USER MOD reduce.3.24.130724 H: found=0, std=0, add=774, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 776 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 39 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 42 GLN : amide:sc= -3.33 K(o=-3.3,f=-0.29) USER MOD Set 2.1: A 18 CYS SG : rot 180:sc= 0.00843 USER MOD Set 2.2: A 28 LYS NZ :NH3+ -145:sc= 0.00756 (180deg=-1.33!) USER MOD Single : A 3 THR OG1 : rot -34:sc= -0.681 USER MOD Single : A 7 SER OG : rot 150:sc= -0.544 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= -0.0758 X(o=-0.076,f=0) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= -0.172 USER MOD Single : A 27 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.0017) USER MOD Single : A 31 GLN : amide:sc= 1.13 K(o=1.1,f=-0.035) USER MOD Single : A 33 SER OG : rot 158:sc= -3.51! USER MOD Single : A 35 MET CE :methyl -157:sc= -0.939 (180deg=-3.42) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0587) USER MOD Single : A 38 LYS NZ :NH3+ 174:sc= -0.44 (180deg=-0.51) USER MOD Single : A 40 SER OG : rot -62:sc= 1.26 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= -0.424 X(o=-0.42,f=-0.42) USER MOD Single : A 54 GLN : amide:sc= -1.31 X(o=-1.3,f=-1.3) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -0.727 K(o=-0.73,f=-0.22) USER MOD Single : A 72 SER OG : rot -52:sc= 0.00337 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0.156 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -89:sc= 0.554 USER MOD Single : A 83 LYS NZ :NH3+ 159:sc= -0.0566 (180deg=-0.314) USER MOD Single : A 84 THR OG1 : rot -48:sc= 0.651 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -4.63 K(o=-4.6,f=-6.3!) USER MOD Single : A 105 MET CE :methyl -175:sc= -3.69! (180deg=-4.21!) USER MOD Single : A 107 GLN : amide:sc= -4.44! C(o=-4.4!,f=-5.6!) USER MOD Single : A 108 SER OG : rot 72:sc= 0.169 USER MOD ----------------------------------------------------------------- ATOM 31 N THR A 3 1.360 -4.524 -1.897 1.00 0.00 N ATOM 32 CA THR A 3 0.317 -5.538 -1.806 1.00 0.00 C ATOM 33 C THR A 3 -0.992 -4.937 -1.306 1.00 0.00 C ATOM 34 O THR A 3 -1.695 -5.542 -0.497 1.00 0.00 O ATOM 35 CB THR A 3 0.731 -6.688 -0.869 1.00 0.00 C ATOM 36 OG1 THR A 3 0.810 -6.217 0.480 1.00 0.00 O ATOM 37 CG2 THR A 3 2.073 -7.271 -1.288 1.00 0.00 C ATOM 0 HA THR A 3 0.172 -5.933 -2.812 1.00 0.00 H new ATOM 0 HB THR A 3 -0.024 -7.471 -0.936 1.00 0.00 H new ATOM 0 HG1 THR A 3 1.116 -5.286 0.484 1.00 0.00 H new ATOM 0 HG21 THR A 3 2.345 -8.082 -0.612 1.00 0.00 H new ATOM 0 HG22 THR A 3 2.001 -7.656 -2.305 1.00 0.00 H new ATOM 0 HG23 THR A 3 2.836 -6.494 -1.248 1.00 0.00 H new ATOM 45 N ASP A 4 -1.313 -3.743 -1.793 1.00 0.00 N ATOM 46 CA ASP A 4 -2.539 -3.060 -1.396 1.00 0.00 C ATOM 47 C ASP A 4 -3.752 -3.675 -2.088 1.00 0.00 C ATOM 48 O ASP A 4 -4.530 -4.401 -1.469 1.00 0.00 O ATOM 49 CB ASP A 4 -2.448 -1.570 -1.727 1.00 0.00 C ATOM 50 CG ASP A 4 -3.738 -0.831 -1.430 1.00 0.00 C ATOM 51 OD1 ASP A 4 -4.374 -1.137 -0.399 1.00 0.00 O ATOM 52 OD2 ASP A 4 -4.112 0.054 -2.228 1.00 0.00 O ATOM 0 H ASP A 4 -0.741 -3.228 -2.463 1.00 0.00 H new ATOM 0 HA ASP A 4 -2.659 -3.178 -0.319 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -1.636 -1.122 -1.154 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -2.198 -1.450 -2.781 1.00 0.00 H new ATOM 57 N ILE A 5 -3.906 -3.378 -3.374 1.00 0.00 N ATOM 58 CA ILE A 5 -5.024 -3.902 -4.149 1.00 0.00 C ATOM 59 C ILE A 5 -5.003 -5.426 -4.184 1.00 0.00 C ATOM 60 O ILE A 5 -6.039 -6.068 -4.361 1.00 0.00 O ATOM 61 CB ILE A 5 -5.007 -3.367 -5.594 1.00 0.00 C ATOM 62 CG1 ILE A 5 -6.428 -3.043 -6.058 1.00 0.00 C ATOM 63 CG2 ILE A 5 -4.356 -4.378 -6.525 1.00 0.00 C ATOM 64 CD1 ILE A 5 -6.581 -1.641 -6.605 1.00 0.00 C ATOM 0 H ILE A 5 -3.271 -2.778 -3.901 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.935 -3.565 -3.655 1.00 0.00 H new ATOM 0 HB ILE A 5 -4.420 -2.449 -5.619 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -6.722 -3.758 -6.826 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.114 -3.174 -5.221 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -4.351 -3.986 -7.542 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -3.331 -4.562 -6.203 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -4.918 -5.312 -6.499 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -7.614 -1.482 -6.915 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -6.318 -0.918 -5.832 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -5.921 -1.511 -7.463 1.00 0.00 H new ATOM 76 N LEU A 6 -3.817 -6.000 -4.011 1.00 0.00 N ATOM 77 CA LEU A 6 -3.661 -7.450 -4.020 1.00 0.00 C ATOM 78 C LEU A 6 -3.593 -8.000 -2.599 1.00 0.00 C ATOM 79 O LEU A 6 -3.451 -7.245 -1.637 1.00 0.00 O ATOM 80 CB LEU A 6 -2.399 -7.842 -4.791 1.00 0.00 C ATOM 81 CG LEU A 6 -2.438 -9.197 -5.498 1.00 0.00 C ATOM 82 CD1 LEU A 6 -1.860 -10.283 -4.603 1.00 0.00 C ATOM 83 CD2 LEU A 6 -3.861 -9.543 -5.910 1.00 0.00 C ATOM 0 H LEU A 6 -2.950 -5.483 -3.863 1.00 0.00 H new ATOM 0 HA LEU A 6 -4.531 -7.881 -4.515 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -2.199 -7.072 -5.536 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -1.558 -7.841 -4.097 1.00 0.00 H new ATOM 0 HG LEU A 6 -1.826 -9.134 -6.398 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -1.896 -11.240 -5.123 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -0.825 -10.041 -4.359 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -2.444 -10.347 -3.685 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -3.869 -10.511 -6.412 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -4.495 -9.588 -5.025 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -4.239 -8.779 -6.589 1.00 0.00 H new ATOM 95 N SER A 7 -3.693 -9.319 -2.475 1.00 0.00 N ATOM 96 CA SER A 7 -3.645 -9.970 -1.170 1.00 0.00 C ATOM 97 C SER A 7 -2.205 -10.269 -0.766 1.00 0.00 C ATOM 98 O SER A 7 -1.475 -10.981 -1.455 1.00 0.00 O ATOM 99 CB SER A 7 -4.461 -11.264 -1.192 1.00 0.00 C ATOM 100 OG SER A 7 -4.484 -11.873 0.087 1.00 0.00 O ATOM 0 H SER A 7 -3.808 -9.958 -3.261 1.00 0.00 H new ATOM 0 HA SER A 7 -4.076 -9.290 -0.435 1.00 0.00 H new ATOM 0 HB2 SER A 7 -5.480 -11.050 -1.515 1.00 0.00 H new ATOM 0 HB3 SER A 7 -4.034 -11.954 -1.920 1.00 0.00 H new ATOM 0 HG SER A 7 -5.323 -12.367 0.199 1.00 0.00 H new ATOM 106 N PRO A 8 -1.785 -9.713 0.380 1.00 0.00 N ATOM 107 CA PRO A 8 -0.430 -9.906 0.904 1.00 0.00 C ATOM 108 C PRO A 8 -0.196 -11.331 1.396 1.00 0.00 C ATOM 109 O PRO A 8 0.936 -11.813 1.414 1.00 0.00 O ATOM 110 CB PRO A 8 -0.357 -8.919 2.072 1.00 0.00 C ATOM 111 CG PRO A 8 -1.772 -8.735 2.501 1.00 0.00 C ATOM 112 CD PRO A 8 -2.602 -8.853 1.253 1.00 0.00 C ATOM 0 HA PRO A 8 0.330 -9.740 0.140 1.00 0.00 H new ATOM 0 HB2 PRO A 8 0.255 -9.311 2.884 1.00 0.00 H new ATOM 0 HB3 PRO A 8 0.090 -7.974 1.764 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -2.059 -9.490 3.233 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -1.913 -7.763 2.973 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -3.575 -9.298 1.458 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -2.786 -7.879 0.799 1.00 0.00 H new ATOM 120 N SER A 9 -1.274 -12.000 1.793 1.00 0.00 N ATOM 121 CA SER A 9 -1.185 -13.368 2.288 1.00 0.00 C ATOM 122 C SER A 9 -1.465 -14.369 1.171 1.00 0.00 C ATOM 123 O SER A 9 -1.842 -15.513 1.427 1.00 0.00 O ATOM 124 CB SER A 9 -2.170 -13.582 3.438 1.00 0.00 C ATOM 125 OG SER A 9 -2.336 -12.396 4.195 1.00 0.00 O ATOM 0 H SER A 9 -2.219 -11.616 1.781 1.00 0.00 H new ATOM 0 HA SER A 9 -0.171 -13.531 2.653 1.00 0.00 H new ATOM 0 HB2 SER A 9 -3.134 -13.901 3.041 1.00 0.00 H new ATOM 0 HB3 SER A 9 -1.811 -14.382 4.085 1.00 0.00 H new ATOM 0 HG SER A 9 -2.972 -12.559 4.923 1.00 0.00 H new ATOM 131 N ASP A 10 -1.278 -13.930 -0.069 1.00 0.00 N ATOM 132 CA ASP A 10 -1.508 -14.786 -1.227 1.00 0.00 C ATOM 133 C ASP A 10 -0.284 -14.812 -2.137 1.00 0.00 C ATOM 134 O ASP A 10 -0.004 -15.818 -2.788 1.00 0.00 O ATOM 135 CB ASP A 10 -2.731 -14.304 -2.009 1.00 0.00 C ATOM 136 CG ASP A 10 -4.010 -14.395 -1.199 1.00 0.00 C ATOM 137 OD1 ASP A 10 -3.941 -14.823 -0.028 1.00 0.00 O ATOM 138 OD2 ASP A 10 -5.078 -14.039 -1.737 1.00 0.00 O ATOM 0 H ASP A 10 -0.968 -12.986 -0.298 1.00 0.00 H new ATOM 0 HA ASP A 10 -1.692 -15.799 -0.868 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -2.575 -13.271 -2.321 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -2.836 -14.899 -2.916 1.00 0.00 H new ATOM 143 N ILE A 11 0.440 -13.698 -2.177 1.00 0.00 N ATOM 144 CA ILE A 11 1.633 -13.593 -3.007 1.00 0.00 C ATOM 145 C ILE A 11 2.737 -14.515 -2.501 1.00 0.00 C ATOM 146 O ILE A 11 3.557 -15.004 -3.278 1.00 0.00 O ATOM 147 CB ILE A 11 2.165 -12.149 -3.048 1.00 0.00 C ATOM 148 CG1 ILE A 11 1.079 -11.196 -3.553 1.00 0.00 C ATOM 149 CG2 ILE A 11 3.403 -12.065 -3.929 1.00 0.00 C ATOM 150 CD1 ILE A 11 0.971 -9.921 -2.747 1.00 0.00 C ATOM 0 H ILE A 11 0.221 -12.856 -1.644 1.00 0.00 H new ATOM 0 HA ILE A 11 1.344 -13.894 -4.014 1.00 0.00 H new ATOM 0 HB ILE A 11 2.442 -11.851 -2.037 1.00 0.00 H new ATOM 0 HG12 ILE A 11 1.285 -10.942 -4.593 1.00 0.00 H new ATOM 0 HG13 ILE A 11 0.118 -11.710 -3.534 1.00 0.00 H new ATOM 0 HG21 ILE A 11 3.767 -11.038 -3.948 1.00 0.00 H new ATOM 0 HG22 ILE A 11 4.179 -12.718 -3.529 1.00 0.00 H new ATOM 0 HG23 ILE A 11 3.151 -12.379 -4.942 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.182 -9.294 -3.162 1.00 0.00 H new ATOM 0 HD12 ILE A 11 0.735 -10.164 -1.711 1.00 0.00 H new ATOM 0 HD13 ILE A 11 1.919 -9.384 -2.786 1.00 0.00 H new ATOM 162 N ALA A 12 2.751 -14.751 -1.193 1.00 0.00 N ATOM 163 CA ALA A 12 3.752 -15.618 -0.583 1.00 0.00 C ATOM 164 C ALA A 12 3.532 -17.074 -0.980 1.00 0.00 C ATOM 165 O ALA A 12 4.487 -17.833 -1.142 1.00 0.00 O ATOM 166 CB ALA A 12 3.725 -15.472 0.931 1.00 0.00 C ATOM 0 H ALA A 12 2.080 -14.354 -0.535 1.00 0.00 H new ATOM 0 HA ALA A 12 4.732 -15.313 -0.949 1.00 0.00 H new ATOM 0 HB1 ALA A 12 4.477 -16.125 1.373 1.00 0.00 H new ATOM 0 HB2 ALA A 12 3.939 -14.438 1.201 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.739 -15.748 1.306 1.00 0.00 H new ATOM 172 N ALA A 13 2.269 -17.456 -1.135 1.00 0.00 N ATOM 173 CA ALA A 13 1.924 -18.820 -1.514 1.00 0.00 C ATOM 174 C ALA A 13 2.500 -19.172 -2.882 1.00 0.00 C ATOM 175 O ALA A 13 2.749 -20.340 -3.179 1.00 0.00 O ATOM 176 CB ALA A 13 0.414 -19.003 -1.512 1.00 0.00 C ATOM 0 H ALA A 13 1.467 -16.839 -1.004 1.00 0.00 H new ATOM 0 HA ALA A 13 2.361 -19.496 -0.780 1.00 0.00 H new ATOM 0 HB1 ALA A 13 0.171 -20.027 -1.797 1.00 0.00 H new ATOM 0 HB2 ALA A 13 0.024 -18.802 -0.514 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -0.037 -18.312 -2.224 1.00 0.00 H new ATOM 182 N ALA A 14 2.707 -18.154 -3.711 1.00 0.00 N ATOM 183 CA ALA A 14 3.255 -18.356 -5.046 1.00 0.00 C ATOM 184 C ALA A 14 4.779 -18.356 -5.021 1.00 0.00 C ATOM 185 O ALA A 14 5.421 -19.215 -5.627 1.00 0.00 O ATOM 186 CB ALA A 14 2.741 -17.283 -5.995 1.00 0.00 C ATOM 0 H ALA A 14 2.503 -17.181 -3.481 1.00 0.00 H new ATOM 0 HA ALA A 14 2.924 -19.331 -5.403 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.158 -17.446 -6.989 1.00 0.00 H new ATOM 0 HB2 ALA A 14 1.653 -17.333 -6.046 1.00 0.00 H new ATOM 0 HB3 ALA A 14 3.043 -16.301 -5.631 1.00 0.00 H new ATOM 192 N LEU A 15 5.354 -17.387 -4.317 1.00 0.00 N ATOM 193 CA LEU A 15 6.805 -17.274 -4.213 1.00 0.00 C ATOM 194 C LEU A 15 7.416 -18.570 -3.689 1.00 0.00 C ATOM 195 O LEU A 15 8.584 -18.865 -3.942 1.00 0.00 O ATOM 196 CB LEU A 15 7.182 -16.111 -3.294 1.00 0.00 C ATOM 197 CG LEU A 15 6.922 -14.709 -3.845 1.00 0.00 C ATOM 198 CD1 LEU A 15 7.119 -13.663 -2.759 1.00 0.00 C ATOM 199 CD2 LEU A 15 7.831 -14.425 -5.032 1.00 0.00 C ATOM 0 H LEU A 15 4.838 -16.668 -3.810 1.00 0.00 H new ATOM 0 HA LEU A 15 7.202 -17.084 -5.210 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.632 -16.220 -2.359 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.242 -16.194 -3.052 1.00 0.00 H new ATOM 0 HG LEU A 15 5.887 -14.660 -4.185 1.00 0.00 H new ATOM 0 HD11 LEU A 15 6.930 -12.671 -3.170 1.00 0.00 H new ATOM 0 HD12 LEU A 15 6.426 -13.854 -1.939 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.143 -13.712 -2.388 1.00 0.00 H new ATOM 0 HD21 LEU A 15 7.632 -13.423 -5.411 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.872 -14.494 -4.717 1.00 0.00 H new ATOM 0 HD23 LEU A 15 7.641 -15.155 -5.819 1.00 0.00 H new ATOM 211 N ARG A 16 6.617 -19.341 -2.958 1.00 0.00 N ATOM 212 CA ARG A 16 7.078 -20.606 -2.399 1.00 0.00 C ATOM 213 C ARG A 16 6.799 -21.759 -3.358 1.00 0.00 C ATOM 214 O ARG A 16 7.705 -22.508 -3.725 1.00 0.00 O ATOM 215 CB ARG A 16 6.399 -20.872 -1.054 1.00 0.00 C ATOM 216 CG ARG A 16 6.920 -22.109 -0.342 1.00 0.00 C ATOM 217 CD ARG A 16 5.783 -22.985 0.159 1.00 0.00 C ATOM 218 NE ARG A 16 4.862 -22.247 1.020 1.00 0.00 N ATOM 219 CZ ARG A 16 3.651 -22.684 1.346 1.00 0.00 C ATOM 220 NH1 ARG A 16 3.217 -23.849 0.885 1.00 0.00 N ATOM 221 NH2 ARG A 16 2.871 -21.956 2.135 1.00 0.00 N ATOM 0 H ARG A 16 5.648 -19.112 -2.739 1.00 0.00 H new ATOM 0 HA ARG A 16 8.155 -20.535 -2.247 1.00 0.00 H new ATOM 0 HB2 ARG A 16 6.540 -20.005 -0.408 1.00 0.00 H new ATOM 0 HB3 ARG A 16 5.326 -20.980 -1.213 1.00 0.00 H new ATOM 0 HG2 ARG A 16 7.550 -22.683 -1.022 1.00 0.00 H new ATOM 0 HG3 ARG A 16 7.547 -21.810 0.498 1.00 0.00 H new ATOM 0 HD2 ARG A 16 5.237 -23.392 -0.692 1.00 0.00 H new ATOM 0 HD3 ARG A 16 6.193 -23.832 0.709 1.00 0.00 H new ATOM 0 HE ARG A 16 5.166 -21.347 1.391 1.00 0.00 H new ATOM 0 HH11 ARG A 16 3.814 -24.412 0.279 1.00 0.00 H new ATOM 0 HH12 ARG A 16 2.287 -24.182 1.137 1.00 0.00 H new ATOM 0 HH21 ARG A 16 3.201 -21.059 2.492 1.00 0.00 H new ATOM 0 HH22 ARG A 16 1.941 -22.293 2.384 1.00 0.00 H new ATOM 235 N ASP A 17 5.540 -21.895 -3.760 1.00 0.00 N ATOM 236 CA ASP A 17 5.141 -22.957 -4.677 1.00 0.00 C ATOM 237 C ASP A 17 5.883 -22.835 -6.005 1.00 0.00 C ATOM 238 O ASP A 17 5.947 -23.789 -6.781 1.00 0.00 O ATOM 239 CB ASP A 17 3.631 -22.912 -4.917 1.00 0.00 C ATOM 240 CG ASP A 17 3.049 -24.282 -5.205 1.00 0.00 C ATOM 241 OD1 ASP A 17 3.567 -25.275 -4.651 1.00 0.00 O ATOM 242 OD2 ASP A 17 2.076 -24.361 -5.982 1.00 0.00 O ATOM 0 H ASP A 17 4.778 -21.284 -3.466 1.00 0.00 H new ATOM 0 HA ASP A 17 5.401 -23.913 -4.222 1.00 0.00 H new ATOM 0 HB2 ASP A 17 3.139 -22.489 -4.041 1.00 0.00 H new ATOM 0 HB3 ASP A 17 3.419 -22.247 -5.754 1.00 0.00 H new ATOM 247 N CYS A 18 6.440 -21.657 -6.259 1.00 0.00 N ATOM 248 CA CYS A 18 7.176 -21.410 -7.494 1.00 0.00 C ATOM 249 C CYS A 18 8.608 -20.977 -7.196 1.00 0.00 C ATOM 250 O CYS A 18 9.124 -20.043 -7.809 1.00 0.00 O ATOM 251 CB CYS A 18 6.470 -20.340 -8.328 1.00 0.00 C ATOM 252 SG CYS A 18 4.695 -20.616 -8.533 1.00 0.00 S ATOM 0 H CYS A 18 6.396 -20.858 -5.627 1.00 0.00 H new ATOM 0 HA CYS A 18 7.207 -22.340 -8.061 1.00 0.00 H new ATOM 0 HB2 CYS A 18 6.624 -19.368 -7.858 1.00 0.00 H new ATOM 0 HB3 CYS A 18 6.936 -20.296 -9.312 1.00 0.00 H new ATOM 0 HG CYS A 18 4.187 -19.658 -9.250 1.00 0.00 H new ATOM 258 N GLN A 19 9.243 -21.661 -6.249 1.00 0.00 N ATOM 259 CA GLN A 19 10.614 -21.345 -5.868 1.00 0.00 C ATOM 260 C GLN A 19 11.610 -22.109 -6.735 1.00 0.00 C ATOM 261 O GLN A 19 12.796 -22.185 -6.415 1.00 0.00 O ATOM 262 CB GLN A 19 10.845 -21.674 -4.393 1.00 0.00 C ATOM 263 CG GLN A 19 12.035 -20.948 -3.786 1.00 0.00 C ATOM 264 CD GLN A 19 11.948 -20.846 -2.276 1.00 0.00 C ATOM 265 OE1 GLN A 19 12.806 -21.359 -1.557 1.00 0.00 O ATOM 266 NE2 GLN A 19 10.908 -20.180 -1.787 1.00 0.00 N ATOM 0 H GLN A 19 8.830 -22.437 -5.732 1.00 0.00 H new ATOM 0 HA GLN A 19 10.770 -20.277 -6.023 1.00 0.00 H new ATOM 0 HB2 GLN A 19 9.948 -21.420 -3.828 1.00 0.00 H new ATOM 0 HB3 GLN A 19 10.994 -22.749 -4.288 1.00 0.00 H new ATOM 0 HG2 GLN A 19 12.952 -21.470 -4.059 1.00 0.00 H new ATOM 0 HG3 GLN A 19 12.100 -19.946 -4.211 1.00 0.00 H new ATOM 0 HE21 GLN A 19 10.221 -19.771 -2.420 1.00 0.00 H new ATOM 0 HE22 GLN A 19 10.797 -20.078 -0.778 1.00 0.00 H new ATOM 275 N ALA A 20 11.119 -22.675 -7.832 1.00 0.00 N ATOM 276 CA ALA A 20 11.966 -23.433 -8.745 1.00 0.00 C ATOM 277 C ALA A 20 12.145 -22.695 -10.068 1.00 0.00 C ATOM 278 O ALA A 20 11.377 -21.798 -10.414 1.00 0.00 O ATOM 279 CB ALA A 20 11.378 -24.816 -8.985 1.00 0.00 C ATOM 0 H ALA A 20 10.139 -22.623 -8.110 1.00 0.00 H new ATOM 0 HA ALA A 20 12.948 -23.543 -8.284 1.00 0.00 H new ATOM 0 HB1 ALA A 20 12.021 -25.371 -9.669 1.00 0.00 H new ATOM 0 HB2 ALA A 20 11.308 -25.351 -8.038 1.00 0.00 H new ATOM 0 HB3 ALA A 20 10.384 -24.718 -9.421 1.00 0.00 H new ATOM 285 N PRO A 21 13.183 -23.080 -10.825 1.00 0.00 N ATOM 286 CA PRO A 21 13.488 -22.468 -12.121 1.00 0.00 C ATOM 287 C PRO A 21 12.454 -22.820 -13.186 1.00 0.00 C ATOM 288 O PRO A 21 12.054 -23.977 -13.317 1.00 0.00 O ATOM 289 CB PRO A 21 14.851 -23.061 -12.482 1.00 0.00 C ATOM 290 CG PRO A 21 14.907 -24.356 -11.749 1.00 0.00 C ATOM 291 CD PRO A 21 14.140 -24.144 -10.474 1.00 0.00 C ATOM 0 HA PRO A 21 13.483 -21.379 -12.069 1.00 0.00 H new ATOM 0 HB2 PRO A 21 14.945 -23.211 -13.558 1.00 0.00 H new ATOM 0 HB3 PRO A 21 15.663 -22.400 -12.180 1.00 0.00 H new ATOM 0 HG2 PRO A 21 14.466 -25.158 -12.341 1.00 0.00 H new ATOM 0 HG3 PRO A 21 15.938 -24.642 -11.541 1.00 0.00 H new ATOM 0 HD2 PRO A 21 13.631 -25.054 -10.155 1.00 0.00 H new ATOM 0 HD3 PRO A 21 14.795 -23.842 -9.657 1.00 0.00 H new ATOM 299 N ASP A 22 12.027 -21.817 -13.944 1.00 0.00 N ATOM 300 CA ASP A 22 11.041 -22.021 -14.999 1.00 0.00 C ATOM 301 C ASP A 22 9.713 -22.496 -14.417 1.00 0.00 C ATOM 302 O ASP A 22 8.904 -23.112 -15.111 1.00 0.00 O ATOM 303 CB ASP A 22 11.557 -23.038 -16.018 1.00 0.00 C ATOM 304 CG ASP A 22 10.714 -23.073 -17.278 1.00 0.00 C ATOM 305 OD1 ASP A 22 10.604 -22.025 -17.947 1.00 0.00 O ATOM 306 OD2 ASP A 22 10.164 -24.149 -17.594 1.00 0.00 O ATOM 0 H ASP A 22 12.348 -20.854 -13.848 1.00 0.00 H new ATOM 0 HA ASP A 22 10.878 -21.067 -15.499 1.00 0.00 H new ATOM 0 HB2 ASP A 22 12.587 -22.795 -16.280 1.00 0.00 H new ATOM 0 HB3 ASP A 22 11.569 -24.029 -15.564 1.00 0.00 H new ATOM 311 N SER A 23 9.496 -22.205 -13.138 1.00 0.00 N ATOM 312 CA SER A 23 8.268 -22.606 -12.461 1.00 0.00 C ATOM 313 C SER A 23 7.469 -21.384 -12.017 1.00 0.00 C ATOM 314 O SER A 23 6.273 -21.478 -11.738 1.00 0.00 O ATOM 315 CB SER A 23 8.591 -23.485 -11.251 1.00 0.00 C ATOM 316 OG SER A 23 7.407 -23.960 -10.635 1.00 0.00 O ATOM 0 H SER A 23 10.154 -21.693 -12.550 1.00 0.00 H new ATOM 0 HA SER A 23 7.664 -23.178 -13.166 1.00 0.00 H new ATOM 0 HB2 SER A 23 9.205 -24.329 -11.564 1.00 0.00 H new ATOM 0 HB3 SER A 23 9.177 -22.915 -10.530 1.00 0.00 H new ATOM 0 HG SER A 23 7.641 -24.520 -9.866 1.00 0.00 H new ATOM 322 N PHE A 24 8.138 -20.238 -11.954 1.00 0.00 N ATOM 323 CA PHE A 24 7.492 -18.997 -11.543 1.00 0.00 C ATOM 324 C PHE A 24 7.266 -18.079 -12.741 1.00 0.00 C ATOM 325 O PHE A 24 8.195 -17.783 -13.493 1.00 0.00 O ATOM 326 CB PHE A 24 8.339 -18.281 -10.489 1.00 0.00 C ATOM 327 CG PHE A 24 7.898 -16.870 -10.224 1.00 0.00 C ATOM 328 CD1 PHE A 24 6.762 -16.614 -9.473 1.00 0.00 C ATOM 329 CD2 PHE A 24 8.619 -15.798 -10.726 1.00 0.00 C ATOM 330 CE1 PHE A 24 6.354 -15.317 -9.226 1.00 0.00 C ATOM 331 CE2 PHE A 24 8.216 -14.499 -10.482 1.00 0.00 C ATOM 332 CZ PHE A 24 7.082 -14.258 -9.732 1.00 0.00 C ATOM 0 H PHE A 24 9.128 -20.143 -12.182 1.00 0.00 H new ATOM 0 HA PHE A 24 6.523 -19.247 -11.111 1.00 0.00 H new ATOM 0 HB2 PHE A 24 8.300 -18.846 -9.558 1.00 0.00 H new ATOM 0 HB3 PHE A 24 9.379 -18.273 -10.814 1.00 0.00 H new ATOM 0 HD1 PHE A 24 6.188 -17.438 -9.076 1.00 0.00 H new ATOM 0 HD2 PHE A 24 9.506 -15.980 -11.315 1.00 0.00 H new ATOM 0 HE1 PHE A 24 5.467 -15.132 -8.638 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.788 -13.673 -10.878 1.00 0.00 H new ATOM 0 HZ PHE A 24 6.765 -13.243 -9.541 1.00 0.00 H new ATOM 342 N SER A 25 6.027 -17.631 -12.911 1.00 0.00 N ATOM 343 CA SER A 25 5.677 -16.750 -14.019 1.00 0.00 C ATOM 344 C SER A 25 4.510 -15.842 -13.644 1.00 0.00 C ATOM 345 O SER A 25 3.751 -16.115 -12.713 1.00 0.00 O ATOM 346 CB SER A 25 5.320 -17.572 -15.259 1.00 0.00 C ATOM 347 OG SER A 25 5.821 -18.894 -15.156 1.00 0.00 O ATOM 0 H SER A 25 5.248 -17.864 -12.295 1.00 0.00 H new ATOM 0 HA SER A 25 6.543 -16.126 -14.242 1.00 0.00 H new ATOM 0 HB2 SER A 25 4.237 -17.599 -15.382 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.730 -17.092 -16.148 1.00 0.00 H new ATOM 0 HG SER A 25 5.578 -19.399 -15.960 1.00 0.00 H new ATOM 353 N PRO A 26 4.362 -14.734 -14.385 1.00 0.00 N ATOM 354 CA PRO A 26 3.290 -13.762 -14.150 1.00 0.00 C ATOM 355 C PRO A 26 1.917 -14.312 -14.521 1.00 0.00 C ATOM 356 O PRO A 26 0.895 -13.855 -14.010 1.00 0.00 O ATOM 357 CB PRO A 26 3.664 -12.593 -15.065 1.00 0.00 C ATOM 358 CG PRO A 26 4.481 -13.207 -16.148 1.00 0.00 C ATOM 359 CD PRO A 26 5.229 -14.344 -15.509 1.00 0.00 C ATOM 0 HA PRO A 26 3.211 -13.489 -13.098 1.00 0.00 H new ATOM 0 HB2 PRO A 26 2.776 -12.105 -15.467 1.00 0.00 H new ATOM 0 HB3 PRO A 26 4.229 -11.833 -14.525 1.00 0.00 H new ATOM 0 HG2 PRO A 26 3.847 -13.564 -16.960 1.00 0.00 H new ATOM 0 HG3 PRO A 26 5.170 -12.479 -16.577 1.00 0.00 H new ATOM 0 HD2 PRO A 26 5.379 -15.169 -16.206 1.00 0.00 H new ATOM 0 HD3 PRO A 26 6.216 -14.033 -15.166 1.00 0.00 H new ATOM 367 N LYS A 27 1.901 -15.296 -15.414 1.00 0.00 N ATOM 368 CA LYS A 27 0.654 -15.910 -15.854 1.00 0.00 C ATOM 369 C LYS A 27 0.390 -17.208 -15.096 1.00 0.00 C ATOM 370 O LYS A 27 -0.339 -18.079 -15.571 1.00 0.00 O ATOM 371 CB LYS A 27 0.700 -16.186 -17.358 1.00 0.00 C ATOM 372 CG LYS A 27 1.599 -17.350 -17.736 1.00 0.00 C ATOM 373 CD LYS A 27 1.942 -17.333 -19.216 1.00 0.00 C ATOM 374 CE LYS A 27 3.003 -18.368 -19.555 1.00 0.00 C ATOM 375 NZ LYS A 27 2.502 -19.758 -19.368 1.00 0.00 N ATOM 0 H LYS A 27 2.738 -15.685 -15.847 1.00 0.00 H new ATOM 0 HA LYS A 27 -0.158 -15.215 -15.643 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -0.311 -16.388 -17.713 1.00 0.00 H new ATOM 0 HB3 LYS A 27 1.045 -15.289 -17.873 1.00 0.00 H new ATOM 0 HG2 LYS A 27 2.516 -17.308 -17.149 1.00 0.00 H new ATOM 0 HG3 LYS A 27 1.104 -18.289 -17.487 1.00 0.00 H new ATOM 0 HD2 LYS A 27 1.043 -17.527 -19.801 1.00 0.00 H new ATOM 0 HD3 LYS A 27 2.297 -16.341 -19.497 1.00 0.00 H new ATOM 0 HE2 LYS A 27 3.324 -18.234 -20.588 1.00 0.00 H new ATOM 0 HE3 LYS A 27 3.879 -18.210 -18.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 3.249 -20.434 -19.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 2.235 -19.900 -18.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 1.672 -19.912 -19.975 1.00 0.00 H new ATOM 389 N LYS A 28 0.987 -17.330 -13.915 1.00 0.00 N ATOM 390 CA LYS A 28 0.815 -18.520 -13.090 1.00 0.00 C ATOM 391 C LYS A 28 0.419 -18.141 -11.666 1.00 0.00 C ATOM 392 O LYS A 28 -0.417 -18.801 -11.048 1.00 0.00 O ATOM 393 CB LYS A 28 2.105 -19.343 -13.070 1.00 0.00 C ATOM 394 CG LYS A 28 1.882 -20.816 -12.778 1.00 0.00 C ATOM 395 CD LYS A 28 2.019 -21.119 -11.296 1.00 0.00 C ATOM 396 CE LYS A 28 1.630 -22.555 -10.981 1.00 0.00 C ATOM 397 NZ LYS A 28 1.838 -22.884 -9.544 1.00 0.00 N ATOM 0 H LYS A 28 1.594 -16.619 -13.508 1.00 0.00 H new ATOM 0 HA LYS A 28 0.015 -19.120 -13.524 1.00 0.00 H new ATOM 0 HB2 LYS A 28 2.604 -19.244 -14.034 1.00 0.00 H new ATOM 0 HB3 LYS A 28 2.778 -18.930 -12.318 1.00 0.00 H new ATOM 0 HG2 LYS A 28 0.889 -21.109 -13.120 1.00 0.00 H new ATOM 0 HG3 LYS A 28 2.601 -21.412 -13.340 1.00 0.00 H new ATOM 0 HD2 LYS A 28 3.048 -20.942 -10.981 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.389 -20.437 -10.725 1.00 0.00 H new ATOM 0 HE2 LYS A 28 0.584 -22.713 -11.242 1.00 0.00 H new ATOM 0 HE3 LYS A 28 2.218 -23.234 -11.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 2.145 -23.874 -9.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 2.568 -22.258 -9.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 0.947 -22.750 -9.025 1.00 0.00 H new ATOM 411 N PHE A 29 1.023 -17.075 -11.152 1.00 0.00 N ATOM 412 CA PHE A 29 0.733 -16.609 -9.801 1.00 0.00 C ATOM 413 C PHE A 29 -0.492 -15.699 -9.792 1.00 0.00 C ATOM 414 O PHE A 29 -1.016 -15.355 -8.732 1.00 0.00 O ATOM 415 CB PHE A 29 1.939 -15.865 -9.225 1.00 0.00 C ATOM 416 CG PHE A 29 1.912 -14.386 -9.485 1.00 0.00 C ATOM 417 CD1 PHE A 29 2.090 -13.891 -10.766 1.00 0.00 C ATOM 418 CD2 PHE A 29 1.706 -13.491 -8.447 1.00 0.00 C ATOM 419 CE1 PHE A 29 2.066 -12.530 -11.008 1.00 0.00 C ATOM 420 CE2 PHE A 29 1.681 -12.129 -8.683 1.00 0.00 C ATOM 421 CZ PHE A 29 1.860 -11.648 -9.965 1.00 0.00 C ATOM 0 H PHE A 29 1.716 -16.517 -11.651 1.00 0.00 H new ATOM 0 HA PHE A 29 0.522 -17.480 -9.180 1.00 0.00 H new ATOM 0 HB2 PHE A 29 1.981 -16.036 -8.149 1.00 0.00 H new ATOM 0 HB3 PHE A 29 2.851 -16.284 -9.650 1.00 0.00 H new ATOM 0 HD1 PHE A 29 2.249 -14.576 -11.586 1.00 0.00 H new ATOM 0 HD2 PHE A 29 1.563 -13.862 -7.443 1.00 0.00 H new ATOM 0 HE1 PHE A 29 2.208 -12.157 -12.011 1.00 0.00 H new ATOM 0 HE2 PHE A 29 1.522 -11.442 -7.865 1.00 0.00 H new ATOM 0 HZ PHE A 29 1.839 -10.584 -10.152 1.00 0.00 H new ATOM 431 N PHE A 30 -0.943 -15.312 -10.980 1.00 0.00 N ATOM 432 CA PHE A 30 -2.105 -14.440 -11.110 1.00 0.00 C ATOM 433 C PHE A 30 -3.303 -15.016 -10.361 1.00 0.00 C ATOM 434 O PHE A 30 -4.176 -14.278 -9.904 1.00 0.00 O ATOM 435 CB PHE A 30 -2.459 -14.243 -12.585 1.00 0.00 C ATOM 436 CG PHE A 30 -3.085 -15.452 -13.219 1.00 0.00 C ATOM 437 CD1 PHE A 30 -2.318 -16.562 -13.533 1.00 0.00 C ATOM 438 CD2 PHE A 30 -4.442 -15.479 -13.500 1.00 0.00 C ATOM 439 CE1 PHE A 30 -2.891 -17.677 -14.115 1.00 0.00 C ATOM 440 CE2 PHE A 30 -5.021 -16.591 -14.082 1.00 0.00 C ATOM 441 CZ PHE A 30 -4.244 -17.691 -14.391 1.00 0.00 C ATOM 0 H PHE A 30 -0.522 -15.588 -11.867 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.854 -13.474 -10.672 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -3.143 -13.400 -12.676 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -1.555 -13.981 -13.135 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -1.259 -16.556 -13.320 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -5.054 -14.622 -13.262 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -2.281 -18.536 -14.354 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -6.080 -16.600 -14.295 1.00 0.00 H new ATOM 0 HZ PHE A 30 -4.694 -18.560 -14.848 1.00 0.00 H new ATOM 451 N GLN A 31 -3.338 -16.339 -10.239 1.00 0.00 N ATOM 452 CA GLN A 31 -4.429 -17.014 -9.546 1.00 0.00 C ATOM 453 C GLN A 31 -4.060 -17.295 -8.093 1.00 0.00 C ATOM 454 O GLN A 31 -4.929 -17.357 -7.223 1.00 0.00 O ATOM 455 CB GLN A 31 -4.781 -18.322 -10.258 1.00 0.00 C ATOM 456 CG GLN A 31 -3.770 -19.433 -10.024 1.00 0.00 C ATOM 457 CD GLN A 31 -3.632 -20.357 -11.218 1.00 0.00 C ATOM 458 OE1 GLN A 31 -4.625 -20.851 -11.753 1.00 0.00 O ATOM 459 NE2 GLN A 31 -2.397 -20.597 -11.642 1.00 0.00 N ATOM 0 H GLN A 31 -2.623 -16.965 -10.611 1.00 0.00 H new ATOM 0 HA GLN A 31 -5.298 -16.356 -9.560 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -5.762 -18.657 -9.920 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -4.860 -18.133 -11.329 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -2.799 -18.993 -9.795 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -4.070 -20.014 -9.152 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -1.603 -20.166 -11.169 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -2.243 -21.212 -12.441 1.00 0.00 H new ATOM 468 N ILE A 32 -2.767 -17.466 -7.839 1.00 0.00 N ATOM 469 CA ILE A 32 -2.285 -17.739 -6.491 1.00 0.00 C ATOM 470 C ILE A 32 -2.385 -16.500 -5.608 1.00 0.00 C ATOM 471 O ILE A 32 -2.882 -16.564 -4.484 1.00 0.00 O ATOM 472 CB ILE A 32 -0.824 -18.229 -6.504 1.00 0.00 C ATOM 473 CG1 ILE A 32 -0.708 -19.533 -7.296 1.00 0.00 C ATOM 474 CG2 ILE A 32 -0.316 -18.418 -5.083 1.00 0.00 C ATOM 475 CD1 ILE A 32 0.651 -19.736 -7.929 1.00 0.00 C ATOM 0 H ILE A 32 -2.035 -17.420 -8.548 1.00 0.00 H new ATOM 0 HA ILE A 32 -2.921 -18.525 -6.083 1.00 0.00 H new ATOM 0 HB ILE A 32 -0.207 -17.474 -6.991 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -0.920 -20.372 -6.633 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.469 -19.544 -8.077 1.00 0.00 H new ATOM 0 HG21 ILE A 32 0.717 -18.764 -5.109 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.367 -17.469 -4.549 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -0.933 -19.156 -4.571 1.00 0.00 H new ATOM 0 HD11 ILE A 32 0.661 -20.680 -8.474 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.858 -18.917 -8.618 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.415 -19.758 -7.152 1.00 0.00 H new ATOM 487 N SER A 33 -1.912 -15.371 -6.127 1.00 0.00 N ATOM 488 CA SER A 33 -1.946 -14.116 -5.385 1.00 0.00 C ATOM 489 C SER A 33 -3.354 -13.527 -5.379 1.00 0.00 C ATOM 490 O SER A 33 -3.822 -13.019 -4.361 1.00 0.00 O ATOM 491 CB SER A 33 -0.964 -13.113 -5.993 1.00 0.00 C ATOM 492 OG SER A 33 -1.642 -12.152 -6.785 1.00 0.00 O ATOM 0 H SER A 33 -1.501 -15.300 -7.058 1.00 0.00 H new ATOM 0 HA SER A 33 -1.653 -14.322 -4.356 1.00 0.00 H new ATOM 0 HB2 SER A 33 -0.413 -12.610 -5.198 1.00 0.00 H new ATOM 0 HB3 SER A 33 -0.231 -13.641 -6.604 1.00 0.00 H new ATOM 0 HG SER A 33 -1.088 -11.348 -6.869 1.00 0.00 H new ATOM 498 N GLY A 34 -4.024 -13.601 -6.525 1.00 0.00 N ATOM 499 CA GLY A 34 -5.372 -13.072 -6.631 1.00 0.00 C ATOM 500 C GLY A 34 -5.476 -11.950 -7.646 1.00 0.00 C ATOM 501 O GLY A 34 -6.386 -11.125 -7.577 1.00 0.00 O ATOM 0 H GLY A 34 -3.658 -14.017 -7.381 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -6.053 -13.875 -6.911 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -5.693 -12.707 -5.656 1.00 0.00 H new ATOM 505 N MET A 35 -4.540 -11.918 -8.589 1.00 0.00 N ATOM 506 CA MET A 35 -4.530 -10.888 -9.621 1.00 0.00 C ATOM 507 C MET A 35 -5.575 -11.183 -10.692 1.00 0.00 C ATOM 508 O MET A 35 -5.925 -10.311 -11.488 1.00 0.00 O ATOM 509 CB MET A 35 -3.143 -10.788 -10.259 1.00 0.00 C ATOM 510 CG MET A 35 -2.074 -10.271 -9.310 1.00 0.00 C ATOM 511 SD MET A 35 -0.774 -9.356 -10.161 1.00 0.00 S ATOM 512 CE MET A 35 -0.547 -10.368 -11.621 1.00 0.00 C ATOM 0 H MET A 35 -3.779 -12.593 -8.660 1.00 0.00 H new ATOM 0 HA MET A 35 -4.775 -9.935 -9.151 1.00 0.00 H new ATOM 0 HB2 MET A 35 -2.848 -11.772 -10.624 1.00 0.00 H new ATOM 0 HB3 MET A 35 -3.197 -10.129 -11.126 1.00 0.00 H new ATOM 0 HG2 MET A 35 -2.538 -9.626 -8.563 1.00 0.00 H new ATOM 0 HG3 MET A 35 -1.631 -11.111 -8.775 1.00 0.00 H new ATOM 0 HE1 MET A 35 0.449 -10.198 -12.031 1.00 0.00 H new ATOM 0 HE2 MET A 35 -0.655 -11.420 -11.355 1.00 0.00 H new ATOM 0 HE3 MET A 35 -1.296 -10.104 -12.367 1.00 0.00 H new ATOM 522 N SER A 36 -6.070 -12.416 -10.707 1.00 0.00 N ATOM 523 CA SER A 36 -7.072 -12.826 -11.684 1.00 0.00 C ATOM 524 C SER A 36 -8.264 -11.874 -11.671 1.00 0.00 C ATOM 525 O SER A 36 -8.889 -11.629 -12.703 1.00 0.00 O ATOM 526 CB SER A 36 -7.542 -14.253 -11.395 1.00 0.00 C ATOM 527 OG SER A 36 -8.455 -14.699 -12.383 1.00 0.00 O ATOM 0 H SER A 36 -5.794 -13.149 -10.054 1.00 0.00 H new ATOM 0 HA SER A 36 -6.614 -12.795 -12.673 1.00 0.00 H new ATOM 0 HB2 SER A 36 -6.682 -14.922 -11.361 1.00 0.00 H new ATOM 0 HB3 SER A 36 -8.015 -14.292 -10.414 1.00 0.00 H new ATOM 0 HG SER A 36 -8.739 -15.614 -12.177 1.00 0.00 H new ATOM 533 N LYS A 37 -8.574 -11.340 -10.495 1.00 0.00 N ATOM 534 CA LYS A 37 -9.690 -10.413 -10.345 1.00 0.00 C ATOM 535 C LYS A 37 -9.416 -9.108 -11.085 1.00 0.00 C ATOM 536 O LYS A 37 -10.340 -8.445 -11.558 1.00 0.00 O ATOM 537 CB LYS A 37 -9.948 -10.128 -8.864 1.00 0.00 C ATOM 538 CG LYS A 37 -10.168 -11.380 -8.032 1.00 0.00 C ATOM 539 CD LYS A 37 -10.387 -11.045 -6.567 1.00 0.00 C ATOM 540 CE LYS A 37 -10.000 -12.207 -5.665 1.00 0.00 C ATOM 541 NZ LYS A 37 -10.766 -13.442 -5.992 1.00 0.00 N ATOM 0 H LYS A 37 -8.068 -11.533 -9.631 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.576 -10.877 -10.779 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -9.102 -9.575 -8.456 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.823 -9.484 -8.774 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.031 -11.925 -8.414 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -9.306 -12.039 -8.130 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -9.799 -10.166 -6.302 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -11.434 -10.789 -6.404 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -8.933 -12.404 -5.765 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -10.178 -11.934 -4.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -10.575 -14.169 -5.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -11.783 -13.226 -6.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -10.475 -13.794 -6.926 1.00 0.00 H new ATOM 555 N LYS A 38 -8.142 -8.745 -11.183 1.00 0.00 N ATOM 556 CA LYS A 38 -7.745 -7.520 -11.867 1.00 0.00 C ATOM 557 C LYS A 38 -8.355 -7.456 -13.264 1.00 0.00 C ATOM 558 O LYS A 38 -8.940 -8.428 -13.742 1.00 0.00 O ATOM 559 CB LYS A 38 -6.220 -7.434 -11.961 1.00 0.00 C ATOM 560 CG LYS A 38 -5.525 -7.477 -10.611 1.00 0.00 C ATOM 561 CD LYS A 38 -6.149 -6.497 -9.631 1.00 0.00 C ATOM 562 CE LYS A 38 -7.096 -7.198 -8.669 1.00 0.00 C ATOM 563 NZ LYS A 38 -6.865 -6.779 -7.259 1.00 0.00 N ATOM 0 H LYS A 38 -7.366 -9.282 -10.797 1.00 0.00 H new ATOM 0 HA LYS A 38 -8.115 -6.674 -11.288 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.855 -8.258 -12.575 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.947 -6.511 -12.472 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -5.582 -8.486 -10.204 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -4.468 -7.243 -10.737 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -5.363 -5.994 -9.068 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -6.691 -5.727 -10.180 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -8.126 -6.978 -8.949 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -6.966 -8.277 -8.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -7.594 -7.200 -6.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -5.926 -7.102 -6.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -6.914 -5.742 -7.192 1.00 0.00 H new ATOM 577 N SER A 39 -8.212 -6.306 -13.915 1.00 0.00 N ATOM 578 CA SER A 39 -8.751 -6.114 -15.256 1.00 0.00 C ATOM 579 C SER A 39 -7.953 -5.060 -16.017 1.00 0.00 C ATOM 580 O SER A 39 -8.521 -4.216 -16.710 1.00 0.00 O ATOM 581 CB SER A 39 -10.223 -5.702 -15.184 1.00 0.00 C ATOM 582 OG SER A 39 -10.446 -4.793 -14.121 1.00 0.00 O ATOM 0 H SER A 39 -7.727 -5.493 -13.535 1.00 0.00 H new ATOM 0 HA SER A 39 -8.672 -7.061 -15.791 1.00 0.00 H new ATOM 0 HB2 SER A 39 -10.522 -5.244 -16.127 1.00 0.00 H new ATOM 0 HB3 SER A 39 -10.845 -6.586 -15.047 1.00 0.00 H new ATOM 0 HG SER A 39 -11.393 -4.544 -14.097 1.00 0.00 H new ATOM 588 N SER A 40 -6.632 -5.115 -15.882 1.00 0.00 N ATOM 589 CA SER A 40 -5.754 -4.163 -16.553 1.00 0.00 C ATOM 590 C SER A 40 -6.067 -2.735 -16.117 1.00 0.00 C ATOM 591 O SER A 40 -5.721 -1.775 -16.804 1.00 0.00 O ATOM 592 CB SER A 40 -5.897 -4.288 -18.071 1.00 0.00 C ATOM 593 OG SER A 40 -6.896 -3.412 -18.563 1.00 0.00 O ATOM 0 H SER A 40 -6.146 -5.809 -15.314 1.00 0.00 H new ATOM 0 HA SER A 40 -4.726 -4.393 -16.272 1.00 0.00 H new ATOM 0 HB2 SER A 40 -4.944 -4.062 -18.549 1.00 0.00 H new ATOM 0 HB3 SER A 40 -6.149 -5.316 -18.332 1.00 0.00 H new ATOM 0 HG SER A 40 -7.762 -3.651 -18.172 1.00 0.00 H new ATOM 599 N SER A 41 -6.725 -2.604 -14.969 1.00 0.00 N ATOM 600 CA SER A 41 -7.089 -1.294 -14.442 1.00 0.00 C ATOM 601 C SER A 41 -6.455 -1.065 -13.073 1.00 0.00 C ATOM 602 O SER A 41 -6.458 0.052 -12.556 1.00 0.00 O ATOM 603 CB SER A 41 -8.610 -1.167 -14.340 1.00 0.00 C ATOM 604 OG SER A 41 -9.015 0.189 -14.420 1.00 0.00 O ATOM 0 H SER A 41 -7.017 -3.389 -14.387 1.00 0.00 H new ATOM 0 HA SER A 41 -6.714 -0.535 -15.129 1.00 0.00 H new ATOM 0 HB2 SER A 41 -9.080 -1.738 -15.140 1.00 0.00 H new ATOM 0 HB3 SER A 41 -8.952 -1.597 -13.398 1.00 0.00 H new ATOM 0 HG SER A 41 -9.991 0.243 -14.354 1.00 0.00 H new ATOM 610 N GLN A 42 -5.913 -2.130 -12.493 1.00 0.00 N ATOM 611 CA GLN A 42 -5.276 -2.045 -11.184 1.00 0.00 C ATOM 612 C GLN A 42 -3.822 -2.500 -11.255 1.00 0.00 C ATOM 613 O GLN A 42 -3.018 -2.182 -10.378 1.00 0.00 O ATOM 614 CB GLN A 42 -6.039 -2.895 -10.166 1.00 0.00 C ATOM 615 CG GLN A 42 -7.509 -2.526 -10.045 1.00 0.00 C ATOM 616 CD GLN A 42 -8.430 -3.633 -10.518 1.00 0.00 C ATOM 617 OE1 GLN A 42 -9.437 -3.935 -9.877 1.00 0.00 O ATOM 618 NE2 GLN A 42 -8.089 -4.246 -11.646 1.00 0.00 N ATOM 0 H GLN A 42 -5.902 -3.062 -12.908 1.00 0.00 H new ATOM 0 HA GLN A 42 -5.296 -1.003 -10.865 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -5.959 -3.945 -10.449 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -5.565 -2.790 -9.190 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -7.736 -2.289 -9.005 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -7.702 -1.625 -10.627 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -7.246 -3.963 -12.145 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -8.671 -4.999 -12.013 1.00 0.00 H new ATOM 627 N LEU A 43 -3.491 -3.245 -12.304 1.00 0.00 N ATOM 628 CA LEU A 43 -2.133 -3.744 -12.490 1.00 0.00 C ATOM 629 C LEU A 43 -1.114 -2.620 -12.337 1.00 0.00 C ATOM 630 O LEU A 43 -0.045 -2.811 -11.758 1.00 0.00 O ATOM 631 CB LEU A 43 -1.991 -4.392 -13.868 1.00 0.00 C ATOM 632 CG LEU A 43 -2.939 -5.555 -14.164 1.00 0.00 C ATOM 633 CD1 LEU A 43 -2.258 -6.586 -15.051 1.00 0.00 C ATOM 634 CD2 LEU A 43 -3.418 -6.195 -12.869 1.00 0.00 C ATOM 0 H LEU A 43 -4.144 -3.517 -13.039 1.00 0.00 H new ATOM 0 HA LEU A 43 -1.939 -4.492 -11.722 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.143 -3.624 -14.626 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.966 -4.748 -13.976 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.807 -5.165 -14.696 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.948 -7.406 -15.251 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.966 -6.120 -15.992 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -1.372 -6.972 -14.546 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.092 -7.021 -13.099 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.561 -6.571 -12.310 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.945 -5.453 -12.270 1.00 0.00 H new ATOM 646 N LYS A 44 -1.454 -1.445 -12.857 1.00 0.00 N ATOM 647 CA LYS A 44 -0.571 -0.288 -12.776 1.00 0.00 C ATOM 648 C LYS A 44 -0.845 0.517 -11.510 1.00 0.00 C ATOM 649 O LYS A 44 -0.009 1.309 -11.074 1.00 0.00 O ATOM 650 CB LYS A 44 -0.749 0.603 -14.008 1.00 0.00 C ATOM 651 CG LYS A 44 -2.188 1.026 -14.250 1.00 0.00 C ATOM 652 CD LYS A 44 -2.593 2.172 -13.338 1.00 0.00 C ATOM 653 CE LYS A 44 -3.081 3.372 -14.135 1.00 0.00 C ATOM 654 NZ LYS A 44 -3.180 4.595 -13.291 1.00 0.00 N ATOM 0 H LYS A 44 -2.335 -1.269 -13.339 1.00 0.00 H new ATOM 0 HA LYS A 44 0.457 -0.648 -12.742 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -0.132 1.494 -13.894 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -0.383 0.072 -14.886 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -2.310 1.327 -15.290 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.851 0.177 -14.085 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.380 1.839 -12.661 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -1.744 2.465 -12.721 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -2.400 3.558 -14.965 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -4.057 3.149 -14.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -3.516 5.391 -13.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -3.849 4.427 -12.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -2.244 4.823 -12.899 1.00 0.00 H new ATOM 668 N GLU A 45 -2.019 0.309 -10.923 1.00 0.00 N ATOM 669 CA GLU A 45 -2.401 1.015 -9.706 1.00 0.00 C ATOM 670 C GLU A 45 -1.308 0.905 -8.647 1.00 0.00 C ATOM 671 O GLU A 45 -0.951 1.892 -8.004 1.00 0.00 O ATOM 672 CB GLU A 45 -3.717 0.458 -9.158 1.00 0.00 C ATOM 673 CG GLU A 45 -4.234 1.206 -7.940 1.00 0.00 C ATOM 674 CD GLU A 45 -4.284 2.706 -8.154 1.00 0.00 C ATOM 675 OE1 GLU A 45 -5.130 3.162 -8.953 1.00 0.00 O ATOM 676 OE2 GLU A 45 -3.479 3.423 -7.525 1.00 0.00 O ATOM 0 H GLU A 45 -2.722 -0.343 -11.271 1.00 0.00 H new ATOM 0 HA GLU A 45 -2.537 2.068 -9.955 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -4.472 0.494 -9.943 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.577 -0.591 -8.897 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -5.232 0.845 -7.693 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -3.595 0.986 -7.085 1.00 0.00 H new ATOM 683 N ILE A 46 -0.783 -0.303 -8.471 1.00 0.00 N ATOM 684 CA ILE A 46 0.269 -0.543 -7.491 1.00 0.00 C ATOM 685 C ILE A 46 1.639 -0.187 -8.057 1.00 0.00 C ATOM 686 O ILE A 46 2.603 -0.009 -7.312 1.00 0.00 O ATOM 687 CB ILE A 46 0.283 -2.012 -7.029 1.00 0.00 C ATOM 688 CG1 ILE A 46 -1.145 -2.508 -6.792 1.00 0.00 C ATOM 689 CG2 ILE A 46 1.117 -2.161 -5.766 1.00 0.00 C ATOM 690 CD1 ILE A 46 -1.682 -3.363 -7.919 1.00 0.00 C ATOM 0 H ILE A 46 -1.069 -1.131 -8.994 1.00 0.00 H new ATOM 0 HA ILE A 46 0.055 0.097 -6.635 1.00 0.00 H new ATOM 0 HB ILE A 46 0.734 -2.620 -7.813 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -1.173 -3.082 -5.866 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.801 -1.649 -6.654 1.00 0.00 H new ATOM 0 HG21 ILE A 46 1.118 -3.205 -5.451 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.140 -1.842 -5.966 1.00 0.00 H new ATOM 0 HG23 ILE A 46 0.692 -1.544 -4.974 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.698 -3.679 -7.683 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -1.687 -2.785 -8.843 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.048 -4.241 -8.043 1.00 0.00 H new ATOM 702 N PHE A 47 1.718 -0.082 -9.380 1.00 0.00 N ATOM 703 CA PHE A 47 2.970 0.255 -10.047 1.00 0.00 C ATOM 704 C PHE A 47 4.152 -0.423 -9.359 1.00 0.00 C ATOM 705 O PHE A 47 5.206 0.184 -9.170 1.00 0.00 O ATOM 706 CB PHE A 47 3.175 1.771 -10.060 1.00 0.00 C ATOM 707 CG PHE A 47 2.976 2.414 -8.717 1.00 0.00 C ATOM 708 CD1 PHE A 47 4.035 2.546 -7.834 1.00 0.00 C ATOM 709 CD2 PHE A 47 1.730 2.887 -8.338 1.00 0.00 C ATOM 710 CE1 PHE A 47 3.855 3.137 -6.597 1.00 0.00 C ATOM 711 CE2 PHE A 47 1.544 3.480 -7.103 1.00 0.00 C ATOM 712 CZ PHE A 47 2.608 3.605 -6.232 1.00 0.00 C ATOM 0 H PHE A 47 0.930 -0.226 -10.011 1.00 0.00 H new ATOM 0 HA PHE A 47 2.913 -0.105 -11.074 1.00 0.00 H new ATOM 0 HB2 PHE A 47 4.183 1.990 -10.413 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.483 2.217 -10.774 1.00 0.00 H new ATOM 0 HD1 PHE A 47 5.013 2.183 -8.115 1.00 0.00 H new ATOM 0 HD2 PHE A 47 0.894 2.791 -9.015 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.689 3.233 -5.917 1.00 0.00 H new ATOM 0 HE2 PHE A 47 0.568 3.845 -6.820 1.00 0.00 H new ATOM 0 HZ PHE A 47 2.465 4.068 -5.267 1.00 0.00 H new ATOM 722 N ARG A 48 3.967 -1.685 -8.986 1.00 0.00 N ATOM 723 CA ARG A 48 5.016 -2.446 -8.317 1.00 0.00 C ATOM 724 C ARG A 48 4.938 -3.923 -8.690 1.00 0.00 C ATOM 725 O ARG A 48 5.514 -4.775 -8.013 1.00 0.00 O ATOM 726 CB ARG A 48 4.904 -2.285 -6.800 1.00 0.00 C ATOM 727 CG ARG A 48 5.449 -0.963 -6.285 1.00 0.00 C ATOM 728 CD ARG A 48 5.928 -1.080 -4.847 1.00 0.00 C ATOM 729 NE ARG A 48 7.010 -0.144 -4.553 1.00 0.00 N ATOM 730 CZ ARG A 48 7.366 0.204 -3.321 1.00 0.00 C ATOM 731 NH1 ARG A 48 6.730 -0.305 -2.275 1.00 0.00 N ATOM 732 NH2 ARG A 48 8.361 1.062 -3.134 1.00 0.00 N ATOM 0 H ARG A 48 3.101 -2.202 -9.136 1.00 0.00 H new ATOM 0 HA ARG A 48 5.979 -2.056 -8.646 1.00 0.00 H new ATOM 0 HB2 ARG A 48 3.857 -2.374 -6.510 1.00 0.00 H new ATOM 0 HB3 ARG A 48 5.439 -3.102 -6.316 1.00 0.00 H new ATOM 0 HG2 ARG A 48 6.274 -0.637 -6.919 1.00 0.00 H new ATOM 0 HG3 ARG A 48 4.675 -0.199 -6.351 1.00 0.00 H new ATOM 0 HD2 ARG A 48 5.094 -0.894 -4.171 1.00 0.00 H new ATOM 0 HD3 ARG A 48 6.269 -2.098 -4.660 1.00 0.00 H new ATOM 0 HE ARG A 48 7.520 0.265 -5.336 1.00 0.00 H new ATOM 0 HH11 ARG A 48 5.965 -0.965 -2.415 1.00 0.00 H new ATOM 0 HH12 ARG A 48 7.005 -0.036 -1.330 1.00 0.00 H new ATOM 0 HH21 ARG A 48 8.853 1.455 -3.936 1.00 0.00 H new ATOM 0 HH22 ARG A 48 8.634 1.329 -2.188 1.00 0.00 H new ATOM 746 N ILE A 49 4.223 -4.219 -9.770 1.00 0.00 N ATOM 747 CA ILE A 49 4.071 -5.592 -10.233 1.00 0.00 C ATOM 748 C ILE A 49 4.639 -5.766 -11.637 1.00 0.00 C ATOM 749 O ILE A 49 5.021 -6.868 -12.033 1.00 0.00 O ATOM 750 CB ILE A 49 2.593 -6.026 -10.232 1.00 0.00 C ATOM 751 CG1 ILE A 49 1.806 -5.235 -11.278 1.00 0.00 C ATOM 752 CG2 ILE A 49 1.986 -5.836 -8.849 1.00 0.00 C ATOM 753 CD1 ILE A 49 0.355 -5.649 -11.383 1.00 0.00 C ATOM 0 H ILE A 49 3.740 -3.526 -10.341 1.00 0.00 H new ATOM 0 HA ILE A 49 4.627 -6.222 -9.539 1.00 0.00 H new ATOM 0 HB ILE A 49 2.540 -7.084 -10.489 1.00 0.00 H new ATOM 0 HG12 ILE A 49 1.856 -4.174 -11.033 1.00 0.00 H new ATOM 0 HG13 ILE A 49 2.282 -5.360 -12.250 1.00 0.00 H new ATOM 0 HG21 ILE A 49 0.941 -6.147 -8.864 1.00 0.00 H new ATOM 0 HG22 ILE A 49 2.534 -6.440 -8.125 1.00 0.00 H new ATOM 0 HG23 ILE A 49 2.048 -4.785 -8.566 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -0.141 -5.046 -12.144 1.00 0.00 H new ATOM 0 HD12 ILE A 49 0.296 -6.702 -11.659 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -0.137 -5.498 -10.422 1.00 0.00 H new ATOM 765 N LEU A 50 4.693 -4.670 -12.387 1.00 0.00 N ATOM 766 CA LEU A 50 5.217 -4.700 -13.748 1.00 0.00 C ATOM 767 C LEU A 50 6.711 -4.392 -13.763 1.00 0.00 C ATOM 768 O LEU A 50 7.529 -5.253 -14.088 1.00 0.00 O ATOM 769 CB LEU A 50 4.468 -3.694 -14.625 1.00 0.00 C ATOM 770 CG LEU A 50 2.950 -3.654 -14.454 1.00 0.00 C ATOM 771 CD1 LEU A 50 2.397 -2.309 -14.900 1.00 0.00 C ATOM 772 CD2 LEU A 50 2.295 -4.787 -15.231 1.00 0.00 C ATOM 0 H LEU A 50 4.380 -3.750 -12.076 1.00 0.00 H new ATOM 0 HA LEU A 50 5.068 -5.703 -14.147 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.863 -2.699 -14.420 1.00 0.00 H new ATOM 0 HB3 LEU A 50 4.690 -3.916 -15.669 1.00 0.00 H new ATOM 0 HG LEU A 50 2.720 -3.785 -13.397 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.315 -2.300 -14.771 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.841 -1.516 -14.299 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.638 -2.147 -15.950 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.214 -4.743 -15.097 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.534 -4.688 -16.290 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.667 -5.743 -14.863 1.00 0.00 H new ATOM 784 N ASP A 51 7.059 -3.160 -13.409 1.00 0.00 N ATOM 785 CA ASP A 51 8.455 -2.740 -13.379 1.00 0.00 C ATOM 786 C ASP A 51 8.759 -1.954 -12.107 1.00 0.00 C ATOM 787 O ASP A 51 7.937 -1.892 -11.193 1.00 0.00 O ATOM 788 CB ASP A 51 8.781 -1.890 -14.608 1.00 0.00 C ATOM 789 CG ASP A 51 10.176 -2.153 -15.141 1.00 0.00 C ATOM 790 OD1 ASP A 51 10.952 -2.848 -14.453 1.00 0.00 O ATOM 791 OD2 ASP A 51 10.491 -1.664 -16.246 1.00 0.00 O ATOM 0 H ASP A 51 6.394 -2.435 -13.139 1.00 0.00 H new ATOM 0 HA ASP A 51 9.078 -3.635 -13.390 1.00 0.00 H new ATOM 0 HB2 ASP A 51 8.051 -2.095 -15.392 1.00 0.00 H new ATOM 0 HB3 ASP A 51 8.686 -0.835 -14.352 1.00 0.00 H new ATOM 796 N ASN A 52 9.945 -1.356 -12.055 1.00 0.00 N ATOM 797 CA ASN A 52 10.357 -0.575 -10.894 1.00 0.00 C ATOM 798 C ASN A 52 10.948 0.765 -11.322 1.00 0.00 C ATOM 799 O ASN A 52 11.507 1.497 -10.506 1.00 0.00 O ATOM 800 CB ASN A 52 11.381 -1.355 -10.067 1.00 0.00 C ATOM 801 CG ASN A 52 11.679 -0.689 -8.738 1.00 0.00 C ATOM 802 OD1 ASN A 52 10.789 -0.514 -7.905 1.00 0.00 O ATOM 803 ND2 ASN A 52 12.936 -0.312 -8.534 1.00 0.00 N ATOM 0 H ASN A 52 10.637 -1.397 -12.803 1.00 0.00 H new ATOM 0 HA ASN A 52 9.475 -0.385 -10.283 1.00 0.00 H new ATOM 0 HB2 ASN A 52 11.008 -2.364 -9.889 1.00 0.00 H new ATOM 0 HB3 ASN A 52 12.305 -1.453 -10.637 1.00 0.00 H new ATOM 0 HD21 ASN A 52 13.196 0.143 -7.659 1.00 0.00 H new ATOM 0 HD22 ASN A 52 13.641 -0.477 -9.252 1.00 0.00 H new ATOM 810 N ASP A 53 10.819 1.079 -12.606 1.00 0.00 N ATOM 811 CA ASP A 53 11.338 2.332 -13.143 1.00 0.00 C ATOM 812 C ASP A 53 10.220 3.161 -13.766 1.00 0.00 C ATOM 813 O ASP A 53 10.253 4.390 -13.732 1.00 0.00 O ATOM 814 CB ASP A 53 12.425 2.054 -14.183 1.00 0.00 C ATOM 815 CG ASP A 53 12.040 0.943 -15.140 1.00 0.00 C ATOM 816 OD1 ASP A 53 11.150 1.171 -15.987 1.00 0.00 O ATOM 817 OD2 ASP A 53 12.629 -0.153 -15.044 1.00 0.00 O ATOM 0 H ASP A 53 10.359 0.483 -13.295 1.00 0.00 H new ATOM 0 HA ASP A 53 11.771 2.900 -12.320 1.00 0.00 H new ATOM 0 HB2 ASP A 53 12.624 2.964 -14.749 1.00 0.00 H new ATOM 0 HB3 ASP A 53 13.351 1.786 -13.674 1.00 0.00 H new ATOM 822 N GLN A 54 9.231 2.479 -14.336 1.00 0.00 N ATOM 823 CA GLN A 54 8.104 3.153 -14.969 1.00 0.00 C ATOM 824 C GLN A 54 8.586 4.180 -15.988 1.00 0.00 C ATOM 825 O GLN A 54 7.968 5.229 -16.166 1.00 0.00 O ATOM 826 CB GLN A 54 7.233 3.835 -13.913 1.00 0.00 C ATOM 827 CG GLN A 54 5.745 3.585 -14.097 1.00 0.00 C ATOM 828 CD GLN A 54 5.394 2.110 -14.075 1.00 0.00 C ATOM 829 OE1 GLN A 54 5.441 1.433 -15.103 1.00 0.00 O ATOM 830 NE2 GLN A 54 5.039 1.603 -12.901 1.00 0.00 N ATOM 0 H GLN A 54 9.188 1.461 -14.372 1.00 0.00 H new ATOM 0 HA GLN A 54 7.510 2.402 -15.491 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.532 3.484 -12.925 1.00 0.00 H new ATOM 0 HB3 GLN A 54 7.418 4.909 -13.939 1.00 0.00 H new ATOM 0 HG2 GLN A 54 5.194 4.097 -13.308 1.00 0.00 H new ATOM 0 HG3 GLN A 54 5.422 4.017 -15.044 1.00 0.00 H new ATOM 0 HE21 GLN A 54 5.014 2.200 -12.074 1.00 0.00 H new ATOM 0 HE22 GLN A 54 4.792 0.616 -12.825 1.00 0.00 H new ATOM 839 N SER A 55 9.694 3.870 -16.654 1.00 0.00 N ATOM 840 CA SER A 55 10.262 4.769 -17.653 1.00 0.00 C ATOM 841 C SER A 55 9.588 4.570 -19.007 1.00 0.00 C ATOM 842 O SER A 55 9.617 5.454 -19.863 1.00 0.00 O ATOM 843 CB SER A 55 11.768 4.537 -17.780 1.00 0.00 C ATOM 844 OG SER A 55 12.479 5.241 -16.777 1.00 0.00 O ATOM 0 H SER A 55 10.216 3.004 -16.520 1.00 0.00 H new ATOM 0 HA SER A 55 10.086 5.794 -17.327 1.00 0.00 H new ATOM 0 HB2 SER A 55 11.983 3.471 -17.702 1.00 0.00 H new ATOM 0 HB3 SER A 55 12.107 4.859 -18.765 1.00 0.00 H new ATOM 0 HG SER A 55 13.439 5.075 -16.879 1.00 0.00 H new ATOM 850 N GLY A 56 8.983 3.401 -19.195 1.00 0.00 N ATOM 851 CA GLY A 56 8.311 3.106 -20.447 1.00 0.00 C ATOM 852 C GLY A 56 8.106 1.619 -20.658 1.00 0.00 C ATOM 853 O GLY A 56 6.972 1.148 -20.752 1.00 0.00 O ATOM 0 H GLY A 56 8.946 2.653 -18.502 1.00 0.00 H new ATOM 0 HA2 GLY A 56 7.344 3.609 -20.464 1.00 0.00 H new ATOM 0 HA3 GLY A 56 8.895 3.510 -21.274 1.00 0.00 H new ATOM 857 N PHE A 57 9.206 0.876 -20.735 1.00 0.00 N ATOM 858 CA PHE A 57 9.142 -0.566 -20.939 1.00 0.00 C ATOM 859 C PHE A 57 9.861 -1.307 -19.816 1.00 0.00 C ATOM 860 O PHE A 57 10.223 -0.715 -18.799 1.00 0.00 O ATOM 861 CB PHE A 57 9.758 -0.939 -22.289 1.00 0.00 C ATOM 862 CG PHE A 57 11.256 -0.830 -22.314 1.00 0.00 C ATOM 863 CD1 PHE A 57 11.875 0.408 -22.255 1.00 0.00 C ATOM 864 CD2 PHE A 57 12.045 -1.966 -22.398 1.00 0.00 C ATOM 865 CE1 PHE A 57 13.253 0.512 -22.278 1.00 0.00 C ATOM 866 CE2 PHE A 57 13.424 -1.868 -22.421 1.00 0.00 C ATOM 867 CZ PHE A 57 14.028 -0.627 -22.362 1.00 0.00 C ATOM 0 H PHE A 57 10.152 1.249 -20.659 1.00 0.00 H new ATOM 0 HA PHE A 57 8.093 -0.863 -20.932 1.00 0.00 H new ATOM 0 HB2 PHE A 57 9.472 -1.960 -22.541 1.00 0.00 H new ATOM 0 HB3 PHE A 57 9.341 -0.292 -23.061 1.00 0.00 H new ATOM 0 HD1 PHE A 57 11.273 1.303 -22.190 1.00 0.00 H new ATOM 0 HD2 PHE A 57 11.578 -2.939 -22.446 1.00 0.00 H new ATOM 0 HE1 PHE A 57 13.723 1.483 -22.230 1.00 0.00 H new ATOM 0 HE2 PHE A 57 14.028 -2.761 -22.485 1.00 0.00 H new ATOM 0 HZ PHE A 57 15.105 -0.548 -22.382 1.00 0.00 H new ATOM 877 N ILE A 58 10.066 -2.606 -20.008 1.00 0.00 N ATOM 878 CA ILE A 58 10.742 -3.428 -19.013 1.00 0.00 C ATOM 879 C ILE A 58 11.885 -4.221 -19.639 1.00 0.00 C ATOM 880 O ILE A 58 11.851 -4.543 -20.826 1.00 0.00 O ATOM 881 CB ILE A 58 9.766 -4.406 -18.332 1.00 0.00 C ATOM 882 CG1 ILE A 58 8.503 -3.669 -17.882 1.00 0.00 C ATOM 883 CG2 ILE A 58 10.438 -5.088 -17.150 1.00 0.00 C ATOM 884 CD1 ILE A 58 7.458 -4.578 -17.273 1.00 0.00 C ATOM 0 H ILE A 58 9.773 -3.112 -20.844 1.00 0.00 H new ATOM 0 HA ILE A 58 11.144 -2.747 -18.262 1.00 0.00 H new ATOM 0 HB ILE A 58 9.480 -5.172 -19.053 1.00 0.00 H new ATOM 0 HG12 ILE A 58 8.777 -2.905 -17.154 1.00 0.00 H new ATOM 0 HG13 ILE A 58 8.069 -3.152 -18.738 1.00 0.00 H new ATOM 0 HG21 ILE A 58 9.736 -5.776 -16.679 1.00 0.00 H new ATOM 0 HG22 ILE A 58 11.310 -5.641 -17.497 1.00 0.00 H new ATOM 0 HG23 ILE A 58 10.750 -4.336 -16.425 1.00 0.00 H new ATOM 0 HD11 ILE A 58 6.591 -3.988 -16.977 1.00 0.00 H new ATOM 0 HD12 ILE A 58 7.155 -5.326 -18.006 1.00 0.00 H new ATOM 0 HD13 ILE A 58 7.874 -5.076 -16.397 1.00 0.00 H new ATOM 896 N GLU A 59 12.893 -4.533 -18.831 1.00 0.00 N ATOM 897 CA GLU A 59 14.046 -5.290 -19.307 1.00 0.00 C ATOM 898 C GLU A 59 14.392 -6.419 -18.341 1.00 0.00 C ATOM 899 O GLU A 59 13.928 -6.437 -17.201 1.00 0.00 O ATOM 900 CB GLU A 59 15.253 -4.366 -19.482 1.00 0.00 C ATOM 901 CG GLU A 59 16.356 -4.963 -20.340 1.00 0.00 C ATOM 902 CD GLU A 59 15.840 -5.513 -21.655 1.00 0.00 C ATOM 903 OE1 GLU A 59 15.041 -4.818 -22.317 1.00 0.00 O ATOM 904 OE2 GLU A 59 16.237 -6.639 -22.023 1.00 0.00 O ATOM 0 H GLU A 59 12.935 -4.274 -17.845 1.00 0.00 H new ATOM 0 HA GLU A 59 13.789 -5.727 -20.272 1.00 0.00 H new ATOM 0 HB2 GLU A 59 14.921 -3.430 -19.931 1.00 0.00 H new ATOM 0 HB3 GLU A 59 15.659 -4.123 -18.500 1.00 0.00 H new ATOM 0 HG2 GLU A 59 17.108 -4.200 -20.540 1.00 0.00 H new ATOM 0 HG3 GLU A 59 16.850 -5.761 -19.786 1.00 0.00 H new ATOM 911 N GLU A 60 15.209 -7.359 -18.806 1.00 0.00 N ATOM 912 CA GLU A 60 15.615 -8.492 -17.984 1.00 0.00 C ATOM 913 C GLU A 60 16.323 -8.019 -16.717 1.00 0.00 C ATOM 914 O GLU A 60 16.392 -8.744 -15.724 1.00 0.00 O ATOM 915 CB GLU A 60 16.535 -9.423 -18.777 1.00 0.00 C ATOM 916 CG GLU A 60 17.763 -8.729 -19.341 1.00 0.00 C ATOM 917 CD GLU A 60 18.880 -8.602 -18.323 1.00 0.00 C ATOM 918 OE1 GLU A 60 18.863 -9.356 -17.327 1.00 0.00 O ATOM 919 OE2 GLU A 60 19.771 -7.749 -18.521 1.00 0.00 O ATOM 0 H GLU A 60 15.602 -7.358 -19.747 1.00 0.00 H new ATOM 0 HA GLU A 60 14.717 -9.039 -17.696 1.00 0.00 H new ATOM 0 HB2 GLU A 60 16.855 -10.241 -18.131 1.00 0.00 H new ATOM 0 HB3 GLU A 60 15.970 -9.867 -19.597 1.00 0.00 H new ATOM 0 HG2 GLU A 60 18.126 -9.286 -20.205 1.00 0.00 H new ATOM 0 HG3 GLU A 60 17.484 -7.736 -19.695 1.00 0.00 H new ATOM 926 N ASP A 61 16.847 -6.799 -16.760 1.00 0.00 N ATOM 927 CA ASP A 61 17.549 -6.228 -15.616 1.00 0.00 C ATOM 928 C ASP A 61 16.569 -5.853 -14.509 1.00 0.00 C ATOM 929 O ASP A 61 16.975 -5.498 -13.403 1.00 0.00 O ATOM 930 CB ASP A 61 18.349 -4.996 -16.045 1.00 0.00 C ATOM 931 CG ASP A 61 19.487 -4.686 -15.094 1.00 0.00 C ATOM 932 OD1 ASP A 61 20.305 -5.592 -14.830 1.00 0.00 O ATOM 933 OD2 ASP A 61 19.561 -3.536 -14.613 1.00 0.00 O ATOM 0 H ASP A 61 16.799 -6.186 -17.574 1.00 0.00 H new ATOM 0 HA ASP A 61 18.235 -6.981 -15.229 1.00 0.00 H new ATOM 0 HB2 ASP A 61 18.749 -5.157 -17.046 1.00 0.00 H new ATOM 0 HB3 ASP A 61 17.683 -4.135 -16.103 1.00 0.00 H new ATOM 938 N GLU A 62 15.278 -5.934 -14.816 1.00 0.00 N ATOM 939 CA GLU A 62 14.241 -5.601 -13.846 1.00 0.00 C ATOM 940 C GLU A 62 13.399 -6.828 -13.507 1.00 0.00 C ATOM 941 O GLU A 62 12.284 -6.708 -12.998 1.00 0.00 O ATOM 942 CB GLU A 62 13.344 -4.487 -14.388 1.00 0.00 C ATOM 943 CG GLU A 62 13.818 -3.091 -14.022 1.00 0.00 C ATOM 944 CD GLU A 62 13.525 -2.735 -12.577 1.00 0.00 C ATOM 945 OE1 GLU A 62 12.747 -3.468 -11.931 1.00 0.00 O ATOM 946 OE2 GLU A 62 14.075 -1.724 -12.092 1.00 0.00 O ATOM 0 H GLU A 62 14.926 -6.227 -15.727 1.00 0.00 H new ATOM 0 HA GLU A 62 14.729 -5.254 -12.935 1.00 0.00 H new ATOM 0 HB2 GLU A 62 13.291 -4.571 -15.474 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.332 -4.629 -14.008 1.00 0.00 H new ATOM 0 HG2 GLU A 62 14.891 -3.017 -14.200 1.00 0.00 H new ATOM 0 HG3 GLU A 62 13.336 -2.365 -14.676 1.00 0.00 H new ATOM 953 N LEU A 63 13.940 -8.007 -13.794 1.00 0.00 N ATOM 954 CA LEU A 63 13.240 -9.257 -13.521 1.00 0.00 C ATOM 955 C LEU A 63 13.998 -10.093 -12.496 1.00 0.00 C ATOM 956 O LEU A 63 13.430 -10.540 -11.499 1.00 0.00 O ATOM 957 CB LEU A 63 13.057 -10.055 -14.813 1.00 0.00 C ATOM 958 CG LEU A 63 12.600 -9.258 -16.035 1.00 0.00 C ATOM 959 CD1 LEU A 63 12.447 -10.172 -17.242 1.00 0.00 C ATOM 960 CD2 LEU A 63 11.293 -8.536 -15.743 1.00 0.00 C ATOM 0 H LEU A 63 14.861 -8.123 -14.216 1.00 0.00 H new ATOM 0 HA LEU A 63 12.260 -9.014 -13.110 1.00 0.00 H new ATOM 0 HB2 LEU A 63 14.003 -10.540 -15.054 1.00 0.00 H new ATOM 0 HB3 LEU A 63 12.331 -10.846 -14.628 1.00 0.00 H new ATOM 0 HG LEU A 63 13.361 -8.512 -16.263 1.00 0.00 H new ATOM 0 HD11 LEU A 63 12.121 -9.587 -18.102 1.00 0.00 H new ATOM 0 HD12 LEU A 63 13.404 -10.643 -17.465 1.00 0.00 H new ATOM 0 HD13 LEU A 63 11.706 -10.941 -17.024 1.00 0.00 H new ATOM 0 HD21 LEU A 63 10.983 -7.974 -16.624 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.524 -9.265 -15.488 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.435 -7.851 -14.907 1.00 0.00 H new ATOM 972 N LYS A 64 15.287 -10.301 -12.746 1.00 0.00 N ATOM 973 CA LYS A 64 16.126 -11.080 -11.844 1.00 0.00 C ATOM 974 C LYS A 64 15.936 -10.630 -10.399 1.00 0.00 C ATOM 975 O LYS A 64 15.905 -11.451 -9.482 1.00 0.00 O ATOM 976 CB LYS A 64 17.598 -10.948 -12.242 1.00 0.00 C ATOM 977 CG LYS A 64 18.016 -9.523 -12.559 1.00 0.00 C ATOM 978 CD LYS A 64 19.529 -9.383 -12.607 1.00 0.00 C ATOM 979 CE LYS A 64 20.124 -10.168 -13.766 1.00 0.00 C ATOM 980 NZ LYS A 64 21.566 -9.852 -13.967 1.00 0.00 N ATOM 0 H LYS A 64 15.773 -9.940 -13.567 1.00 0.00 H new ATOM 0 HA LYS A 64 15.827 -12.125 -11.922 1.00 0.00 H new ATOM 0 HB2 LYS A 64 18.220 -11.329 -11.432 1.00 0.00 H new ATOM 0 HB3 LYS A 64 17.788 -11.576 -13.112 1.00 0.00 H new ATOM 0 HG2 LYS A 64 17.591 -9.223 -13.517 1.00 0.00 H new ATOM 0 HG3 LYS A 64 17.611 -8.848 -11.805 1.00 0.00 H new ATOM 0 HD2 LYS A 64 19.795 -8.331 -12.704 1.00 0.00 H new ATOM 0 HD3 LYS A 64 19.958 -9.735 -11.669 1.00 0.00 H new ATOM 0 HE2 LYS A 64 20.009 -11.236 -13.579 1.00 0.00 H new ATOM 0 HE3 LYS A 64 19.572 -9.943 -14.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 21.935 -10.407 -14.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 21.674 -8.838 -14.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 22.097 -10.090 -13.105 1.00 0.00 H new ATOM 994 N TYR A 65 15.809 -9.323 -10.204 1.00 0.00 N ATOM 995 CA TYR A 65 15.623 -8.764 -8.870 1.00 0.00 C ATOM 996 C TYR A 65 14.190 -8.277 -8.678 1.00 0.00 C ATOM 997 O TYR A 65 13.958 -7.165 -8.203 1.00 0.00 O ATOM 998 CB TYR A 65 16.601 -7.611 -8.636 1.00 0.00 C ATOM 999 CG TYR A 65 17.989 -8.064 -8.244 1.00 0.00 C ATOM 1000 CD1 TYR A 65 18.703 -8.951 -9.040 1.00 0.00 C ATOM 1001 CD2 TYR A 65 18.588 -7.603 -7.078 1.00 0.00 C ATOM 1002 CE1 TYR A 65 19.971 -9.368 -8.685 1.00 0.00 C ATOM 1003 CE2 TYR A 65 19.856 -8.014 -6.715 1.00 0.00 C ATOM 1004 CZ TYR A 65 20.543 -8.897 -7.522 1.00 0.00 C ATOM 1005 OH TYR A 65 21.807 -9.309 -7.165 1.00 0.00 O ATOM 0 H TYR A 65 15.831 -8.630 -10.952 1.00 0.00 H new ATOM 0 HA TYR A 65 15.820 -9.552 -8.143 1.00 0.00 H new ATOM 0 HB2 TYR A 65 16.667 -7.011 -9.544 1.00 0.00 H new ATOM 0 HB3 TYR A 65 16.205 -6.963 -7.854 1.00 0.00 H new ATOM 0 HD1 TYR A 65 18.259 -9.321 -9.952 1.00 0.00 H new ATOM 0 HD2 TYR A 65 18.053 -6.911 -6.444 1.00 0.00 H new ATOM 0 HE1 TYR A 65 20.512 -10.059 -9.315 1.00 0.00 H new ATOM 0 HE2 TYR A 65 20.307 -7.646 -5.805 1.00 0.00 H new ATOM 0 HH TYR A 65 22.063 -8.884 -6.320 1.00 0.00 H new ATOM 1015 N PHE A 66 13.232 -9.119 -9.049 1.00 0.00 N ATOM 1016 CA PHE A 66 11.820 -8.776 -8.919 1.00 0.00 C ATOM 1017 C PHE A 66 11.256 -9.289 -7.597 1.00 0.00 C ATOM 1018 O PHE A 66 10.705 -8.523 -6.805 1.00 0.00 O ATOM 1019 CB PHE A 66 11.022 -9.359 -10.087 1.00 0.00 C ATOM 1020 CG PHE A 66 9.579 -8.941 -10.095 1.00 0.00 C ATOM 1021 CD1 PHE A 66 8.653 -9.589 -9.294 1.00 0.00 C ATOM 1022 CD2 PHE A 66 9.150 -7.901 -10.903 1.00 0.00 C ATOM 1023 CE1 PHE A 66 7.324 -9.207 -9.300 1.00 0.00 C ATOM 1024 CE2 PHE A 66 7.823 -7.514 -10.912 1.00 0.00 C ATOM 1025 CZ PHE A 66 6.909 -8.168 -10.109 1.00 0.00 C ATOM 0 H PHE A 66 13.407 -10.044 -9.442 1.00 0.00 H new ATOM 0 HA PHE A 66 11.732 -7.690 -8.935 1.00 0.00 H new ATOM 0 HB2 PHE A 66 11.486 -9.051 -11.024 1.00 0.00 H new ATOM 0 HB3 PHE A 66 11.077 -10.447 -10.047 1.00 0.00 H new ATOM 0 HD1 PHE A 66 8.972 -10.401 -8.658 1.00 0.00 H new ATOM 0 HD2 PHE A 66 9.860 -7.387 -11.533 1.00 0.00 H new ATOM 0 HE1 PHE A 66 6.611 -9.721 -8.672 1.00 0.00 H new ATOM 0 HE2 PHE A 66 7.501 -6.701 -11.546 1.00 0.00 H new ATOM 0 HZ PHE A 66 5.872 -7.867 -10.114 1.00 0.00 H new ATOM 1035 N LEU A 67 11.397 -10.589 -7.365 1.00 0.00 N ATOM 1036 CA LEU A 67 10.901 -11.206 -6.140 1.00 0.00 C ATOM 1037 C LEU A 67 11.495 -10.527 -4.910 1.00 0.00 C ATOM 1038 O LEU A 67 10.940 -10.612 -3.815 1.00 0.00 O ATOM 1039 CB LEU A 67 11.236 -12.699 -6.125 1.00 0.00 C ATOM 1040 CG LEU A 67 10.934 -13.467 -7.412 1.00 0.00 C ATOM 1041 CD1 LEU A 67 11.340 -14.926 -7.270 1.00 0.00 C ATOM 1042 CD2 LEU A 67 9.459 -13.355 -7.767 1.00 0.00 C ATOM 0 H LEU A 67 11.851 -11.237 -8.009 1.00 0.00 H new ATOM 0 HA LEU A 67 9.818 -11.083 -6.113 1.00 0.00 H new ATOM 0 HB2 LEU A 67 12.296 -12.811 -5.899 1.00 0.00 H new ATOM 0 HB3 LEU A 67 10.685 -13.166 -5.309 1.00 0.00 H new ATOM 0 HG LEU A 67 11.516 -13.025 -8.221 1.00 0.00 H new ATOM 0 HD11 LEU A 67 11.118 -15.457 -8.195 1.00 0.00 H new ATOM 0 HD12 LEU A 67 12.409 -14.988 -7.064 1.00 0.00 H new ATOM 0 HD13 LEU A 67 10.785 -15.380 -6.449 1.00 0.00 H new ATOM 0 HD21 LEU A 67 9.263 -13.908 -8.686 1.00 0.00 H new ATOM 0 HD22 LEU A 67 8.858 -13.770 -6.958 1.00 0.00 H new ATOM 0 HD23 LEU A 67 9.198 -12.307 -7.912 1.00 0.00 H new ATOM 1054 N GLN A 68 12.624 -9.853 -5.100 1.00 0.00 N ATOM 1055 CA GLN A 68 13.292 -9.158 -4.006 1.00 0.00 C ATOM 1056 C GLN A 68 12.332 -8.209 -3.297 1.00 0.00 C ATOM 1057 O GLN A 68 12.538 -7.854 -2.136 1.00 0.00 O ATOM 1058 CB GLN A 68 14.502 -8.383 -4.529 1.00 0.00 C ATOM 1059 CG GLN A 68 15.647 -8.297 -3.532 1.00 0.00 C ATOM 1060 CD GLN A 68 17.004 -8.459 -4.188 1.00 0.00 C ATOM 1061 OE1 GLN A 68 17.918 -7.669 -3.953 1.00 0.00 O ATOM 1062 NE2 GLN A 68 17.143 -9.489 -5.015 1.00 0.00 N ATOM 0 H GLN A 68 13.096 -9.773 -6.001 1.00 0.00 H new ATOM 0 HA GLN A 68 13.631 -9.905 -3.288 1.00 0.00 H new ATOM 0 HB2 GLN A 68 14.861 -8.859 -5.442 1.00 0.00 H new ATOM 0 HB3 GLN A 68 14.188 -7.374 -4.797 1.00 0.00 H new ATOM 0 HG2 GLN A 68 15.607 -7.335 -3.021 1.00 0.00 H new ATOM 0 HG3 GLN A 68 15.521 -9.068 -2.772 1.00 0.00 H new ATOM 0 HE21 GLN A 68 16.358 -10.119 -5.181 1.00 0.00 H new ATOM 0 HE22 GLN A 68 18.034 -9.650 -5.484 1.00 0.00 H new ATOM 1071 N ARG A 69 11.282 -7.801 -4.003 1.00 0.00 N ATOM 1072 CA ARG A 69 10.291 -6.890 -3.442 1.00 0.00 C ATOM 1073 C ARG A 69 9.239 -7.657 -2.645 1.00 0.00 C ATOM 1074 O ARG A 69 9.110 -7.477 -1.434 1.00 0.00 O ATOM 1075 CB ARG A 69 9.618 -6.087 -4.556 1.00 0.00 C ATOM 1076 CG ARG A 69 10.496 -4.986 -5.129 1.00 0.00 C ATOM 1077 CD ARG A 69 10.483 -3.747 -4.248 1.00 0.00 C ATOM 1078 NE ARG A 69 11.407 -3.865 -3.124 1.00 0.00 N ATOM 1079 CZ ARG A 69 12.719 -3.684 -3.228 1.00 0.00 C ATOM 1080 NH1 ARG A 69 13.257 -3.376 -4.400 1.00 0.00 N ATOM 1081 NH2 ARG A 69 13.494 -3.808 -2.159 1.00 0.00 N ATOM 0 H ARG A 69 11.096 -8.087 -4.964 1.00 0.00 H new ATOM 0 HA ARG A 69 10.804 -6.204 -2.768 1.00 0.00 H new ATOM 0 HB2 ARG A 69 9.331 -6.766 -5.359 1.00 0.00 H new ATOM 0 HB3 ARG A 69 8.700 -5.644 -4.169 1.00 0.00 H new ATOM 0 HG2 ARG A 69 11.518 -5.350 -5.231 1.00 0.00 H new ATOM 0 HG3 ARG A 69 10.149 -4.726 -6.129 1.00 0.00 H new ATOM 0 HD2 ARG A 69 10.748 -2.875 -4.845 1.00 0.00 H new ATOM 0 HD3 ARG A 69 9.474 -3.580 -3.872 1.00 0.00 H new ATOM 0 HE ARG A 69 11.024 -4.099 -2.208 1.00 0.00 H new ATOM 0 HH11 ARG A 69 12.663 -3.278 -5.224 1.00 0.00 H new ATOM 0 HH12 ARG A 69 14.265 -3.237 -4.478 1.00 0.00 H new ATOM 0 HH21 ARG A 69 13.083 -4.043 -1.255 1.00 0.00 H new ATOM 0 HH22 ARG A 69 14.501 -3.669 -2.240 1.00 0.00 H new ATOM 1095 N PHE A 70 8.489 -8.511 -3.334 1.00 0.00 N ATOM 1096 CA PHE A 70 7.447 -9.303 -2.691 1.00 0.00 C ATOM 1097 C PHE A 70 8.023 -10.132 -1.546 1.00 0.00 C ATOM 1098 O PHE A 70 7.537 -10.070 -0.418 1.00 0.00 O ATOM 1099 CB PHE A 70 6.773 -10.222 -3.712 1.00 0.00 C ATOM 1100 CG PHE A 70 5.776 -9.517 -4.587 1.00 0.00 C ATOM 1101 CD1 PHE A 70 4.559 -9.098 -4.073 1.00 0.00 C ATOM 1102 CD2 PHE A 70 6.055 -9.274 -5.922 1.00 0.00 C ATOM 1103 CE1 PHE A 70 3.639 -8.449 -4.875 1.00 0.00 C ATOM 1104 CE2 PHE A 70 5.139 -8.625 -6.728 1.00 0.00 C ATOM 1105 CZ PHE A 70 3.930 -8.213 -6.205 1.00 0.00 C ATOM 0 H PHE A 70 8.583 -8.672 -4.337 1.00 0.00 H new ATOM 0 HA PHE A 70 6.704 -8.618 -2.283 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.539 -10.677 -4.341 1.00 0.00 H new ATOM 0 HB3 PHE A 70 6.271 -11.033 -3.184 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.327 -9.281 -3.034 1.00 0.00 H new ATOM 0 HD2 PHE A 70 6.999 -9.595 -6.337 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.694 -8.127 -4.463 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.369 -8.440 -7.767 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.213 -7.707 -6.834 1.00 0.00 H new ATOM 1115 N GLU A 71 9.060 -10.906 -1.847 1.00 0.00 N ATOM 1116 CA GLU A 71 9.701 -11.748 -0.844 1.00 0.00 C ATOM 1117 C GLU A 71 10.780 -10.974 -0.092 1.00 0.00 C ATOM 1118 O GLU A 71 11.211 -9.907 -0.529 1.00 0.00 O ATOM 1119 CB GLU A 71 10.311 -12.989 -1.500 1.00 0.00 C ATOM 1120 CG GLU A 71 10.505 -14.151 -0.541 1.00 0.00 C ATOM 1121 CD GLU A 71 9.235 -14.511 0.204 1.00 0.00 C ATOM 1122 OE1 GLU A 71 8.966 -13.887 1.252 1.00 0.00 O ATOM 1123 OE2 GLU A 71 8.510 -15.416 -0.259 1.00 0.00 O ATOM 0 H GLU A 71 9.474 -10.968 -2.777 1.00 0.00 H new ATOM 0 HA GLU A 71 8.939 -12.061 -0.130 1.00 0.00 H new ATOM 0 HB2 GLU A 71 9.668 -13.309 -2.320 1.00 0.00 H new ATOM 0 HB3 GLU A 71 11.274 -12.723 -1.935 1.00 0.00 H new ATOM 0 HG2 GLU A 71 10.855 -15.021 -1.097 1.00 0.00 H new ATOM 0 HG3 GLU A 71 11.284 -13.898 0.178 1.00 0.00 H new ATOM 1130 N SER A 72 11.211 -11.520 1.041 1.00 0.00 N ATOM 1131 CA SER A 72 12.236 -10.879 1.856 1.00 0.00 C ATOM 1132 C SER A 72 13.527 -11.692 1.844 1.00 0.00 C ATOM 1133 O SER A 72 14.426 -11.463 2.651 1.00 0.00 O ATOM 1134 CB SER A 72 11.741 -10.708 3.294 1.00 0.00 C ATOM 1135 OG SER A 72 12.385 -9.616 3.928 1.00 0.00 O ATOM 0 H SER A 72 10.866 -12.404 1.415 1.00 0.00 H new ATOM 0 HA SER A 72 12.442 -9.897 1.431 1.00 0.00 H new ATOM 0 HB2 SER A 72 10.663 -10.549 3.294 1.00 0.00 H new ATOM 0 HB3 SER A 72 11.928 -11.622 3.858 1.00 0.00 H new ATOM 0 HG SER A 72 13.356 -9.707 3.829 1.00 0.00 H new ATOM 1141 N GLY A 73 13.609 -12.646 0.921 1.00 0.00 N ATOM 1142 CA GLY A 73 14.793 -13.480 0.820 1.00 0.00 C ATOM 1143 C GLY A 73 15.224 -13.703 -0.616 1.00 0.00 C ATOM 1144 O GLY A 73 16.132 -14.489 -0.884 1.00 0.00 O ATOM 0 H GLY A 73 12.877 -12.856 0.242 1.00 0.00 H new ATOM 0 HA2 GLY A 73 15.609 -13.015 1.373 1.00 0.00 H new ATOM 0 HA3 GLY A 73 14.597 -14.443 1.291 1.00 0.00 H new ATOM 1148 N ALA A 74 14.570 -13.010 -1.543 1.00 0.00 N ATOM 1149 CA ALA A 74 14.891 -13.137 -2.959 1.00 0.00 C ATOM 1150 C ALA A 74 16.193 -12.416 -3.294 1.00 0.00 C ATOM 1151 O ALA A 74 16.331 -11.218 -3.046 1.00 0.00 O ATOM 1152 CB ALA A 74 13.752 -12.594 -3.809 1.00 0.00 C ATOM 0 H ALA A 74 13.815 -12.355 -1.338 1.00 0.00 H new ATOM 0 HA ALA A 74 15.024 -14.196 -3.182 1.00 0.00 H new ATOM 0 HB1 ALA A 74 14.005 -12.695 -4.864 1.00 0.00 H new ATOM 0 HB2 ALA A 74 12.842 -13.155 -3.599 1.00 0.00 H new ATOM 0 HB3 ALA A 74 13.592 -11.542 -3.574 1.00 0.00 H new ATOM 1158 N ARG A 75 17.144 -13.153 -3.856 1.00 0.00 N ATOM 1159 CA ARG A 75 18.436 -12.584 -4.222 1.00 0.00 C ATOM 1160 C ARG A 75 18.564 -12.457 -5.738 1.00 0.00 C ATOM 1161 O ARG A 75 18.680 -11.354 -6.271 1.00 0.00 O ATOM 1162 CB ARG A 75 19.572 -13.449 -3.674 1.00 0.00 C ATOM 1163 CG ARG A 75 19.161 -14.883 -3.385 1.00 0.00 C ATOM 1164 CD ARG A 75 20.372 -15.792 -3.245 1.00 0.00 C ATOM 1165 NE ARG A 75 19.989 -17.179 -2.993 1.00 0.00 N ATOM 1166 CZ ARG A 75 19.515 -17.992 -3.930 1.00 0.00 C ATOM 1167 NH1 ARG A 75 19.368 -17.560 -5.175 1.00 0.00 N ATOM 1168 NH2 ARG A 75 19.189 -19.241 -3.624 1.00 0.00 N ATOM 0 H ARG A 75 17.045 -14.146 -4.068 1.00 0.00 H new ATOM 0 HA ARG A 75 18.504 -11.588 -3.784 1.00 0.00 H new ATOM 0 HB2 ARG A 75 20.393 -13.453 -4.391 1.00 0.00 H new ATOM 0 HB3 ARG A 75 19.952 -12.997 -2.758 1.00 0.00 H new ATOM 0 HG2 ARG A 75 18.572 -14.916 -2.469 1.00 0.00 H new ATOM 0 HG3 ARG A 75 18.521 -15.248 -4.188 1.00 0.00 H new ATOM 0 HD2 ARG A 75 20.971 -15.741 -4.154 1.00 0.00 H new ATOM 0 HD3 ARG A 75 21.001 -15.435 -2.429 1.00 0.00 H new ATOM 0 HE ARG A 75 20.091 -17.543 -2.046 1.00 0.00 H new ATOM 0 HH11 ARG A 75 19.619 -16.601 -5.415 1.00 0.00 H new ATOM 0 HH12 ARG A 75 19.004 -18.187 -5.893 1.00 0.00 H new ATOM 0 HH21 ARG A 75 19.302 -19.578 -2.668 1.00 0.00 H new ATOM 0 HH22 ARG A 75 18.825 -19.864 -4.345 1.00 0.00 H new ATOM 1182 N VAL A 76 18.543 -13.595 -6.425 1.00 0.00 N ATOM 1183 CA VAL A 76 18.656 -13.611 -7.879 1.00 0.00 C ATOM 1184 C VAL A 76 17.834 -14.745 -8.481 1.00 0.00 C ATOM 1185 O VAL A 76 17.641 -15.788 -7.854 1.00 0.00 O ATOM 1186 CB VAL A 76 20.123 -13.762 -8.326 1.00 0.00 C ATOM 1187 CG1 VAL A 76 20.255 -13.504 -9.819 1.00 0.00 C ATOM 1188 CG2 VAL A 76 21.020 -12.824 -7.532 1.00 0.00 C ATOM 0 H VAL A 76 18.449 -14.517 -5.999 1.00 0.00 H new ATOM 0 HA VAL A 76 18.271 -12.656 -8.237 1.00 0.00 H new ATOM 0 HB VAL A 76 20.442 -14.786 -8.129 1.00 0.00 H new ATOM 0 HG11 VAL A 76 21.298 -13.615 -10.117 1.00 0.00 H new ATOM 0 HG12 VAL A 76 19.643 -14.220 -10.367 1.00 0.00 H new ATOM 0 HG13 VAL A 76 19.919 -12.492 -10.044 1.00 0.00 H new ATOM 0 HG21 VAL A 76 22.053 -12.943 -7.860 1.00 0.00 H new ATOM 0 HG22 VAL A 76 20.704 -11.794 -7.695 1.00 0.00 H new ATOM 0 HG23 VAL A 76 20.947 -13.062 -6.471 1.00 0.00 H new ATOM 1198 N LEU A 77 17.351 -14.535 -9.701 1.00 0.00 N ATOM 1199 CA LEU A 77 16.549 -15.540 -10.389 1.00 0.00 C ATOM 1200 C LEU A 77 17.357 -16.221 -11.489 1.00 0.00 C ATOM 1201 O LEU A 77 18.561 -15.997 -11.621 1.00 0.00 O ATOM 1202 CB LEU A 77 15.294 -14.899 -10.985 1.00 0.00 C ATOM 1203 CG LEU A 77 14.232 -14.446 -9.984 1.00 0.00 C ATOM 1204 CD1 LEU A 77 13.490 -13.226 -10.507 1.00 0.00 C ATOM 1205 CD2 LEU A 77 13.259 -15.579 -9.690 1.00 0.00 C ATOM 0 H LEU A 77 17.501 -13.678 -10.234 1.00 0.00 H new ATOM 0 HA LEU A 77 16.253 -16.295 -9.660 1.00 0.00 H new ATOM 0 HB2 LEU A 77 15.598 -14.036 -11.578 1.00 0.00 H new ATOM 0 HB3 LEU A 77 14.837 -15.612 -11.671 1.00 0.00 H new ATOM 0 HG LEU A 77 14.730 -14.171 -9.055 1.00 0.00 H new ATOM 0 HD11 LEU A 77 12.738 -12.918 -9.780 1.00 0.00 H new ATOM 0 HD12 LEU A 77 14.196 -12.411 -10.666 1.00 0.00 H new ATOM 0 HD13 LEU A 77 13.003 -13.473 -11.450 1.00 0.00 H new ATOM 0 HD21 LEU A 77 12.510 -15.239 -8.975 1.00 0.00 H new ATOM 0 HD22 LEU A 77 12.767 -15.885 -10.613 1.00 0.00 H new ATOM 0 HD23 LEU A 77 13.802 -16.426 -9.270 1.00 0.00 H new ATOM 1217 N THR A 78 16.687 -17.055 -12.279 1.00 0.00 N ATOM 1218 CA THR A 78 17.342 -17.768 -13.369 1.00 0.00 C ATOM 1219 C THR A 78 17.020 -17.130 -14.715 1.00 0.00 C ATOM 1220 O THR A 78 16.308 -16.129 -14.784 1.00 0.00 O ATOM 1221 CB THR A 78 16.922 -19.250 -13.402 1.00 0.00 C ATOM 1222 OG1 THR A 78 15.563 -19.364 -13.838 1.00 0.00 O ATOM 1223 CG2 THR A 78 17.075 -19.887 -12.029 1.00 0.00 C ATOM 0 H THR A 78 15.691 -17.253 -12.184 1.00 0.00 H new ATOM 0 HA THR A 78 18.415 -17.706 -13.188 1.00 0.00 H new ATOM 0 HB THR A 78 17.573 -19.774 -14.102 1.00 0.00 H new ATOM 0 HG1 THR A 78 15.304 -20.309 -13.858 1.00 0.00 H new ATOM 0 HG21 THR A 78 16.772 -20.933 -12.077 1.00 0.00 H new ATOM 0 HG22 THR A 78 18.116 -19.825 -11.713 1.00 0.00 H new ATOM 0 HG23 THR A 78 16.446 -19.360 -11.311 1.00 0.00 H new ATOM 1231 N ALA A 79 17.549 -17.717 -15.784 1.00 0.00 N ATOM 1232 CA ALA A 79 17.316 -17.207 -17.129 1.00 0.00 C ATOM 1233 C ALA A 79 15.960 -17.659 -17.661 1.00 0.00 C ATOM 1234 O ALA A 79 15.575 -17.317 -18.779 1.00 0.00 O ATOM 1235 CB ALA A 79 18.429 -17.657 -18.065 1.00 0.00 C ATOM 0 H ALA A 79 18.142 -18.546 -15.744 1.00 0.00 H new ATOM 0 HA ALA A 79 17.314 -16.118 -17.082 1.00 0.00 H new ATOM 0 HB1 ALA A 79 18.242 -17.269 -19.066 1.00 0.00 H new ATOM 0 HB2 ALA A 79 19.385 -17.279 -17.702 1.00 0.00 H new ATOM 0 HB3 ALA A 79 18.459 -18.746 -18.098 1.00 0.00 H new ATOM 1241 N SER A 80 15.241 -18.431 -16.853 1.00 0.00 N ATOM 1242 CA SER A 80 13.929 -18.935 -17.244 1.00 0.00 C ATOM 1243 C SER A 80 12.818 -18.114 -16.597 1.00 0.00 C ATOM 1244 O SER A 80 11.977 -17.537 -17.286 1.00 0.00 O ATOM 1245 CB SER A 80 13.787 -20.406 -16.851 1.00 0.00 C ATOM 1246 OG SER A 80 14.679 -21.221 -17.592 1.00 0.00 O ATOM 0 H SER A 80 15.544 -18.721 -15.923 1.00 0.00 H new ATOM 0 HA SER A 80 13.840 -18.846 -18.327 1.00 0.00 H new ATOM 0 HB2 SER A 80 13.984 -20.521 -15.785 1.00 0.00 H new ATOM 0 HB3 SER A 80 12.762 -20.734 -17.023 1.00 0.00 H new ATOM 0 HG SER A 80 14.570 -22.156 -17.321 1.00 0.00 H new ATOM 1252 N GLU A 81 12.821 -18.067 -15.269 1.00 0.00 N ATOM 1253 CA GLU A 81 11.812 -17.318 -14.529 1.00 0.00 C ATOM 1254 C GLU A 81 11.686 -15.896 -15.068 1.00 0.00 C ATOM 1255 O GLU A 81 10.581 -15.391 -15.269 1.00 0.00 O ATOM 1256 CB GLU A 81 12.162 -17.282 -13.040 1.00 0.00 C ATOM 1257 CG GLU A 81 12.066 -18.637 -12.359 1.00 0.00 C ATOM 1258 CD GLU A 81 12.313 -18.558 -10.865 1.00 0.00 C ATOM 1259 OE1 GLU A 81 11.541 -17.862 -10.173 1.00 0.00 O ATOM 1260 OE2 GLU A 81 13.277 -19.191 -10.387 1.00 0.00 O ATOM 0 H GLU A 81 13.510 -18.538 -14.683 1.00 0.00 H new ATOM 0 HA GLU A 81 10.855 -17.823 -14.658 1.00 0.00 H new ATOM 0 HB2 GLU A 81 13.175 -16.897 -12.923 1.00 0.00 H new ATOM 0 HB3 GLU A 81 11.495 -16.583 -12.535 1.00 0.00 H new ATOM 0 HG2 GLU A 81 11.078 -19.060 -12.538 1.00 0.00 H new ATOM 0 HG3 GLU A 81 12.790 -19.317 -12.808 1.00 0.00 H new ATOM 1267 N THR A 82 12.827 -15.254 -15.299 1.00 0.00 N ATOM 1268 CA THR A 82 12.846 -13.890 -15.812 1.00 0.00 C ATOM 1269 C THR A 82 12.426 -13.848 -17.277 1.00 0.00 C ATOM 1270 O THR A 82 11.609 -13.018 -17.676 1.00 0.00 O ATOM 1271 CB THR A 82 14.244 -13.257 -15.673 1.00 0.00 C ATOM 1272 OG1 THR A 82 15.193 -13.987 -16.458 1.00 0.00 O ATOM 1273 CG2 THR A 82 14.687 -13.240 -14.218 1.00 0.00 C ATOM 0 H THR A 82 13.750 -15.657 -15.139 1.00 0.00 H new ATOM 0 HA THR A 82 12.135 -13.318 -15.216 1.00 0.00 H new ATOM 0 HB THR A 82 14.191 -12.229 -16.032 1.00 0.00 H new ATOM 0 HG1 THR A 82 15.579 -14.707 -15.918 1.00 0.00 H new ATOM 0 HG21 THR A 82 15.676 -12.789 -14.144 1.00 0.00 H new ATOM 0 HG22 THR A 82 13.978 -12.658 -13.629 1.00 0.00 H new ATOM 0 HG23 THR A 82 14.724 -14.261 -13.837 1.00 0.00 H new ATOM 1281 N LYS A 83 12.988 -14.750 -18.075 1.00 0.00 N ATOM 1282 CA LYS A 83 12.670 -14.818 -19.497 1.00 0.00 C ATOM 1283 C LYS A 83 11.170 -14.999 -19.711 1.00 0.00 C ATOM 1284 O LYS A 83 10.636 -14.652 -20.765 1.00 0.00 O ATOM 1285 CB LYS A 83 13.432 -15.969 -20.156 1.00 0.00 C ATOM 1286 CG LYS A 83 13.056 -16.194 -21.610 1.00 0.00 C ATOM 1287 CD LYS A 83 14.133 -16.967 -22.352 1.00 0.00 C ATOM 1288 CE LYS A 83 13.948 -18.469 -22.197 1.00 0.00 C ATOM 1289 NZ LYS A 83 12.749 -18.959 -22.931 1.00 0.00 N ATOM 0 H LYS A 83 13.666 -15.444 -17.761 1.00 0.00 H new ATOM 0 HA LYS A 83 12.974 -13.878 -19.957 1.00 0.00 H new ATOM 0 HB2 LYS A 83 14.502 -15.769 -20.093 1.00 0.00 H new ATOM 0 HB3 LYS A 83 13.246 -16.885 -19.595 1.00 0.00 H new ATOM 0 HG2 LYS A 83 12.114 -16.740 -21.663 1.00 0.00 H new ATOM 0 HG3 LYS A 83 12.895 -15.233 -22.098 1.00 0.00 H new ATOM 0 HD2 LYS A 83 14.108 -16.704 -23.409 1.00 0.00 H new ATOM 0 HD3 LYS A 83 15.114 -16.679 -21.975 1.00 0.00 H new ATOM 0 HE2 LYS A 83 14.835 -18.984 -22.566 1.00 0.00 H new ATOM 0 HE3 LYS A 83 13.852 -18.716 -21.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 12.842 -19.980 -23.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 11.897 -18.782 -22.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 12.669 -18.458 -23.839 1.00 0.00 H new ATOM 1303 N THR A 84 10.494 -15.543 -18.703 1.00 0.00 N ATOM 1304 CA THR A 84 9.057 -15.769 -18.781 1.00 0.00 C ATOM 1305 C THR A 84 8.288 -14.687 -18.031 1.00 0.00 C ATOM 1306 O THR A 84 7.171 -14.915 -17.566 1.00 0.00 O ATOM 1307 CB THR A 84 8.673 -17.147 -18.208 1.00 0.00 C ATOM 1308 OG1 THR A 84 7.308 -17.444 -18.520 1.00 0.00 O ATOM 1309 CG2 THR A 84 8.874 -17.180 -16.701 1.00 0.00 C ATOM 0 H THR A 84 10.920 -15.835 -17.823 1.00 0.00 H new ATOM 0 HA THR A 84 8.789 -15.735 -19.837 1.00 0.00 H new ATOM 0 HB THR A 84 9.320 -17.898 -18.661 1.00 0.00 H new ATOM 0 HG1 THR A 84 6.747 -16.671 -18.302 1.00 0.00 H new ATOM 0 HG21 THR A 84 8.597 -18.162 -16.318 1.00 0.00 H new ATOM 0 HG22 THR A 84 9.921 -16.983 -16.469 1.00 0.00 H new ATOM 0 HG23 THR A 84 8.249 -16.419 -16.234 1.00 0.00 H new ATOM 1317 N PHE A 85 8.893 -13.510 -17.917 1.00 0.00 N ATOM 1318 CA PHE A 85 8.265 -12.392 -17.223 1.00 0.00 C ATOM 1319 C PHE A 85 7.808 -11.324 -18.213 1.00 0.00 C ATOM 1320 O PHE A 85 6.630 -10.966 -18.258 1.00 0.00 O ATOM 1321 CB PHE A 85 9.236 -11.782 -16.210 1.00 0.00 C ATOM 1322 CG PHE A 85 8.578 -11.359 -14.928 1.00 0.00 C ATOM 1323 CD1 PHE A 85 7.315 -10.789 -14.937 1.00 0.00 C ATOM 1324 CD2 PHE A 85 9.222 -11.531 -13.713 1.00 0.00 C ATOM 1325 CE1 PHE A 85 6.708 -10.398 -13.759 1.00 0.00 C ATOM 1326 CE2 PHE A 85 8.620 -11.143 -12.532 1.00 0.00 C ATOM 1327 CZ PHE A 85 7.360 -10.576 -12.555 1.00 0.00 C ATOM 0 H PHE A 85 9.818 -13.305 -18.296 1.00 0.00 H new ATOM 0 HA PHE A 85 7.390 -12.771 -16.695 1.00 0.00 H new ATOM 0 HB2 PHE A 85 10.018 -12.508 -15.986 1.00 0.00 H new ATOM 0 HB3 PHE A 85 9.724 -10.918 -16.661 1.00 0.00 H new ATOM 0 HD1 PHE A 85 6.799 -10.649 -15.875 1.00 0.00 H new ATOM 0 HD2 PHE A 85 10.207 -11.974 -13.689 1.00 0.00 H new ATOM 0 HE1 PHE A 85 5.724 -9.953 -13.780 1.00 0.00 H new ATOM 0 HE2 PHE A 85 9.133 -11.283 -11.592 1.00 0.00 H new ATOM 0 HZ PHE A 85 6.886 -10.273 -11.633 1.00 0.00 H new ATOM 1337 N LEU A 86 8.748 -10.819 -19.004 1.00 0.00 N ATOM 1338 CA LEU A 86 8.444 -9.791 -19.993 1.00 0.00 C ATOM 1339 C LEU A 86 8.595 -10.337 -21.410 1.00 0.00 C ATOM 1340 O LEU A 86 7.976 -9.835 -22.348 1.00 0.00 O ATOM 1341 CB LEU A 86 9.361 -8.582 -19.800 1.00 0.00 C ATOM 1342 CG LEU A 86 10.861 -8.853 -19.913 1.00 0.00 C ATOM 1343 CD1 LEU A 86 11.273 -8.979 -21.371 1.00 0.00 C ATOM 1344 CD2 LEU A 86 11.655 -7.751 -19.226 1.00 0.00 C ATOM 0 H LEU A 86 9.727 -11.105 -18.980 1.00 0.00 H new ATOM 0 HA LEU A 86 7.409 -9.480 -19.851 1.00 0.00 H new ATOM 0 HB2 LEU A 86 9.092 -7.826 -20.538 1.00 0.00 H new ATOM 0 HB3 LEU A 86 9.162 -8.154 -18.818 1.00 0.00 H new ATOM 0 HG LEU A 86 11.079 -9.797 -19.413 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.344 -9.172 -21.431 1.00 0.00 H new ATOM 0 HD12 LEU A 86 10.730 -9.803 -21.833 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.041 -8.052 -21.896 1.00 0.00 H new ATOM 0 HD21 LEU A 86 12.721 -7.960 -19.316 1.00 0.00 H new ATOM 0 HD22 LEU A 86 11.432 -6.794 -19.697 1.00 0.00 H new ATOM 0 HD23 LEU A 86 11.382 -7.709 -18.172 1.00 0.00 H new ATOM 1356 N ALA A 87 9.419 -11.369 -21.556 1.00 0.00 N ATOM 1357 CA ALA A 87 9.647 -11.986 -22.856 1.00 0.00 C ATOM 1358 C ALA A 87 8.610 -13.067 -23.141 1.00 0.00 C ATOM 1359 O ALA A 87 8.665 -13.737 -24.172 1.00 0.00 O ATOM 1360 CB ALA A 87 11.051 -12.569 -22.924 1.00 0.00 C ATOM 0 H ALA A 87 9.940 -11.795 -20.790 1.00 0.00 H new ATOM 0 HA ALA A 87 9.548 -11.214 -23.619 1.00 0.00 H new ATOM 0 HB1 ALA A 87 11.208 -13.027 -23.901 1.00 0.00 H new ATOM 0 HB2 ALA A 87 11.782 -11.775 -22.774 1.00 0.00 H new ATOM 0 HB3 ALA A 87 11.170 -13.323 -22.146 1.00 0.00 H new ATOM 1366 N ALA A 88 7.665 -13.231 -22.221 1.00 0.00 N ATOM 1367 CA ALA A 88 6.614 -14.229 -22.374 1.00 0.00 C ATOM 1368 C ALA A 88 5.353 -13.612 -22.970 1.00 0.00 C ATOM 1369 O ALA A 88 4.687 -14.222 -23.805 1.00 0.00 O ATOM 1370 CB ALA A 88 6.304 -14.879 -21.034 1.00 0.00 C ATOM 0 H ALA A 88 7.606 -12.685 -21.361 1.00 0.00 H new ATOM 0 HA ALA A 88 6.972 -14.995 -23.062 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.517 -15.622 -21.163 1.00 0.00 H new ATOM 0 HB2 ALA A 88 7.201 -15.364 -20.648 1.00 0.00 H new ATOM 0 HB3 ALA A 88 5.971 -14.118 -20.329 1.00 0.00 H new ATOM 1376 N ALA A 89 5.032 -12.398 -22.534 1.00 0.00 N ATOM 1377 CA ALA A 89 3.851 -11.698 -23.026 1.00 0.00 C ATOM 1378 C ALA A 89 3.824 -11.671 -24.550 1.00 0.00 C ATOM 1379 O ALA A 89 2.933 -12.247 -25.175 1.00 0.00 O ATOM 1380 CB ALA A 89 3.808 -10.282 -22.470 1.00 0.00 C ATOM 0 H ALA A 89 5.573 -11.879 -21.842 1.00 0.00 H new ATOM 0 HA ALA A 89 2.969 -12.239 -22.683 1.00 0.00 H new ATOM 0 HB1 ALA A 89 2.922 -9.771 -22.845 1.00 0.00 H new ATOM 0 HB2 ALA A 89 3.772 -10.320 -21.381 1.00 0.00 H new ATOM 0 HB3 ALA A 89 4.700 -9.740 -22.785 1.00 0.00 H new ATOM 1386 N ASP A 90 4.805 -10.998 -25.142 1.00 0.00 N ATOM 1387 CA ASP A 90 4.893 -10.896 -26.595 1.00 0.00 C ATOM 1388 C ASP A 90 6.219 -10.269 -27.016 1.00 0.00 C ATOM 1389 O ASP A 90 6.995 -9.812 -26.176 1.00 0.00 O ATOM 1390 CB ASP A 90 3.728 -10.071 -27.141 1.00 0.00 C ATOM 1391 CG ASP A 90 3.354 -10.463 -28.557 1.00 0.00 C ATOM 1392 OD1 ASP A 90 2.791 -11.564 -28.739 1.00 0.00 O ATOM 1393 OD2 ASP A 90 3.623 -9.670 -29.483 1.00 0.00 O ATOM 0 H ASP A 90 5.550 -10.515 -24.639 1.00 0.00 H new ATOM 0 HA ASP A 90 4.840 -11.903 -27.009 1.00 0.00 H new ATOM 0 HB2 ASP A 90 2.862 -10.197 -26.492 1.00 0.00 H new ATOM 0 HB3 ASP A 90 3.993 -9.014 -27.118 1.00 0.00 H new ATOM 1453 N LYS A 96 9.667 -5.906 -25.468 1.00 0.00 N ATOM 1454 CA LYS A 96 9.466 -4.821 -24.515 1.00 0.00 C ATOM 1455 C LYS A 96 7.980 -4.588 -24.262 1.00 0.00 C ATOM 1456 O LYS A 96 7.202 -4.409 -25.200 1.00 0.00 O ATOM 1457 CB LYS A 96 10.113 -3.534 -25.032 1.00 0.00 C ATOM 1458 CG LYS A 96 9.483 -3.006 -26.309 1.00 0.00 C ATOM 1459 CD LYS A 96 10.324 -1.905 -26.933 1.00 0.00 C ATOM 1460 CE LYS A 96 9.746 -1.447 -28.263 1.00 0.00 C ATOM 1461 NZ LYS A 96 10.542 -0.342 -28.863 1.00 0.00 N ATOM 0 HA LYS A 96 9.937 -5.105 -23.574 1.00 0.00 H new ATOM 0 HB2 LYS A 96 10.045 -2.768 -24.260 1.00 0.00 H new ATOM 0 HB3 LYS A 96 11.173 -3.716 -25.208 1.00 0.00 H new ATOM 0 HG2 LYS A 96 9.364 -3.822 -27.022 1.00 0.00 H new ATOM 0 HG3 LYS A 96 8.485 -2.624 -26.093 1.00 0.00 H new ATOM 0 HD2 LYS A 96 10.381 -1.058 -26.249 1.00 0.00 H new ATOM 0 HD3 LYS A 96 11.342 -2.264 -27.082 1.00 0.00 H new ATOM 0 HE2 LYS A 96 9.715 -2.289 -28.955 1.00 0.00 H new ATOM 0 HE3 LYS A 96 8.718 -1.116 -28.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 10.115 -0.059 -29.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 10.551 0.471 -28.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 11.517 -0.665 -29.026 1.00 0.00 H new ATOM 1475 N ILE A 97 7.593 -4.591 -22.991 1.00 0.00 N ATOM 1476 CA ILE A 97 6.201 -4.377 -22.616 1.00 0.00 C ATOM 1477 C ILE A 97 5.869 -2.890 -22.560 1.00 0.00 C ATOM 1478 O ILE A 97 6.746 -2.055 -22.344 1.00 0.00 O ATOM 1479 CB ILE A 97 5.882 -5.015 -21.251 1.00 0.00 C ATOM 1480 CG1 ILE A 97 6.473 -6.424 -21.171 1.00 0.00 C ATOM 1481 CG2 ILE A 97 4.378 -5.052 -21.022 1.00 0.00 C ATOM 1482 CD1 ILE A 97 5.971 -7.352 -22.254 1.00 0.00 C ATOM 0 H ILE A 97 8.224 -4.739 -22.203 1.00 0.00 H new ATOM 0 HA ILE A 97 5.590 -4.854 -23.383 1.00 0.00 H new ATOM 0 HB ILE A 97 6.334 -4.407 -20.468 1.00 0.00 H new ATOM 0 HG12 ILE A 97 7.559 -6.358 -21.235 1.00 0.00 H new ATOM 0 HG13 ILE A 97 6.237 -6.854 -20.197 1.00 0.00 H new ATOM 0 HG21 ILE A 97 4.169 -5.506 -20.053 1.00 0.00 H new ATOM 0 HG22 ILE A 97 3.982 -4.037 -21.040 1.00 0.00 H new ATOM 0 HG23 ILE A 97 3.905 -5.640 -21.808 1.00 0.00 H new ATOM 0 HD11 ILE A 97 6.432 -8.333 -22.135 1.00 0.00 H new ATOM 0 HD12 ILE A 97 4.888 -7.448 -22.177 1.00 0.00 H new ATOM 0 HD13 ILE A 97 6.231 -6.945 -23.231 1.00 0.00 H new ATOM 1494 N GLY A 98 4.594 -2.566 -22.754 1.00 0.00 N ATOM 1495 CA GLY A 98 4.167 -1.180 -22.720 1.00 0.00 C ATOM 1496 C GLY A 98 2.806 -1.008 -22.075 1.00 0.00 C ATOM 1497 O GLY A 98 1.902 -0.419 -22.666 1.00 0.00 O ATOM 0 H GLY A 98 3.849 -3.239 -22.934 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.902 -0.590 -22.173 1.00 0.00 H new ATOM 0 HA3 GLY A 98 4.136 -0.788 -23.736 1.00 0.00 H new ATOM 1501 N ALA A 99 2.659 -1.525 -20.860 1.00 0.00 N ATOM 1502 CA ALA A 99 1.399 -1.425 -20.134 1.00 0.00 C ATOM 1503 C ALA A 99 0.231 -1.891 -20.996 1.00 0.00 C ATOM 1504 O ALA A 99 -0.845 -1.294 -20.974 1.00 0.00 O ATOM 1505 CB ALA A 99 1.173 0.004 -19.663 1.00 0.00 C ATOM 0 H ALA A 99 3.397 -2.018 -20.357 1.00 0.00 H new ATOM 0 HA ALA A 99 1.457 -2.078 -19.263 1.00 0.00 H new ATOM 0 HB1 ALA A 99 0.228 0.064 -19.122 1.00 0.00 H new ATOM 0 HB2 ALA A 99 1.988 0.303 -19.004 1.00 0.00 H new ATOM 0 HB3 ALA A 99 1.141 0.670 -20.525 1.00 0.00 H new ATOM 1511 N GLU A 100 0.451 -2.960 -21.755 1.00 0.00 N ATOM 1512 CA GLU A 100 -0.585 -3.504 -22.626 1.00 0.00 C ATOM 1513 C GLU A 100 -0.448 -5.018 -22.753 1.00 0.00 C ATOM 1514 O GLU A 100 -1.444 -5.739 -22.800 1.00 0.00 O ATOM 1515 CB GLU A 100 -0.511 -2.856 -24.010 1.00 0.00 C ATOM 1516 CG GLU A 100 0.865 -2.942 -24.649 1.00 0.00 C ATOM 1517 CD GLU A 100 0.896 -2.357 -26.048 1.00 0.00 C ATOM 1518 OE1 GLU A 100 -0.167 -2.327 -26.703 1.00 0.00 O ATOM 1519 OE2 GLU A 100 1.983 -1.927 -26.487 1.00 0.00 O ATOM 0 H GLU A 100 1.336 -3.466 -21.785 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.554 -3.280 -22.180 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -1.238 -3.336 -24.666 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -0.799 -1.808 -23.927 1.00 0.00 H new ATOM 0 HG2 GLU A 100 1.586 -2.416 -24.023 1.00 0.00 H new ATOM 0 HG3 GLU A 100 1.179 -3.985 -24.688 1.00 0.00 H new ATOM 1526 N GLU A 101 0.793 -5.492 -22.809 1.00 0.00 N ATOM 1527 CA GLU A 101 1.059 -6.920 -22.933 1.00 0.00 C ATOM 1528 C GLU A 101 0.934 -7.616 -21.580 1.00 0.00 C ATOM 1529 O GLU A 101 0.228 -8.616 -21.447 1.00 0.00 O ATOM 1530 CB GLU A 101 2.457 -7.153 -23.511 1.00 0.00 C ATOM 1531 CG GLU A 101 2.630 -6.612 -24.920 1.00 0.00 C ATOM 1532 CD GLU A 101 4.044 -6.136 -25.192 1.00 0.00 C ATOM 1533 OE1 GLU A 101 4.964 -6.980 -25.200 1.00 0.00 O ATOM 1534 OE2 GLU A 101 4.230 -4.918 -25.397 1.00 0.00 O ATOM 0 H GLU A 101 1.629 -4.909 -22.770 1.00 0.00 H new ATOM 0 HA GLU A 101 0.318 -7.344 -23.611 1.00 0.00 H new ATOM 0 HB2 GLU A 101 3.194 -6.685 -22.858 1.00 0.00 H new ATOM 0 HB3 GLU A 101 2.667 -8.223 -23.513 1.00 0.00 H new ATOM 0 HG2 GLU A 101 2.367 -7.389 -25.638 1.00 0.00 H new ATOM 0 HG3 GLU A 101 1.936 -5.786 -25.076 1.00 0.00 H new ATOM 1541 N PHE A 102 1.624 -7.080 -20.579 1.00 0.00 N ATOM 1542 CA PHE A 102 1.592 -7.649 -19.237 1.00 0.00 C ATOM 1543 C PHE A 102 0.160 -7.735 -18.717 1.00 0.00 C ATOM 1544 O PHE A 102 -0.197 -8.674 -18.006 1.00 0.00 O ATOM 1545 CB PHE A 102 2.444 -6.809 -18.283 1.00 0.00 C ATOM 1546 CG PHE A 102 2.824 -7.533 -17.024 1.00 0.00 C ATOM 1547 CD1 PHE A 102 1.863 -7.863 -16.081 1.00 0.00 C ATOM 1548 CD2 PHE A 102 4.142 -7.885 -16.782 1.00 0.00 C ATOM 1549 CE1 PHE A 102 2.211 -8.529 -14.921 1.00 0.00 C ATOM 1550 CE2 PHE A 102 4.496 -8.551 -15.624 1.00 0.00 C ATOM 1551 CZ PHE A 102 3.528 -8.874 -14.692 1.00 0.00 C ATOM 0 H PHE A 102 2.212 -6.252 -20.672 1.00 0.00 H new ATOM 0 HA PHE A 102 2.003 -8.657 -19.287 1.00 0.00 H new ATOM 0 HB2 PHE A 102 3.351 -6.495 -18.800 1.00 0.00 H new ATOM 0 HB3 PHE A 102 1.896 -5.904 -18.021 1.00 0.00 H new ATOM 0 HD1 PHE A 102 0.831 -7.597 -16.255 1.00 0.00 H new ATOM 0 HD2 PHE A 102 4.902 -7.636 -17.507 1.00 0.00 H new ATOM 0 HE1 PHE A 102 1.453 -8.779 -14.194 1.00 0.00 H new ATOM 0 HE2 PHE A 102 5.527 -8.819 -15.448 1.00 0.00 H new ATOM 0 HZ PHE A 102 3.801 -9.395 -13.786 1.00 0.00 H new ATOM 1561 N GLN A 103 -0.654 -6.749 -19.077 1.00 0.00 N ATOM 1562 CA GLN A 103 -2.047 -6.712 -18.646 1.00 0.00 C ATOM 1563 C GLN A 103 -2.825 -7.893 -19.217 1.00 0.00 C ATOM 1564 O GLN A 103 -3.336 -8.729 -18.473 1.00 0.00 O ATOM 1565 CB GLN A 103 -2.702 -5.399 -19.077 1.00 0.00 C ATOM 1566 CG GLN A 103 -2.397 -4.234 -18.148 1.00 0.00 C ATOM 1567 CD GLN A 103 -0.917 -4.097 -17.850 1.00 0.00 C ATOM 1568 OE1 GLN A 103 -0.497 -4.157 -16.694 1.00 0.00 O ATOM 1569 NE2 GLN A 103 -0.117 -3.911 -18.893 1.00 0.00 N ATOM 0 H GLN A 103 -0.374 -5.965 -19.666 1.00 0.00 H new ATOM 0 HA GLN A 103 -2.066 -6.779 -17.558 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -2.366 -5.148 -20.083 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -3.782 -5.540 -19.127 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -2.760 -3.310 -18.599 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -2.941 -4.368 -17.213 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -0.508 -3.868 -19.834 1.00 0.00 H new ATOM 0 HE22 GLN A 103 0.888 -3.812 -18.753 1.00 0.00 H new ATOM 1578 N GLU A 104 -2.910 -7.954 -20.542 1.00 0.00 N ATOM 1579 CA GLU A 104 -3.627 -9.033 -21.212 1.00 0.00 C ATOM 1580 C GLU A 104 -3.107 -10.395 -20.760 1.00 0.00 C ATOM 1581 O GLU A 104 -3.838 -11.385 -20.771 1.00 0.00 O ATOM 1582 CB GLU A 104 -3.491 -8.900 -22.730 1.00 0.00 C ATOM 1583 CG GLU A 104 -2.051 -8.901 -23.214 1.00 0.00 C ATOM 1584 CD GLU A 104 -1.944 -8.839 -24.726 1.00 0.00 C ATOM 1585 OE1 GLU A 104 -2.997 -8.833 -25.396 1.00 0.00 O ATOM 1586 OE2 GLU A 104 -0.805 -8.796 -25.238 1.00 0.00 O ATOM 0 H GLU A 104 -2.492 -7.270 -21.172 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.680 -8.958 -20.941 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -4.027 -9.720 -23.208 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -3.972 -7.976 -23.050 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -1.525 -8.050 -22.781 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -1.551 -9.801 -22.855 1.00 0.00 H new ATOM 1593 N MET A 105 -1.839 -10.436 -20.365 1.00 0.00 N ATOM 1594 CA MET A 105 -1.220 -11.675 -19.909 1.00 0.00 C ATOM 1595 C MET A 105 -1.865 -12.161 -18.615 1.00 0.00 C ATOM 1596 O MET A 105 -1.872 -13.357 -18.324 1.00 0.00 O ATOM 1597 CB MET A 105 0.282 -11.474 -19.700 1.00 0.00 C ATOM 1598 CG MET A 105 0.927 -12.554 -18.847 1.00 0.00 C ATOM 1599 SD MET A 105 2.604 -12.949 -19.377 1.00 0.00 S ATOM 1600 CE MET A 105 3.363 -11.327 -19.338 1.00 0.00 C ATOM 0 H MET A 105 -1.220 -9.625 -20.351 1.00 0.00 H new ATOM 0 HA MET A 105 -1.374 -12.432 -20.678 1.00 0.00 H new ATOM 0 HB2 MET A 105 0.775 -11.447 -20.672 1.00 0.00 H new ATOM 0 HB3 MET A 105 0.449 -10.504 -19.231 1.00 0.00 H new ATOM 0 HG2 MET A 105 0.946 -12.227 -17.807 1.00 0.00 H new ATOM 0 HG3 MET A 105 0.316 -13.456 -18.886 1.00 0.00 H new ATOM 0 HE1 MET A 105 4.379 -11.392 -19.726 1.00 0.00 H new ATOM 0 HE2 MET A 105 2.783 -10.639 -19.953 1.00 0.00 H new ATOM 0 HE3 MET A 105 3.389 -10.962 -18.311 1.00 0.00 H new ATOM 1610 N VAL A 106 -2.407 -11.225 -17.842 1.00 0.00 N ATOM 1611 CA VAL A 106 -3.055 -11.559 -16.579 1.00 0.00 C ATOM 1612 C VAL A 106 -4.554 -11.760 -16.767 1.00 0.00 C ATOM 1613 O VAL A 106 -5.116 -12.759 -16.320 1.00 0.00 O ATOM 1614 CB VAL A 106 -2.824 -10.461 -15.523 1.00 0.00 C ATOM 1615 CG1 VAL A 106 -3.521 -10.820 -14.219 1.00 0.00 C ATOM 1616 CG2 VAL A 106 -1.335 -10.243 -15.298 1.00 0.00 C ATOM 0 H VAL A 106 -2.410 -10.230 -18.068 1.00 0.00 H new ATOM 0 HA VAL A 106 -2.608 -12.490 -16.230 1.00 0.00 H new ATOM 0 HB VAL A 106 -3.253 -9.529 -15.893 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -3.347 -10.033 -13.485 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -4.592 -10.922 -14.395 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -3.124 -11.762 -13.842 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -1.190 -9.464 -14.549 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -0.880 -11.170 -14.950 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -0.866 -9.938 -16.234 1.00 0.00 H new ATOM 1626 N GLN A 107 -5.195 -10.805 -17.432 1.00 0.00 N ATOM 1627 CA GLN A 107 -6.630 -10.878 -17.680 1.00 0.00 C ATOM 1628 C GLN A 107 -6.983 -12.131 -18.474 1.00 0.00 C ATOM 1629 O GLN A 107 -7.992 -12.783 -18.208 1.00 0.00 O ATOM 1630 CB GLN A 107 -7.104 -9.633 -18.432 1.00 0.00 C ATOM 1631 CG GLN A 107 -6.544 -8.334 -17.873 1.00 0.00 C ATOM 1632 CD GLN A 107 -6.448 -8.345 -16.360 1.00 0.00 C ATOM 1633 OE1 GLN A 107 -7.308 -8.899 -15.675 1.00 0.00 O ATOM 1634 NE2 GLN A 107 -5.397 -7.730 -15.830 1.00 0.00 N ATOM 0 H GLN A 107 -4.744 -9.972 -17.809 1.00 0.00 H new ATOM 0 HA GLN A 107 -7.137 -10.926 -16.716 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -6.818 -9.721 -19.480 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -8.193 -9.593 -18.401 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -5.555 -8.158 -18.295 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -7.177 -7.504 -18.187 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -4.708 -7.284 -16.436 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -5.279 -7.704 -14.817 1.00 0.00 H new ATOM 1643 N SER A 108 -6.144 -12.462 -19.451 1.00 0.00 N ATOM 1644 CA SER A 108 -6.370 -13.635 -20.287 1.00 0.00 C ATOM 1645 C SER A 108 -7.745 -13.577 -20.945 1.00 0.00 C ATOM 1646 O SER A 108 -8.514 -14.534 -20.884 1.00 0.00 O ATOM 1647 CB SER A 108 -6.244 -14.912 -19.455 1.00 0.00 C ATOM 1648 OG SER A 108 -5.089 -14.875 -18.634 1.00 0.00 O ATOM 0 H SER A 108 -5.302 -11.935 -19.683 1.00 0.00 H new ATOM 0 HA SER A 108 -5.612 -13.644 -21.070 1.00 0.00 H new ATOM 0 HB2 SER A 108 -7.131 -15.034 -18.834 1.00 0.00 H new ATOM 0 HB3 SER A 108 -6.196 -15.777 -20.116 1.00 0.00 H new ATOM 0 HG SER A 108 -5.223 -14.229 -17.910 1.00 0.00 H new