USER MOD reduce.3.24.130724 H: found=0, std=0, add=541, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 539 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 224 ASN : amide:sc= -2.99! C(o=-3.7!,f=-3.3!) USER MOD Set 1.2: A 232 THR OG1 : rot 180:sc= -0.718 USER MOD Set 2.1: A 182 HIS : no HD1:sc= 0 X(o=0,f=-0.00089) USER MOD Set 2.2: A 186 MET CE :methyl 171:sc= 0 (180deg=0) USER MOD Single : A 180 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 GLN : amide:sc= -0.201 X(o=-0.2,f=-0.16) USER MOD Single : A 189 SER OG : rot -52:sc= 0.599 USER MOD Single : A 193 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 194 HIS : no HE2:sc= -1.67! C(o=-1.7!,f=-6!) USER MOD Single : A 195 GLN : amide:sc= -0.07 X(o=-0.07,f=-0.07) USER MOD Single : A 196 TYR OH : rot 180:sc= 0 USER MOD Single : A 197 TYR OH : rot 180:sc= -0.705 USER MOD Single : A 198 ASN : amide:sc= -4.59! C(o=-4.6!,f=-19!) USER MOD Single : A 200 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 206 THR OG1 : rot 41:sc= 0.281 USER MOD Single : A 207 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 208 GLN : amide:sc= -3.06 K(o=-3.1,f=-6.8!) USER MOD Single : A 212 TYR OH : rot 50:sc= -3.12! USER MOD Single : A 214 LYS NZ :NH3+ -136:sc= -2.52 (180deg=-5.09!) USER MOD Single : A 218 LYS NZ :NH3+ 152:sc= -0.291 (180deg=-0.941) USER MOD Single : A 223 GLN : amide:sc= -12.2! C(o=-12!,f=-2.1!) USER MOD Single : A 226 LYS NZ :NH3+ 149:sc= -1.88 (180deg=-2.88!) USER MOD Single : A 229 HIS : no HD1:sc= -2.51! C(o=-2.5!,f=-1.9!) USER MOD Single : A 230 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 231 ASN : amide:sc= -0.0272 X(o=-0.027,f=-0.027) USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 239 TYR OH : rot -23:sc= -1.15 USER MOD ----------------------------------------------------------------- ATOM 69 N ASP A 179 5.385 -7.008 -7.475 1.00 0.00 N ATOM 70 CA ASP A 179 4.855 -5.636 -7.581 1.00 0.00 C ATOM 71 C ASP A 179 3.943 -5.361 -6.384 1.00 0.00 C ATOM 72 O ASP A 179 4.105 -4.391 -5.687 1.00 0.00 O ATOM 73 CB ASP A 179 4.073 -5.520 -8.901 1.00 0.00 C ATOM 74 CG ASP A 179 5.048 -5.309 -10.067 1.00 0.00 C ATOM 75 OD1 ASP A 179 6.240 -5.235 -9.818 1.00 0.00 O ATOM 76 OD2 ASP A 179 4.581 -5.226 -11.192 1.00 0.00 O ATOM 0 HA ASP A 179 5.663 -4.904 -7.577 1.00 0.00 H new ATOM 0 HB2 ASP A 179 3.485 -6.423 -9.066 1.00 0.00 H new ATOM 0 HB3 ASP A 179 3.371 -4.688 -8.847 1.00 0.00 H new ATOM 81 N LYS A 180 3.000 -6.211 -6.113 1.00 0.00 N ATOM 82 CA LYS A 180 2.125 -5.958 -4.931 1.00 0.00 C ATOM 83 C LYS A 180 2.980 -5.857 -3.672 1.00 0.00 C ATOM 84 O LYS A 180 2.964 -4.866 -2.979 1.00 0.00 O ATOM 85 CB LYS A 180 1.128 -7.111 -4.766 1.00 0.00 C ATOM 86 CG LYS A 180 0.339 -6.940 -3.457 1.00 0.00 C ATOM 87 CD LYS A 180 -0.862 -7.896 -3.446 1.00 0.00 C ATOM 88 CE LYS A 180 -1.662 -7.708 -2.150 1.00 0.00 C ATOM 89 NZ LYS A 180 -2.697 -8.778 -2.033 1.00 0.00 N ATOM 0 H LYS A 180 2.795 -7.057 -6.645 1.00 0.00 H new ATOM 0 HA LYS A 180 1.583 -5.025 -5.085 1.00 0.00 H new ATOM 0 HB2 LYS A 180 0.443 -7.134 -5.613 1.00 0.00 H new ATOM 0 HB3 LYS A 180 1.658 -8.063 -4.759 1.00 0.00 H new ATOM 0 HG2 LYS A 180 0.985 -7.143 -2.603 1.00 0.00 H new ATOM 0 HG3 LYS A 180 -0.003 -5.910 -3.360 1.00 0.00 H new ATOM 0 HD2 LYS A 180 -1.499 -7.704 -4.309 1.00 0.00 H new ATOM 0 HD3 LYS A 180 -0.519 -8.927 -3.526 1.00 0.00 H new ATOM 0 HE2 LYS A 180 -0.992 -7.742 -1.291 1.00 0.00 H new ATOM 0 HE3 LYS A 180 -2.138 -6.727 -2.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 180 -3.236 -8.645 -1.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 180 -3.344 -8.726 -2.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 180 -2.234 -9.709 -2.018 1.00 0.00 H new ATOM 103 N GLN A 181 3.725 -6.880 -3.372 1.00 0.00 N ATOM 104 CA GLN A 181 4.565 -6.856 -2.143 1.00 0.00 C ATOM 105 C GLN A 181 5.555 -5.688 -2.206 1.00 0.00 C ATOM 106 O GLN A 181 5.759 -4.980 -1.238 1.00 0.00 O ATOM 107 CB GLN A 181 5.319 -8.186 -2.033 1.00 0.00 C ATOM 108 CG GLN A 181 6.085 -8.253 -0.709 1.00 0.00 C ATOM 109 CD GLN A 181 5.111 -8.247 0.475 1.00 0.00 C ATOM 110 OE1 GLN A 181 4.540 -9.265 0.811 1.00 0.00 O ATOM 111 NE2 GLN A 181 4.897 -7.134 1.124 1.00 0.00 N ATOM 0 H GLN A 181 3.790 -7.735 -3.925 1.00 0.00 H new ATOM 0 HA GLN A 181 3.932 -6.722 -1.266 1.00 0.00 H new ATOM 0 HB2 GLN A 181 4.616 -9.017 -2.097 1.00 0.00 H new ATOM 0 HB3 GLN A 181 6.012 -8.289 -2.868 1.00 0.00 H new ATOM 0 HG2 GLN A 181 6.696 -9.155 -0.681 1.00 0.00 H new ATOM 0 HG3 GLN A 181 6.765 -7.405 -0.632 1.00 0.00 H new ATOM 0 HE21 GLN A 181 5.376 -6.279 0.842 1.00 0.00 H new ATOM 0 HE22 GLN A 181 4.251 -7.120 1.913 1.00 0.00 H new ATOM 120 N HIS A 182 6.158 -5.476 -3.343 1.00 0.00 N ATOM 121 CA HIS A 182 7.129 -4.352 -3.497 1.00 0.00 C ATOM 122 C HIS A 182 6.398 -3.028 -3.339 1.00 0.00 C ATOM 123 O HIS A 182 6.892 -2.085 -2.751 1.00 0.00 O ATOM 124 CB HIS A 182 7.736 -4.419 -4.901 1.00 0.00 C ATOM 125 CG HIS A 182 8.722 -3.300 -5.092 1.00 0.00 C ATOM 126 ND1 HIS A 182 8.548 -2.298 -6.037 1.00 0.00 N ATOM 127 CD2 HIS A 182 9.904 -3.025 -4.469 1.00 0.00 C ATOM 128 CE1 HIS A 182 9.610 -1.475 -5.950 1.00 0.00 C ATOM 129 NE2 HIS A 182 10.468 -1.874 -5.007 1.00 0.00 N ATOM 0 H HIS A 182 6.019 -6.039 -4.182 1.00 0.00 H new ATOM 0 HA HIS A 182 7.911 -4.431 -2.741 1.00 0.00 H new ATOM 0 HB2 HIS A 182 8.231 -5.379 -5.046 1.00 0.00 H new ATOM 0 HB3 HIS A 182 6.947 -4.351 -5.650 1.00 0.00 H new ATOM 0 HD2 HIS A 182 10.338 -3.615 -3.675 1.00 0.00 H new ATOM 0 HE1 HIS A 182 9.751 -0.600 -6.567 1.00 0.00 H new ATOM 0 HE2 HIS A 182 11.347 -1.430 -4.740 1.00 0.00 H new ATOM 137 N VAL A 183 5.227 -2.943 -3.877 1.00 0.00 N ATOM 138 CA VAL A 183 4.465 -1.681 -3.779 1.00 0.00 C ATOM 139 C VAL A 183 3.961 -1.481 -2.353 1.00 0.00 C ATOM 140 O VAL A 183 3.888 -0.369 -1.871 1.00 0.00 O ATOM 141 CB VAL A 183 3.319 -1.723 -4.778 1.00 0.00 C ATOM 142 CG1 VAL A 183 2.416 -0.507 -4.570 1.00 0.00 C ATOM 143 CG2 VAL A 183 3.919 -1.695 -6.194 1.00 0.00 C ATOM 0 H VAL A 183 4.761 -3.696 -4.383 1.00 0.00 H new ATOM 0 HA VAL A 183 5.107 -0.833 -4.018 1.00 0.00 H new ATOM 0 HB VAL A 183 2.725 -2.627 -4.641 1.00 0.00 H new ATOM 0 HG11 VAL A 183 1.595 -0.537 -5.286 1.00 0.00 H new ATOM 0 HG12 VAL A 183 2.015 -0.521 -3.557 1.00 0.00 H new ATOM 0 HG13 VAL A 183 2.994 0.405 -4.719 1.00 0.00 H new ATOM 0 HG21 VAL A 183 3.116 -1.724 -6.930 1.00 0.00 H new ATOM 0 HG22 VAL A 183 4.499 -0.781 -6.326 1.00 0.00 H new ATOM 0 HG23 VAL A 183 4.569 -2.560 -6.331 1.00 0.00 H new ATOM 153 N LEU A 184 3.640 -2.534 -1.648 1.00 0.00 N ATOM 154 CA LEU A 184 3.185 -2.332 -0.249 1.00 0.00 C ATOM 155 C LEU A 184 4.323 -1.649 0.507 1.00 0.00 C ATOM 156 O LEU A 184 4.105 -0.772 1.314 1.00 0.00 O ATOM 157 CB LEU A 184 2.854 -3.674 0.416 1.00 0.00 C ATOM 158 CG LEU A 184 1.552 -4.260 -0.158 1.00 0.00 C ATOM 159 CD1 LEU A 184 1.351 -5.662 0.418 1.00 0.00 C ATOM 160 CD2 LEU A 184 0.350 -3.367 0.210 1.00 0.00 C ATOM 0 H LEU A 184 3.673 -3.500 -1.973 1.00 0.00 H new ATOM 0 HA LEU A 184 2.281 -1.722 -0.234 1.00 0.00 H new ATOM 0 HB2 LEU A 184 3.674 -4.375 0.259 1.00 0.00 H new ATOM 0 HB3 LEU A 184 2.753 -3.537 1.493 1.00 0.00 H new ATOM 0 HG LEU A 184 1.623 -4.307 -1.245 1.00 0.00 H new ATOM 0 HD11 LEU A 184 0.431 -6.090 0.020 1.00 0.00 H new ATOM 0 HD12 LEU A 184 2.195 -6.294 0.141 1.00 0.00 H new ATOM 0 HD13 LEU A 184 1.283 -5.603 1.504 1.00 0.00 H new ATOM 0 HD21 LEU A 184 -0.562 -3.796 -0.204 1.00 0.00 H new ATOM 0 HD22 LEU A 184 0.262 -3.304 1.295 1.00 0.00 H new ATOM 0 HD23 LEU A 184 0.500 -2.368 -0.200 1.00 0.00 H new ATOM 172 N ASP A 185 5.542 -2.034 0.228 1.00 0.00 N ATOM 173 CA ASP A 185 6.698 -1.393 0.914 1.00 0.00 C ATOM 174 C ASP A 185 6.636 0.115 0.664 1.00 0.00 C ATOM 175 O ASP A 185 6.899 0.914 1.539 1.00 0.00 O ATOM 176 CB ASP A 185 8.006 -1.951 0.348 1.00 0.00 C ATOM 177 CG ASP A 185 8.185 -3.406 0.788 1.00 0.00 C ATOM 178 OD1 ASP A 185 7.594 -3.783 1.787 1.00 0.00 O ATOM 179 OD2 ASP A 185 8.907 -4.121 0.117 1.00 0.00 O ATOM 0 H ASP A 185 5.784 -2.763 -0.444 1.00 0.00 H new ATOM 0 HA ASP A 185 6.657 -1.598 1.984 1.00 0.00 H new ATOM 0 HB2 ASP A 185 7.997 -1.889 -0.740 1.00 0.00 H new ATOM 0 HB3 ASP A 185 8.848 -1.351 0.694 1.00 0.00 H new ATOM 184 N MET A 186 6.281 0.505 -0.531 1.00 0.00 N ATOM 185 CA MET A 186 6.186 1.957 -0.850 1.00 0.00 C ATOM 186 C MET A 186 5.070 2.593 -0.016 1.00 0.00 C ATOM 187 O MET A 186 5.154 3.738 0.377 1.00 0.00 O ATOM 188 CB MET A 186 5.853 2.124 -2.335 1.00 0.00 C ATOM 189 CG MET A 186 6.953 1.493 -3.185 1.00 0.00 C ATOM 190 SD MET A 186 8.406 2.573 -3.177 1.00 0.00 S ATOM 191 CE MET A 186 9.320 1.738 -4.497 1.00 0.00 C ATOM 0 H MET A 186 6.052 -0.123 -1.302 1.00 0.00 H new ATOM 0 HA MET A 186 7.136 2.442 -0.623 1.00 0.00 H new ATOM 0 HB2 MET A 186 4.895 1.655 -2.557 1.00 0.00 H new ATOM 0 HB3 MET A 186 5.754 3.182 -2.578 1.00 0.00 H new ATOM 0 HG2 MET A 186 7.214 0.510 -2.792 1.00 0.00 H new ATOM 0 HG3 MET A 186 6.601 1.345 -4.206 1.00 0.00 H new ATOM 0 HE1 MET A 186 10.189 2.336 -4.772 1.00 0.00 H new ATOM 0 HE2 MET A 186 9.648 0.759 -4.149 1.00 0.00 H new ATOM 0 HE3 MET A 186 8.674 1.616 -5.366 1.00 0.00 H new ATOM 201 N LEU A 187 4.017 1.863 0.243 1.00 0.00 N ATOM 202 CA LEU A 187 2.894 2.437 1.041 1.00 0.00 C ATOM 203 C LEU A 187 3.373 2.719 2.462 1.00 0.00 C ATOM 204 O LEU A 187 3.093 3.759 3.023 1.00 0.00 O ATOM 205 CB LEU A 187 1.727 1.442 1.086 1.00 0.00 C ATOM 206 CG LEU A 187 1.189 1.156 -0.322 1.00 0.00 C ATOM 207 CD1 LEU A 187 -0.034 0.246 -0.190 1.00 0.00 C ATOM 208 CD2 LEU A 187 0.777 2.463 -1.016 1.00 0.00 C ATOM 0 H LEU A 187 3.886 0.898 -0.062 1.00 0.00 H new ATOM 0 HA LEU A 187 2.560 3.364 0.575 1.00 0.00 H new ATOM 0 HB2 LEU A 187 2.056 0.512 1.549 1.00 0.00 H new ATOM 0 HB3 LEU A 187 0.928 1.843 1.709 1.00 0.00 H new ATOM 0 HG LEU A 187 1.965 0.677 -0.920 1.00 0.00 H new ATOM 0 HD11 LEU A 187 -0.434 0.029 -1.180 1.00 0.00 H new ATOM 0 HD12 LEU A 187 0.256 -0.685 0.296 1.00 0.00 H new ATOM 0 HD13 LEU A 187 -0.796 0.745 0.408 1.00 0.00 H new ATOM 0 HD21 LEU A 187 0.398 2.241 -2.014 1.00 0.00 H new ATOM 0 HD22 LEU A 187 -0.002 2.955 -0.433 1.00 0.00 H new ATOM 0 HD23 LEU A 187 1.642 3.122 -1.095 1.00 0.00 H new ATOM 220 N PHE A 188 4.105 1.818 3.048 1.00 0.00 N ATOM 221 CA PHE A 188 4.592 2.077 4.426 1.00 0.00 C ATOM 222 C PHE A 188 5.398 3.368 4.429 1.00 0.00 C ATOM 223 O PHE A 188 5.256 4.186 5.311 1.00 0.00 O ATOM 224 CB PHE A 188 5.466 0.915 4.913 1.00 0.00 C ATOM 225 CG PHE A 188 4.586 -0.251 5.296 1.00 0.00 C ATOM 226 CD1 PHE A 188 3.958 -0.263 6.546 1.00 0.00 C ATOM 227 CD2 PHE A 188 4.395 -1.316 4.410 1.00 0.00 C ATOM 228 CE1 PHE A 188 3.140 -1.336 6.908 1.00 0.00 C ATOM 229 CE2 PHE A 188 3.577 -2.389 4.774 1.00 0.00 C ATOM 230 CZ PHE A 188 2.949 -2.400 6.023 1.00 0.00 C ATOM 0 H PHE A 188 4.384 0.926 2.640 1.00 0.00 H new ATOM 0 HA PHE A 188 3.739 2.170 5.099 1.00 0.00 H new ATOM 0 HB2 PHE A 188 6.163 0.617 4.129 1.00 0.00 H new ATOM 0 HB3 PHE A 188 6.064 1.229 5.768 1.00 0.00 H new ATOM 0 HD1 PHE A 188 4.106 0.558 7.232 1.00 0.00 H new ATOM 0 HD2 PHE A 188 4.879 -1.309 3.445 1.00 0.00 H new ATOM 0 HE1 PHE A 188 2.655 -1.343 7.873 1.00 0.00 H new ATOM 0 HE2 PHE A 188 3.430 -3.211 4.089 1.00 0.00 H new ATOM 0 HZ PHE A 188 2.317 -3.230 6.303 1.00 0.00 H new ATOM 240 N SER A 189 6.239 3.567 3.450 1.00 0.00 N ATOM 241 CA SER A 189 7.039 4.824 3.422 1.00 0.00 C ATOM 242 C SER A 189 6.081 6.013 3.332 1.00 0.00 C ATOM 243 O SER A 189 6.215 7.000 4.037 1.00 0.00 O ATOM 244 CB SER A 189 7.970 4.819 2.205 1.00 0.00 C ATOM 245 OG SER A 189 7.194 4.877 1.012 1.00 0.00 O ATOM 0 H SER A 189 6.405 2.922 2.677 1.00 0.00 H new ATOM 0 HA SER A 189 7.642 4.899 4.327 1.00 0.00 H new ATOM 0 HB2 SER A 189 8.650 5.670 2.251 1.00 0.00 H new ATOM 0 HB3 SER A 189 8.585 3.919 2.208 1.00 0.00 H new ATOM 0 HG SER A 189 6.518 4.168 1.027 1.00 0.00 H new ATOM 251 N ALA A 190 5.098 5.908 2.481 1.00 0.00 N ATOM 252 CA ALA A 190 4.101 7.001 2.338 1.00 0.00 C ATOM 253 C ALA A 190 3.326 7.127 3.647 1.00 0.00 C ATOM 254 O ALA A 190 3.182 8.199 4.202 1.00 0.00 O ATOM 255 CB ALA A 190 3.143 6.653 1.199 1.00 0.00 C ATOM 0 H ALA A 190 4.943 5.103 1.874 1.00 0.00 H new ATOM 0 HA ALA A 190 4.598 7.945 2.114 1.00 0.00 H new ATOM 0 HB1 ALA A 190 2.407 7.449 1.086 1.00 0.00 H new ATOM 0 HB2 ALA A 190 3.705 6.544 0.271 1.00 0.00 H new ATOM 0 HB3 ALA A 190 2.633 5.717 1.426 1.00 0.00 H new ATOM 261 N PHE A 191 2.842 6.024 4.150 1.00 0.00 N ATOM 262 CA PHE A 191 2.092 6.059 5.433 1.00 0.00 C ATOM 263 C PHE A 191 3.050 6.390 6.583 1.00 0.00 C ATOM 264 O PHE A 191 2.627 6.769 7.657 1.00 0.00 O ATOM 265 CB PHE A 191 1.393 4.709 5.670 1.00 0.00 C ATOM 266 CG PHE A 191 0.111 4.667 4.864 1.00 0.00 C ATOM 267 CD1 PHE A 191 -0.969 5.456 5.263 1.00 0.00 C ATOM 268 CD2 PHE A 191 0.010 3.865 3.727 1.00 0.00 C ATOM 269 CE1 PHE A 191 -2.157 5.445 4.526 1.00 0.00 C ATOM 270 CE2 PHE A 191 -1.179 3.849 2.980 1.00 0.00 C ATOM 271 CZ PHE A 191 -2.265 4.641 3.381 1.00 0.00 C ATOM 0 H PHE A 191 2.935 5.101 3.726 1.00 0.00 H new ATOM 0 HA PHE A 191 1.328 6.835 5.386 1.00 0.00 H new ATOM 0 HB2 PHE A 191 2.049 3.889 5.377 1.00 0.00 H new ATOM 0 HB3 PHE A 191 1.175 4.579 6.730 1.00 0.00 H new ATOM 0 HD1 PHE A 191 -0.887 6.076 6.143 1.00 0.00 H new ATOM 0 HD2 PHE A 191 0.847 3.256 3.421 1.00 0.00 H new ATOM 0 HE1 PHE A 191 -2.992 6.055 4.838 1.00 0.00 H new ATOM 0 HE2 PHE A 191 -1.257 3.229 2.099 1.00 0.00 H new ATOM 0 HZ PHE A 191 -3.182 4.632 2.810 1.00 0.00 H new ATOM 281 N GLU A 192 4.337 6.272 6.370 1.00 0.00 N ATOM 282 CA GLU A 192 5.299 6.609 7.464 1.00 0.00 C ATOM 283 C GLU A 192 5.226 8.113 7.712 1.00 0.00 C ATOM 284 O GLU A 192 5.420 8.582 8.815 1.00 0.00 O ATOM 285 CB GLU A 192 6.734 6.233 7.061 1.00 0.00 C ATOM 286 CG GLU A 192 7.660 6.379 8.273 1.00 0.00 C ATOM 287 CD GLU A 192 9.110 6.137 7.848 1.00 0.00 C ATOM 288 OE1 GLU A 192 9.333 5.909 6.670 1.00 0.00 O ATOM 289 OE2 GLU A 192 9.972 6.180 8.710 1.00 0.00 O ATOM 0 H GLU A 192 4.760 5.960 5.496 1.00 0.00 H new ATOM 0 HA GLU A 192 5.037 6.051 8.363 1.00 0.00 H new ATOM 0 HB2 GLU A 192 6.762 5.209 6.690 1.00 0.00 H new ATOM 0 HB3 GLU A 192 7.075 6.876 6.250 1.00 0.00 H new ATOM 0 HG2 GLU A 192 7.558 7.376 8.702 1.00 0.00 H new ATOM 0 HG3 GLU A 192 7.375 5.668 9.048 1.00 0.00 H new ATOM 296 N LYS A 193 4.941 8.876 6.690 1.00 0.00 N ATOM 297 CA LYS A 193 4.853 10.352 6.870 1.00 0.00 C ATOM 298 C LYS A 193 3.484 10.729 7.452 1.00 0.00 C ATOM 299 O LYS A 193 3.396 11.494 8.394 1.00 0.00 O ATOM 300 CB LYS A 193 5.036 11.028 5.512 1.00 0.00 C ATOM 301 CG LYS A 193 6.465 10.799 5.017 1.00 0.00 C ATOM 302 CD LYS A 193 6.637 11.429 3.634 1.00 0.00 C ATOM 303 CE LYS A 193 8.099 11.321 3.202 1.00 0.00 C ATOM 304 NZ LYS A 193 8.258 11.953 1.864 1.00 0.00 N ATOM 0 H LYS A 193 4.766 8.541 5.742 1.00 0.00 H new ATOM 0 HA LYS A 193 5.631 10.682 7.558 1.00 0.00 H new ATOM 0 HB2 LYS A 193 4.322 10.625 4.794 1.00 0.00 H new ATOM 0 HB3 LYS A 193 4.835 12.096 5.595 1.00 0.00 H new ATOM 0 HG2 LYS A 193 7.177 11.235 5.717 1.00 0.00 H new ATOM 0 HG3 LYS A 193 6.677 9.731 4.970 1.00 0.00 H new ATOM 0 HD2 LYS A 193 5.995 10.925 2.911 1.00 0.00 H new ATOM 0 HD3 LYS A 193 6.330 12.475 3.658 1.00 0.00 H new ATOM 0 HE2 LYS A 193 8.744 11.814 3.930 1.00 0.00 H new ATOM 0 HE3 LYS A 193 8.403 10.275 3.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 193 9.251 11.883 1.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 193 7.652 11.464 1.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 193 7.982 12.954 1.918 1.00 0.00 H new ATOM 318 N HIS A 194 2.414 10.196 6.908 1.00 0.00 N ATOM 319 CA HIS A 194 1.050 10.529 7.439 1.00 0.00 C ATOM 320 C HIS A 194 0.140 9.295 7.422 1.00 0.00 C ATOM 321 O HIS A 194 0.221 8.447 6.563 1.00 0.00 O ATOM 322 CB HIS A 194 0.413 11.609 6.563 1.00 0.00 C ATOM 323 CG HIS A 194 1.001 12.954 6.873 1.00 0.00 C ATOM 324 ND1 HIS A 194 1.730 13.218 8.024 1.00 0.00 N ATOM 325 CD2 HIS A 194 0.966 14.125 6.174 1.00 0.00 C ATOM 326 CE1 HIS A 194 2.104 14.513 7.976 1.00 0.00 C ATOM 327 NE2 HIS A 194 1.663 15.112 6.867 1.00 0.00 N ATOM 0 H HIS A 194 2.425 9.547 6.122 1.00 0.00 H new ATOM 0 HA HIS A 194 1.161 10.880 8.465 1.00 0.00 H new ATOM 0 HB2 HIS A 194 0.570 11.371 5.511 1.00 0.00 H new ATOM 0 HB3 HIS A 194 -0.664 11.630 6.728 1.00 0.00 H new ATOM 0 HD1 HIS A 194 1.944 12.555 8.769 1.00 0.00 H new ATOM 0 HD2 HIS A 194 0.471 14.266 5.224 1.00 0.00 H new ATOM 0 HE1 HIS A 194 2.688 15.005 8.740 1.00 0.00 H new ATOM 335 N GLN A 195 -0.741 9.213 8.369 1.00 0.00 N ATOM 336 CA GLN A 195 -1.684 8.068 8.437 1.00 0.00 C ATOM 337 C GLN A 195 -2.666 8.103 7.246 1.00 0.00 C ATOM 338 O GLN A 195 -3.288 7.106 6.933 1.00 0.00 O ATOM 339 CB GLN A 195 -2.450 8.167 9.769 1.00 0.00 C ATOM 340 CG GLN A 195 -3.371 6.960 9.972 1.00 0.00 C ATOM 341 CD GLN A 195 -2.529 5.709 10.209 1.00 0.00 C ATOM 342 OE1 GLN A 195 -1.989 5.516 11.281 1.00 0.00 O ATOM 343 NE2 GLN A 195 -2.387 4.852 9.240 1.00 0.00 N ATOM 0 H GLN A 195 -0.851 9.902 9.113 1.00 0.00 H new ATOM 0 HA GLN A 195 -1.137 7.127 8.384 1.00 0.00 H new ATOM 0 HB2 GLN A 195 -1.741 8.229 10.595 1.00 0.00 H new ATOM 0 HB3 GLN A 195 -3.039 9.084 9.785 1.00 0.00 H new ATOM 0 HG2 GLN A 195 -4.032 7.133 10.822 1.00 0.00 H new ATOM 0 HG3 GLN A 195 -4.006 6.823 9.097 1.00 0.00 H new ATOM 0 HE21 GLN A 195 -2.842 5.017 8.342 1.00 0.00 H new ATOM 0 HE22 GLN A 195 -1.821 4.015 9.378 1.00 0.00 H new ATOM 352 N TYR A 196 -2.852 9.243 6.600 1.00 0.00 N ATOM 353 CA TYR A 196 -3.853 9.316 5.469 1.00 0.00 C ATOM 354 C TYR A 196 -3.228 9.684 4.116 1.00 0.00 C ATOM 355 O TYR A 196 -2.360 10.528 4.013 1.00 0.00 O ATOM 356 CB TYR A 196 -4.880 10.394 5.804 1.00 0.00 C ATOM 357 CG TYR A 196 -5.556 10.052 7.102 1.00 0.00 C ATOM 358 CD1 TYR A 196 -6.647 9.181 7.112 1.00 0.00 C ATOM 359 CD2 TYR A 196 -5.088 10.612 8.294 1.00 0.00 C ATOM 360 CE1 TYR A 196 -7.279 8.866 8.317 1.00 0.00 C ATOM 361 CE2 TYR A 196 -5.717 10.297 9.505 1.00 0.00 C ATOM 362 CZ TYR A 196 -6.816 9.423 9.517 1.00 0.00 C ATOM 363 OH TYR A 196 -7.435 9.109 10.709 1.00 0.00 O ATOM 0 H TYR A 196 -2.362 10.114 6.803 1.00 0.00 H new ATOM 0 HA TYR A 196 -4.291 8.323 5.374 1.00 0.00 H new ATOM 0 HB2 TYR A 196 -4.392 11.366 5.880 1.00 0.00 H new ATOM 0 HB3 TYR A 196 -5.618 10.470 5.006 1.00 0.00 H new ATOM 0 HD1 TYR A 196 -7.002 8.751 6.187 1.00 0.00 H new ATOM 0 HD2 TYR A 196 -4.244 11.286 8.281 1.00 0.00 H new ATOM 0 HE1 TYR A 196 -8.124 8.194 8.324 1.00 0.00 H new ATOM 0 HE2 TYR A 196 -5.357 10.726 10.429 1.00 0.00 H new ATOM 0 HH TYR A 196 -6.988 9.580 11.443 1.00 0.00 H new ATOM 373 N TYR A 197 -3.738 9.073 3.072 1.00 0.00 N ATOM 374 CA TYR A 197 -3.279 9.371 1.677 1.00 0.00 C ATOM 375 C TYR A 197 -4.447 9.170 0.710 1.00 0.00 C ATOM 376 O TYR A 197 -5.139 8.172 0.762 1.00 0.00 O ATOM 377 CB TYR A 197 -2.113 8.451 1.275 1.00 0.00 C ATOM 378 CG TYR A 197 -0.816 9.031 1.782 1.00 0.00 C ATOM 379 CD1 TYR A 197 -0.414 8.831 3.106 1.00 0.00 C ATOM 380 CD2 TYR A 197 -0.024 9.792 0.912 1.00 0.00 C ATOM 381 CE1 TYR A 197 0.785 9.398 3.558 1.00 0.00 C ATOM 382 CE2 TYR A 197 1.171 10.351 1.364 1.00 0.00 C ATOM 383 CZ TYR A 197 1.575 10.156 2.686 1.00 0.00 C ATOM 384 OH TYR A 197 2.749 10.716 3.131 1.00 0.00 O ATOM 0 H TYR A 197 -4.469 8.365 3.130 1.00 0.00 H new ATOM 0 HA TYR A 197 -2.932 10.403 1.635 1.00 0.00 H new ATOM 0 HB2 TYR A 197 -2.264 7.454 1.688 1.00 0.00 H new ATOM 0 HB3 TYR A 197 -2.077 8.345 0.191 1.00 0.00 H new ATOM 0 HD1 TYR A 197 -1.024 8.243 3.776 1.00 0.00 H new ATOM 0 HD2 TYR A 197 -0.339 9.946 -0.109 1.00 0.00 H new ATOM 0 HE1 TYR A 197 1.100 9.250 4.580 1.00 0.00 H new ATOM 0 HE2 TYR A 197 1.783 10.934 0.692 1.00 0.00 H new ATOM 0 HH TYR A 197 3.175 11.209 2.399 1.00 0.00 H new ATOM 394 N ASN A 198 -4.671 10.103 -0.181 1.00 0.00 N ATOM 395 CA ASN A 198 -5.793 9.945 -1.153 1.00 0.00 C ATOM 396 C ASN A 198 -5.265 9.272 -2.427 1.00 0.00 C ATOM 397 O ASN A 198 -4.074 9.095 -2.599 1.00 0.00 O ATOM 398 CB ASN A 198 -6.396 11.311 -1.475 1.00 0.00 C ATOM 399 CG ASN A 198 -5.452 12.121 -2.346 1.00 0.00 C ATOM 400 OD1 ASN A 198 -4.265 11.881 -2.363 1.00 0.00 O ATOM 401 ND2 ASN A 198 -5.949 13.069 -3.088 1.00 0.00 N ATOM 0 H ASN A 198 -4.129 10.962 -0.277 1.00 0.00 H new ATOM 0 HA ASN A 198 -6.573 9.320 -0.719 1.00 0.00 H new ATOM 0 HB2 ASN A 198 -7.350 11.182 -1.986 1.00 0.00 H new ATOM 0 HB3 ASN A 198 -6.600 11.851 -0.551 1.00 0.00 H new ATOM 0 HD21 ASN A 198 -5.337 13.618 -3.692 1.00 0.00 H new ATOM 0 HD22 ASN A 198 -6.950 13.262 -3.066 1.00 0.00 H new ATOM 408 N LEU A 199 -6.138 8.882 -3.310 1.00 0.00 N ATOM 409 CA LEU A 199 -5.687 8.200 -4.561 1.00 0.00 C ATOM 410 C LEU A 199 -4.713 9.080 -5.353 1.00 0.00 C ATOM 411 O LEU A 199 -3.711 8.612 -5.858 1.00 0.00 O ATOM 412 CB LEU A 199 -6.908 7.913 -5.440 1.00 0.00 C ATOM 413 CG LEU A 199 -7.795 6.843 -4.788 1.00 0.00 C ATOM 414 CD1 LEU A 199 -9.081 6.680 -5.613 1.00 0.00 C ATOM 415 CD2 LEU A 199 -7.048 5.491 -4.722 1.00 0.00 C ATOM 0 H LEU A 199 -7.147 9.004 -3.223 1.00 0.00 H new ATOM 0 HA LEU A 199 -5.179 7.276 -4.283 1.00 0.00 H new ATOM 0 HB2 LEU A 199 -7.481 8.828 -5.589 1.00 0.00 H new ATOM 0 HB3 LEU A 199 -6.584 7.576 -6.425 1.00 0.00 H new ATOM 0 HG LEU A 199 -8.042 7.156 -3.774 1.00 0.00 H new ATOM 0 HD11 LEU A 199 -9.714 5.921 -5.154 1.00 0.00 H new ATOM 0 HD12 LEU A 199 -9.616 7.629 -5.644 1.00 0.00 H new ATOM 0 HD13 LEU A 199 -8.826 6.374 -6.628 1.00 0.00 H new ATOM 0 HD21 LEU A 199 -7.690 4.743 -4.257 1.00 0.00 H new ATOM 0 HD22 LEU A 199 -6.788 5.170 -5.730 1.00 0.00 H new ATOM 0 HD23 LEU A 199 -6.139 5.606 -4.132 1.00 0.00 H new ATOM 427 N LYS A 200 -5.015 10.338 -5.490 1.00 0.00 N ATOM 428 CA LYS A 200 -4.134 11.251 -6.278 1.00 0.00 C ATOM 429 C LYS A 200 -2.729 11.326 -5.670 1.00 0.00 C ATOM 430 O LYS A 200 -1.737 11.377 -6.369 1.00 0.00 O ATOM 431 CB LYS A 200 -4.764 12.649 -6.304 1.00 0.00 C ATOM 432 CG LYS A 200 -3.960 13.590 -7.242 1.00 0.00 C ATOM 433 CD LYS A 200 -2.987 14.467 -6.420 1.00 0.00 C ATOM 434 CE LYS A 200 -1.784 14.872 -7.281 1.00 0.00 C ATOM 435 NZ LYS A 200 -0.808 15.634 -6.447 1.00 0.00 N ATOM 0 H LYS A 200 -5.841 10.780 -5.088 1.00 0.00 H new ATOM 0 HA LYS A 200 -4.040 10.861 -7.291 1.00 0.00 H new ATOM 0 HB2 LYS A 200 -5.797 12.582 -6.644 1.00 0.00 H new ATOM 0 HB3 LYS A 200 -4.787 13.063 -5.296 1.00 0.00 H new ATOM 0 HG2 LYS A 200 -3.402 13.000 -7.969 1.00 0.00 H new ATOM 0 HG3 LYS A 200 -4.645 14.225 -7.805 1.00 0.00 H new ATOM 0 HD2 LYS A 200 -3.503 15.358 -6.061 1.00 0.00 H new ATOM 0 HD3 LYS A 200 -2.647 13.920 -5.541 1.00 0.00 H new ATOM 0 HE2 LYS A 200 -1.307 13.985 -7.698 1.00 0.00 H new ATOM 0 HE3 LYS A 200 -2.114 15.482 -8.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 200 0.008 15.909 -7.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 200 -1.266 16.488 -6.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 200 -0.484 15.037 -5.659 1.00 0.00 H new ATOM 449 N ASP A 201 -2.633 11.367 -4.379 1.00 0.00 N ATOM 450 CA ASP A 201 -1.292 11.466 -3.743 1.00 0.00 C ATOM 451 C ASP A 201 -0.521 10.162 -3.955 1.00 0.00 C ATOM 452 O ASP A 201 0.674 10.162 -4.158 1.00 0.00 O ATOM 453 CB ASP A 201 -1.462 11.706 -2.241 1.00 0.00 C ATOM 454 CG ASP A 201 -2.026 13.110 -1.991 1.00 0.00 C ATOM 455 OD1 ASP A 201 -1.801 13.980 -2.816 1.00 0.00 O ATOM 456 OD2 ASP A 201 -2.683 13.285 -0.977 1.00 0.00 O ATOM 0 H ASP A 201 -3.422 11.337 -3.733 1.00 0.00 H new ATOM 0 HA ASP A 201 -0.741 12.292 -4.193 1.00 0.00 H new ATOM 0 HB2 ASP A 201 -2.131 10.956 -1.819 1.00 0.00 H new ATOM 0 HB3 ASP A 201 -0.502 11.596 -1.737 1.00 0.00 H new ATOM 461 N LEU A 202 -1.198 9.051 -3.890 1.00 0.00 N ATOM 462 CA LEU A 202 -0.513 7.733 -4.061 1.00 0.00 C ATOM 463 C LEU A 202 0.091 7.606 -5.461 1.00 0.00 C ATOM 464 O LEU A 202 1.173 7.079 -5.628 1.00 0.00 O ATOM 465 CB LEU A 202 -1.531 6.604 -3.867 1.00 0.00 C ATOM 466 CG LEU A 202 -1.976 6.521 -2.395 1.00 0.00 C ATOM 467 CD1 LEU A 202 -3.068 5.446 -2.259 1.00 0.00 C ATOM 468 CD2 LEU A 202 -0.777 6.163 -1.486 1.00 0.00 C ATOM 0 H LEU A 202 -2.203 8.995 -3.725 1.00 0.00 H new ATOM 0 HA LEU A 202 0.285 7.665 -3.322 1.00 0.00 H new ATOM 0 HB2 LEU A 202 -2.398 6.775 -4.505 1.00 0.00 H new ATOM 0 HB3 LEU A 202 -1.092 5.655 -4.174 1.00 0.00 H new ATOM 0 HG LEU A 202 -2.368 7.490 -2.086 1.00 0.00 H new ATOM 0 HD11 LEU A 202 -3.388 5.382 -1.219 1.00 0.00 H new ATOM 0 HD12 LEU A 202 -3.920 5.712 -2.885 1.00 0.00 H new ATOM 0 HD13 LEU A 202 -2.671 4.482 -2.577 1.00 0.00 H new ATOM 0 HD21 LEU A 202 -1.110 6.109 -0.449 1.00 0.00 H new ATOM 0 HD22 LEU A 202 -0.368 5.199 -1.787 1.00 0.00 H new ATOM 0 HD23 LEU A 202 -0.007 6.929 -1.580 1.00 0.00 H new ATOM 480 N VAL A 203 -0.597 8.055 -6.471 1.00 0.00 N ATOM 481 CA VAL A 203 -0.041 7.919 -7.844 1.00 0.00 C ATOM 482 C VAL A 203 1.221 8.768 -7.983 1.00 0.00 C ATOM 483 O VAL A 203 2.171 8.371 -8.626 1.00 0.00 O ATOM 484 CB VAL A 203 -1.083 8.324 -8.888 1.00 0.00 C ATOM 485 CG1 VAL A 203 -2.186 7.258 -8.956 1.00 0.00 C ATOM 486 CG2 VAL A 203 -1.703 9.658 -8.489 1.00 0.00 C ATOM 0 H VAL A 203 -1.510 8.505 -6.408 1.00 0.00 H new ATOM 0 HA VAL A 203 0.221 6.875 -8.015 1.00 0.00 H new ATOM 0 HB VAL A 203 -0.603 8.415 -9.862 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -2.927 7.549 -9.700 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -1.749 6.299 -9.234 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -2.666 7.169 -7.982 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -2.446 9.950 -9.231 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -2.182 9.560 -7.515 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -0.925 10.419 -8.436 1.00 0.00 H new ATOM 496 N ASP A 204 1.251 9.927 -7.381 1.00 0.00 N ATOM 497 CA ASP A 204 2.469 10.774 -7.488 1.00 0.00 C ATOM 498 C ASP A 204 3.654 9.996 -6.913 1.00 0.00 C ATOM 499 O ASP A 204 4.747 10.012 -7.446 1.00 0.00 O ATOM 500 CB ASP A 204 2.268 12.064 -6.689 1.00 0.00 C ATOM 501 CG ASP A 204 3.422 13.021 -6.980 1.00 0.00 C ATOM 502 OD1 ASP A 204 4.370 12.593 -7.617 1.00 0.00 O ATOM 503 OD2 ASP A 204 3.339 14.164 -6.559 1.00 0.00 O ATOM 0 H ASP A 204 0.491 10.319 -6.825 1.00 0.00 H new ATOM 0 HA ASP A 204 2.658 11.027 -8.531 1.00 0.00 H new ATOM 0 HB2 ASP A 204 1.319 12.528 -6.957 1.00 0.00 H new ATOM 0 HB3 ASP A 204 2.224 11.842 -5.623 1.00 0.00 H new ATOM 508 N ILE A 205 3.433 9.301 -5.837 1.00 0.00 N ATOM 509 CA ILE A 205 4.525 8.498 -5.223 1.00 0.00 C ATOM 510 C ILE A 205 4.863 7.331 -6.159 1.00 0.00 C ATOM 511 O ILE A 205 5.984 6.861 -6.210 1.00 0.00 O ATOM 512 CB ILE A 205 4.044 7.951 -3.882 1.00 0.00 C ATOM 513 CG1 ILE A 205 3.574 9.115 -3.011 1.00 0.00 C ATOM 514 CG2 ILE A 205 5.200 7.234 -3.179 1.00 0.00 C ATOM 515 CD1 ILE A 205 2.959 8.564 -1.726 1.00 0.00 C ATOM 0 H ILE A 205 2.537 9.253 -5.352 1.00 0.00 H new ATOM 0 HA ILE A 205 5.409 9.117 -5.069 1.00 0.00 H new ATOM 0 HB ILE A 205 3.225 7.250 -4.044 1.00 0.00 H new ATOM 0 HG12 ILE A 205 4.413 9.770 -2.775 1.00 0.00 H new ATOM 0 HG13 ILE A 205 2.842 9.716 -3.550 1.00 0.00 H new ATOM 0 HG21 ILE A 205 4.857 6.843 -2.221 1.00 0.00 H new ATOM 0 HG22 ILE A 205 5.551 6.411 -3.802 1.00 0.00 H new ATOM 0 HG23 ILE A 205 6.017 7.937 -3.013 1.00 0.00 H new ATOM 0 HD11 ILE A 205 2.622 9.391 -1.100 1.00 0.00 H new ATOM 0 HD12 ILE A 205 2.110 7.926 -1.973 1.00 0.00 H new ATOM 0 HD13 ILE A 205 3.705 7.981 -1.186 1.00 0.00 H new ATOM 527 N THR A 206 3.885 6.857 -6.894 1.00 0.00 N ATOM 528 CA THR A 206 4.108 5.711 -7.830 1.00 0.00 C ATOM 529 C THR A 206 3.174 5.834 -9.040 1.00 0.00 C ATOM 530 O THR A 206 1.974 5.830 -8.912 1.00 0.00 O ATOM 531 CB THR A 206 3.795 4.403 -7.100 1.00 0.00 C ATOM 532 OG1 THR A 206 2.555 4.535 -6.416 1.00 0.00 O ATOM 533 CG2 THR A 206 4.917 4.071 -6.111 1.00 0.00 C ATOM 0 H THR A 206 2.932 7.220 -6.884 1.00 0.00 H new ATOM 0 HA THR A 206 5.144 5.720 -8.168 1.00 0.00 H new ATOM 0 HB THR A 206 3.723 3.590 -7.822 1.00 0.00 H new ATOM 0 HG1 THR A 206 1.915 5.009 -6.987 1.00 0.00 H new ATOM 0 HG21 THR A 206 4.685 3.138 -5.597 1.00 0.00 H new ATOM 0 HG22 THR A 206 5.858 3.963 -6.651 1.00 0.00 H new ATOM 0 HG23 THR A 206 5.008 4.875 -5.381 1.00 0.00 H new ATOM 541 N LYS A 207 3.720 5.940 -10.212 1.00 0.00 N ATOM 542 CA LYS A 207 2.866 6.073 -11.426 1.00 0.00 C ATOM 543 C LYS A 207 2.302 4.706 -11.855 1.00 0.00 C ATOM 544 O LYS A 207 2.124 4.449 -13.028 1.00 0.00 O ATOM 545 CB LYS A 207 3.706 6.652 -12.567 1.00 0.00 C ATOM 546 CG LYS A 207 4.160 8.075 -12.216 1.00 0.00 C ATOM 547 CD LYS A 207 4.893 8.684 -13.418 1.00 0.00 C ATOM 548 CE LYS A 207 6.299 8.086 -13.542 1.00 0.00 C ATOM 549 NZ LYS A 207 7.132 8.963 -14.409 1.00 0.00 N ATOM 0 H LYS A 207 4.725 5.941 -10.387 1.00 0.00 H new ATOM 0 HA LYS A 207 2.031 6.735 -11.195 1.00 0.00 H new ATOM 0 HB2 LYS A 207 4.575 6.019 -12.748 1.00 0.00 H new ATOM 0 HB3 LYS A 207 3.123 6.664 -13.488 1.00 0.00 H new ATOM 0 HG2 LYS A 207 3.299 8.689 -11.951 1.00 0.00 H new ATOM 0 HG3 LYS A 207 4.817 8.055 -11.346 1.00 0.00 H new ATOM 0 HD2 LYS A 207 4.328 8.495 -14.331 1.00 0.00 H new ATOM 0 HD3 LYS A 207 4.959 9.766 -13.302 1.00 0.00 H new ATOM 0 HE2 LYS A 207 6.755 7.991 -12.556 1.00 0.00 H new ATOM 0 HE3 LYS A 207 6.244 7.083 -13.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 8.087 8.560 -14.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 6.699 9.031 -15.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 7.193 9.911 -13.987 1.00 0.00 H new ATOM 563 N GLN A 208 2.019 3.824 -10.930 1.00 0.00 N ATOM 564 CA GLN A 208 1.469 2.489 -11.327 1.00 0.00 C ATOM 565 C GLN A 208 -0.051 2.610 -11.518 1.00 0.00 C ATOM 566 O GLN A 208 -0.683 3.427 -10.880 1.00 0.00 O ATOM 567 CB GLN A 208 1.767 1.481 -10.212 1.00 0.00 C ATOM 568 CG GLN A 208 3.284 1.358 -10.064 1.00 0.00 C ATOM 569 CD GLN A 208 3.618 0.667 -8.750 1.00 0.00 C ATOM 570 OE1 GLN A 208 4.202 -0.399 -8.740 1.00 0.00 O ATOM 571 NE2 GLN A 208 3.259 1.238 -7.634 1.00 0.00 N ATOM 0 H GLN A 208 2.143 3.966 -9.928 1.00 0.00 H new ATOM 0 HA GLN A 208 1.927 2.154 -12.258 1.00 0.00 H new ATOM 0 HB2 GLN A 208 1.320 1.810 -9.274 1.00 0.00 H new ATOM 0 HB3 GLN A 208 1.330 0.512 -10.451 1.00 0.00 H new ATOM 0 HG2 GLN A 208 3.695 0.791 -10.899 1.00 0.00 H new ATOM 0 HG3 GLN A 208 3.743 2.346 -10.093 1.00 0.00 H new ATOM 0 HE21 GLN A 208 2.769 2.133 -7.653 1.00 0.00 H new ATOM 0 HE22 GLN A 208 3.468 0.790 -6.742 1.00 0.00 H new ATOM 580 N PRO A 209 -0.652 1.815 -12.380 1.00 0.00 N ATOM 581 CA PRO A 209 -2.124 1.882 -12.598 1.00 0.00 C ATOM 582 C PRO A 209 -2.883 1.928 -11.272 1.00 0.00 C ATOM 583 O PRO A 209 -2.650 1.134 -10.386 1.00 0.00 O ATOM 584 CB PRO A 209 -2.448 0.584 -13.349 1.00 0.00 C ATOM 585 CG PRO A 209 -1.183 0.206 -14.055 1.00 0.00 C ATOM 586 CD PRO A 209 -0.019 0.786 -13.233 1.00 0.00 C ATOM 0 HA PRO A 209 -2.416 2.779 -13.144 1.00 0.00 H new ATOM 0 HB2 PRO A 209 -2.763 -0.200 -12.660 1.00 0.00 H new ATOM 0 HB3 PRO A 209 -3.263 0.733 -14.057 1.00 0.00 H new ATOM 0 HG2 PRO A 209 -1.096 -0.877 -14.136 1.00 0.00 H new ATOM 0 HG3 PRO A 209 -1.174 0.603 -15.070 1.00 0.00 H new ATOM 0 HD2 PRO A 209 0.467 0.016 -12.634 1.00 0.00 H new ATOM 0 HD3 PRO A 209 0.746 1.219 -13.877 1.00 0.00 H new ATOM 594 N VAL A 210 -3.791 2.840 -11.134 1.00 0.00 N ATOM 595 CA VAL A 210 -4.567 2.917 -9.875 1.00 0.00 C ATOM 596 C VAL A 210 -5.324 1.618 -9.672 1.00 0.00 C ATOM 597 O VAL A 210 -5.431 1.109 -8.577 1.00 0.00 O ATOM 598 CB VAL A 210 -5.544 4.073 -9.953 1.00 0.00 C ATOM 599 CG1 VAL A 210 -4.756 5.357 -10.179 1.00 0.00 C ATOM 600 CG2 VAL A 210 -6.520 3.854 -11.110 1.00 0.00 C ATOM 0 H VAL A 210 -4.031 3.537 -11.839 1.00 0.00 H new ATOM 0 HA VAL A 210 -3.890 3.076 -9.036 1.00 0.00 H new ATOM 0 HB VAL A 210 -6.113 4.142 -9.026 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -5.444 6.200 -10.238 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -4.064 5.510 -9.351 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -4.195 5.281 -11.111 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -7.219 4.689 -11.159 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -5.966 3.789 -12.046 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -7.072 2.928 -10.950 1.00 0.00 H new ATOM 610 N VAL A 211 -5.864 1.082 -10.727 1.00 0.00 N ATOM 611 CA VAL A 211 -6.636 -0.178 -10.605 1.00 0.00 C ATOM 612 C VAL A 211 -5.790 -1.195 -9.862 1.00 0.00 C ATOM 613 O VAL A 211 -6.281 -1.962 -9.058 1.00 0.00 O ATOM 614 CB VAL A 211 -6.957 -0.720 -11.998 1.00 0.00 C ATOM 615 CG1 VAL A 211 -7.886 -1.931 -11.878 1.00 0.00 C ATOM 616 CG2 VAL A 211 -7.635 0.371 -12.830 1.00 0.00 C ATOM 0 H VAL A 211 -5.803 1.464 -11.671 1.00 0.00 H new ATOM 0 HA VAL A 211 -7.565 0.009 -10.066 1.00 0.00 H new ATOM 0 HB VAL A 211 -6.033 -1.024 -12.489 1.00 0.00 H new ATOM 0 HG11 VAL A 211 -8.113 -2.315 -12.872 1.00 0.00 H new ATOM 0 HG12 VAL A 211 -7.396 -2.709 -11.292 1.00 0.00 H new ATOM 0 HG13 VAL A 211 -8.811 -1.633 -11.384 1.00 0.00 H new ATOM 0 HG21 VAL A 211 -7.863 -0.017 -13.823 1.00 0.00 H new ATOM 0 HG22 VAL A 211 -8.558 0.681 -12.341 1.00 0.00 H new ATOM 0 HG23 VAL A 211 -6.967 1.228 -12.920 1.00 0.00 H new ATOM 626 N TYR A 212 -4.519 -1.206 -10.126 1.00 0.00 N ATOM 627 CA TYR A 212 -3.642 -2.178 -9.429 1.00 0.00 C ATOM 628 C TYR A 212 -3.483 -1.724 -7.982 1.00 0.00 C ATOM 629 O TYR A 212 -3.616 -2.499 -7.057 1.00 0.00 O ATOM 630 CB TYR A 212 -2.278 -2.233 -10.132 1.00 0.00 C ATOM 631 CG TYR A 212 -1.371 -3.256 -9.463 1.00 0.00 C ATOM 632 CD1 TYR A 212 -1.628 -4.632 -9.607 1.00 0.00 C ATOM 633 CD2 TYR A 212 -0.263 -2.828 -8.720 1.00 0.00 C ATOM 634 CE1 TYR A 212 -0.772 -5.573 -9.005 1.00 0.00 C ATOM 635 CE2 TYR A 212 0.587 -3.772 -8.122 1.00 0.00 C ATOM 636 CZ TYR A 212 0.330 -5.142 -8.266 1.00 0.00 C ATOM 637 OH TYR A 212 1.168 -6.070 -7.681 1.00 0.00 O ATOM 0 H TYR A 212 -4.051 -0.589 -10.790 1.00 0.00 H new ATOM 0 HA TYR A 212 -4.079 -3.176 -9.452 1.00 0.00 H new ATOM 0 HB2 TYR A 212 -2.414 -2.492 -11.182 1.00 0.00 H new ATOM 0 HB3 TYR A 212 -1.809 -1.250 -10.104 1.00 0.00 H new ATOM 0 HD1 TYR A 212 -2.481 -4.966 -10.179 1.00 0.00 H new ATOM 0 HD2 TYR A 212 -0.063 -1.773 -8.607 1.00 0.00 H new ATOM 0 HE1 TYR A 212 -0.968 -6.629 -9.115 1.00 0.00 H new ATOM 0 HE2 TYR A 212 1.441 -3.441 -7.550 1.00 0.00 H new ATOM 0 HH TYR A 212 1.429 -6.741 -8.346 1.00 0.00 H new ATOM 647 N LEU A 213 -3.219 -0.460 -7.785 1.00 0.00 N ATOM 648 CA LEU A 213 -3.066 0.061 -6.397 1.00 0.00 C ATOM 649 C LEU A 213 -4.396 -0.080 -5.652 1.00 0.00 C ATOM 650 O LEU A 213 -4.436 -0.438 -4.495 1.00 0.00 O ATOM 651 CB LEU A 213 -2.676 1.544 -6.434 1.00 0.00 C ATOM 652 CG LEU A 213 -1.326 1.731 -7.130 1.00 0.00 C ATOM 653 CD1 LEU A 213 -1.037 3.230 -7.230 1.00 0.00 C ATOM 654 CD2 LEU A 213 -0.215 1.036 -6.324 1.00 0.00 C ATOM 0 H LEU A 213 -3.103 0.233 -8.524 1.00 0.00 H new ATOM 0 HA LEU A 213 -2.288 -0.509 -5.889 1.00 0.00 H new ATOM 0 HB2 LEU A 213 -3.443 2.114 -6.958 1.00 0.00 H new ATOM 0 HB3 LEU A 213 -2.625 1.937 -5.419 1.00 0.00 H new ATOM 0 HG LEU A 213 -1.357 1.289 -8.126 1.00 0.00 H new ATOM 0 HD11 LEU A 213 -0.078 3.383 -7.724 1.00 0.00 H new ATOM 0 HD12 LEU A 213 -1.824 3.715 -7.808 1.00 0.00 H new ATOM 0 HD13 LEU A 213 -1.003 3.662 -6.230 1.00 0.00 H new ATOM 0 HD21 LEU A 213 0.741 1.175 -6.828 1.00 0.00 H new ATOM 0 HD22 LEU A 213 -0.165 1.469 -5.325 1.00 0.00 H new ATOM 0 HD23 LEU A 213 -0.433 -0.029 -6.247 1.00 0.00 H new ATOM 666 N LYS A 214 -5.485 0.216 -6.307 1.00 0.00 N ATOM 667 CA LYS A 214 -6.813 0.113 -5.638 1.00 0.00 C ATOM 668 C LYS A 214 -7.073 -1.329 -5.181 1.00 0.00 C ATOM 669 O LYS A 214 -7.533 -1.566 -4.085 1.00 0.00 O ATOM 670 CB LYS A 214 -7.912 0.576 -6.607 1.00 0.00 C ATOM 671 CG LYS A 214 -7.833 2.105 -6.797 1.00 0.00 C ATOM 672 CD LYS A 214 -9.116 2.609 -7.480 1.00 0.00 C ATOM 673 CE LYS A 214 -9.017 4.119 -7.795 1.00 0.00 C ATOM 674 NZ LYS A 214 -8.724 4.304 -9.246 1.00 0.00 N ATOM 0 H LYS A 214 -5.513 0.525 -7.279 1.00 0.00 H new ATOM 0 HA LYS A 214 -6.820 0.755 -4.757 1.00 0.00 H new ATOM 0 HB2 LYS A 214 -7.797 0.075 -7.568 1.00 0.00 H new ATOM 0 HB3 LYS A 214 -8.892 0.299 -6.219 1.00 0.00 H new ATOM 0 HG2 LYS A 214 -7.707 2.595 -5.832 1.00 0.00 H new ATOM 0 HG3 LYS A 214 -6.963 2.362 -7.401 1.00 0.00 H new ATOM 0 HD2 LYS A 214 -9.285 2.052 -8.401 1.00 0.00 H new ATOM 0 HD3 LYS A 214 -9.974 2.424 -6.833 1.00 0.00 H new ATOM 0 HE2 LYS A 214 -9.950 4.618 -7.535 1.00 0.00 H new ATOM 0 HE3 LYS A 214 -8.232 4.577 -7.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 214 -7.989 5.030 -9.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 214 -8.390 3.406 -9.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 214 -9.589 4.605 -9.739 1.00 0.00 H new ATOM 688 N GLU A 215 -6.779 -2.299 -6.000 1.00 0.00 N ATOM 689 CA GLU A 215 -7.030 -3.709 -5.575 1.00 0.00 C ATOM 690 C GLU A 215 -6.204 -4.022 -4.327 1.00 0.00 C ATOM 691 O GLU A 215 -6.662 -4.680 -3.414 1.00 0.00 O ATOM 692 CB GLU A 215 -6.625 -4.666 -6.698 1.00 0.00 C ATOM 693 CG GLU A 215 -7.623 -4.546 -7.850 1.00 0.00 C ATOM 694 CD GLU A 215 -7.082 -5.267 -9.086 1.00 0.00 C ATOM 695 OE1 GLU A 215 -5.886 -5.507 -9.134 1.00 0.00 O ATOM 696 OE2 GLU A 215 -7.873 -5.569 -9.964 1.00 0.00 O ATOM 0 H GLU A 215 -6.382 -2.183 -6.932 1.00 0.00 H new ATOM 0 HA GLU A 215 -8.090 -3.833 -5.355 1.00 0.00 H new ATOM 0 HB2 GLU A 215 -5.620 -4.430 -7.047 1.00 0.00 H new ATOM 0 HB3 GLU A 215 -6.602 -5.691 -6.327 1.00 0.00 H new ATOM 0 HG2 GLU A 215 -8.581 -4.976 -7.558 1.00 0.00 H new ATOM 0 HG3 GLU A 215 -7.801 -3.496 -8.080 1.00 0.00 H new ATOM 703 N ILE A 216 -4.993 -3.554 -4.279 1.00 0.00 N ATOM 704 CA ILE A 216 -4.136 -3.821 -3.094 1.00 0.00 C ATOM 705 C ILE A 216 -4.679 -3.041 -1.900 1.00 0.00 C ATOM 706 O ILE A 216 -4.764 -3.542 -0.795 1.00 0.00 O ATOM 707 CB ILE A 216 -2.721 -3.345 -3.417 1.00 0.00 C ATOM 708 CG1 ILE A 216 -2.170 -4.180 -4.574 1.00 0.00 C ATOM 709 CG2 ILE A 216 -1.818 -3.492 -2.188 1.00 0.00 C ATOM 710 CD1 ILE A 216 -0.855 -3.577 -5.059 1.00 0.00 C ATOM 0 H ILE A 216 -4.556 -2.995 -5.012 1.00 0.00 H new ATOM 0 HA ILE A 216 -4.130 -4.884 -2.854 1.00 0.00 H new ATOM 0 HB ILE A 216 -2.747 -2.293 -3.701 1.00 0.00 H new ATOM 0 HG12 ILE A 216 -2.013 -5.209 -4.251 1.00 0.00 H new ATOM 0 HG13 ILE A 216 -2.891 -4.209 -5.391 1.00 0.00 H new ATOM 0 HG21 ILE A 216 -0.813 -3.149 -2.432 1.00 0.00 H new ATOM 0 HG22 ILE A 216 -2.217 -2.893 -1.370 1.00 0.00 H new ATOM 0 HG23 ILE A 216 -1.781 -4.539 -1.887 1.00 0.00 H new ATOM 0 HD11 ILE A 216 -0.464 -4.173 -5.883 1.00 0.00 H new ATOM 0 HD12 ILE A 216 -1.027 -2.556 -5.399 1.00 0.00 H new ATOM 0 HD13 ILE A 216 -0.134 -3.571 -4.241 1.00 0.00 H new ATOM 722 N LEU A 217 -5.047 -1.817 -2.123 1.00 0.00 N ATOM 723 CA LEU A 217 -5.588 -0.981 -1.020 1.00 0.00 C ATOM 724 C LEU A 217 -6.959 -1.510 -0.608 1.00 0.00 C ATOM 725 O LEU A 217 -7.335 -1.468 0.542 1.00 0.00 O ATOM 726 CB LEU A 217 -5.742 0.457 -1.509 1.00 0.00 C ATOM 727 CG LEU A 217 -4.365 1.058 -1.844 1.00 0.00 C ATOM 728 CD1 LEU A 217 -4.550 2.347 -2.655 1.00 0.00 C ATOM 729 CD2 LEU A 217 -3.597 1.385 -0.551 1.00 0.00 C ATOM 0 H LEU A 217 -4.997 -1.353 -3.030 1.00 0.00 H new ATOM 0 HA LEU A 217 -4.907 -1.016 -0.170 1.00 0.00 H new ATOM 0 HB2 LEU A 217 -6.381 0.482 -2.391 1.00 0.00 H new ATOM 0 HB3 LEU A 217 -6.232 1.058 -0.743 1.00 0.00 H new ATOM 0 HG LEU A 217 -3.798 0.331 -2.425 1.00 0.00 H new ATOM 0 HD11 LEU A 217 -3.574 2.771 -2.891 1.00 0.00 H new ATOM 0 HD12 LEU A 217 -5.082 2.122 -3.580 1.00 0.00 H new ATOM 0 HD13 LEU A 217 -5.126 3.065 -2.071 1.00 0.00 H new ATOM 0 HD21 LEU A 217 -2.625 1.809 -0.803 1.00 0.00 H new ATOM 0 HD22 LEU A 217 -4.166 2.105 0.038 1.00 0.00 H new ATOM 0 HD23 LEU A 217 -3.456 0.473 0.029 1.00 0.00 H new ATOM 741 N LYS A 218 -7.720 -1.989 -1.545 1.00 0.00 N ATOM 742 CA LYS A 218 -9.072 -2.503 -1.208 1.00 0.00 C ATOM 743 C LYS A 218 -8.958 -3.736 -0.295 1.00 0.00 C ATOM 744 O LYS A 218 -9.775 -3.943 0.580 1.00 0.00 O ATOM 745 CB LYS A 218 -9.826 -2.863 -2.497 1.00 0.00 C ATOM 746 CG LYS A 218 -10.339 -1.585 -3.185 1.00 0.00 C ATOM 747 CD LYS A 218 -10.802 -1.909 -4.613 1.00 0.00 C ATOM 748 CE LYS A 218 -12.047 -2.800 -4.585 1.00 0.00 C ATOM 749 NZ LYS A 218 -13.057 -2.219 -3.660 1.00 0.00 N ATOM 0 H LYS A 218 -7.465 -2.047 -2.531 1.00 0.00 H new ATOM 0 HA LYS A 218 -9.626 -1.729 -0.677 1.00 0.00 H new ATOM 0 HB2 LYS A 218 -9.167 -3.409 -3.172 1.00 0.00 H new ATOM 0 HB3 LYS A 218 -10.663 -3.522 -2.266 1.00 0.00 H new ATOM 0 HG2 LYS A 218 -11.164 -1.160 -2.614 1.00 0.00 H new ATOM 0 HG3 LYS A 218 -9.550 -0.834 -3.211 1.00 0.00 H new ATOM 0 HD2 LYS A 218 -11.021 -0.985 -5.149 1.00 0.00 H new ATOM 0 HD3 LYS A 218 -10.001 -2.411 -5.156 1.00 0.00 H new ATOM 0 HE2 LYS A 218 -12.466 -2.888 -5.587 1.00 0.00 H new ATOM 0 HE3 LYS A 218 -11.779 -3.806 -4.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 218 -14.011 -2.498 -3.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 218 -12.888 -2.570 -2.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 218 -12.980 -1.182 -3.669 1.00 0.00 H new ATOM 763 N GLU A 219 -7.968 -4.570 -0.505 1.00 0.00 N ATOM 764 CA GLU A 219 -7.836 -5.801 0.338 1.00 0.00 C ATOM 765 C GLU A 219 -7.372 -5.455 1.764 1.00 0.00 C ATOM 766 O GLU A 219 -7.929 -5.937 2.729 1.00 0.00 O ATOM 767 CB GLU A 219 -6.804 -6.739 -0.298 1.00 0.00 C ATOM 768 CG GLU A 219 -7.356 -7.337 -1.598 1.00 0.00 C ATOM 769 CD GLU A 219 -8.515 -8.287 -1.289 1.00 0.00 C ATOM 770 OE1 GLU A 219 -8.649 -8.672 -0.140 1.00 0.00 O ATOM 771 OE2 GLU A 219 -9.244 -8.618 -2.210 1.00 0.00 O ATOM 0 H GLU A 219 -7.249 -4.453 -1.219 1.00 0.00 H new ATOM 0 HA GLU A 219 -8.813 -6.280 0.394 1.00 0.00 H new ATOM 0 HB2 GLU A 219 -5.884 -6.192 -0.504 1.00 0.00 H new ATOM 0 HB3 GLU A 219 -6.551 -7.538 0.399 1.00 0.00 H new ATOM 0 HG2 GLU A 219 -7.696 -6.539 -2.259 1.00 0.00 H new ATOM 0 HG3 GLU A 219 -6.567 -7.873 -2.125 1.00 0.00 H new ATOM 778 N ILE A 220 -6.338 -4.653 1.906 1.00 0.00 N ATOM 779 CA ILE A 220 -5.818 -4.309 3.279 1.00 0.00 C ATOM 780 C ILE A 220 -6.022 -2.825 3.608 1.00 0.00 C ATOM 781 O ILE A 220 -5.817 -2.403 4.728 1.00 0.00 O ATOM 782 CB ILE A 220 -4.312 -4.613 3.338 1.00 0.00 C ATOM 783 CG1 ILE A 220 -3.562 -3.779 2.272 1.00 0.00 C ATOM 784 CG2 ILE A 220 -4.072 -6.104 3.080 1.00 0.00 C ATOM 785 CD1 ILE A 220 -2.064 -3.708 2.596 1.00 0.00 C ATOM 0 H ILE A 220 -5.831 -4.221 1.133 1.00 0.00 H new ATOM 0 HA ILE A 220 -6.371 -4.906 4.004 1.00 0.00 H new ATOM 0 HB ILE A 220 -3.938 -4.352 4.328 1.00 0.00 H new ATOM 0 HG12 ILE A 220 -3.706 -4.224 1.287 1.00 0.00 H new ATOM 0 HG13 ILE A 220 -3.979 -2.773 2.231 1.00 0.00 H new ATOM 0 HG21 ILE A 220 -3.003 -6.313 3.123 1.00 0.00 H new ATOM 0 HG22 ILE A 220 -4.588 -6.692 3.839 1.00 0.00 H new ATOM 0 HG23 ILE A 220 -4.454 -6.369 2.094 1.00 0.00 H new ATOM 0 HD11 ILE A 220 -1.555 -3.117 1.835 1.00 0.00 H new ATOM 0 HD12 ILE A 220 -1.924 -3.241 3.571 1.00 0.00 H new ATOM 0 HD13 ILE A 220 -1.647 -4.715 2.613 1.00 0.00 H new ATOM 797 N GLY A 221 -6.375 -2.017 2.648 1.00 0.00 N ATOM 798 CA GLY A 221 -6.534 -0.558 2.932 1.00 0.00 C ATOM 799 C GLY A 221 -7.954 -0.236 3.400 1.00 0.00 C ATOM 800 O GLY A 221 -8.753 -1.112 3.671 1.00 0.00 O ATOM 0 H GLY A 221 -6.560 -2.298 1.685 1.00 0.00 H new ATOM 0 HA2 GLY A 221 -5.819 -0.254 3.696 1.00 0.00 H new ATOM 0 HA3 GLY A 221 -6.305 0.017 2.035 1.00 0.00 H new ATOM 804 N VAL A 222 -8.266 1.031 3.473 1.00 0.00 N ATOM 805 CA VAL A 222 -9.626 1.477 3.894 1.00 0.00 C ATOM 806 C VAL A 222 -9.987 2.701 3.049 1.00 0.00 C ATOM 807 O VAL A 222 -9.159 3.211 2.337 1.00 0.00 O ATOM 808 CB VAL A 222 -9.615 1.848 5.382 1.00 0.00 C ATOM 809 CG1 VAL A 222 -11.033 2.228 5.829 1.00 0.00 C ATOM 810 CG2 VAL A 222 -9.126 0.645 6.191 1.00 0.00 C ATOM 0 H VAL A 222 -7.622 1.791 3.254 1.00 0.00 H new ATOM 0 HA VAL A 222 -10.357 0.682 3.748 1.00 0.00 H new ATOM 0 HB VAL A 222 -8.950 2.696 5.545 1.00 0.00 H new ATOM 0 HG11 VAL A 222 -11.023 2.491 6.887 1.00 0.00 H new ATOM 0 HG12 VAL A 222 -11.382 3.080 5.246 1.00 0.00 H new ATOM 0 HG13 VAL A 222 -11.703 1.383 5.672 1.00 0.00 H new ATOM 0 HG21 VAL A 222 -9.115 0.900 7.251 1.00 0.00 H new ATOM 0 HG22 VAL A 222 -9.795 -0.200 6.028 1.00 0.00 H new ATOM 0 HG23 VAL A 222 -8.119 0.377 5.872 1.00 0.00 H new ATOM 820 N GLN A 223 -11.208 3.173 3.110 1.00 0.00 N ATOM 821 CA GLN A 223 -11.602 4.368 2.286 1.00 0.00 C ATOM 822 C GLN A 223 -12.504 5.282 3.110 1.00 0.00 C ATOM 823 O GLN A 223 -13.231 4.840 3.977 1.00 0.00 O ATOM 824 CB GLN A 223 -12.364 3.894 1.040 1.00 0.00 C ATOM 825 CG GLN A 223 -12.855 5.097 0.216 1.00 0.00 C ATOM 826 CD GLN A 223 -11.670 5.985 -0.176 1.00 0.00 C ATOM 827 OE1 GLN A 223 -10.856 5.603 -0.990 1.00 0.00 O ATOM 828 NE2 GLN A 223 -11.541 7.165 0.370 1.00 0.00 N ATOM 0 H GLN A 223 -11.951 2.786 3.692 1.00 0.00 H new ATOM 0 HA GLN A 223 -10.708 4.914 1.986 1.00 0.00 H new ATOM 0 HB2 GLN A 223 -11.716 3.267 0.428 1.00 0.00 H new ATOM 0 HB3 GLN A 223 -13.213 3.279 1.338 1.00 0.00 H new ATOM 0 HG2 GLN A 223 -13.370 4.749 -0.679 1.00 0.00 H new ATOM 0 HG3 GLN A 223 -13.576 5.674 0.795 1.00 0.00 H new ATOM 0 HE21 GLN A 223 -12.225 7.488 1.055 1.00 0.00 H new ATOM 0 HE22 GLN A 223 -10.757 7.764 0.112 1.00 0.00 H new ATOM 837 N ASN A 224 -12.460 6.562 2.851 1.00 0.00 N ATOM 838 CA ASN A 224 -13.310 7.506 3.625 1.00 0.00 C ATOM 839 C ASN A 224 -13.614 8.739 2.769 1.00 0.00 C ATOM 840 O ASN A 224 -12.739 9.534 2.473 1.00 0.00 O ATOM 841 CB ASN A 224 -12.556 7.930 4.893 1.00 0.00 C ATOM 842 CG ASN A 224 -11.820 6.718 5.469 1.00 0.00 C ATOM 843 OD1 ASN A 224 -12.307 6.071 6.374 1.00 0.00 O ATOM 844 ND2 ASN A 224 -10.659 6.383 4.971 1.00 0.00 N ATOM 0 H ASN A 224 -11.872 6.992 2.137 1.00 0.00 H new ATOM 0 HA ASN A 224 -14.247 7.022 3.900 1.00 0.00 H new ATOM 0 HB2 ASN A 224 -11.847 8.725 4.660 1.00 0.00 H new ATOM 0 HB3 ASN A 224 -13.254 8.331 5.629 1.00 0.00 H new ATOM 0 HD21 ASN A 224 -10.159 5.576 5.342 1.00 0.00 H new ATOM 0 HD22 ASN A 224 -10.253 6.929 4.211 1.00 0.00 H new ATOM 851 N VAL A 225 -14.853 8.906 2.379 1.00 0.00 N ATOM 852 CA VAL A 225 -15.242 10.094 1.557 1.00 0.00 C ATOM 853 C VAL A 225 -15.799 11.159 2.498 1.00 0.00 C ATOM 854 O VAL A 225 -16.714 10.915 3.256 1.00 0.00 O ATOM 855 CB VAL A 225 -16.312 9.706 0.536 1.00 0.00 C ATOM 856 CG1 VAL A 225 -15.724 8.698 -0.449 1.00 0.00 C ATOM 857 CG2 VAL A 225 -17.519 9.085 1.253 1.00 0.00 C ATOM 0 H VAL A 225 -15.617 8.266 2.596 1.00 0.00 H new ATOM 0 HA VAL A 225 -14.373 10.472 1.019 1.00 0.00 H new ATOM 0 HB VAL A 225 -16.640 10.596 -0.002 1.00 0.00 H new ATOM 0 HG11 VAL A 225 -16.483 8.418 -1.179 1.00 0.00 H new ATOM 0 HG12 VAL A 225 -14.873 9.145 -0.963 1.00 0.00 H new ATOM 0 HG13 VAL A 225 -15.395 7.810 0.091 1.00 0.00 H new ATOM 0 HG21 VAL A 225 -18.277 8.811 0.519 1.00 0.00 H new ATOM 0 HG22 VAL A 225 -17.201 8.195 1.796 1.00 0.00 H new ATOM 0 HG23 VAL A 225 -17.937 9.807 1.954 1.00 0.00 H new ATOM 867 N LYS A 226 -15.233 12.331 2.483 1.00 0.00 N ATOM 868 CA LYS A 226 -15.703 13.409 3.402 1.00 0.00 C ATOM 869 C LYS A 226 -16.714 14.320 2.675 1.00 0.00 C ATOM 870 O LYS A 226 -17.238 13.981 1.633 1.00 0.00 O ATOM 871 CB LYS A 226 -14.491 14.231 3.857 1.00 0.00 C ATOM 872 CG LYS A 226 -13.277 13.313 4.107 1.00 0.00 C ATOM 873 CD LYS A 226 -13.564 12.274 5.201 1.00 0.00 C ATOM 874 CE LYS A 226 -13.869 12.960 6.541 1.00 0.00 C ATOM 875 NZ LYS A 226 -15.331 13.218 6.645 1.00 0.00 N ATOM 0 H LYS A 226 -14.460 12.593 1.871 1.00 0.00 H new ATOM 0 HA LYS A 226 -16.196 12.966 4.268 1.00 0.00 H new ATOM 0 HB2 LYS A 226 -14.243 14.973 3.099 1.00 0.00 H new ATOM 0 HB3 LYS A 226 -14.736 14.776 4.769 1.00 0.00 H new ATOM 0 HG2 LYS A 226 -13.011 12.802 3.182 1.00 0.00 H new ATOM 0 HG3 LYS A 226 -12.417 13.918 4.396 1.00 0.00 H new ATOM 0 HD2 LYS A 226 -14.409 11.652 4.905 1.00 0.00 H new ATOM 0 HD3 LYS A 226 -12.705 11.612 5.314 1.00 0.00 H new ATOM 0 HE2 LYS A 226 -13.540 12.330 7.367 1.00 0.00 H new ATOM 0 HE3 LYS A 226 -13.317 13.897 6.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 226 -15.621 13.173 7.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 226 -15.545 14.162 6.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 226 -15.850 12.499 6.101 1.00 0.00 H new ATOM 889 N GLY A 227 -16.994 15.470 3.234 1.00 0.00 N ATOM 890 CA GLY A 227 -17.973 16.414 2.606 1.00 0.00 C ATOM 891 C GLY A 227 -17.756 16.510 1.086 1.00 0.00 C ATOM 892 O GLY A 227 -18.428 15.855 0.311 1.00 0.00 O ATOM 0 H GLY A 227 -16.583 15.800 4.107 1.00 0.00 H new ATOM 0 HA2 GLY A 227 -18.989 16.077 2.810 1.00 0.00 H new ATOM 0 HA3 GLY A 227 -17.868 17.402 3.054 1.00 0.00 H new ATOM 896 N ILE A 228 -16.824 17.330 0.651 1.00 0.00 N ATOM 897 CA ILE A 228 -16.574 17.467 -0.817 1.00 0.00 C ATOM 898 C ILE A 228 -16.114 16.118 -1.365 1.00 0.00 C ATOM 899 O ILE A 228 -15.878 15.966 -2.544 1.00 0.00 O ATOM 900 CB ILE A 228 -15.524 18.560 -1.094 1.00 0.00 C ATOM 901 CG1 ILE A 228 -14.215 18.242 -0.358 1.00 0.00 C ATOM 902 CG2 ILE A 228 -16.056 19.922 -0.635 1.00 0.00 C ATOM 903 CD1 ILE A 228 -13.104 19.219 -0.794 1.00 0.00 C ATOM 0 H ILE A 228 -16.230 17.906 1.248 1.00 0.00 H new ATOM 0 HA ILE A 228 -17.495 17.767 -1.317 1.00 0.00 H new ATOM 0 HB ILE A 228 -15.327 18.591 -2.166 1.00 0.00 H new ATOM 0 HG12 ILE A 228 -14.369 18.313 0.719 1.00 0.00 H new ATOM 0 HG13 ILE A 228 -13.911 17.217 -0.570 1.00 0.00 H new ATOM 0 HG21 ILE A 228 -15.309 20.690 -0.834 1.00 0.00 H new ATOM 0 HG22 ILE A 228 -16.971 20.157 -1.178 1.00 0.00 H new ATOM 0 HG23 ILE A 228 -16.267 19.889 0.434 1.00 0.00 H new ATOM 0 HD11 ILE A 228 -12.182 18.981 -0.264 1.00 0.00 H new ATOM 0 HD12 ILE A 228 -12.939 19.127 -1.868 1.00 0.00 H new ATOM 0 HD13 ILE A 228 -13.405 20.240 -0.559 1.00 0.00 H new ATOM 915 N HIS A 229 -16.014 15.145 -0.490 1.00 0.00 N ATOM 916 CA HIS A 229 -15.604 13.760 -0.873 1.00 0.00 C ATOM 917 C HIS A 229 -14.082 13.640 -0.932 1.00 0.00 C ATOM 918 O HIS A 229 -13.525 13.161 -1.900 1.00 0.00 O ATOM 919 CB HIS A 229 -16.221 13.364 -2.219 1.00 0.00 C ATOM 920 CG HIS A 229 -17.650 13.834 -2.270 1.00 0.00 C ATOM 921 ND1 HIS A 229 -18.614 13.406 -1.364 1.00 0.00 N ATOM 922 CD2 HIS A 229 -18.289 14.699 -3.116 1.00 0.00 C ATOM 923 CE1 HIS A 229 -19.770 14.017 -1.690 1.00 0.00 C ATOM 924 NE2 HIS A 229 -19.626 14.815 -2.750 1.00 0.00 N ATOM 0 H HIS A 229 -16.206 15.261 0.505 1.00 0.00 H new ATOM 0 HA HIS A 229 -15.974 13.077 -0.108 1.00 0.00 H new ATOM 0 HB2 HIS A 229 -15.652 13.806 -3.037 1.00 0.00 H new ATOM 0 HB3 HIS A 229 -16.177 12.283 -2.348 1.00 0.00 H new ATOM 0 HD2 HIS A 229 -17.825 15.214 -3.944 1.00 0.00 H new ATOM 0 HE1 HIS A 229 -20.700 13.878 -1.158 1.00 0.00 H new ATOM 0 HE2 HIS A 229 -20.343 15.387 -3.196 1.00 0.00 H new ATOM 932 N LYS A 230 -13.404 14.029 0.120 1.00 0.00 N ATOM 933 CA LYS A 230 -11.923 13.882 0.130 1.00 0.00 C ATOM 934 C LYS A 230 -11.615 12.393 0.274 1.00 0.00 C ATOM 935 O LYS A 230 -11.936 11.773 1.267 1.00 0.00 O ATOM 936 CB LYS A 230 -11.304 14.652 1.318 1.00 0.00 C ATOM 937 CG LYS A 230 -11.186 16.176 1.021 1.00 0.00 C ATOM 938 CD LYS A 230 -12.167 16.984 1.888 1.00 0.00 C ATOM 939 CE LYS A 230 -11.678 17.040 3.343 1.00 0.00 C ATOM 940 NZ LYS A 230 -10.791 18.225 3.512 1.00 0.00 N ATOM 0 H LYS A 230 -13.810 14.437 0.962 1.00 0.00 H new ATOM 0 HA LYS A 230 -11.501 14.288 -0.790 1.00 0.00 H new ATOM 0 HB2 LYS A 230 -11.916 14.501 2.207 1.00 0.00 H new ATOM 0 HB3 LYS A 230 -10.316 14.247 1.539 1.00 0.00 H new ATOM 0 HG2 LYS A 230 -10.166 16.510 1.212 1.00 0.00 H new ATOM 0 HG3 LYS A 230 -11.389 16.361 -0.034 1.00 0.00 H new ATOM 0 HD2 LYS A 230 -12.264 17.995 1.492 1.00 0.00 H new ATOM 0 HD3 LYS A 230 -13.157 16.529 1.848 1.00 0.00 H new ATOM 0 HE2 LYS A 230 -12.527 17.105 4.023 1.00 0.00 H new ATOM 0 HE3 LYS A 230 -11.138 16.127 3.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 230 -10.455 18.270 4.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 230 -9.976 18.143 2.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 230 -11.322 19.091 3.287 1.00 0.00 H new ATOM 954 N ASN A 231 -11.022 11.812 -0.724 1.00 0.00 N ATOM 955 CA ASN A 231 -10.717 10.357 -0.674 1.00 0.00 C ATOM 956 C ASN A 231 -9.493 10.095 0.211 1.00 0.00 C ATOM 957 O ASN A 231 -8.448 10.660 -0.007 1.00 0.00 O ATOM 958 CB ASN A 231 -10.394 9.886 -2.093 1.00 0.00 C ATOM 959 CG ASN A 231 -11.473 10.366 -3.067 1.00 0.00 C ATOM 960 OD1 ASN A 231 -12.603 9.931 -3.001 1.00 0.00 O ATOM 961 ND2 ASN A 231 -11.167 11.263 -3.971 1.00 0.00 N ATOM 0 H ASN A 231 -10.732 12.284 -1.580 1.00 0.00 H new ATOM 0 HA ASN A 231 -11.575 9.824 -0.264 1.00 0.00 H new ATOM 0 HB2 ASN A 231 -9.421 10.270 -2.399 1.00 0.00 H new ATOM 0 HB3 ASN A 231 -10.330 8.798 -2.117 1.00 0.00 H new ATOM 0 HD21 ASN A 231 -11.880 11.596 -4.620 1.00 0.00 H new ATOM 0 HD22 ASN A 231 -10.216 11.628 -4.026 1.00 0.00 H new ATOM 968 N THR A 232 -9.595 9.221 1.188 1.00 0.00 N ATOM 969 CA THR A 232 -8.398 8.909 2.046 1.00 0.00 C ATOM 970 C THR A 232 -8.290 7.404 2.238 1.00 0.00 C ATOM 971 O THR A 232 -9.272 6.714 2.457 1.00 0.00 O ATOM 972 CB THR A 232 -8.514 9.592 3.406 1.00 0.00 C ATOM 973 OG1 THR A 232 -9.691 9.155 4.059 1.00 0.00 O ATOM 974 CG2 THR A 232 -8.557 11.099 3.203 1.00 0.00 C ATOM 0 H THR A 232 -10.446 8.713 1.429 1.00 0.00 H new ATOM 0 HA THR A 232 -7.504 9.283 1.546 1.00 0.00 H new ATOM 0 HB THR A 232 -7.654 9.335 4.024 1.00 0.00 H new ATOM 0 HG1 THR A 232 -9.762 9.593 4.933 1.00 0.00 H new ATOM 0 HG21 THR A 232 -8.640 11.594 4.170 1.00 0.00 H new ATOM 0 HG22 THR A 232 -7.644 11.425 2.705 1.00 0.00 H new ATOM 0 HG23 THR A 232 -9.418 11.359 2.587 1.00 0.00 H new ATOM 982 N TRP A 233 -7.087 6.897 2.144 1.00 0.00 N ATOM 983 CA TRP A 233 -6.836 5.435 2.302 1.00 0.00 C ATOM 984 C TRP A 233 -5.950 5.180 3.517 1.00 0.00 C ATOM 985 O TRP A 233 -5.040 5.932 3.796 1.00 0.00 O ATOM 986 CB TRP A 233 -6.144 4.907 1.043 1.00 0.00 C ATOM 987 CG TRP A 233 -7.134 4.837 -0.073 1.00 0.00 C ATOM 988 CD1 TRP A 233 -7.396 5.836 -0.947 1.00 0.00 C ATOM 989 CD2 TRP A 233 -8.002 3.727 -0.449 1.00 0.00 C ATOM 990 NE1 TRP A 233 -8.374 5.415 -1.828 1.00 0.00 N ATOM 991 CE2 TRP A 233 -8.777 4.121 -1.564 1.00 0.00 C ATOM 992 CE3 TRP A 233 -8.194 2.430 0.062 1.00 0.00 C ATOM 993 CZ2 TRP A 233 -9.707 3.264 -2.150 1.00 0.00 C ATOM 994 CZ3 TRP A 233 -9.129 1.564 -0.526 1.00 0.00 C ATOM 995 CH2 TRP A 233 -9.885 1.981 -1.629 1.00 0.00 C ATOM 0 H TRP A 233 -6.250 7.450 1.960 1.00 0.00 H new ATOM 0 HA TRP A 233 -7.786 4.921 2.447 1.00 0.00 H new ATOM 0 HB2 TRP A 233 -5.315 5.560 0.769 1.00 0.00 H new ATOM 0 HB3 TRP A 233 -5.723 3.920 1.233 1.00 0.00 H new ATOM 0 HD1 TRP A 233 -6.919 6.805 -0.955 1.00 0.00 H new ATOM 0 HE1 TRP A 233 -8.752 5.990 -2.581 1.00 0.00 H new ATOM 0 HE3 TRP A 233 -7.618 2.098 0.913 1.00 0.00 H new ATOM 0 HZ2 TRP A 233 -10.286 3.590 -3.001 1.00 0.00 H new ATOM 0 HZ3 TRP A 233 -9.266 0.570 -0.126 1.00 0.00 H new ATOM 0 HH2 TRP A 233 -10.605 1.311 -2.076 1.00 0.00 H new ATOM 1006 N GLU A 234 -6.214 4.117 4.244 1.00 0.00 N ATOM 1007 CA GLU A 234 -5.386 3.791 5.455 1.00 0.00 C ATOM 1008 C GLU A 234 -5.053 2.293 5.454 1.00 0.00 C ATOM 1009 O GLU A 234 -5.913 1.471 5.217 1.00 0.00 O ATOM 1010 CB GLU A 234 -6.196 4.081 6.717 1.00 0.00 C ATOM 1011 CG GLU A 234 -6.557 5.561 6.806 1.00 0.00 C ATOM 1012 CD GLU A 234 -7.187 5.816 8.172 1.00 0.00 C ATOM 1013 OE1 GLU A 234 -8.353 5.489 8.334 1.00 0.00 O ATOM 1014 OE2 GLU A 234 -6.490 6.318 9.040 1.00 0.00 O ATOM 0 H GLU A 234 -6.969 3.459 4.051 1.00 0.00 H new ATOM 0 HA GLU A 234 -4.476 4.391 5.434 1.00 0.00 H new ATOM 0 HB2 GLU A 234 -7.106 3.480 6.716 1.00 0.00 H new ATOM 0 HB3 GLU A 234 -5.623 3.789 7.597 1.00 0.00 H new ATOM 0 HG2 GLU A 234 -5.668 6.178 6.676 1.00 0.00 H new ATOM 0 HG3 GLU A 234 -7.251 5.832 6.011 1.00 0.00 H new ATOM 1021 N LEU A 235 -3.831 1.917 5.745 1.00 0.00 N ATOM 1022 CA LEU A 235 -3.507 0.459 5.773 1.00 0.00 C ATOM 1023 C LEU A 235 -4.257 -0.173 6.936 1.00 0.00 C ATOM 1024 O LEU A 235 -3.979 0.103 8.083 1.00 0.00 O ATOM 1025 CB LEU A 235 -2.000 0.259 5.970 1.00 0.00 C ATOM 1026 CG LEU A 235 -1.243 0.830 4.767 1.00 0.00 C ATOM 1027 CD1 LEU A 235 0.257 0.722 5.031 1.00 0.00 C ATOM 1028 CD2 LEU A 235 -1.605 0.045 3.488 1.00 0.00 C ATOM 0 H LEU A 235 -3.057 2.545 5.961 1.00 0.00 H new ATOM 0 HA LEU A 235 -3.801 -0.004 4.831 1.00 0.00 H new ATOM 0 HB2 LEU A 235 -1.674 0.753 6.885 1.00 0.00 H new ATOM 0 HB3 LEU A 235 -1.776 -0.802 6.083 1.00 0.00 H new ATOM 0 HG LEU A 235 -1.521 1.874 4.625 1.00 0.00 H new ATOM 0 HD11 LEU A 235 0.806 1.126 4.180 1.00 0.00 H new ATOM 0 HD12 LEU A 235 0.510 1.287 5.928 1.00 0.00 H new ATOM 0 HD13 LEU A 235 0.527 -0.324 5.173 1.00 0.00 H new ATOM 0 HD21 LEU A 235 -1.061 0.460 2.640 1.00 0.00 H new ATOM 0 HD22 LEU A 235 -1.334 -1.003 3.615 1.00 0.00 H new ATOM 0 HD23 LEU A 235 -2.677 0.123 3.304 1.00 0.00 H new ATOM 1040 N LYS A 236 -5.215 -1.011 6.650 1.00 0.00 N ATOM 1041 CA LYS A 236 -5.994 -1.653 7.740 1.00 0.00 C ATOM 1042 C LYS A 236 -5.034 -2.528 8.584 1.00 0.00 C ATOM 1043 O LYS A 236 -4.513 -3.506 8.088 1.00 0.00 O ATOM 1044 CB LYS A 236 -7.073 -2.530 7.095 1.00 0.00 C ATOM 1045 CG LYS A 236 -8.172 -2.876 8.109 1.00 0.00 C ATOM 1046 CD LYS A 236 -9.437 -3.288 7.349 1.00 0.00 C ATOM 1047 CE LYS A 236 -10.545 -3.618 8.341 1.00 0.00 C ATOM 1048 NZ LYS A 236 -11.804 -3.909 7.598 1.00 0.00 N ATOM 0 H LYS A 236 -5.491 -1.278 5.705 1.00 0.00 H new ATOM 0 HA LYS A 236 -6.459 -0.908 8.385 1.00 0.00 H new ATOM 0 HB2 LYS A 236 -7.509 -2.010 6.242 1.00 0.00 H new ATOM 0 HB3 LYS A 236 -6.623 -3.446 6.713 1.00 0.00 H new ATOM 0 HG2 LYS A 236 -7.843 -3.686 8.760 1.00 0.00 H new ATOM 0 HG3 LYS A 236 -8.379 -2.018 8.748 1.00 0.00 H new ATOM 0 HD2 LYS A 236 -9.755 -2.482 6.688 1.00 0.00 H new ATOM 0 HD3 LYS A 236 -9.229 -4.153 6.719 1.00 0.00 H new ATOM 0 HE2 LYS A 236 -10.261 -4.478 8.948 1.00 0.00 H new ATOM 0 HE3 LYS A 236 -10.698 -2.782 9.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 236 -12.562 -4.135 8.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 236 -12.077 -3.077 7.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 236 -11.653 -4.719 6.964 1.00 0.00 H new ATOM 1062 N PRO A 237 -4.785 -2.190 9.836 1.00 0.00 N ATOM 1063 CA PRO A 237 -3.858 -2.972 10.714 1.00 0.00 C ATOM 1064 C PRO A 237 -4.570 -4.107 11.450 1.00 0.00 C ATOM 1065 O PRO A 237 -3.993 -4.806 12.261 1.00 0.00 O ATOM 1066 CB PRO A 237 -3.380 -1.912 11.702 1.00 0.00 C ATOM 1067 CG PRO A 237 -4.562 -1.009 11.892 1.00 0.00 C ATOM 1068 CD PRO A 237 -5.353 -1.043 10.573 1.00 0.00 C ATOM 0 HA PRO A 237 -3.061 -3.462 10.154 1.00 0.00 H new ATOM 0 HB2 PRO A 237 -3.069 -2.361 12.645 1.00 0.00 H new ATOM 0 HB3 PRO A 237 -2.522 -1.365 11.311 1.00 0.00 H new ATOM 0 HG2 PRO A 237 -5.180 -1.348 12.724 1.00 0.00 H new ATOM 0 HG3 PRO A 237 -4.241 0.006 12.126 1.00 0.00 H new ATOM 0 HD2 PRO A 237 -6.420 -1.175 10.752 1.00 0.00 H new ATOM 0 HD3 PRO A 237 -5.236 -0.114 10.015 1.00 0.00 H new ATOM 1076 N GLU A 238 -5.831 -4.250 11.203 1.00 0.00 N ATOM 1077 CA GLU A 238 -6.633 -5.283 11.911 1.00 0.00 C ATOM 1078 C GLU A 238 -6.032 -6.692 11.772 1.00 0.00 C ATOM 1079 O GLU A 238 -5.996 -7.435 12.734 1.00 0.00 O ATOM 1080 CB GLU A 238 -8.049 -5.291 11.327 1.00 0.00 C ATOM 1081 CG GLU A 238 -8.752 -3.961 11.636 1.00 0.00 C ATOM 1082 CD GLU A 238 -8.914 -3.787 13.149 1.00 0.00 C ATOM 1083 OE1 GLU A 238 -9.022 -4.791 13.834 1.00 0.00 O ATOM 1084 OE2 GLU A 238 -8.920 -2.651 13.595 1.00 0.00 O ATOM 0 H GLU A 238 -6.354 -3.689 10.531 1.00 0.00 H new ATOM 0 HA GLU A 238 -6.639 -5.029 12.971 1.00 0.00 H new ATOM 0 HB2 GLU A 238 -8.006 -5.447 10.249 1.00 0.00 H new ATOM 0 HB3 GLU A 238 -8.620 -6.120 11.747 1.00 0.00 H new ATOM 0 HG2 GLU A 238 -8.174 -3.132 11.227 1.00 0.00 H new ATOM 0 HG3 GLU A 238 -9.729 -3.937 11.153 1.00 0.00 H new ATOM 1091 N TYR A 239 -5.593 -7.091 10.600 1.00 0.00 N ATOM 1092 CA TYR A 239 -5.037 -8.482 10.441 1.00 0.00 C ATOM 1093 C TYR A 239 -3.708 -8.477 9.672 1.00 0.00 C ATOM 1094 O TYR A 239 -3.261 -9.507 9.209 1.00 0.00 O ATOM 1095 CB TYR A 239 -6.060 -9.324 9.689 1.00 0.00 C ATOM 1096 CG TYR A 239 -6.218 -8.771 8.304 1.00 0.00 C ATOM 1097 CD1 TYR A 239 -7.096 -7.712 8.081 1.00 0.00 C ATOM 1098 CD2 TYR A 239 -5.480 -9.311 7.245 1.00 0.00 C ATOM 1099 CE1 TYR A 239 -7.243 -7.185 6.799 1.00 0.00 C ATOM 1100 CE2 TYR A 239 -5.621 -8.785 5.960 1.00 0.00 C ATOM 1101 CZ TYR A 239 -6.505 -7.721 5.735 1.00 0.00 C ATOM 1102 OH TYR A 239 -6.648 -7.195 4.468 1.00 0.00 O ATOM 0 H TYR A 239 -5.594 -6.523 9.753 1.00 0.00 H new ATOM 0 HA TYR A 239 -4.842 -8.898 11.430 1.00 0.00 H new ATOM 0 HB2 TYR A 239 -5.734 -10.363 9.645 1.00 0.00 H new ATOM 0 HB3 TYR A 239 -7.016 -9.311 10.212 1.00 0.00 H new ATOM 0 HD1 TYR A 239 -7.663 -7.299 8.902 1.00 0.00 H new ATOM 0 HD2 TYR A 239 -4.803 -10.133 7.422 1.00 0.00 H new ATOM 0 HE1 TYR A 239 -7.924 -6.365 6.626 1.00 0.00 H new ATOM 0 HE2 TYR A 239 -5.050 -9.197 5.141 1.00 0.00 H new ATOM 0 HH TYR A 239 -7.514 -6.742 4.398 1.00 0.00 H new ATOM 1112 N ARG A 240 -3.050 -7.359 9.544 1.00 0.00 N ATOM 1113 CA ARG A 240 -1.746 -7.375 8.823 1.00 0.00 C ATOM 1114 C ARG A 240 -0.709 -8.052 9.714 1.00 0.00 C ATOM 1115 O ARG A 240 -0.070 -7.418 10.529 1.00 0.00 O ATOM 1116 CB ARG A 240 -1.286 -5.943 8.501 1.00 0.00 C ATOM 1117 CG ARG A 240 -1.960 -5.430 7.216 1.00 0.00 C ATOM 1118 CD ARG A 240 -1.251 -6.000 5.963 1.00 0.00 C ATOM 1119 NE ARG A 240 -1.847 -7.322 5.592 1.00 0.00 N ATOM 1120 CZ ARG A 240 -1.563 -7.862 4.435 1.00 0.00 C ATOM 1121 NH1 ARG A 240 -0.739 -7.261 3.623 1.00 0.00 N ATOM 1122 NH2 ARG A 240 -2.094 -9.005 4.091 1.00 0.00 N ATOM 0 H ARG A 240 -3.350 -6.451 9.899 1.00 0.00 H new ATOM 0 HA ARG A 240 -1.859 -7.919 7.885 1.00 0.00 H new ATOM 0 HB2 ARG A 240 -1.529 -5.282 9.333 1.00 0.00 H new ATOM 0 HB3 ARG A 240 -0.203 -5.922 8.382 1.00 0.00 H new ATOM 0 HG2 ARG A 240 -3.011 -5.720 7.209 1.00 0.00 H new ATOM 0 HG3 ARG A 240 -1.930 -4.341 7.193 1.00 0.00 H new ATOM 0 HD2 ARG A 240 -1.348 -5.302 5.131 1.00 0.00 H new ATOM 0 HD3 ARG A 240 -0.185 -6.115 6.159 1.00 0.00 H new ATOM 0 HE ARG A 240 -2.473 -7.801 6.240 1.00 0.00 H new ATOM 0 HH11 ARG A 240 -0.317 -6.372 3.890 1.00 0.00 H new ATOM 0 HH12 ARG A 240 -0.516 -7.680 2.720 1.00 0.00 H new ATOM 0 HH21 ARG A 240 -2.734 -9.482 4.726 1.00 0.00 H new ATOM 0 HH22 ARG A 240 -1.868 -9.421 3.187 1.00 0.00 H new