USER MOD reduce.3.24.130724 H: found=0, std=0, add=594, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 595 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 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 139 TYR OH : rot 165:sc= 0 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 131:sc= -1.54! USER MOD Single : A 111 MET CE :methyl -106:sc= -5.04! (180deg=-8.87!) USER MOD Single : A 113 TYR OH : rot 180:sc= -0.112 USER MOD Single : A 118 LYS NZ :NH3+ 165:sc= -0.0096 (180deg=-0.131) USER MOD Single : A 120 TYR OH : rot 91:sc= -0.551 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 CYS SG : rot 21:sc= 0.0404 USER MOD Single : A 127 LYS NZ :NH3+ -158:sc= -0.059 (180deg=-0.367) USER MOD Single : A 132 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 133 THR OG1 : rot -20:sc= -0.625 USER MOD Single : A 136 SER OG : rot -124:sc= -0.364 USER MOD Single : A 143 LYS NZ :NH3+ 158:sc= -0.778 (180deg=-1.63!) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 GLN : amide:sc= -8.29! C(o=-8.3!,f=-20!) USER MOD Single : A 151 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00486) USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 CYS SG : rot -149:sc= -0.87 USER MOD Single : A 158 GLN : amide:sc= -0.659! C(o=-0.66!,f=-4.6!) USER MOD Single : A 165 SER OG : rot 180:sc= 0 USER MOD Single : A 166 LYS NZ :NH3+ -164:sc= -0.0706 (180deg=-0.375) USER MOD Single : A 171 SER OG : rot -56:sc= 0.119! USER MOD ----------------------------------------------------------------- ATOM 95 N TYR A 96 -8.324 1.740 3.344 1.00 0.00 N ATOM 96 CA TYR A 96 -7.944 0.406 2.897 1.00 0.00 C ATOM 97 C TYR A 96 -9.039 -0.608 3.215 1.00 0.00 C ATOM 98 O TYR A 96 -9.451 -0.753 4.365 1.00 0.00 O ATOM 99 CB TYR A 96 -6.632 -0.022 3.556 1.00 0.00 C ATOM 100 CG TYR A 96 -5.549 1.032 3.489 1.00 0.00 C ATOM 101 CD1 TYR A 96 -4.946 1.360 2.281 1.00 0.00 C ATOM 102 CD2 TYR A 96 -5.130 1.699 4.634 1.00 0.00 C ATOM 103 CE1 TYR A 96 -3.956 2.322 2.215 1.00 0.00 C ATOM 104 CE2 TYR A 96 -4.142 2.663 4.577 1.00 0.00 C ATOM 105 CZ TYR A 96 -3.558 2.971 3.366 1.00 0.00 C ATOM 106 OH TYR A 96 -2.573 3.929 3.305 1.00 0.00 O ATOM 0 HA TYR A 96 -7.806 0.439 1.816 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -6.823 -0.269 4.600 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -6.273 -0.931 3.074 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -5.256 0.855 1.378 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -5.584 1.460 5.584 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -3.496 2.564 1.268 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -3.829 3.173 5.476 1.00 0.00 H new ATOM 0 HH TYR A 96 -2.411 4.290 4.202 1.00 0.00 H new ATOM 116 N SER A 97 -9.507 -1.307 2.185 1.00 0.00 N ATOM 117 CA SER A 97 -10.556 -2.305 2.352 1.00 0.00 C ATOM 118 C SER A 97 -10.261 -3.549 1.520 1.00 0.00 C ATOM 119 O SER A 97 -9.485 -3.501 0.564 1.00 0.00 O ATOM 120 CB SER A 97 -11.913 -1.721 1.953 1.00 0.00 C ATOM 121 OG SER A 97 -11.875 -1.196 0.637 1.00 0.00 O ATOM 0 H SER A 97 -9.176 -1.200 1.226 1.00 0.00 H new ATOM 0 HA SER A 97 -10.586 -2.591 3.403 1.00 0.00 H new ATOM 0 HB2 SER A 97 -12.678 -2.494 2.017 1.00 0.00 H new ATOM 0 HB3 SER A 97 -12.194 -0.935 2.654 1.00 0.00 H new ATOM 0 HG SER A 97 -12.754 -0.830 0.405 1.00 0.00 H new ATOM 127 N LEU A 98 -10.884 -4.662 1.889 1.00 0.00 N ATOM 128 CA LEU A 98 -10.689 -5.921 1.178 1.00 0.00 C ATOM 129 C LEU A 98 -12.023 -6.496 0.713 1.00 0.00 C ATOM 130 O LEU A 98 -13.050 -6.320 1.370 1.00 0.00 O ATOM 131 CB LEU A 98 -9.970 -6.930 2.075 1.00 0.00 C ATOM 132 CG LEU A 98 -8.520 -6.600 2.429 1.00 0.00 C ATOM 133 CD1 LEU A 98 -7.931 -7.678 3.325 1.00 0.00 C ATOM 134 CD2 LEU A 98 -7.686 -6.439 1.166 1.00 0.00 C ATOM 0 H LEU A 98 -11.529 -4.719 2.677 1.00 0.00 H new ATOM 0 HA LEU A 98 -10.074 -5.723 0.300 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -10.535 -7.030 3.002 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -9.990 -7.902 1.583 1.00 0.00 H new ATOM 0 HG LEU A 98 -8.505 -5.656 2.973 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -6.898 -7.426 3.567 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -8.513 -7.745 4.244 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -7.959 -8.637 2.807 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -6.657 -6.204 1.437 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.708 -7.367 0.595 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.095 -5.630 0.561 1.00 0.00 H new ATOM 146 N PHE A 99 -12.001 -7.185 -0.423 1.00 0.00 N ATOM 147 CA PHE A 99 -13.208 -7.788 -0.975 1.00 0.00 C ATOM 148 C PHE A 99 -13.343 -9.241 -0.530 1.00 0.00 C ATOM 149 O PHE A 99 -12.472 -10.068 -0.800 1.00 0.00 O ATOM 150 CB PHE A 99 -13.190 -7.710 -2.503 1.00 0.00 C ATOM 151 CG PHE A 99 -14.151 -8.656 -3.163 1.00 0.00 C ATOM 152 CD1 PHE A 99 -15.456 -8.767 -2.710 1.00 0.00 C ATOM 153 CD2 PHE A 99 -13.751 -9.434 -4.238 1.00 0.00 C ATOM 154 CE1 PHE A 99 -16.342 -9.638 -3.315 1.00 0.00 C ATOM 155 CE2 PHE A 99 -14.633 -10.306 -4.848 1.00 0.00 C ATOM 156 CZ PHE A 99 -15.931 -10.407 -4.386 1.00 0.00 C ATOM 0 H PHE A 99 -11.160 -7.340 -0.979 1.00 0.00 H new ATOM 0 HA PHE A 99 -14.066 -7.231 -0.600 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -13.427 -6.691 -2.810 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -12.182 -7.923 -2.858 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -15.784 -8.166 -1.875 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -12.738 -9.358 -4.604 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -17.356 -9.717 -2.950 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -14.308 -10.907 -5.684 1.00 0.00 H new ATOM 0 HZ PHE A 99 -16.623 -11.086 -4.862 1.00 0.00 H new ATOM 166 N VAL A 100 -14.442 -9.545 0.154 1.00 0.00 N ATOM 167 CA VAL A 100 -14.692 -10.898 0.636 1.00 0.00 C ATOM 168 C VAL A 100 -15.900 -11.515 -0.060 1.00 0.00 C ATOM 169 O VAL A 100 -16.865 -10.822 -0.381 1.00 0.00 O ATOM 170 CB VAL A 100 -14.926 -10.917 2.158 1.00 0.00 C ATOM 171 CG1 VAL A 100 -13.662 -10.505 2.898 1.00 0.00 C ATOM 172 CG2 VAL A 100 -16.090 -10.011 2.530 1.00 0.00 C ATOM 0 H VAL A 100 -15.173 -8.873 0.387 1.00 0.00 H new ATOM 0 HA VAL A 100 -13.804 -11.486 0.405 1.00 0.00 H new ATOM 0 HB VAL A 100 -15.178 -11.935 2.456 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -13.847 -10.524 3.972 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -12.856 -11.198 2.656 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -13.376 -9.497 2.597 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -16.241 -10.037 3.609 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -15.870 -8.990 2.219 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -16.994 -10.356 2.029 1.00 0.00 H new ATOM 182 N GLY A 101 -15.840 -12.823 -0.290 1.00 0.00 N ATOM 183 CA GLY A 101 -16.936 -13.512 -0.946 1.00 0.00 C ATOM 184 C GLY A 101 -17.316 -14.799 -0.242 1.00 0.00 C ATOM 185 O GLY A 101 -16.796 -15.105 0.831 1.00 0.00 O ATOM 0 H GLY A 101 -15.052 -13.418 -0.034 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -17.804 -12.853 -0.985 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -16.657 -13.734 -1.976 1.00 0.00 H new ATOM 189 N ASP A 102 -18.228 -15.555 -0.845 1.00 0.00 N ATOM 190 CA ASP A 102 -18.678 -16.816 -0.269 1.00 0.00 C ATOM 191 C ASP A 102 -19.001 -16.652 1.213 1.00 0.00 C ATOM 192 O ASP A 102 -18.524 -17.418 2.052 1.00 0.00 O ATOM 193 CB ASP A 102 -17.611 -17.896 -0.455 1.00 0.00 C ATOM 194 CG ASP A 102 -17.317 -18.174 -1.916 1.00 0.00 C ATOM 195 OD1 ASP A 102 -16.610 -17.358 -2.543 1.00 0.00 O ATOM 196 OD2 ASP A 102 -17.794 -19.206 -2.432 1.00 0.00 O ATOM 0 H ASP A 102 -18.670 -15.316 -1.733 1.00 0.00 H new ATOM 0 HA ASP A 102 -19.586 -17.121 -0.789 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -16.693 -17.586 0.045 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -17.941 -18.816 0.028 1.00 0.00 H new ATOM 201 N LEU A 103 -19.811 -15.648 1.529 1.00 0.00 N ATOM 202 CA LEU A 103 -20.197 -15.382 2.910 1.00 0.00 C ATOM 203 C LEU A 103 -21.543 -16.022 3.233 1.00 0.00 C ATOM 204 O LEU A 103 -22.598 -15.475 2.908 1.00 0.00 O ATOM 205 CB LEU A 103 -20.264 -13.874 3.161 1.00 0.00 C ATOM 206 CG LEU A 103 -18.927 -13.176 3.412 1.00 0.00 C ATOM 207 CD1 LEU A 103 -19.141 -11.696 3.688 1.00 0.00 C ATOM 208 CD2 LEU A 103 -18.190 -13.835 4.569 1.00 0.00 C ATOM 0 H LEU A 103 -20.213 -15.005 0.847 1.00 0.00 H new ATOM 0 HA LEU A 103 -19.441 -15.820 3.562 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -20.741 -13.404 2.301 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -20.911 -13.697 4.021 1.00 0.00 H new ATOM 0 HG LEU A 103 -18.315 -13.273 2.515 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -18.178 -11.216 3.864 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -19.626 -11.232 2.829 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -19.772 -11.578 4.569 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -17.241 -13.325 4.733 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -18.798 -13.770 5.472 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -18.003 -14.882 4.332 1.00 0.00 H new ATOM 220 N THR A 104 -21.501 -17.185 3.876 1.00 0.00 N ATOM 221 CA THR A 104 -22.717 -17.900 4.243 1.00 0.00 C ATOM 222 C THR A 104 -23.713 -16.973 4.931 1.00 0.00 C ATOM 223 O THR A 104 -23.342 -15.993 5.577 1.00 0.00 O ATOM 224 CB THR A 104 -22.411 -19.088 5.175 1.00 0.00 C ATOM 225 OG1 THR A 104 -21.582 -18.658 6.261 1.00 0.00 O ATOM 226 CG2 THR A 104 -21.717 -20.208 4.414 1.00 0.00 C ATOM 0 H THR A 104 -20.638 -17.652 4.153 1.00 0.00 H new ATOM 0 HA THR A 104 -23.154 -18.277 3.318 1.00 0.00 H new ATOM 0 HB THR A 104 -23.355 -19.466 5.567 1.00 0.00 H new ATOM 0 HG1 THR A 104 -21.962 -18.974 7.107 1.00 0.00 H new ATOM 0 HG21 THR A 104 -21.511 -21.036 5.093 1.00 0.00 H new ATOM 0 HG22 THR A 104 -22.362 -20.553 3.606 1.00 0.00 H new ATOM 0 HG23 THR A 104 -20.780 -19.839 3.997 1.00 0.00 H new ATOM 234 N PRO A 105 -25.009 -17.288 4.791 1.00 0.00 N ATOM 235 CA PRO A 105 -26.086 -16.496 5.393 1.00 0.00 C ATOM 236 C PRO A 105 -26.118 -16.622 6.912 1.00 0.00 C ATOM 237 O PRO A 105 -26.979 -16.043 7.575 1.00 0.00 O ATOM 238 CB PRO A 105 -27.354 -17.096 4.780 1.00 0.00 C ATOM 239 CG PRO A 105 -26.977 -18.492 4.420 1.00 0.00 C ATOM 240 CD PRO A 105 -25.524 -18.442 4.035 1.00 0.00 C ATOM 0 HA PRO A 105 -25.966 -15.430 5.198 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -28.182 -17.080 5.489 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -27.674 -16.534 3.903 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -27.135 -19.168 5.260 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -27.587 -18.861 3.595 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -25.005 -19.362 4.304 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -25.398 -18.307 2.961 1.00 0.00 H new ATOM 248 N ASP A 106 -25.175 -17.381 7.458 1.00 0.00 N ATOM 249 CA ASP A 106 -25.095 -17.582 8.901 1.00 0.00 C ATOM 250 C ASP A 106 -24.012 -16.699 9.513 1.00 0.00 C ATOM 251 O ASP A 106 -23.655 -16.856 10.680 1.00 0.00 O ATOM 252 CB ASP A 106 -24.811 -19.051 9.218 1.00 0.00 C ATOM 253 CG ASP A 106 -25.335 -19.461 10.580 1.00 0.00 C ATOM 254 OD1 ASP A 106 -26.518 -19.850 10.669 1.00 0.00 O ATOM 255 OD2 ASP A 106 -24.561 -19.393 11.558 1.00 0.00 O ATOM 0 H ASP A 106 -24.455 -17.868 6.924 1.00 0.00 H new ATOM 0 HA ASP A 106 -26.055 -17.303 9.335 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -25.266 -19.679 8.453 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -23.736 -19.227 9.177 1.00 0.00 H new ATOM 260 N VAL A 107 -23.491 -15.771 8.716 1.00 0.00 N ATOM 261 CA VAL A 107 -22.449 -14.863 9.179 1.00 0.00 C ATOM 262 C VAL A 107 -22.889 -13.409 9.046 1.00 0.00 C ATOM 263 O VAL A 107 -23.628 -13.054 8.128 1.00 0.00 O ATOM 264 CB VAL A 107 -21.139 -15.065 8.394 1.00 0.00 C ATOM 265 CG1 VAL A 107 -19.973 -14.417 9.125 1.00 0.00 C ATOM 266 CG2 VAL A 107 -20.879 -16.546 8.166 1.00 0.00 C ATOM 0 H VAL A 107 -23.774 -15.629 7.746 1.00 0.00 H new ATOM 0 HA VAL A 107 -22.273 -15.092 10.230 1.00 0.00 H new ATOM 0 HB VAL A 107 -21.240 -14.583 7.422 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -19.056 -14.570 8.556 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -20.159 -13.348 9.232 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -19.867 -14.868 10.112 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -19.950 -16.671 7.610 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -20.798 -17.053 9.127 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -21.703 -16.977 7.597 1.00 0.00 H new ATOM 276 N ASP A 108 -22.428 -12.571 9.969 1.00 0.00 N ATOM 277 CA ASP A 108 -22.772 -11.154 9.955 1.00 0.00 C ATOM 278 C ASP A 108 -21.529 -10.291 10.148 1.00 0.00 C ATOM 279 O ASP A 108 -20.424 -10.806 10.316 1.00 0.00 O ATOM 280 CB ASP A 108 -23.798 -10.846 11.047 1.00 0.00 C ATOM 281 CG ASP A 108 -23.661 -11.764 12.245 1.00 0.00 C ATOM 282 OD1 ASP A 108 -24.204 -12.888 12.196 1.00 0.00 O ATOM 283 OD2 ASP A 108 -23.013 -11.359 13.233 1.00 0.00 O ATOM 0 H ASP A 108 -21.815 -12.849 10.736 1.00 0.00 H new ATOM 0 HA ASP A 108 -23.207 -10.920 8.983 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -23.681 -9.812 11.370 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -24.803 -10.939 10.634 1.00 0.00 H new ATOM 288 N ASP A 109 -21.718 -8.977 10.122 1.00 0.00 N ATOM 289 CA ASP A 109 -20.612 -8.042 10.294 1.00 0.00 C ATOM 290 C ASP A 109 -19.877 -8.305 11.604 1.00 0.00 C ATOM 291 O ASP A 109 -18.650 -8.238 11.664 1.00 0.00 O ATOM 292 CB ASP A 109 -21.125 -6.601 10.263 1.00 0.00 C ATOM 293 CG ASP A 109 -21.837 -6.212 11.543 1.00 0.00 C ATOM 294 OD1 ASP A 109 -21.147 -5.839 12.516 1.00 0.00 O ATOM 295 OD2 ASP A 109 -23.083 -6.279 11.573 1.00 0.00 O ATOM 0 H ASP A 109 -22.627 -8.535 9.983 1.00 0.00 H new ATOM 0 HA ASP A 109 -19.913 -8.189 9.470 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -20.287 -5.924 10.097 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -21.806 -6.479 9.421 1.00 0.00 H new ATOM 300 N GLY A 110 -20.637 -8.604 12.654 1.00 0.00 N ATOM 301 CA GLY A 110 -20.041 -8.871 13.949 1.00 0.00 C ATOM 302 C GLY A 110 -18.903 -9.870 13.869 1.00 0.00 C ATOM 303 O GLY A 110 -17.883 -9.713 14.538 1.00 0.00 O ATOM 0 H GLY A 110 -21.655 -8.666 12.630 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -19.672 -7.938 14.375 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -20.806 -9.250 14.626 1.00 0.00 H new ATOM 307 N MET A 111 -19.079 -10.901 13.049 1.00 0.00 N ATOM 308 CA MET A 111 -18.059 -11.929 12.884 1.00 0.00 C ATOM 309 C MET A 111 -16.994 -11.483 11.887 1.00 0.00 C ATOM 310 O MET A 111 -15.803 -11.731 12.082 1.00 0.00 O ATOM 311 CB MET A 111 -18.695 -13.240 12.418 1.00 0.00 C ATOM 312 CG MET A 111 -19.441 -13.978 13.517 1.00 0.00 C ATOM 313 SD MET A 111 -19.485 -15.761 13.250 1.00 0.00 S ATOM 314 CE MET A 111 -20.780 -15.888 12.020 1.00 0.00 C ATOM 0 H MET A 111 -19.919 -11.046 12.489 1.00 0.00 H new ATOM 0 HA MET A 111 -17.582 -12.090 13.851 1.00 0.00 H new ATOM 0 HB2 MET A 111 -19.384 -13.029 11.601 1.00 0.00 H new ATOM 0 HB3 MET A 111 -17.917 -13.890 12.019 1.00 0.00 H new ATOM 0 HG2 MET A 111 -18.967 -13.770 14.476 1.00 0.00 H new ATOM 0 HG3 MET A 111 -20.461 -13.598 13.577 1.00 0.00 H new ATOM 0 HE1 MET A 111 -21.683 -16.286 12.482 1.00 0.00 H new ATOM 0 HE2 MET A 111 -20.988 -14.901 11.608 1.00 0.00 H new ATOM 0 HE3 MET A 111 -20.458 -16.555 11.220 1.00 0.00 H new ATOM 324 N LEU A 112 -17.429 -10.826 10.818 1.00 0.00 N ATOM 325 CA LEU A 112 -16.513 -10.346 9.789 1.00 0.00 C ATOM 326 C LEU A 112 -15.465 -9.413 10.386 1.00 0.00 C ATOM 327 O LEU A 112 -14.350 -9.307 9.875 1.00 0.00 O ATOM 328 CB LEU A 112 -17.288 -9.622 8.686 1.00 0.00 C ATOM 329 CG LEU A 112 -16.496 -9.281 7.423 1.00 0.00 C ATOM 330 CD1 LEU A 112 -16.036 -10.550 6.722 1.00 0.00 C ATOM 331 CD2 LEU A 112 -17.333 -8.424 6.485 1.00 0.00 C ATOM 0 H LEU A 112 -18.411 -10.613 10.641 1.00 0.00 H new ATOM 0 HA LEU A 112 -16.003 -11.208 9.360 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -18.139 -10.241 8.401 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -17.690 -8.697 9.099 1.00 0.00 H new ATOM 0 HG LEU A 112 -15.613 -8.711 7.713 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -15.474 -10.287 5.826 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -15.399 -11.126 7.393 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -16.904 -11.147 6.444 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -16.754 -8.191 5.591 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -18.234 -8.968 6.202 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -17.611 -7.498 6.989 1.00 0.00 H new ATOM 343 N TYR A 113 -15.829 -8.739 11.472 1.00 0.00 N ATOM 344 CA TYR A 113 -14.920 -7.815 12.139 1.00 0.00 C ATOM 345 C TYR A 113 -13.963 -8.563 13.061 1.00 0.00 C ATOM 346 O TYR A 113 -12.746 -8.503 12.890 1.00 0.00 O ATOM 347 CB TYR A 113 -15.710 -6.777 12.938 1.00 0.00 C ATOM 348 CG TYR A 113 -14.849 -5.926 13.843 1.00 0.00 C ATOM 349 CD1 TYR A 113 -13.781 -5.197 13.335 1.00 0.00 C ATOM 350 CD2 TYR A 113 -15.102 -5.851 15.207 1.00 0.00 C ATOM 351 CE1 TYR A 113 -12.991 -4.419 14.158 1.00 0.00 C ATOM 352 CE2 TYR A 113 -14.318 -5.074 16.038 1.00 0.00 C ATOM 353 CZ TYR A 113 -13.264 -4.360 15.509 1.00 0.00 C ATOM 354 OH TYR A 113 -12.479 -3.586 16.333 1.00 0.00 O ATOM 0 H TYR A 113 -16.748 -8.816 11.909 1.00 0.00 H new ATOM 0 HA TYR A 113 -14.334 -7.305 11.374 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -16.246 -6.128 12.245 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -16.460 -7.289 13.540 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -13.565 -5.240 12.278 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -15.926 -6.410 15.625 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -12.164 -3.860 13.746 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -14.530 -5.026 17.096 1.00 0.00 H new ATOM 0 HH TYR A 113 -12.806 -3.654 17.254 1.00 0.00 H new ATOM 364 N GLU A 114 -14.523 -9.267 14.039 1.00 0.00 N ATOM 365 CA GLU A 114 -13.719 -10.027 14.990 1.00 0.00 C ATOM 366 C GLU A 114 -12.810 -11.016 14.265 1.00 0.00 C ATOM 367 O GLU A 114 -11.617 -11.106 14.555 1.00 0.00 O ATOM 368 CB GLU A 114 -14.623 -10.774 15.973 1.00 0.00 C ATOM 369 CG GLU A 114 -14.956 -9.975 17.221 1.00 0.00 C ATOM 370 CD GLU A 114 -15.904 -10.710 18.149 1.00 0.00 C ATOM 371 OE1 GLU A 114 -15.672 -11.911 18.403 1.00 0.00 O ATOM 372 OE2 GLU A 114 -16.877 -10.086 18.620 1.00 0.00 O ATOM 0 H GLU A 114 -15.529 -9.327 14.194 1.00 0.00 H new ATOM 0 HA GLU A 114 -13.095 -9.325 15.543 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -15.550 -11.045 15.467 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -14.136 -11.704 16.266 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -14.035 -9.745 17.757 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -15.402 -9.024 16.931 1.00 0.00 H new ATOM 379 N PHE A 115 -13.383 -11.756 13.322 1.00 0.00 N ATOM 380 CA PHE A 115 -12.626 -12.739 12.557 1.00 0.00 C ATOM 381 C PHE A 115 -11.333 -12.133 12.020 1.00 0.00 C ATOM 382 O PHE A 115 -10.314 -12.814 11.909 1.00 0.00 O ATOM 383 CB PHE A 115 -13.470 -13.276 11.399 1.00 0.00 C ATOM 384 CG PHE A 115 -12.842 -14.440 10.687 1.00 0.00 C ATOM 385 CD1 PHE A 115 -12.866 -15.706 11.248 1.00 0.00 C ATOM 386 CD2 PHE A 115 -12.226 -14.267 9.458 1.00 0.00 C ATOM 387 CE1 PHE A 115 -12.289 -16.780 10.596 1.00 0.00 C ATOM 388 CE2 PHE A 115 -11.648 -15.337 8.801 1.00 0.00 C ATOM 389 CZ PHE A 115 -11.678 -16.594 9.371 1.00 0.00 C ATOM 0 H PHE A 115 -14.369 -11.693 13.069 1.00 0.00 H new ATOM 0 HA PHE A 115 -12.371 -13.562 13.224 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -14.445 -13.578 11.781 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -13.642 -12.473 10.683 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -13.341 -15.856 12.206 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -12.197 -13.285 9.008 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -12.316 -17.763 11.044 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -11.173 -15.190 7.842 1.00 0.00 H new ATOM 0 HZ PHE A 115 -11.225 -17.431 8.860 1.00 0.00 H new ATOM 399 N PHE A 116 -11.383 -10.847 11.688 1.00 0.00 N ATOM 400 CA PHE A 116 -10.217 -10.147 11.161 1.00 0.00 C ATOM 401 C PHE A 116 -9.458 -9.438 12.278 1.00 0.00 C ATOM 402 O PHE A 116 -8.321 -9.791 12.593 1.00 0.00 O ATOM 403 CB PHE A 116 -10.642 -9.135 10.095 1.00 0.00 C ATOM 404 CG PHE A 116 -10.658 -9.701 8.704 1.00 0.00 C ATOM 405 CD1 PHE A 116 -9.504 -10.222 8.141 1.00 0.00 C ATOM 406 CD2 PHE A 116 -11.826 -9.711 7.959 1.00 0.00 C ATOM 407 CE1 PHE A 116 -9.516 -10.743 6.860 1.00 0.00 C ATOM 408 CE2 PHE A 116 -11.844 -10.231 6.678 1.00 0.00 C ATOM 409 CZ PHE A 116 -10.687 -10.748 6.129 1.00 0.00 C ATOM 0 H PHE A 116 -12.219 -10.268 11.775 1.00 0.00 H new ATOM 0 HA PHE A 116 -9.555 -10.885 10.708 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -11.636 -8.760 10.337 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -9.964 -8.282 10.124 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -8.585 -10.221 8.709 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -12.733 -9.308 8.384 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -8.610 -11.146 6.432 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -12.761 -10.233 6.108 1.00 0.00 H new ATOM 0 HZ PHE A 116 -10.698 -11.156 5.129 1.00 0.00 H new ATOM 419 N VAL A 117 -10.095 -8.434 12.874 1.00 0.00 N ATOM 420 CA VAL A 117 -9.481 -7.675 13.956 1.00 0.00 C ATOM 421 C VAL A 117 -8.639 -8.577 14.852 1.00 0.00 C ATOM 422 O VAL A 117 -7.646 -8.140 15.434 1.00 0.00 O ATOM 423 CB VAL A 117 -10.543 -6.963 14.815 1.00 0.00 C ATOM 424 CG1 VAL A 117 -11.160 -7.932 15.812 1.00 0.00 C ATOM 425 CG2 VAL A 117 -9.935 -5.765 15.529 1.00 0.00 C ATOM 0 H VAL A 117 -11.036 -8.128 12.625 1.00 0.00 H new ATOM 0 HA VAL A 117 -8.838 -6.927 13.492 1.00 0.00 H new ATOM 0 HB VAL A 117 -11.334 -6.602 14.158 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -11.908 -7.411 16.410 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -11.633 -8.754 15.275 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -10.382 -8.325 16.466 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -10.699 -5.274 16.131 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -9.124 -6.100 16.175 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.546 -5.062 14.793 1.00 0.00 H new ATOM 435 N LYS A 118 -9.043 -9.838 14.959 1.00 0.00 N ATOM 436 CA LYS A 118 -8.326 -10.804 15.782 1.00 0.00 C ATOM 437 C LYS A 118 -6.936 -11.076 15.217 1.00 0.00 C ATOM 438 O LYS A 118 -5.927 -10.854 15.887 1.00 0.00 O ATOM 439 CB LYS A 118 -9.115 -12.112 15.874 1.00 0.00 C ATOM 440 CG LYS A 118 -8.315 -13.266 16.452 1.00 0.00 C ATOM 441 CD LYS A 118 -9.197 -14.471 16.735 1.00 0.00 C ATOM 442 CE LYS A 118 -9.292 -15.388 15.526 1.00 0.00 C ATOM 443 NZ LYS A 118 -8.030 -16.146 15.304 1.00 0.00 N ATOM 0 H LYS A 118 -9.864 -10.215 14.486 1.00 0.00 H new ATOM 0 HA LYS A 118 -8.216 -10.381 16.781 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -10.000 -11.950 16.490 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -9.465 -12.386 14.879 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -7.526 -13.548 15.755 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -7.828 -12.947 17.373 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -8.796 -15.026 17.583 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -10.195 -14.135 17.017 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -10.116 -16.088 15.665 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -9.521 -14.797 14.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -8.208 -16.931 14.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -7.311 -15.512 14.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -7.688 -16.524 16.210 1.00 0.00 H new ATOM 457 N VAL A 119 -6.889 -11.557 13.978 1.00 0.00 N ATOM 458 CA VAL A 119 -5.623 -11.856 13.322 1.00 0.00 C ATOM 459 C VAL A 119 -4.828 -10.583 13.053 1.00 0.00 C ATOM 460 O VAL A 119 -3.598 -10.582 13.110 1.00 0.00 O ATOM 461 CB VAL A 119 -5.842 -12.602 11.992 1.00 0.00 C ATOM 462 CG1 VAL A 119 -6.828 -11.847 11.113 1.00 0.00 C ATOM 463 CG2 VAL A 119 -4.518 -12.804 11.270 1.00 0.00 C ATOM 0 H VAL A 119 -7.714 -11.748 13.409 1.00 0.00 H new ATOM 0 HA VAL A 119 -5.059 -12.496 14.001 1.00 0.00 H new ATOM 0 HB VAL A 119 -6.264 -13.583 12.211 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -6.970 -12.389 10.178 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -7.783 -11.759 11.630 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.438 -10.852 10.900 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.692 -13.333 10.333 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -4.066 -11.834 11.062 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -3.847 -13.390 11.898 1.00 0.00 H new ATOM 473 N TYR A 120 -5.539 -9.500 12.760 1.00 0.00 N ATOM 474 CA TYR A 120 -4.901 -8.219 12.481 1.00 0.00 C ATOM 475 C TYR A 120 -5.534 -7.103 13.306 1.00 0.00 C ATOM 476 O TYR A 120 -6.689 -6.726 13.105 1.00 0.00 O ATOM 477 CB TYR A 120 -5.004 -7.889 10.991 1.00 0.00 C ATOM 478 CG TYR A 120 -4.302 -8.887 10.099 1.00 0.00 C ATOM 479 CD1 TYR A 120 -2.918 -8.882 9.972 1.00 0.00 C ATOM 480 CD2 TYR A 120 -5.022 -9.836 9.383 1.00 0.00 C ATOM 481 CE1 TYR A 120 -2.273 -9.792 9.157 1.00 0.00 C ATOM 482 CE2 TYR A 120 -4.385 -10.751 8.567 1.00 0.00 C ATOM 483 CZ TYR A 120 -3.010 -10.724 8.457 1.00 0.00 C ATOM 484 OH TYR A 120 -2.371 -11.633 7.646 1.00 0.00 O ATOM 0 H TYR A 120 -6.558 -9.484 12.710 1.00 0.00 H new ATOM 0 HA TYR A 120 -3.850 -8.298 12.758 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -6.056 -7.841 10.710 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -4.582 -6.899 10.817 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -2.337 -8.155 10.520 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -6.099 -9.859 9.466 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -1.197 -9.774 9.068 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -4.960 -11.483 8.019 1.00 0.00 H new ATOM 0 HH TYR A 120 -2.165 -12.442 8.160 1.00 0.00 H new ATOM 494 N PRO A 121 -4.760 -6.561 14.258 1.00 0.00 N ATOM 495 CA PRO A 121 -5.222 -5.479 15.133 1.00 0.00 C ATOM 496 C PRO A 121 -5.394 -4.162 14.385 1.00 0.00 C ATOM 497 O PRO A 121 -5.753 -3.144 14.976 1.00 0.00 O ATOM 498 CB PRO A 121 -4.105 -5.362 16.172 1.00 0.00 C ATOM 499 CG PRO A 121 -2.891 -5.884 15.484 1.00 0.00 C ATOM 500 CD PRO A 121 -3.374 -6.961 14.553 1.00 0.00 C ATOM 0 HA PRO A 121 -6.201 -5.692 15.562 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -3.966 -4.329 16.489 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -4.334 -5.942 17.066 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -2.383 -5.092 14.934 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -2.175 -6.282 16.203 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -2.769 -7.011 13.648 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.331 -7.945 15.020 1.00 0.00 H new ATOM 508 N SER A 122 -5.137 -4.189 13.081 1.00 0.00 N ATOM 509 CA SER A 122 -5.260 -2.995 12.252 1.00 0.00 C ATOM 510 C SER A 122 -6.590 -2.988 11.505 1.00 0.00 C ATOM 511 O SER A 122 -6.747 -2.292 10.501 1.00 0.00 O ATOM 512 CB SER A 122 -4.102 -2.918 11.256 1.00 0.00 C ATOM 513 OG SER A 122 -2.917 -3.467 11.808 1.00 0.00 O ATOM 0 H SER A 122 -4.842 -5.025 12.576 1.00 0.00 H new ATOM 0 HA SER A 122 -5.225 -2.123 12.906 1.00 0.00 H new ATOM 0 HB2 SER A 122 -4.365 -3.455 10.345 1.00 0.00 H new ATOM 0 HB3 SER A 122 -3.929 -1.879 10.975 1.00 0.00 H new ATOM 0 HG SER A 122 -2.192 -3.407 11.151 1.00 0.00 H new ATOM 519 N CYS A 123 -7.544 -3.768 12.001 1.00 0.00 N ATOM 520 CA CYS A 123 -8.861 -3.853 11.380 1.00 0.00 C ATOM 521 C CYS A 123 -9.745 -2.690 11.819 1.00 0.00 C ATOM 522 O CYS A 123 -9.830 -2.375 13.006 1.00 0.00 O ATOM 523 CB CYS A 123 -9.531 -5.181 11.736 1.00 0.00 C ATOM 524 SG CYS A 123 -11.075 -5.491 10.848 1.00 0.00 S ATOM 0 H CYS A 123 -7.430 -4.350 12.831 1.00 0.00 H new ATOM 0 HA CYS A 123 -8.730 -3.799 10.299 1.00 0.00 H new ATOM 0 HB2 CYS A 123 -8.835 -5.994 11.528 1.00 0.00 H new ATOM 0 HB3 CYS A 123 -9.731 -5.199 12.807 1.00 0.00 H new ATOM 0 HG CYS A 123 -11.113 -4.758 9.775 1.00 0.00 H new ATOM 530 N ARG A 124 -10.401 -2.054 10.853 1.00 0.00 N ATOM 531 CA ARG A 124 -11.276 -0.924 11.139 1.00 0.00 C ATOM 532 C ARG A 124 -12.700 -1.396 11.417 1.00 0.00 C ATOM 533 O ARG A 124 -13.362 -0.902 12.328 1.00 0.00 O ATOM 534 CB ARG A 124 -11.273 0.060 9.968 1.00 0.00 C ATOM 535 CG ARG A 124 -10.203 1.135 10.078 1.00 0.00 C ATOM 536 CD ARG A 124 -10.275 2.114 8.917 1.00 0.00 C ATOM 537 NE ARG A 124 -9.506 3.328 9.177 1.00 0.00 N ATOM 538 CZ ARG A 124 -9.949 4.332 9.925 1.00 0.00 C ATOM 539 NH1 ARG A 124 -11.148 4.267 10.486 1.00 0.00 N ATOM 540 NH2 ARG A 124 -9.190 5.404 10.115 1.00 0.00 N ATOM 0 H ARG A 124 -10.343 -2.303 9.865 1.00 0.00 H new ATOM 0 HA ARG A 124 -10.898 -0.420 12.029 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -11.126 -0.493 9.040 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -12.251 0.538 9.903 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -10.323 1.674 11.018 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -9.218 0.668 10.101 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -9.899 1.633 8.014 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -11.316 2.377 8.729 1.00 0.00 H new ATOM 0 HE ARG A 124 -8.578 3.409 8.761 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -11.734 3.444 10.344 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -11.485 5.040 11.060 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -8.266 5.457 9.686 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -9.531 6.175 10.690 1.00 0.00 H new ATOM 554 N GLY A 125 -13.165 -2.356 10.623 1.00 0.00 N ATOM 555 CA GLY A 125 -14.508 -2.878 10.799 1.00 0.00 C ATOM 556 C GLY A 125 -14.942 -3.761 9.646 1.00 0.00 C ATOM 557 O GLY A 125 -14.504 -3.573 8.511 1.00 0.00 O ATOM 0 H GLY A 125 -12.636 -2.781 9.862 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -14.554 -3.448 11.727 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -15.207 -2.048 10.900 1.00 0.00 H new ATOM 561 N GLY A 126 -15.806 -4.730 9.936 1.00 0.00 N ATOM 562 CA GLY A 126 -16.284 -5.632 8.905 1.00 0.00 C ATOM 563 C GLY A 126 -17.690 -5.299 8.449 1.00 0.00 C ATOM 564 O GLY A 126 -18.537 -4.911 9.255 1.00 0.00 O ATOM 0 H GLY A 126 -16.183 -4.906 10.867 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -15.609 -5.592 8.050 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -16.260 -6.655 9.282 1.00 0.00 H new ATOM 568 N LYS A 127 -17.942 -5.448 7.153 1.00 0.00 N ATOM 569 CA LYS A 127 -19.256 -5.160 6.590 1.00 0.00 C ATOM 570 C LYS A 127 -19.668 -6.238 5.593 1.00 0.00 C ATOM 571 O LYS A 127 -18.887 -6.626 4.723 1.00 0.00 O ATOM 572 CB LYS A 127 -19.251 -3.792 5.905 1.00 0.00 C ATOM 573 CG LYS A 127 -20.641 -3.239 5.641 1.00 0.00 C ATOM 574 CD LYS A 127 -21.556 -3.436 6.838 1.00 0.00 C ATOM 575 CE LYS A 127 -22.789 -2.550 6.748 1.00 0.00 C ATOM 576 NZ LYS A 127 -22.446 -1.107 6.871 1.00 0.00 N ATOM 0 H LYS A 127 -17.253 -5.767 6.472 1.00 0.00 H new ATOM 0 HA LYS A 127 -19.979 -5.148 7.406 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -18.700 -3.086 6.526 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -18.715 -3.870 4.959 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -20.572 -2.177 5.405 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -21.070 -3.732 4.769 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -21.861 -4.481 6.896 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -21.011 -3.211 7.755 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -23.292 -2.724 5.797 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -23.491 -2.824 7.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -23.286 -0.575 7.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -21.688 -0.989 7.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -22.124 -0.747 5.950 1.00 0.00 H new ATOM 590 N VAL A 128 -20.901 -6.719 5.724 1.00 0.00 N ATOM 591 CA VAL A 128 -21.418 -7.750 4.832 1.00 0.00 C ATOM 592 C VAL A 128 -22.663 -7.267 4.096 1.00 0.00 C ATOM 593 O VAL A 128 -23.605 -6.766 4.710 1.00 0.00 O ATOM 594 CB VAL A 128 -21.759 -9.039 5.604 1.00 0.00 C ATOM 595 CG1 VAL A 128 -22.645 -8.726 6.800 1.00 0.00 C ATOM 596 CG2 VAL A 128 -22.429 -10.048 4.683 1.00 0.00 C ATOM 0 H VAL A 128 -21.560 -6.411 6.439 1.00 0.00 H new ATOM 0 HA VAL A 128 -20.633 -7.965 4.108 1.00 0.00 H new ATOM 0 HB VAL A 128 -20.832 -9.478 5.974 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -22.876 -9.648 7.333 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -22.125 -8.041 7.469 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -23.571 -8.265 6.456 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -22.663 -10.953 5.244 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -23.348 -9.621 4.283 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -21.756 -10.294 3.862 1.00 0.00 H new ATOM 606 N VAL A 129 -22.660 -7.421 2.776 1.00 0.00 N ATOM 607 CA VAL A 129 -23.789 -7.001 1.955 1.00 0.00 C ATOM 608 C VAL A 129 -24.980 -7.935 2.140 1.00 0.00 C ATOM 609 O VAL A 129 -24.816 -9.147 2.287 1.00 0.00 O ATOM 610 CB VAL A 129 -23.412 -6.958 0.462 1.00 0.00 C ATOM 611 CG1 VAL A 129 -22.233 -6.025 0.235 1.00 0.00 C ATOM 612 CG2 VAL A 129 -23.101 -8.357 -0.050 1.00 0.00 C ATOM 0 H VAL A 129 -21.888 -7.834 2.252 1.00 0.00 H new ATOM 0 HA VAL A 129 -24.063 -5.998 2.282 1.00 0.00 H new ATOM 0 HB VAL A 129 -24.263 -6.572 -0.098 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -21.981 -6.008 -0.825 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -22.497 -5.019 0.562 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -21.374 -6.378 0.806 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -22.837 -8.307 -1.106 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -22.266 -8.774 0.514 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -23.977 -8.993 0.075 1.00 0.00 H new ATOM 622 N LEU A 130 -26.179 -7.364 2.132 1.00 0.00 N ATOM 623 CA LEU A 130 -27.400 -8.145 2.299 1.00 0.00 C ATOM 624 C LEU A 130 -28.391 -7.853 1.178 1.00 0.00 C ATOM 625 O LEU A 130 -28.260 -6.858 0.464 1.00 0.00 O ATOM 626 CB LEU A 130 -28.041 -7.842 3.654 1.00 0.00 C ATOM 627 CG LEU A 130 -27.091 -7.790 4.851 1.00 0.00 C ATOM 628 CD1 LEU A 130 -27.763 -7.118 6.038 1.00 0.00 C ATOM 629 CD2 LEU A 130 -26.623 -9.190 5.222 1.00 0.00 C ATOM 0 H LEU A 130 -26.332 -6.363 2.012 1.00 0.00 H new ATOM 0 HA LEU A 130 -27.135 -9.201 2.258 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -28.556 -6.884 3.583 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -28.800 -8.599 3.851 1.00 0.00 H new ATOM 0 HG LEU A 130 -26.219 -7.199 4.572 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -27.071 -7.090 6.880 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -28.046 -6.101 5.768 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -28.654 -7.680 6.318 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -25.948 -9.134 6.076 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -27.485 -9.805 5.481 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -26.101 -9.635 4.375 1.00 0.00 H new ATOM 641 N ASP A 131 -29.383 -8.724 1.030 1.00 0.00 N ATOM 642 CA ASP A 131 -30.399 -8.558 -0.003 1.00 0.00 C ATOM 643 C ASP A 131 -31.656 -7.912 0.571 1.00 0.00 C ATOM 644 O ASP A 131 -31.687 -7.521 1.737 1.00 0.00 O ATOM 645 CB ASP A 131 -30.745 -9.909 -0.630 1.00 0.00 C ATOM 646 CG ASP A 131 -31.871 -10.615 0.101 1.00 0.00 C ATOM 647 OD1 ASP A 131 -32.079 -10.320 1.297 1.00 0.00 O ATOM 648 OD2 ASP A 131 -32.544 -11.461 -0.523 1.00 0.00 O ATOM 0 H ASP A 131 -29.505 -9.552 1.612 1.00 0.00 H new ATOM 0 HA ASP A 131 -29.995 -7.902 -0.774 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -31.029 -9.761 -1.672 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -29.860 -10.545 -0.628 1.00 0.00 H new ATOM 653 N GLN A 132 -32.690 -7.803 -0.257 1.00 0.00 N ATOM 654 CA GLN A 132 -33.949 -7.202 0.168 1.00 0.00 C ATOM 655 C GLN A 132 -34.416 -7.798 1.492 1.00 0.00 C ATOM 656 O GLN A 132 -34.773 -7.072 2.420 1.00 0.00 O ATOM 657 CB GLN A 132 -35.022 -7.405 -0.903 1.00 0.00 C ATOM 658 CG GLN A 132 -36.428 -7.080 -0.424 1.00 0.00 C ATOM 659 CD GLN A 132 -37.459 -7.178 -1.532 1.00 0.00 C ATOM 660 OE1 GLN A 132 -37.116 -7.355 -2.701 1.00 0.00 O ATOM 661 NE2 GLN A 132 -38.731 -7.064 -1.169 1.00 0.00 N ATOM 0 H GLN A 132 -32.681 -8.123 -1.226 1.00 0.00 H new ATOM 0 HA GLN A 132 -33.784 -6.134 0.309 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -34.787 -6.780 -1.764 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -34.993 -8.440 -1.243 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -36.700 -7.762 0.382 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -36.442 -6.073 -0.008 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -38.970 -6.918 -0.188 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -39.469 -7.122 -1.871 1.00 0.00 H new ATOM 670 N THR A 133 -34.412 -9.125 1.572 1.00 0.00 N ATOM 671 CA THR A 133 -34.837 -9.819 2.782 1.00 0.00 C ATOM 672 C THR A 133 -33.885 -9.540 3.939 1.00 0.00 C ATOM 673 O THR A 133 -34.258 -9.659 5.105 1.00 0.00 O ATOM 674 CB THR A 133 -34.922 -11.340 2.557 1.00 0.00 C ATOM 675 OG1 THR A 133 -33.606 -11.896 2.469 1.00 0.00 O ATOM 676 CG2 THR A 133 -35.697 -11.657 1.286 1.00 0.00 C ATOM 0 H THR A 133 -34.119 -9.741 0.813 1.00 0.00 H new ATOM 0 HA THR A 133 -35.828 -9.440 3.032 1.00 0.00 H new ATOM 0 HB THR A 133 -35.447 -11.781 3.404 1.00 0.00 H new ATOM 0 HG1 THR A 133 -32.966 -11.188 2.245 1.00 0.00 H new ATOM 0 HG21 THR A 133 -35.744 -12.737 1.148 1.00 0.00 H new ATOM 0 HG22 THR A 133 -36.708 -11.257 1.367 1.00 0.00 H new ATOM 0 HG23 THR A 133 -35.195 -11.204 0.431 1.00 0.00 H new ATOM 684 N GLY A 134 -32.652 -9.168 3.608 1.00 0.00 N ATOM 685 CA GLY A 134 -31.665 -8.877 4.631 1.00 0.00 C ATOM 686 C GLY A 134 -30.764 -10.061 4.921 1.00 0.00 C ATOM 687 O GLY A 134 -30.171 -10.152 5.996 1.00 0.00 O ATOM 0 H GLY A 134 -32.319 -9.063 2.650 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -31.056 -8.030 4.314 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -32.174 -8.578 5.548 1.00 0.00 H new ATOM 691 N VAL A 135 -30.661 -10.974 3.959 1.00 0.00 N ATOM 692 CA VAL A 135 -29.827 -12.159 4.116 1.00 0.00 C ATOM 693 C VAL A 135 -28.518 -12.016 3.347 1.00 0.00 C ATOM 694 O VAL A 135 -28.514 -11.648 2.173 1.00 0.00 O ATOM 695 CB VAL A 135 -30.556 -13.427 3.634 1.00 0.00 C ATOM 696 CG1 VAL A 135 -31.846 -13.630 4.414 1.00 0.00 C ATOM 697 CG2 VAL A 135 -30.833 -13.347 2.141 1.00 0.00 C ATOM 0 H VAL A 135 -31.145 -10.915 3.063 1.00 0.00 H new ATOM 0 HA VAL A 135 -29.612 -12.255 5.180 1.00 0.00 H new ATOM 0 HB VAL A 135 -29.911 -14.287 3.815 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -32.348 -14.531 4.060 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -31.617 -13.735 5.474 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -32.499 -12.770 4.267 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -31.349 -14.251 1.818 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -31.458 -12.479 1.933 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -29.891 -13.254 1.601 1.00 0.00 H new ATOM 707 N SER A 136 -27.409 -12.309 4.018 1.00 0.00 N ATOM 708 CA SER A 136 -26.092 -12.209 3.398 1.00 0.00 C ATOM 709 C SER A 136 -26.132 -12.702 1.955 1.00 0.00 C ATOM 710 O SER A 136 -26.411 -13.872 1.693 1.00 0.00 O ATOM 711 CB SER A 136 -25.067 -13.018 4.196 1.00 0.00 C ATOM 712 OG SER A 136 -23.746 -12.605 3.895 1.00 0.00 O ATOM 0 H SER A 136 -27.396 -12.617 4.990 1.00 0.00 H new ATOM 0 HA SER A 136 -25.797 -11.160 3.398 1.00 0.00 H new ATOM 0 HB2 SER A 136 -25.255 -12.898 5.263 1.00 0.00 H new ATOM 0 HB3 SER A 136 -25.180 -14.078 3.970 1.00 0.00 H new ATOM 0 HG SER A 136 -23.225 -13.375 3.585 1.00 0.00 H new ATOM 718 N LYS A 137 -25.852 -11.799 1.021 1.00 0.00 N ATOM 719 CA LYS A 137 -25.854 -12.139 -0.397 1.00 0.00 C ATOM 720 C LYS A 137 -24.783 -13.179 -0.709 1.00 0.00 C ATOM 721 O LYS A 137 -24.921 -13.964 -1.646 1.00 0.00 O ATOM 722 CB LYS A 137 -25.624 -10.885 -1.243 1.00 0.00 C ATOM 723 CG LYS A 137 -26.672 -9.806 -1.029 1.00 0.00 C ATOM 724 CD LYS A 137 -26.857 -8.953 -2.273 1.00 0.00 C ATOM 725 CE LYS A 137 -25.920 -7.756 -2.273 1.00 0.00 C ATOM 726 NZ LYS A 137 -26.297 -6.756 -3.310 1.00 0.00 N ATOM 0 H LYS A 137 -25.621 -10.826 1.221 1.00 0.00 H new ATOM 0 HA LYS A 137 -26.828 -12.562 -0.642 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -24.641 -10.476 -1.011 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -25.612 -11.165 -2.296 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -27.622 -10.268 -0.759 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -26.377 -9.172 -0.193 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -26.675 -9.559 -3.161 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -27.889 -8.608 -2.328 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -25.934 -7.284 -1.291 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -24.899 -8.094 -2.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -25.634 -5.955 -3.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -26.259 -7.199 -4.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -27.262 -6.414 -3.128 1.00 0.00 H new ATOM 740 N GLY A 138 -23.716 -13.179 0.084 1.00 0.00 N ATOM 741 CA GLY A 138 -22.637 -14.128 -0.123 1.00 0.00 C ATOM 742 C GLY A 138 -21.294 -13.449 -0.305 1.00 0.00 C ATOM 743 O GLY A 138 -20.330 -14.074 -0.747 1.00 0.00 O ATOM 0 H GLY A 138 -23.579 -12.539 0.866 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -22.585 -14.806 0.729 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -22.855 -14.736 -1.001 1.00 0.00 H new ATOM 747 N TYR A 139 -21.231 -12.167 0.036 1.00 0.00 N ATOM 748 CA TYR A 139 -19.997 -11.401 -0.096 1.00 0.00 C ATOM 749 C TYR A 139 -20.053 -10.129 0.744 1.00 0.00 C ATOM 750 O TYR A 139 -21.100 -9.772 1.282 1.00 0.00 O ATOM 751 CB TYR A 139 -19.746 -11.047 -1.562 1.00 0.00 C ATOM 752 CG TYR A 139 -20.578 -9.885 -2.056 1.00 0.00 C ATOM 753 CD1 TYR A 139 -20.115 -8.579 -1.950 1.00 0.00 C ATOM 754 CD2 TYR A 139 -21.828 -10.093 -2.626 1.00 0.00 C ATOM 755 CE1 TYR A 139 -20.872 -7.514 -2.399 1.00 0.00 C ATOM 756 CE2 TYR A 139 -22.591 -9.034 -3.079 1.00 0.00 C ATOM 757 CZ TYR A 139 -22.109 -7.747 -2.963 1.00 0.00 C ATOM 758 OH TYR A 139 -22.867 -6.690 -3.412 1.00 0.00 O ATOM 0 H TYR A 139 -22.020 -11.636 0.406 1.00 0.00 H new ATOM 0 HA TYR A 139 -19.175 -12.019 0.267 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -18.690 -10.809 -1.694 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -19.955 -11.921 -2.179 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -19.147 -8.393 -1.509 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -22.210 -11.099 -2.716 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -20.497 -6.505 -2.309 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -23.560 -9.213 -3.522 1.00 0.00 H new ATOM 0 HH TYR A 139 -23.586 -7.024 -3.988 1.00 0.00 H new ATOM 768 N GLY A 140 -18.916 -9.448 0.852 1.00 0.00 N ATOM 769 CA GLY A 140 -18.856 -8.222 1.626 1.00 0.00 C ATOM 770 C GLY A 140 -17.527 -7.509 1.481 1.00 0.00 C ATOM 771 O GLY A 140 -16.783 -7.753 0.530 1.00 0.00 O ATOM 0 H GLY A 140 -18.035 -9.724 0.417 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -19.658 -7.556 1.309 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -19.029 -8.451 2.678 1.00 0.00 H new ATOM 775 N PHE A 141 -17.226 -6.622 2.424 1.00 0.00 N ATOM 776 CA PHE A 141 -15.978 -5.868 2.395 1.00 0.00 C ATOM 777 C PHE A 141 -15.567 -5.443 3.802 1.00 0.00 C ATOM 778 O PHE A 141 -16.412 -5.116 4.635 1.00 0.00 O ATOM 779 CB PHE A 141 -16.122 -4.637 1.499 1.00 0.00 C ATOM 780 CG PHE A 141 -16.862 -4.908 0.221 1.00 0.00 C ATOM 781 CD1 PHE A 141 -16.191 -5.376 -0.898 1.00 0.00 C ATOM 782 CD2 PHE A 141 -18.229 -4.697 0.137 1.00 0.00 C ATOM 783 CE1 PHE A 141 -16.870 -5.626 -2.076 1.00 0.00 C ATOM 784 CE2 PHE A 141 -18.913 -4.946 -1.038 1.00 0.00 C ATOM 785 CZ PHE A 141 -18.233 -5.412 -2.145 1.00 0.00 C ATOM 0 H PHE A 141 -17.830 -6.408 3.218 1.00 0.00 H new ATOM 0 HA PHE A 141 -15.201 -6.515 1.988 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -16.642 -3.854 2.051 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -15.130 -4.253 1.261 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -15.126 -5.547 -0.849 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -18.767 -4.334 1.000 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -16.335 -5.988 -2.942 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -19.978 -4.776 -1.090 1.00 0.00 H new ATOM 0 HZ PHE A 141 -18.766 -5.609 -3.064 1.00 0.00 H new ATOM 795 N VAL A 142 -14.263 -5.450 4.058 1.00 0.00 N ATOM 796 CA VAL A 142 -13.738 -5.065 5.363 1.00 0.00 C ATOM 797 C VAL A 142 -12.889 -3.803 5.263 1.00 0.00 C ATOM 798 O VAL A 142 -12.766 -3.207 4.193 1.00 0.00 O ATOM 799 CB VAL A 142 -12.892 -6.192 5.983 1.00 0.00 C ATOM 800 CG1 VAL A 142 -13.778 -7.352 6.411 1.00 0.00 C ATOM 801 CG2 VAL A 142 -11.826 -6.658 5.003 1.00 0.00 C ATOM 0 H VAL A 142 -13.550 -5.718 3.379 1.00 0.00 H new ATOM 0 HA VAL A 142 -14.597 -4.872 6.005 1.00 0.00 H new ATOM 0 HB VAL A 142 -12.393 -5.802 6.870 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -13.162 -8.139 6.847 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -14.500 -7.005 7.150 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -14.308 -7.745 5.543 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -11.237 -7.455 5.458 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -12.303 -7.031 4.097 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -11.173 -5.822 4.752 1.00 0.00 H new ATOM 811 N LYS A 143 -12.303 -3.400 6.385 1.00 0.00 N ATOM 812 CA LYS A 143 -11.463 -2.209 6.426 1.00 0.00 C ATOM 813 C LYS A 143 -10.258 -2.424 7.337 1.00 0.00 C ATOM 814 O LYS A 143 -10.310 -3.221 8.274 1.00 0.00 O ATOM 815 CB LYS A 143 -12.273 -1.004 6.909 1.00 0.00 C ATOM 816 CG LYS A 143 -13.496 -0.713 6.057 1.00 0.00 C ATOM 817 CD LYS A 143 -14.610 -0.083 6.878 1.00 0.00 C ATOM 818 CE LYS A 143 -15.977 -0.372 6.277 1.00 0.00 C ATOM 819 NZ LYS A 143 -16.135 -1.811 5.927 1.00 0.00 N ATOM 0 H LYS A 143 -12.395 -3.882 7.279 1.00 0.00 H new ATOM 0 HA LYS A 143 -11.102 -2.015 5.416 1.00 0.00 H new ATOM 0 HB2 LYS A 143 -12.590 -1.178 7.937 1.00 0.00 H new ATOM 0 HB3 LYS A 143 -11.629 -0.124 6.919 1.00 0.00 H new ATOM 0 HG2 LYS A 143 -13.221 -0.045 5.241 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -13.854 -1.638 5.605 1.00 0.00 H new ATOM 0 HD2 LYS A 143 -14.572 -0.465 7.898 1.00 0.00 H new ATOM 0 HD3 LYS A 143 -14.457 0.995 6.935 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -16.754 -0.083 6.985 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -16.117 0.237 5.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -17.147 -2.048 5.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -15.693 -1.994 5.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -15.676 -2.397 6.653 1.00 0.00 H new ATOM 833 N PHE A 144 -9.175 -1.707 7.057 1.00 0.00 N ATOM 834 CA PHE A 144 -7.958 -1.819 7.852 1.00 0.00 C ATOM 835 C PHE A 144 -7.234 -0.478 7.930 1.00 0.00 C ATOM 836 O PHE A 144 -6.981 0.166 6.911 1.00 0.00 O ATOM 837 CB PHE A 144 -7.029 -2.878 7.254 1.00 0.00 C ATOM 838 CG PHE A 144 -7.654 -4.240 7.162 1.00 0.00 C ATOM 839 CD1 PHE A 144 -7.621 -5.107 8.242 1.00 0.00 C ATOM 840 CD2 PHE A 144 -8.276 -4.654 5.995 1.00 0.00 C ATOM 841 CE1 PHE A 144 -8.195 -6.362 8.159 1.00 0.00 C ATOM 842 CE2 PHE A 144 -8.852 -5.907 5.906 1.00 0.00 C ATOM 843 CZ PHE A 144 -8.812 -6.762 6.990 1.00 0.00 C ATOM 0 H PHE A 144 -9.115 -1.042 6.286 1.00 0.00 H new ATOM 0 HA PHE A 144 -8.239 -2.120 8.861 1.00 0.00 H new ATOM 0 HB2 PHE A 144 -6.722 -2.560 6.258 1.00 0.00 H new ATOM 0 HB3 PHE A 144 -6.126 -2.942 7.861 1.00 0.00 H new ATOM 0 HD1 PHE A 144 -7.141 -4.799 9.159 1.00 0.00 H new ATOM 0 HD2 PHE A 144 -8.311 -3.989 5.145 1.00 0.00 H new ATOM 0 HE1 PHE A 144 -8.161 -7.029 9.008 1.00 0.00 H new ATOM 0 HE2 PHE A 144 -9.333 -6.217 4.990 1.00 0.00 H new ATOM 0 HZ PHE A 144 -9.262 -7.741 6.924 1.00 0.00 H new ATOM 853 N THR A 145 -6.904 -0.061 9.149 1.00 0.00 N ATOM 854 CA THR A 145 -6.211 1.204 9.362 1.00 0.00 C ATOM 855 C THR A 145 -4.802 1.164 8.782 1.00 0.00 C ATOM 856 O THR A 145 -4.144 2.196 8.653 1.00 0.00 O ATOM 857 CB THR A 145 -6.128 1.552 10.860 1.00 0.00 C ATOM 858 OG1 THR A 145 -5.568 0.454 11.589 1.00 0.00 O ATOM 859 CG2 THR A 145 -7.504 1.887 11.415 1.00 0.00 C ATOM 0 H THR A 145 -7.105 -0.581 10.003 1.00 0.00 H new ATOM 0 HA THR A 145 -6.790 1.972 8.849 1.00 0.00 H new ATOM 0 HB THR A 145 -5.486 2.426 10.972 1.00 0.00 H new ATOM 0 HG1 THR A 145 -5.518 0.685 12.540 1.00 0.00 H new ATOM 0 HG21 THR A 145 -7.420 2.129 12.474 1.00 0.00 H new ATOM 0 HG22 THR A 145 -7.914 2.743 10.878 1.00 0.00 H new ATOM 0 HG23 THR A 145 -8.165 1.029 11.290 1.00 0.00 H new ATOM 867 N ASP A 146 -4.344 -0.034 8.434 1.00 0.00 N ATOM 868 CA ASP A 146 -3.013 -0.208 7.866 1.00 0.00 C ATOM 869 C ASP A 146 -3.081 -0.968 6.545 1.00 0.00 C ATOM 870 O ASP A 146 -3.783 -1.972 6.432 1.00 0.00 O ATOM 871 CB ASP A 146 -2.108 -0.951 8.850 1.00 0.00 C ATOM 872 CG ASP A 146 -0.651 -0.559 8.705 1.00 0.00 C ATOM 873 OD1 ASP A 146 -0.332 0.629 8.919 1.00 0.00 O ATOM 874 OD2 ASP A 146 0.172 -1.441 8.378 1.00 0.00 O ATOM 0 H ASP A 146 -4.875 -0.899 8.536 1.00 0.00 H new ATOM 0 HA ASP A 146 -2.595 0.780 7.675 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -2.437 -0.745 9.869 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -2.210 -2.025 8.693 1.00 0.00 H new ATOM 879 N GLU A 147 -2.347 -0.481 5.549 1.00 0.00 N ATOM 880 CA GLU A 147 -2.327 -1.114 4.236 1.00 0.00 C ATOM 881 C GLU A 147 -1.416 -2.338 4.236 1.00 0.00 C ATOM 882 O GLU A 147 -1.684 -3.326 3.550 1.00 0.00 O ATOM 883 CB GLU A 147 -1.860 -0.118 3.172 1.00 0.00 C ATOM 884 CG GLU A 147 -2.303 -0.479 1.764 1.00 0.00 C ATOM 885 CD GLU A 147 -1.788 0.495 0.722 1.00 0.00 C ATOM 886 OE1 GLU A 147 -0.768 1.164 0.990 1.00 0.00 O ATOM 887 OE2 GLU A 147 -2.404 0.589 -0.359 1.00 0.00 O ATOM 0 H GLU A 147 -1.759 0.349 5.627 1.00 0.00 H new ATOM 0 HA GLU A 147 -3.341 -1.437 4.001 1.00 0.00 H new ATOM 0 HB2 GLU A 147 -2.241 0.872 3.421 1.00 0.00 H new ATOM 0 HB3 GLU A 147 -0.772 -0.056 3.197 1.00 0.00 H new ATOM 0 HG2 GLU A 147 -1.952 -1.482 1.523 1.00 0.00 H new ATOM 0 HG3 GLU A 147 -3.392 -0.504 1.725 1.00 0.00 H new ATOM 894 N LEU A 148 -0.338 -2.266 5.009 1.00 0.00 N ATOM 895 CA LEU A 148 0.614 -3.368 5.100 1.00 0.00 C ATOM 896 C LEU A 148 -0.092 -4.668 5.471 1.00 0.00 C ATOM 897 O LEU A 148 -0.053 -5.643 4.720 1.00 0.00 O ATOM 898 CB LEU A 148 1.696 -3.049 6.132 1.00 0.00 C ATOM 899 CG LEU A 148 2.489 -1.763 5.898 1.00 0.00 C ATOM 900 CD1 LEU A 148 3.295 -1.400 7.135 1.00 0.00 C ATOM 901 CD2 LEU A 148 3.401 -1.911 4.689 1.00 0.00 C ATOM 0 H LEU A 148 -0.101 -1.456 5.582 1.00 0.00 H new ATOM 0 HA LEU A 148 1.080 -3.495 4.123 1.00 0.00 H new ATOM 0 HB2 LEU A 148 1.227 -2.989 7.114 1.00 0.00 H new ATOM 0 HB3 LEU A 148 2.397 -3.883 6.164 1.00 0.00 H new ATOM 0 HG LEU A 148 1.784 -0.956 5.699 1.00 0.00 H new ATOM 0 HD11 LEU A 148 3.853 -0.482 6.949 1.00 0.00 H new ATOM 0 HD12 LEU A 148 2.620 -1.251 7.978 1.00 0.00 H new ATOM 0 HD13 LEU A 148 3.991 -2.207 7.366 1.00 0.00 H new ATOM 0 HD21 LEU A 148 3.958 -0.986 4.538 1.00 0.00 H new ATOM 0 HD22 LEU A 148 4.099 -2.731 4.858 1.00 0.00 H new ATOM 0 HD23 LEU A 148 2.801 -2.122 3.804 1.00 0.00 H new ATOM 913 N GLU A 149 -0.738 -4.674 6.633 1.00 0.00 N ATOM 914 CA GLU A 149 -1.453 -5.855 7.102 1.00 0.00 C ATOM 915 C GLU A 149 -2.630 -6.178 6.186 1.00 0.00 C ATOM 916 O GLU A 149 -2.917 -7.344 5.916 1.00 0.00 O ATOM 917 CB GLU A 149 -1.951 -5.642 8.533 1.00 0.00 C ATOM 918 CG GLU A 149 -0.833 -5.459 9.546 1.00 0.00 C ATOM 919 CD GLU A 149 0.335 -6.395 9.300 1.00 0.00 C ATOM 920 OE1 GLU A 149 0.303 -7.531 9.817 1.00 0.00 O ATOM 921 OE2 GLU A 149 1.280 -5.991 8.591 1.00 0.00 O ATOM 0 H GLU A 149 -0.781 -3.875 7.266 1.00 0.00 H new ATOM 0 HA GLU A 149 -0.761 -6.697 7.087 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -2.598 -4.765 8.557 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -2.560 -6.496 8.828 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -0.481 -4.428 9.511 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -1.225 -5.629 10.549 1.00 0.00 H new ATOM 928 N GLN A 150 -3.307 -5.137 5.712 1.00 0.00 N ATOM 929 CA GLN A 150 -4.453 -5.310 4.827 1.00 0.00 C ATOM 930 C GLN A 150 -4.127 -6.284 3.699 1.00 0.00 C ATOM 931 O GLN A 150 -4.941 -7.139 3.349 1.00 0.00 O ATOM 932 CB GLN A 150 -4.883 -3.963 4.245 1.00 0.00 C ATOM 933 CG GLN A 150 -6.107 -4.050 3.348 1.00 0.00 C ATOM 934 CD GLN A 150 -5.748 -4.265 1.891 1.00 0.00 C ATOM 935 OE1 GLN A 150 -4.933 -5.126 1.561 1.00 0.00 O ATOM 936 NE2 GLN A 150 -6.358 -3.481 1.009 1.00 0.00 N ATOM 0 H GLN A 150 -3.082 -4.165 5.926 1.00 0.00 H new ATOM 0 HA GLN A 150 -5.274 -5.723 5.413 1.00 0.00 H new ATOM 0 HB2 GLN A 150 -5.091 -3.273 5.063 1.00 0.00 H new ATOM 0 HB3 GLN A 150 -4.055 -3.542 3.675 1.00 0.00 H new ATOM 0 HG2 GLN A 150 -6.743 -4.868 3.686 1.00 0.00 H new ATOM 0 HG3 GLN A 150 -6.689 -3.133 3.444 1.00 0.00 H new ATOM 0 HE21 GLN A 150 -7.027 -2.780 1.327 1.00 0.00 H new ATOM 0 HE22 GLN A 150 -6.157 -3.580 0.014 1.00 0.00 H new ATOM 945 N LYS A 151 -2.933 -6.148 3.133 1.00 0.00 N ATOM 946 CA LYS A 151 -2.498 -7.016 2.045 1.00 0.00 C ATOM 947 C LYS A 151 -2.057 -8.376 2.577 1.00 0.00 C ATOM 948 O LYS A 151 -2.125 -9.381 1.870 1.00 0.00 O ATOM 949 CB LYS A 151 -1.352 -6.362 1.271 1.00 0.00 C ATOM 950 CG LYS A 151 -1.740 -5.059 0.593 1.00 0.00 C ATOM 951 CD LYS A 151 -2.542 -5.307 -0.674 1.00 0.00 C ATOM 952 CE LYS A 151 -2.394 -4.159 -1.660 1.00 0.00 C ATOM 953 NZ LYS A 151 -2.940 -2.885 -1.115 1.00 0.00 N ATOM 0 H LYS A 151 -2.248 -5.444 3.410 1.00 0.00 H new ATOM 0 HA LYS A 151 -3.343 -7.166 1.373 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -0.524 -6.173 1.955 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -0.989 -7.060 0.517 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -2.325 -4.450 1.282 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -0.841 -4.492 0.351 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -2.210 -6.234 -1.141 1.00 0.00 H new ATOM 0 HD3 LYS A 151 -3.594 -5.437 -0.420 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -1.341 -4.026 -1.907 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -2.910 -4.408 -2.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 -2.851 -2.135 -1.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 -3.943 -3.013 -0.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 -2.408 -2.616 -0.263 1.00 0.00 H new ATOM 967 N ARG A 152 -1.605 -8.399 3.826 1.00 0.00 N ATOM 968 CA ARG A 152 -1.152 -9.635 4.452 1.00 0.00 C ATOM 969 C ARG A 152 -2.308 -10.619 4.611 1.00 0.00 C ATOM 970 O ARG A 152 -2.135 -11.827 4.450 1.00 0.00 O ATOM 971 CB ARG A 152 -0.527 -9.342 5.817 1.00 0.00 C ATOM 972 CG ARG A 152 0.803 -8.611 5.733 1.00 0.00 C ATOM 973 CD ARG A 152 1.649 -8.848 6.975 1.00 0.00 C ATOM 974 NE ARG A 152 3.078 -8.766 6.687 1.00 0.00 N ATOM 975 CZ ARG A 152 4.023 -8.909 7.610 1.00 0.00 C ATOM 976 NH1 ARG A 152 3.691 -9.141 8.873 1.00 0.00 N ATOM 977 NH2 ARG A 152 5.303 -8.821 7.271 1.00 0.00 N ATOM 0 H ARG A 152 -1.543 -7.576 4.425 1.00 0.00 H new ATOM 0 HA ARG A 152 -0.399 -10.086 3.805 1.00 0.00 H new ATOM 0 HB2 ARG A 152 -1.224 -8.745 6.406 1.00 0.00 H new ATOM 0 HB3 ARG A 152 -0.383 -10.282 6.350 1.00 0.00 H new ATOM 0 HG2 ARG A 152 1.348 -8.946 4.851 1.00 0.00 H new ATOM 0 HG3 ARG A 152 0.625 -7.543 5.611 1.00 0.00 H new ATOM 0 HD2 ARG A 152 1.390 -8.112 7.736 1.00 0.00 H new ATOM 0 HD3 ARG A 152 1.418 -9.830 7.389 1.00 0.00 H new ATOM 0 HE ARG A 152 3.367 -8.589 5.725 1.00 0.00 H new ATOM 0 HH11 ARG A 152 2.708 -9.210 9.138 1.00 0.00 H new ATOM 0 HH12 ARG A 152 4.418 -9.250 9.580 1.00 0.00 H new ATOM 0 HH21 ARG A 152 5.563 -8.643 6.301 1.00 0.00 H new ATOM 0 HH22 ARG A 152 6.027 -8.931 7.981 1.00 0.00 H new ATOM 991 N ALA A 153 -3.486 -10.093 4.929 1.00 0.00 N ATOM 992 CA ALA A 153 -4.670 -10.924 5.108 1.00 0.00 C ATOM 993 C ALA A 153 -5.087 -11.576 3.794 1.00 0.00 C ATOM 994 O ALA A 153 -5.552 -12.717 3.776 1.00 0.00 O ATOM 995 CB ALA A 153 -5.814 -10.097 5.675 1.00 0.00 C ATOM 0 H ALA A 153 -3.646 -9.095 5.068 1.00 0.00 H new ATOM 0 HA ALA A 153 -4.424 -11.717 5.815 1.00 0.00 H new ATOM 0 HB1 ALA A 153 -6.692 -10.730 5.804 1.00 0.00 H new ATOM 0 HB2 ALA A 153 -5.521 -9.683 6.640 1.00 0.00 H new ATOM 0 HB3 ALA A 153 -6.050 -9.284 4.988 1.00 0.00 H new ATOM 1001 N LEU A 154 -4.919 -10.846 2.697 1.00 0.00 N ATOM 1002 CA LEU A 154 -5.279 -11.354 1.378 1.00 0.00 C ATOM 1003 C LEU A 154 -4.633 -12.712 1.122 1.00 0.00 C ATOM 1004 O LEU A 154 -5.262 -13.619 0.577 1.00 0.00 O ATOM 1005 CB LEU A 154 -4.853 -10.362 0.294 1.00 0.00 C ATOM 1006 CG LEU A 154 -5.756 -9.142 0.110 1.00 0.00 C ATOM 1007 CD1 LEU A 154 -5.023 -8.045 -0.648 1.00 0.00 C ATOM 1008 CD2 LEU A 154 -7.036 -9.530 -0.616 1.00 0.00 C ATOM 0 H LEU A 154 -4.536 -9.901 2.695 1.00 0.00 H new ATOM 0 HA LEU A 154 -6.362 -11.476 1.346 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -3.846 -10.013 0.524 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -4.796 -10.894 -0.656 1.00 0.00 H new ATOM 0 HG LEU A 154 -6.023 -8.759 1.095 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -5.681 -7.185 -0.770 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -4.136 -7.747 -0.089 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -4.726 -8.416 -1.629 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -7.666 -8.649 -0.738 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -6.789 -9.938 -1.596 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -7.571 -10.281 -0.035 1.00 0.00 H new ATOM 1020 N THR A 155 -3.371 -12.846 1.521 1.00 0.00 N ATOM 1021 CA THR A 155 -2.640 -14.093 1.337 1.00 0.00 C ATOM 1022 C THR A 155 -2.776 -14.996 2.557 1.00 0.00 C ATOM 1023 O THR A 155 -2.858 -16.218 2.430 1.00 0.00 O ATOM 1024 CB THR A 155 -1.145 -13.833 1.069 1.00 0.00 C ATOM 1025 OG1 THR A 155 -0.468 -15.072 0.831 1.00 0.00 O ATOM 1026 CG2 THR A 155 -0.502 -13.115 2.246 1.00 0.00 C ATOM 0 H THR A 155 -2.835 -12.106 1.974 1.00 0.00 H new ATOM 0 HA THR A 155 -3.076 -14.590 0.471 1.00 0.00 H new ATOM 0 HB THR A 155 -1.061 -13.198 0.187 1.00 0.00 H new ATOM 0 HG1 THR A 155 0.481 -14.899 0.660 1.00 0.00 H new ATOM 0 HG21 THR A 155 0.553 -12.942 2.034 1.00 0.00 H new ATOM 0 HG22 THR A 155 -1.001 -12.159 2.406 1.00 0.00 H new ATOM 0 HG23 THR A 155 -0.597 -13.728 3.142 1.00 0.00 H new ATOM 1034 N GLU A 156 -2.801 -14.388 3.739 1.00 0.00 N ATOM 1035 CA GLU A 156 -2.928 -15.139 4.982 1.00 0.00 C ATOM 1036 C GLU A 156 -4.365 -15.609 5.189 1.00 0.00 C ATOM 1037 O GLU A 156 -4.636 -16.810 5.236 1.00 0.00 O ATOM 1038 CB GLU A 156 -2.484 -14.282 6.169 1.00 0.00 C ATOM 1039 CG GLU A 156 -0.975 -14.205 6.333 1.00 0.00 C ATOM 1040 CD GLU A 156 -0.420 -15.342 7.169 1.00 0.00 C ATOM 1041 OE1 GLU A 156 -0.964 -15.593 8.265 1.00 0.00 O ATOM 1042 OE2 GLU A 156 0.558 -15.980 6.727 1.00 0.00 O ATOM 0 H GLU A 156 -2.735 -13.378 3.862 1.00 0.00 H new ATOM 0 HA GLU A 156 -2.283 -16.015 4.915 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -2.880 -13.274 6.047 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -2.920 -14.687 7.082 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -0.505 -14.219 5.350 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -0.712 -13.255 6.798 1.00 0.00 H new ATOM 1049 N CYS A 157 -5.281 -14.655 5.314 1.00 0.00 N ATOM 1050 CA CYS A 157 -6.690 -14.970 5.518 1.00 0.00 C ATOM 1051 C CYS A 157 -7.312 -15.531 4.244 1.00 0.00 C ATOM 1052 O CYS A 157 -8.501 -15.849 4.210 1.00 0.00 O ATOM 1053 CB CYS A 157 -7.454 -13.723 5.966 1.00 0.00 C ATOM 1054 SG CYS A 157 -7.354 -13.393 7.741 1.00 0.00 S ATOM 0 H CYS A 157 -5.073 -13.657 5.278 1.00 0.00 H new ATOM 0 HA CYS A 157 -6.757 -15.728 6.298 1.00 0.00 H new ATOM 0 HB2 CYS A 157 -7.068 -12.859 5.425 1.00 0.00 H new ATOM 0 HB3 CYS A 157 -8.502 -13.832 5.686 1.00 0.00 H new ATOM 0 HG CYS A 157 -8.446 -12.810 8.136 1.00 0.00 H new ATOM 1060 N GLN A 158 -6.501 -15.649 3.198 1.00 0.00 N ATOM 1061 CA GLN A 158 -6.973 -16.170 1.920 1.00 0.00 C ATOM 1062 C GLN A 158 -7.868 -17.388 2.126 1.00 0.00 C ATOM 1063 O GLN A 158 -7.559 -18.269 2.926 1.00 0.00 O ATOM 1064 CB GLN A 158 -5.787 -16.539 1.027 1.00 0.00 C ATOM 1065 CG GLN A 158 -6.155 -16.693 -0.440 1.00 0.00 C ATOM 1066 CD GLN A 158 -7.230 -15.716 -0.878 1.00 0.00 C ATOM 1067 OE1 GLN A 158 -8.402 -16.076 -0.994 1.00 0.00 O ATOM 1068 NE2 GLN A 158 -6.835 -14.472 -1.122 1.00 0.00 N ATOM 0 H GLN A 158 -5.514 -15.391 3.210 1.00 0.00 H new ATOM 0 HA GLN A 158 -7.558 -15.391 1.432 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -5.019 -15.771 1.122 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -5.351 -17.472 1.384 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -5.265 -16.546 -1.051 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -6.500 -17.711 -0.619 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -5.853 -14.218 -1.013 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -7.513 -13.770 -1.419 1.00 0.00 H new ATOM 1077 N GLY A 159 -8.979 -17.429 1.397 1.00 0.00 N ATOM 1078 CA GLY A 159 -9.902 -18.543 1.515 1.00 0.00 C ATOM 1079 C GLY A 159 -10.187 -18.909 2.958 1.00 0.00 C ATOM 1080 O GLY A 159 -10.454 -20.070 3.269 1.00 0.00 O ATOM 0 H GLY A 159 -9.256 -16.711 0.727 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -10.837 -18.290 1.016 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -9.489 -19.409 0.998 1.00 0.00 H new ATOM 1084 N ALA A 160 -10.130 -17.918 3.841 1.00 0.00 N ATOM 1085 CA ALA A 160 -10.384 -18.142 5.258 1.00 0.00 C ATOM 1086 C ALA A 160 -11.681 -18.917 5.468 1.00 0.00 C ATOM 1087 O ALA A 160 -12.770 -18.409 5.200 1.00 0.00 O ATOM 1088 CB ALA A 160 -10.435 -16.815 6.002 1.00 0.00 C ATOM 0 H ALA A 160 -9.910 -16.952 3.600 1.00 0.00 H new ATOM 0 HA ALA A 160 -9.565 -18.740 5.658 1.00 0.00 H new ATOM 0 HB1 ALA A 160 -10.625 -16.998 7.060 1.00 0.00 H new ATOM 0 HB2 ALA A 160 -9.482 -16.298 5.889 1.00 0.00 H new ATOM 0 HB3 ALA A 160 -11.234 -16.198 5.591 1.00 0.00 H new ATOM 1094 N VAL A 161 -11.556 -20.151 5.947 1.00 0.00 N ATOM 1095 CA VAL A 161 -12.719 -20.996 6.192 1.00 0.00 C ATOM 1096 C VAL A 161 -13.287 -20.758 7.586 1.00 0.00 C ATOM 1097 O VAL A 161 -14.497 -20.836 7.797 1.00 0.00 O ATOM 1098 CB VAL A 161 -12.369 -22.489 6.040 1.00 0.00 C ATOM 1099 CG1 VAL A 161 -13.430 -23.356 6.701 1.00 0.00 C ATOM 1100 CG2 VAL A 161 -12.211 -22.852 4.572 1.00 0.00 C ATOM 0 H VAL A 161 -10.662 -20.587 6.173 1.00 0.00 H new ATOM 0 HA VAL A 161 -13.468 -20.728 5.447 1.00 0.00 H new ATOM 0 HB VAL A 161 -11.419 -22.675 6.541 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -13.166 -24.407 6.584 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -13.489 -23.113 7.762 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -14.396 -23.170 6.232 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -11.964 -23.910 4.483 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -13.144 -22.652 4.045 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -11.412 -22.255 4.134 1.00 0.00 H new ATOM 1110 N GLY A 162 -12.405 -20.466 8.537 1.00 0.00 N ATOM 1111 CA GLY A 162 -12.838 -20.220 9.901 1.00 0.00 C ATOM 1112 C GLY A 162 -14.080 -19.354 9.967 1.00 0.00 C ATOM 1113 O GLY A 162 -14.894 -19.491 10.882 1.00 0.00 O ATOM 0 H GLY A 162 -11.398 -20.395 8.388 1.00 0.00 H new ATOM 0 HA2 GLY A 162 -13.036 -21.172 10.393 1.00 0.00 H new ATOM 0 HA3 GLY A 162 -12.032 -19.737 10.453 1.00 0.00 H new ATOM 1117 N LEU A 163 -14.228 -18.459 8.997 1.00 0.00 N ATOM 1118 CA LEU A 163 -15.381 -17.565 8.949 1.00 0.00 C ATOM 1119 C LEU A 163 -16.521 -18.189 8.151 1.00 0.00 C ATOM 1120 O LEU A 163 -16.441 -18.317 6.930 1.00 0.00 O ATOM 1121 CB LEU A 163 -14.985 -16.223 8.331 1.00 0.00 C ATOM 1122 CG LEU A 163 -16.018 -15.102 8.444 1.00 0.00 C ATOM 1123 CD1 LEU A 163 -16.281 -14.763 9.903 1.00 0.00 C ATOM 1124 CD2 LEU A 163 -15.551 -13.869 7.684 1.00 0.00 C ATOM 0 H LEU A 163 -13.564 -18.332 8.233 1.00 0.00 H new ATOM 0 HA LEU A 163 -15.725 -17.400 9.970 1.00 0.00 H new ATOM 0 HB2 LEU A 163 -14.061 -15.887 8.802 1.00 0.00 H new ATOM 0 HB3 LEU A 163 -14.765 -16.382 7.275 1.00 0.00 H new ATOM 0 HG LEU A 163 -16.951 -15.447 7.999 1.00 0.00 H new ATOM 0 HD11 LEU A 163 -17.019 -13.963 9.963 1.00 0.00 H new ATOM 0 HD12 LEU A 163 -16.659 -15.645 10.419 1.00 0.00 H new ATOM 0 HD13 LEU A 163 -15.353 -14.437 10.374 1.00 0.00 H new ATOM 0 HD21 LEU A 163 -16.298 -13.081 7.775 1.00 0.00 H new ATOM 0 HD22 LEU A 163 -14.605 -13.522 8.100 1.00 0.00 H new ATOM 0 HD23 LEU A 163 -15.415 -14.120 6.632 1.00 0.00 H new ATOM 1136 N GLY A 164 -17.584 -18.575 8.850 1.00 0.00 N ATOM 1137 CA GLY A 164 -18.727 -19.179 8.190 1.00 0.00 C ATOM 1138 C GLY A 164 -18.436 -20.582 7.696 1.00 0.00 C ATOM 1139 O GLY A 164 -17.283 -21.013 7.672 1.00 0.00 O ATOM 0 H GLY A 164 -17.674 -18.480 9.862 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -19.569 -19.208 8.882 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -19.028 -18.556 7.348 1.00 0.00 H new ATOM 1143 N SER A 165 -19.485 -21.299 7.303 1.00 0.00 N ATOM 1144 CA SER A 165 -19.337 -22.664 6.813 1.00 0.00 C ATOM 1145 C SER A 165 -18.568 -22.688 5.496 1.00 0.00 C ATOM 1146 O SER A 165 -17.973 -23.702 5.129 1.00 0.00 O ATOM 1147 CB SER A 165 -20.710 -23.313 6.627 1.00 0.00 C ATOM 1148 OG SER A 165 -21.313 -23.598 7.877 1.00 0.00 O ATOM 0 H SER A 165 -20.446 -20.957 7.315 1.00 0.00 H new ATOM 0 HA SER A 165 -18.772 -23.231 7.554 1.00 0.00 H new ATOM 0 HB2 SER A 165 -21.355 -22.649 6.052 1.00 0.00 H new ATOM 0 HB3 SER A 165 -20.606 -24.233 6.052 1.00 0.00 H new ATOM 0 HG SER A 165 -22.190 -24.011 7.731 1.00 0.00 H new ATOM 1154 N LYS A 166 -18.583 -21.564 4.788 1.00 0.00 N ATOM 1155 CA LYS A 166 -17.887 -21.453 3.512 1.00 0.00 C ATOM 1156 C LYS A 166 -16.680 -20.528 3.630 1.00 0.00 C ATOM 1157 O LYS A 166 -16.617 -19.656 4.497 1.00 0.00 O ATOM 1158 CB LYS A 166 -18.838 -20.932 2.432 1.00 0.00 C ATOM 1159 CG LYS A 166 -19.866 -21.956 1.982 1.00 0.00 C ATOM 1160 CD LYS A 166 -20.504 -21.562 0.661 1.00 0.00 C ATOM 1161 CE LYS A 166 -21.485 -22.620 0.178 1.00 0.00 C ATOM 1162 NZ LYS A 166 -20.822 -23.937 -0.031 1.00 0.00 N ATOM 0 H LYS A 166 -19.070 -20.716 5.077 1.00 0.00 H new ATOM 0 HA LYS A 166 -17.536 -22.446 3.230 1.00 0.00 H new ATOM 0 HB2 LYS A 166 -19.356 -20.051 2.810 1.00 0.00 H new ATOM 0 HB3 LYS A 166 -18.254 -20.612 1.569 1.00 0.00 H new ATOM 0 HG2 LYS A 166 -19.389 -22.931 1.880 1.00 0.00 H new ATOM 0 HG3 LYS A 166 -20.638 -22.057 2.744 1.00 0.00 H new ATOM 0 HD2 LYS A 166 -21.022 -20.610 0.776 1.00 0.00 H new ATOM 0 HD3 LYS A 166 -19.728 -21.415 -0.090 1.00 0.00 H new ATOM 0 HE2 LYS A 166 -22.289 -22.730 0.906 1.00 0.00 H new ATOM 0 HE3 LYS A 166 -21.943 -22.292 -0.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 -21.437 -24.548 -0.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 -19.917 -23.796 -0.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 -20.648 -24.388 0.890 1.00 0.00 H new ATOM 1176 N PRO A 167 -15.698 -20.718 2.736 1.00 0.00 N ATOM 1177 CA PRO A 167 -14.476 -19.909 2.719 1.00 0.00 C ATOM 1178 C PRO A 167 -14.737 -18.475 2.272 1.00 0.00 C ATOM 1179 O PRO A 167 -15.880 -18.088 2.028 1.00 0.00 O ATOM 1180 CB PRO A 167 -13.586 -20.632 1.704 1.00 0.00 C ATOM 1181 CG PRO A 167 -14.538 -21.350 0.810 1.00 0.00 C ATOM 1182 CD PRO A 167 -15.705 -21.739 1.674 1.00 0.00 C ATOM 0 HA PRO A 167 -14.031 -19.821 3.710 1.00 0.00 H new ATOM 0 HB2 PRO A 167 -12.971 -19.927 1.144 1.00 0.00 H new ATOM 0 HB3 PRO A 167 -12.906 -21.326 2.197 1.00 0.00 H new ATOM 0 HG2 PRO A 167 -14.858 -20.711 -0.013 1.00 0.00 H new ATOM 0 HG3 PRO A 167 -14.070 -22.229 0.367 1.00 0.00 H new ATOM 0 HD2 PRO A 167 -16.640 -21.730 1.114 1.00 0.00 H new ATOM 0 HD3 PRO A 167 -15.587 -22.743 2.081 1.00 0.00 H new ATOM 1190 N VAL A 168 -13.669 -17.689 2.166 1.00 0.00 N ATOM 1191 CA VAL A 168 -13.783 -16.298 1.747 1.00 0.00 C ATOM 1192 C VAL A 168 -12.718 -15.946 0.714 1.00 0.00 C ATOM 1193 O VAL A 168 -11.530 -16.186 0.927 1.00 0.00 O ATOM 1194 CB VAL A 168 -13.657 -15.338 2.945 1.00 0.00 C ATOM 1195 CG1 VAL A 168 -14.817 -15.532 3.909 1.00 0.00 C ATOM 1196 CG2 VAL A 168 -12.326 -15.543 3.653 1.00 0.00 C ATOM 0 H VAL A 168 -12.716 -17.993 2.365 1.00 0.00 H new ATOM 0 HA VAL A 168 -14.771 -16.182 1.301 1.00 0.00 H new ATOM 0 HB VAL A 168 -13.692 -14.314 2.573 1.00 0.00 H new ATOM 0 HG11 VAL A 168 -14.711 -14.845 4.749 1.00 0.00 H new ATOM 0 HG12 VAL A 168 -15.756 -15.332 3.393 1.00 0.00 H new ATOM 0 HG13 VAL A 168 -14.817 -16.558 4.277 1.00 0.00 H new ATOM 0 HG21 VAL A 168 -12.253 -14.857 4.497 1.00 0.00 H new ATOM 0 HG22 VAL A 168 -12.260 -16.570 4.013 1.00 0.00 H new ATOM 0 HG23 VAL A 168 -11.510 -15.350 2.957 1.00 0.00 H new ATOM 1206 N ARG A 169 -13.153 -15.375 -0.405 1.00 0.00 N ATOM 1207 CA ARG A 169 -12.236 -14.991 -1.472 1.00 0.00 C ATOM 1208 C ARG A 169 -11.778 -13.546 -1.300 1.00 0.00 C ATOM 1209 O ARG A 169 -12.447 -12.613 -1.748 1.00 0.00 O ATOM 1210 CB ARG A 169 -12.906 -15.166 -2.836 1.00 0.00 C ATOM 1211 CG ARG A 169 -11.924 -15.408 -3.970 1.00 0.00 C ATOM 1212 CD ARG A 169 -12.547 -16.242 -5.078 1.00 0.00 C ATOM 1213 NE ARG A 169 -13.400 -15.442 -5.953 1.00 0.00 N ATOM 1214 CZ ARG A 169 -13.923 -15.897 -7.086 1.00 0.00 C ATOM 1215 NH1 ARG A 169 -13.682 -17.140 -7.479 1.00 0.00 N ATOM 1216 NH2 ARG A 169 -14.690 -15.108 -7.828 1.00 0.00 N ATOM 0 H ARG A 169 -14.133 -15.168 -0.596 1.00 0.00 H new ATOM 0 HA ARG A 169 -11.362 -15.640 -1.418 1.00 0.00 H new ATOM 0 HB2 ARG A 169 -13.602 -16.003 -2.785 1.00 0.00 H new ATOM 0 HB3 ARG A 169 -13.494 -14.276 -3.059 1.00 0.00 H new ATOM 0 HG2 ARG A 169 -11.592 -14.452 -4.375 1.00 0.00 H new ATOM 0 HG3 ARG A 169 -11.040 -15.915 -3.585 1.00 0.00 H new ATOM 0 HD2 ARG A 169 -11.758 -16.708 -5.668 1.00 0.00 H new ATOM 0 HD3 ARG A 169 -13.134 -17.048 -4.638 1.00 0.00 H new ATOM 0 HE ARG A 169 -13.605 -14.481 -5.679 1.00 0.00 H new ATOM 0 HH11 ARG A 169 -13.094 -17.750 -6.911 1.00 0.00 H new ATOM 0 HH12 ARG A 169 -14.085 -17.487 -8.349 1.00 0.00 H new ATOM 0 HH21 ARG A 169 -14.878 -14.151 -7.528 1.00 0.00 H new ATOM 0 HH22 ARG A 169 -15.091 -15.458 -8.698 1.00 0.00 H new ATOM 1230 N LEU A 170 -10.634 -13.367 -0.648 1.00 0.00 N ATOM 1231 CA LEU A 170 -10.086 -12.035 -0.416 1.00 0.00 C ATOM 1232 C LEU A 170 -9.543 -11.437 -1.710 1.00 0.00 C ATOM 1233 O LEU A 170 -9.132 -12.162 -2.617 1.00 0.00 O ATOM 1234 CB LEU A 170 -8.977 -12.095 0.636 1.00 0.00 C ATOM 1235 CG LEU A 170 -9.240 -13.004 1.837 1.00 0.00 C ATOM 1236 CD1 LEU A 170 -8.135 -12.854 2.871 1.00 0.00 C ATOM 1237 CD2 LEU A 170 -10.596 -12.694 2.453 1.00 0.00 C ATOM 0 H LEU A 170 -10.068 -14.127 -0.271 1.00 0.00 H new ATOM 0 HA LEU A 170 -10.890 -11.396 -0.051 1.00 0.00 H new ATOM 0 HB2 LEU A 170 -8.060 -12.426 0.149 1.00 0.00 H new ATOM 0 HB3 LEU A 170 -8.797 -11.085 1.003 1.00 0.00 H new ATOM 0 HG LEU A 170 -9.248 -14.038 1.492 1.00 0.00 H new ATOM 0 HD11 LEU A 170 -8.339 -13.508 3.719 1.00 0.00 H new ATOM 0 HD12 LEU A 170 -7.179 -13.126 2.424 1.00 0.00 H new ATOM 0 HD13 LEU A 170 -8.094 -11.820 3.213 1.00 0.00 H new ATOM 0 HD21 LEU A 170 -10.767 -13.350 3.306 1.00 0.00 H new ATOM 0 HD22 LEU A 170 -10.616 -11.656 2.784 1.00 0.00 H new ATOM 0 HD23 LEU A 170 -11.378 -12.854 1.711 1.00 0.00 H new ATOM 1249 N SER A 171 -9.543 -10.110 -1.789 1.00 0.00 N ATOM 1250 CA SER A 171 -9.052 -9.414 -2.972 1.00 0.00 C ATOM 1251 C SER A 171 -8.863 -7.927 -2.689 1.00 0.00 C ATOM 1252 O SER A 171 -9.143 -7.452 -1.588 1.00 0.00 O ATOM 1253 CB SER A 171 -10.022 -9.603 -4.140 1.00 0.00 C ATOM 1254 OG SER A 171 -10.666 -10.863 -4.069 1.00 0.00 O ATOM 0 H SER A 171 -9.878 -9.495 -1.047 1.00 0.00 H new ATOM 0 HA SER A 171 -8.085 -9.841 -3.239 1.00 0.00 H new ATOM 0 HB2 SER A 171 -10.768 -8.809 -4.129 1.00 0.00 H new ATOM 0 HB3 SER A 171 -9.481 -9.520 -5.083 1.00 0.00 H new ATOM 0 HG SER A 171 -9.992 -11.574 -4.036 1.00 0.00 H new ATOM 1260 N VAL A 172 -8.384 -7.196 -3.690 1.00 0.00 N ATOM 1261 CA VAL A 172 -8.157 -5.763 -3.551 1.00 0.00 C ATOM 1262 C VAL A 172 -9.248 -4.963 -4.255 1.00 0.00 C ATOM 1263 O VAL A 172 -9.212 -4.783 -5.472 1.00 0.00 O ATOM 1264 CB VAL A 172 -6.786 -5.353 -4.120 1.00 0.00 C ATOM 1265 CG1 VAL A 172 -6.531 -3.872 -3.885 1.00 0.00 C ATOM 1266 CG2 VAL A 172 -5.681 -6.198 -3.506 1.00 0.00 C ATOM 0 H VAL A 172 -8.145 -7.573 -4.607 1.00 0.00 H new ATOM 0 HA VAL A 172 -8.179 -5.541 -2.484 1.00 0.00 H new ATOM 0 HB VAL A 172 -6.791 -5.529 -5.196 1.00 0.00 H new ATOM 0 HG11 VAL A 172 -5.558 -3.601 -4.294 1.00 0.00 H new ATOM 0 HG12 VAL A 172 -7.307 -3.286 -4.378 1.00 0.00 H new ATOM 0 HG13 VAL A 172 -6.545 -3.666 -2.815 1.00 0.00 H new ATOM 0 HG21 VAL A 172 -4.719 -5.895 -3.919 1.00 0.00 H new ATOM 0 HG22 VAL A 172 -5.673 -6.056 -2.425 1.00 0.00 H new ATOM 0 HG23 VAL A 172 -5.858 -7.249 -3.733 1.00 0.00 H new ATOM 1276 N ALA A 173 -10.216 -4.484 -3.481 1.00 0.00 N ATOM 1277 CA ALA A 173 -11.316 -3.701 -4.031 1.00 0.00 C ATOM 1278 C ALA A 173 -10.886 -2.262 -4.297 1.00 0.00 C ATOM 1279 O ALA A 173 -10.186 -1.654 -3.487 1.00 0.00 O ATOM 1280 CB ALA A 173 -12.509 -3.731 -3.086 1.00 0.00 C ATOM 0 H ALA A 173 -10.261 -4.624 -2.472 1.00 0.00 H new ATOM 0 HA ALA A 173 -11.608 -4.147 -4.982 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -13.323 -3.142 -3.509 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -12.839 -4.761 -2.949 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -12.220 -3.311 -2.122 1.00 0.00 H new