USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1066 hydrogens (31 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -177:sc= -0.528 (180deg=-0.547) USER MOD Single : A 2 LYS NZ :NH3+ -147:sc= -0.596 (180deg=-2.53!) USER MOD Single : A 3 LYS NZ :NH3+ 155:sc= 0.0213 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -1.9 K(o=-1.9,f=-8.2!) USER MOD Single : A 13 ASN : amide:sc= -0.133 X(o=-0.13,f=0) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 ASN : amide:sc= -4.31! C(o=-4.3!,f=-9.9!) USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.228 USER MOD Single : A 28 HIS : no HD1:sc= -1.36! C(o=-1.4!,f=-1.2!) USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -5.26! C(o=-5.3!,f=-5.5!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ -149:sc= -0.045 (180deg=-0.128) USER MOD Single : A 42 MET CE :methyl -143:sc= -1.02 (180deg=-2.23) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 GLN : amide:sc= -0.0219 X(o=-0.022,f=-0.084) USER MOD Single : A 61 THR OG1 : rot 14:sc= 0.0451 USER MOD Single : A 63 GLN :FLIP amide:sc= -12! C(o=-14!,f=-12!) USER MOD Single : A 64 HIS : no HD1:sc= -0.508 X(o=-0.51,f=-0.93!) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 157:sc= 0.705 (180deg=0.186) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 HIS : no HD1:sc= -2.36 X(o=-2.4,f=-2) USER MOD Single : A 81 THR OG1 : rot -130:sc= -1.03! USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -0.355 K(o=-0.36,f=-1.1) USER MOD Single : A 105 MET CE :methyl -150:sc= -0.33 (180deg=-2.08) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -0.193 K(o=-0.19,f=-1.7!) USER MOD Single : A 119 ASN :FLIP amide:sc= -12! C(o=-14!,f=-12!) USER MOD Single : A 125 LYS NZ :NH3+ -149:sc= 0.623 (180deg=-0.414) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 APC O2' : rot 9:sc= 0.371 USER MOD Single : A 130 APC O3' : rot -178:sc= 0.355 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 15.709 16.995 4.412 1.00 0.00 N ATOM 2 CA MET A 1 16.703 16.258 3.581 1.00 0.00 C ATOM 3 C MET A 1 16.486 14.752 3.742 1.00 0.00 C ATOM 4 O MET A 1 16.688 13.984 2.822 1.00 0.00 O ATOM 5 CB MET A 1 18.118 16.619 4.036 1.00 0.00 C ATOM 6 CG MET A 1 18.392 15.987 5.402 1.00 0.00 C ATOM 7 SD MET A 1 19.968 16.600 6.045 1.00 0.00 S ATOM 8 CE MET A 1 21.015 15.282 5.381 1.00 0.00 C ATOM 0 H1 MET A 1 15.823 18.018 4.264 1.00 0.00 H new ATOM 0 H2 MET A 1 14.747 16.710 4.137 1.00 0.00 H new ATOM 0 H3 MET A 1 15.862 16.772 5.416 1.00 0.00 H new ATOM 0 HA MET A 1 16.576 16.535 2.534 1.00 0.00 H new ATOM 0 HB2 MET A 1 18.847 16.265 3.307 1.00 0.00 H new ATOM 0 HB3 MET A 1 18.227 17.702 4.096 1.00 0.00 H new ATOM 0 HG2 MET A 1 17.586 16.229 6.095 1.00 0.00 H new ATOM 0 HG3 MET A 1 18.421 14.901 5.313 1.00 0.00 H new ATOM 0 HE1 MET A 1 22.052 15.464 5.664 1.00 0.00 H new ATOM 0 HE2 MET A 1 20.692 14.322 5.784 1.00 0.00 H new ATOM 0 HE3 MET A 1 20.933 15.265 4.294 1.00 0.00 H new ATOM 20 N LYS A 2 16.078 14.323 4.903 1.00 0.00 N ATOM 21 CA LYS A 2 15.851 12.867 5.120 1.00 0.00 C ATOM 22 C LYS A 2 14.881 12.337 4.064 1.00 0.00 C ATOM 23 O LYS A 2 14.453 13.055 3.182 1.00 0.00 O ATOM 24 CB LYS A 2 15.254 12.643 6.514 1.00 0.00 C ATOM 25 CG LYS A 2 13.977 13.478 6.677 1.00 0.00 C ATOM 26 CD LYS A 2 12.844 12.854 5.856 1.00 0.00 C ATOM 27 CE LYS A 2 11.543 12.882 6.655 1.00 0.00 C ATOM 28 NZ LYS A 2 11.797 12.378 8.035 1.00 0.00 N ATOM 0 H LYS A 2 15.892 14.917 5.711 1.00 0.00 H new ATOM 0 HA LYS A 2 16.801 12.339 5.041 1.00 0.00 H new ATOM 0 HB2 LYS A 2 15.028 11.586 6.657 1.00 0.00 H new ATOM 0 HB3 LYS A 2 15.980 12.920 7.279 1.00 0.00 H new ATOM 0 HG2 LYS A 2 13.694 13.525 7.728 1.00 0.00 H new ATOM 0 HG3 LYS A 2 14.156 14.502 6.349 1.00 0.00 H new ATOM 0 HD2 LYS A 2 12.718 13.400 4.921 1.00 0.00 H new ATOM 0 HD3 LYS A 2 13.097 11.827 5.594 1.00 0.00 H new ATOM 0 HE2 LYS A 2 11.149 13.898 6.694 1.00 0.00 H new ATOM 0 HE3 LYS A 2 10.789 12.266 6.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 10.954 11.878 8.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 12.607 11.725 8.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 12.008 13.179 8.664 1.00 0.00 H new ATOM 42 N LYS A 3 14.519 11.088 4.159 1.00 0.00 N ATOM 43 CA LYS A 3 13.563 10.513 3.174 1.00 0.00 C ATOM 44 C LYS A 3 12.931 9.245 3.760 1.00 0.00 C ATOM 45 O LYS A 3 13.575 8.476 4.446 1.00 0.00 O ATOM 46 CB LYS A 3 14.302 10.166 1.881 1.00 0.00 C ATOM 47 CG LYS A 3 13.406 9.301 0.992 1.00 0.00 C ATOM 48 CD LYS A 3 13.171 10.009 -0.340 1.00 0.00 C ATOM 49 CE LYS A 3 13.296 8.995 -1.477 1.00 0.00 C ATOM 50 NZ LYS A 3 13.274 9.707 -2.785 1.00 0.00 N ATOM 0 H LYS A 3 14.844 10.441 4.877 1.00 0.00 H new ATOM 0 HA LYS A 3 12.783 11.243 2.957 1.00 0.00 H new ATOM 0 HB2 LYS A 3 14.581 11.078 1.354 1.00 0.00 H new ATOM 0 HB3 LYS A 3 15.226 9.634 2.110 1.00 0.00 H new ATOM 0 HG2 LYS A 3 13.873 8.331 0.822 1.00 0.00 H new ATOM 0 HG3 LYS A 3 12.454 9.114 1.489 1.00 0.00 H new ATOM 0 HD2 LYS A 3 12.182 10.467 -0.352 1.00 0.00 H new ATOM 0 HD3 LYS A 3 13.896 10.812 -0.472 1.00 0.00 H new ATOM 0 HE2 LYS A 3 14.223 8.430 -1.374 1.00 0.00 H new ATOM 0 HE3 LYS A 3 12.478 8.276 -1.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 13.763 9.133 -3.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 12.289 9.862 -3.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 13.755 10.624 -2.689 1.00 0.00 H new ATOM 64 N LEU A 4 11.676 9.025 3.488 1.00 0.00 N ATOM 65 CA LEU A 4 10.984 7.815 4.014 1.00 0.00 C ATOM 66 C LEU A 4 10.080 7.265 2.909 1.00 0.00 C ATOM 67 O LEU A 4 9.089 7.860 2.570 1.00 0.00 O ATOM 68 CB LEU A 4 10.165 8.225 5.258 1.00 0.00 C ATOM 69 CG LEU A 4 8.943 7.330 5.490 1.00 0.00 C ATOM 70 CD1 LEU A 4 7.744 7.882 4.726 1.00 0.00 C ATOM 71 CD2 LEU A 4 9.217 5.897 5.052 1.00 0.00 C ATOM 0 H LEU A 4 11.093 9.638 2.918 1.00 0.00 H new ATOM 0 HA LEU A 4 11.693 7.040 4.305 1.00 0.00 H new ATOM 0 HB2 LEU A 4 10.808 8.189 6.138 1.00 0.00 H new ATOM 0 HB3 LEU A 4 9.836 9.258 5.146 1.00 0.00 H new ATOM 0 HG LEU A 4 8.726 7.324 6.558 1.00 0.00 H new ATOM 0 HD11 LEU A 4 6.879 7.241 4.895 1.00 0.00 H new ATOM 0 HD12 LEU A 4 7.523 8.890 5.076 1.00 0.00 H new ATOM 0 HD13 LEU A 4 7.973 7.909 3.661 1.00 0.00 H new ATOM 0 HD21 LEU A 4 8.331 5.287 5.229 1.00 0.00 H new ATOM 0 HD22 LEU A 4 9.462 5.882 3.990 1.00 0.00 H new ATOM 0 HD23 LEU A 4 10.054 5.496 5.623 1.00 0.00 H new ATOM 83 N GLN A 5 10.414 6.130 2.346 1.00 0.00 N ATOM 84 CA GLN A 5 9.555 5.557 1.266 1.00 0.00 C ATOM 85 C GLN A 5 8.610 4.518 1.855 1.00 0.00 C ATOM 86 O GLN A 5 8.814 4.016 2.942 1.00 0.00 O ATOM 87 CB GLN A 5 10.416 4.882 0.198 1.00 0.00 C ATOM 88 CG GLN A 5 11.332 5.925 -0.449 1.00 0.00 C ATOM 89 CD GLN A 5 12.690 5.923 0.257 1.00 0.00 C ATOM 90 OE1 GLN A 5 12.811 6.398 1.367 1.00 0.00 O ATOM 91 NE2 GLN A 5 13.723 5.402 -0.348 1.00 0.00 N ATOM 0 H GLN A 5 11.238 5.579 2.586 1.00 0.00 H new ATOM 0 HA GLN A 5 8.987 6.370 0.815 1.00 0.00 H new ATOM 0 HB2 GLN A 5 11.011 4.086 0.645 1.00 0.00 H new ATOM 0 HB3 GLN A 5 9.781 4.420 -0.558 1.00 0.00 H new ATOM 0 HG2 GLN A 5 11.461 5.703 -1.508 1.00 0.00 H new ATOM 0 HG3 GLN A 5 10.878 6.914 -0.383 1.00 0.00 H new ATOM 0 HE21 GLN A 5 13.620 5.003 -1.281 1.00 0.00 H new ATOM 0 HE22 GLN A 5 14.633 5.394 0.112 1.00 0.00 H new ATOM 100 N ILE A 6 7.580 4.188 1.136 1.00 0.00 N ATOM 101 CA ILE A 6 6.616 3.181 1.642 1.00 0.00 C ATOM 102 C ILE A 6 6.401 2.111 0.566 1.00 0.00 C ATOM 103 O ILE A 6 5.796 2.358 -0.458 1.00 0.00 O ATOM 104 CB ILE A 6 5.304 3.896 1.985 1.00 0.00 C ATOM 105 CG1 ILE A 6 5.426 4.470 3.413 1.00 0.00 C ATOM 106 CG2 ILE A 6 4.126 2.919 1.884 1.00 0.00 C ATOM 107 CD1 ILE A 6 4.197 4.109 4.271 1.00 0.00 C ATOM 0 H ILE A 6 7.364 4.574 0.217 1.00 0.00 H new ATOM 0 HA ILE A 6 6.995 2.691 2.539 1.00 0.00 H new ATOM 0 HB ILE A 6 5.119 4.707 1.281 1.00 0.00 H new ATOM 0 HG12 ILE A 6 6.328 4.083 3.886 1.00 0.00 H new ATOM 0 HG13 ILE A 6 5.531 5.554 3.363 1.00 0.00 H new ATOM 0 HG21 ILE A 6 3.200 3.439 2.130 1.00 0.00 H new ATOM 0 HG22 ILE A 6 4.064 2.528 0.869 1.00 0.00 H new ATOM 0 HG23 ILE A 6 4.276 2.095 2.582 1.00 0.00 H new ATOM 0 HD11 ILE A 6 4.315 4.528 5.270 1.00 0.00 H new ATOM 0 HD12 ILE A 6 3.298 4.518 3.810 1.00 0.00 H new ATOM 0 HD13 ILE A 6 4.108 3.025 4.341 1.00 0.00 H new ATOM 119 N ALA A 7 6.906 0.928 0.791 1.00 0.00 N ATOM 120 CA ALA A 7 6.747 -0.161 -0.214 1.00 0.00 C ATOM 121 C ALA A 7 5.403 -0.846 0.001 1.00 0.00 C ATOM 122 O ALA A 7 5.334 -2.006 0.354 1.00 0.00 O ATOM 123 CB ALA A 7 7.870 -1.185 -0.043 1.00 0.00 C ATOM 0 H ALA A 7 7.424 0.669 1.631 1.00 0.00 H new ATOM 0 HA ALA A 7 6.791 0.260 -1.219 1.00 0.00 H new ATOM 0 HB1 ALA A 7 7.752 -1.981 -0.779 1.00 0.00 H new ATOM 0 HB2 ALA A 7 8.833 -0.696 -0.188 1.00 0.00 H new ATOM 0 HB3 ALA A 7 7.826 -1.609 0.960 1.00 0.00 H new ATOM 129 N VAL A 8 4.333 -0.135 -0.198 1.00 0.00 N ATOM 130 CA VAL A 8 2.995 -0.745 0.009 1.00 0.00 C ATOM 131 C VAL A 8 2.606 -1.599 -1.198 1.00 0.00 C ATOM 132 O VAL A 8 2.556 -2.807 -1.116 1.00 0.00 O ATOM 133 CB VAL A 8 1.938 0.350 0.249 1.00 0.00 C ATOM 134 CG1 VAL A 8 2.171 1.535 -0.693 1.00 0.00 C ATOM 135 CG2 VAL A 8 0.535 -0.227 0.016 1.00 0.00 C ATOM 0 H VAL A 8 4.327 0.841 -0.495 1.00 0.00 H new ATOM 0 HA VAL A 8 3.040 -1.386 0.889 1.00 0.00 H new ATOM 0 HB VAL A 8 2.023 0.699 1.278 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.416 2.299 -0.510 1.00 0.00 H new ATOM 0 HG12 VAL A 8 3.161 1.953 -0.513 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.102 1.197 -1.727 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.211 0.550 0.186 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.456 -0.588 -1.010 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.362 -1.053 0.705 1.00 0.00 H new ATOM 145 N GLY A 9 2.297 -1.005 -2.310 1.00 0.00 N ATOM 146 CA GLY A 9 1.876 -1.835 -3.459 1.00 0.00 C ATOM 147 C GLY A 9 0.640 -2.594 -3.021 1.00 0.00 C ATOM 148 O GLY A 9 0.681 -3.776 -2.742 1.00 0.00 O ATOM 0 H GLY A 9 2.317 0.002 -2.471 1.00 0.00 H new ATOM 0 HA2 GLY A 9 1.660 -1.212 -4.327 1.00 0.00 H new ATOM 0 HA3 GLY A 9 2.669 -2.523 -3.750 1.00 0.00 H new ATOM 152 N ILE A 10 -0.455 -1.897 -2.938 1.00 0.00 N ATOM 153 CA ILE A 10 -1.723 -2.538 -2.490 1.00 0.00 C ATOM 154 C ILE A 10 -1.822 -3.892 -3.160 1.00 0.00 C ATOM 155 O ILE A 10 -1.431 -4.061 -4.292 1.00 0.00 O ATOM 156 CB ILE A 10 -2.950 -1.695 -2.862 1.00 0.00 C ATOM 157 CG1 ILE A 10 -2.547 -0.240 -3.104 1.00 0.00 C ATOM 158 CG2 ILE A 10 -3.958 -1.751 -1.713 1.00 0.00 C ATOM 159 CD1 ILE A 10 -3.790 0.583 -3.445 1.00 0.00 C ATOM 0 H ILE A 10 -0.529 -0.905 -3.162 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.708 -2.632 -1.404 1.00 0.00 H new ATOM 0 HB ILE A 10 -3.392 -2.095 -3.775 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -2.061 0.166 -2.217 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -1.825 -0.182 -3.918 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -4.834 -1.155 -1.968 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -4.260 -2.785 -1.544 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -3.500 -1.354 -0.807 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -3.503 1.620 -3.618 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -4.257 0.181 -4.344 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -4.497 0.535 -2.617 1.00 0.00 H new ATOM 171 N ILE A 11 -2.321 -4.859 -2.473 1.00 0.00 N ATOM 172 CA ILE A 11 -2.413 -6.203 -3.085 1.00 0.00 C ATOM 173 C ILE A 11 -3.823 -6.414 -3.618 1.00 0.00 C ATOM 174 O ILE A 11 -4.721 -6.772 -2.894 1.00 0.00 O ATOM 175 CB ILE A 11 -2.063 -7.268 -2.042 1.00 0.00 C ATOM 176 CG1 ILE A 11 -2.630 -6.864 -0.681 1.00 0.00 C ATOM 177 CG2 ILE A 11 -0.540 -7.387 -1.936 1.00 0.00 C ATOM 178 CD1 ILE A 11 -2.303 -7.946 0.349 1.00 0.00 C ATOM 0 H ILE A 11 -2.670 -4.784 -1.517 1.00 0.00 H new ATOM 0 HA ILE A 11 -1.707 -6.285 -3.912 1.00 0.00 H new ATOM 0 HB ILE A 11 -2.491 -8.224 -2.344 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -2.207 -5.909 -0.368 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -3.709 -6.727 -0.751 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -0.285 -8.144 -1.195 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -0.129 -7.674 -2.904 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -0.120 -6.427 -1.634 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -2.707 -7.658 1.320 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.747 -8.891 0.037 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -1.222 -8.061 0.426 1.00 0.00 H new ATOM 190 N ARG A 12 -4.011 -6.195 -4.889 1.00 0.00 N ATOM 191 CA ARG A 12 -5.360 -6.385 -5.499 1.00 0.00 C ATOM 192 C ARG A 12 -5.572 -7.887 -5.685 1.00 0.00 C ATOM 193 O ARG A 12 -4.667 -8.661 -5.446 1.00 0.00 O ATOM 194 CB ARG A 12 -5.419 -5.644 -6.844 1.00 0.00 C ATOM 195 CG ARG A 12 -5.643 -4.151 -6.575 1.00 0.00 C ATOM 196 CD ARG A 12 -5.840 -3.353 -7.881 1.00 0.00 C ATOM 197 NE ARG A 12 -5.793 -4.245 -9.082 1.00 0.00 N ATOM 198 CZ ARG A 12 -6.244 -3.815 -10.230 1.00 0.00 C ATOM 199 NH1 ARG A 12 -7.310 -3.066 -10.274 1.00 0.00 N ATOM 200 NH2 ARG A 12 -5.621 -4.125 -11.333 1.00 0.00 N ATOM 0 H ARG A 12 -3.285 -5.891 -5.537 1.00 0.00 H new ATOM 0 HA ARG A 12 -6.147 -5.981 -4.862 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -4.492 -5.793 -7.398 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -6.226 -6.042 -7.459 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -6.518 -4.025 -5.937 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -4.790 -3.749 -6.029 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -6.798 -2.833 -7.850 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -5.066 -2.590 -7.963 1.00 0.00 H new ATOM 0 HE ARG A 12 -5.409 -5.187 -9.004 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -7.793 -2.815 -9.411 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -7.661 -2.731 -11.171 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -4.781 -4.703 -11.299 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -5.973 -3.789 -12.229 1.00 0.00 H new ATOM 214 N ASN A 13 -6.745 -8.344 -6.049 1.00 0.00 N ATOM 215 CA ASN A 13 -6.891 -9.823 -6.144 1.00 0.00 C ATOM 216 C ASN A 13 -7.892 -10.305 -7.212 1.00 0.00 C ATOM 217 O ASN A 13 -7.513 -10.985 -8.110 1.00 0.00 O ATOM 218 CB ASN A 13 -7.300 -10.351 -4.767 1.00 0.00 C ATOM 219 CG ASN A 13 -7.820 -11.788 -4.879 1.00 0.00 C ATOM 220 OD1 ASN A 13 -7.047 -12.722 -4.972 1.00 0.00 O ATOM 221 ND2 ASN A 13 -9.106 -12.007 -4.870 1.00 0.00 N ATOM 0 H ASN A 13 -7.569 -7.787 -6.274 1.00 0.00 H new ATOM 0 HA ASN A 13 -5.926 -10.218 -6.463 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -6.447 -10.318 -4.090 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -8.071 -9.711 -4.339 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -9.461 -12.960 -4.941 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -9.756 -11.225 -4.792 1.00 0.00 H new ATOM 228 N GLU A 14 -9.159 -10.035 -7.124 1.00 0.00 N ATOM 229 CA GLU A 14 -10.079 -10.635 -8.157 1.00 0.00 C ATOM 230 C GLU A 14 -10.272 -9.702 -9.345 1.00 0.00 C ATOM 231 O GLU A 14 -10.483 -10.124 -10.465 1.00 0.00 O ATOM 232 CB GLU A 14 -11.432 -10.898 -7.497 1.00 0.00 C ATOM 233 CG GLU A 14 -12.394 -11.515 -8.516 1.00 0.00 C ATOM 234 CD GLU A 14 -12.224 -13.035 -8.526 1.00 0.00 C ATOM 235 OE1 GLU A 14 -11.155 -13.489 -8.897 1.00 0.00 O ATOM 236 OE2 GLU A 14 -13.166 -13.719 -8.162 1.00 0.00 O ATOM 0 H GLU A 14 -9.598 -9.449 -6.414 1.00 0.00 H new ATOM 0 HA GLU A 14 -9.636 -11.559 -8.528 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.308 -11.569 -6.647 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -11.846 -9.967 -7.110 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -13.422 -11.255 -8.264 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -12.197 -11.110 -9.509 1.00 0.00 H new ATOM 243 N ASN A 15 -10.171 -8.456 -9.104 1.00 0.00 N ATOM 244 CA ASN A 15 -10.305 -7.442 -10.181 1.00 0.00 C ATOM 245 C ASN A 15 -9.707 -6.186 -9.598 1.00 0.00 C ATOM 246 O ASN A 15 -8.933 -5.475 -10.208 1.00 0.00 O ATOM 247 CB ASN A 15 -11.780 -7.222 -10.524 1.00 0.00 C ATOM 248 CG ASN A 15 -11.901 -6.730 -11.968 1.00 0.00 C ATOM 249 OD1 ASN A 15 -12.031 -7.521 -12.881 1.00 0.00 O ATOM 250 ND2 ASN A 15 -11.857 -5.450 -12.214 1.00 0.00 N ATOM 0 H ASN A 15 -9.995 -8.067 -8.178 1.00 0.00 H new ATOM 0 HA ASN A 15 -9.809 -7.747 -11.103 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -12.336 -8.151 -10.397 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -12.218 -6.493 -9.842 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -11.932 -5.112 -13.174 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -11.748 -4.787 -11.447 1.00 0.00 H new ATOM 257 N ASN A 16 -10.055 -5.965 -8.373 1.00 0.00 N ATOM 258 CA ASN A 16 -9.541 -4.827 -7.612 1.00 0.00 C ATOM 259 C ASN A 16 -9.754 -5.178 -6.150 1.00 0.00 C ATOM 260 O ASN A 16 -9.978 -4.314 -5.326 1.00 0.00 O ATOM 261 CB ASN A 16 -10.324 -3.558 -7.957 1.00 0.00 C ATOM 262 CG ASN A 16 -9.404 -2.341 -7.861 1.00 0.00 C ATOM 263 OD1 ASN A 16 -9.378 -1.511 -8.749 1.00 0.00 O ATOM 264 ND2 ASN A 16 -8.638 -2.197 -6.814 1.00 0.00 N ATOM 0 H ASN A 16 -10.703 -6.557 -7.853 1.00 0.00 H new ATOM 0 HA ASN A 16 -8.492 -4.639 -7.839 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -10.736 -3.636 -8.963 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -11.167 -3.443 -7.276 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -8.019 -1.389 -6.742 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -8.658 -2.892 -6.068 1.00 0.00 H new ATOM 271 N GLU A 17 -9.697 -6.450 -5.803 1.00 0.00 N ATOM 272 CA GLU A 17 -9.917 -6.781 -4.374 1.00 0.00 C ATOM 273 C GLU A 17 -8.609 -6.586 -3.642 1.00 0.00 C ATOM 274 O GLU A 17 -7.789 -7.477 -3.533 1.00 0.00 O ATOM 275 CB GLU A 17 -10.437 -8.204 -4.213 1.00 0.00 C ATOM 276 CG GLU A 17 -11.666 -8.385 -5.100 1.00 0.00 C ATOM 277 CD GLU A 17 -12.506 -9.554 -4.582 1.00 0.00 C ATOM 278 OE1 GLU A 17 -12.009 -10.292 -3.746 1.00 0.00 O ATOM 279 OE2 GLU A 17 -13.633 -9.690 -5.026 1.00 0.00 O ATOM 0 H GLU A 17 -9.515 -7.236 -6.427 1.00 0.00 H new ATOM 0 HA GLU A 17 -10.677 -6.123 -3.952 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -9.664 -8.921 -4.489 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.693 -8.396 -3.171 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -12.260 -7.471 -5.106 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -11.360 -8.572 -6.129 1.00 0.00 H new ATOM 286 N ILE A 18 -8.401 -5.398 -3.168 1.00 0.00 N ATOM 287 CA ILE A 18 -7.133 -5.088 -2.467 1.00 0.00 C ATOM 288 C ILE A 18 -7.217 -5.479 -1.001 1.00 0.00 C ATOM 289 O ILE A 18 -8.262 -5.426 -0.387 1.00 0.00 O ATOM 290 CB ILE A 18 -6.822 -3.589 -2.558 1.00 0.00 C ATOM 291 CG1 ILE A 18 -8.117 -2.781 -2.683 1.00 0.00 C ATOM 292 CG2 ILE A 18 -5.943 -3.333 -3.776 1.00 0.00 C ATOM 293 CD1 ILE A 18 -7.834 -1.310 -2.379 1.00 0.00 C ATOM 0 H ILE A 18 -9.059 -4.622 -3.236 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.341 -5.659 -2.951 1.00 0.00 H new ATOM 0 HB ILE A 18 -6.302 -3.278 -1.652 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -8.526 -2.883 -3.688 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -8.867 -3.168 -1.993 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -5.719 -2.269 -3.846 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.014 -3.894 -3.678 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -6.467 -3.653 -4.677 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -8.756 -0.736 -2.468 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -7.445 -1.216 -1.365 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -7.099 -0.927 -3.087 1.00 0.00 H new ATOM 305 N PHE A 19 -6.104 -5.832 -0.429 1.00 0.00 N ATOM 306 CA PHE A 19 -6.070 -6.177 1.016 1.00 0.00 C ATOM 307 C PHE A 19 -5.970 -4.865 1.801 1.00 0.00 C ATOM 308 O PHE A 19 -5.187 -4.736 2.719 1.00 0.00 O ATOM 309 CB PHE A 19 -4.840 -7.046 1.292 1.00 0.00 C ATOM 310 CG PHE A 19 -5.011 -7.806 2.586 1.00 0.00 C ATOM 311 CD1 PHE A 19 -6.047 -8.734 2.727 1.00 0.00 C ATOM 312 CD2 PHE A 19 -4.118 -7.594 3.637 1.00 0.00 C ATOM 313 CE1 PHE A 19 -6.189 -9.447 3.924 1.00 0.00 C ATOM 314 CE2 PHE A 19 -4.261 -8.304 4.834 1.00 0.00 C ATOM 315 CZ PHE A 19 -5.296 -9.232 4.977 1.00 0.00 C ATOM 0 H PHE A 19 -5.205 -5.897 -0.907 1.00 0.00 H new ATOM 0 HA PHE A 19 -6.963 -6.727 1.312 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.689 -7.745 0.470 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -3.949 -6.420 1.346 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -6.737 -8.901 1.913 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -3.315 -6.880 3.526 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -6.989 -10.164 4.033 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -3.571 -8.135 5.648 1.00 0.00 H new ATOM 0 HZ PHE A 19 -5.406 -9.782 5.900 1.00 0.00 H new ATOM 325 N ILE A 20 -6.737 -3.876 1.415 1.00 0.00 N ATOM 326 CA ILE A 20 -6.683 -2.558 2.091 1.00 0.00 C ATOM 327 C ILE A 20 -7.497 -2.587 3.372 1.00 0.00 C ATOM 328 O ILE A 20 -8.411 -3.369 3.530 1.00 0.00 O ATOM 329 CB ILE A 20 -7.274 -1.495 1.168 1.00 0.00 C ATOM 330 CG1 ILE A 20 -7.261 -0.136 1.873 1.00 0.00 C ATOM 331 CG2 ILE A 20 -8.715 -1.867 0.820 1.00 0.00 C ATOM 332 CD1 ILE A 20 -5.817 0.280 2.161 1.00 0.00 C ATOM 0 H ILE A 20 -7.406 -3.934 0.647 1.00 0.00 H new ATOM 0 HA ILE A 20 -5.644 -2.328 2.326 1.00 0.00 H new ATOM 0 HB ILE A 20 -6.678 -1.438 0.257 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -7.748 0.613 1.249 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -7.826 -0.192 2.803 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -9.138 -1.108 0.161 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -8.730 -2.834 0.317 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -9.307 -1.924 1.734 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -5.810 1.248 2.663 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -5.345 -0.464 2.802 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -5.266 0.354 1.224 1.00 0.00 H new ATOM 344 N THR A 21 -7.190 -1.707 4.268 1.00 0.00 N ATOM 345 CA THR A 21 -7.950 -1.636 5.536 1.00 0.00 C ATOM 346 C THR A 21 -9.315 -1.013 5.242 1.00 0.00 C ATOM 347 O THR A 21 -9.501 0.182 5.351 1.00 0.00 O ATOM 348 CB THR A 21 -7.182 -0.760 6.518 1.00 0.00 C ATOM 349 OG1 THR A 21 -7.992 -0.489 7.652 1.00 0.00 O ATOM 350 CG2 THR A 21 -6.791 0.550 5.833 1.00 0.00 C ATOM 0 H THR A 21 -6.437 -1.025 4.177 1.00 0.00 H new ATOM 0 HA THR A 21 -8.083 -2.629 5.966 1.00 0.00 H new ATOM 0 HB THR A 21 -6.280 -1.280 6.841 1.00 0.00 H new ATOM 0 HG1 THR A 21 -7.495 0.073 8.282 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.241 1.178 6.535 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.162 0.335 4.969 1.00 0.00 H new ATOM 0 HG23 THR A 21 -7.690 1.072 5.506 1.00 0.00 H new ATOM 358 N ARG A 22 -10.265 -1.810 4.847 1.00 0.00 N ATOM 359 CA ARG A 22 -11.607 -1.260 4.516 1.00 0.00 C ATOM 360 C ARG A 22 -12.426 -1.079 5.795 1.00 0.00 C ATOM 361 O ARG A 22 -13.208 -1.931 6.166 1.00 0.00 O ATOM 362 CB ARG A 22 -12.310 -2.227 3.560 1.00 0.00 C ATOM 363 CG ARG A 22 -13.730 -1.733 3.277 1.00 0.00 C ATOM 364 CD ARG A 22 -13.666 -0.416 2.505 1.00 0.00 C ATOM 365 NE ARG A 22 -14.888 0.388 2.789 1.00 0.00 N ATOM 366 CZ ARG A 22 -14.914 1.659 2.494 1.00 0.00 C ATOM 367 NH1 ARG A 22 -13.903 2.422 2.809 1.00 0.00 N ATOM 368 NH2 ARG A 22 -15.949 2.166 1.884 1.00 0.00 N ATOM 0 H ARG A 22 -10.171 -2.820 4.739 1.00 0.00 H new ATOM 0 HA ARG A 22 -11.505 -0.286 4.037 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -11.749 -2.304 2.628 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.342 -3.225 3.996 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -14.278 -2.479 2.701 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -14.271 -1.593 4.213 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -12.775 0.143 2.792 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -13.588 -0.613 1.436 1.00 0.00 H new ATOM 0 HE ARG A 22 -15.703 -0.054 3.213 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -13.093 2.025 3.285 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -13.923 3.415 2.579 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -16.739 1.569 1.637 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -15.969 3.159 1.654 1.00 0.00 H new ATOM 382 N ARG A 23 -12.236 0.037 6.467 1.00 0.00 N ATOM 383 CA ARG A 23 -12.974 0.324 7.739 1.00 0.00 C ATOM 384 C ARG A 23 -13.295 -0.978 8.473 1.00 0.00 C ATOM 385 O ARG A 23 -14.442 -1.344 8.640 1.00 0.00 O ATOM 386 CB ARG A 23 -14.274 1.090 7.447 1.00 0.00 C ATOM 387 CG ARG A 23 -14.900 0.605 6.137 1.00 0.00 C ATOM 388 CD ARG A 23 -16.423 0.766 6.212 1.00 0.00 C ATOM 389 NE ARG A 23 -17.073 -0.523 5.835 1.00 0.00 N ATOM 390 CZ ARG A 23 -18.327 -0.736 6.124 1.00 0.00 C ATOM 391 NH1 ARG A 23 -19.104 0.262 6.448 1.00 0.00 N ATOM 392 NH2 ARG A 23 -18.806 -1.950 6.089 1.00 0.00 N ATOM 0 H ARG A 23 -11.589 0.772 6.180 1.00 0.00 H new ATOM 0 HA ARG A 23 -12.336 0.941 8.372 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -14.978 0.949 8.267 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -14.067 2.158 7.384 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -14.503 1.176 5.298 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -14.642 -0.439 5.962 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -16.721 1.056 7.220 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -16.750 1.561 5.542 1.00 0.00 H new ATOM 0 HE ARG A 23 -16.535 -1.240 5.349 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -18.731 1.211 6.476 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -20.084 0.093 6.674 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -18.200 -2.730 5.836 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -19.786 -2.118 6.315 1.00 0.00 H new ATOM 406 N ALA A 24 -12.286 -1.681 8.914 1.00 0.00 N ATOM 407 CA ALA A 24 -12.528 -2.961 9.636 1.00 0.00 C ATOM 408 C ALA A 24 -13.638 -2.755 10.669 1.00 0.00 C ATOM 409 O ALA A 24 -14.625 -3.463 10.685 1.00 0.00 O ATOM 410 CB ALA A 24 -11.248 -3.400 10.347 1.00 0.00 C ATOM 0 H ALA A 24 -11.305 -1.423 8.805 1.00 0.00 H new ATOM 0 HA ALA A 24 -12.826 -3.730 8.923 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -11.428 -4.337 10.875 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -10.455 -3.543 9.613 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -10.947 -2.633 11.061 1.00 0.00 H new ATOM 416 N ALA A 25 -13.485 -1.785 11.531 1.00 0.00 N ATOM 417 CA ALA A 25 -14.530 -1.526 12.559 1.00 0.00 C ATOM 418 C ALA A 25 -15.724 -0.852 11.890 1.00 0.00 C ATOM 419 O ALA A 25 -15.741 -0.650 10.692 1.00 0.00 O ATOM 420 CB ALA A 25 -13.964 -0.607 13.646 1.00 0.00 C ATOM 0 H ALA A 25 -12.679 -1.161 11.566 1.00 0.00 H new ATOM 0 HA ALA A 25 -14.843 -2.466 13.013 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -14.730 -0.418 14.398 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -13.105 -1.085 14.116 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -13.654 0.337 13.199 1.00 0.00 H new ATOM 426 N ASP A 26 -16.725 -0.497 12.645 1.00 0.00 N ATOM 427 CA ASP A 26 -17.906 0.165 12.029 1.00 0.00 C ATOM 428 C ASP A 26 -17.562 1.620 11.711 1.00 0.00 C ATOM 429 O ASP A 26 -17.803 2.513 12.499 1.00 0.00 O ATOM 430 CB ASP A 26 -19.089 0.115 12.997 1.00 0.00 C ATOM 431 CG ASP A 26 -20.393 0.054 12.199 1.00 0.00 C ATOM 432 OD1 ASP A 26 -20.375 -0.509 11.118 1.00 0.00 O ATOM 433 OD2 ASP A 26 -21.387 0.571 12.684 1.00 0.00 O ATOM 0 H ASP A 26 -16.776 -0.635 13.654 1.00 0.00 H new ATOM 0 HA ASP A 26 -18.175 -0.355 11.109 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -19.006 -0.756 13.647 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -19.084 0.994 13.641 1.00 0.00 H new ATOM 438 N ALA A 27 -16.994 1.864 10.563 1.00 0.00 N ATOM 439 CA ALA A 27 -16.630 3.261 10.196 1.00 0.00 C ATOM 440 C ALA A 27 -17.895 4.084 9.977 1.00 0.00 C ATOM 441 O ALA A 27 -17.890 5.288 10.127 1.00 0.00 O ATOM 442 CB ALA A 27 -15.818 3.264 8.895 1.00 0.00 C ATOM 0 H ALA A 27 -16.766 1.157 9.864 1.00 0.00 H new ATOM 0 HA ALA A 27 -16.039 3.691 11.005 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -15.555 4.289 8.632 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -14.908 2.680 9.033 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -16.413 2.825 8.094 1.00 0.00 H new ATOM 448 N HIS A 28 -18.974 3.458 9.579 1.00 0.00 N ATOM 449 CA HIS A 28 -20.207 4.245 9.308 1.00 0.00 C ATOM 450 C HIS A 28 -19.800 5.413 8.414 1.00 0.00 C ATOM 451 O HIS A 28 -20.427 6.452 8.385 1.00 0.00 O ATOM 452 CB HIS A 28 -20.793 4.774 10.621 1.00 0.00 C ATOM 453 CG HIS A 28 -21.923 5.722 10.323 1.00 0.00 C ATOM 454 ND1 HIS A 28 -23.103 5.303 9.729 1.00 0.00 N ATOM 455 CD2 HIS A 28 -22.066 7.073 10.527 1.00 0.00 C ATOM 456 CE1 HIS A 28 -23.896 6.382 9.598 1.00 0.00 C ATOM 457 NE2 HIS A 28 -23.312 7.487 10.068 1.00 0.00 N ATOM 0 H HIS A 28 -19.051 2.452 9.433 1.00 0.00 H new ATOM 0 HA HIS A 28 -20.965 3.627 8.826 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -21.152 3.945 11.231 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -20.020 5.283 11.197 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -21.323 7.716 10.976 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -24.885 6.357 9.165 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -23.697 8.431 10.086 1.00 0.00 H new ATOM 465 N MET A 29 -18.724 5.235 7.694 1.00 0.00 N ATOM 466 CA MET A 29 -18.212 6.304 6.806 1.00 0.00 C ATOM 467 C MET A 29 -17.460 5.660 5.651 1.00 0.00 C ATOM 468 O MET A 29 -17.534 4.466 5.433 1.00 0.00 O ATOM 469 CB MET A 29 -17.233 7.180 7.593 1.00 0.00 C ATOM 470 CG MET A 29 -18.006 8.193 8.440 1.00 0.00 C ATOM 471 SD MET A 29 -17.638 9.872 7.877 1.00 0.00 S ATOM 472 CE MET A 29 -18.659 10.739 9.096 1.00 0.00 C ATOM 0 H MET A 29 -18.173 4.377 7.688 1.00 0.00 H new ATOM 0 HA MET A 29 -19.040 6.907 6.434 1.00 0.00 H new ATOM 0 HB2 MET A 29 -16.609 6.557 8.234 1.00 0.00 H new ATOM 0 HB3 MET A 29 -16.565 7.701 6.907 1.00 0.00 H new ATOM 0 HG2 MET A 29 -19.076 8.001 8.365 1.00 0.00 H new ATOM 0 HG3 MET A 29 -17.735 8.084 9.490 1.00 0.00 H new ATOM 0 HE1 MET A 29 -18.583 11.814 8.935 1.00 0.00 H new ATOM 0 HE2 MET A 29 -19.698 10.428 8.988 1.00 0.00 H new ATOM 0 HE3 MET A 29 -18.311 10.497 10.100 1.00 0.00 H new ATOM 482 N ALA A 30 -16.720 6.435 4.921 1.00 0.00 N ATOM 483 CA ALA A 30 -15.945 5.869 3.797 1.00 0.00 C ATOM 484 C ALA A 30 -14.552 6.494 3.799 1.00 0.00 C ATOM 485 O ALA A 30 -14.050 6.887 4.829 1.00 0.00 O ATOM 486 CB ALA A 30 -16.657 6.171 2.488 1.00 0.00 C ATOM 0 H ALA A 30 -16.619 7.441 5.056 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.857 4.788 3.905 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -16.086 5.754 1.659 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -17.652 5.726 2.504 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -16.744 7.250 2.362 1.00 0.00 H new ATOM 492 N ASN A 31 -13.914 6.569 2.665 1.00 0.00 N ATOM 493 CA ASN A 31 -12.539 7.152 2.615 1.00 0.00 C ATOM 494 C ASN A 31 -11.578 6.274 3.438 1.00 0.00 C ATOM 495 O ASN A 31 -10.413 6.581 3.587 1.00 0.00 O ATOM 496 CB ASN A 31 -12.566 8.601 3.148 1.00 0.00 C ATOM 497 CG ASN A 31 -12.176 8.667 4.633 1.00 0.00 C ATOM 498 OD1 ASN A 31 -13.024 8.806 5.491 1.00 0.00 O ATOM 499 ND2 ASN A 31 -10.917 8.600 4.971 1.00 0.00 N ATOM 0 H ASN A 31 -14.283 6.252 1.768 1.00 0.00 H new ATOM 0 HA ASN A 31 -12.185 7.177 1.584 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -11.882 9.216 2.564 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -13.564 9.019 3.015 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -10.648 8.664 5.953 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -10.202 8.483 4.253 1.00 0.00 H new ATOM 506 N LYS A 32 -12.066 5.185 3.975 1.00 0.00 N ATOM 507 CA LYS A 32 -11.210 4.281 4.789 1.00 0.00 C ATOM 508 C LYS A 32 -10.431 3.321 3.878 1.00 0.00 C ATOM 509 O LYS A 32 -10.430 2.124 4.089 1.00 0.00 O ATOM 510 CB LYS A 32 -12.118 3.485 5.730 1.00 0.00 C ATOM 511 CG LYS A 32 -11.565 3.524 7.158 1.00 0.00 C ATOM 512 CD LYS A 32 -10.048 3.325 7.140 1.00 0.00 C ATOM 513 CE LYS A 32 -9.629 2.492 8.352 1.00 0.00 C ATOM 514 NZ LYS A 32 -9.263 3.398 9.478 1.00 0.00 N ATOM 0 H LYS A 32 -13.036 4.883 3.880 1.00 0.00 H new ATOM 0 HA LYS A 32 -10.490 4.866 5.361 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -13.126 3.899 5.711 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.192 2.452 5.389 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -11.809 4.478 7.625 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -12.035 2.746 7.760 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.747 2.825 6.220 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -9.543 4.291 7.157 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -10.443 1.833 8.652 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -8.783 1.856 8.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -8.978 2.831 10.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -8.473 4.009 9.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -10.082 3.987 9.730 1.00 0.00 H new ATOM 528 N LEU A 33 -9.766 3.827 2.875 1.00 0.00 N ATOM 529 CA LEU A 33 -8.990 2.931 1.963 1.00 0.00 C ATOM 530 C LEU A 33 -7.566 3.483 1.848 1.00 0.00 C ATOM 531 O LEU A 33 -7.266 4.244 0.961 1.00 0.00 O ATOM 532 CB LEU A 33 -9.676 2.896 0.574 1.00 0.00 C ATOM 533 CG LEU A 33 -10.965 2.069 0.655 1.00 0.00 C ATOM 534 CD1 LEU A 33 -11.417 1.702 -0.758 1.00 0.00 C ATOM 535 CD2 LEU A 33 -10.714 0.781 1.444 1.00 0.00 C ATOM 0 H LEU A 33 -9.725 4.820 2.646 1.00 0.00 H new ATOM 0 HA LEU A 33 -8.955 1.915 2.355 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.903 3.910 0.244 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -9.001 2.464 -0.165 1.00 0.00 H new ATOM 0 HG LEU A 33 -11.734 2.657 1.156 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -12.333 1.114 -0.706 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -11.602 2.612 -1.329 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -10.639 1.118 -1.249 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -11.635 0.201 1.496 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -9.943 0.194 0.946 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -10.385 1.031 2.453 1.00 0.00 H new ATOM 547 N GLU A 34 -6.692 3.125 2.762 1.00 0.00 N ATOM 548 CA GLU A 34 -5.294 3.661 2.711 1.00 0.00 C ATOM 549 C GLU A 34 -4.376 2.724 1.898 1.00 0.00 C ATOM 550 O GLU A 34 -4.637 2.452 0.744 1.00 0.00 O ATOM 551 CB GLU A 34 -4.763 3.841 4.138 1.00 0.00 C ATOM 552 CG GLU A 34 -5.385 5.096 4.752 1.00 0.00 C ATOM 553 CD GLU A 34 -4.510 5.583 5.910 1.00 0.00 C ATOM 554 OE1 GLU A 34 -4.667 5.066 7.003 1.00 0.00 O ATOM 555 OE2 GLU A 34 -3.696 6.462 5.681 1.00 0.00 O ATOM 0 H GLU A 34 -6.886 2.489 3.536 1.00 0.00 H new ATOM 0 HA GLU A 34 -5.303 4.629 2.211 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.007 2.967 4.742 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -3.677 3.928 4.126 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -5.476 5.877 3.997 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -6.392 4.879 5.109 1.00 0.00 H new ATOM 562 N PHE A 35 -3.292 2.245 2.470 1.00 0.00 N ATOM 563 CA PHE A 35 -2.370 1.356 1.693 1.00 0.00 C ATOM 564 C PHE A 35 -1.485 0.552 2.658 1.00 0.00 C ATOM 565 O PHE A 35 -0.796 1.125 3.478 1.00 0.00 O ATOM 566 CB PHE A 35 -1.462 2.205 0.789 1.00 0.00 C ATOM 567 CG PHE A 35 -1.754 3.672 0.999 1.00 0.00 C ATOM 568 CD1 PHE A 35 -1.549 4.253 2.257 1.00 0.00 C ATOM 569 CD2 PHE A 35 -2.248 4.442 -0.055 1.00 0.00 C ATOM 570 CE1 PHE A 35 -1.837 5.607 2.457 1.00 0.00 C ATOM 571 CE2 PHE A 35 -2.541 5.794 0.145 1.00 0.00 C ATOM 572 CZ PHE A 35 -2.335 6.377 1.401 1.00 0.00 C ATOM 0 H PHE A 35 -3.010 2.430 3.432 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.970 0.679 1.085 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.415 1.998 1.013 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -1.623 1.939 -0.256 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -1.169 3.656 3.072 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -2.404 3.993 -1.025 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -1.675 6.057 3.425 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -2.926 6.389 -0.670 1.00 0.00 H new ATOM 0 HZ PHE A 35 -2.561 7.422 1.555 1.00 0.00 H new ATOM 582 N PRO A 36 -1.525 -0.752 2.531 1.00 0.00 N ATOM 583 CA PRO A 36 -0.724 -1.656 3.383 1.00 0.00 C ATOM 584 C PRO A 36 0.748 -1.667 2.927 1.00 0.00 C ATOM 585 O PRO A 36 1.113 -2.395 2.024 1.00 0.00 O ATOM 586 CB PRO A 36 -1.358 -3.032 3.142 1.00 0.00 C ATOM 587 CG PRO A 36 -2.160 -2.933 1.818 1.00 0.00 C ATOM 588 CD PRO A 36 -2.377 -1.441 1.541 1.00 0.00 C ATOM 0 HA PRO A 36 -0.724 -1.358 4.431 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -0.591 -3.804 3.072 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.012 -3.306 3.970 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -1.614 -3.403 1.000 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -3.114 -3.453 1.904 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -2.091 -1.181 0.522 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.425 -1.164 1.658 1.00 0.00 H new ATOM 596 N GLY A 37 1.601 -0.877 3.536 1.00 0.00 N ATOM 597 CA GLY A 37 3.039 -0.872 3.114 1.00 0.00 C ATOM 598 C GLY A 37 3.943 -0.638 4.325 1.00 0.00 C ATOM 599 O GLY A 37 3.800 0.335 5.038 1.00 0.00 O ATOM 0 H GLY A 37 1.367 -0.242 4.299 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.290 -1.821 2.641 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.205 -0.092 2.371 1.00 0.00 H new ATOM 603 N GLY A 38 4.863 -1.534 4.578 1.00 0.00 N ATOM 604 CA GLY A 38 5.758 -1.368 5.759 1.00 0.00 C ATOM 605 C GLY A 38 7.149 -0.894 5.357 1.00 0.00 C ATOM 606 O GLY A 38 8.101 -1.646 5.430 1.00 0.00 O ATOM 0 H GLY A 38 5.031 -2.370 4.019 1.00 0.00 H new ATOM 0 HA2 GLY A 38 5.316 -0.651 6.451 1.00 0.00 H new ATOM 0 HA3 GLY A 38 5.837 -2.316 6.290 1.00 0.00 H new ATOM 610 N LYS A 39 7.259 0.362 5.000 1.00 0.00 N ATOM 611 CA LYS A 39 8.578 0.985 4.648 1.00 0.00 C ATOM 612 C LYS A 39 9.476 0.091 3.785 1.00 0.00 C ATOM 613 O LYS A 39 9.898 -0.972 4.192 1.00 0.00 O ATOM 614 CB LYS A 39 9.313 1.304 5.951 1.00 0.00 C ATOM 615 CG LYS A 39 10.701 1.879 5.648 1.00 0.00 C ATOM 616 CD LYS A 39 10.638 3.403 5.717 1.00 0.00 C ATOM 617 CE LYS A 39 11.919 4.004 5.129 1.00 0.00 C ATOM 618 NZ LYS A 39 12.579 4.862 6.154 1.00 0.00 N ATOM 0 H LYS A 39 6.467 1.001 4.936 1.00 0.00 H new ATOM 0 HA LYS A 39 8.367 1.876 4.057 1.00 0.00 H new ATOM 0 HB2 LYS A 39 8.735 2.018 6.537 1.00 0.00 H new ATOM 0 HB3 LYS A 39 9.409 0.401 6.554 1.00 0.00 H new ATOM 0 HG2 LYS A 39 11.429 1.500 6.365 1.00 0.00 H new ATOM 0 HG3 LYS A 39 11.032 1.561 4.659 1.00 0.00 H new ATOM 0 HD2 LYS A 39 9.770 3.765 5.167 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.516 3.724 6.751 1.00 0.00 H new ATOM 0 HE2 LYS A 39 12.595 3.209 4.814 1.00 0.00 H new ATOM 0 HE3 LYS A 39 11.684 4.593 4.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 13.084 5.640 5.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 11.859 5.254 6.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 13.255 4.292 6.701 1.00 0.00 H new ATOM 632 N ILE A 40 9.841 0.563 2.620 1.00 0.00 N ATOM 633 CA ILE A 40 10.788 -0.215 1.765 1.00 0.00 C ATOM 634 C ILE A 40 12.193 0.079 2.285 1.00 0.00 C ATOM 635 O ILE A 40 12.562 1.221 2.473 1.00 0.00 O ATOM 636 CB ILE A 40 10.669 0.179 0.269 1.00 0.00 C ATOM 637 CG1 ILE A 40 12.069 0.294 -0.383 1.00 0.00 C ATOM 638 CG2 ILE A 40 9.918 1.506 0.116 1.00 0.00 C ATOM 639 CD1 ILE A 40 12.643 1.701 -0.178 1.00 0.00 C ATOM 0 H ILE A 40 9.526 1.449 2.225 1.00 0.00 H new ATOM 0 HA ILE A 40 10.557 -1.279 1.822 1.00 0.00 H new ATOM 0 HB ILE A 40 10.108 -0.606 -0.238 1.00 0.00 H new ATOM 0 HG12 ILE A 40 12.741 -0.446 0.052 1.00 0.00 H new ATOM 0 HG13 ILE A 40 12.000 0.075 -1.448 1.00 0.00 H new ATOM 0 HG21 ILE A 40 9.846 1.764 -0.941 1.00 0.00 H new ATOM 0 HG22 ILE A 40 8.916 1.408 0.535 1.00 0.00 H new ATOM 0 HG23 ILE A 40 10.457 2.292 0.645 1.00 0.00 H new ATOM 0 HD11 ILE A 40 13.627 1.764 -0.643 1.00 0.00 H new ATOM 0 HD12 ILE A 40 11.979 2.435 -0.634 1.00 0.00 H new ATOM 0 HD13 ILE A 40 12.732 1.906 0.889 1.00 0.00 H new ATOM 651 N GLU A 41 12.978 -0.922 2.530 1.00 0.00 N ATOM 652 CA GLU A 41 14.346 -0.643 3.048 1.00 0.00 C ATOM 653 C GLU A 41 15.203 -1.919 3.087 1.00 0.00 C ATOM 654 O GLU A 41 16.415 -1.847 3.119 1.00 0.00 O ATOM 655 CB GLU A 41 14.220 -0.027 4.445 1.00 0.00 C ATOM 656 CG GLU A 41 14.118 -1.130 5.505 1.00 0.00 C ATOM 657 CD GLU A 41 13.271 -0.637 6.679 1.00 0.00 C ATOM 658 OE1 GLU A 41 12.079 -0.462 6.490 1.00 0.00 O ATOM 659 OE2 GLU A 41 13.828 -0.444 7.747 1.00 0.00 O ATOM 0 H GLU A 41 12.743 -1.906 2.399 1.00 0.00 H new ATOM 0 HA GLU A 41 14.849 0.055 2.379 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.084 0.606 4.650 1.00 0.00 H new ATOM 0 HB3 GLU A 41 13.339 0.613 4.490 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.671 -2.025 5.071 1.00 0.00 H new ATOM 0 HG3 GLU A 41 15.113 -1.407 5.853 1.00 0.00 H new ATOM 666 N MET A 42 14.593 -3.080 3.094 1.00 0.00 N ATOM 667 CA MET A 42 15.385 -4.345 3.136 1.00 0.00 C ATOM 668 C MET A 42 16.622 -4.207 2.248 1.00 0.00 C ATOM 669 O MET A 42 17.729 -4.056 2.726 1.00 0.00 O ATOM 670 CB MET A 42 14.524 -5.497 2.616 1.00 0.00 C ATOM 671 CG MET A 42 13.561 -5.957 3.712 1.00 0.00 C ATOM 672 SD MET A 42 14.194 -7.471 4.476 1.00 0.00 S ATOM 673 CE MET A 42 12.672 -7.943 5.334 1.00 0.00 C ATOM 0 H MET A 42 13.581 -3.204 3.072 1.00 0.00 H new ATOM 0 HA MET A 42 15.693 -4.544 4.163 1.00 0.00 H new ATOM 0 HB2 MET A 42 13.964 -5.177 1.737 1.00 0.00 H new ATOM 0 HB3 MET A 42 15.159 -6.327 2.305 1.00 0.00 H new ATOM 0 HG2 MET A 42 13.450 -5.176 4.465 1.00 0.00 H new ATOM 0 HG3 MET A 42 12.572 -6.136 3.290 1.00 0.00 H new ATOM 0 HE1 MET A 42 12.920 -8.378 6.302 1.00 0.00 H new ATOM 0 HE2 MET A 42 12.049 -7.061 5.482 1.00 0.00 H new ATOM 0 HE3 MET A 42 12.129 -8.675 4.736 1.00 0.00 H new ATOM 683 N GLY A 43 16.442 -4.252 0.959 1.00 0.00 N ATOM 684 CA GLY A 43 17.605 -4.117 0.041 1.00 0.00 C ATOM 685 C GLY A 43 17.716 -2.665 -0.425 1.00 0.00 C ATOM 686 O GLY A 43 17.642 -1.739 0.359 1.00 0.00 O ATOM 0 H GLY A 43 15.539 -4.377 0.501 1.00 0.00 H new ATOM 0 HA2 GLY A 43 18.521 -4.419 0.549 1.00 0.00 H new ATOM 0 HA3 GLY A 43 17.484 -4.778 -0.817 1.00 0.00 H new ATOM 690 N GLU A 44 17.886 -2.468 -1.698 1.00 0.00 N ATOM 691 CA GLU A 44 17.997 -1.086 -2.240 1.00 0.00 C ATOM 692 C GLU A 44 17.118 -0.965 -3.487 1.00 0.00 C ATOM 693 O GLU A 44 17.087 0.057 -4.143 1.00 0.00 O ATOM 694 CB GLU A 44 19.454 -0.799 -2.613 1.00 0.00 C ATOM 695 CG GLU A 44 19.912 -1.801 -3.674 1.00 0.00 C ATOM 696 CD GLU A 44 21.255 -1.353 -4.256 1.00 0.00 C ATOM 697 OE1 GLU A 44 21.429 -0.160 -4.444 1.00 0.00 O ATOM 698 OE2 GLU A 44 22.086 -2.210 -4.505 1.00 0.00 O ATOM 0 H GLU A 44 17.954 -3.210 -2.394 1.00 0.00 H new ATOM 0 HA GLU A 44 17.669 -0.369 -1.488 1.00 0.00 H new ATOM 0 HB2 GLU A 44 19.551 0.219 -2.992 1.00 0.00 H new ATOM 0 HB3 GLU A 44 20.089 -0.872 -1.730 1.00 0.00 H new ATOM 0 HG2 GLU A 44 20.008 -2.794 -3.234 1.00 0.00 H new ATOM 0 HG3 GLU A 44 19.167 -1.874 -4.466 1.00 0.00 H new ATOM 705 N THR A 45 16.404 -2.007 -3.819 1.00 0.00 N ATOM 706 CA THR A 45 15.526 -1.970 -5.017 1.00 0.00 C ATOM 707 C THR A 45 14.082 -2.182 -4.569 1.00 0.00 C ATOM 708 O THR A 45 13.837 -2.959 -3.682 1.00 0.00 O ATOM 709 CB THR A 45 15.946 -3.105 -5.957 1.00 0.00 C ATOM 710 OG1 THR A 45 17.352 -3.051 -6.159 1.00 0.00 O ATOM 711 CG2 THR A 45 15.234 -2.965 -7.302 1.00 0.00 C ATOM 0 H THR A 45 16.394 -2.888 -3.305 1.00 0.00 H new ATOM 0 HA THR A 45 15.612 -1.013 -5.532 1.00 0.00 H new ATOM 0 HB THR A 45 15.673 -4.060 -5.508 1.00 0.00 H new ATOM 0 HG1 THR A 45 17.624 -3.777 -6.759 1.00 0.00 H new ATOM 0 HG21 THR A 45 15.540 -3.777 -7.962 1.00 0.00 H new ATOM 0 HG22 THR A 45 14.156 -3.009 -7.149 1.00 0.00 H new ATOM 0 HG23 THR A 45 15.498 -2.010 -7.756 1.00 0.00 H new ATOM 719 N PRO A 46 13.161 -1.497 -5.194 1.00 0.00 N ATOM 720 CA PRO A 46 11.735 -1.638 -4.852 1.00 0.00 C ATOM 721 C PRO A 46 11.339 -3.118 -4.893 1.00 0.00 C ATOM 722 O PRO A 46 10.337 -3.514 -4.334 1.00 0.00 O ATOM 723 CB PRO A 46 10.997 -0.814 -5.917 1.00 0.00 C ATOM 724 CG PRO A 46 12.070 -0.021 -6.710 1.00 0.00 C ATOM 725 CD PRO A 46 13.452 -0.541 -6.274 1.00 0.00 C ATOM 0 HA PRO A 46 11.494 -1.287 -3.849 1.00 0.00 H new ATOM 0 HB2 PRO A 46 10.430 -1.465 -6.582 1.00 0.00 H new ATOM 0 HB3 PRO A 46 10.283 -0.135 -5.451 1.00 0.00 H new ATOM 0 HG2 PRO A 46 11.931 -0.157 -7.783 1.00 0.00 H new ATOM 0 HG3 PRO A 46 11.982 1.047 -6.510 1.00 0.00 H new ATOM 0 HD2 PRO A 46 13.974 -1.023 -7.101 1.00 0.00 H new ATOM 0 HD3 PRO A 46 14.090 0.271 -5.924 1.00 0.00 H new ATOM 733 N GLU A 47 12.132 -3.943 -5.529 1.00 0.00 N ATOM 734 CA GLU A 47 11.813 -5.396 -5.573 1.00 0.00 C ATOM 735 C GLU A 47 12.238 -6.034 -4.252 1.00 0.00 C ATOM 736 O GLU A 47 11.465 -6.127 -3.335 1.00 0.00 O ATOM 737 CB GLU A 47 12.566 -6.070 -6.720 1.00 0.00 C ATOM 738 CG GLU A 47 11.591 -6.397 -7.852 1.00 0.00 C ATOM 739 CD GLU A 47 12.261 -6.121 -9.199 1.00 0.00 C ATOM 740 OE1 GLU A 47 13.097 -6.915 -9.596 1.00 0.00 O ATOM 741 OE2 GLU A 47 11.925 -5.120 -9.810 1.00 0.00 O ATOM 0 H GLU A 47 12.985 -3.670 -6.018 1.00 0.00 H new ATOM 0 HA GLU A 47 10.742 -5.524 -5.730 1.00 0.00 H new ATOM 0 HB2 GLU A 47 13.356 -5.414 -7.085 1.00 0.00 H new ATOM 0 HB3 GLU A 47 13.047 -6.982 -6.366 1.00 0.00 H new ATOM 0 HG2 GLU A 47 11.286 -7.442 -7.793 1.00 0.00 H new ATOM 0 HG3 GLU A 47 10.688 -5.795 -7.753 1.00 0.00 H new ATOM 748 N GLN A 48 13.464 -6.472 -4.141 1.00 0.00 N ATOM 749 CA GLN A 48 13.906 -7.101 -2.858 1.00 0.00 C ATOM 750 C GLN A 48 13.374 -6.285 -1.687 1.00 0.00 C ATOM 751 O GLN A 48 13.048 -6.802 -0.649 1.00 0.00 O ATOM 752 CB GLN A 48 15.430 -7.125 -2.770 1.00 0.00 C ATOM 753 CG GLN A 48 15.988 -8.143 -3.765 1.00 0.00 C ATOM 754 CD GLN A 48 17.294 -7.611 -4.360 1.00 0.00 C ATOM 755 OE1 GLN A 48 17.276 -6.794 -5.258 1.00 0.00 O ATOM 756 NE2 GLN A 48 18.434 -8.041 -3.892 1.00 0.00 N ATOM 0 H GLN A 48 14.173 -6.423 -4.873 1.00 0.00 H new ATOM 0 HA GLN A 48 13.523 -8.121 -2.824 1.00 0.00 H new ATOM 0 HB2 GLN A 48 15.832 -6.135 -2.984 1.00 0.00 H new ATOM 0 HB3 GLN A 48 15.741 -7.383 -1.758 1.00 0.00 H new ATOM 0 HG2 GLN A 48 16.165 -9.096 -3.266 1.00 0.00 H new ATOM 0 HG3 GLN A 48 15.263 -8.328 -4.558 1.00 0.00 H new ATOM 0 HE21 GLN A 48 18.449 -8.727 -3.138 1.00 0.00 H new ATOM 0 HE22 GLN A 48 19.310 -7.691 -4.281 1.00 0.00 H new ATOM 765 N ALA A 49 13.292 -5.010 -1.849 1.00 0.00 N ATOM 766 CA ALA A 49 12.791 -4.160 -0.743 1.00 0.00 C ATOM 767 C ALA A 49 11.337 -4.505 -0.433 1.00 0.00 C ATOM 768 O ALA A 49 11.019 -4.926 0.649 1.00 0.00 O ATOM 769 CB ALA A 49 12.885 -2.693 -1.146 1.00 0.00 C ATOM 0 H ALA A 49 13.550 -4.511 -2.701 1.00 0.00 H new ATOM 0 HA ALA A 49 13.399 -4.339 0.144 1.00 0.00 H new ATOM 0 HB1 ALA A 49 12.517 -2.068 -0.333 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.924 -2.439 -1.357 1.00 0.00 H new ATOM 0 HB3 ALA A 49 12.282 -2.521 -2.037 1.00 0.00 H new ATOM 775 N VAL A 50 10.452 -4.314 -1.369 1.00 0.00 N ATOM 776 CA VAL A 50 9.010 -4.612 -1.110 1.00 0.00 C ATOM 777 C VAL A 50 8.783 -6.123 -0.973 1.00 0.00 C ATOM 778 O VAL A 50 8.150 -6.583 -0.047 1.00 0.00 O ATOM 779 CB VAL A 50 8.180 -4.043 -2.267 1.00 0.00 C ATOM 780 CG1 VAL A 50 8.168 -5.015 -3.450 1.00 0.00 C ATOM 781 CG2 VAL A 50 6.748 -3.801 -1.798 1.00 0.00 C ATOM 0 H VAL A 50 10.661 -3.964 -2.304 1.00 0.00 H new ATOM 0 HA VAL A 50 8.702 -4.149 -0.173 1.00 0.00 H new ATOM 0 HB VAL A 50 8.629 -3.103 -2.588 1.00 0.00 H new ATOM 0 HG11 VAL A 50 7.574 -4.594 -4.261 1.00 0.00 H new ATOM 0 HG12 VAL A 50 9.189 -5.180 -3.795 1.00 0.00 H new ATOM 0 HG13 VAL A 50 7.733 -5.964 -3.137 1.00 0.00 H new ATOM 0 HG21 VAL A 50 6.159 -3.397 -2.621 1.00 0.00 H new ATOM 0 HG22 VAL A 50 6.310 -4.742 -1.466 1.00 0.00 H new ATOM 0 HG23 VAL A 50 6.751 -3.091 -0.971 1.00 0.00 H new ATOM 791 N VAL A 51 9.288 -6.883 -1.893 1.00 0.00 N ATOM 792 CA VAL A 51 9.119 -8.363 -1.858 1.00 0.00 C ATOM 793 C VAL A 51 9.626 -8.925 -0.521 1.00 0.00 C ATOM 794 O VAL A 51 8.991 -9.756 0.095 1.00 0.00 O ATOM 795 CB VAL A 51 9.922 -8.962 -3.014 1.00 0.00 C ATOM 796 CG1 VAL A 51 11.399 -8.993 -2.647 1.00 0.00 C ATOM 797 CG2 VAL A 51 9.448 -10.382 -3.299 1.00 0.00 C ATOM 0 H VAL A 51 9.824 -6.537 -2.689 1.00 0.00 H new ATOM 0 HA VAL A 51 8.064 -8.620 -1.957 1.00 0.00 H new ATOM 0 HB VAL A 51 9.775 -8.347 -3.902 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.970 -9.420 -3.472 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.747 -7.979 -2.452 1.00 0.00 H new ATOM 0 HG13 VAL A 51 11.539 -9.603 -1.754 1.00 0.00 H new ATOM 0 HG21 VAL A 51 10.026 -10.800 -4.124 1.00 0.00 H new ATOM 0 HG22 VAL A 51 9.587 -10.997 -2.410 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.392 -10.366 -3.568 1.00 0.00 H new ATOM 807 N ARG A 52 10.763 -8.473 -0.065 1.00 0.00 N ATOM 808 CA ARG A 52 11.298 -8.970 1.232 1.00 0.00 C ATOM 809 C ARG A 52 10.438 -8.368 2.339 1.00 0.00 C ATOM 810 O ARG A 52 10.114 -9.011 3.316 1.00 0.00 O ATOM 811 CB ARG A 52 12.760 -8.538 1.385 1.00 0.00 C ATOM 812 CG ARG A 52 13.617 -9.265 0.345 1.00 0.00 C ATOM 813 CD ARG A 52 14.830 -9.889 1.035 1.00 0.00 C ATOM 814 NE ARG A 52 15.036 -11.272 0.524 1.00 0.00 N ATOM 815 CZ ARG A 52 16.174 -11.880 0.725 1.00 0.00 C ATOM 816 NH1 ARG A 52 16.910 -11.563 1.755 1.00 0.00 N ATOM 817 NH2 ARG A 52 16.572 -12.804 -0.104 1.00 0.00 N ATOM 0 H ARG A 52 11.344 -7.780 -0.537 1.00 0.00 H new ATOM 0 HA ARG A 52 11.265 -10.058 1.281 1.00 0.00 H new ATOM 0 HB2 ARG A 52 12.847 -7.459 1.255 1.00 0.00 H new ATOM 0 HB3 ARG A 52 13.115 -8.767 2.390 1.00 0.00 H new ATOM 0 HG2 ARG A 52 13.029 -10.037 -0.151 1.00 0.00 H new ATOM 0 HG3 ARG A 52 13.942 -8.567 -0.427 1.00 0.00 H new ATOM 0 HD2 ARG A 52 15.718 -9.285 0.849 1.00 0.00 H new ATOM 0 HD3 ARG A 52 14.678 -9.908 2.114 1.00 0.00 H new ATOM 0 HE ARG A 52 14.288 -11.745 0.017 1.00 0.00 H new ATOM 0 HH11 ARG A 52 16.596 -10.840 2.403 1.00 0.00 H new ATOM 0 HH12 ARG A 52 17.799 -12.038 1.912 1.00 0.00 H new ATOM 0 HH21 ARG A 52 15.995 -13.051 -0.908 1.00 0.00 H new ATOM 0 HH22 ARG A 52 17.461 -13.280 0.051 1.00 0.00 H new ATOM 831 N GLU A 53 10.024 -7.144 2.154 1.00 0.00 N ATOM 832 CA GLU A 53 9.131 -6.496 3.152 1.00 0.00 C ATOM 833 C GLU A 53 7.777 -7.197 3.083 1.00 0.00 C ATOM 834 O GLU A 53 6.937 -7.052 3.945 1.00 0.00 O ATOM 835 CB GLU A 53 8.945 -5.018 2.804 1.00 0.00 C ATOM 836 CG GLU A 53 10.278 -4.285 2.950 1.00 0.00 C ATOM 837 CD GLU A 53 10.297 -3.501 4.264 1.00 0.00 C ATOM 838 OE1 GLU A 53 9.323 -3.580 4.992 1.00 0.00 O ATOM 839 OE2 GLU A 53 11.289 -2.837 4.519 1.00 0.00 O ATOM 0 H GLU A 53 10.268 -6.564 1.351 1.00 0.00 H new ATOM 0 HA GLU A 53 9.563 -6.571 4.150 1.00 0.00 H new ATOM 0 HB2 GLU A 53 8.573 -4.918 1.784 1.00 0.00 H new ATOM 0 HB3 GLU A 53 8.199 -4.571 3.460 1.00 0.00 H new ATOM 0 HG2 GLU A 53 11.101 -5.000 2.930 1.00 0.00 H new ATOM 0 HG3 GLU A 53 10.425 -3.607 2.109 1.00 0.00 H new ATOM 846 N LEU A 54 7.575 -7.967 2.047 1.00 0.00 N ATOM 847 CA LEU A 54 6.294 -8.695 1.865 1.00 0.00 C ATOM 848 C LEU A 54 6.311 -9.954 2.733 1.00 0.00 C ATOM 849 O LEU A 54 5.500 -10.125 3.622 1.00 0.00 O ATOM 850 CB LEU A 54 6.167 -9.083 0.385 1.00 0.00 C ATOM 851 CG LEU A 54 5.093 -8.229 -0.292 1.00 0.00 C ATOM 852 CD1 LEU A 54 3.778 -8.343 0.478 1.00 0.00 C ATOM 853 CD2 LEU A 54 5.547 -6.769 -0.303 1.00 0.00 C ATOM 0 H LEU A 54 8.260 -8.122 1.307 1.00 0.00 H new ATOM 0 HA LEU A 54 5.450 -8.070 2.157 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.124 -8.945 -0.119 1.00 0.00 H new ATOM 0 HB3 LEU A 54 5.911 -10.139 0.298 1.00 0.00 H new ATOM 0 HG LEU A 54 4.943 -8.579 -1.313 1.00 0.00 H new ATOM 0 HD11 LEU A 54 3.017 -7.733 -0.009 1.00 0.00 H new ATOM 0 HD12 LEU A 54 3.454 -9.384 0.493 1.00 0.00 H new ATOM 0 HD13 LEU A 54 3.924 -7.994 1.500 1.00 0.00 H new ATOM 0 HD21 LEU A 54 4.786 -6.155 -0.784 1.00 0.00 H new ATOM 0 HD22 LEU A 54 5.696 -6.426 0.721 1.00 0.00 H new ATOM 0 HD23 LEU A 54 6.484 -6.683 -0.854 1.00 0.00 H new ATOM 865 N GLN A 55 7.236 -10.830 2.473 1.00 0.00 N ATOM 866 CA GLN A 55 7.328 -12.092 3.272 1.00 0.00 C ATOM 867 C GLN A 55 7.509 -11.758 4.753 1.00 0.00 C ATOM 868 O GLN A 55 6.815 -12.280 5.604 1.00 0.00 O ATOM 869 CB GLN A 55 8.526 -12.946 2.815 1.00 0.00 C ATOM 870 CG GLN A 55 9.492 -12.119 1.960 1.00 0.00 C ATOM 871 CD GLN A 55 10.878 -12.765 1.982 1.00 0.00 C ATOM 872 OE1 GLN A 55 11.513 -12.834 3.015 1.00 0.00 O ATOM 873 NE2 GLN A 55 11.376 -13.246 0.876 1.00 0.00 N ATOM 0 H GLN A 55 7.938 -10.731 1.740 1.00 0.00 H new ATOM 0 HA GLN A 55 6.406 -12.653 3.119 1.00 0.00 H new ATOM 0 HB2 GLN A 55 9.050 -13.340 3.686 1.00 0.00 H new ATOM 0 HB3 GLN A 55 8.170 -13.803 2.243 1.00 0.00 H new ATOM 0 HG2 GLN A 55 9.125 -12.057 0.936 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.549 -11.099 2.341 1.00 0.00 H new ATOM 0 HE21 GLN A 55 10.842 -13.188 0.009 1.00 0.00 H new ATOM 0 HE22 GLN A 55 12.299 -13.680 0.879 1.00 0.00 H new ATOM 882 N GLU A 56 8.446 -10.908 5.076 1.00 0.00 N ATOM 883 CA GLU A 56 8.673 -10.570 6.511 1.00 0.00 C ATOM 884 C GLU A 56 7.348 -10.211 7.180 1.00 0.00 C ATOM 885 O GLU A 56 7.218 -10.274 8.386 1.00 0.00 O ATOM 886 CB GLU A 56 9.637 -9.387 6.627 1.00 0.00 C ATOM 887 CG GLU A 56 9.218 -8.265 5.682 1.00 0.00 C ATOM 888 CD GLU A 56 8.342 -7.249 6.427 1.00 0.00 C ATOM 889 OE1 GLU A 56 7.618 -7.663 7.319 1.00 0.00 O ATOM 890 OE2 GLU A 56 8.411 -6.073 6.095 1.00 0.00 O ATOM 0 H GLU A 56 9.061 -10.435 4.413 1.00 0.00 H new ATOM 0 HA GLU A 56 9.106 -11.438 7.009 1.00 0.00 H new ATOM 0 HB2 GLU A 56 9.651 -9.020 7.653 1.00 0.00 H new ATOM 0 HB3 GLU A 56 10.650 -9.711 6.390 1.00 0.00 H new ATOM 0 HG2 GLU A 56 10.101 -7.769 5.279 1.00 0.00 H new ATOM 0 HG3 GLU A 56 8.670 -8.678 4.835 1.00 0.00 H new ATOM 897 N GLU A 57 6.363 -9.828 6.420 1.00 0.00 N ATOM 898 CA GLU A 57 5.061 -9.467 7.035 1.00 0.00 C ATOM 899 C GLU A 57 4.274 -10.738 7.354 1.00 0.00 C ATOM 900 O GLU A 57 4.451 -11.347 8.391 1.00 0.00 O ATOM 901 CB GLU A 57 4.268 -8.581 6.069 1.00 0.00 C ATOM 902 CG GLU A 57 4.528 -7.115 6.413 1.00 0.00 C ATOM 903 CD GLU A 57 4.813 -6.321 5.135 1.00 0.00 C ATOM 904 OE1 GLU A 57 4.138 -6.563 4.148 1.00 0.00 O ATOM 905 OE2 GLU A 57 5.706 -5.482 5.164 1.00 0.00 O ATOM 0 H GLU A 57 6.404 -9.750 5.404 1.00 0.00 H new ATOM 0 HA GLU A 57 5.233 -8.918 7.961 1.00 0.00 H new ATOM 0 HB2 GLU A 57 4.565 -8.785 5.040 1.00 0.00 H new ATOM 0 HB3 GLU A 57 3.203 -8.802 6.143 1.00 0.00 H new ATOM 0 HG2 GLU A 57 3.664 -6.695 6.927 1.00 0.00 H new ATOM 0 HG3 GLU A 57 5.374 -7.037 7.096 1.00 0.00 H new ATOM 912 N VAL A 58 3.403 -11.137 6.476 1.00 0.00 N ATOM 913 CA VAL A 58 2.593 -12.356 6.716 1.00 0.00 C ATOM 914 C VAL A 58 3.413 -13.609 6.388 1.00 0.00 C ATOM 915 O VAL A 58 3.933 -14.257 7.274 1.00 0.00 O ATOM 916 CB VAL A 58 1.356 -12.267 5.839 1.00 0.00 C ATOM 917 CG1 VAL A 58 0.438 -13.453 6.110 1.00 0.00 C ATOM 918 CG2 VAL A 58 0.632 -10.960 6.172 1.00 0.00 C ATOM 0 H VAL A 58 3.216 -10.664 5.592 1.00 0.00 H new ATOM 0 HA VAL A 58 2.300 -12.425 7.764 1.00 0.00 H new ATOM 0 HB VAL A 58 1.638 -12.285 4.786 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.446 -13.381 5.477 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.967 -14.380 5.890 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.136 -13.447 7.157 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -0.262 -10.872 5.554 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.348 -10.959 7.224 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.294 -10.117 5.975 1.00 0.00 H new ATOM 928 N GLY A 59 3.558 -13.954 5.133 1.00 0.00 N ATOM 929 CA GLY A 59 4.377 -15.160 4.813 1.00 0.00 C ATOM 930 C GLY A 59 3.790 -15.978 3.648 1.00 0.00 C ATOM 931 O GLY A 59 3.958 -17.180 3.598 1.00 0.00 O ATOM 0 H GLY A 59 3.155 -13.465 4.334 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.391 -14.850 4.561 1.00 0.00 H new ATOM 0 HA3 GLY A 59 4.448 -15.793 5.698 1.00 0.00 H new ATOM 935 N ILE A 60 3.142 -15.361 2.695 1.00 0.00 N ATOM 936 CA ILE A 60 2.612 -16.162 1.543 1.00 0.00 C ATOM 937 C ILE A 60 3.730 -16.266 0.495 1.00 0.00 C ATOM 938 O ILE A 60 4.895 -16.187 0.828 1.00 0.00 O ATOM 939 CB ILE A 60 1.374 -15.489 0.933 1.00 0.00 C ATOM 940 CG1 ILE A 60 1.699 -14.036 0.606 1.00 0.00 C ATOM 941 CG2 ILE A 60 0.210 -15.541 1.923 1.00 0.00 C ATOM 942 CD1 ILE A 60 1.694 -13.837 -0.910 1.00 0.00 C ATOM 0 H ILE A 60 2.957 -14.358 2.659 1.00 0.00 H new ATOM 0 HA ILE A 60 2.311 -17.152 1.884 1.00 0.00 H new ATOM 0 HB ILE A 60 1.091 -16.017 0.022 1.00 0.00 H new ATOM 0 HG12 ILE A 60 0.968 -13.376 1.072 1.00 0.00 H new ATOM 0 HG13 ILE A 60 2.674 -13.770 1.014 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -0.664 -15.061 1.482 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -0.024 -16.580 2.155 1.00 0.00 H new ATOM 0 HG23 ILE A 60 0.487 -15.019 2.839 1.00 0.00 H new ATOM 0 HD11 ILE A 60 1.927 -12.798 -1.141 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.442 -14.486 -1.365 1.00 0.00 H new ATOM 0 HD13 ILE A 60 0.709 -14.085 -1.306 1.00 0.00 H new ATOM 954 N THR A 61 3.411 -16.438 -0.763 1.00 0.00 N ATOM 955 CA THR A 61 4.504 -16.533 -1.777 1.00 0.00 C ATOM 956 C THR A 61 4.162 -15.692 -3.023 1.00 0.00 C ATOM 957 O THR A 61 4.778 -14.667 -3.240 1.00 0.00 O ATOM 958 CB THR A 61 4.751 -18.008 -2.136 1.00 0.00 C ATOM 959 OG1 THR A 61 5.581 -18.590 -1.140 1.00 0.00 O ATOM 960 CG2 THR A 61 5.453 -18.119 -3.498 1.00 0.00 C ATOM 0 H THR A 61 2.461 -16.515 -1.127 1.00 0.00 H new ATOM 0 HA THR A 61 5.424 -16.127 -1.356 1.00 0.00 H new ATOM 0 HB THR A 61 3.794 -18.527 -2.188 1.00 0.00 H new ATOM 0 HG1 THR A 61 5.613 -18.002 -0.357 1.00 0.00 H new ATOM 0 HG21 THR A 61 5.620 -19.169 -3.737 1.00 0.00 H new ATOM 0 HG22 THR A 61 4.827 -17.667 -4.268 1.00 0.00 H new ATOM 0 HG23 THR A 61 6.410 -17.599 -3.457 1.00 0.00 H new ATOM 968 N PRO A 62 3.201 -16.124 -3.813 1.00 0.00 N ATOM 969 CA PRO A 62 2.811 -15.383 -5.023 1.00 0.00 C ATOM 970 C PRO A 62 2.263 -14.003 -4.659 1.00 0.00 C ATOM 971 O PRO A 62 2.335 -13.573 -3.526 1.00 0.00 O ATOM 972 CB PRO A 62 1.705 -16.227 -5.667 1.00 0.00 C ATOM 973 CG PRO A 62 1.346 -17.350 -4.670 1.00 0.00 C ATOM 974 CD PRO A 62 2.432 -17.358 -3.582 1.00 0.00 C ATOM 0 HA PRO A 62 3.659 -15.225 -5.689 1.00 0.00 H new ATOM 0 HB2 PRO A 62 0.831 -15.613 -5.886 1.00 0.00 H new ATOM 0 HB3 PRO A 62 2.044 -16.647 -6.614 1.00 0.00 H new ATOM 0 HG2 PRO A 62 0.364 -17.175 -4.231 1.00 0.00 H new ATOM 0 HG3 PRO A 62 1.302 -18.314 -5.176 1.00 0.00 H new ATOM 0 HD2 PRO A 62 1.993 -17.370 -2.584 1.00 0.00 H new ATOM 0 HD3 PRO A 62 3.066 -18.241 -3.662 1.00 0.00 H new ATOM 982 N GLN A 63 1.711 -13.335 -5.636 1.00 0.00 N ATOM 983 CA GLN A 63 1.117 -11.976 -5.460 1.00 0.00 C ATOM 984 C GLN A 63 1.427 -11.180 -6.725 1.00 0.00 C ATOM 985 O GLN A 63 0.726 -10.259 -7.081 1.00 0.00 O ATOM 986 CB GLN A 63 1.682 -11.246 -4.229 1.00 0.00 C ATOM 987 CG GLN A 63 3.209 -11.176 -4.299 1.00 0.00 C ATOM 988 CD GLN A 63 3.677 -9.794 -3.828 1.00 0.00 C ATOM 989 OE1 GLN A 63 3.038 -8.732 -4.227 1.00 0.00 O flip ATOM 990 NE2 GLN A 63 4.635 -9.676 -3.095 1.00 0.00 N flip ATOM 0 H GLN A 63 1.645 -13.692 -6.589 1.00 0.00 H new ATOM 0 HA GLN A 63 0.043 -12.071 -5.297 1.00 0.00 H new ATOM 0 HB2 GLN A 63 1.268 -10.239 -4.175 1.00 0.00 H new ATOM 0 HB3 GLN A 63 1.378 -11.765 -3.320 1.00 0.00 H new ATOM 0 HG2 GLN A 63 3.649 -11.954 -3.674 1.00 0.00 H new ATOM 0 HG3 GLN A 63 3.546 -11.358 -5.319 1.00 0.00 H new ATOM 0 HE21 GLN A 63 5.140 -10.504 -2.779 1.00 0.00 H new ATOM 0 HE22 GLN A 63 4.936 -8.749 -2.794 1.00 0.00 H new ATOM 999 N HIS A 64 2.469 -11.551 -7.420 1.00 0.00 N ATOM 1000 CA HIS A 64 2.823 -10.838 -8.678 1.00 0.00 C ATOM 1001 C HIS A 64 2.716 -9.332 -8.452 1.00 0.00 C ATOM 1002 O HIS A 64 1.820 -8.680 -8.951 1.00 0.00 O ATOM 1003 CB HIS A 64 1.853 -11.260 -9.783 1.00 0.00 C ATOM 1004 CG HIS A 64 2.563 -11.369 -11.111 1.00 0.00 C ATOM 1005 ND1 HIS A 64 3.935 -11.193 -11.257 1.00 0.00 N ATOM 1006 CD2 HIS A 64 2.091 -11.648 -12.370 1.00 0.00 C ATOM 1007 CE1 HIS A 64 4.230 -11.370 -12.556 1.00 0.00 C ATOM 1008 NE2 HIS A 64 3.144 -11.649 -13.279 1.00 0.00 N ATOM 0 H HIS A 64 3.091 -12.319 -7.169 1.00 0.00 H new ATOM 0 HA HIS A 64 3.843 -11.089 -8.971 1.00 0.00 H new ATOM 0 HB2 HIS A 64 1.400 -12.218 -9.528 1.00 0.00 H new ATOM 0 HB3 HIS A 64 1.043 -10.535 -9.858 1.00 0.00 H new ATOM 0 HD2 HIS A 64 1.057 -11.838 -12.617 1.00 0.00 H new ATOM 0 HE1 HIS A 64 5.227 -11.295 -12.966 1.00 0.00 H new ATOM 0 HE2 HIS A 64 3.096 -11.825 -14.283 1.00 0.00 H new ATOM 1016 N PHE A 65 3.618 -8.776 -7.697 1.00 0.00 N ATOM 1017 CA PHE A 65 3.563 -7.314 -7.431 1.00 0.00 C ATOM 1018 C PHE A 65 3.843 -6.542 -8.719 1.00 0.00 C ATOM 1019 O PHE A 65 4.671 -6.925 -9.523 1.00 0.00 O ATOM 1020 CB PHE A 65 4.605 -6.951 -6.377 1.00 0.00 C ATOM 1021 CG PHE A 65 5.886 -7.700 -6.650 1.00 0.00 C ATOM 1022 CD1 PHE A 65 6.779 -7.228 -7.621 1.00 0.00 C ATOM 1023 CD2 PHE A 65 6.183 -8.866 -5.934 1.00 0.00 C ATOM 1024 CE1 PHE A 65 7.966 -7.924 -7.875 1.00 0.00 C ATOM 1025 CE2 PHE A 65 7.370 -9.561 -6.189 1.00 0.00 C ATOM 1026 CZ PHE A 65 8.263 -9.091 -7.158 1.00 0.00 C ATOM 0 H PHE A 65 4.391 -9.270 -7.252 1.00 0.00 H new ATOM 0 HA PHE A 65 2.570 -7.050 -7.067 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.791 -5.877 -6.390 1.00 0.00 H new ATOM 0 HB3 PHE A 65 4.232 -7.198 -5.383 1.00 0.00 H new ATOM 0 HD1 PHE A 65 6.551 -6.328 -8.173 1.00 0.00 H new ATOM 0 HD2 PHE A 65 5.495 -9.229 -5.184 1.00 0.00 H new ATOM 0 HE1 PHE A 65 8.654 -7.562 -8.624 1.00 0.00 H new ATOM 0 HE2 PHE A 65 7.597 -10.461 -5.637 1.00 0.00 H new ATOM 0 HZ PHE A 65 9.180 -9.627 -7.353 1.00 0.00 H new ATOM 1036 N SER A 66 3.156 -5.455 -8.914 1.00 0.00 N ATOM 1037 CA SER A 66 3.367 -4.637 -10.139 1.00 0.00 C ATOM 1038 C SER A 66 3.507 -3.173 -9.731 1.00 0.00 C ATOM 1039 O SER A 66 2.765 -2.681 -8.912 1.00 0.00 O ATOM 1040 CB SER A 66 2.162 -4.793 -11.064 1.00 0.00 C ATOM 1041 OG SER A 66 2.504 -5.644 -12.150 1.00 0.00 O ATOM 0 H SER A 66 2.451 -5.094 -8.272 1.00 0.00 H new ATOM 0 HA SER A 66 4.267 -4.967 -10.659 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.319 -5.210 -10.513 1.00 0.00 H new ATOM 0 HB3 SER A 66 1.848 -3.818 -11.437 1.00 0.00 H new ATOM 0 HG SER A 66 1.730 -5.745 -12.743 1.00 0.00 H new ATOM 1047 N LEU A 67 4.452 -2.471 -10.286 1.00 0.00 N ATOM 1048 CA LEU A 67 4.628 -1.039 -9.909 1.00 0.00 C ATOM 1049 C LEU A 67 3.326 -0.280 -10.177 1.00 0.00 C ATOM 1050 O LEU A 67 2.688 0.206 -9.273 1.00 0.00 O ATOM 1051 CB LEU A 67 5.769 -0.433 -10.739 1.00 0.00 C ATOM 1052 CG LEU A 67 6.377 0.783 -10.024 1.00 0.00 C ATOM 1053 CD1 LEU A 67 5.450 1.988 -10.184 1.00 0.00 C ATOM 1054 CD2 LEU A 67 6.564 0.483 -8.534 1.00 0.00 C ATOM 0 H LEU A 67 5.109 -2.823 -10.982 1.00 0.00 H new ATOM 0 HA LEU A 67 4.875 -0.963 -8.850 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.540 -1.184 -10.908 1.00 0.00 H new ATOM 0 HB3 LEU A 67 5.394 -0.135 -11.718 1.00 0.00 H new ATOM 0 HG LEU A 67 7.348 1.003 -10.468 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.883 2.850 -9.676 1.00 0.00 H new ATOM 0 HD12 LEU A 67 5.327 2.215 -11.243 1.00 0.00 H new ATOM 0 HD13 LEU A 67 4.478 1.760 -9.747 1.00 0.00 H new ATOM 0 HD21 LEU A 67 6.996 1.353 -8.039 1.00 0.00 H new ATOM 0 HD22 LEU A 67 5.598 0.252 -8.085 1.00 0.00 H new ATOM 0 HD23 LEU A 67 7.232 -0.370 -8.416 1.00 0.00 H new ATOM 1066 N PHE A 68 2.940 -0.184 -11.419 1.00 0.00 N ATOM 1067 CA PHE A 68 1.686 0.533 -11.800 1.00 0.00 C ATOM 1068 C PHE A 68 1.955 2.048 -11.839 1.00 0.00 C ATOM 1069 O PHE A 68 1.632 2.711 -12.802 1.00 0.00 O ATOM 1070 CB PHE A 68 0.548 0.171 -10.813 1.00 0.00 C ATOM 1071 CG PHE A 68 -0.093 1.412 -10.227 1.00 0.00 C ATOM 1072 CD1 PHE A 68 -1.023 2.135 -10.980 1.00 0.00 C ATOM 1073 CD2 PHE A 68 0.245 1.836 -8.935 1.00 0.00 C ATOM 1074 CE1 PHE A 68 -1.617 3.283 -10.446 1.00 0.00 C ATOM 1075 CE2 PHE A 68 -0.349 2.985 -8.400 1.00 0.00 C ATOM 1076 CZ PHE A 68 -1.281 3.708 -9.155 1.00 0.00 C ATOM 0 H PHE A 68 3.453 -0.582 -12.206 1.00 0.00 H new ATOM 0 HA PHE A 68 1.365 0.222 -12.794 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.208 -0.421 -11.329 1.00 0.00 H new ATOM 0 HB3 PHE A 68 0.945 -0.449 -10.009 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -1.283 1.807 -11.975 1.00 0.00 H new ATOM 0 HD2 PHE A 68 0.963 1.277 -8.353 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.334 3.841 -11.029 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.089 3.314 -7.405 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.741 4.593 -8.741 1.00 0.00 H new ATOM 1086 N GLU A 69 2.546 2.578 -10.797 1.00 0.00 N ATOM 1087 CA GLU A 69 2.858 4.041 -10.729 1.00 0.00 C ATOM 1088 C GLU A 69 2.819 4.468 -9.268 1.00 0.00 C ATOM 1089 O GLU A 69 2.018 3.987 -8.495 1.00 0.00 O ATOM 1090 CB GLU A 69 1.835 4.859 -11.527 1.00 0.00 C ATOM 1091 CG GLU A 69 1.957 6.339 -11.157 1.00 0.00 C ATOM 1092 CD GLU A 69 1.386 7.196 -12.288 1.00 0.00 C ATOM 1093 OE1 GLU A 69 1.008 6.631 -13.301 1.00 0.00 O ATOM 1094 OE2 GLU A 69 1.335 8.404 -12.122 1.00 0.00 O ATOM 0 H GLU A 69 2.831 2.048 -9.974 1.00 0.00 H new ATOM 0 HA GLU A 69 3.843 4.220 -11.160 1.00 0.00 H new ATOM 0 HB2 GLU A 69 2.003 4.726 -12.596 1.00 0.00 H new ATOM 0 HB3 GLU A 69 0.826 4.503 -11.316 1.00 0.00 H new ATOM 0 HG2 GLU A 69 1.421 6.538 -10.229 1.00 0.00 H new ATOM 0 HG3 GLU A 69 3.002 6.596 -10.983 1.00 0.00 H new ATOM 1101 N LYS A 70 3.691 5.350 -8.874 1.00 0.00 N ATOM 1102 CA LYS A 70 3.711 5.777 -7.451 1.00 0.00 C ATOM 1103 C LYS A 70 3.745 7.302 -7.349 1.00 0.00 C ATOM 1104 O LYS A 70 3.793 8.003 -8.340 1.00 0.00 O ATOM 1105 CB LYS A 70 4.961 5.205 -6.795 1.00 0.00 C ATOM 1106 CG LYS A 70 6.185 5.549 -7.644 1.00 0.00 C ATOM 1107 CD LYS A 70 7.424 4.884 -7.040 1.00 0.00 C ATOM 1108 CE LYS A 70 7.935 5.730 -5.873 1.00 0.00 C ATOM 1109 NZ LYS A 70 9.280 6.278 -6.208 1.00 0.00 N ATOM 0 H LYS A 70 4.388 5.792 -9.473 1.00 0.00 H new ATOM 0 HA LYS A 70 2.812 5.414 -6.952 1.00 0.00 H new ATOM 0 HB2 LYS A 70 5.076 5.612 -5.790 1.00 0.00 H new ATOM 0 HB3 LYS A 70 4.869 4.124 -6.692 1.00 0.00 H new ATOM 0 HG2 LYS A 70 6.038 5.208 -8.669 1.00 0.00 H new ATOM 0 HG3 LYS A 70 6.322 6.630 -7.684 1.00 0.00 H new ATOM 0 HD2 LYS A 70 7.180 3.879 -6.696 1.00 0.00 H new ATOM 0 HD3 LYS A 70 8.201 4.782 -7.797 1.00 0.00 H new ATOM 0 HE2 LYS A 70 7.240 6.544 -5.668 1.00 0.00 H new ATOM 0 HE3 LYS A 70 7.992 5.124 -4.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 9.461 7.128 -5.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 10.007 5.563 -6.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 9.312 6.526 -7.217 1.00 0.00 H new ATOM 1123 N LEU A 71 3.726 7.816 -6.149 1.00 0.00 N ATOM 1124 CA LEU A 71 3.764 9.292 -5.971 1.00 0.00 C ATOM 1125 C LEU A 71 4.887 9.670 -5.011 1.00 0.00 C ATOM 1126 O LEU A 71 5.419 8.846 -4.294 1.00 0.00 O ATOM 1127 CB LEU A 71 2.436 9.792 -5.389 1.00 0.00 C ATOM 1128 CG LEU A 71 1.952 8.855 -4.273 1.00 0.00 C ATOM 1129 CD1 LEU A 71 3.034 8.700 -3.192 1.00 0.00 C ATOM 1130 CD2 LEU A 71 0.691 9.445 -3.635 1.00 0.00 C ATOM 0 H LEU A 71 3.686 7.275 -5.285 1.00 0.00 H new ATOM 0 HA LEU A 71 3.934 9.751 -6.945 1.00 0.00 H new ATOM 0 HB2 LEU A 71 2.561 10.801 -4.996 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.685 9.848 -6.177 1.00 0.00 H new ATOM 0 HG LEU A 71 1.738 7.876 -4.703 1.00 0.00 H new ATOM 0 HD11 LEU A 71 2.673 8.033 -2.409 1.00 0.00 H new ATOM 0 HD12 LEU A 71 3.937 8.282 -3.638 1.00 0.00 H new ATOM 0 HD13 LEU A 71 3.260 9.675 -2.761 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.342 8.785 -2.841 1.00 0.00 H new ATOM 0 HD22 LEU A 71 0.919 10.425 -3.217 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -0.087 9.546 -4.392 1.00 0.00 H new ATOM 1142 N GLU A 72 5.217 10.923 -4.971 1.00 0.00 N ATOM 1143 CA GLU A 72 6.269 11.397 -4.040 1.00 0.00 C ATOM 1144 C GLU A 72 5.813 12.745 -3.493 1.00 0.00 C ATOM 1145 O GLU A 72 6.069 13.782 -4.073 1.00 0.00 O ATOM 1146 CB GLU A 72 7.602 11.549 -4.776 1.00 0.00 C ATOM 1147 CG GLU A 72 8.755 11.365 -3.784 1.00 0.00 C ATOM 1148 CD GLU A 72 10.082 11.652 -4.486 1.00 0.00 C ATOM 1149 OE1 GLU A 72 10.314 12.802 -4.822 1.00 0.00 O ATOM 1150 OE2 GLU A 72 10.843 10.717 -4.677 1.00 0.00 O ATOM 0 H GLU A 72 4.798 11.650 -5.551 1.00 0.00 H new ATOM 0 HA GLU A 72 6.417 10.681 -3.231 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.675 10.812 -5.576 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.662 12.532 -5.242 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.628 12.036 -2.934 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.752 10.348 -3.391 1.00 0.00 H new ATOM 1157 N TYR A 73 5.124 12.739 -2.387 1.00 0.00 N ATOM 1158 CA TYR A 73 4.634 14.016 -1.812 1.00 0.00 C ATOM 1159 C TYR A 73 5.794 14.687 -1.093 1.00 0.00 C ATOM 1160 O TYR A 73 6.294 14.195 -0.103 1.00 0.00 O ATOM 1161 CB TYR A 73 3.493 13.731 -0.828 1.00 0.00 C ATOM 1162 CG TYR A 73 2.343 14.669 -1.103 1.00 0.00 C ATOM 1163 CD1 TYR A 73 2.431 16.016 -0.733 1.00 0.00 C ATOM 1164 CD2 TYR A 73 1.184 14.191 -1.728 1.00 0.00 C ATOM 1165 CE1 TYR A 73 1.364 16.884 -0.986 1.00 0.00 C ATOM 1166 CE2 TYR A 73 0.116 15.058 -1.982 1.00 0.00 C ATOM 1167 CZ TYR A 73 0.205 16.404 -1.611 1.00 0.00 C ATOM 1168 OH TYR A 73 -0.849 17.260 -1.863 1.00 0.00 O ATOM 0 H TYR A 73 4.880 11.902 -1.857 1.00 0.00 H new ATOM 0 HA TYR A 73 4.257 14.670 -2.598 1.00 0.00 H new ATOM 0 HB2 TYR A 73 3.164 12.697 -0.927 1.00 0.00 H new ATOM 0 HB3 TYR A 73 3.842 13.858 0.197 1.00 0.00 H new ATOM 0 HD1 TYR A 73 3.324 16.386 -0.251 1.00 0.00 H new ATOM 0 HD2 TYR A 73 1.115 13.152 -2.014 1.00 0.00 H new ATOM 0 HE1 TYR A 73 1.433 17.923 -0.700 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -0.777 14.688 -2.464 1.00 0.00 H new ATOM 0 HH TYR A 73 -1.573 16.767 -2.302 1.00 0.00 H new ATOM 1178 N GLU A 74 6.236 15.803 -1.592 1.00 0.00 N ATOM 1179 CA GLU A 74 7.371 16.492 -0.946 1.00 0.00 C ATOM 1180 C GLU A 74 6.823 17.485 0.067 1.00 0.00 C ATOM 1181 O GLU A 74 5.766 18.056 -0.117 1.00 0.00 O ATOM 1182 CB GLU A 74 8.196 17.233 -2.002 1.00 0.00 C ATOM 1183 CG GLU A 74 9.672 16.853 -1.863 1.00 0.00 C ATOM 1184 CD GLU A 74 10.422 17.243 -3.140 1.00 0.00 C ATOM 1185 OE1 GLU A 74 10.905 18.361 -3.200 1.00 0.00 O ATOM 1186 OE2 GLU A 74 10.497 16.418 -4.035 1.00 0.00 O ATOM 0 H GLU A 74 5.858 16.265 -2.419 1.00 0.00 H new ATOM 0 HA GLU A 74 8.011 15.765 -0.446 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.838 16.981 -3.000 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.075 18.310 -1.883 1.00 0.00 H new ATOM 0 HG2 GLU A 74 10.109 17.359 -1.003 1.00 0.00 H new ATOM 0 HG3 GLU A 74 9.768 15.782 -1.685 1.00 0.00 H new ATOM 1193 N PHE A 75 7.522 17.692 1.139 1.00 0.00 N ATOM 1194 CA PHE A 75 7.028 18.643 2.162 1.00 0.00 C ATOM 1195 C PHE A 75 8.182 19.563 2.577 1.00 0.00 C ATOM 1196 O PHE A 75 9.310 19.345 2.184 1.00 0.00 O ATOM 1197 CB PHE A 75 6.533 17.847 3.376 1.00 0.00 C ATOM 1198 CG PHE A 75 5.019 17.795 3.387 1.00 0.00 C ATOM 1199 CD1 PHE A 75 4.266 18.911 2.995 1.00 0.00 C ATOM 1200 CD2 PHE A 75 4.369 16.624 3.793 1.00 0.00 C ATOM 1201 CE1 PHE A 75 2.868 18.853 3.009 1.00 0.00 C ATOM 1202 CE2 PHE A 75 2.970 16.567 3.807 1.00 0.00 C ATOM 1203 CZ PHE A 75 2.220 17.681 3.415 1.00 0.00 C ATOM 0 H PHE A 75 8.414 17.245 1.352 1.00 0.00 H new ATOM 0 HA PHE A 75 6.210 19.244 1.764 1.00 0.00 H new ATOM 0 HB2 PHE A 75 6.938 16.836 3.347 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.895 18.309 4.295 1.00 0.00 H new ATOM 0 HD1 PHE A 75 4.765 19.816 2.682 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.947 15.763 4.096 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.289 19.713 2.706 1.00 0.00 H new ATOM 0 HE2 PHE A 75 2.470 15.663 4.121 1.00 0.00 H new ATOM 0 HZ PHE A 75 1.141 17.636 3.426 1.00 0.00 H new ATOM 1213 N PRO A 76 7.874 20.556 3.374 1.00 0.00 N ATOM 1214 CA PRO A 76 8.891 21.502 3.865 1.00 0.00 C ATOM 1215 C PRO A 76 10.101 20.731 4.394 1.00 0.00 C ATOM 1216 O PRO A 76 11.237 21.099 4.172 1.00 0.00 O ATOM 1217 CB PRO A 76 8.187 22.265 4.992 1.00 0.00 C ATOM 1218 CG PRO A 76 6.688 21.865 4.964 1.00 0.00 C ATOM 1219 CD PRO A 76 6.508 20.817 3.857 1.00 0.00 C ATOM 0 HA PRO A 76 9.262 22.173 3.091 1.00 0.00 H new ATOM 0 HB2 PRO A 76 8.631 22.019 5.957 1.00 0.00 H new ATOM 0 HB3 PRO A 76 8.299 23.340 4.855 1.00 0.00 H new ATOM 0 HG2 PRO A 76 6.382 21.460 5.928 1.00 0.00 H new ATOM 0 HG3 PRO A 76 6.063 22.737 4.771 1.00 0.00 H new ATOM 0 HD2 PRO A 76 6.042 19.909 4.241 1.00 0.00 H new ATOM 0 HD3 PRO A 76 5.868 21.190 3.057 1.00 0.00 H new ATOM 1227 N ASP A 77 9.857 19.653 5.080 1.00 0.00 N ATOM 1228 CA ASP A 77 10.973 18.832 5.620 1.00 0.00 C ATOM 1229 C ASP A 77 10.490 17.388 5.718 1.00 0.00 C ATOM 1230 O ASP A 77 10.675 16.721 6.717 1.00 0.00 O ATOM 1231 CB ASP A 77 11.371 19.344 7.006 1.00 0.00 C ATOM 1232 CG ASP A 77 12.647 20.178 6.889 1.00 0.00 C ATOM 1233 OD1 ASP A 77 13.257 20.146 5.833 1.00 0.00 O ATOM 1234 OD2 ASP A 77 12.995 20.835 7.857 1.00 0.00 O ATOM 0 H ASP A 77 8.923 19.302 5.292 1.00 0.00 H new ATOM 0 HA ASP A 77 11.843 18.896 4.966 1.00 0.00 H new ATOM 0 HB2 ASP A 77 10.567 19.946 7.429 1.00 0.00 H new ATOM 0 HB3 ASP A 77 11.532 18.506 7.684 1.00 0.00 H new ATOM 1239 N ARG A 78 9.851 16.914 4.687 1.00 0.00 N ATOM 1240 CA ARG A 78 9.325 15.526 4.704 1.00 0.00 C ATOM 1241 C ARG A 78 9.343 14.953 3.283 1.00 0.00 C ATOM 1242 O ARG A 78 8.406 15.123 2.527 1.00 0.00 O ATOM 1243 CB ARG A 78 7.887 15.560 5.225 1.00 0.00 C ATOM 1244 CG ARG A 78 7.856 15.061 6.669 1.00 0.00 C ATOM 1245 CD ARG A 78 7.895 16.262 7.619 1.00 0.00 C ATOM 1246 NE ARG A 78 6.683 16.262 8.491 1.00 0.00 N ATOM 1247 CZ ARG A 78 5.528 15.877 8.017 1.00 0.00 C ATOM 1248 NH1 ARG A 78 4.907 16.610 7.134 1.00 0.00 N ATOM 1249 NH2 ARG A 78 4.997 14.758 8.426 1.00 0.00 N ATOM 0 H ARG A 78 9.670 17.434 3.828 1.00 0.00 H new ATOM 0 HA ARG A 78 9.942 14.899 5.347 1.00 0.00 H new ATOM 0 HB2 ARG A 78 7.493 16.575 5.171 1.00 0.00 H new ATOM 0 HB3 ARG A 78 7.248 14.937 4.600 1.00 0.00 H new ATOM 0 HG2 ARG A 78 6.955 14.473 6.844 1.00 0.00 H new ATOM 0 HG3 ARG A 78 8.706 14.405 6.858 1.00 0.00 H new ATOM 0 HD2 ARG A 78 8.795 16.222 8.233 1.00 0.00 H new ATOM 0 HD3 ARG A 78 7.941 17.188 7.046 1.00 0.00 H new ATOM 0 HE ARG A 78 6.757 16.564 9.462 1.00 0.00 H new ATOM 0 HH11 ARG A 78 5.323 17.484 6.813 1.00 0.00 H new ATOM 0 HH12 ARG A 78 4.005 16.309 6.764 1.00 0.00 H new ATOM 0 HH21 ARG A 78 5.483 14.185 9.115 1.00 0.00 H new ATOM 0 HH22 ARG A 78 4.095 14.456 8.057 1.00 0.00 H new ATOM 1263 N HIS A 79 10.393 14.270 2.914 1.00 0.00 N ATOM 1264 CA HIS A 79 10.455 13.688 1.545 1.00 0.00 C ATOM 1265 C HIS A 79 9.900 12.264 1.591 1.00 0.00 C ATOM 1266 O HIS A 79 10.637 11.301 1.525 1.00 0.00 O ATOM 1267 CB HIS A 79 11.911 13.652 1.071 1.00 0.00 C ATOM 1268 CG HIS A 79 12.284 14.978 0.466 1.00 0.00 C ATOM 1269 ND1 HIS A 79 12.894 15.983 1.202 1.00 0.00 N ATOM 1270 CD2 HIS A 79 12.148 15.477 -0.806 1.00 0.00 C ATOM 1271 CE1 HIS A 79 13.103 17.024 0.376 1.00 0.00 C ATOM 1272 NE2 HIS A 79 12.666 16.769 -0.860 1.00 0.00 N ATOM 0 H HIS A 79 11.208 14.091 3.501 1.00 0.00 H new ATOM 0 HA HIS A 79 9.867 14.295 0.856 1.00 0.00 H new ATOM 0 HB2 HIS A 79 12.570 13.426 1.909 1.00 0.00 H new ATOM 0 HB3 HIS A 79 12.044 12.857 0.337 1.00 0.00 H new ATOM 0 HD2 HIS A 79 11.707 14.948 -1.638 1.00 0.00 H new ATOM 0 HE1 HIS A 79 13.567 17.952 0.676 1.00 0.00 H new ATOM 0 HE2 HIS A 79 12.704 17.388 -1.670 1.00 0.00 H new ATOM 1280 N ILE A 80 8.607 12.115 1.723 1.00 0.00 N ATOM 1281 CA ILE A 80 8.035 10.741 1.794 1.00 0.00 C ATOM 1282 C ILE A 80 7.812 10.181 0.389 1.00 0.00 C ATOM 1283 O ILE A 80 7.613 10.903 -0.567 1.00 0.00 O ATOM 1284 CB ILE A 80 6.694 10.744 2.541 1.00 0.00 C ATOM 1285 CG1 ILE A 80 6.797 11.473 3.892 1.00 0.00 C ATOM 1286 CG2 ILE A 80 6.269 9.304 2.801 1.00 0.00 C ATOM 1287 CD1 ILE A 80 8.192 11.319 4.515 1.00 0.00 C ATOM 0 H ILE A 80 7.931 12.876 1.784 1.00 0.00 H new ATOM 0 HA ILE A 80 8.747 10.116 2.332 1.00 0.00 H new ATOM 0 HB ILE A 80 5.965 11.266 1.921 1.00 0.00 H new ATOM 0 HG12 ILE A 80 6.575 12.531 3.752 1.00 0.00 H new ATOM 0 HG13 ILE A 80 6.047 11.078 4.577 1.00 0.00 H new ATOM 0 HG21 ILE A 80 5.317 9.296 3.332 1.00 0.00 H new ATOM 0 HG22 ILE A 80 6.160 8.780 1.852 1.00 0.00 H new ATOM 0 HG23 ILE A 80 7.026 8.805 3.406 1.00 0.00 H new ATOM 0 HD11 ILE A 80 8.225 11.847 5.468 1.00 0.00 H new ATOM 0 HD12 ILE A 80 8.403 10.262 4.679 1.00 0.00 H new ATOM 0 HD13 ILE A 80 8.940 11.738 3.841 1.00 0.00 H new ATOM 1299 N THR A 81 7.822 8.884 0.282 1.00 0.00 N ATOM 1300 CA THR A 81 7.594 8.209 -1.015 1.00 0.00 C ATOM 1301 C THR A 81 6.650 7.042 -0.751 1.00 0.00 C ATOM 1302 O THR A 81 6.584 6.533 0.350 1.00 0.00 O ATOM 1303 CB THR A 81 8.918 7.674 -1.556 1.00 0.00 C ATOM 1304 OG1 THR A 81 9.945 8.627 -1.319 1.00 0.00 O ATOM 1305 CG2 THR A 81 8.793 7.414 -3.058 1.00 0.00 C ATOM 0 H THR A 81 7.984 8.250 1.064 1.00 0.00 H new ATOM 0 HA THR A 81 7.173 8.901 -1.744 1.00 0.00 H new ATOM 0 HB THR A 81 9.166 6.741 -1.050 1.00 0.00 H new ATOM 0 HG1 THR A 81 10.443 8.785 -2.148 1.00 0.00 H new ATOM 0 HG21 THR A 81 9.739 7.032 -3.441 1.00 0.00 H new ATOM 0 HG22 THR A 81 8.007 6.680 -3.236 1.00 0.00 H new ATOM 0 HG23 THR A 81 8.543 8.344 -3.569 1.00 0.00 H new ATOM 1313 N LEU A 82 5.911 6.612 -1.725 1.00 0.00 N ATOM 1314 CA LEU A 82 4.980 5.482 -1.472 1.00 0.00 C ATOM 1315 C LEU A 82 4.981 4.529 -2.661 1.00 0.00 C ATOM 1316 O LEU A 82 4.055 4.506 -3.440 1.00 0.00 O ATOM 1317 CB LEU A 82 3.570 6.032 -1.265 1.00 0.00 C ATOM 1318 CG LEU A 82 2.877 5.252 -0.149 1.00 0.00 C ATOM 1319 CD1 LEU A 82 2.744 6.144 1.086 1.00 0.00 C ATOM 1320 CD2 LEU A 82 1.486 4.820 -0.617 1.00 0.00 C ATOM 0 H LEU A 82 5.908 6.986 -2.674 1.00 0.00 H new ATOM 0 HA LEU A 82 5.303 4.941 -0.582 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.615 7.091 -1.009 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.998 5.951 -2.189 1.00 0.00 H new ATOM 0 HG LEU A 82 3.467 4.370 0.100 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.250 5.590 1.884 1.00 0.00 H new ATOM 0 HD12 LEU A 82 3.734 6.454 1.419 1.00 0.00 H new ATOM 0 HD13 LEU A 82 2.153 7.025 0.836 1.00 0.00 H new ATOM 0 HD21 LEU A 82 0.991 4.263 0.179 1.00 0.00 H new ATOM 0 HD22 LEU A 82 0.895 5.702 -0.865 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.579 4.186 -1.499 1.00 0.00 H new ATOM 1332 N TRP A 83 6.000 3.732 -2.812 1.00 0.00 N ATOM 1333 CA TRP A 83 6.002 2.785 -3.967 1.00 0.00 C ATOM 1334 C TRP A 83 4.646 2.062 -4.011 1.00 0.00 C ATOM 1335 O TRP A 83 4.226 1.459 -3.045 1.00 0.00 O ATOM 1336 CB TRP A 83 7.130 1.766 -3.800 1.00 0.00 C ATOM 1337 CG TRP A 83 8.446 2.475 -3.827 1.00 0.00 C ATOM 1338 CD1 TRP A 83 9.064 3.002 -2.746 1.00 0.00 C ATOM 1339 CD2 TRP A 83 9.312 2.749 -4.967 1.00 0.00 C ATOM 1340 NE1 TRP A 83 10.258 3.573 -3.148 1.00 0.00 N ATOM 1341 CE2 TRP A 83 10.455 3.447 -4.507 1.00 0.00 C ATOM 1342 CE3 TRP A 83 9.221 2.463 -6.342 1.00 0.00 C ATOM 1343 CZ2 TRP A 83 11.469 3.846 -5.377 1.00 0.00 C ATOM 1344 CZ3 TRP A 83 10.242 2.864 -7.220 1.00 0.00 C ATOM 1345 CH2 TRP A 83 11.363 3.555 -6.738 1.00 0.00 C ATOM 0 H TRP A 83 6.817 3.692 -2.202 1.00 0.00 H new ATOM 0 HA TRP A 83 6.161 3.332 -4.896 1.00 0.00 H new ATOM 0 HB2 TRP A 83 7.013 1.228 -2.859 1.00 0.00 H new ATOM 0 HB3 TRP A 83 7.087 1.025 -4.598 1.00 0.00 H new ATOM 0 HD1 TRP A 83 8.687 2.981 -1.734 1.00 0.00 H new ATOM 0 HE1 TRP A 83 10.914 4.032 -2.516 1.00 0.00 H new ATOM 0 HE3 TRP A 83 8.362 1.932 -6.724 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 12.331 4.377 -5.000 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 10.163 2.639 -8.273 1.00 0.00 H new ATOM 0 HH2 TRP A 83 12.143 3.862 -7.419 1.00 0.00 H new ATOM 1356 N PHE A 84 3.949 2.132 -5.118 1.00 0.00 N ATOM 1357 CA PHE A 84 2.613 1.463 -5.208 1.00 0.00 C ATOM 1358 C PHE A 84 2.726 0.158 -5.987 1.00 0.00 C ATOM 1359 O PHE A 84 2.239 0.054 -7.087 1.00 0.00 O ATOM 1360 CB PHE A 84 1.629 2.366 -5.955 1.00 0.00 C ATOM 1361 CG PHE A 84 1.111 3.436 -5.029 1.00 0.00 C ATOM 1362 CD1 PHE A 84 1.894 4.560 -4.758 1.00 0.00 C ATOM 1363 CD2 PHE A 84 -0.153 3.304 -4.443 1.00 0.00 C ATOM 1364 CE1 PHE A 84 1.418 5.554 -3.898 1.00 0.00 C ATOM 1365 CE2 PHE A 84 -0.633 4.301 -3.584 1.00 0.00 C ATOM 1366 CZ PHE A 84 0.154 5.425 -3.311 1.00 0.00 C ATOM 0 H PHE A 84 4.246 2.622 -5.962 1.00 0.00 H new ATOM 0 HA PHE A 84 2.264 1.268 -4.194 1.00 0.00 H new ATOM 0 HB2 PHE A 84 2.121 2.823 -6.814 1.00 0.00 H new ATOM 0 HB3 PHE A 84 0.799 1.774 -6.341 1.00 0.00 H new ATOM 0 HD1 PHE A 84 2.868 4.661 -5.213 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -0.758 2.434 -4.653 1.00 0.00 H new ATOM 0 HE1 PHE A 84 2.026 6.421 -3.687 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -1.609 4.202 -3.133 1.00 0.00 H new ATOM 0 HZ PHE A 84 -0.214 6.193 -2.647 1.00 0.00 H new ATOM 1376 N TRP A 85 3.325 -0.848 -5.429 1.00 0.00 N ATOM 1377 CA TRP A 85 3.412 -2.132 -6.170 1.00 0.00 C ATOM 1378 C TRP A 85 2.048 -2.829 -6.122 1.00 0.00 C ATOM 1379 O TRP A 85 1.803 -3.658 -5.269 1.00 0.00 O ATOM 1380 CB TRP A 85 4.462 -3.033 -5.515 1.00 0.00 C ATOM 1381 CG TRP A 85 5.828 -2.614 -5.952 1.00 0.00 C ATOM 1382 CD1 TRP A 85 6.682 -1.866 -5.217 1.00 0.00 C ATOM 1383 CD2 TRP A 85 6.514 -2.906 -7.206 1.00 0.00 C ATOM 1384 NE1 TRP A 85 7.847 -1.678 -5.939 1.00 0.00 N ATOM 1385 CE2 TRP A 85 7.793 -2.300 -7.170 1.00 0.00 C ATOM 1386 CE3 TRP A 85 6.156 -3.631 -8.357 1.00 0.00 C ATOM 1387 CZ2 TRP A 85 8.683 -2.408 -8.240 1.00 0.00 C ATOM 1388 CZ3 TRP A 85 7.049 -3.741 -9.434 1.00 0.00 C ATOM 1389 CH2 TRP A 85 8.310 -3.131 -9.375 1.00 0.00 C ATOM 0 H TRP A 85 3.754 -0.841 -4.504 1.00 0.00 H new ATOM 0 HA TRP A 85 3.696 -1.939 -7.205 1.00 0.00 H new ATOM 0 HB2 TRP A 85 4.382 -2.971 -4.430 1.00 0.00 H new ATOM 0 HB3 TRP A 85 4.285 -4.073 -5.789 1.00 0.00 H new ATOM 0 HD1 TRP A 85 6.486 -1.479 -4.228 1.00 0.00 H new ATOM 0 HE1 TRP A 85 8.649 -1.144 -5.602 1.00 0.00 H new ATOM 0 HE3 TRP A 85 5.188 -4.106 -8.412 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 9.653 -1.936 -8.190 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 6.763 -4.299 -10.313 1.00 0.00 H new ATOM 0 HH2 TRP A 85 8.993 -3.220 -10.207 1.00 0.00 H new ATOM 1400 N LEU A 86 1.147 -2.511 -7.019 1.00 0.00 N ATOM 1401 CA LEU A 86 -0.176 -3.195 -6.968 1.00 0.00 C ATOM 1402 C LEU A 86 -0.003 -4.631 -7.437 1.00 0.00 C ATOM 1403 O LEU A 86 0.459 -4.895 -8.529 1.00 0.00 O ATOM 1404 CB LEU A 86 -1.208 -2.501 -7.860 1.00 0.00 C ATOM 1405 CG LEU A 86 -1.856 -1.335 -7.112 1.00 0.00 C ATOM 1406 CD1 LEU A 86 -2.226 -1.763 -5.688 1.00 0.00 C ATOM 1407 CD2 LEU A 86 -0.879 -0.157 -7.064 1.00 0.00 C ATOM 0 H LEU A 86 1.267 -1.826 -7.765 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.539 -3.160 -5.941 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.728 -2.137 -8.769 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.972 -3.215 -8.167 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.764 -1.033 -7.634 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -2.687 -0.925 -5.164 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -2.928 -2.596 -5.729 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -1.327 -2.073 -5.156 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -1.339 0.675 -6.531 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.031 -0.460 -6.547 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.633 0.154 -8.080 1.00 0.00 H new ATOM 1419 N VAL A 87 -0.377 -5.557 -6.613 1.00 0.00 N ATOM 1420 CA VAL A 87 -0.242 -6.990 -6.987 1.00 0.00 C ATOM 1421 C VAL A 87 -1.624 -7.516 -7.388 1.00 0.00 C ATOM 1422 O VAL A 87 -2.605 -6.802 -7.314 1.00 0.00 O ATOM 1423 CB VAL A 87 0.340 -7.787 -5.796 1.00 0.00 C ATOM 1424 CG1 VAL A 87 0.993 -6.830 -4.790 1.00 0.00 C ATOM 1425 CG2 VAL A 87 -0.759 -8.585 -5.078 1.00 0.00 C ATOM 0 H VAL A 87 -0.774 -5.386 -5.689 1.00 0.00 H new ATOM 0 HA VAL A 87 0.441 -7.106 -7.829 1.00 0.00 H new ATOM 0 HB VAL A 87 1.084 -8.479 -6.190 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.400 -7.401 -3.955 1.00 0.00 H new ATOM 0 HG12 VAL A 87 1.797 -6.281 -5.280 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.247 -6.127 -4.419 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.323 -9.136 -4.245 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.519 -7.900 -4.702 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.216 -9.286 -5.777 1.00 0.00 H new ATOM 1435 N GLU A 88 -1.721 -8.746 -7.818 1.00 0.00 N ATOM 1436 CA GLU A 88 -3.061 -9.258 -8.223 1.00 0.00 C ATOM 1437 C GLU A 88 -3.138 -10.794 -8.159 1.00 0.00 C ATOM 1438 O GLU A 88 -4.039 -11.384 -8.722 1.00 0.00 O ATOM 1439 CB GLU A 88 -3.352 -8.799 -9.653 1.00 0.00 C ATOM 1440 CG GLU A 88 -3.314 -7.269 -9.722 1.00 0.00 C ATOM 1441 CD GLU A 88 -3.819 -6.808 -11.089 1.00 0.00 C ATOM 1442 OE1 GLU A 88 -4.964 -7.088 -11.401 1.00 0.00 O ATOM 1443 OE2 GLU A 88 -3.052 -6.181 -11.801 1.00 0.00 O ATOM 0 H GLU A 88 -0.948 -9.406 -7.905 1.00 0.00 H new ATOM 0 HA GLU A 88 -3.799 -8.861 -7.526 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -2.617 -9.222 -10.338 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.329 -9.163 -9.970 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -3.932 -6.843 -8.932 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -2.297 -6.912 -9.559 1.00 0.00 H new ATOM 1450 N ARG A 89 -2.237 -11.462 -7.479 1.00 0.00 N ATOM 1451 CA ARG A 89 -2.350 -12.955 -7.419 1.00 0.00 C ATOM 1452 C ARG A 89 -1.569 -13.530 -6.228 1.00 0.00 C ATOM 1453 O ARG A 89 -0.642 -14.287 -6.380 1.00 0.00 O ATOM 1454 CB ARG A 89 -1.871 -13.577 -8.747 1.00 0.00 C ATOM 1455 CG ARG A 89 -0.344 -13.718 -8.781 1.00 0.00 C ATOM 1456 CD ARG A 89 0.041 -15.192 -8.607 1.00 0.00 C ATOM 1457 NE ARG A 89 0.187 -15.838 -9.941 1.00 0.00 N ATOM 1458 CZ ARG A 89 0.775 -16.997 -10.042 1.00 0.00 C ATOM 1459 NH1 ARG A 89 2.030 -17.124 -9.704 1.00 0.00 N ATOM 1460 NH2 ARG A 89 0.108 -18.032 -10.471 1.00 0.00 N ATOM 0 H ARG A 89 -1.449 -11.054 -6.976 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.399 -13.212 -7.272 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -2.331 -14.556 -8.879 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -2.199 -12.956 -9.581 1.00 0.00 H new ATOM 0 HG2 ARG A 89 0.045 -13.339 -9.726 1.00 0.00 H new ATOM 0 HG3 ARG A 89 0.104 -13.119 -7.989 1.00 0.00 H new ATOM 0 HD2 ARG A 89 0.975 -15.270 -8.051 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -0.721 -15.710 -8.024 1.00 0.00 H new ATOM 0 HE ARG A 89 -0.173 -15.374 -10.775 1.00 0.00 H new ATOM 0 HH11 ARG A 89 2.550 -16.316 -9.361 1.00 0.00 H new ATOM 0 HH12 ARG A 89 2.490 -18.031 -9.783 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -0.874 -17.935 -10.728 1.00 0.00 H new ATOM 0 HH22 ARG A 89 0.569 -18.939 -10.550 1.00 0.00 H new ATOM 1474 N TRP A 90 -1.960 -13.214 -5.027 1.00 0.00 N ATOM 1475 CA TRP A 90 -1.242 -13.798 -3.859 1.00 0.00 C ATOM 1476 C TRP A 90 -1.761 -15.218 -3.635 1.00 0.00 C ATOM 1477 O TRP A 90 -2.760 -15.616 -4.200 1.00 0.00 O ATOM 1478 CB TRP A 90 -1.494 -12.958 -2.601 1.00 0.00 C ATOM 1479 CG TRP A 90 -2.941 -13.017 -2.226 1.00 0.00 C ATOM 1480 CD1 TRP A 90 -3.607 -14.141 -1.872 1.00 0.00 C ATOM 1481 CD2 TRP A 90 -3.908 -11.930 -2.140 1.00 0.00 C ATOM 1482 NE1 TRP A 90 -4.917 -13.816 -1.595 1.00 0.00 N ATOM 1483 CE2 TRP A 90 -5.154 -12.469 -1.740 1.00 0.00 C ATOM 1484 CE3 TRP A 90 -3.832 -10.548 -2.371 1.00 0.00 C ATOM 1485 CZ2 TRP A 90 -6.282 -11.667 -1.574 1.00 0.00 C ATOM 1486 CZ3 TRP A 90 -4.968 -9.739 -2.204 1.00 0.00 C ATOM 1487 CH2 TRP A 90 -6.188 -10.296 -1.806 1.00 0.00 C ATOM 0 H TRP A 90 -2.733 -12.587 -4.803 1.00 0.00 H new ATOM 0 HA TRP A 90 -0.170 -13.809 -4.058 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -0.882 -13.328 -1.779 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -1.198 -11.924 -2.779 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -3.181 -15.132 -1.816 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -5.626 -14.494 -1.316 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -2.896 -10.105 -2.678 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -7.221 -12.104 -1.268 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -4.899 -8.676 -2.385 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -7.055 -9.665 -1.679 1.00 0.00 H new ATOM 1498 N GLU A 91 -1.106 -15.983 -2.808 1.00 0.00 N ATOM 1499 CA GLU A 91 -1.588 -17.370 -2.546 1.00 0.00 C ATOM 1500 C GLU A 91 -2.566 -17.345 -1.369 1.00 0.00 C ATOM 1501 O GLU A 91 -2.172 -17.083 -0.259 1.00 0.00 O ATOM 1502 CB GLU A 91 -0.381 -18.268 -2.209 1.00 0.00 C ATOM 1503 CG GLU A 91 -0.718 -19.261 -1.081 1.00 0.00 C ATOM 1504 CD GLU A 91 0.092 -20.543 -1.269 1.00 0.00 C ATOM 1505 OE1 GLU A 91 -0.203 -21.277 -2.198 1.00 0.00 O ATOM 1506 OE2 GLU A 91 0.993 -20.772 -0.479 1.00 0.00 O ATOM 0 H GLU A 91 -0.262 -15.711 -2.304 1.00 0.00 H new ATOM 0 HA GLU A 91 -2.095 -17.765 -3.427 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -0.074 -18.817 -3.099 1.00 0.00 H new ATOM 0 HB3 GLU A 91 0.464 -17.648 -1.910 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -0.494 -18.816 -0.112 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -1.784 -19.488 -1.089 1.00 0.00 H new ATOM 1513 N GLY A 92 -3.819 -17.648 -1.608 1.00 0.00 N ATOM 1514 CA GLY A 92 -4.834 -17.680 -0.503 1.00 0.00 C ATOM 1515 C GLY A 92 -4.692 -16.468 0.425 1.00 0.00 C ATOM 1516 O GLY A 92 -5.428 -15.513 0.332 1.00 0.00 O ATOM 0 H GLY A 92 -4.188 -17.877 -2.531 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -5.837 -17.698 -0.929 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -4.717 -18.597 0.074 1.00 0.00 H new ATOM 1520 N GLU A 93 -3.771 -16.513 1.339 1.00 0.00 N ATOM 1521 CA GLU A 93 -3.594 -15.377 2.280 1.00 0.00 C ATOM 1522 C GLU A 93 -2.744 -14.279 1.622 1.00 0.00 C ATOM 1523 O GLU A 93 -1.841 -14.568 0.867 1.00 0.00 O ATOM 1524 CB GLU A 93 -2.872 -15.887 3.528 1.00 0.00 C ATOM 1525 CG GLU A 93 -3.286 -17.334 3.811 1.00 0.00 C ATOM 1526 CD GLU A 93 -3.030 -17.659 5.283 1.00 0.00 C ATOM 1527 OE1 GLU A 93 -2.432 -16.834 5.956 1.00 0.00 O ATOM 1528 OE2 GLU A 93 -3.438 -18.725 5.714 1.00 0.00 O ATOM 0 H GLU A 93 -3.128 -17.293 1.477 1.00 0.00 H new ATOM 0 HA GLU A 93 -4.568 -14.965 2.544 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -1.793 -15.829 3.384 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -3.114 -15.256 4.383 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.341 -17.475 3.575 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -2.723 -18.016 3.174 1.00 0.00 H new ATOM 1535 N PRO A 94 -3.050 -13.049 1.945 1.00 0.00 N ATOM 1536 CA PRO A 94 -2.306 -11.886 1.426 1.00 0.00 C ATOM 1537 C PRO A 94 -1.007 -11.741 2.229 1.00 0.00 C ATOM 1538 O PRO A 94 -0.648 -12.622 2.984 1.00 0.00 O ATOM 1539 CB PRO A 94 -3.225 -10.696 1.711 1.00 0.00 C ATOM 1540 CG PRO A 94 -4.294 -11.180 2.722 1.00 0.00 C ATOM 1541 CD PRO A 94 -4.177 -12.708 2.829 1.00 0.00 C ATOM 0 HA PRO A 94 -2.049 -11.969 0.370 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -2.658 -9.860 2.121 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -3.695 -10.343 0.793 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -4.138 -10.715 3.696 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -5.292 -10.895 2.389 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -3.987 -13.022 3.855 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -5.096 -13.201 2.511 1.00 0.00 H new ATOM 1549 N TRP A 95 -0.315 -10.637 2.113 1.00 0.00 N ATOM 1550 CA TRP A 95 0.926 -10.481 2.924 1.00 0.00 C ATOM 1551 C TRP A 95 1.600 -9.129 2.686 1.00 0.00 C ATOM 1552 O TRP A 95 2.808 -9.019 2.737 1.00 0.00 O ATOM 1553 CB TRP A 95 1.916 -11.600 2.604 1.00 0.00 C ATOM 1554 CG TRP A 95 2.513 -11.403 1.245 1.00 0.00 C ATOM 1555 CD1 TRP A 95 1.929 -10.749 0.213 1.00 0.00 C ATOM 1556 CD2 TRP A 95 3.804 -11.865 0.758 1.00 0.00 C ATOM 1557 NE1 TRP A 95 2.784 -10.787 -0.878 1.00 0.00 N ATOM 1558 CE2 TRP A 95 3.952 -11.468 -0.589 1.00 0.00 C ATOM 1559 CE3 TRP A 95 4.848 -12.592 1.355 1.00 0.00 C ATOM 1560 CZ2 TRP A 95 5.102 -11.783 -1.320 1.00 0.00 C ATOM 1561 CZ3 TRP A 95 6.002 -12.908 0.624 1.00 0.00 C ATOM 1562 CH2 TRP A 95 6.129 -12.506 -0.710 1.00 0.00 C ATOM 0 H TRP A 95 -0.550 -9.852 1.505 1.00 0.00 H new ATOM 0 HA TRP A 95 0.631 -10.535 3.972 1.00 0.00 H new ATOM 0 HB2 TRP A 95 2.706 -11.620 3.355 1.00 0.00 H new ATOM 0 HB3 TRP A 95 1.410 -12.564 2.648 1.00 0.00 H new ATOM 0 HD1 TRP A 95 0.958 -10.276 0.236 1.00 0.00 H new ATOM 0 HE1 TRP A 95 2.577 -10.364 -1.783 1.00 0.00 H new ATOM 0 HE3 TRP A 95 4.761 -12.909 2.384 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 5.195 -11.469 -2.349 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 6.798 -13.466 1.094 1.00 0.00 H new ATOM 0 HH2 TRP A 95 7.020 -12.755 -1.267 1.00 0.00 H new ATOM 1573 N GLY A 96 0.845 -8.094 2.463 1.00 0.00 N ATOM 1574 CA GLY A 96 1.472 -6.758 2.258 1.00 0.00 C ATOM 1575 C GLY A 96 0.940 -5.788 3.311 1.00 0.00 C ATOM 1576 O GLY A 96 1.275 -4.620 3.321 1.00 0.00 O ATOM 0 H GLY A 96 -0.174 -8.112 2.413 1.00 0.00 H new ATOM 0 HA2 GLY A 96 2.557 -6.836 2.333 1.00 0.00 H new ATOM 0 HA3 GLY A 96 1.248 -6.387 1.258 1.00 0.00 H new ATOM 1580 N LYS A 97 0.101 -6.263 4.190 1.00 0.00 N ATOM 1581 CA LYS A 97 -0.480 -5.379 5.235 1.00 0.00 C ATOM 1582 C LYS A 97 0.480 -5.173 6.403 1.00 0.00 C ATOM 1583 O LYS A 97 0.957 -6.105 7.018 1.00 0.00 O ATOM 1584 CB LYS A 97 -1.764 -6.008 5.756 1.00 0.00 C ATOM 1585 CG LYS A 97 -1.444 -7.370 6.373 1.00 0.00 C ATOM 1586 CD LYS A 97 -2.061 -7.429 7.764 1.00 0.00 C ATOM 1587 CE LYS A 97 -1.748 -8.778 8.413 1.00 0.00 C ATOM 1588 NZ LYS A 97 -2.942 -9.663 8.323 1.00 0.00 N ATOM 0 H LYS A 97 -0.208 -7.234 4.228 1.00 0.00 H new ATOM 0 HA LYS A 97 -0.676 -4.406 4.784 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -2.225 -5.358 6.500 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -2.482 -6.123 4.944 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -1.840 -8.171 5.749 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -0.365 -7.515 6.431 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -1.670 -6.619 8.380 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -3.140 -7.288 7.700 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -0.898 -9.245 7.915 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -1.466 -8.635 9.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -2.728 -10.580 8.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -3.742 -9.219 8.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -3.191 -9.809 7.324 1.00 0.00 H new ATOM 1602 N GLU A 98 0.731 -3.946 6.738 1.00 0.00 N ATOM 1603 CA GLU A 98 1.610 -3.655 7.893 1.00 0.00 C ATOM 1604 C GLU A 98 0.754 -3.773 9.156 1.00 0.00 C ATOM 1605 O GLU A 98 -0.042 -4.683 9.282 1.00 0.00 O ATOM 1606 CB GLU A 98 2.146 -2.237 7.753 1.00 0.00 C ATOM 1607 CG GLU A 98 2.963 -2.127 6.469 1.00 0.00 C ATOM 1608 CD GLU A 98 3.822 -3.382 6.274 1.00 0.00 C ATOM 1609 OE1 GLU A 98 4.648 -3.657 7.133 1.00 0.00 O ATOM 1610 OE2 GLU A 98 3.639 -4.046 5.268 1.00 0.00 O ATOM 0 H GLU A 98 0.362 -3.126 6.257 1.00 0.00 H new ATOM 0 HA GLU A 98 2.452 -4.346 7.942 1.00 0.00 H new ATOM 0 HB2 GLU A 98 1.321 -1.525 7.734 1.00 0.00 H new ATOM 0 HB3 GLU A 98 2.765 -1.984 8.614 1.00 0.00 H new ATOM 0 HG2 GLU A 98 2.297 -1.998 5.616 1.00 0.00 H new ATOM 0 HG3 GLU A 98 3.601 -1.244 6.511 1.00 0.00 H new ATOM 1617 N GLY A 99 0.864 -2.853 10.074 1.00 0.00 N ATOM 1618 CA GLY A 99 -0.002 -2.934 11.278 1.00 0.00 C ATOM 1619 C GLY A 99 -1.457 -2.900 10.802 1.00 0.00 C ATOM 1620 O GLY A 99 -2.368 -3.307 11.495 1.00 0.00 O ATOM 0 H GLY A 99 1.506 -2.061 10.043 1.00 0.00 H new ATOM 0 HA2 GLY A 99 0.198 -3.850 11.833 1.00 0.00 H new ATOM 0 HA3 GLY A 99 0.200 -2.102 11.952 1.00 0.00 H new ATOM 1624 N GLN A 100 -1.663 -2.419 9.603 1.00 0.00 N ATOM 1625 CA GLN A 100 -3.034 -2.344 9.024 1.00 0.00 C ATOM 1626 C GLN A 100 -3.686 -3.728 9.052 1.00 0.00 C ATOM 1627 O GLN A 100 -3.009 -4.729 8.925 1.00 0.00 O ATOM 1628 CB GLN A 100 -2.921 -1.889 7.565 1.00 0.00 C ATOM 1629 CG GLN A 100 -3.725 -0.609 7.349 1.00 0.00 C ATOM 1630 CD GLN A 100 -2.781 0.518 6.928 1.00 0.00 C ATOM 1631 OE1 GLN A 100 -1.639 0.558 7.343 1.00 0.00 O ATOM 1632 NE2 GLN A 100 -3.211 1.443 6.113 1.00 0.00 N ATOM 0 H GLN A 100 -0.925 -2.070 8.992 1.00 0.00 H new ATOM 0 HA GLN A 100 -3.637 -1.645 9.603 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -1.875 -1.718 7.310 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -3.287 -2.673 6.902 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -4.484 -0.768 6.583 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -4.249 -0.336 8.265 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -4.169 1.410 5.764 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -2.589 2.198 5.825 1.00 0.00 H new ATOM 1641 N PRO A 101 -4.987 -3.745 9.190 1.00 0.00 N ATOM 1642 CA PRO A 101 -5.750 -5.000 9.199 1.00 0.00 C ATOM 1643 C PRO A 101 -5.627 -5.647 7.828 1.00 0.00 C ATOM 1644 O PRO A 101 -5.529 -6.850 7.693 1.00 0.00 O ATOM 1645 CB PRO A 101 -7.204 -4.582 9.449 1.00 0.00 C ATOM 1646 CG PRO A 101 -7.235 -3.035 9.553 1.00 0.00 C ATOM 1647 CD PRO A 101 -5.800 -2.524 9.347 1.00 0.00 C ATOM 0 HA PRO A 101 -5.399 -5.708 9.950 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -7.846 -4.924 8.637 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -7.581 -5.035 10.366 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -7.902 -2.614 8.801 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -7.616 -2.725 10.526 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -5.730 -1.885 8.466 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -5.465 -1.932 10.198 1.00 0.00 H new ATOM 1655 N GLY A 102 -5.632 -4.837 6.807 1.00 0.00 N ATOM 1656 CA GLY A 102 -5.521 -5.365 5.428 1.00 0.00 C ATOM 1657 C GLY A 102 -6.665 -6.343 5.169 1.00 0.00 C ATOM 1658 O GLY A 102 -6.770 -7.371 5.803 1.00 0.00 O ATOM 0 H GLY A 102 -5.709 -3.822 6.874 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -5.557 -4.547 4.709 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -4.562 -5.865 5.294 1.00 0.00 H new ATOM 1662 N GLU A 103 -7.533 -6.028 4.255 1.00 0.00 N ATOM 1663 CA GLU A 103 -8.669 -6.959 3.975 1.00 0.00 C ATOM 1664 C GLU A 103 -9.103 -6.838 2.509 1.00 0.00 C ATOM 1665 O GLU A 103 -9.332 -5.750 2.019 1.00 0.00 O ATOM 1666 CB GLU A 103 -9.846 -6.613 4.895 1.00 0.00 C ATOM 1667 CG GLU A 103 -10.147 -5.112 4.827 1.00 0.00 C ATOM 1668 CD GLU A 103 -11.182 -4.757 5.898 1.00 0.00 C ATOM 1669 OE1 GLU A 103 -11.530 -5.633 6.669 1.00 0.00 O ATOM 1670 OE2 GLU A 103 -11.607 -3.614 5.926 1.00 0.00 O ATOM 0 H GLU A 103 -7.512 -5.178 3.692 1.00 0.00 H new ATOM 0 HA GLU A 103 -8.348 -7.984 4.161 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -10.728 -7.182 4.599 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -9.612 -6.898 5.921 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -9.233 -4.538 4.983 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -10.524 -4.849 3.839 1.00 0.00 H new ATOM 1677 N TRP A 104 -9.229 -7.942 1.799 1.00 0.00 N ATOM 1678 CA TRP A 104 -9.663 -7.840 0.371 1.00 0.00 C ATOM 1679 C TRP A 104 -10.856 -6.896 0.320 1.00 0.00 C ATOM 1680 O TRP A 104 -11.778 -7.005 1.103 1.00 0.00 O ATOM 1681 CB TRP A 104 -10.076 -9.208 -0.200 1.00 0.00 C ATOM 1682 CG TRP A 104 -9.229 -10.298 0.378 1.00 0.00 C ATOM 1683 CD1 TRP A 104 -7.880 -10.272 0.469 1.00 0.00 C ATOM 1684 CD2 TRP A 104 -9.650 -11.582 0.926 1.00 0.00 C ATOM 1685 NE1 TRP A 104 -7.447 -11.454 1.046 1.00 0.00 N ATOM 1686 CE2 TRP A 104 -8.501 -12.293 1.346 1.00 0.00 C ATOM 1687 CE3 TRP A 104 -10.905 -12.189 1.102 1.00 0.00 C ATOM 1688 CZ2 TRP A 104 -8.593 -13.561 1.917 1.00 0.00 C ATOM 1689 CZ3 TRP A 104 -11.002 -13.467 1.677 1.00 0.00 C ATOM 1690 CH2 TRP A 104 -9.848 -14.151 2.085 1.00 0.00 C ATOM 0 H TRP A 104 -9.053 -8.887 2.141 1.00 0.00 H new ATOM 0 HA TRP A 104 -8.831 -7.472 -0.229 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -11.126 -9.399 0.023 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -9.977 -9.200 -1.285 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -7.244 -9.462 0.145 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -6.468 -11.677 1.227 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -11.800 -11.670 0.793 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -7.700 -14.084 2.227 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -11.971 -13.926 1.806 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -9.929 -15.132 2.528 1.00 0.00 H new ATOM 1701 N MET A 105 -10.843 -5.958 -0.573 1.00 0.00 N ATOM 1702 CA MET A 105 -11.972 -5.003 -0.642 1.00 0.00 C ATOM 1703 C MET A 105 -12.611 -5.077 -2.021 1.00 0.00 C ATOM 1704 O MET A 105 -11.958 -4.890 -3.024 1.00 0.00 O ATOM 1705 CB MET A 105 -11.442 -3.587 -0.380 1.00 0.00 C ATOM 1706 CG MET A 105 -12.513 -2.762 0.334 1.00 0.00 C ATOM 1707 SD MET A 105 -13.826 -2.338 -0.837 1.00 0.00 S ATOM 1708 CE MET A 105 -15.142 -3.298 -0.052 1.00 0.00 C ATOM 0 H MET A 105 -10.101 -5.810 -1.258 1.00 0.00 H new ATOM 0 HA MET A 105 -12.722 -5.253 0.109 1.00 0.00 H new ATOM 0 HB2 MET A 105 -10.539 -3.633 0.228 1.00 0.00 H new ATOM 0 HB3 MET A 105 -11.169 -3.110 -1.321 1.00 0.00 H new ATOM 0 HG2 MET A 105 -12.925 -3.327 1.170 1.00 0.00 H new ATOM 0 HG3 MET A 105 -12.073 -1.855 0.748 1.00 0.00 H new ATOM 0 HE1 MET A 105 -15.852 -3.630 -0.810 1.00 0.00 H new ATOM 0 HE2 MET A 105 -14.711 -4.166 0.446 1.00 0.00 H new ATOM 0 HE3 MET A 105 -15.657 -2.677 0.681 1.00 0.00 H new ATOM 1718 N SER A 106 -13.886 -5.347 -2.082 1.00 0.00 N ATOM 1719 CA SER A 106 -14.568 -5.425 -3.402 1.00 0.00 C ATOM 1720 C SER A 106 -14.943 -4.010 -3.850 1.00 0.00 C ATOM 1721 O SER A 106 -16.049 -3.751 -4.282 1.00 0.00 O ATOM 1722 CB SER A 106 -15.830 -6.280 -3.278 1.00 0.00 C ATOM 1723 OG SER A 106 -15.933 -7.130 -4.412 1.00 0.00 O ATOM 0 H SER A 106 -14.484 -5.517 -1.274 1.00 0.00 H new ATOM 0 HA SER A 106 -13.903 -5.879 -4.137 1.00 0.00 H new ATOM 0 HB2 SER A 106 -15.792 -6.875 -2.365 1.00 0.00 H new ATOM 0 HB3 SER A 106 -16.710 -5.641 -3.206 1.00 0.00 H new ATOM 0 HG SER A 106 -16.740 -7.681 -4.336 1.00 0.00 H new ATOM 1729 N LEU A 107 -14.019 -3.095 -3.748 1.00 0.00 N ATOM 1730 CA LEU A 107 -14.281 -1.694 -4.159 1.00 0.00 C ATOM 1731 C LEU A 107 -14.273 -1.646 -5.696 1.00 0.00 C ATOM 1732 O LEU A 107 -14.980 -0.870 -6.308 1.00 0.00 O ATOM 1733 CB LEU A 107 -13.199 -0.815 -3.492 1.00 0.00 C ATOM 1734 CG LEU A 107 -12.574 0.203 -4.443 1.00 0.00 C ATOM 1735 CD1 LEU A 107 -11.711 -0.513 -5.483 1.00 0.00 C ATOM 1736 CD2 LEU A 107 -13.661 1.027 -5.128 1.00 0.00 C ATOM 0 H LEU A 107 -13.079 -3.266 -3.391 1.00 0.00 H new ATOM 0 HA LEU A 107 -15.252 -1.315 -3.839 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -13.640 -0.288 -2.646 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -12.414 -1.458 -3.093 1.00 0.00 H new ATOM 0 HG LEU A 107 -11.941 0.879 -3.868 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -11.269 0.221 -6.157 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -10.918 -1.066 -4.979 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -12.329 -1.205 -6.055 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -13.200 1.748 -5.803 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -14.315 0.366 -5.696 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -14.245 1.556 -4.375 1.00 0.00 H new ATOM 1748 N VAL A 108 -13.522 -2.527 -6.312 1.00 0.00 N ATOM 1749 CA VAL A 108 -13.490 -2.616 -7.809 1.00 0.00 C ATOM 1750 C VAL A 108 -13.116 -1.273 -8.414 1.00 0.00 C ATOM 1751 O VAL A 108 -13.758 -0.273 -8.162 1.00 0.00 O ATOM 1752 CB VAL A 108 -14.867 -3.041 -8.320 1.00 0.00 C ATOM 1753 CG1 VAL A 108 -14.821 -3.194 -9.842 1.00 0.00 C ATOM 1754 CG2 VAL A 108 -15.250 -4.381 -7.688 1.00 0.00 C ATOM 0 H VAL A 108 -12.921 -3.199 -5.835 1.00 0.00 H new ATOM 0 HA VAL A 108 -12.742 -3.352 -8.103 1.00 0.00 H new ATOM 0 HB VAL A 108 -15.605 -2.285 -8.052 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -15.802 -3.497 -10.207 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -14.543 -2.242 -10.295 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -14.085 -3.952 -10.109 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -16.231 -4.687 -8.050 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -14.512 -5.136 -7.959 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -15.280 -4.276 -6.603 1.00 0.00 H new ATOM 1764 N GLY A 109 -12.073 -1.234 -9.209 1.00 0.00 N ATOM 1765 CA GLY A 109 -11.656 0.062 -9.812 1.00 0.00 C ATOM 1766 C GLY A 109 -11.750 1.115 -8.719 1.00 0.00 C ATOM 1767 O GLY A 109 -12.752 1.788 -8.586 1.00 0.00 O ATOM 0 H GLY A 109 -11.500 -2.039 -9.462 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -10.639 -0.003 -10.198 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -12.300 0.321 -10.652 1.00 0.00 H new ATOM 1771 N LEU A 110 -10.745 1.218 -7.896 1.00 0.00 N ATOM 1772 CA LEU A 110 -10.817 2.189 -6.779 1.00 0.00 C ATOM 1773 C LEU A 110 -11.348 3.528 -7.301 1.00 0.00 C ATOM 1774 O LEU A 110 -11.585 3.689 -8.482 1.00 0.00 O ATOM 1775 CB LEU A 110 -9.444 2.356 -6.141 1.00 0.00 C ATOM 1776 CG LEU A 110 -9.580 2.064 -4.648 1.00 0.00 C ATOM 1777 CD1 LEU A 110 -8.277 1.483 -4.107 1.00 0.00 C ATOM 1778 CD2 LEU A 110 -9.929 3.356 -3.909 1.00 0.00 C ATOM 0 H LEU A 110 -9.884 0.674 -7.950 1.00 0.00 H new ATOM 0 HA LEU A 110 -11.500 1.818 -6.015 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -8.726 1.676 -6.599 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -9.071 3.368 -6.299 1.00 0.00 H new ATOM 0 HG LEU A 110 -10.375 1.335 -4.493 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -8.384 1.278 -3.042 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -8.046 0.557 -4.633 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -7.469 2.198 -4.259 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -10.027 3.150 -2.843 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -9.139 4.090 -4.066 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -10.871 3.750 -4.290 1.00 0.00 H new ATOM 1790 N ASN A 111 -11.578 4.488 -6.447 1.00 0.00 N ATOM 1791 CA ASN A 111 -12.153 5.768 -6.961 1.00 0.00 C ATOM 1792 C ASN A 111 -11.605 6.996 -6.235 1.00 0.00 C ATOM 1793 O ASN A 111 -11.935 8.109 -6.589 1.00 0.00 O ATOM 1794 CB ASN A 111 -13.670 5.720 -6.762 1.00 0.00 C ATOM 1795 CG ASN A 111 -14.372 5.989 -8.095 1.00 0.00 C ATOM 1796 OD1 ASN A 111 -13.829 5.717 -9.147 1.00 0.00 O ATOM 1797 ND2 ASN A 111 -15.567 6.516 -8.095 1.00 0.00 N ATOM 0 H ASN A 111 -11.400 4.448 -5.444 1.00 0.00 H new ATOM 0 HA ASN A 111 -11.879 5.861 -8.012 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -13.965 4.745 -6.374 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -13.974 6.462 -6.023 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -16.044 6.699 -8.978 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -16.024 6.745 -7.212 1.00 0.00 H new ATOM 1804 N ALA A 112 -10.816 6.822 -5.209 1.00 0.00 N ATOM 1805 CA ALA A 112 -10.301 8.006 -4.450 1.00 0.00 C ATOM 1806 C ALA A 112 -11.378 8.447 -3.452 1.00 0.00 C ATOM 1807 O ALA A 112 -11.085 8.853 -2.344 1.00 0.00 O ATOM 1808 CB ALA A 112 -9.970 9.156 -5.403 1.00 0.00 C ATOM 0 H ALA A 112 -10.505 5.915 -4.862 1.00 0.00 H new ATOM 0 HA ALA A 112 -9.387 7.732 -3.923 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -9.598 10.006 -4.832 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -9.208 8.833 -6.112 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -10.869 9.449 -5.945 1.00 0.00 H new ATOM 1814 N ASP A 113 -12.625 8.339 -3.829 1.00 0.00 N ATOM 1815 CA ASP A 113 -13.727 8.706 -2.910 1.00 0.00 C ATOM 1816 C ASP A 113 -13.542 7.913 -1.621 1.00 0.00 C ATOM 1817 O ASP A 113 -13.981 8.302 -0.557 1.00 0.00 O ATOM 1818 CB ASP A 113 -15.052 8.319 -3.569 1.00 0.00 C ATOM 1819 CG ASP A 113 -16.076 9.435 -3.361 1.00 0.00 C ATOM 1820 OD1 ASP A 113 -16.087 10.009 -2.284 1.00 0.00 O ATOM 1821 OD2 ASP A 113 -16.833 9.699 -4.281 1.00 0.00 O ATOM 0 H ASP A 113 -12.924 8.008 -4.746 1.00 0.00 H new ATOM 0 HA ASP A 113 -13.726 9.774 -2.695 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -14.902 8.144 -4.634 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -15.423 7.387 -3.142 1.00 0.00 H new ATOM 1826 N ASP A 114 -12.877 6.797 -1.725 1.00 0.00 N ATOM 1827 CA ASP A 114 -12.625 5.949 -0.534 1.00 0.00 C ATOM 1828 C ASP A 114 -11.159 6.109 -0.127 1.00 0.00 C ATOM 1829 O ASP A 114 -10.768 5.795 0.980 1.00 0.00 O ATOM 1830 CB ASP A 114 -12.909 4.493 -0.894 1.00 0.00 C ATOM 1831 CG ASP A 114 -14.285 4.089 -0.358 1.00 0.00 C ATOM 1832 OD1 ASP A 114 -15.222 4.845 -0.560 1.00 0.00 O ATOM 1833 OD2 ASP A 114 -14.378 3.032 0.241 1.00 0.00 O ATOM 0 H ASP A 114 -12.493 6.434 -2.598 1.00 0.00 H new ATOM 0 HA ASP A 114 -13.270 6.246 0.293 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -12.877 4.363 -1.976 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -12.139 3.847 -0.472 1.00 0.00 H new ATOM 1838 N PHE A 115 -10.349 6.612 -1.016 1.00 0.00 N ATOM 1839 CA PHE A 115 -8.912 6.820 -0.695 1.00 0.00 C ATOM 1840 C PHE A 115 -8.720 8.239 -0.143 1.00 0.00 C ATOM 1841 O PHE A 115 -9.047 9.201 -0.810 1.00 0.00 O ATOM 1842 CB PHE A 115 -8.084 6.674 -1.974 1.00 0.00 C ATOM 1843 CG PHE A 115 -7.127 5.525 -1.824 1.00 0.00 C ATOM 1844 CD1 PHE A 115 -6.150 5.559 -0.834 1.00 0.00 C ATOM 1845 CD2 PHE A 115 -7.224 4.421 -2.676 1.00 0.00 C ATOM 1846 CE1 PHE A 115 -5.270 4.487 -0.688 1.00 0.00 C ATOM 1847 CE2 PHE A 115 -6.344 3.348 -2.532 1.00 0.00 C ATOM 1848 CZ PHE A 115 -5.366 3.378 -1.536 1.00 0.00 C ATOM 0 H PHE A 115 -10.624 6.890 -1.958 1.00 0.00 H new ATOM 0 HA PHE A 115 -8.592 6.085 0.043 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -8.741 6.505 -2.827 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -7.535 7.595 -2.171 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -6.073 6.415 -0.179 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -7.981 4.399 -3.446 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -4.513 4.513 0.081 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -6.419 2.495 -3.190 1.00 0.00 H new ATOM 0 HZ PHE A 115 -4.685 2.547 -1.420 1.00 0.00 H new ATOM 1858 N PRO A 116 -8.188 8.337 1.049 1.00 0.00 N ATOM 1859 CA PRO A 116 -7.940 9.644 1.685 1.00 0.00 C ATOM 1860 C PRO A 116 -7.223 10.589 0.708 1.00 0.00 C ATOM 1861 O PRO A 116 -6.453 10.151 -0.123 1.00 0.00 O ATOM 1862 CB PRO A 116 -7.055 9.315 2.893 1.00 0.00 C ATOM 1863 CG PRO A 116 -7.082 7.778 3.083 1.00 0.00 C ATOM 1864 CD PRO A 116 -7.789 7.172 1.859 1.00 0.00 C ATOM 0 HA PRO A 116 -8.858 10.154 1.978 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -6.035 9.663 2.728 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -7.423 9.819 3.787 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -6.069 7.385 3.174 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -7.610 7.514 4.000 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -7.124 6.511 1.303 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -8.654 6.578 2.154 1.00 0.00 H new ATOM 1872 N PRO A 117 -7.514 11.863 0.832 1.00 0.00 N ATOM 1873 CA PRO A 117 -6.924 12.899 -0.037 1.00 0.00 C ATOM 1874 C PRO A 117 -5.397 12.922 0.095 1.00 0.00 C ATOM 1875 O PRO A 117 -4.693 13.253 -0.838 1.00 0.00 O ATOM 1876 CB PRO A 117 -7.526 14.220 0.460 1.00 0.00 C ATOM 1877 CG PRO A 117 -8.486 13.891 1.631 1.00 0.00 C ATOM 1878 CD PRO A 117 -8.454 12.371 1.850 1.00 0.00 C ATOM 0 HA PRO A 117 -7.139 12.716 -1.090 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -6.739 14.898 0.790 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -8.063 14.722 -0.345 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -8.178 14.414 2.536 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -9.498 14.223 1.400 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -8.118 12.123 2.857 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -9.444 11.933 1.728 1.00 0.00 H new ATOM 1886 N ALA A 118 -4.880 12.580 1.244 1.00 0.00 N ATOM 1887 CA ALA A 118 -3.400 12.591 1.427 1.00 0.00 C ATOM 1888 C ALA A 118 -2.726 11.984 0.193 1.00 0.00 C ATOM 1889 O ALA A 118 -1.963 12.634 -0.494 1.00 0.00 O ATOM 1890 CB ALA A 118 -3.037 11.768 2.664 1.00 0.00 C ATOM 0 H ALA A 118 -5.417 12.294 2.063 1.00 0.00 H new ATOM 0 HA ALA A 118 -3.057 13.617 1.557 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -1.956 11.774 2.801 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -3.516 12.201 3.542 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -3.380 10.742 2.532 1.00 0.00 H new ATOM 1896 N ASN A 119 -3.003 10.742 -0.090 1.00 0.00 N ATOM 1897 CA ASN A 119 -2.387 10.082 -1.274 1.00 0.00 C ATOM 1898 C ASN A 119 -3.272 10.321 -2.498 1.00 0.00 C ATOM 1899 O ASN A 119 -3.659 9.406 -3.197 1.00 0.00 O ATOM 1900 CB ASN A 119 -2.271 8.589 -0.992 1.00 0.00 C ATOM 1901 CG ASN A 119 -1.048 8.355 -0.107 1.00 0.00 C ATOM 1902 OD1 ASN A 119 -0.360 7.260 -0.234 1.00 0.00 O flip ATOM 1903 ND2 ASN A 119 -0.714 9.187 0.713 1.00 0.00 N flip ATOM 0 H ASN A 119 -3.634 10.152 0.452 1.00 0.00 H new ATOM 0 HA ASN A 119 -1.396 10.493 -1.468 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -3.172 8.226 -0.497 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -2.175 8.034 -1.925 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -1.252 10.047 0.815 1.00 0.00 H new ATOM 0 HD22 ASN A 119 0.105 9.025 1.300 1.00 0.00 H new ATOM 1910 N GLU A 120 -3.605 11.554 -2.737 1.00 0.00 N ATOM 1911 CA GLU A 120 -4.481 11.912 -3.889 1.00 0.00 C ATOM 1912 C GLU A 120 -3.780 11.734 -5.253 1.00 0.00 C ATOM 1913 O GLU A 120 -4.411 11.305 -6.195 1.00 0.00 O ATOM 1914 CB GLU A 120 -4.888 13.373 -3.736 1.00 0.00 C ATOM 1915 CG GLU A 120 -6.334 13.456 -3.243 1.00 0.00 C ATOM 1916 CD GLU A 120 -7.228 13.979 -4.369 1.00 0.00 C ATOM 1917 OE1 GLU A 120 -6.846 14.951 -4.999 1.00 0.00 O ATOM 1918 OE2 GLU A 120 -8.281 13.398 -4.581 1.00 0.00 O ATOM 0 H GLU A 120 -3.302 12.348 -2.172 1.00 0.00 H new ATOM 0 HA GLU A 120 -5.341 11.242 -3.877 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -4.224 13.874 -3.031 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -4.789 13.890 -4.690 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -6.676 12.473 -2.920 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -6.397 14.116 -2.378 1.00 0.00 H new ATOM 1925 N PRO A 121 -2.522 12.107 -5.348 1.00 0.00 N ATOM 1926 CA PRO A 121 -1.776 12.027 -6.624 1.00 0.00 C ATOM 1927 C PRO A 121 -1.805 10.630 -7.251 1.00 0.00 C ATOM 1928 O PRO A 121 -2.047 10.487 -8.432 1.00 0.00 O ATOM 1929 CB PRO A 121 -0.343 12.442 -6.266 1.00 0.00 C ATOM 1930 CG PRO A 121 -0.350 12.936 -4.799 1.00 0.00 C ATOM 1931 CD PRO A 121 -1.737 12.637 -4.213 1.00 0.00 C ATOM 0 HA PRO A 121 -2.228 12.672 -7.377 1.00 0.00 H new ATOM 0 HB2 PRO A 121 0.340 11.600 -6.383 1.00 0.00 H new ATOM 0 HB3 PRO A 121 0.005 13.230 -6.934 1.00 0.00 H new ATOM 0 HG2 PRO A 121 0.426 12.432 -4.222 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -0.138 14.004 -4.754 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -1.675 11.911 -3.402 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -2.195 13.537 -3.802 1.00 0.00 H new ATOM 1939 N VAL A 122 -1.553 9.603 -6.500 1.00 0.00 N ATOM 1940 CA VAL A 122 -1.565 8.244 -7.100 1.00 0.00 C ATOM 1941 C VAL A 122 -2.987 7.688 -7.051 1.00 0.00 C ATOM 1942 O VAL A 122 -3.377 6.892 -7.880 1.00 0.00 O ATOM 1943 CB VAL A 122 -0.603 7.348 -6.322 1.00 0.00 C ATOM 1944 CG1 VAL A 122 -1.104 5.901 -6.315 1.00 0.00 C ATOM 1945 CG2 VAL A 122 0.776 7.398 -6.983 1.00 0.00 C ATOM 0 H VAL A 122 -1.340 9.642 -5.503 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.242 8.283 -8.140 1.00 0.00 H new ATOM 0 HB VAL A 122 -0.542 7.705 -5.294 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.406 5.277 -5.756 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.086 5.858 -5.844 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -1.177 5.536 -7.340 1.00 0.00 H new ATOM 0 HG21 VAL A 122 1.467 6.760 -6.432 1.00 0.00 H new ATOM 0 HG22 VAL A 122 0.699 7.046 -8.012 1.00 0.00 H new ATOM 0 HG23 VAL A 122 1.145 8.423 -6.977 1.00 0.00 H new ATOM 1955 N ILE A 123 -3.767 8.106 -6.098 1.00 0.00 N ATOM 1956 CA ILE A 123 -5.161 7.607 -6.030 1.00 0.00 C ATOM 1957 C ILE A 123 -5.902 8.163 -7.240 1.00 0.00 C ATOM 1958 O ILE A 123 -6.879 7.609 -7.700 1.00 0.00 O ATOM 1959 CB ILE A 123 -5.806 8.070 -4.716 1.00 0.00 C ATOM 1960 CG1 ILE A 123 -5.605 6.979 -3.662 1.00 0.00 C ATOM 1961 CG2 ILE A 123 -7.309 8.316 -4.910 1.00 0.00 C ATOM 1962 CD1 ILE A 123 -4.157 6.481 -3.695 1.00 0.00 C ATOM 0 H ILE A 123 -3.501 8.767 -5.368 1.00 0.00 H new ATOM 0 HA ILE A 123 -5.198 6.518 -6.047 1.00 0.00 H new ATOM 0 HB ILE A 123 -5.340 9.002 -4.396 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -5.842 7.370 -2.672 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -6.288 6.150 -3.849 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -7.749 8.643 -3.968 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.457 9.087 -5.667 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.790 7.393 -5.233 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -4.022 5.705 -2.942 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -3.935 6.073 -4.681 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -3.482 7.311 -3.486 1.00 0.00 H new ATOM 1974 N ALA A 124 -5.411 9.244 -7.774 1.00 0.00 N ATOM 1975 CA ALA A 124 -6.039 9.838 -8.976 1.00 0.00 C ATOM 1976 C ALA A 124 -6.019 8.781 -10.070 1.00 0.00 C ATOM 1977 O ALA A 124 -6.842 8.758 -10.964 1.00 0.00 O ATOM 1978 CB ALA A 124 -5.214 11.046 -9.419 1.00 0.00 C ATOM 0 H ALA A 124 -4.594 9.743 -7.423 1.00 0.00 H new ATOM 0 HA ALA A 124 -7.061 10.158 -8.770 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -5.668 11.492 -10.304 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -5.187 11.782 -8.616 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -4.198 10.727 -9.653 1.00 0.00 H new ATOM 1984 N LYS A 125 -5.054 7.916 -9.993 1.00 0.00 N ATOM 1985 CA LYS A 125 -4.905 6.837 -11.006 1.00 0.00 C ATOM 1986 C LYS A 125 -5.849 5.665 -10.713 1.00 0.00 C ATOM 1987 O LYS A 125 -6.440 5.112 -11.618 1.00 0.00 O ATOM 1988 CB LYS A 125 -3.457 6.366 -10.987 1.00 0.00 C ATOM 1989 CG LYS A 125 -2.543 7.589 -11.034 1.00 0.00 C ATOM 1990 CD LYS A 125 -3.010 8.547 -12.134 1.00 0.00 C ATOM 1991 CE LYS A 125 -2.808 7.894 -13.501 1.00 0.00 C ATOM 1992 NZ LYS A 125 -1.373 7.992 -13.887 1.00 0.00 N ATOM 0 H LYS A 125 -4.347 7.909 -9.257 1.00 0.00 H new ATOM 0 HA LYS A 125 -5.167 7.225 -11.991 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -3.261 5.783 -10.087 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -3.260 5.715 -11.838 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -2.551 8.097 -10.070 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -1.515 7.279 -11.222 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -4.061 8.797 -11.991 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -2.450 9.481 -12.079 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -3.117 6.849 -13.467 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -3.432 8.386 -14.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -1.296 8.058 -14.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -0.954 8.840 -13.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -0.866 7.147 -13.555 1.00 0.00 H new ATOM 2006 N LEU A 126 -6.009 5.269 -9.474 1.00 0.00 N ATOM 2007 CA LEU A 126 -6.938 4.130 -9.204 1.00 0.00 C ATOM 2008 C LEU A 126 -8.336 4.581 -9.588 1.00 0.00 C ATOM 2009 O LEU A 126 -9.188 3.795 -9.952 1.00 0.00 O ATOM 2010 CB LEU A 126 -6.927 3.731 -7.723 1.00 0.00 C ATOM 2011 CG LEU A 126 -5.532 3.250 -7.265 1.00 0.00 C ATOM 2012 CD1 LEU A 126 -4.482 3.402 -8.376 1.00 0.00 C ATOM 2013 CD2 LEU A 126 -5.100 4.078 -6.053 1.00 0.00 C ATOM 0 H LEU A 126 -5.550 5.673 -8.658 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.621 3.262 -9.782 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -7.235 4.582 -7.116 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.657 2.939 -7.555 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.602 2.192 -7.012 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.515 3.053 -8.013 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.780 2.811 -9.242 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.405 4.451 -8.662 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -4.116 3.748 -5.719 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -5.055 5.131 -6.329 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -5.820 3.945 -5.246 1.00 0.00 H new ATOM 2025 N LYS A 127 -8.567 5.858 -9.533 1.00 0.00 N ATOM 2026 CA LYS A 127 -9.891 6.383 -9.927 1.00 0.00 C ATOM 2027 C LYS A 127 -10.214 5.798 -11.290 1.00 0.00 C ATOM 2028 O LYS A 127 -11.338 5.455 -11.601 1.00 0.00 O ATOM 2029 CB LYS A 127 -9.802 7.898 -10.040 1.00 0.00 C ATOM 2030 CG LYS A 127 -9.123 8.455 -8.793 1.00 0.00 C ATOM 2031 CD LYS A 127 -9.835 9.734 -8.350 1.00 0.00 C ATOM 2032 CE LYS A 127 -9.860 10.735 -9.508 1.00 0.00 C ATOM 2033 NZ LYS A 127 -10.722 11.895 -9.142 1.00 0.00 N ATOM 0 H LYS A 127 -7.892 6.561 -9.231 1.00 0.00 H new ATOM 0 HA LYS A 127 -10.657 6.120 -9.198 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -9.238 8.176 -10.930 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -10.799 8.326 -10.148 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.149 7.716 -7.992 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -8.074 8.664 -9.001 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -10.852 9.505 -8.032 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -9.323 10.168 -7.491 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -8.849 11.075 -9.731 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -10.241 10.255 -10.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -10.740 12.576 -9.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -11.688 11.562 -8.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -10.340 12.357 -8.292 1.00 0.00 H new ATOM 2047 N ARG A 128 -9.203 5.685 -12.098 1.00 0.00 N ATOM 2048 CA ARG A 128 -9.369 5.127 -13.458 1.00 0.00 C ATOM 2049 C ARG A 128 -9.324 3.597 -13.375 1.00 0.00 C ATOM 2050 O ARG A 128 -9.896 2.904 -14.192 1.00 0.00 O ATOM 2051 CB ARG A 128 -8.226 5.625 -14.355 1.00 0.00 C ATOM 2052 CG ARG A 128 -7.671 6.962 -13.839 1.00 0.00 C ATOM 2053 CD ARG A 128 -7.564 7.945 -15.004 1.00 0.00 C ATOM 2054 NE ARG A 128 -6.132 8.132 -15.368 1.00 0.00 N ATOM 2055 CZ ARG A 128 -5.817 8.681 -16.508 1.00 0.00 C ATOM 2056 NH1 ARG A 128 -5.838 7.969 -17.601 1.00 0.00 N ATOM 2057 NH2 ARG A 128 -5.483 9.941 -16.555 1.00 0.00 N ATOM 0 H ARG A 128 -8.249 5.963 -11.866 1.00 0.00 H new ATOM 0 HA ARG A 128 -10.323 5.447 -13.877 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -7.429 4.882 -14.383 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -8.586 5.745 -15.377 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -8.324 7.366 -13.065 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -6.692 6.812 -13.383 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -8.122 7.570 -15.862 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -8.008 8.902 -14.728 1.00 0.00 H new ATOM 0 HE ARG A 128 -5.399 7.831 -14.726 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -6.101 6.984 -17.563 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -5.592 8.397 -18.493 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -5.468 10.497 -15.700 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -5.237 10.370 -17.447 1.00 0.00 H new ATOM 2071 N LEU A 129 -8.639 3.069 -12.389 1.00 0.00 N ATOM 2072 CA LEU A 129 -8.546 1.585 -12.246 1.00 0.00 C ATOM 2073 C LEU A 129 -9.902 0.949 -12.548 1.00 0.00 C ATOM 2074 O LEU A 129 -9.914 -0.145 -13.089 1.00 0.00 O ATOM 2075 CB LEU A 129 -8.121 1.220 -10.820 1.00 0.00 C ATOM 2076 CG LEU A 129 -6.807 0.438 -10.873 1.00 0.00 C ATOM 2077 CD1 LEU A 129 -5.717 1.314 -11.492 1.00 0.00 C ATOM 2078 CD2 LEU A 129 -6.396 0.036 -9.456 1.00 0.00 C ATOM 2079 OXT LEU A 129 -10.907 1.565 -12.234 1.00 0.00 O ATOM 0 H LEU A 129 -8.141 3.604 -11.678 1.00 0.00 H new ATOM 0 HA LEU A 129 -7.803 1.210 -12.950 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -7.997 2.123 -10.222 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -8.895 0.622 -10.338 1.00 0.00 H new ATOM 0 HG LEU A 129 -6.941 -0.457 -11.480 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -4.781 0.757 -11.530 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -6.010 1.600 -12.502 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -5.582 2.210 -10.886 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -5.460 -0.521 -9.493 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -6.262 0.931 -8.848 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -7.173 -0.589 -9.015 1.00 0.00 H new TER 2091 LEU A 129 HETATM 2092 MG MG A 132 7.132 -3.937 6.490 1.00 0.00 MG HETATM 2093 PG APC A 130 4.284 1.202 8.492 1.00 0.00 P HETATM 2094 O1G APC A 130 4.041 1.296 10.079 1.00 0.00 O HETATM 2095 O2G APC A 130 3.315 0.283 7.856 1.00 0.00 O HETATM 2096 O3G APC A 130 4.194 2.654 7.805 1.00 0.00 O HETATM 2097 PB APC A 130 7.152 1.065 8.953 1.00 0.00 P HETATM 2098 O1B APC A 130 6.984 0.695 10.511 1.00 0.00 O HETATM 2099 O2B APC A 130 8.249 0.271 8.358 1.00 0.00 O HETATM 2100 O3B APC A 130 5.786 0.721 8.183 1.00 0.00 O HETATM 2101 PA APC A 130 8.824 2.799 9.248 1.00 0.00 P HETATM 2102 O1A APC A 130 9.752 2.125 8.314 1.00 0.00 O HETATM 2103 O2A APC A 130 8.922 2.476 10.688 1.00 0.00 O HETATM 2104 C3A APC A 130 7.438 2.511 8.811 1.00 0.00 C HETATM 2105 O5' APC A 130 9.090 4.385 9.108 1.00 0.00 O HETATM 2106 C5' APC A 130 8.450 5.166 8.089 1.00 0.00 C HETATM 2107 C4' APC A 130 7.517 6.210 8.695 1.00 0.00 C HETATM 2108 O4' APC A 130 7.201 7.257 7.755 1.00 0.00 O HETATM 2109 C3' APC A 130 6.207 5.584 9.140 1.00 0.00 C HETATM 2110 O3' APC A 130 6.160 5.443 10.563 1.00 0.00 O HETATM 2111 C2' APC A 130 5.113 6.502 8.649 1.00 0.00 C HETATM 2112 O2' APC A 130 4.398 7.079 9.744 1.00 0.00 O HETATM 2113 C1' APC A 130 5.798 7.581 7.821 1.00 0.00 C HETATM 2114 N9 APC A 130 5.196 7.646 6.473 1.00 0.00 N HETATM 2115 C8 APC A 130 5.053 6.670 5.546 1.00 0.00 C HETATM 2116 N7 APC A 130 4.415 6.962 4.464 1.00 0.00 N HETATM 2117 C5 APC A 130 4.098 8.302 4.674 1.00 0.00 C HETATM 2118 C6 APC A 130 3.419 9.243 3.896 1.00 0.00 C HETATM 2119 N6 APC A 130 2.899 8.961 2.700 1.00 0.00 N HETATM 2120 N1 APC A 130 3.292 10.482 4.396 1.00 0.00 N HETATM 2121 C2 APC A 130 3.800 10.780 5.591 1.00 0.00 C HETATM 2122 N3 APC A 130 4.454 9.967 6.417 1.00 0.00 N HETATM 2123 C4 APC A 130 4.571 8.731 5.893 1.00 0.00 C HETATM 0 HO3' APC A 130 5.320 5.010 10.821 1.00 0.00 H new HETATM 0 HO2' APC A 130 4.859 6.869 10.583 1.00 0.00 H new HETATM 0 HN62 APC A 130 2.412 9.685 2.172 1.00 0.00 H new HETATM 0 HN61 APC A 130 2.988 8.021 2.314 1.00 0.00 H new HETATM 0 H5'2 APC A 130 9.206 5.661 7.479 1.00 0.00 H new HETATM 0 H5'1 APC A 130 7.885 4.510 7.427 1.00 0.00 H new HETATM 0 H3A2 APC A 130 7.304 2.816 7.773 1.00 0.00 H new HETATM 0 H3A1 APC A 130 6.732 3.090 9.407 1.00 0.00 H new HETATM 0 H8 APC A 130 5.462 5.673 5.708 1.00 0.00 H new HETATM 0 H4' APC A 130 8.049 6.629 9.550 1.00 0.00 H new HETATM 0 H3' APC A 130 6.092 4.581 8.730 1.00 0.00 H new HETATM 0 H2' APC A 130 4.381 5.955 8.055 1.00 0.00 H new HETATM 0 H2 APC A 130 3.665 11.807 5.931 1.00 0.00 H new HETATM 0 H1' APC A 130 5.670 8.562 8.278 1.00 0.00 H new HETATM 2139 CO CON A 131 5.222 0.575 11.680 1.00 0.00 CO HETATM 2140 N1 CON A 131 6.365 -0.154 13.297 1.00 0.00 N HETATM 2141 N2 CON A 131 3.473 0.459 12.856 1.00 0.00 N HETATM 2142 N3 CON A 131 5.530 2.556 12.336 1.00 0.00 N HETATM 2143 N4 CON A 131 4.913 -1.411 11.028 1.00 0.00 N HETATM 2156 O HOH A 133 8.578 -2.728 7.431 1.00 0.00 O HETATM 2159 O HOH A 134 6.960 -4.929 8.354 1.00 0.00 O