USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 845 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 38 LYS NZ :NH3+ -158:sc= 2.32 (180deg=1.19) USER MOD Set 1.2: A 42 HIS : no HE2:sc= 0.96 K(o=-0.029,f=-9.1!) USER MOD Set 1.3: A 45 ASN : amide:sc= -3.31 K(o=-0.029,f=-4.4!) USER MOD Set 2.1: A 25 GLN : amide:sc= 2.1 K(o=2.9,f=-5.1!) USER MOD Set 2.2: B 5 SER OG : rot -157:sc= 0.812 USER MOD Single : A 1 ARG N :NH3+ 149:sc= 0.00555 (180deg=-0.084) USER MOD Single : A 5 SER OG : rot 180:sc= 0.551 USER MOD Single : A 6 LYS NZ :NH3+ 177:sc= 1.95 (180deg=1.66) USER MOD Single : A 11 LYS NZ :NH3+ 164:sc= 1.27 (180deg=1.13) USER MOD Single : A 17 GLN : amide:sc= -0.102 X(o=-0.1,f=-0.45) USER MOD Single : A 18 LYS NZ :NH3+ -134:sc= 1.17 (180deg=-0.246) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 80:sc= 1.23 USER MOD Single : A 50 CYS SG : rot 180:sc= 0.0364 USER MOD Single : A 52 GLN : amide:sc= -0.176 K(o=-0.18,f=-1.1) USER MOD Single : A 54 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 55 GLN : amide:sc= 0.648 K(o=0.65,f=-0.089) USER MOD Single : A 58 GLN : amide:sc= -0.207 X(o=-0.21,f=-0.21) USER MOD Single : A 61 GLN : amide:sc= -1.07 K(o=-1.1,f=-1.7) USER MOD Single : A 62 GLN : amide:sc= -0.982 X(o=-0.98,f=-1.1) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -0.0245 X(o=-0.024,f=0) USER MOD Single : A 71 MET CE :methyl -167:sc= -0.132 (180deg=-0.165) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -149:sc= 1.27 (180deg=1.12) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0.00546 USER MOD Single : A 81 GLN : amide:sc= 1.56 K(o=1.6,f=-6.5!) USER MOD Single : A 85 SER OG : rot 84:sc= 0.886 USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 SER OG : rot 39:sc= 1.08 USER MOD Single : B 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 SER OG : rot -32:sc= 0.22 USER MOD Single : B 10 TYR OH : rot 166:sc=-0.00207 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 1 4.025 7.237 9.813 1.00 0.00 N ATOM 2 CA ARG A 1 3.168 7.966 8.859 1.00 0.00 C ATOM 3 C ARG A 1 3.984 9.027 8.123 1.00 0.00 C ATOM 4 O ARG A 1 5.035 9.430 8.618 1.00 0.00 O ATOM 5 CB ARG A 1 1.900 8.527 9.531 1.00 0.00 C ATOM 6 CG ARG A 1 2.091 9.320 10.837 1.00 0.00 C ATOM 7 CD ARG A 1 2.666 10.729 10.639 1.00 0.00 C ATOM 8 NE ARG A 1 2.647 11.502 11.893 1.00 0.00 N ATOM 9 CZ ARG A 1 1.572 12.110 12.427 1.00 0.00 C ATOM 10 NH1 ARG A 1 0.379 12.042 11.820 1.00 0.00 N ATOM 11 NH2 ARG A 1 1.695 12.789 13.575 1.00 0.00 N ATOM 0 H1 ARG A 1 3.456 6.932 10.628 1.00 0.00 H new ATOM 0 H2 ARG A 1 4.434 6.403 9.345 1.00 0.00 H new ATOM 0 H3 ARG A 1 4.791 7.861 10.139 1.00 0.00 H new ATOM 0 HA ARG A 1 2.804 7.263 8.110 1.00 0.00 H new ATOM 0 HB2 ARG A 1 1.395 9.173 8.813 1.00 0.00 H new ATOM 0 HB3 ARG A 1 1.229 7.693 9.737 1.00 0.00 H new ATOM 0 HG2 ARG A 1 1.130 9.400 11.344 1.00 0.00 H new ATOM 0 HG3 ARG A 1 2.753 8.759 11.496 1.00 0.00 H new ATOM 0 HD2 ARG A 1 3.689 10.657 10.271 1.00 0.00 H new ATOM 0 HD3 ARG A 1 2.089 11.255 9.878 1.00 0.00 H new ATOM 0 HE ARG A 1 3.527 11.584 12.402 1.00 0.00 H new ATOM 0 HH11 ARG A 1 0.280 11.526 10.946 1.00 0.00 H new ATOM 0 HH12 ARG A 1 -0.430 12.506 12.232 1.00 0.00 H new ATOM 0 HH21 ARG A 1 2.601 12.844 14.041 1.00 0.00 H new ATOM 0 HH22 ARG A 1 0.883 13.252 13.983 1.00 0.00 H new ATOM 27 N ALA A 2 3.512 9.459 6.948 1.00 0.00 N ATOM 28 CA ALA A 2 4.165 10.451 6.105 1.00 0.00 C ATOM 29 C ALA A 2 3.197 10.874 4.995 1.00 0.00 C ATOM 30 O ALA A 2 2.069 10.388 4.941 1.00 0.00 O ATOM 31 CB ALA A 2 5.450 9.856 5.508 1.00 0.00 C ATOM 0 H ALA A 2 2.638 9.114 6.551 1.00 0.00 H new ATOM 0 HA ALA A 2 4.435 11.327 6.695 1.00 0.00 H new ATOM 0 HB1 ALA A 2 5.937 10.600 4.878 1.00 0.00 H new ATOM 0 HB2 ALA A 2 6.125 9.565 6.313 1.00 0.00 H new ATOM 0 HB3 ALA A 2 5.201 8.980 4.909 1.00 0.00 H new ATOM 37 N GLY A 3 3.654 11.769 4.111 1.00 0.00 N ATOM 38 CA GLY A 3 2.914 12.286 2.968 1.00 0.00 C ATOM 39 C GLY A 3 3.913 12.527 1.838 1.00 0.00 C ATOM 40 O GLY A 3 5.088 12.772 2.108 1.00 0.00 O ATOM 0 H GLY A 3 4.591 12.166 4.181 1.00 0.00 H new ATOM 0 HA2 GLY A 3 2.148 11.576 2.656 1.00 0.00 H new ATOM 0 HA3 GLY A 3 2.403 13.212 3.231 1.00 0.00 H new ATOM 44 N LEU A 4 3.463 12.444 0.580 1.00 0.00 N ATOM 45 CA LEU A 4 4.317 12.616 -0.590 1.00 0.00 C ATOM 46 C LEU A 4 3.450 12.972 -1.798 1.00 0.00 C ATOM 47 O LEU A 4 2.322 12.490 -1.905 1.00 0.00 O ATOM 48 CB LEU A 4 5.124 11.312 -0.770 1.00 0.00 C ATOM 49 CG LEU A 4 5.896 11.062 -2.085 1.00 0.00 C ATOM 50 CD1 LEU A 4 7.015 10.061 -1.776 1.00 0.00 C ATOM 51 CD2 LEU A 4 4.997 10.453 -3.171 1.00 0.00 C ATOM 0 H LEU A 4 2.488 12.254 0.349 1.00 0.00 H new ATOM 0 HA LEU A 4 5.025 13.436 -0.472 1.00 0.00 H new ATOM 0 HB2 LEU A 4 5.846 11.261 0.045 1.00 0.00 H new ATOM 0 HB3 LEU A 4 4.432 10.480 -0.636 1.00 0.00 H new ATOM 0 HG LEU A 4 6.277 12.014 -2.455 1.00 0.00 H new ATOM 0 HD11 LEU A 4 7.584 9.859 -2.684 1.00 0.00 H new ATOM 0 HD12 LEU A 4 7.678 10.479 -1.018 1.00 0.00 H new ATOM 0 HD13 LEU A 4 6.580 9.132 -1.406 1.00 0.00 H new ATOM 0 HD21 LEU A 4 5.580 10.294 -4.078 1.00 0.00 H new ATOM 0 HD22 LEU A 4 4.600 9.500 -2.822 1.00 0.00 H new ATOM 0 HD23 LEU A 4 4.172 11.133 -3.384 1.00 0.00 H new ATOM 63 N SER A 5 3.975 13.817 -2.698 1.00 0.00 N ATOM 64 CA SER A 5 3.340 14.293 -3.917 1.00 0.00 C ATOM 65 C SER A 5 4.361 15.137 -4.700 1.00 0.00 C ATOM 66 O SER A 5 5.558 14.994 -4.461 1.00 0.00 O ATOM 67 CB SER A 5 2.059 15.088 -3.587 1.00 0.00 C ATOM 68 OG SER A 5 1.310 15.356 -4.757 1.00 0.00 O ATOM 0 H SER A 5 4.911 14.204 -2.579 1.00 0.00 H new ATOM 0 HA SER A 5 3.031 13.452 -4.537 1.00 0.00 H new ATOM 0 HB2 SER A 5 1.449 14.524 -2.882 1.00 0.00 H new ATOM 0 HB3 SER A 5 2.325 16.026 -3.099 1.00 0.00 H new ATOM 0 HG SER A 5 0.503 15.859 -4.521 1.00 0.00 H new ATOM 74 N LYS A 6 3.863 15.999 -5.605 1.00 0.00 N ATOM 75 CA LYS A 6 4.550 16.949 -6.489 1.00 0.00 C ATOM 76 C LYS A 6 6.079 16.752 -6.549 1.00 0.00 C ATOM 77 O LYS A 6 6.780 17.230 -5.658 1.00 0.00 O ATOM 78 CB LYS A 6 4.212 18.398 -6.056 1.00 0.00 C ATOM 79 CG LYS A 6 3.122 19.118 -6.868 1.00 0.00 C ATOM 80 CD LYS A 6 1.725 18.495 -6.726 1.00 0.00 C ATOM 81 CE LYS A 6 0.664 19.303 -7.487 1.00 0.00 C ATOM 82 NZ LYS A 6 0.790 19.143 -8.947 1.00 0.00 N ATOM 0 H LYS A 6 2.854 16.049 -5.748 1.00 0.00 H new ATOM 0 HA LYS A 6 4.185 16.757 -7.498 1.00 0.00 H new ATOM 0 HB2 LYS A 6 3.903 18.379 -5.011 1.00 0.00 H new ATOM 0 HB3 LYS A 6 5.125 18.992 -6.108 1.00 0.00 H new ATOM 0 HG2 LYS A 6 3.078 20.161 -6.553 1.00 0.00 H new ATOM 0 HG3 LYS A 6 3.405 19.115 -7.921 1.00 0.00 H new ATOM 0 HD2 LYS A 6 1.743 17.472 -7.102 1.00 0.00 H new ATOM 0 HD3 LYS A 6 1.455 18.442 -5.671 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -0.330 18.984 -7.172 1.00 0.00 H new ATOM 0 HE3 LYS A 6 0.757 20.358 -7.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 0.024 19.664 -9.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 1.708 19.518 -9.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 0.726 18.134 -9.192 1.00 0.00 H new ATOM 96 N LEU A 7 6.599 16.073 -7.587 1.00 0.00 N ATOM 97 CA LEU A 7 8.022 15.820 -7.773 1.00 0.00 C ATOM 98 C LEU A 7 8.605 15.074 -6.568 1.00 0.00 C ATOM 99 O LEU A 7 9.371 15.657 -5.803 1.00 0.00 O ATOM 100 CB LEU A 7 8.774 17.129 -8.076 1.00 0.00 C ATOM 101 CG LEU A 7 8.272 17.885 -9.319 1.00 0.00 C ATOM 102 CD1 LEU A 7 8.924 19.270 -9.359 1.00 0.00 C ATOM 103 CD2 LEU A 7 8.593 17.155 -10.631 1.00 0.00 C ATOM 0 H LEU A 7 6.022 15.680 -8.331 1.00 0.00 H new ATOM 0 HA LEU A 7 8.152 15.171 -8.639 1.00 0.00 H new ATOM 0 HB2 LEU A 7 8.694 17.787 -7.210 1.00 0.00 H new ATOM 0 HB3 LEU A 7 9.832 16.902 -8.208 1.00 0.00 H new ATOM 0 HG LEU A 7 7.187 17.955 -9.237 1.00 0.00 H new ATOM 0 HD11 LEU A 7 8.573 19.812 -10.237 1.00 0.00 H new ATOM 0 HD12 LEU A 7 8.656 19.824 -8.460 1.00 0.00 H new ATOM 0 HD13 LEU A 7 10.007 19.161 -9.409 1.00 0.00 H new ATOM 0 HD21 LEU A 7 8.215 17.736 -11.472 1.00 0.00 H new ATOM 0 HD22 LEU A 7 9.672 17.037 -10.727 1.00 0.00 H new ATOM 0 HD23 LEU A 7 8.120 16.173 -10.626 1.00 0.00 H new ATOM 115 N PRO A 8 8.248 13.789 -6.392 1.00 0.00 N ATOM 116 CA PRO A 8 8.721 12.965 -5.290 1.00 0.00 C ATOM 117 C PRO A 8 10.202 12.608 -5.495 1.00 0.00 C ATOM 118 O PRO A 8 11.064 13.457 -5.285 1.00 0.00 O ATOM 119 CB PRO A 8 7.761 11.771 -5.269 1.00 0.00 C ATOM 120 CG PRO A 8 7.358 11.598 -6.733 1.00 0.00 C ATOM 121 CD PRO A 8 7.339 13.037 -7.250 1.00 0.00 C ATOM 0 HA PRO A 8 8.708 13.458 -4.318 1.00 0.00 H new ATOM 0 HB2 PRO A 8 8.245 10.876 -4.879 1.00 0.00 H new ATOM 0 HB3 PRO A 8 6.895 11.966 -4.636 1.00 0.00 H new ATOM 0 HG2 PRO A 8 8.072 10.981 -7.279 1.00 0.00 H new ATOM 0 HG3 PRO A 8 6.383 11.120 -6.831 1.00 0.00 H new ATOM 0 HD2 PRO A 8 7.660 13.081 -8.291 1.00 0.00 H new ATOM 0 HD3 PRO A 8 6.332 13.452 -7.209 1.00 0.00 H new ATOM 129 N ASP A 9 10.523 11.374 -5.907 1.00 0.00 N ATOM 130 CA ASP A 9 11.914 10.988 -6.136 1.00 0.00 C ATOM 131 C ASP A 9 12.421 11.599 -7.448 1.00 0.00 C ATOM 132 O ASP A 9 13.618 11.843 -7.592 1.00 0.00 O ATOM 133 CB ASP A 9 12.098 9.464 -6.093 1.00 0.00 C ATOM 134 CG ASP A 9 13.573 9.065 -6.177 1.00 0.00 C ATOM 135 OD1 ASP A 9 14.418 9.781 -5.589 1.00 0.00 O ATOM 136 OD2 ASP A 9 13.852 8.063 -6.866 1.00 0.00 O ATOM 0 H ASP A 9 9.843 10.635 -6.086 1.00 0.00 H new ATOM 0 HA ASP A 9 12.521 11.387 -5.324 1.00 0.00 H new ATOM 0 HB2 ASP A 9 11.668 9.072 -5.171 1.00 0.00 H new ATOM 0 HB3 ASP A 9 11.551 9.009 -6.919 1.00 0.00 H new ATOM 141 N LEU A 10 11.511 11.880 -8.399 1.00 0.00 N ATOM 142 CA LEU A 10 11.760 12.518 -9.683 1.00 0.00 C ATOM 143 C LEU A 10 12.508 11.670 -10.721 1.00 0.00 C ATOM 144 O LEU A 10 12.540 12.030 -11.895 1.00 0.00 O ATOM 145 CB LEU A 10 12.479 13.843 -9.380 1.00 0.00 C ATOM 146 CG LEU A 10 11.942 15.136 -9.995 1.00 0.00 C ATOM 147 CD1 LEU A 10 12.869 16.200 -9.435 1.00 0.00 C ATOM 148 CD2 LEU A 10 11.991 15.107 -11.521 1.00 0.00 C ATOM 0 H LEU A 10 10.525 11.649 -8.273 1.00 0.00 H new ATOM 0 HA LEU A 10 10.801 12.676 -10.176 1.00 0.00 H new ATOM 0 HB2 LEU A 10 12.488 13.972 -8.298 1.00 0.00 H new ATOM 0 HB3 LEU A 10 13.516 13.734 -9.697 1.00 0.00 H new ATOM 0 HG LEU A 10 10.893 15.309 -9.754 1.00 0.00 H new ATOM 0 HD11 LEU A 10 12.572 17.178 -9.815 1.00 0.00 H new ATOM 0 HD12 LEU A 10 12.808 16.200 -8.347 1.00 0.00 H new ATOM 0 HD13 LEU A 10 13.893 15.988 -9.741 1.00 0.00 H new ATOM 0 HD21 LEU A 10 11.600 16.045 -11.915 1.00 0.00 H new ATOM 0 HD22 LEU A 10 13.022 14.977 -11.850 1.00 0.00 H new ATOM 0 HD23 LEU A 10 11.386 14.278 -11.889 1.00 0.00 H new ATOM 160 N LYS A 11 13.099 10.551 -10.307 1.00 0.00 N ATOM 161 CA LYS A 11 13.829 9.649 -11.197 1.00 0.00 C ATOM 162 C LYS A 11 12.856 8.824 -12.042 1.00 0.00 C ATOM 163 O LYS A 11 13.184 8.463 -13.171 1.00 0.00 O ATOM 164 CB LYS A 11 14.743 8.692 -10.417 1.00 0.00 C ATOM 165 CG LYS A 11 16.072 9.307 -9.939 1.00 0.00 C ATOM 166 CD LYS A 11 15.813 10.347 -8.854 1.00 0.00 C ATOM 167 CE LYS A 11 16.977 10.647 -7.913 1.00 0.00 C ATOM 168 NZ LYS A 11 16.457 11.302 -6.694 1.00 0.00 N ATOM 0 H LYS A 11 13.085 10.242 -9.335 1.00 0.00 H new ATOM 0 HA LYS A 11 14.447 10.273 -11.843 1.00 0.00 H new ATOM 0 HB2 LYS A 11 14.199 8.321 -9.549 1.00 0.00 H new ATOM 0 HB3 LYS A 11 14.964 7.831 -11.047 1.00 0.00 H new ATOM 0 HG2 LYS A 11 16.725 8.524 -9.554 1.00 0.00 H new ATOM 0 HG3 LYS A 11 16.590 9.769 -10.779 1.00 0.00 H new ATOM 0 HD2 LYS A 11 15.515 11.278 -9.336 1.00 0.00 H new ATOM 0 HD3 LYS A 11 14.966 10.013 -8.255 1.00 0.00 H new ATOM 0 HE2 LYS A 11 17.497 9.725 -7.652 1.00 0.00 H new ATOM 0 HE3 LYS A 11 17.703 11.293 -8.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 17.178 11.265 -5.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 16.226 12.294 -6.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 15.600 10.808 -6.373 1.00 0.00 H new ATOM 182 N ASP A 12 11.669 8.517 -11.505 1.00 0.00 N ATOM 183 CA ASP A 12 10.696 7.698 -12.210 1.00 0.00 C ATOM 184 C ASP A 12 9.946 8.520 -13.251 1.00 0.00 C ATOM 185 O ASP A 12 9.560 9.666 -13.021 1.00 0.00 O ATOM 186 CB ASP A 12 9.680 7.096 -11.241 1.00 0.00 C ATOM 187 CG ASP A 12 10.331 6.216 -10.185 1.00 0.00 C ATOM 188 OD1 ASP A 12 10.701 5.079 -10.547 1.00 0.00 O ATOM 189 OD2 ASP A 12 10.442 6.703 -9.040 1.00 0.00 O ATOM 0 H ASP A 12 11.366 8.828 -10.582 1.00 0.00 H new ATOM 0 HA ASP A 12 11.248 6.897 -12.703 1.00 0.00 H new ATOM 0 HB2 ASP A 12 9.130 7.900 -10.751 1.00 0.00 H new ATOM 0 HB3 ASP A 12 8.953 6.508 -11.801 1.00 0.00 H new ATOM 194 N ALA A 13 9.749 7.889 -14.408 1.00 0.00 N ATOM 195 CA ALA A 13 9.075 8.461 -15.559 1.00 0.00 C ATOM 196 C ALA A 13 7.584 8.577 -15.301 1.00 0.00 C ATOM 197 O ALA A 13 6.977 9.582 -15.649 1.00 0.00 O ATOM 198 CB ALA A 13 9.370 7.623 -16.805 1.00 0.00 C ATOM 0 H ALA A 13 10.067 6.933 -14.569 1.00 0.00 H new ATOM 0 HA ALA A 13 9.454 9.468 -15.732 1.00 0.00 H new ATOM 0 HB1 ALA A 13 8.861 8.058 -17.665 1.00 0.00 H new ATOM 0 HB2 ALA A 13 10.444 7.609 -16.988 1.00 0.00 H new ATOM 0 HB3 ALA A 13 9.015 6.604 -16.651 1.00 0.00 H new ATOM 204 N GLU A 14 7.005 7.548 -14.683 1.00 0.00 N ATOM 205 CA GLU A 14 5.586 7.531 -14.355 1.00 0.00 C ATOM 206 C GLU A 14 5.267 8.671 -13.389 1.00 0.00 C ATOM 207 O GLU A 14 4.262 9.353 -13.544 1.00 0.00 O ATOM 208 CB GLU A 14 5.162 6.180 -13.756 1.00 0.00 C ATOM 209 CG GLU A 14 3.628 6.055 -13.708 1.00 0.00 C ATOM 210 CD GLU A 14 3.117 5.631 -12.335 1.00 0.00 C ATOM 211 OE1 GLU A 14 3.561 4.564 -11.862 1.00 0.00 O ATOM 212 OE2 GLU A 14 2.291 6.386 -11.775 1.00 0.00 O ATOM 0 H GLU A 14 7.507 6.707 -14.398 1.00 0.00 H new ATOM 0 HA GLU A 14 5.020 7.671 -15.276 1.00 0.00 H new ATOM 0 HB2 GLU A 14 5.578 5.367 -14.351 1.00 0.00 H new ATOM 0 HB3 GLU A 14 5.570 6.080 -12.750 1.00 0.00 H new ATOM 0 HG2 GLU A 14 3.181 7.011 -13.979 1.00 0.00 H new ATOM 0 HG3 GLU A 14 3.303 5.329 -14.453 1.00 0.00 H new ATOM 219 N ALA A 15 6.127 8.883 -12.390 1.00 0.00 N ATOM 220 CA ALA A 15 5.945 9.929 -11.389 1.00 0.00 C ATOM 221 C ALA A 15 6.017 11.310 -12.032 1.00 0.00 C ATOM 222 O ALA A 15 5.284 12.224 -11.654 1.00 0.00 O ATOM 223 CB ALA A 15 7.010 9.803 -10.297 1.00 0.00 C ATOM 0 H ALA A 15 6.973 8.329 -12.255 1.00 0.00 H new ATOM 0 HA ALA A 15 4.959 9.808 -10.941 1.00 0.00 H new ATOM 0 HB1 ALA A 15 6.865 10.588 -9.555 1.00 0.00 H new ATOM 0 HB2 ALA A 15 6.924 8.829 -9.816 1.00 0.00 H new ATOM 0 HB3 ALA A 15 8.000 9.902 -10.741 1.00 0.00 H new ATOM 229 N VAL A 16 6.910 11.443 -13.013 1.00 0.00 N ATOM 230 CA VAL A 16 7.111 12.685 -13.746 1.00 0.00 C ATOM 231 C VAL A 16 5.913 12.883 -14.662 1.00 0.00 C ATOM 232 O VAL A 16 5.461 14.011 -14.825 1.00 0.00 O ATOM 233 CB VAL A 16 8.468 12.694 -14.481 1.00 0.00 C ATOM 234 CG1 VAL A 16 8.451 13.196 -15.927 1.00 0.00 C ATOM 235 CG2 VAL A 16 9.552 13.376 -13.661 1.00 0.00 C ATOM 0 H VAL A 16 7.517 10.683 -13.321 1.00 0.00 H new ATOM 0 HA VAL A 16 7.166 13.534 -13.065 1.00 0.00 H new ATOM 0 HB VAL A 16 8.712 11.636 -14.578 1.00 0.00 H new ATOM 0 HG11 VAL A 16 9.460 13.156 -16.338 1.00 0.00 H new ATOM 0 HG12 VAL A 16 7.791 12.566 -16.523 1.00 0.00 H new ATOM 0 HG13 VAL A 16 8.090 14.224 -15.951 1.00 0.00 H new ATOM 0 HG21 VAL A 16 10.491 13.361 -14.215 1.00 0.00 H new ATOM 0 HG22 VAL A 16 9.264 14.409 -13.464 1.00 0.00 H new ATOM 0 HG23 VAL A 16 9.679 12.848 -12.716 1.00 0.00 H new ATOM 245 N GLN A 17 5.393 11.794 -15.241 1.00 0.00 N ATOM 246 CA GLN A 17 4.238 11.842 -16.126 1.00 0.00 C ATOM 247 C GLN A 17 3.016 12.280 -15.330 1.00 0.00 C ATOM 248 O GLN A 17 2.242 13.110 -15.799 1.00 0.00 O ATOM 249 CB GLN A 17 3.989 10.478 -16.801 1.00 0.00 C ATOM 250 CG GLN A 17 2.893 10.508 -17.876 1.00 0.00 C ATOM 251 CD GLN A 17 3.241 11.395 -19.068 1.00 0.00 C ATOM 252 OE1 GLN A 17 2.475 12.286 -19.423 1.00 0.00 O ATOM 253 NE2 GLN A 17 4.391 11.157 -19.698 1.00 0.00 N ATOM 0 H GLN A 17 5.767 10.855 -15.104 1.00 0.00 H new ATOM 0 HA GLN A 17 4.433 12.563 -16.920 1.00 0.00 H new ATOM 0 HB2 GLN A 17 4.919 10.132 -17.253 1.00 0.00 H new ATOM 0 HB3 GLN A 17 3.716 9.750 -16.037 1.00 0.00 H new ATOM 0 HG2 GLN A 17 2.711 9.493 -18.228 1.00 0.00 H new ATOM 0 HG3 GLN A 17 1.964 10.861 -17.428 1.00 0.00 H new ATOM 0 HE21 GLN A 17 5.004 10.408 -19.376 1.00 0.00 H new ATOM 0 HE22 GLN A 17 4.659 11.724 -20.503 1.00 0.00 H new ATOM 262 N LYS A 18 2.856 11.713 -14.129 1.00 0.00 N ATOM 263 CA LYS A 18 1.731 12.007 -13.252 1.00 0.00 C ATOM 264 C LYS A 18 1.723 13.496 -12.920 1.00 0.00 C ATOM 265 O LYS A 18 0.723 14.176 -13.141 1.00 0.00 O ATOM 266 CB LYS A 18 1.791 11.124 -11.996 1.00 0.00 C ATOM 267 CG LYS A 18 1.612 9.632 -12.337 1.00 0.00 C ATOM 268 CD LYS A 18 0.237 9.074 -11.950 1.00 0.00 C ATOM 269 CE LYS A 18 0.077 8.813 -10.445 1.00 0.00 C ATOM 270 NZ LYS A 18 1.102 7.882 -9.932 1.00 0.00 N ATOM 0 H LYS A 18 3.511 11.034 -13.741 1.00 0.00 H new ATOM 0 HA LYS A 18 0.793 11.775 -13.756 1.00 0.00 H new ATOM 0 HB2 LYS A 18 2.748 11.270 -11.494 1.00 0.00 H new ATOM 0 HB3 LYS A 18 1.014 11.433 -11.297 1.00 0.00 H new ATOM 0 HG2 LYS A 18 1.763 9.492 -13.407 1.00 0.00 H new ATOM 0 HG3 LYS A 18 2.385 9.056 -11.828 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -0.533 9.775 -12.272 1.00 0.00 H new ATOM 0 HD3 LYS A 18 0.067 8.143 -12.491 1.00 0.00 H new ATOM 0 HE2 LYS A 18 0.142 9.757 -9.905 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -0.914 8.403 -10.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 0.650 7.167 -9.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 1.574 7.412 -10.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 1.805 8.411 -9.377 1.00 0.00 H new ATOM 284 N PHE A 19 2.847 13.999 -12.408 1.00 0.00 N ATOM 285 CA PHE A 19 3.002 15.406 -12.065 1.00 0.00 C ATOM 286 C PHE A 19 2.812 16.303 -13.299 1.00 0.00 C ATOM 287 O PHE A 19 2.101 17.308 -13.236 1.00 0.00 O ATOM 288 CB PHE A 19 4.381 15.610 -11.406 1.00 0.00 C ATOM 289 CG PHE A 19 4.956 16.993 -11.626 1.00 0.00 C ATOM 290 CD1 PHE A 19 5.686 17.245 -12.799 1.00 0.00 C ATOM 291 CD2 PHE A 19 4.754 18.027 -10.693 1.00 0.00 C ATOM 292 CE1 PHE A 19 6.195 18.524 -13.042 1.00 0.00 C ATOM 293 CE2 PHE A 19 5.281 19.309 -10.939 1.00 0.00 C ATOM 294 CZ PHE A 19 6.001 19.552 -12.122 1.00 0.00 C ATOM 0 H PHE A 19 3.677 13.436 -12.220 1.00 0.00 H new ATOM 0 HA PHE A 19 2.229 15.697 -11.354 1.00 0.00 H new ATOM 0 HB2 PHE A 19 4.294 15.427 -10.335 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.076 14.869 -11.800 1.00 0.00 H new ATOM 0 HD1 PHE A 19 5.854 16.452 -13.512 1.00 0.00 H new ATOM 0 HD2 PHE A 19 4.195 17.837 -9.789 1.00 0.00 H new ATOM 0 HE1 PHE A 19 6.744 18.717 -13.952 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.133 20.103 -10.222 1.00 0.00 H new ATOM 0 HZ PHE A 19 6.403 20.535 -12.317 1.00 0.00 H new ATOM 304 N PHE A 20 3.460 15.942 -14.415 1.00 0.00 N ATOM 305 CA PHE A 20 3.403 16.702 -15.658 1.00 0.00 C ATOM 306 C PHE A 20 1.929 16.910 -16.022 1.00 0.00 C ATOM 307 O PHE A 20 1.493 18.036 -16.248 1.00 0.00 O ATOM 308 CB PHE A 20 4.183 15.970 -16.762 1.00 0.00 C ATOM 309 CG PHE A 20 3.687 16.180 -18.170 1.00 0.00 C ATOM 310 CD1 PHE A 20 2.704 15.315 -18.678 1.00 0.00 C ATOM 311 CD2 PHE A 20 4.195 17.218 -18.969 1.00 0.00 C ATOM 312 CE1 PHE A 20 2.225 15.486 -19.979 1.00 0.00 C ATOM 313 CE2 PHE A 20 3.713 17.389 -20.278 1.00 0.00 C ATOM 314 CZ PHE A 20 2.728 16.518 -20.780 1.00 0.00 C ATOM 0 H PHE A 20 4.042 15.106 -14.474 1.00 0.00 H new ATOM 0 HA PHE A 20 3.874 17.678 -15.541 1.00 0.00 H new ATOM 0 HB2 PHE A 20 5.225 16.286 -16.714 1.00 0.00 H new ATOM 0 HB3 PHE A 20 4.163 14.902 -16.546 1.00 0.00 H new ATOM 0 HD1 PHE A 20 2.318 14.516 -18.062 1.00 0.00 H new ATOM 0 HD2 PHE A 20 4.953 17.882 -18.579 1.00 0.00 H new ATOM 0 HE1 PHE A 20 1.467 14.822 -20.367 1.00 0.00 H new ATOM 0 HE2 PHE A 20 4.097 18.186 -20.897 1.00 0.00 H new ATOM 0 HZ PHE A 20 2.359 16.646 -21.787 1.00 0.00 H new ATOM 324 N LEU A 21 1.163 15.810 -16.051 1.00 0.00 N ATOM 325 CA LEU A 21 -0.258 15.823 -16.352 1.00 0.00 C ATOM 326 C LEU A 21 -1.029 16.590 -15.291 1.00 0.00 C ATOM 327 O LEU A 21 -1.992 17.275 -15.627 1.00 0.00 O ATOM 328 CB LEU A 21 -0.797 14.385 -16.496 1.00 0.00 C ATOM 329 CG LEU A 21 -1.080 13.894 -17.932 1.00 0.00 C ATOM 330 CD1 LEU A 21 -1.249 12.369 -17.879 1.00 0.00 C ATOM 331 CD2 LEU A 21 -2.351 14.570 -18.459 1.00 0.00 C ATOM 0 H LEU A 21 1.528 14.877 -15.862 1.00 0.00 H new ATOM 0 HA LEU A 21 -0.400 16.335 -17.304 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -0.079 13.704 -16.038 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -1.720 14.308 -15.921 1.00 0.00 H new ATOM 0 HG LEU A 21 -0.261 14.148 -18.605 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -1.451 11.990 -18.881 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -0.335 11.915 -17.497 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -2.082 12.118 -17.222 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -2.553 14.225 -19.473 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -3.192 14.315 -17.815 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -2.213 15.651 -18.465 1.00 0.00 H new ATOM 343 N GLU A 22 -0.629 16.497 -14.020 1.00 0.00 N ATOM 344 CA GLU A 22 -1.319 17.237 -12.978 1.00 0.00 C ATOM 345 C GLU A 22 -1.255 18.736 -13.280 1.00 0.00 C ATOM 346 O GLU A 22 -2.221 19.435 -13.001 1.00 0.00 O ATOM 347 CB GLU A 22 -0.770 16.888 -11.587 1.00 0.00 C ATOM 348 CG GLU A 22 -1.717 17.360 -10.475 1.00 0.00 C ATOM 349 CD GLU A 22 -1.326 16.777 -9.121 1.00 0.00 C ATOM 350 OE1 GLU A 22 -0.104 16.604 -8.917 1.00 0.00 O ATOM 351 OE2 GLU A 22 -2.239 16.551 -8.302 1.00 0.00 O ATOM 0 H GLU A 22 0.154 15.927 -13.699 1.00 0.00 H new ATOM 0 HA GLU A 22 -2.369 16.946 -12.967 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -0.626 15.810 -11.511 1.00 0.00 H new ATOM 0 HB3 GLU A 22 0.208 17.350 -11.454 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -1.702 18.449 -10.421 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -2.738 17.067 -10.717 1.00 0.00 H new ATOM 358 N GLU A 23 -0.146 19.222 -13.862 1.00 0.00 N ATOM 359 CA GLU A 23 0.056 20.627 -14.202 1.00 0.00 C ATOM 360 C GLU A 23 -0.539 20.964 -15.573 1.00 0.00 C ATOM 361 O GLU A 23 -1.067 22.063 -15.731 1.00 0.00 O ATOM 362 CB GLU A 23 1.529 21.010 -14.022 1.00 0.00 C ATOM 363 CG GLU A 23 1.751 21.627 -12.626 1.00 0.00 C ATOM 364 CD GLU A 23 1.394 20.723 -11.452 1.00 0.00 C ATOM 365 OE1 GLU A 23 0.215 20.732 -11.038 1.00 0.00 O ATOM 366 OE2 GLU A 23 2.319 20.072 -10.919 1.00 0.00 O ATOM 0 H GLU A 23 0.647 18.631 -14.111 1.00 0.00 H new ATOM 0 HA GLU A 23 -0.499 21.256 -13.506 1.00 0.00 H new ATOM 0 HB2 GLU A 23 2.159 20.129 -14.143 1.00 0.00 H new ATOM 0 HB3 GLU A 23 1.824 21.721 -14.793 1.00 0.00 H new ATOM 0 HG2 GLU A 23 2.798 21.915 -12.536 1.00 0.00 H new ATOM 0 HG3 GLU A 23 1.161 22.541 -12.552 1.00 0.00 H new ATOM 373 N ILE A 24 -0.513 20.036 -16.544 1.00 0.00 N ATOM 374 CA ILE A 24 -1.171 20.250 -17.847 1.00 0.00 C ATOM 375 C ILE A 24 -2.645 20.536 -17.513 1.00 0.00 C ATOM 376 O ILE A 24 -3.209 21.522 -17.995 1.00 0.00 O ATOM 377 CB ILE A 24 -0.981 19.047 -18.855 1.00 0.00 C ATOM 378 CG1 ILE A 24 0.177 19.212 -19.886 1.00 0.00 C ATOM 379 CG2 ILE A 24 -2.262 18.551 -19.567 1.00 0.00 C ATOM 380 CD1 ILE A 24 -0.075 18.568 -21.259 1.00 0.00 C ATOM 0 H ILE A 24 -0.046 19.134 -16.454 1.00 0.00 H new ATOM 0 HA ILE A 24 -0.717 21.084 -18.383 1.00 0.00 H new ATOM 0 HB ILE A 24 -0.686 18.262 -18.159 1.00 0.00 H new ATOM 0 HG12 ILE A 24 0.365 20.276 -20.030 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.084 18.782 -19.462 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -2.012 17.725 -20.233 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -2.983 18.212 -18.824 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -2.695 19.366 -20.147 1.00 0.00 H new ATOM 0 HD11 ILE A 24 0.787 18.737 -21.904 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -0.230 17.496 -21.135 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -0.961 19.013 -21.713 1.00 0.00 H new ATOM 392 N GLN A 25 -3.235 19.671 -16.669 1.00 0.00 N ATOM 393 CA GLN A 25 -4.631 19.739 -16.242 1.00 0.00 C ATOM 394 C GLN A 25 -4.924 20.903 -15.297 1.00 0.00 C ATOM 395 O GLN A 25 -5.885 21.640 -15.491 1.00 0.00 O ATOM 396 CB GLN A 25 -5.058 18.400 -15.608 1.00 0.00 C ATOM 397 CG GLN A 25 -4.989 17.169 -16.536 1.00 0.00 C ATOM 398 CD GLN A 25 -5.255 15.886 -15.761 1.00 0.00 C ATOM 399 OE1 GLN A 25 -6.309 15.266 -15.907 1.00 0.00 O ATOM 400 NE2 GLN A 25 -4.291 15.478 -14.938 1.00 0.00 N ATOM 0 H GLN A 25 -2.733 18.885 -16.257 1.00 0.00 H new ATOM 0 HA GLN A 25 -5.222 19.925 -17.139 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -4.427 18.213 -14.739 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -6.080 18.501 -15.244 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -5.720 17.272 -17.338 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -4.007 17.118 -17.005 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -3.433 16.023 -14.848 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -4.410 14.621 -14.398 1.00 0.00 H new ATOM 409 N LEU A 26 -4.105 21.074 -14.266 1.00 0.00 N ATOM 410 CA LEU A 26 -4.285 22.155 -13.297 1.00 0.00 C ATOM 411 C LEU A 26 -4.219 23.503 -14.025 1.00 0.00 C ATOM 412 O LEU A 26 -5.065 24.364 -13.790 1.00 0.00 O ATOM 413 CB LEU A 26 -3.315 21.976 -12.113 1.00 0.00 C ATOM 414 CG LEU A 26 -3.160 23.078 -11.065 1.00 0.00 C ATOM 415 CD1 LEU A 26 -2.561 24.372 -11.610 1.00 0.00 C ATOM 416 CD2 LEU A 26 -4.481 23.341 -10.365 1.00 0.00 C ATOM 0 H LEU A 26 -3.302 20.474 -14.076 1.00 0.00 H new ATOM 0 HA LEU A 26 -5.274 22.125 -12.839 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.614 21.070 -11.586 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -2.326 21.789 -12.532 1.00 0.00 H new ATOM 0 HG LEU A 26 -2.437 22.704 -10.340 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -2.483 25.104 -10.806 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.569 24.171 -12.015 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -3.202 24.766 -12.399 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -4.349 24.129 -9.623 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -5.225 23.654 -11.098 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -4.819 22.430 -9.871 1.00 0.00 H new ATOM 428 N GLY A 27 -3.244 23.686 -14.924 1.00 0.00 N ATOM 429 CA GLY A 27 -3.102 24.913 -15.698 1.00 0.00 C ATOM 430 C GLY A 27 -4.335 25.138 -16.552 1.00 0.00 C ATOM 431 O GLY A 27 -5.066 26.085 -16.283 1.00 0.00 O ATOM 0 H GLY A 27 -2.534 22.984 -15.131 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.955 25.760 -15.028 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -2.218 24.852 -16.332 1.00 0.00 H new ATOM 435 N GLU A 28 -4.589 24.295 -17.562 1.00 0.00 N ATOM 436 CA GLU A 28 -5.785 24.474 -18.396 1.00 0.00 C ATOM 437 C GLU A 28 -7.080 24.694 -17.593 1.00 0.00 C ATOM 438 O GLU A 28 -7.929 25.483 -18.002 1.00 0.00 O ATOM 439 CB GLU A 28 -5.906 23.357 -19.429 1.00 0.00 C ATOM 440 CG GLU A 28 -6.002 21.997 -18.742 1.00 0.00 C ATOM 441 CD GLU A 28 -7.407 21.495 -18.440 1.00 0.00 C ATOM 442 OE1 GLU A 28 -8.377 22.222 -18.740 1.00 0.00 O ATOM 443 OE2 GLU A 28 -7.483 20.345 -17.956 1.00 0.00 O ATOM 0 H GLU A 28 -4.000 23.502 -17.817 1.00 0.00 H new ATOM 0 HA GLU A 28 -5.645 25.409 -18.939 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -6.788 23.521 -20.048 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -5.043 23.374 -20.094 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -5.502 21.260 -19.370 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -5.447 22.046 -17.805 1.00 0.00 H new ATOM 450 N GLU A 29 -7.221 24.034 -16.439 1.00 0.00 N ATOM 451 CA GLU A 29 -8.386 24.197 -15.572 1.00 0.00 C ATOM 452 C GLU A 29 -8.372 25.597 -14.948 1.00 0.00 C ATOM 453 O GLU A 29 -9.398 26.268 -14.901 1.00 0.00 O ATOM 454 CB GLU A 29 -8.440 23.082 -14.522 1.00 0.00 C ATOM 455 CG GLU A 29 -9.641 23.172 -13.572 1.00 0.00 C ATOM 456 CD GLU A 29 -10.973 22.976 -14.293 1.00 0.00 C ATOM 457 OE1 GLU A 29 -11.094 21.962 -15.014 1.00 0.00 O ATOM 458 OE2 GLU A 29 -11.868 23.822 -14.085 1.00 0.00 O ATOM 0 H GLU A 29 -6.530 23.373 -16.083 1.00 0.00 H new ATOM 0 HA GLU A 29 -9.298 24.109 -16.162 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -8.465 22.119 -15.032 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -7.523 23.107 -13.934 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -9.540 22.418 -12.791 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -9.638 24.144 -13.079 1.00 0.00 H new ATOM 465 N LEU A 30 -7.213 26.080 -14.487 1.00 0.00 N ATOM 466 CA LEU A 30 -7.118 27.430 -13.949 1.00 0.00 C ATOM 467 C LEU A 30 -7.453 28.421 -15.065 1.00 0.00 C ATOM 468 O LEU A 30 -8.139 29.412 -14.822 1.00 0.00 O ATOM 469 CB LEU A 30 -5.724 27.698 -13.351 1.00 0.00 C ATOM 470 CG LEU A 30 -5.530 27.373 -11.859 1.00 0.00 C ATOM 471 CD1 LEU A 30 -4.087 27.716 -11.478 1.00 0.00 C ATOM 472 CD2 LEU A 30 -6.451 28.184 -10.931 1.00 0.00 C ATOM 0 H LEU A 30 -6.338 25.557 -14.478 1.00 0.00 H new ATOM 0 HA LEU A 30 -7.831 27.551 -13.133 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -4.994 27.122 -13.921 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -5.487 28.751 -13.502 1.00 0.00 H new ATOM 0 HG LEU A 30 -5.769 26.317 -11.730 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -3.926 27.493 -10.423 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.400 27.123 -12.083 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -3.906 28.776 -11.657 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -6.261 27.904 -9.895 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -6.254 29.248 -11.062 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -7.492 27.975 -11.178 1.00 0.00 H new ATOM 484 N LEU A 31 -7.013 28.149 -16.299 1.00 0.00 N ATOM 485 CA LEU A 31 -7.350 29.000 -17.443 1.00 0.00 C ATOM 486 C LEU A 31 -8.854 28.995 -17.622 1.00 0.00 C ATOM 487 O LEU A 31 -9.453 30.044 -17.839 1.00 0.00 O ATOM 488 CB LEU A 31 -6.694 28.497 -18.715 1.00 0.00 C ATOM 489 CG LEU A 31 -5.293 29.066 -18.841 1.00 0.00 C ATOM 490 CD1 LEU A 31 -4.424 28.886 -17.604 1.00 0.00 C ATOM 491 CD2 LEU A 31 -4.639 28.338 -20.000 1.00 0.00 C ATOM 0 H LEU A 31 -6.425 27.348 -16.529 1.00 0.00 H new ATOM 0 HA LEU A 31 -6.986 30.009 -17.249 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.653 27.408 -18.706 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -7.291 28.786 -19.580 1.00 0.00 H new ATOM 0 HG LEU A 31 -5.380 30.143 -18.987 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.441 29.322 -17.783 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -4.892 29.384 -16.755 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.315 27.823 -17.387 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.623 28.710 -20.137 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -4.609 27.269 -19.788 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -5.214 28.511 -20.910 1.00 0.00 H new ATOM 503 N ALA A 32 -9.450 27.808 -17.484 1.00 0.00 N ATOM 504 CA ALA A 32 -10.896 27.628 -17.528 1.00 0.00 C ATOM 505 C ALA A 32 -11.598 28.549 -16.519 1.00 0.00 C ATOM 506 O ALA A 32 -12.777 28.853 -16.687 1.00 0.00 O ATOM 507 CB ALA A 32 -11.286 26.161 -17.295 1.00 0.00 C ATOM 0 H ALA A 32 -8.935 26.940 -17.338 1.00 0.00 H new ATOM 0 HA ALA A 32 -11.231 27.905 -18.528 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -12.371 26.062 -17.334 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -10.837 25.538 -18.068 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -10.928 25.840 -16.317 1.00 0.00 H new ATOM 513 N GLN A 33 -10.867 29.008 -15.492 1.00 0.00 N ATOM 514 CA GLN A 33 -11.339 29.922 -14.464 1.00 0.00 C ATOM 515 C GLN A 33 -11.016 31.364 -14.866 1.00 0.00 C ATOM 516 O GLN A 33 -11.783 32.276 -14.565 1.00 0.00 O ATOM 517 CB GLN A 33 -10.720 29.544 -13.108 1.00 0.00 C ATOM 518 CG GLN A 33 -11.808 29.495 -12.032 1.00 0.00 C ATOM 519 CD GLN A 33 -11.219 29.297 -10.638 1.00 0.00 C ATOM 520 OE1 GLN A 33 -11.355 28.231 -10.045 1.00 0.00 O ATOM 521 NE2 GLN A 33 -10.568 30.328 -10.100 1.00 0.00 N ATOM 0 H GLN A 33 -9.893 28.736 -15.358 1.00 0.00 H new ATOM 0 HA GLN A 33 -12.422 29.844 -14.363 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -10.226 28.575 -13.182 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -9.956 30.271 -12.832 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -12.384 30.420 -12.055 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -12.501 28.683 -12.252 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -10.474 31.200 -10.621 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -10.164 30.245 -9.167 1.00 0.00 H new ATOM 530 N GLY A 34 -9.886 31.556 -15.556 1.00 0.00 N ATOM 531 CA GLY A 34 -9.399 32.823 -16.075 1.00 0.00 C ATOM 532 C GLY A 34 -7.930 33.103 -15.751 1.00 0.00 C ATOM 533 O GLY A 34 -7.476 34.210 -16.033 1.00 0.00 O ATOM 0 H GLY A 34 -9.257 30.783 -15.775 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.531 32.836 -17.157 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -10.010 33.629 -15.670 1.00 0.00 H new ATOM 537 N ASP A 35 -7.179 32.154 -15.164 1.00 0.00 N ATOM 538 CA ASP A 35 -5.782 32.421 -14.795 1.00 0.00 C ATOM 539 C ASP A 35 -4.749 32.027 -15.863 1.00 0.00 C ATOM 540 O ASP A 35 -3.916 31.148 -15.657 1.00 0.00 O ATOM 541 CB ASP A 35 -5.462 31.857 -13.404 1.00 0.00 C ATOM 542 CG ASP A 35 -4.237 32.526 -12.777 1.00 0.00 C ATOM 543 OD1 ASP A 35 -3.396 33.056 -13.539 1.00 0.00 O ATOM 544 OD2 ASP A 35 -4.148 32.466 -11.532 1.00 0.00 O ATOM 0 H ASP A 35 -7.509 31.215 -14.940 1.00 0.00 H new ATOM 0 HA ASP A 35 -5.687 33.506 -14.742 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -6.324 31.995 -12.751 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -5.289 30.784 -13.480 1.00 0.00 H new ATOM 549 N TYR A 36 -4.784 32.727 -16.998 1.00 0.00 N ATOM 550 CA TYR A 36 -3.862 32.590 -18.126 1.00 0.00 C ATOM 551 C TYR A 36 -2.400 32.651 -17.697 1.00 0.00 C ATOM 552 O TYR A 36 -1.571 31.912 -18.227 1.00 0.00 O ATOM 553 CB TYR A 36 -4.212 33.611 -19.218 1.00 0.00 C ATOM 554 CG TYR A 36 -4.772 34.927 -18.712 1.00 0.00 C ATOM 555 CD1 TYR A 36 -3.917 35.923 -18.213 1.00 0.00 C ATOM 556 CD2 TYR A 36 -6.164 35.144 -18.730 1.00 0.00 C ATOM 557 CE1 TYR A 36 -4.453 37.131 -17.732 1.00 0.00 C ATOM 558 CE2 TYR A 36 -6.698 36.350 -18.250 1.00 0.00 C ATOM 559 CZ TYR A 36 -5.842 37.345 -17.751 1.00 0.00 C ATOM 560 OH TYR A 36 -6.360 38.518 -17.283 1.00 0.00 O ATOM 0 H TYR A 36 -5.493 33.442 -17.163 1.00 0.00 H new ATOM 0 HA TYR A 36 -3.988 31.594 -18.551 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -3.315 33.816 -19.803 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -4.938 33.161 -19.895 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -2.849 35.762 -18.199 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -6.823 34.379 -19.115 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -3.795 37.896 -17.347 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -7.766 36.512 -18.264 1.00 0.00 H new ATOM 0 HH TYR A 36 -7.336 38.502 -17.370 1.00 0.00 H new ATOM 570 N GLU A 37 -2.091 33.511 -16.730 1.00 0.00 N ATOM 571 CA GLU A 37 -0.743 33.664 -16.210 1.00 0.00 C ATOM 572 C GLU A 37 -0.274 32.355 -15.594 1.00 0.00 C ATOM 573 O GLU A 37 0.849 31.912 -15.836 1.00 0.00 O ATOM 574 CB GLU A 37 -0.633 34.852 -15.250 1.00 0.00 C ATOM 575 CG GLU A 37 -0.944 36.167 -15.981 1.00 0.00 C ATOM 576 CD GLU A 37 -0.251 37.357 -15.327 1.00 0.00 C ATOM 577 OE1 GLU A 37 0.990 37.427 -15.475 1.00 0.00 O ATOM 578 OE2 GLU A 37 -0.960 38.174 -14.705 1.00 0.00 O ATOM 0 H GLU A 37 -2.775 34.123 -16.285 1.00 0.00 H new ATOM 0 HA GLU A 37 -0.072 33.897 -17.036 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -1.325 34.720 -14.418 1.00 0.00 H new ATOM 0 HB3 GLU A 37 0.371 34.893 -14.827 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -0.627 36.088 -17.021 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.021 36.333 -15.988 1.00 0.00 H new ATOM 585 N LYS A 38 -1.161 31.723 -14.827 1.00 0.00 N ATOM 586 CA LYS A 38 -0.866 30.437 -14.222 1.00 0.00 C ATOM 587 C LYS A 38 -0.662 29.373 -15.292 1.00 0.00 C ATOM 588 O LYS A 38 0.146 28.472 -15.084 1.00 0.00 O ATOM 589 CB LYS A 38 -1.909 30.026 -13.172 1.00 0.00 C ATOM 590 CG LYS A 38 -1.498 30.487 -11.764 1.00 0.00 C ATOM 591 CD LYS A 38 -0.468 29.477 -11.237 1.00 0.00 C ATOM 592 CE LYS A 38 0.349 29.951 -10.037 1.00 0.00 C ATOM 593 NZ LYS A 38 1.428 28.981 -9.758 1.00 0.00 N ATOM 0 H LYS A 38 -2.090 32.086 -14.613 1.00 0.00 H new ATOM 0 HA LYS A 38 0.072 30.538 -13.676 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -2.877 30.457 -13.430 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -2.030 28.943 -13.181 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -1.071 31.490 -11.797 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -2.365 30.531 -11.105 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -0.989 28.560 -10.963 1.00 0.00 H new ATOM 0 HD3 LYS A 38 0.217 29.224 -12.046 1.00 0.00 H new ATOM 0 HE2 LYS A 38 0.774 30.934 -10.239 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -0.295 30.055 -9.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 1.737 29.081 -8.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 1.076 28.015 -9.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 2.232 29.164 -10.392 1.00 0.00 H new ATOM 607 N GLY A 39 -1.340 29.465 -16.444 1.00 0.00 N ATOM 608 CA GLY A 39 -1.098 28.500 -17.507 1.00 0.00 C ATOM 609 C GLY A 39 0.308 28.679 -18.047 1.00 0.00 C ATOM 610 O GLY A 39 0.949 27.698 -18.388 1.00 0.00 O ATOM 0 H GLY A 39 -2.039 30.178 -16.654 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -1.226 27.486 -17.128 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -1.826 28.635 -18.307 1.00 0.00 H new ATOM 614 N VAL A 40 0.805 29.915 -18.129 1.00 0.00 N ATOM 615 CA VAL A 40 2.149 30.130 -18.632 1.00 0.00 C ATOM 616 C VAL A 40 3.155 29.481 -17.678 1.00 0.00 C ATOM 617 O VAL A 40 4.046 28.766 -18.122 1.00 0.00 O ATOM 618 CB VAL A 40 2.425 31.633 -18.859 1.00 0.00 C ATOM 619 CG1 VAL A 40 3.869 31.860 -19.315 1.00 0.00 C ATOM 620 CG2 VAL A 40 1.472 32.286 -19.880 1.00 0.00 C ATOM 0 H VAL A 40 0.304 30.761 -17.858 1.00 0.00 H new ATOM 0 HA VAL A 40 2.256 29.655 -19.607 1.00 0.00 H new ATOM 0 HB VAL A 40 2.251 32.109 -17.894 1.00 0.00 H new ATOM 0 HG11 VAL A 40 4.039 32.926 -19.468 1.00 0.00 H new ATOM 0 HG12 VAL A 40 4.554 31.489 -18.552 1.00 0.00 H new ATOM 0 HG13 VAL A 40 4.044 31.327 -20.249 1.00 0.00 H new ATOM 0 HG21 VAL A 40 1.724 33.341 -19.990 1.00 0.00 H new ATOM 0 HG22 VAL A 40 1.574 31.787 -20.844 1.00 0.00 H new ATOM 0 HG23 VAL A 40 0.444 32.193 -19.530 1.00 0.00 H new ATOM 630 N ASP A 41 3.004 29.721 -16.375 1.00 0.00 N ATOM 631 CA ASP A 41 3.880 29.189 -15.332 1.00 0.00 C ATOM 632 C ASP A 41 3.837 27.661 -15.288 1.00 0.00 C ATOM 633 O ASP A 41 4.861 26.979 -15.365 1.00 0.00 O ATOM 634 CB ASP A 41 3.489 29.809 -13.975 1.00 0.00 C ATOM 635 CG ASP A 41 3.953 29.002 -12.765 1.00 0.00 C ATOM 636 OD1 ASP A 41 5.163 28.707 -12.697 1.00 0.00 O ATOM 637 OD2 ASP A 41 3.081 28.710 -11.913 1.00 0.00 O ATOM 0 H ASP A 41 2.252 30.304 -16.008 1.00 0.00 H new ATOM 0 HA ASP A 41 4.910 29.462 -15.561 1.00 0.00 H new ATOM 0 HB2 ASP A 41 3.909 30.813 -13.912 1.00 0.00 H new ATOM 0 HB3 ASP A 41 2.405 29.914 -13.934 1.00 0.00 H new ATOM 642 N HIS A 42 2.628 27.129 -15.146 1.00 0.00 N ATOM 643 CA HIS A 42 2.419 25.700 -15.030 1.00 0.00 C ATOM 644 C HIS A 42 2.716 24.961 -16.316 1.00 0.00 C ATOM 645 O HIS A 42 3.200 23.829 -16.266 1.00 0.00 O ATOM 646 CB HIS A 42 1.055 25.350 -14.430 1.00 0.00 C ATOM 647 CG HIS A 42 1.012 25.646 -12.954 1.00 0.00 C ATOM 648 ND1 HIS A 42 1.964 25.153 -12.073 1.00 0.00 N ATOM 649 CD2 HIS A 42 0.150 26.379 -12.182 1.00 0.00 C ATOM 650 CE1 HIS A 42 1.641 25.598 -10.848 1.00 0.00 C ATOM 651 NE2 HIS A 42 0.542 26.356 -10.843 1.00 0.00 N ATOM 0 H HIS A 42 1.770 27.679 -15.109 1.00 0.00 H new ATOM 0 HA HIS A 42 3.155 25.340 -14.311 1.00 0.00 H new ATOM 0 HB2 HIS A 42 0.276 25.917 -14.939 1.00 0.00 H new ATOM 0 HB3 HIS A 42 0.842 24.294 -14.597 1.00 0.00 H new ATOM 0 HD1 HIS A 42 2.761 24.563 -12.312 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -0.716 26.904 -12.559 1.00 0.00 H new ATOM 0 HE1 HIS A 42 2.211 25.367 -9.960 1.00 0.00 H new ATOM 659 N LEU A 43 2.469 25.587 -17.470 1.00 0.00 N ATOM 660 CA LEU A 43 2.807 24.904 -18.699 1.00 0.00 C ATOM 661 C LEU A 43 4.330 24.944 -18.766 1.00 0.00 C ATOM 662 O LEU A 43 4.934 23.922 -19.063 1.00 0.00 O ATOM 663 CB LEU A 43 2.118 25.495 -19.936 1.00 0.00 C ATOM 664 CG LEU A 43 2.045 24.456 -21.067 1.00 0.00 C ATOM 665 CD1 LEU A 43 0.721 23.679 -21.002 1.00 0.00 C ATOM 666 CD2 LEU A 43 2.105 25.152 -22.426 1.00 0.00 C ATOM 0 H LEU A 43 2.058 26.515 -17.570 1.00 0.00 H new ATOM 0 HA LEU A 43 2.440 23.878 -18.699 1.00 0.00 H new ATOM 0 HB2 LEU A 43 1.113 25.827 -19.675 1.00 0.00 H new ATOM 0 HB3 LEU A 43 2.665 26.374 -20.278 1.00 0.00 H new ATOM 0 HG LEU A 43 2.888 23.776 -20.946 1.00 0.00 H new ATOM 0 HD11 LEU A 43 0.688 22.948 -21.810 1.00 0.00 H new ATOM 0 HD12 LEU A 43 0.648 23.164 -20.044 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -0.113 24.373 -21.105 1.00 0.00 H new ATOM 0 HD21 LEU A 43 2.053 24.406 -23.219 1.00 0.00 H new ATOM 0 HD22 LEU A 43 1.265 25.841 -22.519 1.00 0.00 H new ATOM 0 HD23 LEU A 43 3.040 25.706 -22.510 1.00 0.00 H new ATOM 678 N THR A 44 4.960 26.091 -18.449 1.00 0.00 N ATOM 679 CA THR A 44 6.420 26.198 -18.458 1.00 0.00 C ATOM 680 C THR A 44 7.046 25.043 -17.661 1.00 0.00 C ATOM 681 O THR A 44 8.053 24.458 -18.068 1.00 0.00 O ATOM 682 CB THR A 44 6.928 27.571 -17.986 1.00 0.00 C ATOM 683 OG1 THR A 44 6.608 28.541 -18.961 1.00 0.00 O ATOM 684 CG2 THR A 44 8.453 27.576 -17.840 1.00 0.00 C ATOM 0 H THR A 44 4.477 26.950 -18.185 1.00 0.00 H new ATOM 0 HA THR A 44 6.744 26.113 -19.495 1.00 0.00 H new ATOM 0 HB THR A 44 6.461 27.787 -17.025 1.00 0.00 H new ATOM 0 HG1 THR A 44 5.669 28.805 -18.864 1.00 0.00 H new ATOM 0 HG21 THR A 44 8.783 28.559 -17.505 1.00 0.00 H new ATOM 0 HG22 THR A 44 8.751 26.825 -17.109 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.911 27.348 -18.802 1.00 0.00 H new ATOM 692 N ASN A 45 6.433 24.698 -16.524 1.00 0.00 N ATOM 693 CA ASN A 45 6.945 23.603 -15.700 1.00 0.00 C ATOM 694 C ASN A 45 6.783 22.272 -16.424 1.00 0.00 C ATOM 695 O ASN A 45 7.690 21.437 -16.434 1.00 0.00 O ATOM 696 CB ASN A 45 6.437 23.625 -14.253 1.00 0.00 C ATOM 697 CG ASN A 45 5.089 22.983 -13.921 1.00 0.00 C ATOM 698 OD1 ASN A 45 4.257 23.620 -13.285 1.00 0.00 O ATOM 699 ND2 ASN A 45 4.889 21.703 -14.240 1.00 0.00 N ATOM 0 H ASN A 45 5.596 25.153 -16.159 1.00 0.00 H new ATOM 0 HA ASN A 45 8.017 23.754 -15.571 1.00 0.00 H new ATOM 0 HB2 ASN A 45 7.192 23.140 -13.634 1.00 0.00 H new ATOM 0 HB3 ASN A 45 6.389 24.668 -13.939 1.00 0.00 H new ATOM 0 HD21 ASN A 45 4.029 21.234 -13.954 1.00 0.00 H new ATOM 0 HD22 ASN A 45 5.596 21.193 -14.770 1.00 0.00 H new ATOM 706 N ALA A 46 5.621 22.091 -17.056 1.00 0.00 N ATOM 707 CA ALA A 46 5.329 20.897 -17.834 1.00 0.00 C ATOM 708 C ALA A 46 6.456 20.706 -18.868 1.00 0.00 C ATOM 709 O ALA A 46 6.969 19.600 -19.023 1.00 0.00 O ATOM 710 CB ALA A 46 3.907 20.946 -18.409 1.00 0.00 C ATOM 0 H ALA A 46 4.860 22.770 -17.039 1.00 0.00 H new ATOM 0 HA ALA A 46 5.323 20.004 -17.208 1.00 0.00 H new ATOM 0 HB1 ALA A 46 3.716 20.041 -18.986 1.00 0.00 H new ATOM 0 HB2 ALA A 46 3.187 21.015 -17.594 1.00 0.00 H new ATOM 0 HB3 ALA A 46 3.806 21.817 -19.057 1.00 0.00 H new ATOM 716 N ILE A 47 6.885 21.790 -19.534 1.00 0.00 N ATOM 717 CA ILE A 47 7.998 21.760 -20.487 1.00 0.00 C ATOM 718 C ILE A 47 9.302 21.367 -19.802 1.00 0.00 C ATOM 719 O ILE A 47 10.110 20.641 -20.376 1.00 0.00 O ATOM 720 CB ILE A 47 8.214 23.113 -21.216 1.00 0.00 C ATOM 721 CG1 ILE A 47 7.150 23.394 -22.301 1.00 0.00 C ATOM 722 CG2 ILE A 47 9.633 23.248 -21.808 1.00 0.00 C ATOM 723 CD1 ILE A 47 5.825 23.866 -21.717 1.00 0.00 C ATOM 0 H ILE A 47 6.466 22.713 -19.424 1.00 0.00 H new ATOM 0 HA ILE A 47 7.721 21.012 -21.230 1.00 0.00 H new ATOM 0 HB ILE A 47 8.099 23.871 -20.441 1.00 0.00 H new ATOM 0 HG12 ILE A 47 7.529 24.150 -22.989 1.00 0.00 H new ATOM 0 HG13 ILE A 47 6.983 22.488 -22.884 1.00 0.00 H new ATOM 0 HG21 ILE A 47 9.729 24.213 -22.306 1.00 0.00 H new ATOM 0 HG22 ILE A 47 10.369 23.178 -21.007 1.00 0.00 H new ATOM 0 HG23 ILE A 47 9.804 22.449 -22.529 1.00 0.00 H new ATOM 0 HD11 ILE A 47 5.116 24.048 -22.524 1.00 0.00 H new ATOM 0 HD12 ILE A 47 5.428 23.100 -21.051 1.00 0.00 H new ATOM 0 HD13 ILE A 47 5.982 24.788 -21.157 1.00 0.00 H new ATOM 735 N ALA A 48 9.517 21.881 -18.594 1.00 0.00 N ATOM 736 CA ALA A 48 10.738 21.667 -17.837 1.00 0.00 C ATOM 737 C ALA A 48 10.938 20.199 -17.517 1.00 0.00 C ATOM 738 O ALA A 48 12.075 19.737 -17.454 1.00 0.00 O ATOM 739 CB ALA A 48 10.781 22.538 -16.579 1.00 0.00 C ATOM 0 H ALA A 48 8.836 22.466 -18.110 1.00 0.00 H new ATOM 0 HA ALA A 48 11.573 21.976 -18.465 1.00 0.00 H new ATOM 0 HB1 ALA A 48 11.709 22.351 -16.038 1.00 0.00 H new ATOM 0 HB2 ALA A 48 10.732 23.589 -16.863 1.00 0.00 H new ATOM 0 HB3 ALA A 48 9.933 22.295 -15.939 1.00 0.00 H new ATOM 745 N VAL A 49 9.833 19.472 -17.333 1.00 0.00 N ATOM 746 CA VAL A 49 9.890 18.058 -17.031 1.00 0.00 C ATOM 747 C VAL A 49 9.640 17.201 -18.270 1.00 0.00 C ATOM 748 O VAL A 49 9.949 16.011 -18.246 1.00 0.00 O ATOM 749 CB VAL A 49 8.951 17.740 -15.866 1.00 0.00 C ATOM 750 CG1 VAL A 49 9.222 18.707 -14.710 1.00 0.00 C ATOM 751 CG2 VAL A 49 7.462 17.782 -16.210 1.00 0.00 C ATOM 0 H VAL A 49 8.888 19.851 -17.390 1.00 0.00 H new ATOM 0 HA VAL A 49 10.900 17.801 -16.711 1.00 0.00 H new ATOM 0 HB VAL A 49 9.169 16.708 -15.590 1.00 0.00 H new ATOM 0 HG11 VAL A 49 8.552 18.479 -13.881 1.00 0.00 H new ATOM 0 HG12 VAL A 49 10.256 18.601 -14.381 1.00 0.00 H new ATOM 0 HG13 VAL A 49 9.051 19.730 -15.044 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.877 17.543 -15.322 1.00 0.00 H new ATOM 0 HG22 VAL A 49 7.198 18.779 -16.562 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.249 17.053 -16.992 1.00 0.00 H new ATOM 761 N CYS A 50 9.099 17.780 -19.352 1.00 0.00 N ATOM 762 CA CYS A 50 8.852 17.028 -20.577 1.00 0.00 C ATOM 763 C CYS A 50 10.129 17.012 -21.417 1.00 0.00 C ATOM 764 O CYS A 50 10.589 15.945 -21.817 1.00 0.00 O ATOM 765 CB CYS A 50 7.651 17.613 -21.322 1.00 0.00 C ATOM 766 SG CYS A 50 7.480 16.814 -22.937 1.00 0.00 S ATOM 0 H CYS A 50 8.828 18.762 -19.398 1.00 0.00 H new ATOM 0 HA CYS A 50 8.596 15.994 -20.348 1.00 0.00 H new ATOM 0 HB2 CYS A 50 6.743 17.468 -20.737 1.00 0.00 H new ATOM 0 HB3 CYS A 50 7.780 18.688 -21.450 1.00 0.00 H new ATOM 0 HG CYS A 50 6.457 17.315 -23.563 1.00 0.00 H new ATOM 772 N GLY A 51 10.709 18.191 -21.673 1.00 0.00 N ATOM 773 CA GLY A 51 11.944 18.322 -22.438 1.00 0.00 C ATOM 774 C GLY A 51 11.716 18.398 -23.948 1.00 0.00 C ATOM 775 O GLY A 51 12.674 18.555 -24.701 1.00 0.00 O ATOM 0 H GLY A 51 10.329 19.081 -21.352 1.00 0.00 H new ATOM 0 HA2 GLY A 51 12.472 19.218 -22.112 1.00 0.00 H new ATOM 0 HA3 GLY A 51 12.591 17.473 -22.218 1.00 0.00 H new ATOM 779 N GLN A 52 10.458 18.304 -24.391 1.00 0.00 N ATOM 780 CA GLN A 52 10.067 18.380 -25.796 1.00 0.00 C ATOM 781 C GLN A 52 8.975 19.446 -25.891 1.00 0.00 C ATOM 782 O GLN A 52 7.831 19.125 -26.220 1.00 0.00 O ATOM 783 CB GLN A 52 9.632 16.984 -26.276 1.00 0.00 C ATOM 784 CG GLN A 52 9.755 16.861 -27.802 1.00 0.00 C ATOM 785 CD GLN A 52 11.199 16.766 -28.298 1.00 0.00 C ATOM 786 OE1 GLN A 52 12.115 16.481 -27.534 1.00 0.00 O ATOM 787 NE2 GLN A 52 11.410 17.008 -29.592 1.00 0.00 N ATOM 0 H GLN A 52 9.665 18.169 -23.763 1.00 0.00 H new ATOM 0 HA GLN A 52 10.884 18.674 -26.455 1.00 0.00 H new ATOM 0 HB2 GLN A 52 10.247 16.223 -25.796 1.00 0.00 H new ATOM 0 HB3 GLN A 52 8.601 16.797 -25.975 1.00 0.00 H new ATOM 0 HG2 GLN A 52 9.208 15.977 -28.131 1.00 0.00 H new ATOM 0 HG3 GLN A 52 9.277 17.723 -28.267 1.00 0.00 H new ATOM 0 HE21 GLN A 52 10.626 17.243 -30.201 1.00 0.00 H new ATOM 0 HE22 GLN A 52 12.355 16.959 -29.973 1.00 0.00 H new ATOM 796 N PRO A 53 9.305 20.719 -25.591 1.00 0.00 N ATOM 797 CA PRO A 53 8.342 21.801 -25.621 1.00 0.00 C ATOM 798 C PRO A 53 7.530 21.857 -26.898 1.00 0.00 C ATOM 799 O PRO A 53 6.313 21.831 -26.845 1.00 0.00 O ATOM 800 CB PRO A 53 9.128 23.105 -25.423 1.00 0.00 C ATOM 801 CG PRO A 53 10.585 22.713 -25.645 1.00 0.00 C ATOM 802 CD PRO A 53 10.602 21.259 -25.189 1.00 0.00 C ATOM 0 HA PRO A 53 7.611 21.642 -24.829 1.00 0.00 H new ATOM 0 HB2 PRO A 53 8.811 23.870 -26.131 1.00 0.00 H new ATOM 0 HB3 PRO A 53 8.975 23.512 -24.424 1.00 0.00 H new ATOM 0 HG2 PRO A 53 10.879 22.815 -26.690 1.00 0.00 H new ATOM 0 HG3 PRO A 53 11.266 23.331 -25.060 1.00 0.00 H new ATOM 0 HD2 PRO A 53 11.420 20.709 -25.655 1.00 0.00 H new ATOM 0 HD3 PRO A 53 10.743 21.186 -24.111 1.00 0.00 H new ATOM 810 N GLN A 54 8.210 21.957 -28.033 1.00 0.00 N ATOM 811 CA GLN A 54 7.595 22.101 -29.346 1.00 0.00 C ATOM 812 C GLN A 54 6.635 20.960 -29.670 1.00 0.00 C ATOM 813 O GLN A 54 5.533 21.219 -30.153 1.00 0.00 O ATOM 814 CB GLN A 54 8.679 22.298 -30.417 1.00 0.00 C ATOM 815 CG GLN A 54 9.652 23.460 -30.114 1.00 0.00 C ATOM 816 CD GLN A 54 10.600 23.732 -31.281 1.00 0.00 C ATOM 817 OE1 GLN A 54 10.676 22.956 -32.229 1.00 0.00 O ATOM 818 NE2 GLN A 54 11.338 24.841 -31.214 1.00 0.00 N ATOM 0 H GLN A 54 9.229 21.940 -28.067 1.00 0.00 H new ATOM 0 HA GLN A 54 6.974 22.996 -29.336 1.00 0.00 H new ATOM 0 HB2 GLN A 54 9.250 21.375 -30.517 1.00 0.00 H new ATOM 0 HB3 GLN A 54 8.198 22.480 -31.378 1.00 0.00 H new ATOM 0 HG2 GLN A 54 9.082 24.362 -29.893 1.00 0.00 H new ATOM 0 HG3 GLN A 54 10.233 23.223 -29.223 1.00 0.00 H new ATOM 0 HE21 GLN A 54 11.250 25.464 -30.412 1.00 0.00 H new ATOM 0 HE22 GLN A 54 11.990 25.066 -31.965 1.00 0.00 H new ATOM 827 N GLN A 55 7.020 19.707 -29.390 1.00 0.00 N ATOM 828 CA GLN A 55 6.120 18.586 -29.636 1.00 0.00 C ATOM 829 C GLN A 55 4.868 18.779 -28.788 1.00 0.00 C ATOM 830 O GLN A 55 3.753 18.562 -29.258 1.00 0.00 O ATOM 831 CB GLN A 55 6.790 17.230 -29.371 1.00 0.00 C ATOM 832 CG GLN A 55 5.867 16.024 -29.608 1.00 0.00 C ATOM 833 CD GLN A 55 5.286 15.964 -31.020 1.00 0.00 C ATOM 834 OE1 GLN A 55 5.875 15.359 -31.910 1.00 0.00 O ATOM 835 NE2 GLN A 55 4.119 16.574 -31.228 1.00 0.00 N ATOM 0 H GLN A 55 7.929 19.453 -29.002 1.00 0.00 H new ATOM 0 HA GLN A 55 5.847 18.572 -30.691 1.00 0.00 H new ATOM 0 HB2 GLN A 55 7.666 17.137 -30.013 1.00 0.00 H new ATOM 0 HB3 GLN A 55 7.146 17.206 -28.341 1.00 0.00 H new ATOM 0 HG2 GLN A 55 6.424 15.107 -29.415 1.00 0.00 H new ATOM 0 HG3 GLN A 55 5.049 16.057 -28.889 1.00 0.00 H new ATOM 0 HE21 GLN A 55 3.658 17.068 -30.464 1.00 0.00 H new ATOM 0 HE22 GLN A 55 3.687 16.547 -32.152 1.00 0.00 H new ATOM 844 N LEU A 56 5.052 19.207 -27.538 1.00 0.00 N ATOM 845 CA LEU A 56 3.936 19.460 -26.654 1.00 0.00 C ATOM 846 C LEU A 56 3.076 20.606 -27.196 1.00 0.00 C ATOM 847 O LEU A 56 1.860 20.491 -27.243 1.00 0.00 O ATOM 848 CB LEU A 56 4.406 19.707 -25.210 1.00 0.00 C ATOM 849 CG LEU A 56 3.232 19.915 -24.244 1.00 0.00 C ATOM 850 CD1 LEU A 56 2.450 18.612 -24.013 1.00 0.00 C ATOM 851 CD2 LEU A 56 3.778 20.460 -22.920 1.00 0.00 C ATOM 0 H LEU A 56 5.967 19.383 -27.124 1.00 0.00 H new ATOM 0 HA LEU A 56 3.309 18.569 -26.622 1.00 0.00 H new ATOM 0 HB2 LEU A 56 5.004 18.860 -24.875 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.054 20.583 -25.186 1.00 0.00 H new ATOM 0 HG LEU A 56 2.535 20.629 -24.682 1.00 0.00 H new ATOM 0 HD11 LEU A 56 1.627 18.799 -23.324 1.00 0.00 H new ATOM 0 HD12 LEU A 56 2.054 18.252 -24.963 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.114 17.859 -23.589 1.00 0.00 H new ATOM 0 HD21 LEU A 56 2.955 20.613 -22.222 1.00 0.00 H new ATOM 0 HD22 LEU A 56 4.484 19.746 -22.496 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.284 21.409 -23.098 1.00 0.00 H new ATOM 863 N LEU A 57 3.674 21.719 -27.623 1.00 0.00 N ATOM 864 CA LEU A 57 2.890 22.841 -28.140 1.00 0.00 C ATOM 865 C LEU A 57 2.071 22.382 -29.351 1.00 0.00 C ATOM 866 O LEU A 57 0.923 22.795 -29.521 1.00 0.00 O ATOM 867 CB LEU A 57 3.741 24.109 -28.368 1.00 0.00 C ATOM 868 CG LEU A 57 4.631 24.558 -27.180 1.00 0.00 C ATOM 869 CD1 LEU A 57 5.143 25.990 -27.353 1.00 0.00 C ATOM 870 CD2 LEU A 57 3.963 24.438 -25.799 1.00 0.00 C ATOM 0 H LEU A 57 4.683 21.867 -27.622 1.00 0.00 H new ATOM 0 HA LEU A 57 2.174 23.159 -27.382 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.383 23.940 -29.233 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.071 24.930 -28.624 1.00 0.00 H new ATOM 0 HG LEU A 57 5.464 23.855 -27.203 1.00 0.00 H new ATOM 0 HD11 LEU A 57 5.762 26.261 -26.497 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.736 26.057 -28.265 1.00 0.00 H new ATOM 0 HD13 LEU A 57 4.297 26.673 -27.420 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.657 24.773 -25.029 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.066 25.057 -25.774 1.00 0.00 H new ATOM 0 HD23 LEU A 57 3.692 23.398 -25.615 1.00 0.00 H new ATOM 882 N GLN A 58 2.636 21.479 -30.162 1.00 0.00 N ATOM 883 CA GLN A 58 1.926 20.900 -31.292 1.00 0.00 C ATOM 884 C GLN A 58 0.756 20.065 -30.757 1.00 0.00 C ATOM 885 O GLN A 58 -0.362 20.170 -31.257 1.00 0.00 O ATOM 886 CB GLN A 58 2.879 20.076 -32.178 1.00 0.00 C ATOM 887 CG GLN A 58 2.203 19.560 -33.455 1.00 0.00 C ATOM 888 CD GLN A 58 1.712 20.693 -34.351 1.00 0.00 C ATOM 889 OE1 GLN A 58 0.515 20.847 -34.565 1.00 0.00 O ATOM 890 NE2 GLN A 58 2.635 21.498 -34.876 1.00 0.00 N ATOM 0 H GLN A 58 3.590 21.136 -30.049 1.00 0.00 H new ATOM 0 HA GLN A 58 1.528 21.689 -31.929 1.00 0.00 H new ATOM 0 HB2 GLN A 58 3.738 20.690 -32.449 1.00 0.00 H new ATOM 0 HB3 GLN A 58 3.260 19.230 -31.606 1.00 0.00 H new ATOM 0 HG2 GLN A 58 2.907 18.940 -34.010 1.00 0.00 H new ATOM 0 HG3 GLN A 58 1.361 18.923 -33.185 1.00 0.00 H new ATOM 0 HE21 GLN A 58 3.623 21.340 -34.676 1.00 0.00 H new ATOM 0 HE22 GLN A 58 2.354 22.272 -35.478 1.00 0.00 H new ATOM 899 N VAL A 59 1.012 19.247 -29.728 1.00 0.00 N ATOM 900 CA VAL A 59 0.013 18.392 -29.100 1.00 0.00 C ATOM 901 C VAL A 59 -1.142 19.180 -28.513 1.00 0.00 C ATOM 902 O VAL A 59 -2.285 18.732 -28.559 1.00 0.00 O ATOM 903 CB VAL A 59 0.635 17.407 -28.088 1.00 0.00 C ATOM 904 CG1 VAL A 59 0.502 17.682 -26.568 1.00 0.00 C ATOM 905 CG2 VAL A 59 0.020 16.059 -28.328 1.00 0.00 C ATOM 0 H VAL A 59 1.937 19.164 -29.306 1.00 0.00 H new ATOM 0 HA VAL A 59 -0.413 17.782 -29.897 1.00 0.00 H new ATOM 0 HB VAL A 59 1.703 17.505 -28.284 1.00 0.00 H new ATOM 0 HG11 VAL A 59 0.998 16.888 -26.010 1.00 0.00 H new ATOM 0 HG12 VAL A 59 0.967 18.638 -26.329 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -0.553 17.714 -26.295 1.00 0.00 H new ATOM 0 HG21 VAL A 59 0.440 15.338 -27.627 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -1.059 16.120 -28.184 1.00 0.00 H new ATOM 0 HG23 VAL A 59 0.232 15.739 -29.348 1.00 0.00 H new ATOM 915 N LEU A 60 -0.854 20.378 -28.015 1.00 0.00 N ATOM 916 CA LEU A 60 -1.876 21.211 -27.419 1.00 0.00 C ATOM 917 C LEU A 60 -2.660 21.826 -28.573 1.00 0.00 C ATOM 918 O LEU A 60 -3.880 21.904 -28.478 1.00 0.00 O ATOM 919 CB LEU A 60 -1.199 22.346 -26.630 1.00 0.00 C ATOM 920 CG LEU A 60 -0.890 22.086 -25.146 1.00 0.00 C ATOM 921 CD1 LEU A 60 -2.128 22.379 -24.286 1.00 0.00 C ATOM 922 CD2 LEU A 60 -0.449 20.666 -24.802 1.00 0.00 C ATOM 0 H LEU A 60 0.080 20.788 -28.015 1.00 0.00 H new ATOM 0 HA LEU A 60 -2.519 20.636 -26.752 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.263 22.594 -27.131 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -1.837 23.228 -26.692 1.00 0.00 H new ATOM 0 HG LEU A 60 -0.052 22.751 -24.937 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.896 22.191 -23.238 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -2.420 23.422 -24.412 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -2.949 21.733 -24.597 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -0.257 20.594 -23.731 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -1.236 19.964 -25.078 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.461 20.425 -25.351 1.00 0.00 H new ATOM 934 N GLN A 61 -1.999 22.213 -29.670 1.00 0.00 N ATOM 935 CA GLN A 61 -2.699 22.780 -30.822 1.00 0.00 C ATOM 936 C GLN A 61 -3.654 21.751 -31.430 1.00 0.00 C ATOM 937 O GLN A 61 -4.759 22.105 -31.839 1.00 0.00 O ATOM 938 CB GLN A 61 -1.694 23.353 -31.844 1.00 0.00 C ATOM 939 CG GLN A 61 -2.321 24.183 -32.979 1.00 0.00 C ATOM 940 CD GLN A 61 -3.079 23.351 -34.012 1.00 0.00 C ATOM 941 OE1 GLN A 61 -2.684 22.235 -34.337 1.00 0.00 O ATOM 942 NE2 GLN A 61 -4.176 23.892 -34.542 1.00 0.00 N ATOM 0 H GLN A 61 -0.988 22.144 -29.782 1.00 0.00 H new ATOM 0 HA GLN A 61 -3.313 23.618 -30.492 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -0.975 23.977 -31.313 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -1.136 22.527 -32.284 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -3.003 24.915 -32.546 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -1.533 24.741 -33.485 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -4.478 24.822 -34.251 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -4.713 23.376 -35.239 1.00 0.00 H new ATOM 951 N GLN A 62 -3.229 20.484 -31.481 1.00 0.00 N ATOM 952 CA GLN A 62 -4.002 19.387 -32.047 1.00 0.00 C ATOM 953 C GLN A 62 -5.313 19.191 -31.288 1.00 0.00 C ATOM 954 O GLN A 62 -6.345 18.943 -31.909 1.00 0.00 O ATOM 955 CB GLN A 62 -3.143 18.109 -32.174 1.00 0.00 C ATOM 956 CG GLN A 62 -3.495 16.925 -31.252 1.00 0.00 C ATOM 957 CD GLN A 62 -4.782 16.201 -31.650 1.00 0.00 C ATOM 958 OE1 GLN A 62 -4.982 15.873 -32.816 1.00 0.00 O ATOM 959 NE2 GLN A 62 -5.659 15.938 -30.681 1.00 0.00 N ATOM 0 H GLN A 62 -2.320 20.193 -31.122 1.00 0.00 H new ATOM 0 HA GLN A 62 -4.292 19.644 -33.066 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -3.204 17.763 -33.206 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -2.104 18.382 -31.991 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -2.670 16.212 -31.259 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -3.594 17.289 -30.229 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -5.461 16.225 -29.722 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -6.528 15.450 -30.898 1.00 0.00 H new ATOM 968 N THR A 63 -5.283 19.303 -29.954 1.00 0.00 N ATOM 969 CA THR A 63 -6.495 19.125 -29.168 1.00 0.00 C ATOM 970 C THR A 63 -7.363 20.378 -29.187 1.00 0.00 C ATOM 971 O THR A 63 -8.585 20.265 -29.135 1.00 0.00 O ATOM 972 CB THR A 63 -6.202 18.625 -27.750 1.00 0.00 C ATOM 973 OG1 THR A 63 -7.410 18.298 -27.092 1.00 0.00 O ATOM 974 CG2 THR A 63 -5.404 19.602 -26.895 1.00 0.00 C ATOM 0 H THR A 63 -4.446 19.512 -29.411 1.00 0.00 H new ATOM 0 HA THR A 63 -7.076 18.336 -29.645 1.00 0.00 H new ATOM 0 HB THR A 63 -5.575 17.741 -27.871 1.00 0.00 H new ATOM 0 HG1 THR A 63 -7.213 17.978 -26.187 1.00 0.00 H new ATOM 0 HG21 THR A 63 -5.240 19.171 -25.907 1.00 0.00 H new ATOM 0 HG22 THR A 63 -4.442 19.799 -27.369 1.00 0.00 H new ATOM 0 HG23 THR A 63 -5.958 20.536 -26.796 1.00 0.00 H new ATOM 982 N LEU A 64 -6.736 21.558 -29.251 1.00 0.00 N ATOM 983 CA LEU A 64 -7.441 22.838 -29.249 1.00 0.00 C ATOM 984 C LEU A 64 -6.425 23.967 -29.433 1.00 0.00 C ATOM 985 O LEU A 64 -5.452 23.995 -28.691 1.00 0.00 O ATOM 986 CB LEU A 64 -8.208 22.984 -27.915 1.00 0.00 C ATOM 987 CG LEU A 64 -8.635 24.417 -27.544 1.00 0.00 C ATOM 988 CD1 LEU A 64 -10.065 24.414 -26.990 1.00 0.00 C ATOM 989 CD2 LEU A 64 -7.702 25.002 -26.475 1.00 0.00 C ATOM 0 H LEU A 64 -5.722 21.649 -29.306 1.00 0.00 H new ATOM 0 HA LEU A 64 -8.159 22.886 -30.068 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -9.100 22.359 -27.959 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -7.583 22.591 -27.113 1.00 0.00 H new ATOM 0 HG LEU A 64 -8.583 25.026 -28.447 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.357 25.432 -26.731 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -10.747 24.022 -27.745 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -10.109 23.786 -26.100 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -8.022 26.014 -26.228 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -7.739 24.381 -25.580 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -6.681 25.027 -26.857 1.00 0.00 H new ATOM 1001 N PRO A 65 -6.608 24.909 -30.376 1.00 0.00 N ATOM 1002 CA PRO A 65 -5.668 26.007 -30.574 1.00 0.00 C ATOM 1003 C PRO A 65 -5.598 26.869 -29.303 1.00 0.00 C ATOM 1004 O PRO A 65 -6.593 27.499 -28.951 1.00 0.00 O ATOM 1005 CB PRO A 65 -6.188 26.784 -31.789 1.00 0.00 C ATOM 1006 CG PRO A 65 -7.677 26.442 -31.835 1.00 0.00 C ATOM 1007 CD PRO A 65 -7.719 25.009 -31.308 1.00 0.00 C ATOM 0 HA PRO A 65 -4.650 25.665 -30.759 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -6.028 27.856 -31.676 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -5.680 26.481 -32.704 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -8.265 27.117 -31.214 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -8.076 26.511 -32.847 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -8.667 24.800 -30.813 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -7.617 24.289 -32.120 1.00 0.00 H new ATOM 1015 N PRO A 66 -4.455 26.900 -28.594 1.00 0.00 N ATOM 1016 CA PRO A 66 -4.292 27.644 -27.354 1.00 0.00 C ATOM 1017 C PRO A 66 -4.035 29.139 -27.600 1.00 0.00 C ATOM 1018 O PRO A 66 -3.011 29.490 -28.179 1.00 0.00 O ATOM 1019 CB PRO A 66 -3.118 26.946 -26.666 1.00 0.00 C ATOM 1020 CG PRO A 66 -2.222 26.515 -27.830 1.00 0.00 C ATOM 1021 CD PRO A 66 -3.230 26.178 -28.919 1.00 0.00 C ATOM 0 HA PRO A 66 -5.192 27.638 -26.739 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -2.595 27.618 -25.985 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -3.449 26.091 -26.077 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -1.545 27.312 -28.137 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -1.605 25.655 -27.569 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -2.855 26.474 -29.899 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -3.413 25.104 -28.959 1.00 0.00 H new ATOM 1029 N PRO A 67 -4.924 30.050 -27.162 1.00 0.00 N ATOM 1030 CA PRO A 67 -4.709 31.482 -27.324 1.00 0.00 C ATOM 1031 C PRO A 67 -3.687 31.955 -26.280 1.00 0.00 C ATOM 1032 O PRO A 67 -2.809 32.761 -26.578 1.00 0.00 O ATOM 1033 CB PRO A 67 -6.084 32.117 -27.114 1.00 0.00 C ATOM 1034 CG PRO A 67 -6.783 31.164 -26.143 1.00 0.00 C ATOM 1035 CD PRO A 67 -6.182 29.794 -26.470 1.00 0.00 C ATOM 0 HA PRO A 67 -4.308 31.755 -28.300 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -6.001 33.121 -26.699 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -6.632 32.204 -28.052 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -6.597 31.444 -25.106 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -7.864 31.170 -26.286 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -6.014 29.217 -25.561 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -6.859 29.213 -27.097 1.00 0.00 H new ATOM 1043 N VAL A 68 -3.805 31.430 -25.055 1.00 0.00 N ATOM 1044 CA VAL A 68 -2.950 31.708 -23.906 1.00 0.00 C ATOM 1045 C VAL A 68 -1.500 31.431 -24.265 1.00 0.00 C ATOM 1046 O VAL A 68 -0.621 32.217 -23.936 1.00 0.00 O ATOM 1047 CB VAL A 68 -3.385 30.869 -22.696 1.00 0.00 C ATOM 1048 CG1 VAL A 68 -2.285 30.933 -21.634 1.00 0.00 C ATOM 1049 CG2 VAL A 68 -4.714 31.414 -22.164 1.00 0.00 C ATOM 0 H VAL A 68 -4.543 30.762 -24.831 1.00 0.00 H new ATOM 0 HA VAL A 68 -3.047 32.760 -23.636 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.534 29.826 -22.976 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -2.581 30.341 -20.768 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -1.358 30.535 -22.046 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -2.132 31.969 -21.330 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -5.031 30.824 -21.304 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.587 32.454 -21.863 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.471 31.352 -22.945 1.00 0.00 H new ATOM 1059 N PHE A 69 -1.274 30.317 -24.956 1.00 0.00 N ATOM 1060 CA PHE A 69 0.039 29.915 -25.461 1.00 0.00 C ATOM 1061 C PHE A 69 0.771 31.109 -26.075 1.00 0.00 C ATOM 1062 O PHE A 69 1.961 31.281 -25.836 1.00 0.00 O ATOM 1063 CB PHE A 69 -0.145 28.769 -26.459 1.00 0.00 C ATOM 1064 CG PHE A 69 0.701 28.765 -27.718 1.00 0.00 C ATOM 1065 CD1 PHE A 69 0.280 29.514 -28.833 1.00 0.00 C ATOM 1066 CD2 PHE A 69 1.886 28.013 -27.789 1.00 0.00 C ATOM 1067 CE1 PHE A 69 1.038 29.518 -30.015 1.00 0.00 C ATOM 1068 CE2 PHE A 69 2.643 28.017 -28.976 1.00 0.00 C ATOM 1069 CZ PHE A 69 2.221 28.768 -30.086 1.00 0.00 C ATOM 0 H PHE A 69 -2.013 29.653 -25.186 1.00 0.00 H new ATOM 0 HA PHE A 69 0.663 29.560 -24.641 1.00 0.00 H new ATOM 0 HB2 PHE A 69 0.043 27.835 -25.930 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -1.192 28.758 -26.763 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -0.632 30.090 -28.779 1.00 0.00 H new ATOM 0 HD2 PHE A 69 2.214 27.435 -26.938 1.00 0.00 H new ATOM 0 HE1 PHE A 69 0.711 30.097 -30.866 1.00 0.00 H new ATOM 0 HE2 PHE A 69 3.554 27.439 -29.034 1.00 0.00 H new ATOM 0 HZ PHE A 69 2.807 28.768 -30.993 1.00 0.00 H new ATOM 1079 N GLN A 70 0.055 31.938 -26.841 1.00 0.00 N ATOM 1080 CA GLN A 70 0.634 33.123 -27.484 1.00 0.00 C ATOM 1081 C GLN A 70 1.238 34.068 -26.437 1.00 0.00 C ATOM 1082 O GLN A 70 2.303 34.650 -26.633 1.00 0.00 O ATOM 1083 CB GLN A 70 -0.434 33.852 -28.310 1.00 0.00 C ATOM 1084 CG GLN A 70 0.181 34.888 -29.260 1.00 0.00 C ATOM 1085 CD GLN A 70 -0.888 35.770 -29.895 1.00 0.00 C ATOM 1086 OE1 GLN A 70 -0.784 36.993 -29.874 1.00 0.00 O ATOM 1087 NE2 GLN A 70 -1.933 35.159 -30.453 1.00 0.00 N ATOM 0 H GLN A 70 -0.938 31.808 -27.033 1.00 0.00 H new ATOM 0 HA GLN A 70 1.433 32.798 -28.151 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -1.005 33.125 -28.887 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -1.136 34.347 -27.639 1.00 0.00 H new ATOM 0 HG2 GLN A 70 0.889 35.510 -28.712 1.00 0.00 H new ATOM 0 HG3 GLN A 70 0.744 34.377 -30.041 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -1.988 34.140 -30.453 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -2.678 35.710 -30.880 1.00 0.00 H new ATOM 1096 N MET A 71 0.533 34.200 -25.315 1.00 0.00 N ATOM 1097 CA MET A 71 0.897 35.011 -24.171 1.00 0.00 C ATOM 1098 C MET A 71 2.046 34.321 -23.443 1.00 0.00 C ATOM 1099 O MET A 71 2.939 35.001 -22.958 1.00 0.00 O ATOM 1100 CB MET A 71 -0.320 35.300 -23.274 1.00 0.00 C ATOM 1101 CG MET A 71 -1.541 35.820 -24.059 1.00 0.00 C ATOM 1102 SD MET A 71 -2.697 36.846 -23.112 1.00 0.00 S ATOM 1103 CE MET A 71 -3.199 35.670 -21.838 1.00 0.00 C ATOM 0 H MET A 71 -0.354 33.715 -25.179 1.00 0.00 H new ATOM 0 HA MET A 71 1.241 35.994 -24.493 1.00 0.00 H new ATOM 0 HB2 MET A 71 -0.598 34.389 -22.744 1.00 0.00 H new ATOM 0 HB3 MET A 71 -0.041 36.035 -22.519 1.00 0.00 H new ATOM 0 HG2 MET A 71 -1.184 36.398 -24.912 1.00 0.00 H new ATOM 0 HG3 MET A 71 -2.085 34.965 -24.459 1.00 0.00 H new ATOM 0 HE1 MET A 71 -4.073 36.055 -21.312 1.00 0.00 H new ATOM 0 HE2 MET A 71 -3.446 34.715 -22.301 1.00 0.00 H new ATOM 0 HE3 MET A 71 -2.382 35.529 -21.130 1.00 0.00 H new ATOM 1113 N LEU A 72 2.075 32.984 -23.398 1.00 0.00 N ATOM 1114 CA LEU A 72 3.185 32.241 -22.823 1.00 0.00 C ATOM 1115 C LEU A 72 4.438 32.621 -23.594 1.00 0.00 C ATOM 1116 O LEU A 72 5.479 32.893 -23.000 1.00 0.00 O ATOM 1117 CB LEU A 72 2.892 30.717 -22.777 1.00 0.00 C ATOM 1118 CG LEU A 72 3.835 29.731 -23.501 1.00 0.00 C ATOM 1119 CD1 LEU A 72 5.237 29.630 -22.878 1.00 0.00 C ATOM 1120 CD2 LEU A 72 3.231 28.324 -23.407 1.00 0.00 C ATOM 0 H LEU A 72 1.327 32.394 -23.761 1.00 0.00 H new ATOM 0 HA LEU A 72 3.338 32.505 -21.777 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.859 30.424 -21.728 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.891 30.566 -23.182 1.00 0.00 H new ATOM 0 HG LEU A 72 3.936 30.106 -24.519 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.837 28.918 -23.445 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.717 30.608 -22.902 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.153 29.292 -21.845 1.00 0.00 H new ATOM 0 HD21 LEU A 72 3.884 27.613 -23.913 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.130 28.041 -22.359 1.00 0.00 H new ATOM 0 HD23 LEU A 72 2.250 28.317 -23.881 1.00 0.00 H new ATOM 1132 N LEU A 73 4.324 32.668 -24.922 1.00 0.00 N ATOM 1133 CA LEU A 73 5.467 33.016 -25.755 1.00 0.00 C ATOM 1134 C LEU A 73 5.920 34.455 -25.555 1.00 0.00 C ATOM 1135 O LEU A 73 7.097 34.757 -25.732 1.00 0.00 O ATOM 1136 CB LEU A 73 5.202 32.796 -27.248 1.00 0.00 C ATOM 1137 CG LEU A 73 4.722 31.412 -27.705 1.00 0.00 C ATOM 1138 CD1 LEU A 73 4.647 31.474 -29.226 1.00 0.00 C ATOM 1139 CD2 LEU A 73 5.605 30.250 -27.243 1.00 0.00 C ATOM 0 H LEU A 73 3.464 32.472 -25.434 1.00 0.00 H new ATOM 0 HA LEU A 73 6.259 32.341 -25.430 1.00 0.00 H new ATOM 0 HB2 LEU A 73 4.458 33.527 -27.565 1.00 0.00 H new ATOM 0 HB3 LEU A 73 6.122 33.023 -27.786 1.00 0.00 H new ATOM 0 HG LEU A 73 3.756 31.201 -27.247 1.00 0.00 H new ATOM 0 HD11 LEU A 73 4.309 30.513 -29.613 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.945 32.252 -29.524 1.00 0.00 H new ATOM 0 HD13 LEU A 73 5.634 31.701 -29.630 1.00 0.00 H new ATOM 0 HD21 LEU A 73 5.192 29.311 -27.611 1.00 0.00 H new ATOM 0 HD22 LEU A 73 6.613 30.381 -27.635 1.00 0.00 H new ATOM 0 HD23 LEU A 73 5.639 30.230 -26.154 1.00 0.00 H new ATOM 1151 N THR A 74 4.983 35.334 -25.202 1.00 0.00 N ATOM 1152 CA THR A 74 5.261 36.745 -24.987 1.00 0.00 C ATOM 1153 C THR A 74 5.727 36.994 -23.553 1.00 0.00 C ATOM 1154 O THR A 74 6.416 37.978 -23.297 1.00 0.00 O ATOM 1155 CB THR A 74 4.122 37.647 -25.493 1.00 0.00 C ATOM 1156 OG1 THR A 74 4.649 38.799 -26.123 1.00 0.00 O ATOM 1157 CG2 THR A 74 3.214 38.123 -24.370 1.00 0.00 C ATOM 0 H THR A 74 4.005 35.081 -25.057 1.00 0.00 H new ATOM 0 HA THR A 74 6.105 37.043 -25.609 1.00 0.00 H new ATOM 0 HB THR A 74 3.544 37.041 -26.190 1.00 0.00 H new ATOM 0 HG1 THR A 74 3.914 39.363 -26.442 1.00 0.00 H new ATOM 0 HG21 THR A 74 2.428 38.756 -24.781 1.00 0.00 H new ATOM 0 HG22 THR A 74 2.765 37.262 -23.875 1.00 0.00 H new ATOM 0 HG23 THR A 74 3.798 38.693 -23.647 1.00 0.00 H new ATOM 1165 N LYS A 75 5.373 36.104 -22.616 1.00 0.00 N ATOM 1166 CA LYS A 75 5.766 36.223 -21.225 1.00 0.00 C ATOM 1167 C LYS A 75 7.246 35.874 -21.035 1.00 0.00 C ATOM 1168 O LYS A 75 7.863 36.357 -20.089 1.00 0.00 O ATOM 1169 CB LYS A 75 4.850 35.298 -20.419 1.00 0.00 C ATOM 1170 CG LYS A 75 3.504 35.960 -20.074 1.00 0.00 C ATOM 1171 CD LYS A 75 3.517 36.688 -18.722 1.00 0.00 C ATOM 1172 CE LYS A 75 3.499 35.711 -17.534 1.00 0.00 C ATOM 1173 NZ LYS A 75 3.352 36.413 -16.245 1.00 0.00 N ATOM 0 H LYS A 75 4.803 35.281 -22.813 1.00 0.00 H new ATOM 0 HA LYS A 75 5.657 37.251 -20.878 1.00 0.00 H new ATOM 0 HB2 LYS A 75 4.668 34.386 -20.988 1.00 0.00 H new ATOM 0 HB3 LYS A 75 5.354 35.004 -19.498 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.244 36.670 -20.859 1.00 0.00 H new ATOM 0 HG3 LYS A 75 2.724 35.198 -20.062 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.405 37.317 -18.659 1.00 0.00 H new ATOM 0 HD3 LYS A 75 2.653 37.349 -18.659 1.00 0.00 H new ATOM 0 HE2 LYS A 75 2.678 35.004 -17.658 1.00 0.00 H new ATOM 0 HE3 LYS A 75 4.421 35.130 -17.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 3.843 35.878 -15.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 3.766 37.364 -16.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 2.343 36.493 -16.006 1.00 0.00 H new ATOM 1187 N LEU A 76 7.813 35.054 -21.928 1.00 0.00 N ATOM 1188 CA LEU A 76 9.214 34.655 -21.889 1.00 0.00 C ATOM 1189 C LEU A 76 10.163 35.867 -21.994 1.00 0.00 C ATOM 1190 O LEU A 76 10.897 36.129 -21.042 1.00 0.00 O ATOM 1191 CB LEU A 76 9.479 33.540 -22.923 1.00 0.00 C ATOM 1192 CG LEU A 76 8.826 32.173 -22.626 1.00 0.00 C ATOM 1193 CD1 LEU A 76 8.855 31.329 -23.905 1.00 0.00 C ATOM 1194 CD2 LEU A 76 9.547 31.422 -21.501 1.00 0.00 C ATOM 0 H LEU A 76 7.298 34.646 -22.708 1.00 0.00 H new ATOM 0 HA LEU A 76 9.437 34.225 -20.913 1.00 0.00 H new ATOM 0 HB2 LEU A 76 9.129 33.884 -23.896 1.00 0.00 H new ATOM 0 HB3 LEU A 76 10.556 33.396 -23.004 1.00 0.00 H new ATOM 0 HG LEU A 76 7.802 32.347 -22.297 1.00 0.00 H new ATOM 0 HD11 LEU A 76 8.397 30.359 -23.711 1.00 0.00 H new ATOM 0 HD12 LEU A 76 8.301 31.841 -24.692 1.00 0.00 H new ATOM 0 HD13 LEU A 76 9.888 31.185 -24.223 1.00 0.00 H new ATOM 0 HD21 LEU A 76 9.053 30.466 -21.327 1.00 0.00 H new ATOM 0 HD22 LEU A 76 10.584 31.248 -21.787 1.00 0.00 H new ATOM 0 HD23 LEU A 76 9.517 32.018 -20.589 1.00 0.00 H new ATOM 1206 N PRO A 77 10.182 36.622 -23.106 1.00 0.00 N ATOM 1207 CA PRO A 77 11.037 37.791 -23.271 1.00 0.00 C ATOM 1208 C PRO A 77 10.529 38.974 -22.437 1.00 0.00 C ATOM 1209 O PRO A 77 9.541 38.866 -21.713 1.00 0.00 O ATOM 1210 CB PRO A 77 10.974 38.108 -24.771 1.00 0.00 C ATOM 1211 CG PRO A 77 9.558 37.673 -25.143 1.00 0.00 C ATOM 1212 CD PRO A 77 9.385 36.416 -24.297 1.00 0.00 C ATOM 0 HA PRO A 77 12.055 37.604 -22.930 1.00 0.00 H new ATOM 0 HB2 PRO A 77 11.138 39.167 -24.969 1.00 0.00 H new ATOM 0 HB3 PRO A 77 11.728 37.558 -25.334 1.00 0.00 H new ATOM 0 HG2 PRO A 77 8.819 38.435 -24.898 1.00 0.00 H new ATOM 0 HG3 PRO A 77 9.461 37.465 -26.209 1.00 0.00 H new ATOM 0 HD2 PRO A 77 8.337 36.259 -24.042 1.00 0.00 H new ATOM 0 HD3 PRO A 77 9.717 35.531 -24.840 1.00 0.00 H new ATOM 1220 N THR A 78 11.218 40.115 -22.555 1.00 0.00 N ATOM 1221 CA THR A 78 10.894 41.364 -21.869 1.00 0.00 C ATOM 1222 C THR A 78 11.114 42.525 -22.833 1.00 0.00 C ATOM 1223 O THR A 78 10.227 43.344 -23.069 1.00 0.00 O ATOM 1224 CB THR A 78 11.700 41.471 -20.563 1.00 0.00 C ATOM 1225 OG1 THR A 78 11.014 42.298 -19.646 1.00 0.00 O ATOM 1226 CG2 THR A 78 13.156 41.945 -20.641 1.00 0.00 C ATOM 0 H THR A 78 12.042 40.193 -23.151 1.00 0.00 H new ATOM 0 HA THR A 78 9.846 41.392 -21.571 1.00 0.00 H new ATOM 0 HB THR A 78 11.776 40.431 -20.247 1.00 0.00 H new ATOM 0 HG1 THR A 78 11.529 42.363 -18.815 1.00 0.00 H new ATOM 0 HG21 THR A 78 13.586 41.967 -19.639 1.00 0.00 H new ATOM 0 HG22 THR A 78 13.729 41.260 -21.267 1.00 0.00 H new ATOM 0 HG23 THR A 78 13.190 42.945 -21.072 1.00 0.00 H new ATOM 1234 N ILE A 79 12.323 42.560 -23.397 1.00 0.00 N ATOM 1235 CA ILE A 79 12.779 43.561 -24.353 1.00 0.00 C ATOM 1236 C ILE A 79 11.760 43.756 -25.474 1.00 0.00 C ATOM 1237 O ILE A 79 11.419 44.885 -25.817 1.00 0.00 O ATOM 1238 CB ILE A 79 14.181 43.224 -24.911 1.00 0.00 C ATOM 1239 CG1 ILE A 79 15.235 42.982 -23.813 1.00 0.00 C ATOM 1240 CG2 ILE A 79 14.671 44.358 -25.821 1.00 0.00 C ATOM 1241 CD1 ILE A 79 15.473 41.487 -23.618 1.00 0.00 C ATOM 0 H ILE A 79 13.037 41.862 -23.189 1.00 0.00 H new ATOM 0 HA ILE A 79 12.868 44.507 -23.819 1.00 0.00 H new ATOM 0 HB ILE A 79 14.069 42.294 -25.469 1.00 0.00 H new ATOM 0 HG12 ILE A 79 16.170 43.472 -24.084 1.00 0.00 H new ATOM 0 HG13 ILE A 79 14.901 43.428 -22.876 1.00 0.00 H new ATOM 0 HG21 ILE A 79 15.659 44.112 -26.209 1.00 0.00 H new ATOM 0 HG22 ILE A 79 13.976 44.484 -26.651 1.00 0.00 H new ATOM 0 HG23 ILE A 79 14.726 45.285 -25.250 1.00 0.00 H new ATOM 0 HD11 ILE A 79 16.220 41.336 -22.839 1.00 0.00 H new ATOM 0 HD12 ILE A 79 14.540 41.005 -23.324 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.829 41.050 -24.551 1.00 0.00 H new ATOM 1253 N SER A 80 11.273 42.648 -26.033 1.00 0.00 N ATOM 1254 CA SER A 80 10.292 42.643 -27.105 1.00 0.00 C ATOM 1255 C SER A 80 9.090 43.515 -26.750 1.00 0.00 C ATOM 1256 O SER A 80 8.686 44.367 -27.542 1.00 0.00 O ATOM 1257 CB SER A 80 9.876 41.198 -27.405 1.00 0.00 C ATOM 1258 OG SER A 80 11.029 40.393 -27.552 1.00 0.00 O ATOM 0 H SER A 80 11.559 41.713 -25.743 1.00 0.00 H new ATOM 0 HA SER A 80 10.737 43.070 -28.004 1.00 0.00 H new ATOM 0 HB2 SER A 80 9.252 40.814 -26.598 1.00 0.00 H new ATOM 0 HB3 SER A 80 9.277 41.163 -28.315 1.00 0.00 H new ATOM 0 HG SER A 80 10.761 39.470 -27.742 1.00 0.00 H new ATOM 1264 N GLN A 81 8.531 43.315 -25.550 1.00 0.00 N ATOM 1265 CA GLN A 81 7.398 44.095 -25.082 1.00 0.00 C ATOM 1266 C GLN A 81 7.762 45.572 -24.999 1.00 0.00 C ATOM 1267 O GLN A 81 6.942 46.423 -25.335 1.00 0.00 O ATOM 1268 CB GLN A 81 6.853 43.575 -23.745 1.00 0.00 C ATOM 1269 CG GLN A 81 6.387 42.114 -23.826 1.00 0.00 C ATOM 1270 CD GLN A 81 7.475 41.143 -23.380 1.00 0.00 C ATOM 1271 OE1 GLN A 81 8.434 40.898 -24.109 1.00 0.00 O ATOM 1272 NE2 GLN A 81 7.337 40.598 -22.173 1.00 0.00 N ATOM 0 H GLN A 81 8.855 42.611 -24.887 1.00 0.00 H new ATOM 0 HA GLN A 81 6.596 43.982 -25.811 1.00 0.00 H new ATOM 0 HB2 GLN A 81 7.626 43.664 -22.982 1.00 0.00 H new ATOM 0 HB3 GLN A 81 6.019 44.202 -23.428 1.00 0.00 H new ATOM 0 HG2 GLN A 81 5.503 41.980 -23.202 1.00 0.00 H new ATOM 0 HG3 GLN A 81 6.092 41.883 -24.850 1.00 0.00 H new ATOM 0 HE21 GLN A 81 6.526 40.828 -21.599 1.00 0.00 H new ATOM 0 HE22 GLN A 81 8.043 39.951 -21.822 1.00 0.00 H new ATOM 1281 N ARG A 82 8.988 45.874 -24.564 1.00 0.00 N ATOM 1282 CA ARG A 82 9.462 47.247 -24.452 1.00 0.00 C ATOM 1283 C ARG A 82 9.503 47.940 -25.816 1.00 0.00 C ATOM 1284 O ARG A 82 9.138 49.112 -25.894 1.00 0.00 O ATOM 1285 CB ARG A 82 10.823 47.340 -23.749 1.00 0.00 C ATOM 1286 CG ARG A 82 10.761 46.853 -22.297 1.00 0.00 C ATOM 1287 CD ARG A 82 12.111 47.093 -21.615 1.00 0.00 C ATOM 1288 NE ARG A 82 12.083 46.670 -20.209 1.00 0.00 N ATOM 1289 CZ ARG A 82 13.058 46.920 -19.317 1.00 0.00 C ATOM 1290 NH1 ARG A 82 14.168 47.567 -19.692 1.00 0.00 N ATOM 1291 NH2 ARG A 82 12.916 46.522 -18.047 1.00 0.00 N ATOM 0 H ARG A 82 9.674 45.174 -24.282 1.00 0.00 H new ATOM 0 HA ARG A 82 8.741 47.773 -23.827 1.00 0.00 H new ATOM 0 HB2 ARG A 82 11.555 46.747 -24.298 1.00 0.00 H new ATOM 0 HB3 ARG A 82 11.170 48.373 -23.769 1.00 0.00 H new ATOM 0 HG2 ARG A 82 9.972 47.380 -21.760 1.00 0.00 H new ATOM 0 HG3 ARG A 82 10.512 45.792 -22.269 1.00 0.00 H new ATOM 0 HD2 ARG A 82 12.891 46.547 -22.146 1.00 0.00 H new ATOM 0 HD3 ARG A 82 12.367 48.151 -21.673 1.00 0.00 H new ATOM 0 HE ARG A 82 11.267 46.150 -19.886 1.00 0.00 H new ATOM 0 HH11 ARG A 82 14.278 47.873 -20.659 1.00 0.00 H new ATOM 0 HH12 ARG A 82 14.904 47.754 -19.011 1.00 0.00 H new ATOM 0 HH21 ARG A 82 12.070 46.031 -17.758 1.00 0.00 H new ATOM 0 HH22 ARG A 82 13.654 46.710 -17.368 1.00 0.00 H new ATOM 1305 N ILE A 83 9.933 47.248 -26.885 1.00 0.00 N ATOM 1306 CA ILE A 83 9.993 47.865 -28.209 1.00 0.00 C ATOM 1307 C ILE A 83 8.591 48.305 -28.604 1.00 0.00 C ATOM 1308 O ILE A 83 8.369 49.462 -28.942 1.00 0.00 O ATOM 1309 CB ILE A 83 10.532 46.919 -29.308 1.00 0.00 C ATOM 1310 CG1 ILE A 83 11.751 46.105 -28.912 1.00 0.00 C ATOM 1311 CG2 ILE A 83 10.780 47.662 -30.634 1.00 0.00 C ATOM 1312 CD1 ILE A 83 12.875 46.842 -28.201 1.00 0.00 C ATOM 0 H ILE A 83 10.239 46.275 -26.854 1.00 0.00 H new ATOM 0 HA ILE A 83 10.685 48.704 -28.136 1.00 0.00 H new ATOM 0 HB ILE A 83 9.731 46.193 -29.451 1.00 0.00 H new ATOM 0 HG12 ILE A 83 11.419 45.291 -28.267 1.00 0.00 H new ATOM 0 HG13 ILE A 83 12.162 45.650 -29.814 1.00 0.00 H new ATOM 0 HG21 ILE A 83 11.158 46.961 -31.379 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.845 48.098 -30.987 1.00 0.00 H new ATOM 0 HG23 ILE A 83 11.512 48.454 -30.476 1.00 0.00 H new ATOM 0 HD11 ILE A 83 13.682 46.145 -27.976 1.00 0.00 H new ATOM 0 HD12 ILE A 83 13.252 47.638 -28.844 1.00 0.00 H new ATOM 0 HD13 ILE A 83 12.498 47.273 -27.273 1.00 0.00 H new ATOM 1324 N VAL A 84 7.654 47.356 -28.559 1.00 0.00 N ATOM 1325 CA VAL A 84 6.266 47.613 -28.923 1.00 0.00 C ATOM 1326 C VAL A 84 5.654 48.705 -28.054 1.00 0.00 C ATOM 1327 O VAL A 84 4.986 49.604 -28.564 1.00 0.00 O ATOM 1328 CB VAL A 84 5.442 46.311 -28.918 1.00 0.00 C ATOM 1329 CG1 VAL A 84 3.990 46.573 -29.339 1.00 0.00 C ATOM 1330 CG2 VAL A 84 6.042 45.264 -29.870 1.00 0.00 C ATOM 0 H VAL A 84 7.838 46.395 -28.271 1.00 0.00 H new ATOM 0 HA VAL A 84 6.246 47.991 -29.945 1.00 0.00 H new ATOM 0 HB VAL A 84 5.466 45.930 -27.897 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.433 45.636 -29.326 1.00 0.00 H new ATOM 0 HG12 VAL A 84 3.531 47.278 -28.645 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.973 46.992 -30.345 1.00 0.00 H new ATOM 0 HG21 VAL A 84 5.437 44.358 -29.842 1.00 0.00 H new ATOM 0 HG22 VAL A 84 6.055 45.661 -30.885 1.00 0.00 H new ATOM 0 HG23 VAL A 84 7.060 45.030 -29.558 1.00 0.00 H new ATOM 1340 N SER A 85 5.900 48.641 -26.747 1.00 0.00 N ATOM 1341 CA SER A 85 5.412 49.603 -25.776 1.00 0.00 C ATOM 1342 C SER A 85 6.227 50.900 -25.803 1.00 0.00 C ATOM 1343 O SER A 85 6.583 51.427 -24.751 1.00 0.00 O ATOM 1344 CB SER A 85 5.412 48.983 -24.379 1.00 0.00 C ATOM 1345 OG SER A 85 4.699 47.763 -24.378 1.00 0.00 O ATOM 0 H SER A 85 6.459 47.897 -26.329 1.00 0.00 H new ATOM 0 HA SER A 85 4.388 49.865 -26.044 1.00 0.00 H new ATOM 0 HB2 SER A 85 6.437 48.812 -24.051 1.00 0.00 H new ATOM 0 HB3 SER A 85 4.961 49.675 -23.668 1.00 0.00 H new ATOM 0 HG SER A 85 5.287 47.040 -24.682 1.00 0.00 H new ATOM 1351 N ALA A 86 6.509 51.416 -27.003 1.00 0.00 N ATOM 1352 CA ALA A 86 7.246 52.649 -27.231 1.00 0.00 C ATOM 1353 C ALA A 86 7.191 53.017 -28.708 1.00 0.00 C ATOM 1354 O ALA A 86 6.894 54.164 -29.042 1.00 0.00 O ATOM 1355 CB ALA A 86 8.700 52.523 -26.758 1.00 0.00 C ATOM 0 H ALA A 86 6.217 50.965 -27.870 1.00 0.00 H new ATOM 0 HA ALA A 86 6.779 53.443 -26.649 1.00 0.00 H new ATOM 0 HB1 ALA A 86 9.225 53.460 -26.942 1.00 0.00 H new ATOM 0 HB2 ALA A 86 8.718 52.300 -25.691 1.00 0.00 H new ATOM 0 HB3 ALA A 86 9.192 51.718 -27.305 1.00 0.00 H new ATOM 1361 N GLN A 87 7.455 52.043 -29.588 1.00 0.00 N ATOM 1362 CA GLN A 87 7.417 52.175 -31.039 1.00 0.00 C ATOM 1363 C GLN A 87 5.943 52.152 -31.470 1.00 0.00 C ATOM 1364 O GLN A 87 5.502 51.263 -32.193 1.00 0.00 O ATOM 1365 CB GLN A 87 8.254 51.061 -31.697 1.00 0.00 C ATOM 1366 CG GLN A 87 8.485 51.309 -33.193 1.00 0.00 C ATOM 1367 CD GLN A 87 9.332 50.199 -33.809 1.00 0.00 C ATOM 1368 OE1 GLN A 87 10.474 50.425 -34.195 1.00 0.00 O ATOM 1369 NE2 GLN A 87 8.775 48.991 -33.905 1.00 0.00 N ATOM 0 H GLN A 87 7.712 51.102 -29.289 1.00 0.00 H new ATOM 0 HA GLN A 87 7.860 53.116 -31.366 1.00 0.00 H new ATOM 0 HB2 GLN A 87 9.217 50.987 -31.191 1.00 0.00 H new ATOM 0 HB3 GLN A 87 7.749 50.104 -31.564 1.00 0.00 H new ATOM 0 HG2 GLN A 87 7.526 51.367 -33.708 1.00 0.00 H new ATOM 0 HG3 GLN A 87 8.981 52.270 -33.333 1.00 0.00 H new ATOM 0 HE21 GLN A 87 7.822 48.841 -33.573 1.00 0.00 H new ATOM 0 HE22 GLN A 87 9.302 48.217 -34.310 1.00 0.00 H new ATOM 1378 N SER A 88 5.194 53.143 -30.979 1.00 0.00 N ATOM 1379 CA SER A 88 3.773 53.395 -31.151 1.00 0.00 C ATOM 1380 C SER A 88 3.466 54.725 -30.454 1.00 0.00 C ATOM 1381 O SER A 88 2.758 55.560 -31.012 1.00 0.00 O ATOM 1382 CB SER A 88 2.928 52.271 -30.534 1.00 0.00 C ATOM 1383 OG SER A 88 2.880 51.141 -31.381 1.00 0.00 O ATOM 0 H SER A 88 5.619 53.860 -30.391 1.00 0.00 H new ATOM 0 HA SER A 88 3.526 53.436 -32.212 1.00 0.00 H new ATOM 0 HB2 SER A 88 3.346 51.987 -29.568 1.00 0.00 H new ATOM 0 HB3 SER A 88 1.917 52.633 -30.349 1.00 0.00 H new ATOM 0 HG SER A 88 3.759 51.003 -31.792 1.00 0.00 H new ATOM 1389 N LEU A 89 4.011 54.923 -29.242 1.00 0.00 N ATOM 1390 CA LEU A 89 3.839 56.135 -28.448 1.00 0.00 C ATOM 1391 C LEU A 89 5.022 57.090 -28.631 1.00 0.00 C ATOM 1392 O LEU A 89 5.427 57.780 -27.700 1.00 0.00 O ATOM 1393 CB LEU A 89 3.551 55.762 -26.982 1.00 0.00 C ATOM 1394 CG LEU A 89 4.731 55.277 -26.129 1.00 0.00 C ATOM 1395 CD1 LEU A 89 4.985 56.204 -24.933 1.00 0.00 C ATOM 1396 CD2 LEU A 89 4.410 53.883 -25.574 1.00 0.00 C ATOM 0 H LEU A 89 4.596 54.224 -28.783 1.00 0.00 H new ATOM 0 HA LEU A 89 2.971 56.690 -28.804 1.00 0.00 H new ATOM 0 HB2 LEU A 89 3.118 56.634 -26.492 1.00 0.00 H new ATOM 0 HB3 LEU A 89 2.789 54.982 -26.977 1.00 0.00 H new ATOM 0 HG LEU A 89 5.615 55.264 -26.766 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.828 55.827 -24.353 1.00 0.00 H new ATOM 0 HD12 LEU A 89 5.211 57.208 -25.292 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.096 56.236 -24.302 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.244 53.532 -24.967 1.00 0.00 H new ATOM 0 HD22 LEU A 89 3.511 53.934 -24.960 1.00 0.00 H new ATOM 0 HD23 LEU A 89 4.247 53.191 -26.400 1.00 0.00 H new ATOM 1408 N GLY A 90 5.569 57.121 -29.848 1.00 0.00 N ATOM 1409 CA GLY A 90 6.694 57.959 -30.227 1.00 0.00 C ATOM 1410 C GLY A 90 6.227 59.174 -31.025 1.00 0.00 C ATOM 1411 O GLY A 90 5.033 59.341 -31.277 1.00 0.00 O ATOM 0 H GLY A 90 5.226 56.544 -30.616 1.00 0.00 H new ATOM 0 HA2 GLY A 90 7.224 58.288 -29.333 1.00 0.00 H new ATOM 0 HA3 GLY A 90 7.400 57.379 -30.821 1.00 0.00 H new ATOM 1415 N GLU A 91 7.186 60.015 -31.428 1.00 0.00 N ATOM 1416 CA GLU A 91 6.925 61.215 -32.214 1.00 0.00 C ATOM 1417 C GLU A 91 6.645 60.834 -33.674 1.00 0.00 C ATOM 1418 O GLU A 91 6.649 59.653 -34.026 1.00 0.00 O ATOM 1419 CB GLU A 91 8.118 62.186 -32.092 1.00 0.00 C ATOM 1420 CG GLU A 91 7.669 63.612 -31.747 1.00 0.00 C ATOM 1421 CD GLU A 91 7.098 63.704 -30.335 1.00 0.00 C ATOM 1422 OE1 GLU A 91 7.903 63.560 -29.389 1.00 0.00 O ATOM 1423 OE2 GLU A 91 5.870 63.908 -30.226 1.00 0.00 O ATOM 0 H GLU A 91 8.173 59.876 -31.213 1.00 0.00 H new ATOM 0 HA GLU A 91 6.040 61.723 -31.831 1.00 0.00 H new ATOM 0 HB2 GLU A 91 8.801 61.825 -31.323 1.00 0.00 H new ATOM 0 HB3 GLU A 91 8.672 62.198 -33.030 1.00 0.00 H new ATOM 0 HG2 GLU A 91 8.516 64.292 -31.841 1.00 0.00 H new ATOM 0 HG3 GLU A 91 6.917 63.939 -32.465 1.00 0.00 H new ATOM 1430 N ASP A 92 6.409 61.835 -34.527 1.00 0.00 N ATOM 1431 CA ASP A 92 6.142 61.632 -35.944 1.00 0.00 C ATOM 1432 C ASP A 92 7.414 61.171 -36.668 1.00 0.00 C ATOM 1433 O ASP A 92 8.522 61.330 -36.153 1.00 0.00 O ATOM 1434 CB ASP A 92 5.563 62.915 -36.558 1.00 0.00 C ATOM 1435 CG ASP A 92 6.501 64.112 -36.424 1.00 0.00 C ATOM 1436 OD1 ASP A 92 6.742 64.511 -35.263 1.00 0.00 O ATOM 1437 OD2 ASP A 92 6.937 64.622 -37.477 1.00 0.00 O ATOM 0 H ASP A 92 6.399 62.815 -34.246 1.00 0.00 H new ATOM 0 HA ASP A 92 5.399 60.843 -36.063 1.00 0.00 H new ATOM 0 HB2 ASP A 92 5.350 62.743 -37.613 1.00 0.00 H new ATOM 0 HB3 ASP A 92 4.614 63.147 -36.075 1.00 0.00 H new ATOM 1442 N ASP A 93 7.257 60.584 -37.862 1.00 0.00 N ATOM 1443 CA ASP A 93 8.369 60.076 -38.654 1.00 0.00 C ATOM 1444 C ASP A 93 9.242 61.223 -39.176 1.00 0.00 C ATOM 1445 O ASP A 93 8.802 62.371 -39.222 1.00 0.00 O ATOM 1446 CB ASP A 93 7.834 59.236 -39.822 1.00 0.00 C ATOM 1447 CG ASP A 93 6.949 58.092 -39.342 1.00 0.00 C ATOM 1448 OD1 ASP A 93 5.732 58.342 -39.208 1.00 0.00 O ATOM 1449 OD2 ASP A 93 7.504 56.997 -39.109 1.00 0.00 O ATOM 0 H ASP A 93 6.347 60.451 -38.302 1.00 0.00 H new ATOM 0 HA ASP A 93 8.990 59.447 -38.016 1.00 0.00 H new ATOM 0 HB2 ASP A 93 7.266 59.875 -40.498 1.00 0.00 H new ATOM 0 HB3 ASP A 93 8.671 58.833 -40.392 1.00 0.00 H new ATOM 1454 N VAL A 94 10.482 60.911 -39.576 1.00 0.00 N ATOM 1455 CA VAL A 94 11.442 61.873 -40.101 1.00 0.00 C ATOM 1456 C VAL A 94 12.147 61.219 -41.290 1.00 0.00 C ATOM 1457 O VAL A 94 12.539 60.057 -41.195 1.00 0.00 O ATOM 1458 CB VAL A 94 12.443 62.278 -39.000 1.00 0.00 C ATOM 1459 CG1 VAL A 94 13.467 63.290 -39.532 1.00 0.00 C ATOM 1460 CG2 VAL A 94 11.733 62.895 -37.787 1.00 0.00 C ATOM 0 H VAL A 94 10.847 59.959 -39.540 1.00 0.00 H new ATOM 0 HA VAL A 94 10.943 62.785 -40.429 1.00 0.00 H new ATOM 0 HB VAL A 94 12.951 61.365 -38.691 1.00 0.00 H new ATOM 0 HG11 VAL A 94 14.161 63.559 -38.735 1.00 0.00 H new ATOM 0 HG12 VAL A 94 14.020 62.847 -40.360 1.00 0.00 H new ATOM 0 HG13 VAL A 94 12.949 64.184 -39.879 1.00 0.00 H new ATOM 0 HG21 VAL A 94 12.471 63.167 -37.033 1.00 0.00 H new ATOM 0 HG22 VAL A 94 11.187 63.786 -38.099 1.00 0.00 H new ATOM 0 HG23 VAL A 94 11.035 62.171 -37.367 1.00 0.00 H new ATOM 1470 N GLU A 95 12.295 61.977 -42.383 1.00 0.00 N ATOM 1471 CA GLU A 95 12.926 61.565 -43.630 1.00 0.00 C ATOM 1472 C GLU A 95 12.037 60.543 -44.350 1.00 0.00 C ATOM 1473 O GLU A 95 10.917 60.962 -44.720 1.00 0.00 O ATOM 1474 CB GLU A 95 14.378 61.103 -43.392 1.00 0.00 C ATOM 1475 CG GLU A 95 15.222 61.108 -44.675 1.00 0.00 C ATOM 1476 CD GLU A 95 15.510 62.522 -45.175 1.00 0.00 C ATOM 1477 OE1 GLU A 95 16.259 63.231 -44.468 1.00 0.00 O ATOM 1478 OE2 GLU A 95 14.981 62.869 -46.253 1.00 0.00 O ATOM 1479 OXT GLU A 95 12.348 59.335 -44.265 1.00 0.00 O ATOM 0 H GLU A 95 11.960 62.940 -42.417 1.00 0.00 H new ATOM 0 HA GLU A 95 13.015 62.417 -44.304 1.00 0.00 H new ATOM 0 HB2 GLU A 95 14.845 61.754 -42.653 1.00 0.00 H new ATOM 0 HB3 GLU A 95 14.370 60.097 -42.972 1.00 0.00 H new ATOM 0 HG2 GLU A 95 16.164 60.592 -44.489 1.00 0.00 H new ATOM 0 HG3 GLU A 95 14.700 60.550 -45.452 1.00 0.00 H new TER 1486 GLU A 95 ATOM 1487 N GLY B 1 -15.116 20.883 -13.521 1.00 0.00 N ATOM 1488 CA GLY B 1 -13.955 21.396 -14.264 1.00 0.00 C ATOM 1489 C GLY B 1 -13.865 20.724 -15.636 1.00 0.00 C ATOM 1490 O GLY B 1 -13.754 19.498 -15.679 1.00 0.00 O ATOM 0 H1 GLY B 1 -15.166 21.347 -12.592 1.00 0.00 H new ATOM 0 H2 GLY B 1 -15.986 21.083 -14.055 1.00 0.00 H new ATOM 0 H3 GLY B 1 -15.018 19.856 -13.390 1.00 0.00 H new ATOM 0 HA2 GLY B 1 -14.040 22.476 -14.385 1.00 0.00 H new ATOM 0 HA3 GLY B 1 -13.042 21.210 -13.699 1.00 0.00 H new ATOM 1496 N PRO B 2 -13.935 21.472 -16.752 1.00 0.00 N ATOM 1497 CA PRO B 2 -13.888 20.915 -18.096 1.00 0.00 C ATOM 1498 C PRO B 2 -12.442 20.591 -18.489 1.00 0.00 C ATOM 1499 O PRO B 2 -11.855 21.268 -19.330 1.00 0.00 O ATOM 1500 CB PRO B 2 -14.518 21.996 -18.979 1.00 0.00 C ATOM 1501 CG PRO B 2 -14.073 23.289 -18.296 1.00 0.00 C ATOM 1502 CD PRO B 2 -14.085 22.919 -16.810 1.00 0.00 C ATOM 0 HA PRO B 2 -14.425 19.972 -18.193 1.00 0.00 H new ATOM 0 HB2 PRO B 2 -14.161 21.938 -20.007 1.00 0.00 H new ATOM 0 HB3 PRO B 2 -15.604 21.909 -19.013 1.00 0.00 H new ATOM 0 HG2 PRO B 2 -13.081 23.599 -18.626 1.00 0.00 H new ATOM 0 HG3 PRO B 2 -14.753 24.113 -18.512 1.00 0.00 H new ATOM 0 HD2 PRO B 2 -13.274 23.416 -16.278 1.00 0.00 H new ATOM 0 HD3 PRO B 2 -15.016 23.233 -16.338 1.00 0.00 H new ATOM 1510 N ARG B 3 -11.876 19.548 -17.870 1.00 0.00 N ATOM 1511 CA ARG B 3 -10.505 19.111 -18.106 1.00 0.00 C ATOM 1512 C ARG B 3 -10.198 18.875 -19.592 1.00 0.00 C ATOM 1513 O ARG B 3 -11.051 18.414 -20.350 1.00 0.00 O ATOM 1514 CB ARG B 3 -10.194 17.869 -17.260 1.00 0.00 C ATOM 1515 CG ARG B 3 -9.910 18.271 -15.805 1.00 0.00 C ATOM 1516 CD ARG B 3 -9.930 17.072 -14.849 1.00 0.00 C ATOM 1517 NE ARG B 3 -9.100 15.952 -15.332 1.00 0.00 N ATOM 1518 CZ ARG B 3 -9.537 14.762 -15.788 1.00 0.00 C ATOM 1519 NH1 ARG B 3 -10.844 14.503 -15.931 1.00 0.00 N ATOM 1520 NH2 ARG B 3 -8.644 13.818 -16.099 1.00 0.00 N ATOM 0 H ARG B 3 -12.369 18.979 -17.182 1.00 0.00 H new ATOM 0 HA ARG B 3 -9.847 19.922 -17.795 1.00 0.00 H new ATOM 0 HB2 ARG B 3 -11.035 17.177 -17.295 1.00 0.00 H new ATOM 0 HB3 ARG B 3 -9.333 17.345 -17.674 1.00 0.00 H new ATOM 0 HG2 ARG B 3 -8.937 18.759 -15.750 1.00 0.00 H new ATOM 0 HG3 ARG B 3 -10.652 19.001 -15.482 1.00 0.00 H new ATOM 0 HD2 ARG B 3 -9.574 17.387 -13.868 1.00 0.00 H new ATOM 0 HD3 ARG B 3 -10.957 16.730 -14.721 1.00 0.00 H new ATOM 0 HE ARG B 3 -8.090 16.093 -15.319 1.00 0.00 H new ATOM 0 HH11 ARG B 3 -11.534 15.215 -15.692 1.00 0.00 H new ATOM 0 HH12 ARG B 3 -11.149 13.594 -16.278 1.00 0.00 H new ATOM 0 HH21 ARG B 3 -7.647 14.003 -15.990 1.00 0.00 H new ATOM 0 HH22 ARG B 3 -8.959 12.912 -16.445 1.00 0.00 H new ATOM 1534 N LEU B 4 -8.963 19.207 -19.982 1.00 0.00 N ATOM 1535 CA LEU B 4 -8.365 19.135 -21.311 1.00 0.00 C ATOM 1536 C LEU B 4 -7.957 17.719 -21.687 1.00 0.00 C ATOM 1537 O LEU B 4 -8.263 17.283 -22.796 1.00 0.00 O ATOM 1538 CB LEU B 4 -7.120 20.043 -21.306 1.00 0.00 C ATOM 1539 CG LEU B 4 -6.224 20.090 -22.561 1.00 0.00 C ATOM 1540 CD1 LEU B 4 -5.395 21.383 -22.519 1.00 0.00 C ATOM 1541 CD2 LEU B 4 -5.203 18.939 -22.646 1.00 0.00 C ATOM 0 H LEU B 4 -8.293 19.569 -19.303 1.00 0.00 H new ATOM 0 HA LEU B 4 -9.101 19.458 -22.047 1.00 0.00 H new ATOM 0 HB2 LEU B 4 -7.455 21.060 -21.103 1.00 0.00 H new ATOM 0 HB3 LEU B 4 -6.495 19.740 -20.466 1.00 0.00 H new ATOM 0 HG LEU B 4 -6.899 20.020 -23.414 1.00 0.00 H new ATOM 0 HD11 LEU B 4 -4.755 21.433 -23.400 1.00 0.00 H new ATOM 0 HD12 LEU B 4 -6.064 22.244 -22.507 1.00 0.00 H new ATOM 0 HD13 LEU B 4 -4.778 21.390 -21.621 1.00 0.00 H new ATOM 0 HD21 LEU B 4 -4.612 19.043 -23.556 1.00 0.00 H new ATOM 0 HD22 LEU B 4 -4.543 18.973 -21.779 1.00 0.00 H new ATOM 0 HD23 LEU B 4 -5.730 17.985 -22.663 1.00 0.00 H new ATOM 1553 N SER B 5 -7.239 17.045 -20.778 1.00 0.00 N ATOM 1554 CA SER B 5 -6.675 15.709 -20.932 1.00 0.00 C ATOM 1555 C SER B 5 -7.508 14.762 -21.803 1.00 0.00 C ATOM 1556 O SER B 5 -8.482 14.163 -21.354 1.00 0.00 O ATOM 1557 CB SER B 5 -6.298 15.122 -19.567 1.00 0.00 C ATOM 1558 OG SER B 5 -7.309 15.347 -18.605 1.00 0.00 O ATOM 0 H SER B 5 -7.028 17.447 -19.865 1.00 0.00 H new ATOM 0 HA SER B 5 -5.756 15.823 -21.507 1.00 0.00 H new ATOM 0 HB2 SER B 5 -6.123 14.051 -19.667 1.00 0.00 H new ATOM 0 HB3 SER B 5 -5.364 15.567 -19.225 1.00 0.00 H new ATOM 0 HG SER B 5 -6.920 15.308 -17.706 1.00 0.00 H new ATOM 1564 N ARG B 6 -7.073 14.648 -23.063 1.00 0.00 N ATOM 1565 CA ARG B 6 -7.624 13.823 -24.130 1.00 0.00 C ATOM 1566 C ARG B 6 -6.426 13.268 -24.887 1.00 0.00 C ATOM 1567 O ARG B 6 -6.233 12.055 -24.948 1.00 0.00 O ATOM 1568 CB ARG B 6 -8.490 14.669 -25.074 1.00 0.00 C ATOM 1569 CG ARG B 6 -9.874 14.923 -24.480 1.00 0.00 C ATOM 1570 CD ARG B 6 -10.611 15.991 -25.296 1.00 0.00 C ATOM 1571 NE ARG B 6 -11.916 16.300 -24.698 1.00 0.00 N ATOM 1572 CZ ARG B 6 -12.079 16.957 -23.537 1.00 0.00 C ATOM 1573 NH1 ARG B 6 -11.027 17.488 -22.907 1.00 0.00 N ATOM 1574 NH2 ARG B 6 -13.297 17.072 -22.996 1.00 0.00 N ATOM 0 H ARG B 6 -6.261 15.175 -23.383 1.00 0.00 H new ATOM 0 HA ARG B 6 -8.257 13.031 -23.730 1.00 0.00 H new ATOM 0 HB2 ARG B 6 -7.996 15.621 -25.269 1.00 0.00 H new ATOM 0 HB3 ARG B 6 -8.591 14.160 -26.032 1.00 0.00 H new ATOM 0 HG2 ARG B 6 -10.450 13.998 -24.473 1.00 0.00 H new ATOM 0 HG3 ARG B 6 -9.779 15.247 -23.444 1.00 0.00 H new ATOM 0 HD2 ARG B 6 -10.006 16.897 -25.347 1.00 0.00 H new ATOM 0 HD3 ARG B 6 -10.749 15.642 -26.319 1.00 0.00 H new ATOM 0 HE ARG B 6 -12.753 15.996 -25.196 1.00 0.00 H new ATOM 0 HH11 ARG B 6 -10.093 17.396 -23.307 1.00 0.00 H new ATOM 0 HH12 ARG B 6 -11.158 17.985 -22.026 1.00 0.00 H new ATOM 0 HH21 ARG B 6 -14.104 16.661 -23.465 1.00 0.00 H new ATOM 0 HH22 ARG B 6 -13.419 17.571 -22.115 1.00 0.00 H new ATOM 1588 N LEU B 7 -5.612 14.178 -25.440 1.00 0.00 N ATOM 1589 CA LEU B 7 -4.405 13.841 -26.171 1.00 0.00 C ATOM 1590 C LEU B 7 -3.531 12.924 -25.332 1.00 0.00 C ATOM 1591 O LEU B 7 -3.041 11.949 -25.871 1.00 0.00 O ATOM 1592 CB LEU B 7 -3.636 15.102 -26.623 1.00 0.00 C ATOM 1593 CG LEU B 7 -3.124 15.940 -25.439 1.00 0.00 C ATOM 1594 CD1 LEU B 7 -1.656 15.600 -25.192 1.00 0.00 C ATOM 1595 CD2 LEU B 7 -3.206 17.457 -25.532 1.00 0.00 C ATOM 0 H LEU B 7 -5.786 15.182 -25.385 1.00 0.00 H new ATOM 0 HA LEU B 7 -4.692 13.311 -27.079 1.00 0.00 H new ATOM 0 HB2 LEU B 7 -2.791 14.804 -27.245 1.00 0.00 H new ATOM 0 HB3 LEU B 7 -4.288 15.717 -27.244 1.00 0.00 H new ATOM 0 HG LEU B 7 -3.811 15.666 -24.639 1.00 0.00 H new ATOM 0 HD11 LEU B 7 -1.282 16.189 -24.354 1.00 0.00 H new ATOM 0 HD12 LEU B 7 -1.562 14.539 -24.961 1.00 0.00 H new ATOM 0 HD13 LEU B 7 -1.074 15.829 -26.085 1.00 0.00 H new ATOM 0 HD21 LEU B 7 -2.806 17.900 -24.620 1.00 0.00 H new ATOM 0 HD22 LEU B 7 -2.624 17.801 -26.387 1.00 0.00 H new ATOM 0 HD23 LEU B 7 -4.246 17.758 -25.656 1.00 0.00 H new ATOM 1607 N LEU B 8 -3.328 13.218 -24.040 1.00 0.00 N ATOM 1608 CA LEU B 8 -2.446 12.436 -23.180 1.00 0.00 C ATOM 1609 C LEU B 8 -2.837 10.957 -23.073 1.00 0.00 C ATOM 1610 O LEU B 8 -2.020 10.154 -22.634 1.00 0.00 O ATOM 1611 CB LEU B 8 -2.166 13.102 -21.821 1.00 0.00 C ATOM 1612 CG LEU B 8 -1.371 14.437 -21.790 1.00 0.00 C ATOM 1613 CD1 LEU B 8 -0.059 14.481 -22.604 1.00 0.00 C ATOM 1614 CD2 LEU B 8 -2.275 15.657 -22.015 1.00 0.00 C ATOM 0 H LEU B 8 -3.773 14.005 -23.568 1.00 0.00 H new ATOM 0 HA LEU B 8 -1.485 12.430 -23.695 1.00 0.00 H new ATOM 0 HB2 LEU B 8 -3.126 13.279 -21.336 1.00 0.00 H new ATOM 0 HB3 LEU B 8 -1.626 12.382 -21.206 1.00 0.00 H new ATOM 0 HG LEU B 8 -1.000 14.490 -20.766 1.00 0.00 H new ATOM 0 HD11 LEU B 8 0.400 15.464 -22.501 1.00 0.00 H new ATOM 0 HD12 LEU B 8 0.626 13.720 -22.231 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -0.276 14.290 -23.655 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -1.674 16.566 -21.985 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -2.761 15.576 -22.987 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -3.033 15.697 -21.233 1.00 0.00 H new ATOM 1626 N SER B 9 -4.045 10.570 -23.511 1.00 0.00 N ATOM 1627 CA SER B 9 -4.449 9.170 -23.531 1.00 0.00 C ATOM 1628 C SER B 9 -3.672 8.400 -24.616 1.00 0.00 C ATOM 1629 O SER B 9 -3.732 7.173 -24.658 1.00 0.00 O ATOM 1630 CB SER B 9 -5.959 9.071 -23.776 1.00 0.00 C ATOM 1631 OG SER B 9 -6.391 7.739 -23.590 1.00 0.00 O ATOM 0 H SER B 9 -4.756 11.215 -23.856 1.00 0.00 H new ATOM 0 HA SER B 9 -4.218 8.720 -22.566 1.00 0.00 H new ATOM 0 HB2 SER B 9 -6.491 9.734 -23.093 1.00 0.00 H new ATOM 0 HB3 SER B 9 -6.194 9.401 -24.788 1.00 0.00 H new ATOM 0 HG SER B 9 -5.677 7.123 -23.857 1.00 0.00 H new ATOM 1637 N TYR B 10 -2.950 9.117 -25.491 1.00 0.00 N ATOM 1638 CA TYR B 10 -2.136 8.603 -26.585 1.00 0.00 C ATOM 1639 C TYR B 10 -0.815 7.970 -26.131 1.00 0.00 C ATOM 1640 O TYR B 10 -0.035 7.534 -26.976 1.00 0.00 O ATOM 1641 CB TYR B 10 -1.834 9.769 -27.551 1.00 0.00 C ATOM 1642 CG TYR B 10 -0.859 10.867 -27.104 1.00 0.00 C ATOM 1643 CD1 TYR B 10 -0.437 11.026 -25.763 1.00 0.00 C ATOM 1644 CD2 TYR B 10 -0.376 11.775 -28.065 1.00 0.00 C ATOM 1645 CE1 TYR B 10 0.453 12.044 -25.395 1.00 0.00 C ATOM 1646 CE2 TYR B 10 0.517 12.791 -27.697 1.00 0.00 C ATOM 1647 CZ TYR B 10 0.940 12.927 -26.364 1.00 0.00 C ATOM 1648 OH TYR B 10 1.807 13.917 -26.003 1.00 0.00 O ATOM 0 H TYR B 10 -2.923 10.136 -25.444 1.00 0.00 H new ATOM 0 HA TYR B 10 -2.706 7.808 -27.066 1.00 0.00 H new ATOM 0 HB2 TYR B 10 -1.446 9.340 -28.475 1.00 0.00 H new ATOM 0 HB3 TYR B 10 -2.782 10.249 -27.795 1.00 0.00 H new ATOM 0 HD1 TYR B 10 -0.808 10.349 -25.008 1.00 0.00 H new ATOM 0 HD2 TYR B 10 -0.696 11.688 -29.093 1.00 0.00 H new ATOM 0 HE1 TYR B 10 0.762 12.146 -24.365 1.00 0.00 H new ATOM 0 HE2 TYR B 10 0.884 13.477 -28.446 1.00 0.00 H new ATOM 0 HH TYR B 10 2.226 14.294 -26.805 1.00 0.00 H new ATOM 1658 N ALA B 11 -0.535 7.956 -24.823 1.00 0.00 N ATOM 1659 CA ALA B 11 0.713 7.468 -24.267 1.00 0.00 C ATOM 1660 C ALA B 11 0.498 7.048 -22.813 1.00 0.00 C ATOM 1661 O ALA B 11 -0.612 7.304 -22.295 1.00 0.00 O ATOM 1662 CB ALA B 11 1.739 8.606 -24.370 1.00 0.00 C ATOM 1663 OXT ALA B 11 1.474 6.532 -22.224 1.00 0.00 O ATOM 0 H ALA B 11 -1.188 8.292 -24.115 1.00 0.00 H new ATOM 0 HA ALA B 11 1.075 6.596 -24.811 1.00 0.00 H new ATOM 0 HB1 ALA B 11 2.693 8.274 -23.960 1.00 0.00 H new ATOM 0 HB2 ALA B 11 1.871 8.884 -25.416 1.00 0.00 H new ATOM 0 HB3 ALA B 11 1.383 9.469 -23.807 1.00 0.00 H new TER 1669 ALA B 11