USER MOD reduce.3.24.130724 H: found=0, std=0, add=560, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 561 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 Single : A 10 GLN : amide:sc= -0.34 X(o=-0.34,f=-0.057) USER MOD Single : A 16 SER OG : rot 180:sc= -0.223 USER MOD Single : A 19 SER OG : rot 180:sc= 0.027 USER MOD Single : A 24 SER OG : rot 78:sc= 1.29 USER MOD Single : A 25 LYS NZ :NH3+ -146:sc= 0.0984 (180deg=0) USER MOD Single : A 26 SER OG : rot 46:sc= -0.538 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -42:sc= 0.416 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= -0.0103 X(o=-0.01,f=0) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.408 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.209) USER MOD Single : A 68 GLN : amide:sc= 0.0936 K(o=0.094,f=-9!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl 164:sc= -0.427 (180deg=-1.02) USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 ASN : amide:sc= 0 K(o=0,f=-0.71) USER MOD ----------------------------------------------------------------- ATOM 104 N GLN A 10 -15.718 -6.344 1.347 1.00 0.00 N ATOM 105 CA GLN A 10 -16.349 -7.079 2.438 1.00 0.00 C ATOM 106 C GLN A 10 -17.431 -8.015 1.909 1.00 0.00 C ATOM 107 O GLN A 10 -17.941 -7.851 0.801 1.00 0.00 O ATOM 108 CB GLN A 10 -16.951 -6.108 3.455 1.00 0.00 C ATOM 109 CG GLN A 10 -15.962 -5.646 4.513 1.00 0.00 C ATOM 110 CD GLN A 10 -14.876 -4.752 3.948 1.00 0.00 C ATOM 111 OE1 GLN A 10 -13.688 -4.975 4.183 1.00 0.00 O ATOM 112 NE2 GLN A 10 -15.279 -3.733 3.197 1.00 0.00 N ATOM 0 HA GLN A 10 -15.583 -7.679 2.929 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -17.340 -5.237 2.927 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -17.798 -6.588 3.946 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -16.498 -5.109 5.296 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -15.503 -6.517 4.981 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -16.274 -3.586 3.028 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -14.593 -3.098 2.789 1.00 0.00 H new ATOM 121 N PRO A 11 -17.791 -9.022 2.719 1.00 0.00 N ATOM 122 CA PRO A 11 -18.816 -10.004 2.354 1.00 0.00 C ATOM 123 C PRO A 11 -20.215 -9.398 2.324 1.00 0.00 C ATOM 124 O PRO A 11 -20.521 -8.446 3.043 1.00 0.00 O ATOM 125 CB PRO A 11 -18.712 -11.054 3.463 1.00 0.00 C ATOM 126 CG PRO A 11 -18.146 -10.319 4.628 1.00 0.00 C ATOM 127 CD PRO A 11 -17.225 -9.278 4.054 1.00 0.00 C ATOM 0 HA PRO A 11 -18.658 -10.404 1.353 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -19.688 -11.479 3.699 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -18.068 -11.881 3.166 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -18.937 -9.857 5.219 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -17.606 -10.995 5.291 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -17.209 -8.375 4.664 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -16.198 -9.639 3.993 1.00 0.00 H new ATOM 135 N PRO A 12 -21.087 -9.960 1.474 1.00 0.00 N ATOM 136 CA PRO A 12 -22.468 -9.492 1.331 1.00 0.00 C ATOM 137 C PRO A 12 -23.316 -9.803 2.560 1.00 0.00 C ATOM 138 O PRO A 12 -22.858 -10.468 3.489 1.00 0.00 O ATOM 139 CB PRO A 12 -22.983 -10.268 0.116 1.00 0.00 C ATOM 140 CG PRO A 12 -22.145 -11.499 0.072 1.00 0.00 C ATOM 141 CD PRO A 12 -20.791 -11.098 0.587 1.00 0.00 C ATOM 0 HA PRO A 12 -22.521 -8.409 1.216 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -24.040 -10.512 0.221 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -22.879 -9.685 -0.799 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -22.578 -12.288 0.687 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -22.076 -11.888 -0.944 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -20.309 -11.913 1.126 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -20.121 -10.812 -0.224 1.00 0.00 H new ATOM 149 N ALA A 13 -24.553 -9.318 2.558 1.00 0.00 N ATOM 150 CA ALA A 13 -25.465 -9.546 3.672 1.00 0.00 C ATOM 151 C ALA A 13 -26.372 -10.742 3.402 1.00 0.00 C ATOM 152 O ALA A 13 -26.844 -11.398 4.331 1.00 0.00 O ATOM 153 CB ALA A 13 -26.297 -8.300 3.937 1.00 0.00 C ATOM 0 H ALA A 13 -24.947 -8.765 1.797 1.00 0.00 H new ATOM 0 HA ALA A 13 -24.869 -9.767 4.558 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -26.973 -8.485 4.771 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -25.638 -7.467 4.182 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -26.877 -8.054 3.048 1.00 0.00 H new ATOM 159 N ASP A 14 -26.613 -11.020 2.125 1.00 0.00 N ATOM 160 CA ASP A 14 -27.464 -12.138 1.733 1.00 0.00 C ATOM 161 C ASP A 14 -26.693 -13.453 1.791 1.00 0.00 C ATOM 162 O ASP A 14 -27.219 -14.474 2.238 1.00 0.00 O ATOM 163 CB ASP A 14 -28.015 -11.917 0.324 1.00 0.00 C ATOM 164 CG ASP A 14 -29.313 -11.134 0.326 1.00 0.00 C ATOM 165 OD1 ASP A 14 -29.367 -10.075 0.986 1.00 0.00 O ATOM 166 OD2 ASP A 14 -30.276 -11.580 -0.333 1.00 0.00 O ATOM 0 H ASP A 14 -26.231 -10.487 1.344 1.00 0.00 H new ATOM 0 HA ASP A 14 -28.296 -12.194 2.435 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -27.274 -11.385 -0.273 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -28.177 -12.883 -0.155 1.00 0.00 H new ATOM 171 N LEU A 15 -25.446 -13.423 1.335 1.00 0.00 N ATOM 172 CA LEU A 15 -24.603 -14.614 1.334 1.00 0.00 C ATOM 173 C LEU A 15 -25.297 -15.771 0.624 1.00 0.00 C ATOM 174 O LEU A 15 -25.052 -16.938 0.932 1.00 0.00 O ATOM 175 CB LEU A 15 -24.253 -15.016 2.768 1.00 0.00 C ATOM 176 CG LEU A 15 -23.261 -14.109 3.496 1.00 0.00 C ATOM 177 CD1 LEU A 15 -23.844 -13.633 4.818 1.00 0.00 C ATOM 178 CD2 LEU A 15 -21.942 -14.834 3.723 1.00 0.00 C ATOM 0 H LEU A 15 -24.996 -12.587 0.961 1.00 0.00 H new ATOM 0 HA LEU A 15 -23.685 -14.380 0.795 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -25.175 -15.053 3.349 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -23.846 -16.027 2.752 1.00 0.00 H new ATOM 0 HG LEU A 15 -23.070 -13.237 2.871 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -23.124 -12.989 5.322 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -24.762 -13.075 4.631 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -24.065 -14.494 5.449 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -21.248 -14.173 4.242 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -22.116 -15.725 4.327 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -21.516 -15.124 2.762 1.00 0.00 H new ATOM 190 N SER A 16 -26.161 -15.441 -0.330 1.00 0.00 N ATOM 191 CA SER A 16 -26.892 -16.454 -1.084 1.00 0.00 C ATOM 192 C SER A 16 -26.411 -16.506 -2.531 1.00 0.00 C ATOM 193 O SER A 16 -27.171 -16.841 -3.438 1.00 0.00 O ATOM 194 CB SER A 16 -28.393 -16.165 -1.043 1.00 0.00 C ATOM 195 OG SER A 16 -28.707 -15.236 -0.020 1.00 0.00 O ATOM 0 H SER A 16 -26.372 -14.480 -0.600 1.00 0.00 H new ATOM 0 HA SER A 16 -26.703 -17.423 -0.622 1.00 0.00 H new ATOM 0 HB2 SER A 16 -28.717 -15.772 -2.007 1.00 0.00 H new ATOM 0 HB3 SER A 16 -28.940 -17.093 -0.876 1.00 0.00 H new ATOM 0 HG SER A 16 -29.672 -15.067 -0.016 1.00 0.00 H new ATOM 201 N GLY A 17 -25.141 -16.170 -2.739 1.00 0.00 N ATOM 202 CA GLY A 17 -24.580 -16.184 -4.077 1.00 0.00 C ATOM 203 C GLY A 17 -23.064 -16.171 -4.070 1.00 0.00 C ATOM 204 O GLY A 17 -22.435 -15.712 -5.024 1.00 0.00 O ATOM 0 H GLY A 17 -24.491 -15.889 -2.005 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -24.930 -17.071 -4.605 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -24.945 -15.319 -4.630 1.00 0.00 H new ATOM 208 N LEU A 18 -22.475 -16.675 -2.991 1.00 0.00 N ATOM 209 CA LEU A 18 -21.022 -16.718 -2.862 1.00 0.00 C ATOM 210 C LEU A 18 -20.494 -18.124 -3.127 1.00 0.00 C ATOM 211 O LEU A 18 -21.067 -19.111 -2.664 1.00 0.00 O ATOM 212 CB LEU A 18 -20.600 -16.257 -1.466 1.00 0.00 C ATOM 213 CG LEU A 18 -20.929 -14.806 -1.111 1.00 0.00 C ATOM 214 CD1 LEU A 18 -20.482 -14.490 0.308 1.00 0.00 C ATOM 215 CD2 LEU A 18 -20.277 -13.853 -2.102 1.00 0.00 C ATOM 0 H LEU A 18 -22.981 -17.059 -2.193 1.00 0.00 H new ATOM 0 HA LEU A 18 -20.596 -16.043 -3.604 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -21.076 -16.907 -0.731 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -19.524 -16.399 -1.368 1.00 0.00 H new ATOM 0 HG LEU A 18 -22.009 -14.674 -1.168 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -20.724 -13.454 0.543 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -20.996 -15.150 1.007 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -19.406 -14.639 0.392 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -20.522 -12.825 -1.834 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -19.195 -13.986 -2.077 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -20.646 -14.064 -3.106 1.00 0.00 H new ATOM 227 N SER A 19 -19.397 -18.208 -3.872 1.00 0.00 N ATOM 228 CA SER A 19 -18.791 -19.494 -4.200 1.00 0.00 C ATOM 229 C SER A 19 -17.895 -19.977 -3.063 1.00 0.00 C ATOM 230 O SER A 19 -17.675 -19.263 -2.085 1.00 0.00 O ATOM 231 CB SER A 19 -17.981 -19.385 -5.493 1.00 0.00 C ATOM 232 OG SER A 19 -17.170 -18.223 -5.490 1.00 0.00 O ATOM 0 H SER A 19 -18.909 -17.401 -4.260 1.00 0.00 H new ATOM 0 HA SER A 19 -19.591 -20.220 -4.342 1.00 0.00 H new ATOM 0 HB2 SER A 19 -17.354 -20.269 -5.609 1.00 0.00 H new ATOM 0 HB3 SER A 19 -18.657 -19.359 -6.348 1.00 0.00 H new ATOM 0 HG SER A 19 -16.661 -18.177 -6.326 1.00 0.00 H new ATOM 238 N ILE A 20 -17.382 -21.195 -3.201 1.00 0.00 N ATOM 239 CA ILE A 20 -16.509 -21.775 -2.187 1.00 0.00 C ATOM 240 C ILE A 20 -15.267 -20.916 -1.975 1.00 0.00 C ATOM 241 O ILE A 20 -14.670 -20.927 -0.899 1.00 0.00 O ATOM 242 CB ILE A 20 -16.073 -23.202 -2.569 1.00 0.00 C ATOM 243 CG1 ILE A 20 -17.299 -24.093 -2.781 1.00 0.00 C ATOM 244 CG2 ILE A 20 -15.167 -23.784 -1.494 1.00 0.00 C ATOM 245 CD1 ILE A 20 -16.976 -25.418 -3.436 1.00 0.00 C ATOM 0 H ILE A 20 -17.555 -21.799 -4.004 1.00 0.00 H new ATOM 0 HA ILE A 20 -17.083 -21.815 -1.261 1.00 0.00 H new ATOM 0 HB ILE A 20 -15.513 -23.158 -3.503 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -17.774 -24.279 -1.818 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -18.024 -23.560 -3.396 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -14.867 -24.793 -1.778 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -14.281 -23.158 -1.387 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -15.703 -23.818 -0.546 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -17.891 -25.998 -3.555 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -16.529 -25.241 -4.414 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -16.275 -25.971 -2.811 1.00 0.00 H new ATOM 257 N GLU A 21 -14.886 -20.170 -3.008 1.00 0.00 N ATOM 258 CA GLU A 21 -13.715 -19.304 -2.933 1.00 0.00 C ATOM 259 C GLU A 21 -14.037 -18.020 -2.174 1.00 0.00 C ATOM 260 O GLU A 21 -13.185 -17.471 -1.475 1.00 0.00 O ATOM 261 CB GLU A 21 -13.212 -18.967 -4.338 1.00 0.00 C ATOM 262 CG GLU A 21 -12.035 -19.819 -4.783 1.00 0.00 C ATOM 263 CD GLU A 21 -12.309 -21.305 -4.656 1.00 0.00 C ATOM 264 OE1 GLU A 21 -13.446 -21.726 -4.953 1.00 0.00 O ATOM 265 OE2 GLU A 21 -11.385 -22.046 -4.260 1.00 0.00 O ATOM 0 H GLU A 21 -15.371 -20.148 -3.905 1.00 0.00 H new ATOM 0 HA GLU A 21 -12.933 -19.838 -2.394 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -14.030 -19.093 -5.048 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -12.922 -17.917 -4.369 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -11.794 -19.585 -5.820 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.160 -19.563 -4.186 1.00 0.00 H new ATOM 272 N GLU A 22 -15.271 -17.547 -2.318 1.00 0.00 N ATOM 273 CA GLU A 22 -15.704 -16.327 -1.647 1.00 0.00 C ATOM 274 C GLU A 22 -15.858 -16.556 -0.146 1.00 0.00 C ATOM 275 O GLU A 22 -15.583 -15.667 0.660 1.00 0.00 O ATOM 276 CB GLU A 22 -17.028 -15.836 -2.238 1.00 0.00 C ATOM 277 CG GLU A 22 -16.862 -15.022 -3.510 1.00 0.00 C ATOM 278 CD GLU A 22 -16.332 -13.626 -3.244 1.00 0.00 C ATOM 279 OE1 GLU A 22 -15.152 -13.503 -2.854 1.00 0.00 O ATOM 280 OE2 GLU A 22 -17.099 -12.657 -3.426 1.00 0.00 O ATOM 0 H GLU A 22 -15.988 -17.990 -2.893 1.00 0.00 H new ATOM 0 HA GLU A 22 -14.940 -15.566 -1.804 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.664 -16.696 -2.448 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -17.546 -15.230 -1.494 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -16.182 -15.543 -4.184 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -17.823 -14.951 -4.019 1.00 0.00 H new ATOM 287 N VAL A 23 -16.299 -17.755 0.221 1.00 0.00 N ATOM 288 CA VAL A 23 -16.490 -18.102 1.624 1.00 0.00 C ATOM 289 C VAL A 23 -15.201 -17.913 2.417 1.00 0.00 C ATOM 290 O VAL A 23 -15.214 -17.364 3.519 1.00 0.00 O ATOM 291 CB VAL A 23 -16.967 -19.558 1.782 1.00 0.00 C ATOM 292 CG1 VAL A 23 -17.193 -19.890 3.249 1.00 0.00 C ATOM 293 CG2 VAL A 23 -18.233 -19.795 0.972 1.00 0.00 C ATOM 0 H VAL A 23 -16.531 -18.502 -0.434 1.00 0.00 H new ATOM 0 HA VAL A 23 -17.256 -17.432 2.014 1.00 0.00 H new ATOM 0 HB VAL A 23 -16.190 -20.220 1.400 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -17.530 -20.923 3.341 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -16.261 -19.762 3.799 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -17.951 -19.223 3.660 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -18.556 -20.829 1.095 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -19.019 -19.125 1.321 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -18.032 -19.601 -0.082 1.00 0.00 H new ATOM 303 N SER A 24 -14.090 -18.369 1.848 1.00 0.00 N ATOM 304 CA SER A 24 -12.793 -18.253 2.503 1.00 0.00 C ATOM 305 C SER A 24 -12.525 -16.811 2.926 1.00 0.00 C ATOM 306 O SER A 24 -11.831 -16.559 3.911 1.00 0.00 O ATOM 307 CB SER A 24 -11.681 -18.737 1.570 1.00 0.00 C ATOM 308 OG SER A 24 -12.219 -19.289 0.381 1.00 0.00 O ATOM 0 H SER A 24 -14.062 -18.822 0.935 1.00 0.00 H new ATOM 0 HA SER A 24 -12.807 -18.879 3.395 1.00 0.00 H new ATOM 0 HB2 SER A 24 -11.021 -17.905 1.323 1.00 0.00 H new ATOM 0 HB3 SER A 24 -11.074 -19.485 2.080 1.00 0.00 H new ATOM 0 HG SER A 24 -12.502 -18.566 -0.216 1.00 0.00 H new ATOM 314 N LYS A 25 -13.081 -15.868 2.173 1.00 0.00 N ATOM 315 CA LYS A 25 -12.905 -14.451 2.468 1.00 0.00 C ATOM 316 C LYS A 25 -14.018 -13.942 3.378 1.00 0.00 C ATOM 317 O LYS A 25 -13.825 -12.996 4.142 1.00 0.00 O ATOM 318 CB LYS A 25 -12.880 -13.638 1.172 1.00 0.00 C ATOM 319 CG LYS A 25 -11.748 -14.022 0.235 1.00 0.00 C ATOM 320 CD LYS A 25 -11.465 -12.925 -0.778 1.00 0.00 C ATOM 321 CE LYS A 25 -10.941 -13.496 -2.087 1.00 0.00 C ATOM 322 NZ LYS A 25 -11.977 -13.470 -3.156 1.00 0.00 N ATOM 0 H LYS A 25 -13.657 -16.060 1.354 1.00 0.00 H new ATOM 0 HA LYS A 25 -11.953 -14.329 2.985 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.830 -13.768 0.653 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.793 -12.580 1.418 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.847 -14.224 0.815 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -12.004 -14.944 -0.288 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -12.377 -12.358 -0.966 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.736 -12.228 -0.366 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.071 -12.925 -2.410 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.608 -14.522 -1.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -11.859 -14.298 -3.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.923 -13.493 -2.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -11.874 -12.601 -3.718 1.00 0.00 H new ATOM 336 N SER A 26 -15.183 -14.577 3.292 1.00 0.00 N ATOM 337 CA SER A 26 -16.328 -14.186 4.106 1.00 0.00 C ATOM 338 C SER A 26 -15.954 -14.142 5.585 1.00 0.00 C ATOM 339 O SER A 26 -16.257 -13.176 6.286 1.00 0.00 O ATOM 340 CB SER A 26 -17.489 -15.159 3.891 1.00 0.00 C ATOM 341 OG SER A 26 -17.815 -15.269 2.517 1.00 0.00 O ATOM 0 H SER A 26 -15.359 -15.364 2.667 1.00 0.00 H new ATOM 0 HA SER A 26 -16.638 -13.187 3.798 1.00 0.00 H new ATOM 0 HB2 SER A 26 -17.223 -16.140 4.284 1.00 0.00 H new ATOM 0 HB3 SER A 26 -18.361 -14.818 4.449 1.00 0.00 H new ATOM 0 HG SER A 26 -16.994 -15.381 1.994 1.00 0.00 H new ATOM 347 N LEU A 27 -15.293 -15.196 6.053 1.00 0.00 N ATOM 348 CA LEU A 27 -14.876 -15.279 7.448 1.00 0.00 C ATOM 349 C LEU A 27 -13.764 -14.278 7.745 1.00 0.00 C ATOM 350 O LEU A 27 -13.632 -13.798 8.871 1.00 0.00 O ATOM 351 CB LEU A 27 -14.402 -16.696 7.775 1.00 0.00 C ATOM 352 CG LEU A 27 -15.442 -17.806 7.613 1.00 0.00 C ATOM 353 CD1 LEU A 27 -14.875 -19.140 8.073 1.00 0.00 C ATOM 354 CD2 LEU A 27 -16.709 -17.467 8.385 1.00 0.00 C ATOM 0 H LEU A 27 -15.035 -16.004 5.487 1.00 0.00 H new ATOM 0 HA LEU A 27 -15.735 -15.036 8.073 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.549 -16.929 7.137 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -14.043 -16.709 8.804 1.00 0.00 H new ATOM 0 HG LEU A 27 -15.696 -17.888 6.556 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -15.629 -19.918 7.950 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -13.998 -19.388 7.476 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -14.591 -19.072 9.123 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -17.438 -18.268 8.258 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -16.472 -17.356 9.443 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -17.126 -16.534 8.007 1.00 0.00 H new ATOM 366 N ARG A 28 -12.969 -13.965 6.727 1.00 0.00 N ATOM 367 CA ARG A 28 -11.869 -13.020 6.879 1.00 0.00 C ATOM 368 C ARG A 28 -12.358 -11.712 7.495 1.00 0.00 C ATOM 369 O ARG A 28 -11.613 -11.029 8.198 1.00 0.00 O ATOM 370 CB ARG A 28 -11.215 -12.745 5.524 1.00 0.00 C ATOM 371 CG ARG A 28 -9.708 -12.564 5.601 1.00 0.00 C ATOM 372 CD ARG A 28 -9.006 -13.230 4.427 1.00 0.00 C ATOM 373 NE ARG A 28 -7.895 -12.426 3.927 1.00 0.00 N ATOM 374 CZ ARG A 28 -7.170 -12.755 2.863 1.00 0.00 C ATOM 375 NH1 ARG A 28 -7.440 -13.865 2.191 1.00 0.00 N ATOM 376 NH2 ARG A 28 -6.174 -11.971 2.469 1.00 0.00 N ATOM 0 H ARG A 28 -13.066 -14.352 5.788 1.00 0.00 H new ATOM 0 HA ARG A 28 -11.131 -13.463 7.548 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -11.439 -13.570 4.848 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -11.659 -11.848 5.091 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -9.468 -11.501 5.614 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -9.337 -12.986 6.535 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -8.636 -14.209 4.733 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -9.723 -13.397 3.623 1.00 0.00 H new ATOM 0 HE ARG A 28 -7.662 -11.565 4.421 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -8.206 -14.469 2.490 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -6.882 -14.115 1.375 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -5.965 -11.115 2.983 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -5.618 -12.224 1.652 1.00 0.00 H new ATOM 390 N PHE A 29 -13.614 -11.371 7.227 1.00 0.00 N ATOM 391 CA PHE A 29 -14.201 -10.144 7.754 1.00 0.00 C ATOM 392 C PHE A 29 -14.017 -10.059 9.266 1.00 0.00 C ATOM 393 O PHE A 29 -13.544 -9.049 9.788 1.00 0.00 O ATOM 394 CB PHE A 29 -15.690 -10.076 7.406 1.00 0.00 C ATOM 395 CG PHE A 29 -16.353 -8.806 7.856 1.00 0.00 C ATOM 396 CD1 PHE A 29 -15.938 -7.580 7.363 1.00 0.00 C ATOM 397 CD2 PHE A 29 -17.392 -8.839 8.772 1.00 0.00 C ATOM 398 CE1 PHE A 29 -16.546 -6.410 7.777 1.00 0.00 C ATOM 399 CE2 PHE A 29 -18.005 -7.672 9.189 1.00 0.00 C ATOM 400 CZ PHE A 29 -17.582 -6.456 8.689 1.00 0.00 C ATOM 0 H PHE A 29 -14.245 -11.926 6.649 1.00 0.00 H new ATOM 0 HA PHE A 29 -13.688 -9.299 7.295 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -15.808 -10.175 6.327 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -16.201 -10.924 7.862 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -15.130 -7.538 6.647 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -17.727 -9.788 9.165 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -16.211 -5.460 7.387 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -18.813 -7.711 9.904 1.00 0.00 H new ATOM 0 HZ PHE A 29 -18.061 -5.543 9.011 1.00 0.00 H new ATOM 410 N ILE A 30 -14.394 -11.125 9.963 1.00 0.00 N ATOM 411 CA ILE A 30 -14.270 -11.171 11.415 1.00 0.00 C ATOM 412 C ILE A 30 -12.874 -11.620 11.833 1.00 0.00 C ATOM 413 O ILE A 30 -12.407 -11.294 12.924 1.00 0.00 O ATOM 414 CB ILE A 30 -15.310 -12.120 12.039 1.00 0.00 C ATOM 415 CG1 ILE A 30 -15.175 -13.523 11.444 1.00 0.00 C ATOM 416 CG2 ILE A 30 -16.716 -11.581 11.823 1.00 0.00 C ATOM 417 CD1 ILE A 30 -16.028 -14.560 12.140 1.00 0.00 C ATOM 0 H ILE A 30 -14.788 -11.969 9.546 1.00 0.00 H new ATOM 0 HA ILE A 30 -14.449 -10.159 11.779 1.00 0.00 H new ATOM 0 HB ILE A 30 -15.126 -12.181 13.112 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -15.447 -13.489 10.389 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -14.131 -13.831 11.494 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -17.440 -12.263 12.270 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -16.805 -10.600 12.290 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -16.912 -11.493 10.754 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -15.881 -15.530 11.665 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -15.741 -14.623 13.190 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -17.078 -14.276 12.068 1.00 0.00 H new ATOM 429 N GLY A 31 -12.211 -12.368 10.957 1.00 0.00 N ATOM 430 CA GLY A 31 -10.874 -12.848 11.253 1.00 0.00 C ATOM 431 C GLY A 31 -10.883 -14.116 12.084 1.00 0.00 C ATOM 432 O GLY A 31 -10.785 -14.064 13.310 1.00 0.00 O ATOM 0 H GLY A 31 -12.576 -12.650 10.047 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -10.343 -13.033 10.319 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -10.323 -12.073 11.785 1.00 0.00 H new ATOM 436 N LEU A 32 -11.003 -15.258 11.415 1.00 0.00 N ATOM 437 CA LEU A 32 -11.027 -16.546 12.100 1.00 0.00 C ATOM 438 C LEU A 32 -9.729 -17.311 11.864 1.00 0.00 C ATOM 439 O LEU A 32 -8.833 -16.835 11.167 1.00 0.00 O ATOM 440 CB LEU A 32 -12.217 -17.378 11.621 1.00 0.00 C ATOM 441 CG LEU A 32 -13.601 -16.846 11.993 1.00 0.00 C ATOM 442 CD1 LEU A 32 -14.685 -17.806 11.528 1.00 0.00 C ATOM 443 CD2 LEU A 32 -13.698 -16.617 13.494 1.00 0.00 C ATOM 0 H LEU A 32 -11.085 -15.318 10.400 1.00 0.00 H new ATOM 0 HA LEU A 32 -11.129 -16.360 13.169 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -12.162 -17.463 10.536 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -12.116 -18.385 12.025 1.00 0.00 H new ATOM 0 HG LEU A 32 -13.749 -15.891 11.489 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.663 -17.410 11.802 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -14.630 -17.920 10.445 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -14.540 -18.776 12.003 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.690 -16.238 13.741 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -13.528 -17.558 14.017 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -12.946 -15.890 13.801 1.00 0.00 H new ATOM 455 N SER A 33 -9.635 -18.502 12.449 1.00 0.00 N ATOM 456 CA SER A 33 -8.446 -19.333 12.304 1.00 0.00 C ATOM 457 C SER A 33 -8.389 -19.962 10.915 1.00 0.00 C ATOM 458 O SER A 33 -9.414 -20.349 10.355 1.00 0.00 O ATOM 459 CB SER A 33 -8.430 -20.428 13.373 1.00 0.00 C ATOM 460 OG SER A 33 -8.844 -19.919 14.629 1.00 0.00 O ATOM 0 H SER A 33 -10.368 -18.912 13.027 1.00 0.00 H new ATOM 0 HA SER A 33 -7.570 -18.697 12.432 1.00 0.00 H new ATOM 0 HB2 SER A 33 -9.088 -21.244 13.073 1.00 0.00 H new ATOM 0 HB3 SER A 33 -7.426 -20.843 13.458 1.00 0.00 H new ATOM 0 HG SER A 33 -8.827 -20.638 15.295 1.00 0.00 H new ATOM 466 N GLU A 34 -7.182 -20.060 10.366 1.00 0.00 N ATOM 467 CA GLU A 34 -6.991 -20.642 9.042 1.00 0.00 C ATOM 468 C GLU A 34 -7.633 -22.023 8.957 1.00 0.00 C ATOM 469 O GLU A 34 -8.183 -22.401 7.922 1.00 0.00 O ATOM 470 CB GLU A 34 -5.500 -20.738 8.714 1.00 0.00 C ATOM 471 CG GLU A 34 -4.707 -21.558 9.719 1.00 0.00 C ATOM 472 CD GLU A 34 -3.211 -21.339 9.600 1.00 0.00 C ATOM 473 OE1 GLU A 34 -2.649 -21.659 8.531 1.00 0.00 O ATOM 474 OE2 GLU A 34 -2.603 -20.850 10.574 1.00 0.00 O ATOM 0 H GLU A 34 -6.323 -19.745 10.817 1.00 0.00 H new ATOM 0 HA GLU A 34 -7.474 -19.991 8.313 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.382 -21.179 7.724 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -5.081 -19.733 8.667 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -5.029 -21.300 10.728 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.928 -22.616 9.575 1.00 0.00 H new ATOM 481 N ASP A 35 -7.557 -22.773 10.051 1.00 0.00 N ATOM 482 CA ASP A 35 -8.131 -24.113 10.101 1.00 0.00 C ATOM 483 C ASP A 35 -9.633 -24.071 9.837 1.00 0.00 C ATOM 484 O ASP A 35 -10.150 -24.828 9.015 1.00 0.00 O ATOM 485 CB ASP A 35 -7.857 -24.757 11.461 1.00 0.00 C ATOM 486 CG ASP A 35 -7.611 -26.249 11.356 1.00 0.00 C ATOM 487 OD1 ASP A 35 -8.599 -27.012 11.321 1.00 0.00 O ATOM 488 OD2 ASP A 35 -6.431 -26.654 11.310 1.00 0.00 O ATOM 0 H ASP A 35 -7.104 -22.476 10.915 1.00 0.00 H new ATOM 0 HA ASP A 35 -7.660 -24.713 9.322 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -6.990 -24.280 11.917 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -8.705 -24.577 12.122 1.00 0.00 H new ATOM 493 N VAL A 36 -10.328 -23.182 10.540 1.00 0.00 N ATOM 494 CA VAL A 36 -11.770 -23.042 10.381 1.00 0.00 C ATOM 495 C VAL A 36 -12.136 -22.719 8.937 1.00 0.00 C ATOM 496 O VAL A 36 -12.977 -23.386 8.334 1.00 0.00 O ATOM 497 CB VAL A 36 -12.331 -21.940 11.300 1.00 0.00 C ATOM 498 CG1 VAL A 36 -13.836 -21.807 11.117 1.00 0.00 C ATOM 499 CG2 VAL A 36 -11.986 -22.232 12.752 1.00 0.00 C ATOM 0 H VAL A 36 -9.915 -22.548 11.225 1.00 0.00 H new ATOM 0 HA VAL A 36 -12.213 -23.998 10.659 1.00 0.00 H new ATOM 0 HB VAL A 36 -11.871 -20.991 11.024 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -14.215 -21.024 11.774 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -14.055 -21.549 10.081 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -14.318 -22.753 11.365 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -12.390 -21.444 13.387 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -12.418 -23.190 13.043 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -10.903 -22.272 12.868 1.00 0.00 H new ATOM 509 N ILE A 37 -11.497 -21.691 8.386 1.00 0.00 N ATOM 510 CA ILE A 37 -11.754 -21.281 7.012 1.00 0.00 C ATOM 511 C ILE A 37 -11.589 -22.451 6.048 1.00 0.00 C ATOM 512 O ILE A 37 -12.503 -22.780 5.292 1.00 0.00 O ATOM 513 CB ILE A 37 -10.814 -20.139 6.580 1.00 0.00 C ATOM 514 CG1 ILE A 37 -10.974 -18.938 7.514 1.00 0.00 C ATOM 515 CG2 ILE A 37 -11.094 -19.739 5.140 1.00 0.00 C ATOM 516 CD1 ILE A 37 -9.951 -17.849 7.279 1.00 0.00 C ATOM 0 H ILE A 37 -10.798 -21.128 8.871 1.00 0.00 H new ATOM 0 HA ILE A 37 -12.784 -20.927 6.977 1.00 0.00 H new ATOM 0 HB ILE A 37 -9.784 -20.491 6.644 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -11.973 -18.520 7.388 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -10.899 -19.279 8.547 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -10.422 -18.931 4.850 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -10.934 -20.597 4.487 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -12.127 -19.402 5.050 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -10.125 -17.030 7.976 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -8.950 -18.251 7.434 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -10.040 -17.481 6.257 1.00 0.00 H new ATOM 528 N SER A 38 -10.417 -23.078 6.082 1.00 0.00 N ATOM 529 CA SER A 38 -10.131 -24.211 5.211 1.00 0.00 C ATOM 530 C SER A 38 -11.103 -25.357 5.473 1.00 0.00 C ATOM 531 O SER A 38 -11.388 -26.161 4.585 1.00 0.00 O ATOM 532 CB SER A 38 -8.693 -24.690 5.418 1.00 0.00 C ATOM 533 OG SER A 38 -8.598 -25.551 6.540 1.00 0.00 O ATOM 0 H SER A 38 -9.651 -22.820 6.704 1.00 0.00 H new ATOM 0 HA SER A 38 -10.253 -23.883 4.179 1.00 0.00 H new ATOM 0 HB2 SER A 38 -8.348 -25.212 4.525 1.00 0.00 H new ATOM 0 HB3 SER A 38 -8.037 -23.831 5.558 1.00 0.00 H new ATOM 0 HG SER A 38 -9.135 -25.190 7.276 1.00 0.00 H new ATOM 539 N PHE A 39 -11.610 -25.426 6.700 1.00 0.00 N ATOM 540 CA PHE A 39 -12.550 -26.474 7.081 1.00 0.00 C ATOM 541 C PHE A 39 -13.834 -26.377 6.262 1.00 0.00 C ATOM 542 O PHE A 39 -14.531 -27.371 6.059 1.00 0.00 O ATOM 543 CB PHE A 39 -12.874 -26.379 8.573 1.00 0.00 C ATOM 544 CG PHE A 39 -12.484 -27.603 9.351 1.00 0.00 C ATOM 545 CD1 PHE A 39 -12.943 -28.855 8.974 1.00 0.00 C ATOM 546 CD2 PHE A 39 -11.657 -27.502 10.458 1.00 0.00 C ATOM 547 CE1 PHE A 39 -12.585 -29.983 9.688 1.00 0.00 C ATOM 548 CE2 PHE A 39 -11.296 -28.626 11.176 1.00 0.00 C ATOM 549 CZ PHE A 39 -11.760 -29.869 10.790 1.00 0.00 C ATOM 0 H PHE A 39 -11.386 -24.769 7.447 1.00 0.00 H new ATOM 0 HA PHE A 39 -12.083 -27.438 6.878 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -12.362 -25.513 8.993 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -13.944 -26.207 8.694 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -13.588 -28.950 8.113 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -11.290 -26.533 10.763 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -12.950 -30.953 9.384 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -10.652 -28.533 12.038 1.00 0.00 H new ATOM 0 HZ PHE A 39 -11.478 -30.749 11.349 1.00 0.00 H new ATOM 559 N PHE A 40 -14.141 -25.171 5.796 1.00 0.00 N ATOM 560 CA PHE A 40 -15.342 -24.942 5.001 1.00 0.00 C ATOM 561 C PHE A 40 -15.060 -25.156 3.516 1.00 0.00 C ATOM 562 O PHE A 40 -15.846 -25.787 2.809 1.00 0.00 O ATOM 563 CB PHE A 40 -15.870 -23.525 5.232 1.00 0.00 C ATOM 564 CG PHE A 40 -16.827 -23.422 6.385 1.00 0.00 C ATOM 565 CD1 PHE A 40 -16.541 -24.032 7.596 1.00 0.00 C ATOM 566 CD2 PHE A 40 -18.012 -22.715 6.258 1.00 0.00 C ATOM 567 CE1 PHE A 40 -17.420 -23.939 8.659 1.00 0.00 C ATOM 568 CE2 PHE A 40 -18.893 -22.618 7.318 1.00 0.00 C ATOM 569 CZ PHE A 40 -18.598 -23.232 8.519 1.00 0.00 C ATOM 0 H PHE A 40 -13.575 -24.337 5.955 1.00 0.00 H new ATOM 0 HA PHE A 40 -16.099 -25.660 5.317 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -15.028 -22.856 5.409 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -16.367 -23.179 4.326 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -15.621 -24.586 7.711 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -18.250 -22.235 5.320 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -17.186 -24.419 9.598 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -19.812 -22.062 7.207 1.00 0.00 H new ATOM 0 HZ PHE A 40 -19.287 -23.159 9.347 1.00 0.00 H new ATOM 579 N VAL A 41 -13.934 -24.626 3.051 1.00 0.00 N ATOM 580 CA VAL A 41 -13.547 -24.759 1.652 1.00 0.00 C ATOM 581 C VAL A 41 -13.235 -26.210 1.303 1.00 0.00 C ATOM 582 O VAL A 41 -13.341 -26.620 0.147 1.00 0.00 O ATOM 583 CB VAL A 41 -12.320 -23.888 1.323 1.00 0.00 C ATOM 584 CG1 VAL A 41 -12.005 -23.947 -0.164 1.00 0.00 C ATOM 585 CG2 VAL A 41 -12.551 -22.452 1.771 1.00 0.00 C ATOM 0 H VAL A 41 -13.273 -24.100 3.623 1.00 0.00 H new ATOM 0 HA VAL A 41 -14.394 -24.419 1.056 1.00 0.00 H new ATOM 0 HB VAL A 41 -11.461 -24.281 1.867 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -11.135 -23.325 -0.377 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -11.794 -24.977 -0.451 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -12.860 -23.581 -0.732 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -11.674 -21.850 1.531 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -13.422 -22.046 1.256 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -12.723 -22.430 2.847 1.00 0.00 H new ATOM 595 N THR A 42 -12.848 -26.985 2.312 1.00 0.00 N ATOM 596 CA THR A 42 -12.519 -28.391 2.113 1.00 0.00 C ATOM 597 C THR A 42 -13.774 -29.256 2.124 1.00 0.00 C ATOM 598 O THR A 42 -13.797 -30.339 1.541 1.00 0.00 O ATOM 599 CB THR A 42 -11.549 -28.900 3.196 1.00 0.00 C ATOM 600 OG1 THR A 42 -11.079 -30.209 2.856 1.00 0.00 O ATOM 601 CG2 THR A 42 -12.228 -28.936 4.557 1.00 0.00 C ATOM 0 H THR A 42 -12.755 -26.662 3.275 1.00 0.00 H new ATOM 0 HA THR A 42 -12.036 -28.468 1.139 1.00 0.00 H new ATOM 0 HB THR A 42 -10.704 -28.213 3.248 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.462 -30.525 3.548 1.00 0.00 H new ATOM 0 HG21 THR A 42 -11.524 -29.299 5.306 1.00 0.00 H new ATOM 0 HG22 THR A 42 -12.558 -27.933 4.826 1.00 0.00 H new ATOM 0 HG23 THR A 42 -13.089 -29.603 4.516 1.00 0.00 H new ATOM 609 N GLU A 43 -14.817 -28.770 2.790 1.00 0.00 N ATOM 610 CA GLU A 43 -16.076 -29.500 2.876 1.00 0.00 C ATOM 611 C GLU A 43 -17.054 -29.027 1.804 1.00 0.00 C ATOM 612 O GLU A 43 -18.268 -29.171 1.948 1.00 0.00 O ATOM 613 CB GLU A 43 -16.698 -29.326 4.263 1.00 0.00 C ATOM 614 CG GLU A 43 -16.212 -30.345 5.280 1.00 0.00 C ATOM 615 CD GLU A 43 -16.955 -31.663 5.187 1.00 0.00 C ATOM 616 OE1 GLU A 43 -17.199 -32.127 4.053 1.00 0.00 O ATOM 617 OE2 GLU A 43 -17.293 -32.231 6.247 1.00 0.00 O ATOM 0 H GLU A 43 -14.815 -27.874 3.278 1.00 0.00 H new ATOM 0 HA GLU A 43 -15.866 -30.557 2.710 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -16.474 -28.324 4.629 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -17.782 -29.399 4.178 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -15.147 -30.522 5.131 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -16.330 -29.936 6.283 1.00 0.00 H new ATOM 624 N LYS A 44 -16.516 -28.461 0.729 1.00 0.00 N ATOM 625 CA LYS A 44 -17.339 -27.966 -0.368 1.00 0.00 C ATOM 626 C LYS A 44 -18.370 -26.962 0.135 1.00 0.00 C ATOM 627 O LYS A 44 -19.423 -26.780 -0.477 1.00 0.00 O ATOM 628 CB LYS A 44 -18.044 -29.130 -1.069 1.00 0.00 C ATOM 629 CG LYS A 44 -18.359 -28.859 -2.530 1.00 0.00 C ATOM 630 CD LYS A 44 -19.109 -30.019 -3.163 1.00 0.00 C ATOM 631 CE LYS A 44 -19.174 -29.881 -4.676 1.00 0.00 C ATOM 632 NZ LYS A 44 -18.581 -31.059 -5.366 1.00 0.00 N ATOM 0 H LYS A 44 -15.513 -28.334 0.594 1.00 0.00 H new ATOM 0 HA LYS A 44 -16.686 -27.462 -1.081 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -17.416 -30.019 -1.000 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -18.971 -29.353 -0.541 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -18.956 -27.951 -2.612 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -17.432 -28.682 -3.076 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -18.618 -30.957 -2.903 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -20.120 -30.065 -2.757 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -20.212 -29.763 -4.986 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -18.646 -28.978 -4.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -18.645 -30.927 -6.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -17.583 -31.157 -5.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -19.101 -31.918 -5.095 1.00 0.00 H new ATOM 646 N ILE A 45 -18.061 -26.312 1.252 1.00 0.00 N ATOM 647 CA ILE A 45 -18.961 -25.325 1.835 1.00 0.00 C ATOM 648 C ILE A 45 -18.920 -24.015 1.055 1.00 0.00 C ATOM 649 O ILE A 45 -17.858 -23.418 0.880 1.00 0.00 O ATOM 650 CB ILE A 45 -18.609 -25.043 3.308 1.00 0.00 C ATOM 651 CG1 ILE A 45 -18.444 -26.356 4.076 1.00 0.00 C ATOM 652 CG2 ILE A 45 -19.682 -24.177 3.952 1.00 0.00 C ATOM 653 CD1 ILE A 45 -19.701 -27.198 4.111 1.00 0.00 C ATOM 0 H ILE A 45 -17.194 -26.451 1.771 1.00 0.00 H new ATOM 0 HA ILE A 45 -19.966 -25.745 1.784 1.00 0.00 H new ATOM 0 HB ILE A 45 -17.663 -24.502 3.344 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -17.641 -26.935 3.621 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -18.137 -26.134 5.098 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -19.420 -23.986 4.993 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -19.755 -23.230 3.417 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -20.641 -24.693 3.909 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -19.510 -28.113 4.672 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -20.501 -26.637 4.593 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -19.998 -27.451 3.093 1.00 0.00 H new ATOM 665 N ASP A 46 -20.083 -23.574 0.589 1.00 0.00 N ATOM 666 CA ASP A 46 -20.182 -22.333 -0.171 1.00 0.00 C ATOM 667 C ASP A 46 -21.121 -21.348 0.518 1.00 0.00 C ATOM 668 O ASP A 46 -21.547 -21.569 1.650 1.00 0.00 O ATOM 669 CB ASP A 46 -20.672 -22.618 -1.591 1.00 0.00 C ATOM 670 CG ASP A 46 -22.086 -23.165 -1.617 1.00 0.00 C ATOM 671 OD1 ASP A 46 -22.268 -24.354 -1.278 1.00 0.00 O ATOM 672 OD2 ASP A 46 -23.009 -22.405 -1.975 1.00 0.00 O ATOM 0 H ASP A 46 -20.971 -24.057 0.724 1.00 0.00 H new ATOM 0 HA ASP A 46 -19.189 -21.885 -0.221 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -20.630 -21.700 -2.178 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -20.000 -23.332 -2.067 1.00 0.00 H new ATOM 677 N GLY A 47 -21.439 -20.259 -0.176 1.00 0.00 N ATOM 678 CA GLY A 47 -22.325 -19.255 0.385 1.00 0.00 C ATOM 679 C GLY A 47 -23.689 -19.816 0.736 1.00 0.00 C ATOM 680 O GLY A 47 -24.136 -19.711 1.877 1.00 0.00 O ATOM 0 H GLY A 47 -21.099 -20.054 -1.116 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -21.869 -18.831 1.280 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -22.444 -18.440 -0.329 1.00 0.00 H new ATOM 684 N ASN A 48 -24.353 -20.414 -0.249 1.00 0.00 N ATOM 685 CA ASN A 48 -25.675 -20.992 -0.038 1.00 0.00 C ATOM 686 C ASN A 48 -25.642 -22.034 1.075 1.00 0.00 C ATOM 687 O ASN A 48 -26.641 -22.258 1.761 1.00 0.00 O ATOM 688 CB ASN A 48 -26.188 -21.627 -1.332 1.00 0.00 C ATOM 689 CG ASN A 48 -27.687 -21.857 -1.308 1.00 0.00 C ATOM 690 OD1 ASN A 48 -28.462 -21.022 -1.775 1.00 0.00 O ATOM 691 ND2 ASN A 48 -28.102 -22.994 -0.762 1.00 0.00 N ATOM 0 H ASN A 48 -23.997 -20.511 -1.200 1.00 0.00 H new ATOM 0 HA ASN A 48 -26.352 -20.191 0.259 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -25.935 -20.983 -2.175 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -25.680 -22.578 -1.493 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -29.099 -23.204 -0.717 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -27.424 -23.657 -0.387 1.00 0.00 H new ATOM 698 N LEU A 49 -24.488 -22.668 1.251 1.00 0.00 N ATOM 699 CA LEU A 49 -24.324 -23.687 2.282 1.00 0.00 C ATOM 700 C LEU A 49 -24.168 -23.049 3.658 1.00 0.00 C ATOM 701 O LEU A 49 -24.739 -23.521 4.642 1.00 0.00 O ATOM 702 CB LEU A 49 -23.109 -24.563 1.972 1.00 0.00 C ATOM 703 CG LEU A 49 -23.152 -25.989 2.521 1.00 0.00 C ATOM 704 CD1 LEU A 49 -23.218 -25.975 4.040 1.00 0.00 C ATOM 705 CD2 LEU A 49 -24.336 -26.748 1.941 1.00 0.00 C ATOM 0 H LEU A 49 -23.652 -22.494 0.693 1.00 0.00 H new ATOM 0 HA LEU A 49 -25.219 -24.308 2.290 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -22.991 -24.615 0.890 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -22.221 -24.070 2.366 1.00 0.00 H new ATOM 0 HG LEU A 49 -22.237 -26.500 2.223 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -23.248 -26.999 4.412 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -22.338 -25.470 4.438 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -24.116 -25.446 4.360 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -24.351 -27.761 2.343 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -25.261 -26.238 2.208 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -24.245 -26.789 0.856 1.00 0.00 H new ATOM 717 N LEU A 50 -23.392 -21.972 3.720 1.00 0.00 N ATOM 718 CA LEU A 50 -23.162 -21.266 4.976 1.00 0.00 C ATOM 719 C LEU A 50 -24.466 -20.701 5.530 1.00 0.00 C ATOM 720 O LEU A 50 -24.788 -20.887 6.703 1.00 0.00 O ATOM 721 CB LEU A 50 -22.150 -20.138 4.772 1.00 0.00 C ATOM 722 CG LEU A 50 -22.039 -19.122 5.909 1.00 0.00 C ATOM 723 CD1 LEU A 50 -21.804 -19.829 7.235 1.00 0.00 C ATOM 724 CD2 LEU A 50 -20.922 -18.126 5.628 1.00 0.00 C ATOM 0 H LEU A 50 -22.912 -21.569 2.916 1.00 0.00 H new ATOM 0 HA LEU A 50 -22.761 -21.979 5.697 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -21.168 -20.583 4.612 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.411 -19.604 3.858 1.00 0.00 H new ATOM 0 HG LEU A 50 -22.979 -18.574 5.974 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.728 -19.090 8.033 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -22.637 -20.501 7.442 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -20.879 -20.403 7.182 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -20.858 -17.411 6.448 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -19.975 -18.658 5.535 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -21.133 -17.596 4.699 1.00 0.00 H new ATOM 736 N VAL A 51 -25.216 -20.010 4.676 1.00 0.00 N ATOM 737 CA VAL A 51 -26.487 -19.420 5.078 1.00 0.00 C ATOM 738 C VAL A 51 -27.475 -20.493 5.521 1.00 0.00 C ATOM 739 O VAL A 51 -28.384 -20.226 6.306 1.00 0.00 O ATOM 740 CB VAL A 51 -27.113 -18.601 3.933 1.00 0.00 C ATOM 741 CG1 VAL A 51 -26.230 -17.415 3.580 1.00 0.00 C ATOM 742 CG2 VAL A 51 -27.348 -19.483 2.716 1.00 0.00 C ATOM 0 H VAL A 51 -24.965 -19.845 3.701 1.00 0.00 H new ATOM 0 HA VAL A 51 -26.277 -18.756 5.916 1.00 0.00 H new ATOM 0 HB VAL A 51 -28.077 -18.218 4.268 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -26.688 -16.849 2.769 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -26.117 -16.773 4.453 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -25.250 -17.772 3.264 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -27.791 -18.889 1.916 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -26.398 -19.897 2.378 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -28.024 -20.296 2.981 1.00 0.00 H new ATOM 752 N GLN A 52 -27.290 -21.707 5.012 1.00 0.00 N ATOM 753 CA GLN A 52 -28.166 -22.820 5.355 1.00 0.00 C ATOM 754 C GLN A 52 -27.758 -23.444 6.686 1.00 0.00 C ATOM 755 O GLN A 52 -28.601 -23.938 7.436 1.00 0.00 O ATOM 756 CB GLN A 52 -28.136 -23.879 4.251 1.00 0.00 C ATOM 757 CG GLN A 52 -29.197 -23.675 3.182 1.00 0.00 C ATOM 758 CD GLN A 52 -29.324 -24.864 2.251 1.00 0.00 C ATOM 759 OE1 GLN A 52 -30.383 -25.487 2.162 1.00 0.00 O ATOM 760 NE2 GLN A 52 -28.243 -25.186 1.551 1.00 0.00 N ATOM 0 H GLN A 52 -26.541 -21.944 4.361 1.00 0.00 H new ATOM 0 HA GLN A 52 -29.181 -22.434 5.451 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -27.153 -23.873 3.781 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -28.269 -24.863 4.700 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -30.158 -23.489 3.661 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -28.954 -22.787 2.599 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -27.387 -24.642 1.656 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -28.269 -25.977 0.908 1.00 0.00 H new ATOM 769 N LEU A 53 -26.461 -23.418 6.972 1.00 0.00 N ATOM 770 CA LEU A 53 -25.941 -23.981 8.213 1.00 0.00 C ATOM 771 C LEU A 53 -26.618 -23.348 9.425 1.00 0.00 C ATOM 772 O LEU A 53 -26.995 -22.176 9.397 1.00 0.00 O ATOM 773 CB LEU A 53 -24.427 -23.775 8.295 1.00 0.00 C ATOM 774 CG LEU A 53 -23.573 -24.738 7.469 1.00 0.00 C ATOM 775 CD1 LEU A 53 -22.144 -24.230 7.367 1.00 0.00 C ATOM 776 CD2 LEU A 53 -23.604 -26.133 8.077 1.00 0.00 C ATOM 0 H LEU A 53 -25.751 -23.013 6.362 1.00 0.00 H new ATOM 0 HA LEU A 53 -26.157 -25.049 8.216 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -24.201 -22.757 7.977 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -24.125 -23.858 9.339 1.00 0.00 H new ATOM 0 HG LEU A 53 -23.990 -24.793 6.463 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -21.551 -24.928 6.776 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -22.139 -23.252 6.886 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -21.716 -24.146 8.366 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -22.991 -26.805 7.477 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -23.212 -26.096 9.094 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -24.631 -26.499 8.097 1.00 0.00 H new ATOM 788 N THR A 54 -26.767 -24.130 10.489 1.00 0.00 N ATOM 789 CA THR A 54 -27.397 -23.646 11.711 1.00 0.00 C ATOM 790 C THR A 54 -26.509 -23.898 12.924 1.00 0.00 C ATOM 791 O THR A 54 -25.619 -24.746 12.888 1.00 0.00 O ATOM 792 CB THR A 54 -28.764 -24.317 11.942 1.00 0.00 C ATOM 793 OG1 THR A 54 -28.592 -25.724 12.145 1.00 0.00 O ATOM 794 CG2 THR A 54 -29.690 -24.079 10.758 1.00 0.00 C ATOM 0 H THR A 54 -26.460 -25.102 10.529 1.00 0.00 H new ATOM 0 HA THR A 54 -27.543 -22.573 11.588 1.00 0.00 H new ATOM 0 HB THR A 54 -29.215 -23.876 12.831 1.00 0.00 H new ATOM 0 HG1 THR A 54 -29.466 -26.142 12.293 1.00 0.00 H new ATOM 0 HG21 THR A 54 -30.649 -24.562 10.944 1.00 0.00 H new ATOM 0 HG22 THR A 54 -29.843 -23.008 10.625 1.00 0.00 H new ATOM 0 HG23 THR A 54 -29.242 -24.496 9.856 1.00 0.00 H new ATOM 802 N GLU A 55 -26.758 -23.155 13.999 1.00 0.00 N ATOM 803 CA GLU A 55 -25.980 -23.299 15.223 1.00 0.00 C ATOM 804 C GLU A 55 -25.963 -24.752 15.689 1.00 0.00 C ATOM 805 O GLU A 55 -24.997 -25.206 16.303 1.00 0.00 O ATOM 806 CB GLU A 55 -26.551 -22.405 16.325 1.00 0.00 C ATOM 807 CG GLU A 55 -25.508 -21.920 17.318 1.00 0.00 C ATOM 808 CD GLU A 55 -25.993 -20.747 18.147 1.00 0.00 C ATOM 809 OE1 GLU A 55 -27.222 -20.611 18.323 1.00 0.00 O ATOM 810 OE2 GLU A 55 -25.143 -19.964 18.622 1.00 0.00 O ATOM 0 H GLU A 55 -27.492 -22.448 14.046 1.00 0.00 H new ATOM 0 HA GLU A 55 -24.956 -22.992 15.010 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -27.033 -21.541 15.867 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -27.324 -22.954 16.862 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -25.234 -22.740 17.981 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -24.606 -21.631 16.779 1.00 0.00 H new ATOM 817 N GLU A 56 -27.038 -25.475 15.394 1.00 0.00 N ATOM 818 CA GLU A 56 -27.147 -26.876 15.784 1.00 0.00 C ATOM 819 C GLU A 56 -26.243 -27.752 14.923 1.00 0.00 C ATOM 820 O GLU A 56 -25.586 -28.665 15.424 1.00 0.00 O ATOM 821 CB GLU A 56 -28.597 -27.350 15.666 1.00 0.00 C ATOM 822 CG GLU A 56 -29.488 -26.873 16.801 1.00 0.00 C ATOM 823 CD GLU A 56 -30.864 -27.509 16.769 1.00 0.00 C ATOM 824 OE1 GLU A 56 -31.552 -27.384 15.735 1.00 0.00 O ATOM 825 OE2 GLU A 56 -31.252 -28.132 17.780 1.00 0.00 O ATOM 0 H GLU A 56 -27.846 -25.114 14.886 1.00 0.00 H new ATOM 0 HA GLU A 56 -26.827 -26.963 16.822 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -29.009 -26.999 14.720 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -28.613 -28.439 15.636 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -29.009 -27.100 17.754 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -29.591 -25.789 16.746 1.00 0.00 H new ATOM 832 N ILE A 57 -26.215 -27.468 13.625 1.00 0.00 N ATOM 833 CA ILE A 57 -25.391 -28.230 12.694 1.00 0.00 C ATOM 834 C ILE A 57 -23.915 -27.879 12.853 1.00 0.00 C ATOM 835 O ILE A 57 -23.038 -28.697 12.572 1.00 0.00 O ATOM 836 CB ILE A 57 -25.813 -27.979 11.234 1.00 0.00 C ATOM 837 CG1 ILE A 57 -27.283 -28.351 11.035 1.00 0.00 C ATOM 838 CG2 ILE A 57 -24.927 -28.771 10.284 1.00 0.00 C ATOM 839 CD1 ILE A 57 -27.859 -27.856 9.727 1.00 0.00 C ATOM 0 H ILE A 57 -26.753 -26.716 13.194 1.00 0.00 H new ATOM 0 HA ILE A 57 -25.539 -29.284 12.930 1.00 0.00 H new ATOM 0 HB ILE A 57 -25.693 -26.918 11.013 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -27.384 -29.435 11.080 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -27.868 -27.941 11.859 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -25.237 -28.584 9.256 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -23.889 -28.463 10.412 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -25.019 -29.835 10.503 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -28.904 -28.156 9.653 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -27.790 -26.769 9.687 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -27.299 -28.286 8.897 1.00 0.00 H new ATOM 851 N LEU A 58 -23.648 -26.659 13.306 1.00 0.00 N ATOM 852 CA LEU A 58 -22.278 -26.200 13.504 1.00 0.00 C ATOM 853 C LEU A 58 -21.636 -26.900 14.698 1.00 0.00 C ATOM 854 O LEU A 58 -20.415 -27.041 14.765 1.00 0.00 O ATOM 855 CB LEU A 58 -22.252 -24.685 13.713 1.00 0.00 C ATOM 856 CG LEU A 58 -22.547 -23.832 12.478 1.00 0.00 C ATOM 857 CD1 LEU A 58 -23.019 -22.445 12.888 1.00 0.00 C ATOM 858 CD2 LEU A 58 -21.316 -23.738 11.589 1.00 0.00 C ATOM 0 H LEU A 58 -24.362 -25.970 13.543 1.00 0.00 H new ATOM 0 HA LEU A 58 -21.706 -26.448 12.610 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -22.978 -24.432 14.486 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -21.270 -24.408 14.095 1.00 0.00 H new ATOM 0 HG LEU A 58 -23.344 -24.311 11.910 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -23.224 -21.852 11.997 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -23.928 -22.531 13.483 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -22.244 -21.956 13.478 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -21.544 -23.128 10.715 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -20.498 -23.282 12.147 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -21.023 -24.737 11.267 1.00 0.00 H new ATOM 870 N SER A 59 -22.468 -27.339 15.637 1.00 0.00 N ATOM 871 CA SER A 59 -21.981 -28.023 16.830 1.00 0.00 C ATOM 872 C SER A 59 -22.170 -29.532 16.705 1.00 0.00 C ATOM 873 O SER A 59 -21.438 -30.311 17.314 1.00 0.00 O ATOM 874 CB SER A 59 -22.710 -27.508 18.072 1.00 0.00 C ATOM 875 OG SER A 59 -21.953 -27.751 19.245 1.00 0.00 O ATOM 0 H SER A 59 -23.482 -27.234 15.595 1.00 0.00 H new ATOM 0 HA SER A 59 -20.916 -27.814 16.930 1.00 0.00 H new ATOM 0 HB2 SER A 59 -22.897 -26.439 17.971 1.00 0.00 H new ATOM 0 HB3 SER A 59 -23.682 -27.995 18.155 1.00 0.00 H new ATOM 0 HG SER A 59 -22.440 -27.411 20.025 1.00 0.00 H new ATOM 881 N GLU A 60 -23.157 -29.935 15.910 1.00 0.00 N ATOM 882 CA GLU A 60 -23.442 -31.350 15.706 1.00 0.00 C ATOM 883 C GLU A 60 -22.459 -31.966 14.715 1.00 0.00 C ATOM 884 O GLU A 60 -21.711 -32.883 15.054 1.00 0.00 O ATOM 885 CB GLU A 60 -24.875 -31.537 15.202 1.00 0.00 C ATOM 886 CG GLU A 60 -25.913 -31.552 16.312 1.00 0.00 C ATOM 887 CD GLU A 60 -26.472 -32.937 16.569 1.00 0.00 C ATOM 888 OE1 GLU A 60 -27.041 -33.531 15.629 1.00 0.00 O ATOM 889 OE2 GLU A 60 -26.341 -33.428 17.710 1.00 0.00 O ATOM 0 H GLU A 60 -23.771 -29.302 15.398 1.00 0.00 H new ATOM 0 HA GLU A 60 -23.332 -31.858 16.664 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -25.113 -30.735 14.504 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -24.937 -32.472 14.646 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -25.465 -31.169 17.229 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -26.729 -30.878 16.051 1.00 0.00 H new ATOM 896 N ASP A 61 -22.467 -31.456 13.488 1.00 0.00 N ATOM 897 CA ASP A 61 -21.576 -31.954 12.447 1.00 0.00 C ATOM 898 C ASP A 61 -20.183 -31.347 12.587 1.00 0.00 C ATOM 899 O ASP A 61 -19.221 -32.044 12.910 1.00 0.00 O ATOM 900 CB ASP A 61 -22.147 -31.638 11.064 1.00 0.00 C ATOM 901 CG ASP A 61 -22.697 -32.869 10.370 1.00 0.00 C ATOM 902 OD1 ASP A 61 -22.112 -33.959 10.541 1.00 0.00 O ATOM 903 OD2 ASP A 61 -23.714 -32.742 9.657 1.00 0.00 O ATOM 0 H ASP A 61 -23.081 -30.698 13.190 1.00 0.00 H new ATOM 0 HA ASP A 61 -21.494 -33.035 12.560 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -22.939 -30.895 11.162 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -21.368 -31.193 10.445 1.00 0.00 H new ATOM 908 N PHE A 62 -20.083 -30.045 12.341 1.00 0.00 N ATOM 909 CA PHE A 62 -18.808 -29.345 12.437 1.00 0.00 C ATOM 910 C PHE A 62 -18.181 -29.543 13.815 1.00 0.00 C ATOM 911 O PHE A 62 -16.984 -29.805 13.933 1.00 0.00 O ATOM 912 CB PHE A 62 -19.000 -27.852 12.162 1.00 0.00 C ATOM 913 CG PHE A 62 -18.963 -27.502 10.702 1.00 0.00 C ATOM 914 CD1 PHE A 62 -17.781 -27.596 9.984 1.00 0.00 C ATOM 915 CD2 PHE A 62 -20.109 -27.080 10.048 1.00 0.00 C ATOM 916 CE1 PHE A 62 -17.744 -27.273 8.640 1.00 0.00 C ATOM 917 CE2 PHE A 62 -20.078 -26.757 8.704 1.00 0.00 C ATOM 918 CZ PHE A 62 -18.894 -26.855 7.999 1.00 0.00 C ATOM 0 H PHE A 62 -20.870 -29.454 12.074 1.00 0.00 H new ATOM 0 HA PHE A 62 -18.135 -29.762 11.688 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -19.955 -27.534 12.580 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -18.222 -27.292 12.682 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -16.880 -27.925 10.480 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -21.037 -27.002 10.594 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -16.816 -27.347 8.092 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -20.978 -26.429 8.206 1.00 0.00 H new ATOM 0 HZ PHE A 62 -18.868 -26.605 6.949 1.00 0.00 H new ATOM 928 N LYS A 63 -18.999 -29.415 14.854 1.00 0.00 N ATOM 929 CA LYS A 63 -18.528 -29.580 16.224 1.00 0.00 C ATOM 930 C LYS A 63 -17.420 -28.581 16.542 1.00 0.00 C ATOM 931 O LYS A 63 -16.542 -28.852 17.362 1.00 0.00 O ATOM 932 CB LYS A 63 -18.020 -31.007 16.442 1.00 0.00 C ATOM 933 CG LYS A 63 -19.006 -32.077 16.004 1.00 0.00 C ATOM 934 CD LYS A 63 -19.453 -32.936 17.175 1.00 0.00 C ATOM 935 CE LYS A 63 -19.623 -34.391 16.767 1.00 0.00 C ATOM 936 NZ LYS A 63 -18.430 -35.209 17.120 1.00 0.00 N ATOM 0 H LYS A 63 -19.992 -29.197 14.773 1.00 0.00 H new ATOM 0 HA LYS A 63 -19.366 -29.393 16.895 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -17.087 -31.139 15.895 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -17.792 -31.145 17.499 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -19.875 -31.606 15.544 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -18.546 -32.708 15.244 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -18.721 -32.866 17.979 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -20.396 -32.555 17.568 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -20.505 -34.805 17.256 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -19.798 -34.449 15.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -18.585 -36.194 16.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -17.593 -34.830 16.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -18.278 -35.175 18.148 1.00 0.00 H new ATOM 950 N LEU A 64 -17.468 -27.424 15.891 1.00 0.00 N ATOM 951 CA LEU A 64 -16.469 -26.383 16.107 1.00 0.00 C ATOM 952 C LEU A 64 -16.497 -25.892 17.551 1.00 0.00 C ATOM 953 O LEU A 64 -17.324 -26.330 18.350 1.00 0.00 O ATOM 954 CB LEU A 64 -16.712 -25.211 15.153 1.00 0.00 C ATOM 955 CG LEU A 64 -16.430 -25.480 13.675 1.00 0.00 C ATOM 956 CD1 LEU A 64 -17.463 -24.787 12.800 1.00 0.00 C ATOM 957 CD2 LEU A 64 -15.026 -25.023 13.308 1.00 0.00 C ATOM 0 H LEU A 64 -18.188 -27.183 15.210 1.00 0.00 H new ATOM 0 HA LEU A 64 -15.486 -26.810 15.907 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -17.751 -24.897 15.253 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -16.093 -24.373 15.474 1.00 0.00 H new ATOM 0 HG LEU A 64 -16.498 -26.554 13.502 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -17.246 -24.990 11.751 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -18.457 -25.162 13.044 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -17.427 -23.712 12.977 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -14.843 -25.222 12.252 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -14.930 -23.954 13.497 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -14.298 -25.565 13.911 1.00 0.00 H new ATOM 969 N SER A 65 -15.587 -24.979 17.877 1.00 0.00 N ATOM 970 CA SER A 65 -15.506 -24.430 19.226 1.00 0.00 C ATOM 971 C SER A 65 -16.761 -23.630 19.563 1.00 0.00 C ATOM 972 O SER A 65 -17.388 -23.037 18.686 1.00 0.00 O ATOM 973 CB SER A 65 -14.268 -23.541 19.363 1.00 0.00 C ATOM 974 OG SER A 65 -13.084 -24.318 19.402 1.00 0.00 O ATOM 0 H SER A 65 -14.896 -24.604 17.226 1.00 0.00 H new ATOM 0 HA SER A 65 -15.427 -25.261 19.927 1.00 0.00 H new ATOM 0 HB2 SER A 65 -14.222 -22.844 18.526 1.00 0.00 H new ATOM 0 HB3 SER A 65 -14.344 -22.943 20.271 1.00 0.00 H new ATOM 0 HG SER A 65 -12.307 -23.727 19.488 1.00 0.00 H new ATOM 980 N LYS A 66 -17.121 -23.618 20.842 1.00 0.00 N ATOM 981 CA LYS A 66 -18.299 -22.891 21.299 1.00 0.00 C ATOM 982 C LYS A 66 -18.256 -21.439 20.836 1.00 0.00 C ATOM 983 O LYS A 66 -19.293 -20.831 20.566 1.00 0.00 O ATOM 984 CB LYS A 66 -18.399 -22.949 22.825 1.00 0.00 C ATOM 985 CG LYS A 66 -17.264 -22.233 23.536 1.00 0.00 C ATOM 986 CD LYS A 66 -16.972 -22.859 24.890 1.00 0.00 C ATOM 987 CE LYS A 66 -17.156 -21.857 26.019 1.00 0.00 C ATOM 988 NZ LYS A 66 -16.194 -20.725 25.919 1.00 0.00 N ATOM 0 H LYS A 66 -16.613 -24.104 21.581 1.00 0.00 H new ATOM 0 HA LYS A 66 -19.179 -23.366 20.865 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -19.346 -22.509 23.136 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -18.414 -23.992 23.140 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -16.367 -22.267 22.917 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -17.521 -21.182 23.668 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -17.632 -23.712 25.048 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -15.951 -23.240 24.903 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -18.175 -21.470 25.999 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -17.025 -22.361 26.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -16.096 -20.269 26.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -15.268 -21.083 25.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -16.545 -20.031 25.229 1.00 0.00 H new ATOM 1002 N LEU A 67 -17.050 -20.887 20.746 1.00 0.00 N ATOM 1003 CA LEU A 67 -16.872 -19.506 20.313 1.00 0.00 C ATOM 1004 C LEU A 67 -17.057 -19.378 18.805 1.00 0.00 C ATOM 1005 O LEU A 67 -17.636 -18.406 18.322 1.00 0.00 O ATOM 1006 CB LEU A 67 -15.484 -19.001 20.712 1.00 0.00 C ATOM 1007 CG LEU A 67 -15.452 -17.810 21.671 1.00 0.00 C ATOM 1008 CD1 LEU A 67 -15.953 -16.553 20.977 1.00 0.00 C ATOM 1009 CD2 LEU A 67 -16.281 -18.103 22.913 1.00 0.00 C ATOM 0 H LEU A 67 -16.182 -21.375 20.967 1.00 0.00 H new ATOM 0 HA LEU A 67 -17.630 -18.897 20.806 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -14.938 -19.825 21.170 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -14.945 -18.726 19.805 1.00 0.00 H new ATOM 0 HG LEU A 67 -14.420 -17.643 21.979 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -15.923 -15.716 21.674 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -15.318 -16.333 20.119 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -16.978 -16.708 20.639 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -16.247 -17.245 23.584 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -17.314 -18.296 22.624 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -15.877 -18.978 23.422 1.00 0.00 H new ATOM 1021 N GLN A 68 -16.564 -20.368 18.068 1.00 0.00 N ATOM 1022 CA GLN A 68 -16.677 -20.367 16.614 1.00 0.00 C ATOM 1023 C GLN A 68 -18.134 -20.499 16.181 1.00 0.00 C ATOM 1024 O GLN A 68 -18.627 -19.708 15.377 1.00 0.00 O ATOM 1025 CB GLN A 68 -15.850 -21.506 16.016 1.00 0.00 C ATOM 1026 CG GLN A 68 -14.386 -21.151 15.808 1.00 0.00 C ATOM 1027 CD GLN A 68 -13.464 -22.338 16.003 1.00 0.00 C ATOM 1028 OE1 GLN A 68 -13.918 -23.463 16.216 1.00 0.00 O ATOM 1029 NE2 GLN A 68 -12.161 -22.094 15.932 1.00 0.00 N ATOM 0 H GLN A 68 -16.083 -21.181 18.453 1.00 0.00 H new ATOM 0 HA GLN A 68 -16.292 -19.416 16.246 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -15.915 -22.374 16.672 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -16.284 -21.796 15.059 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -14.252 -20.753 14.802 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -14.106 -20.360 16.504 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -11.829 -21.146 15.754 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -11.492 -22.854 16.056 1.00 0.00 H new ATOM 1038 N VAL A 69 -18.817 -21.504 16.720 1.00 0.00 N ATOM 1039 CA VAL A 69 -20.217 -21.740 16.390 1.00 0.00 C ATOM 1040 C VAL A 69 -21.068 -20.513 16.698 1.00 0.00 C ATOM 1041 O VAL A 69 -22.090 -20.275 16.053 1.00 0.00 O ATOM 1042 CB VAL A 69 -20.780 -22.948 17.162 1.00 0.00 C ATOM 1043 CG1 VAL A 69 -22.213 -23.232 16.738 1.00 0.00 C ATOM 1044 CG2 VAL A 69 -19.901 -24.172 16.950 1.00 0.00 C ATOM 0 H VAL A 69 -18.423 -22.168 17.387 1.00 0.00 H new ATOM 0 HA VAL A 69 -20.259 -21.950 15.321 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.781 -22.709 18.225 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -22.594 -24.089 17.294 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -22.833 -22.360 16.945 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -22.240 -23.451 15.671 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -20.313 -25.016 17.503 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -19.866 -24.415 15.888 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -18.893 -23.962 17.307 1.00 0.00 H new ATOM 1054 N LYS A 70 -20.641 -19.736 17.687 1.00 0.00 N ATOM 1055 CA LYS A 70 -21.361 -18.532 18.081 1.00 0.00 C ATOM 1056 C LYS A 70 -20.981 -17.354 17.189 1.00 0.00 C ATOM 1057 O LYS A 70 -21.762 -16.419 17.011 1.00 0.00 O ATOM 1058 CB LYS A 70 -21.068 -18.193 19.544 1.00 0.00 C ATOM 1059 CG LYS A 70 -22.192 -17.435 20.230 1.00 0.00 C ATOM 1060 CD LYS A 70 -21.700 -16.128 20.828 1.00 0.00 C ATOM 1061 CE LYS A 70 -22.818 -15.387 21.546 1.00 0.00 C ATOM 1062 NZ LYS A 70 -22.292 -14.478 22.601 1.00 0.00 N ATOM 0 H LYS A 70 -19.798 -19.919 18.231 1.00 0.00 H new ATOM 0 HA LYS A 70 -22.428 -18.723 17.966 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -20.877 -19.116 20.091 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -20.156 -17.598 19.595 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -22.986 -17.231 19.512 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -22.624 -18.055 21.015 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -20.888 -16.329 21.527 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -21.292 -15.497 20.039 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -23.394 -14.809 20.823 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -23.501 -16.108 21.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -23.084 -13.992 23.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -21.764 -15.032 23.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -21.660 -13.774 22.169 1.00 0.00 H new ATOM 1076 N LYS A 71 -19.777 -17.406 16.630 1.00 0.00 N ATOM 1077 CA LYS A 71 -19.293 -16.346 15.754 1.00 0.00 C ATOM 1078 C LYS A 71 -19.858 -16.503 14.346 1.00 0.00 C ATOM 1079 O LYS A 71 -20.402 -15.556 13.776 1.00 0.00 O ATOM 1080 CB LYS A 71 -17.763 -16.355 15.704 1.00 0.00 C ATOM 1081 CG LYS A 71 -17.147 -14.967 15.679 1.00 0.00 C ATOM 1082 CD LYS A 71 -15.818 -14.933 16.414 1.00 0.00 C ATOM 1083 CE LYS A 71 -16.015 -14.756 17.912 1.00 0.00 C ATOM 1084 NZ LYS A 71 -15.071 -13.755 18.481 1.00 0.00 N ATOM 0 H LYS A 71 -19.118 -18.172 16.768 1.00 0.00 H new ATOM 0 HA LYS A 71 -19.632 -15.392 16.159 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -17.383 -16.897 16.570 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -17.440 -16.903 14.819 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -17.001 -14.652 14.646 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -17.834 -14.255 16.135 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -15.272 -15.857 16.224 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -15.208 -14.117 16.027 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -17.040 -14.442 18.109 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -15.874 -15.714 18.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -15.237 -13.663 19.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -14.093 -14.067 18.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -15.223 -12.834 18.022 1.00 0.00 H new ATOM 1098 N ILE A 72 -19.728 -17.703 13.791 1.00 0.00 N ATOM 1099 CA ILE A 72 -20.228 -17.983 12.451 1.00 0.00 C ATOM 1100 C ILE A 72 -21.714 -17.656 12.340 1.00 0.00 C ATOM 1101 O ILE A 72 -22.148 -17.011 11.386 1.00 0.00 O ATOM 1102 CB ILE A 72 -20.008 -19.458 12.065 1.00 0.00 C ATOM 1103 CG1 ILE A 72 -18.522 -19.811 12.141 1.00 0.00 C ATOM 1104 CG2 ILE A 72 -20.551 -19.726 10.669 1.00 0.00 C ATOM 1105 CD1 ILE A 72 -18.252 -21.299 12.122 1.00 0.00 C ATOM 0 H ILE A 72 -19.281 -18.497 14.249 1.00 0.00 H new ATOM 0 HA ILE A 72 -19.666 -17.349 11.765 1.00 0.00 H new ATOM 0 HB ILE A 72 -20.548 -20.088 12.771 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -18.003 -19.345 11.303 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -18.102 -19.385 13.052 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -20.388 -20.772 10.410 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -21.619 -19.508 10.646 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -20.035 -19.090 9.950 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -17.178 -21.475 12.179 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -18.742 -21.769 12.975 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -18.641 -21.728 11.199 1.00 0.00 H new ATOM 1117 N MET A 73 -22.488 -18.105 13.322 1.00 0.00 N ATOM 1118 CA MET A 73 -23.925 -17.857 13.336 1.00 0.00 C ATOM 1119 C MET A 73 -24.220 -16.362 13.266 1.00 0.00 C ATOM 1120 O MET A 73 -25.136 -15.934 12.564 1.00 0.00 O ATOM 1121 CB MET A 73 -24.555 -18.455 14.596 1.00 0.00 C ATOM 1122 CG MET A 73 -25.360 -19.717 14.332 1.00 0.00 C ATOM 1123 SD MET A 73 -27.078 -19.370 13.910 1.00 0.00 S ATOM 1124 CE MET A 73 -26.957 -19.175 12.134 1.00 0.00 C ATOM 0 H MET A 73 -22.145 -18.642 14.118 1.00 0.00 H new ATOM 0 HA MET A 73 -24.360 -18.336 12.459 1.00 0.00 H new ATOM 0 HB2 MET A 73 -23.767 -18.680 15.315 1.00 0.00 H new ATOM 0 HB3 MET A 73 -25.203 -17.710 15.057 1.00 0.00 H new ATOM 0 HG2 MET A 73 -24.896 -20.276 13.519 1.00 0.00 H new ATOM 0 HG3 MET A 73 -25.329 -20.355 15.215 1.00 0.00 H new ATOM 0 HE1 MET A 73 -27.951 -19.240 11.692 1.00 0.00 H new ATOM 0 HE2 MET A 73 -26.520 -18.203 11.904 1.00 0.00 H new ATOM 0 HE3 MET A 73 -26.326 -19.963 11.724 1.00 0.00 H new ATOM 1134 N GLN A 74 -23.438 -15.574 13.998 1.00 0.00 N ATOM 1135 CA GLN A 74 -23.618 -14.128 14.018 1.00 0.00 C ATOM 1136 C GLN A 74 -23.290 -13.519 12.659 1.00 0.00 C ATOM 1137 O GLN A 74 -23.824 -12.473 12.290 1.00 0.00 O ATOM 1138 CB GLN A 74 -22.735 -13.499 15.098 1.00 0.00 C ATOM 1139 CG GLN A 74 -23.522 -12.866 16.234 1.00 0.00 C ATOM 1140 CD GLN A 74 -22.929 -11.548 16.692 1.00 0.00 C ATOM 1141 OE1 GLN A 74 -23.060 -10.527 16.017 1.00 0.00 O ATOM 1142 NE2 GLN A 74 -22.271 -11.563 17.846 1.00 0.00 N ATOM 0 H GLN A 74 -22.675 -15.913 14.584 1.00 0.00 H new ATOM 0 HA GLN A 74 -24.664 -13.920 14.245 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -22.074 -14.264 15.507 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -22.100 -12.741 14.640 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -24.551 -12.705 15.912 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -23.556 -13.557 17.076 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -22.186 -12.432 18.374 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -21.850 -10.706 18.204 1.00 0.00 H new ATOM 1151 N PHE A 75 -22.408 -14.181 11.917 1.00 0.00 N ATOM 1152 CA PHE A 75 -22.007 -13.704 10.599 1.00 0.00 C ATOM 1153 C PHE A 75 -23.120 -13.928 9.578 1.00 0.00 C ATOM 1154 O PHE A 75 -23.252 -13.175 8.613 1.00 0.00 O ATOM 1155 CB PHE A 75 -20.731 -14.413 10.142 1.00 0.00 C ATOM 1156 CG PHE A 75 -20.271 -13.998 8.774 1.00 0.00 C ATOM 1157 CD1 PHE A 75 -19.699 -12.753 8.569 1.00 0.00 C ATOM 1158 CD2 PHE A 75 -20.411 -14.853 7.693 1.00 0.00 C ATOM 1159 CE1 PHE A 75 -19.274 -12.368 7.311 1.00 0.00 C ATOM 1160 CE2 PHE A 75 -19.987 -14.474 6.433 1.00 0.00 C ATOM 1161 CZ PHE A 75 -19.419 -13.230 6.242 1.00 0.00 C ATOM 0 H PHE A 75 -21.958 -15.049 12.206 1.00 0.00 H new ATOM 0 HA PHE A 75 -21.813 -12.634 10.671 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -19.936 -14.212 10.860 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -20.901 -15.490 10.148 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -19.584 -12.075 9.402 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -20.856 -15.826 7.836 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -18.829 -11.395 7.165 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -20.100 -15.150 5.599 1.00 0.00 H new ATOM 0 HZ PHE A 75 -19.089 -12.932 5.258 1.00 0.00 H new ATOM 1171 N ILE A 76 -23.916 -14.969 9.799 1.00 0.00 N ATOM 1172 CA ILE A 76 -25.016 -15.293 8.900 1.00 0.00 C ATOM 1173 C ILE A 76 -26.201 -14.358 9.123 1.00 0.00 C ATOM 1174 O ILE A 76 -26.576 -13.593 8.236 1.00 0.00 O ATOM 1175 CB ILE A 76 -25.484 -16.749 9.084 1.00 0.00 C ATOM 1176 CG1 ILE A 76 -24.323 -17.715 8.837 1.00 0.00 C ATOM 1177 CG2 ILE A 76 -26.643 -17.055 8.147 1.00 0.00 C ATOM 1178 CD1 ILE A 76 -24.672 -19.161 9.111 1.00 0.00 C ATOM 0 H ILE A 76 -23.819 -15.602 10.593 1.00 0.00 H new ATOM 0 HA ILE A 76 -24.641 -15.166 7.884 1.00 0.00 H new ATOM 0 HB ILE A 76 -25.828 -16.878 10.110 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -23.995 -17.619 7.802 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -23.481 -17.427 9.467 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -26.963 -18.087 8.289 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -27.474 -16.385 8.365 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -26.324 -16.913 7.115 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -23.803 -19.789 8.915 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -24.972 -19.272 10.153 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -25.493 -19.466 8.463 1.00 0.00 H new ATOM 1190 N ASN A 77 -26.785 -14.426 10.315 1.00 0.00 N ATOM 1191 CA ASN A 77 -27.926 -13.585 10.656 1.00 0.00 C ATOM 1192 C ASN A 77 -27.542 -12.108 10.627 1.00 0.00 C ATOM 1193 O ASN A 77 -28.386 -11.241 10.406 1.00 0.00 O ATOM 1194 CB ASN A 77 -28.465 -13.956 12.039 1.00 0.00 C ATOM 1195 CG ASN A 77 -29.027 -15.364 12.082 1.00 0.00 C ATOM 1196 OD1 ASN A 77 -29.572 -15.857 11.094 1.00 0.00 O ATOM 1197 ND2 ASN A 77 -28.895 -16.019 13.230 1.00 0.00 N ATOM 0 H ASN A 77 -26.487 -15.055 11.061 1.00 0.00 H new ATOM 0 HA ASN A 77 -28.705 -13.754 9.912 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -27.665 -13.864 12.774 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -29.243 -13.248 12.324 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -29.253 -16.970 13.318 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -28.436 -15.571 14.023 1.00 0.00 H new