new ATOM 0 HA SER A 532 20.417 -21.057 -15.967 1.00 0.00 H new ATOM 0 HB2 SER A 532 20.964 -22.460 -17.929 1.00 0.00 H new ATOM 0 HB3 SER A 532 20.068 -23.385 -16.741 1.00 0.00 H new ATOM 0 HG SER A 532 19.269 -23.709 -18.891 1.00 0.00 H new ATOM 1298 N SER A 533 18.402 -19.937 -18.318 1.00 0.00 N ATOM 1299 CA SER A 533 18.169 -18.979 -19.399 1.00 0.00 C ATOM 1300 C SER A 533 17.591 -17.651 -18.872 1.00 0.00 C ATOM 1301 O SER A 533 17.837 -16.592 -19.460 1.00 0.00 O ATOM 1302 CB SER A 533 17.184 -19.624 -20.387 1.00 0.00 C ATOM 1303 OG SER A 533 15.990 -20.037 -19.738 1.00 0.00 O ATOM 0 H SER A 533 17.578 -20.491 -18.085 1.00 0.00 H new ATOM 0 HA SER A 533 19.117 -18.744 -19.883 1.00 0.00 H new ATOM 0 HB2 SER A 533 16.942 -18.913 -21.177 1.00 0.00 H new ATOM 0 HB3 SER A 533 17.656 -20.483 -20.864 1.00 0.00 H new ATOM 0 HG SER A 533 15.384 -20.441 -20.394 1.00 0.00 H new ATOM 1309 N TRP A 534 16.834 -17.741 -17.743 1.00 0.00 N ATOM 1310 CA TRP A 534 16.034 -16.617 -17.181 1.00 0.00 C ATOM 1311 C TRP A 534 14.985 -16.157 -18.234 1.00 0.00 C ATOM 1312 O TRP A 534 14.654 -14.971 -18.317 1.00 0.00 O ATOM 1313 CB TRP A 534 16.961 -15.430 -16.706 1.00 0.00 C ATOM 1314 CG TRP A 534 16.646 -14.809 -15.351 1.00 0.00 C ATOM 1315 CD1 TRP A 534 17.351 -15.002 -14.200 1.00 0.00 C ATOM 1316 CD2 TRP A 534 15.578 -13.898 -15.001 1.00 0.00 C ATOM 1317 NE1 TRP A 534 16.813 -14.279 -13.174 1.00 0.00 N ATOM 1318 CE2 TRP A 534 15.726 -13.594 -13.632 1.00 0.00 C ATOM 1319 CE3 TRP A 534 14.524 -13.310 -15.698 1.00 0.00 C ATOM 1320 CZ2 TRP A 534 14.857 -12.742 -12.956 1.00 0.00 C ATOM 1321 CZ3 TRP A 534 13.664 -12.463 -15.028 1.00 0.00 C ATOM 1322 CH2 TRP A 534 13.835 -12.189 -13.667 1.00 0.00 C ATOM 0 H TRP A 534 16.762 -18.599 -17.196 1.00 0.00 H new ATOM 0 HA TRP A 534 15.504 -16.962 -16.293 1.00 0.00 H new ATOM 0 HB2 TRP A 534 17.989 -15.791 -16.683 1.00 0.00 H new ATOM 0 HB3 TRP A 534 16.916 -14.643 -17.459 1.00 0.00 H new ATOM 0 HD1 TRP A 534 18.218 -15.640 -14.112 1.00 0.00 H new ATOM 0 HE1 TRP A 534 17.167 -14.255 -12.218 1.00 0.00 H new ATOM 0 HE3 TRP A 534 14.382 -13.514 -16.749 1.00 0.00 H new ATOM 0 HZ2 TRP A 534 14.988 -12.527 -11.906 1.00 0.00 H new ATOM 0 HZ3 TRP A 534 12.846 -12.004 -15.563 1.00 0.00 H new ATOM 0 HH2 TRP A 534 13.143 -11.526 -13.170 1.00 0.00 H new ATOM 1333 N GLY A 535 14.451 -17.126 -19.032 1.00 0.00 N ATOM 1334 CA GLY A 535 13.451 -16.818 -20.064 1.00 0.00 C ATOM 1335 C GLY A 535 14.066 -16.242 -21.340 1.00 0.00 C ATOM 1336 O GLY A 535 14.104 -15.015 -21.500 1.00 0.00 O ATOM 0 H GLY A 535 14.701 -18.113 -18.972 1.00 0.00 H new ATOM 0 HA2 GLY A 535 12.900 -17.726 -20.311 1.00 0.00 H new ATOM 0 HA3 GLY A 535 12.730 -16.107 -19.662 1.00 0.00 H new ATOM 1340 N THR A 536 14.600 -17.128 -22.218 1.00 0.00 N ATOM 1341 CA THR A 536 15.232 -16.729 -23.500 1.00 0.00 C ATOM 1342 C THR A 536 14.293 -15.885 -24.383 1.00 0.00 C ATOM 1343 O THR A 536 13.062 -16.044 -24.368 1.00 0.00 O ATOM 1344 CB THR A 536 15.749 -17.959 -24.341 1.00 0.00 C ATOM 1345 OG1 THR A 536 14.746 -18.987 -24.378 1.00 0.00 O ATOM 1346 CG2 THR A 536 17.067 -18.542 -23.802 1.00 0.00 C ATOM 0 H THR A 536 14.604 -18.135 -22.058 1.00 0.00 H new ATOM 0 HA THR A 536 16.089 -16.122 -23.206 1.00 0.00 H new ATOM 0 HB THR A 536 15.948 -17.590 -25.347 1.00 0.00 H new ATOM 0 HG1 THR A 536 13.859 -18.583 -24.275 1.00 0.00 H new ATOM 0 HG21 THR A 536 17.372 -19.385 -24.422 1.00 0.00 H new ATOM 0 HG22 THR A 536 17.841 -17.775 -23.826 1.00 0.00 H new ATOM 0 HG23 THR A 536 16.923 -18.879 -22.776 1.00 0.00 H new ATOM 1354 N GLY A 537 14.921 -15.000 -25.146 1.00 0.00 N ATOM 1355 CA GLY A 537 14.242 -14.066 -26.011 1.00 0.00 C ATOM 1356 C GLY A 537 15.186 -12.966 -26.453 1.00 0.00 C ATOM 1357 O GLY A 537 15.976 -12.468 -25.637 1.00 0.00 O ATOM 0 H GLY A 537 15.937 -14.916 -25.176 1.00 0.00 H new ATOM 0 HA2 GLY A 537 13.850 -14.589 -26.883 1.00 0.00 H new ATOM 0 HA3 GLY A 537 13.389 -13.633 -25.489 1.00 0.00 H new ATOM 1361 N GLU A 538 15.142 -12.621 -27.747 1.00 0.00 N ATOM 1362 CA GLU A 538 15.937 -11.510 -28.299 1.00 0.00 C ATOM 1363 C GLU A 538 15.210 -10.181 -28.047 1.00 0.00 C ATOM 1364 O GLU A 538 15.848 -9.183 -27.723 1.00 0.00 O ATOM 1365 CB GLU A 538 16.236 -11.731 -29.810 1.00 0.00 C ATOM 1366 CG GLU A 538 15.002 -11.982 -30.689 1.00 0.00 C ATOM 1367 CD GLU A 538 15.342 -12.228 -32.169 1.00 0.00 C ATOM 1368 OE1 GLU A 538 15.922 -13.293 -32.490 1.00 0.00 O ATOM 1369 OE2 GLU A 538 15.036 -11.361 -33.018 1.00 0.00 O ATOM 0 H GLU A 538 14.561 -13.097 -28.437 1.00 0.00 H new ATOM 0 HA GLU A 538 16.901 -11.474 -27.791 1.00 0.00 H new ATOM 0 HB2 GLU A 538 16.763 -10.856 -30.192 1.00 0.00 H new ATOM 0 HB3 GLU A 538 16.913 -12.580 -29.910 1.00 0.00 H new ATOM 0 HG2 GLU A 538 14.459 -12.844 -30.301 1.00 0.00 H new ATOM 0 HG3 GLU A 538 14.333 -11.124 -30.616 1.00 0.00 H new ATOM 1376 N SER A 539 13.868 -10.192 -28.153 1.00 0.00 N ATOM 1377 CA SER A 539 13.038 -8.999 -28.010 1.00 0.00 C ATOM 1378 C SER A 539 11.963 -9.256 -26.938 1.00 0.00 C ATOM 1379 O SER A 539 11.203 -10.231 -27.021 1.00 0.00 O ATOM 1380 CB SER A 539 12.408 -8.652 -29.373 1.00 0.00 C ATOM 1381 OG SER A 539 13.399 -8.484 -30.380 1.00 0.00 O ATOM 0 H SER A 539 13.333 -11.040 -28.342 1.00 0.00 H new ATOM 0 HA SER A 539 13.641 -8.149 -27.690 1.00 0.00 H new ATOM 0 HB2 SER A 539 11.719 -9.443 -29.668 1.00 0.00 H new ATOM 0 HB3 SER A 539 11.822 -7.737 -29.282 1.00 0.00 H new ATOM 0 HG SER A 539 12.966 -8.267 -31.232 1.00 0.00 H new ATOM 1387 N PHE A 540 11.925 -8.383 -25.919 1.00 0.00 N ATOM 1388 CA PHE A 540 11.055 -8.538 -24.748 1.00 0.00 C ATOM 1389 C PHE A 540 10.835 -7.194 -24.042 1.00 0.00 C ATOM 1390 O PHE A 540 11.591 -6.248 -24.242 1.00 0.00 O ATOM 1391 CB PHE A 540 11.657 -9.581 -23.760 1.00 0.00 C ATOM 1392 CG PHE A 540 13.127 -9.364 -23.393 1.00 0.00 C ATOM 1393 CD1 PHE A 540 13.497 -8.541 -22.328 1.00 0.00 C ATOM 1394 CD2 PHE A 540 14.145 -9.988 -24.119 1.00 0.00 C ATOM 1395 CE1 PHE A 540 14.826 -8.346 -22.010 1.00 0.00 C ATOM 1396 CE2 PHE A 540 15.475 -9.792 -23.798 1.00 0.00 C ATOM 1397 CZ PHE A 540 15.816 -8.975 -22.744 1.00 0.00 C ATOM 0 H PHE A 540 12.503 -7.543 -25.887 1.00 0.00 H new ATOM 0 HA PHE A 540 10.086 -8.900 -25.091 1.00 0.00 H new ATOM 0 HB2 PHE A 540 11.066 -9.572 -22.844 1.00 0.00 H new ATOM 0 HB3 PHE A 540 11.552 -10.574 -24.198 1.00 0.00 H new ATOM 0 HD1 PHE A 540 12.732 -8.050 -21.744 1.00 0.00 H new ATOM 0 HD2 PHE A 540 13.888 -10.635 -24.945 1.00 0.00 H new ATOM 0 HE1 PHE A 540 15.094 -7.701 -21.186 1.00 0.00 H new ATOM 0 HE2 PHE A 540 16.247 -10.280 -24.374 1.00 0.00 H new ATOM 0 HZ PHE A 540 16.855 -8.825 -22.490 1.00 0.00 H new ATOM 1407 N ARG A 541 9.780 -7.137 -23.219 1.00 0.00 N ATOM 1408 CA ARG A 541 9.535 -6.039 -22.275 1.00 0.00 C ATOM 1409 C ARG A 541 9.507 -6.614 -20.845 1.00 0.00 C ATOM 1410 O ARG A 541 8.625 -7.399 -20.489 1.00 0.00 O ATOM 1411 CB ARG A 541 8.221 -5.270 -22.625 1.00 0.00 C ATOM 1412 CG ARG A 541 6.964 -6.151 -22.764 1.00 0.00 C ATOM 1413 CD ARG A 541 5.693 -5.353 -23.113 1.00 0.00 C ATOM 1414 NE ARG A 541 4.532 -6.236 -23.344 1.00 0.00 N ATOM 1415 CZ ARG A 541 3.333 -5.838 -23.793 1.00 0.00 C ATOM 1416 NH1 ARG A 541 3.072 -4.553 -24.027 1.00 0.00 N ATOM 1417 NH2 ARG A 541 2.386 -6.734 -24.010 1.00 0.00 N ATOM 0 H ARG A 541 9.063 -7.862 -23.190 1.00 0.00 H new ATOM 0 HA ARG A 541 10.340 -5.308 -22.346 1.00 0.00 H new ATOM 0 HB2 ARG A 541 8.039 -4.524 -21.852 1.00 0.00 H new ATOM 0 HB3 ARG A 541 8.372 -4.730 -23.560 1.00 0.00 H new ATOM 0 HG2 ARG A 541 7.138 -6.900 -23.537 1.00 0.00 H new ATOM 0 HG3 ARG A 541 6.801 -6.689 -21.830 1.00 0.00 H new ATOM 0 HD2 ARG A 541 5.466 -4.660 -22.303 1.00 0.00 H new ATOM 0 HD3 ARG A 541 5.875 -4.753 -24.004 1.00 0.00 H new ATOM 0 HE ARG A 541 4.652 -7.229 -23.146 1.00 0.00 H new ATOM 0 HH11 ARG A 541 3.792 -3.849 -23.865 1.00 0.00 H new ATOM 0 HH12 ARG A 541 2.152 -4.273 -24.368 1.00 0.00 H new ATOM 0 HH21 ARG A 541 2.569 -7.722 -23.836 1.00 0.00 H new ATOM 0 HH22 ARG A 541 1.472 -6.437 -24.352 1.00 0.00 H new ATOM 1431 N THR A 542 10.517 -6.260 -20.046 1.00 0.00 N ATOM 1432 CA THR A 542 10.604 -6.669 -18.642 1.00 0.00 C ATOM 1433 C THR A 542 9.901 -5.612 -17.775 1.00 0.00 C ATOM 1434 O THR A 542 10.107 -4.413 -17.963 1.00 0.00 O ATOM 1435 CB THR A 542 12.089 -6.848 -18.216 1.00 0.00 C ATOM 1436 OG1 THR A 542 12.738 -7.794 -19.090 1.00 0.00 O ATOM 1437 CG2 THR A 542 12.238 -7.316 -16.759 1.00 0.00 C ATOM 0 H THR A 542 11.298 -5.681 -20.355 1.00 0.00 H new ATOM 0 HA THR A 542 10.109 -7.631 -18.506 1.00 0.00 H new ATOM 0 HB THR A 542 12.562 -5.869 -18.294 1.00 0.00 H new ATOM 0 HG1 THR A 542 13.619 -8.023 -18.727 1.00 0.00 H new ATOM 0 HG21 THR A 542 13.296 -7.424 -16.518 1.00 0.00 H new ATOM 0 HG22 THR A 542 11.787 -6.581 -16.093 1.00 0.00 H new ATOM 0 HG23 THR A 542 11.737 -8.276 -16.632 1.00 0.00 H new ATOM 1445 N VAL A 543 9.054 -6.078 -16.848 1.00 0.00 N ATOM 1446 CA VAL A 543 8.207 -5.233 -16.002 1.00 0.00 C ATOM 1447 C VAL A 543 8.495 -5.564 -14.528 1.00 0.00 C ATOM 1448 O VAL A 543 8.277 -6.699 -14.104 1.00 0.00 O ATOM 1449 CB VAL A 543 6.668 -5.483 -16.298 1.00 0.00 C ATOM 1450 CG1 VAL A 543 5.786 -4.444 -15.577 1.00 0.00 C ATOM 1451 CG2 VAL A 543 6.367 -5.523 -17.822 1.00 0.00 C ATOM 0 H VAL A 543 8.937 -7.074 -16.663 1.00 0.00 H new ATOM 0 HA VAL A 543 8.432 -4.188 -16.216 1.00 0.00 H new ATOM 0 HB VAL A 543 6.419 -6.466 -15.899 1.00 0.00 H new ATOM 0 HG11 VAL A 543 4.737 -4.641 -15.799 1.00 0.00 H new ATOM 0 HG12 VAL A 543 5.949 -4.512 -14.501 1.00 0.00 H new ATOM 0 HG13 VAL A 543 6.048 -3.443 -15.921 1.00 0.00 H new ATOM 0 HG21 VAL A 543 5.302 -5.696 -17.978 1.00 0.00 H new ATOM 0 HG22 VAL A 543 6.650 -4.572 -18.274 1.00 0.00 H new ATOM 0 HG23 VAL A 543 6.937 -6.329 -18.284 1.00 0.00 H new ATOM 1461 N LEU A 544 8.986 -4.587 -13.755 1.00 0.00 N ATOM 1462 CA LEU A 544 9.123 -4.724 -12.295 1.00 0.00 C ATOM 1463 C LEU A 544 7.803 -4.280 -11.639 1.00 0.00 C ATOM 1464 O LEU A 544 7.239 -3.237 -11.987 1.00 0.00 O ATOM 1465 CB LEU A 544 10.331 -3.902 -11.772 1.00 0.00 C ATOM 1466 CG LEU A 544 10.632 -3.984 -10.238 1.00 0.00 C ATOM 1467 CD1 LEU A 544 10.835 -5.438 -9.757 1.00 0.00 C ATOM 1468 CD2 LEU A 544 11.838 -3.097 -9.880 1.00 0.00 C ATOM 0 H LEU A 544 9.298 -3.686 -14.118 1.00 0.00 H new ATOM 0 HA LEU A 544 9.319 -5.764 -12.035 1.00 0.00 H new ATOM 0 HB2 LEU A 544 11.221 -4.227 -12.310 1.00 0.00 H new ATOM 0 HB3 LEU A 544 10.167 -2.856 -12.030 1.00 0.00 H new ATOM 0 HG LEU A 544 9.757 -3.605 -9.710 1.00 0.00 H new ATOM 0 HD11 LEU A 544 11.041 -5.442 -8.687 1.00 0.00 H new ATOM 0 HD12 LEU A 544 9.932 -6.016 -9.955 1.00 0.00 H new ATOM 0 HD13 LEU A 544 11.675 -5.884 -10.290 1.00 0.00 H new ATOM 0 HD21 LEU A 544 12.035 -3.165 -8.810 1.00 0.00 H new ATOM 0 HD22 LEU A 544 12.715 -3.435 -10.432 1.00 0.00 H new ATOM 0 HD23 LEU A 544 11.620 -2.062 -10.144 1.00 0.00 H new ATOM 1480 N VAL A 545 7.312 -5.104 -10.710 1.00 0.00 N ATOM 1481 CA VAL A 545 6.006 -4.951 -10.044 1.00 0.00 C ATOM 1482 C VAL A 545 6.222 -5.103 -8.524 1.00 0.00 C ATOM 1483 O VAL A 545 7.221 -5.685 -8.103 1.00 0.00 O ATOM 1484 CB VAL A 545 5.003 -6.037 -10.610 1.00 0.00 C ATOM 1485 CG1 VAL A 545 3.685 -6.125 -9.811 1.00 0.00 C ATOM 1486 CG2 VAL A 545 4.716 -5.778 -12.113 1.00 0.00 C ATOM 0 H VAL A 545 7.825 -5.924 -10.387 1.00 0.00 H new ATOM 0 HA VAL A 545 5.573 -3.970 -10.238 1.00 0.00 H new ATOM 0 HB VAL A 545 5.495 -7.003 -10.497 1.00 0.00 H new ATOM 0 HG11 VAL A 545 3.043 -6.888 -10.251 1.00 0.00 H new ATOM 0 HG12 VAL A 545 3.904 -6.388 -8.776 1.00 0.00 H new ATOM 0 HG13 VAL A 545 3.176 -5.161 -9.841 1.00 0.00 H new ATOM 0 HG21 VAL A 545 4.025 -6.533 -12.487 1.00 0.00 H new ATOM 0 HG22 VAL A 545 4.273 -4.789 -12.234 1.00 0.00 H new ATOM 0 HG23 VAL A 545 5.648 -5.829 -12.676 1.00 0.00 H new ATOM 1496 N ASN A 546 5.299 -4.559 -7.705 1.00 0.00 N ATOM 1497 CA ASN A 546 5.406 -4.611 -6.225 1.00 0.00 C ATOM 1498 C ASN A 546 4.227 -5.394 -5.606 1.00 0.00 C ATOM 1499 O ASN A 546 3.427 -6.004 -6.327 1.00 0.00 O ATOM 1500 CB ASN A 546 5.509 -3.158 -5.646 1.00 0.00 C ATOM 1501 CG ASN A 546 4.172 -2.477 -5.320 1.00 0.00 C ATOM 1502 OD1 ASN A 546 3.465 -2.009 -6.322 1.00 0.00 O flip ATOM 1503 ND2 ASN A 546 3.756 -2.438 -4.163 1.00 0.00 N flip ATOM 0 H ASN A 546 4.466 -4.076 -8.042 1.00 0.00 H new ATOM 0 HA ASN A 546 6.315 -5.149 -5.957 1.00 0.00 H new ATOM 0 HB2 ASN A 546 6.111 -3.190 -4.738 1.00 0.00 H new ATOM 0 HB3 ASN A 546 6.047 -2.538 -6.363 1.00 0.00 H new ATOM 0 HD21 ASN A 546 4.326 -2.809 -3.403 1.00 0.00 H new ATOM 0 HD22 ASN A 546 2.841 -2.035 -3.963 1.00 0.00 H new ATOM 1510 N ALA A 547 4.133 -5.327 -4.262 1.00 0.00 N ATOM 1511 CA ALA A 547 3.084 -5.969 -3.445 1.00 0.00 C ATOM 1512 C ALA A 547 1.642 -5.650 -3.914 1.00 0.00 C ATOM 1513 O ALA A 547 0.757 -6.515 -3.861 1.00 0.00 O ATOM 1514 CB ALA A 547 3.281 -5.538 -1.979 1.00 0.00 C ATOM 0 H ALA A 547 4.806 -4.808 -3.698 1.00 0.00 H new ATOM 0 HA ALA A 547 3.192 -7.048 -3.557 1.00 0.00 H new ATOM 0 HB1 ALA A 547 2.515 -6.002 -1.357 1.00 0.00 H new ATOM 0 HB2 ALA A 547 4.267 -5.853 -1.636 1.00 0.00 H new ATOM 0 HB3 ALA A 547 3.201 -4.453 -1.905 1.00 0.00 H new ATOM 1520 N ASP A 548 1.425 -4.402 -4.360 1.00 0.00 N ATOM 1521 CA ASP A 548 0.101 -3.912 -4.817 1.00 0.00 C ATOM 1522 C ASP A 548 -0.355 -4.606 -6.115 1.00 0.00 C ATOM 1523 O ASP A 548 -1.555 -4.852 -6.320 1.00 0.00 O ATOM 1524 CB ASP A 548 0.166 -2.384 -5.041 1.00 0.00 C ATOM 1525 CG ASP A 548 -1.182 -1.745 -5.428 1.00 0.00 C ATOM 1526 OD1 ASP A 548 -2.074 -1.640 -4.559 1.00 0.00 O ATOM 1527 OD2 ASP A 548 -1.353 -1.337 -6.593 1.00 0.00 O ATOM 0 H ASP A 548 2.161 -3.698 -4.416 1.00 0.00 H new ATOM 0 HA ASP A 548 -0.628 -4.149 -4.042 1.00 0.00 H new ATOM 0 HB2 ASP A 548 0.532 -1.910 -4.130 1.00 0.00 H new ATOM 0 HB3 ASP A 548 0.894 -2.173 -5.825 1.00 0.00 H new ATOM 1532 N GLY A 549 0.617 -4.917 -6.981 1.00 0.00 N ATOM 1533 CA GLY A 549 0.338 -5.491 -8.301 1.00 0.00 C ATOM 1534 C GLY A 549 0.500 -4.475 -9.427 1.00 0.00 C ATOM 1535 O GLY A 549 0.551 -4.856 -10.606 1.00 0.00 O ATOM 0 H GLY A 549 1.609 -4.779 -6.789 1.00 0.00 H new ATOM 0 HA2 GLY A 549 1.008 -6.333 -8.476 1.00 0.00 H new ATOM 0 HA3 GLY A 549 -0.678 -5.885 -8.315 1.00 0.00 H new ATOM 1539 N GLU A 550 0.598 -3.181 -9.061 1.00 0.00 N ATOM 1540 CA GLU A 550 0.860 -2.095 -10.026 1.00 0.00 C ATOM 1541 C GLU A 550 2.288 -2.228 -10.602 1.00 0.00 C ATOM 1542 O GLU A 550 3.215 -2.697 -9.911 1.00 0.00 O ATOM 1543 CB GLU A 550 0.681 -0.709 -9.350 1.00 0.00 C ATOM 1544 CG GLU A 550 1.735 -0.389 -8.280 1.00 0.00 C ATOM 1545 CD GLU A 550 1.485 0.917 -7.514 1.00 0.00 C ATOM 1546 OE1 GLU A 550 1.517 1.992 -8.146 1.00 0.00 O ATOM 1547 OE2 GLU A 550 1.256 0.874 -6.281 1.00 0.00 O ATOM 0 H GLU A 550 0.499 -2.862 -8.097 1.00 0.00 H new ATOM 0 HA GLU A 550 0.141 -2.176 -10.842 1.00 0.00 H new ATOM 0 HB2 GLU A 550 0.713 0.064 -10.118 1.00 0.00 H new ATOM 0 HB3 GLU A 550 -0.308 -0.665 -8.894 1.00 0.00 H new ATOM 0 HG2 GLU A 550 1.773 -1.213 -7.567 1.00 0.00 H new ATOM 0 HG3 GLU A 550 2.714 -0.335 -8.756 1.00 0.00 H new ATOM 1554 N GLU A 551 2.448 -1.806 -11.864 1.00 0.00 N ATOM 1555 CA GLU A 551 3.728 -1.864 -12.585 1.00 0.00 C ATOM 1556 C GLU A 551 4.578 -0.652 -12.148 1.00 0.00 C ATOM 1557 O GLU A 551 4.320 0.481 -12.574 1.00 0.00 O ATOM 1558 CB GLU A 551 3.501 -1.856 -14.131 1.00 0.00 C ATOM 1559 CG GLU A 551 2.578 -2.969 -14.696 1.00 0.00 C ATOM 1560 CD GLU A 551 1.089 -2.804 -14.335 1.00 0.00 C ATOM 1561 OE1 GLU A 551 0.516 -1.733 -14.636 1.00 0.00 O ATOM 1562 OE2 GLU A 551 0.497 -3.723 -13.736 1.00 0.00 O ATOM 0 H GLU A 551 1.687 -1.412 -12.418 1.00 0.00 H new ATOM 0 HA GLU A 551 4.248 -2.791 -12.344 1.00 0.00 H new ATOM 0 HB2 GLU A 551 3.082 -0.889 -14.410 1.00 0.00 H new ATOM 0 HB3 GLU A 551 4.472 -1.936 -14.620 1.00 0.00 H new ATOM 0 HG2 GLU A 551 2.676 -2.990 -15.781 1.00 0.00 H new ATOM 0 HG3 GLU A 551 2.924 -3.934 -14.326 1.00 0.00 H new ATOM 1569 N VAL A 552 5.549 -0.887 -11.243 1.00 0.00 N ATOM 1570 CA VAL A 552 6.380 0.195 -10.666 1.00 0.00 C ATOM 1571 C VAL A 552 7.498 0.629 -11.632 1.00 0.00 C ATOM 1572 O VAL A 552 8.043 1.734 -11.513 1.00 0.00 O ATOM 1573 CB VAL A 552 6.993 -0.231 -9.288 1.00 0.00 C ATOM 1574 CG1 VAL A 552 5.884 -0.633 -8.299 1.00 0.00 C ATOM 1575 CG2 VAL A 552 8.037 -1.362 -9.441 1.00 0.00 C ATOM 0 H VAL A 552 5.779 -1.817 -10.894 1.00 0.00 H new ATOM 0 HA VAL A 552 5.721 1.048 -10.503 1.00 0.00 H new ATOM 0 HB VAL A 552 7.518 0.635 -8.885 1.00 0.00 H new ATOM 0 HG11 VAL A 552 6.332 -0.925 -7.349 1.00 0.00 H new ATOM 0 HG12 VAL A 552 5.215 0.212 -8.140 1.00 0.00 H new ATOM 0 HG13 VAL A 552 5.319 -1.471 -8.707 1.00 0.00 H new ATOM 0 HG21 VAL A 552 8.435 -1.625 -8.461 1.00 0.00 H new ATOM 0 HG22 VAL A 552 7.563 -2.237 -9.887 1.00 0.00 H new ATOM 0 HG23 VAL A 552 8.850 -1.023 -10.083 1.00 0.00 H new ATOM 1585 N ALA A 553 7.826 -0.267 -12.576 1.00 0.00 N ATOM 1586 CA ALA A 553 8.851 -0.046 -13.604 1.00 0.00 C ATOM 1587 C ALA A 553 8.598 -1.002 -14.785 1.00 0.00 C ATOM 1588 O ALA A 553 8.036 -2.086 -14.593 1.00 0.00 O ATOM 1589 CB ALA A 553 10.259 -0.249 -13.010 1.00 0.00 C ATOM 0 H ALA A 553 7.378 -1.181 -12.646 1.00 0.00 H new ATOM 0 HA ALA A 553 8.793 0.980 -13.966 1.00 0.00 H new ATOM 0 HB1 ALA A 553 11.008 -0.082 -13.784 1.00 0.00 H new ATOM 0 HB2 ALA A 553 10.415 0.458 -12.195 1.00 0.00 H new ATOM 0 HB3 ALA A 553 10.351 -1.267 -12.630 1.00 0.00 H new ATOM 1595 N MET A 554 9.009 -0.589 -15.996 1.00 0.00 N ATOM 1596 CA MET A 554 8.804 -1.363 -17.239 1.00 0.00 C ATOM 1597 C MET A 554 9.716 -0.816 -18.344 1.00 0.00 C ATOM 1598 O MET A 554 9.579 0.348 -18.747 1.00 0.00 O ATOM 1599 CB MET A 554 7.314 -1.288 -17.689 1.00 0.00 C ATOM 1600 CG MET A 554 6.987 -1.982 -19.026 1.00 0.00 C ATOM 1601 SD MET A 554 5.233 -1.880 -19.452 1.00 0.00 S ATOM 1602 CE MET A 554 4.977 -0.102 -19.547 1.00 0.00 C ATOM 0 H MET A 554 9.496 0.295 -16.144 1.00 0.00 H new ATOM 0 HA MET A 554 9.055 -2.407 -17.049 1.00 0.00 H new ATOM 0 HB2 MET A 554 6.695 -1.731 -16.909 1.00 0.00 H new ATOM 0 HB3 MET A 554 7.028 -0.239 -17.765 1.00 0.00 H new ATOM 0 HG2 MET A 554 7.577 -1.527 -19.821 1.00 0.00 H new ATOM 0 HG3 MET A 554 7.283 -3.030 -18.969 1.00 0.00 H new ATOM 0 HE1 MET A 554 4.309 0.126 -20.378 1.00 0.00 H new ATOM 0 HE2 MET A 554 4.532 0.252 -18.617 1.00 0.00 H new ATOM 0 HE3 MET A 554 5.934 0.396 -19.704 1.00 0.00 H new ATOM 1612 N ARG A 555 10.658 -1.648 -18.816 1.00 0.00 N ATOM 1613 CA ARG A 555 11.587 -1.293 -19.899 1.00 0.00 C ATOM 1614 C ARG A 555 11.659 -2.428 -20.933 1.00 0.00 C ATOM 1615 O ARG A 555 11.842 -3.601 -20.576 1.00 0.00 O ATOM 1616 CB ARG A 555 12.998 -0.984 -19.327 1.00 0.00 C ATOM 1617 CG ARG A 555 13.035 0.241 -18.387 1.00 0.00 C ATOM 1618 CD ARG A 555 14.433 0.545 -17.840 1.00 0.00 C ATOM 1619 NE ARG A 555 15.375 0.902 -18.906 1.00 0.00 N ATOM 1620 CZ ARG A 555 16.638 1.277 -18.720 1.00 0.00 C ATOM 1621 NH1 ARG A 555 17.154 1.338 -17.505 1.00 0.00 N ATOM 1622 NH2 ARG A 555 17.379 1.594 -19.768 1.00 0.00 N ATOM 0 H ARG A 555 10.797 -2.592 -18.454 1.00 0.00 H new ATOM 0 HA ARG A 555 11.216 -0.396 -20.395 1.00 0.00 H new ATOM 0 HB2 ARG A 555 13.359 -1.858 -18.784 1.00 0.00 H new ATOM 0 HB3 ARG A 555 13.687 -0.816 -20.155 1.00 0.00 H new ATOM 0 HG2 ARG A 555 12.666 1.114 -18.925 1.00 0.00 H new ATOM 0 HG3 ARG A 555 12.355 0.070 -17.552 1.00 0.00 H new ATOM 0 HD2 ARG A 555 14.371 1.363 -17.122 1.00 0.00 H new ATOM 0 HD3 ARG A 555 14.808 -0.325 -17.301 1.00 0.00 H new ATOM 0 HE ARG A 555 15.035 0.859 -19.867 1.00 0.00 H new ATOM 0 HH11 ARG A 555 16.583 1.096 -16.695 1.00 0.00 H new ATOM 0 HH12 ARG A 555 18.124 1.627 -17.377 1.00 0.00 H new ATOM 0 HH21 ARG A 555 16.981 1.550 -20.706 1.00 0.00 H new ATOM 0 HH22 ARG A 555 18.349 1.883 -19.638 1.00 0.00 H new ATOM 1636 N THR A 556 11.511 -2.052 -22.207 1.00 0.00 N ATOM 1637 CA THR A 556 11.585 -2.963 -23.352 1.00 0.00 C ATOM 1638 C THR A 556 13.039 -3.036 -23.861 1.00 0.00 C ATOM 1639 O THR A 556 13.638 -2.006 -24.188 1.00 0.00 O ATOM 1640 CB THR A 556 10.634 -2.470 -24.495 1.00 0.00 C ATOM 1641 OG1 THR A 556 9.287 -2.363 -23.997 1.00 0.00 O ATOM 1642 CG2 THR A 556 10.656 -3.401 -25.720 1.00 0.00 C ATOM 0 H THR A 556 11.333 -1.084 -22.476 1.00 0.00 H new ATOM 0 HA THR A 556 11.266 -3.958 -23.041 1.00 0.00 H new ATOM 0 HB THR A 556 10.996 -1.494 -24.818 1.00 0.00 H new ATOM 0 HG1 THR A 556 8.696 -2.053 -24.715 1.00 0.00 H new ATOM 0 HG21 THR A 556 9.980 -3.015 -26.483 1.00 0.00 H new ATOM 0 HG22 THR A 556 11.668 -3.449 -26.122 1.00 0.00 H new ATOM 0 HG23 THR A 556 10.335 -4.400 -25.424 1.00 0.00 H new ATOM 1650 N VAL A 557 13.605 -4.260 -23.904 1.00 0.00 N ATOM 1651 CA VAL A 557 14.980 -4.511 -24.369 1.00 0.00 C ATOM 1652 C VAL A 557 14.961 -5.532 -25.514 1.00 0.00 C ATOM 1653 O VAL A 557 14.346 -6.598 -25.406 1.00 0.00 O ATOM 1654 CB VAL A 557 15.914 -5.024 -23.205 1.00 0.00 C ATOM 1655 CG1 VAL A 557 17.356 -5.348 -23.701 1.00 0.00 C ATOM 1656 CG2 VAL A 557 15.954 -4.004 -22.045 1.00 0.00 C ATOM 0 H VAL A 557 13.115 -5.106 -23.614 1.00 0.00 H new ATOM 0 HA VAL A 557 15.388 -3.565 -24.723 1.00 0.00 H new ATOM 0 HB VAL A 557 15.483 -5.956 -22.839 1.00 0.00 H new ATOM 0 HG11 VAL A 557 17.959 -5.697 -22.863 1.00 0.00 H new ATOM 0 HG12 VAL A 557 17.312 -6.125 -24.465 1.00 0.00 H new ATOM 0 HG13 VAL A 557 17.806 -4.449 -24.123 1.00 0.00 H new ATOM 0 HG21 VAL A 557 16.604 -4.378 -21.254 1.00 0.00 H new ATOM 0 HG22 VAL A 557 16.339 -3.052 -22.411 1.00 0.00 H new ATOM 0 HG23 VAL A 557 14.948 -3.861 -21.651 1.00 0.00 H new ATOM 1666 N LYS A 558 15.627 -5.165 -26.612 1.00 0.00 N ATOM 1667 CA LYS A 558 15.867 -6.031 -27.768 1.00 0.00 C ATOM 1668 C LYS A 558 17.385 -6.189 -27.953 1.00 0.00 C ATOM 1669 O LYS A 558 18.157 -5.292 -27.582 1.00 0.00 O ATOM 1670 CB LYS A 558 15.198 -5.473 -29.066 1.00 0.00 C ATOM 1671 CG LYS A 558 15.512 -3.987 -29.414 1.00 0.00 C ATOM 1672 CD LYS A 558 14.641 -2.953 -28.637 1.00 0.00 C ATOM 1673 CE LYS A 558 13.248 -2.707 -29.264 1.00 0.00 C ATOM 1674 NZ LYS A 558 12.419 -3.933 -29.391 1.00 0.00 N ATOM 0 H LYS A 558 16.025 -4.232 -26.724 1.00 0.00 H new ATOM 0 HA LYS A 558 15.412 -7.004 -27.583 1.00 0.00 H new ATOM 0 HB2 LYS A 558 15.507 -6.095 -29.906 1.00 0.00 H new ATOM 0 HB3 LYS A 558 14.118 -5.582 -28.969 1.00 0.00 H new ATOM 0 HG2 LYS A 558 16.563 -3.790 -29.204 1.00 0.00 H new ATOM 0 HG3 LYS A 558 15.367 -3.837 -30.484 1.00 0.00 H new ATOM 0 HD2 LYS A 558 14.511 -3.300 -27.612 1.00 0.00 H new ATOM 0 HD3 LYS A 558 15.178 -2.006 -28.587 1.00 0.00 H new ATOM 0 HE2 LYS A 558 12.711 -1.979 -28.657 1.00 0.00 H new ATOM 0 HE3 LYS A 558 13.378 -2.265 -30.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 558 11.449 -3.670 -29.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 558 12.823 -4.551 -30.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 558 12.404 -4.438 -28.482 1.00 0.00 H new ATOM 1688 N LYS A 559 17.807 -7.332 -28.518 1.00 0.00 N ATOM 1689 CA LYS A 559 19.227 -7.649 -28.722 1.00 0.00 C ATOM 1690 C LYS A 559 19.766 -6.831 -29.910 1.00 0.00 C ATOM 1691 O LYS A 559 19.778 -7.290 -31.061 1.00 0.00 O ATOM 1692 CB LYS A 559 19.407 -9.181 -28.928 1.00 0.00 C ATOM 1693 CG LYS A 559 20.878 -9.640 -29.007 1.00 0.00 C ATOM 1694 CD LYS A 559 21.037 -11.165 -29.159 1.00 0.00 C ATOM 1695 CE LYS A 559 22.511 -11.604 -29.186 1.00 0.00 C ATOM 1696 NZ LYS A 559 22.640 -13.069 -29.343 1.00 0.00 N ATOM 0 H LYS A 559 17.173 -8.061 -28.845 1.00 0.00 H new ATOM 0 HA LYS A 559 19.805 -7.375 -27.839 1.00 0.00 H new ATOM 0 HB2 LYS A 559 18.918 -9.706 -28.108 1.00 0.00 H new ATOM 0 HB3 LYS A 559 18.896 -9.475 -29.845 1.00 0.00 H new ATOM 0 HG2 LYS A 559 21.360 -9.146 -29.851 1.00 0.00 H new ATOM 0 HG3 LYS A 559 21.401 -9.316 -28.107 1.00 0.00 H new ATOM 0 HD2 LYS A 559 20.528 -11.664 -28.335 1.00 0.00 H new ATOM 0 HD3 LYS A 559 20.548 -11.488 -30.078 1.00 0.00 H new ATOM 0 HE2 LYS A 559 23.025 -11.103 -30.006 1.00 0.00 H new ATOM 0 HE3 LYS A 559 23.001 -11.292 -28.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 559 23.641 -13.317 -29.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 559 22.276 -13.543 -28.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 559 22.093 -13.379 -30.172 1.00 0.00 H new