USER MOD reduce.3.24.130724 H: found=0, std=0, add=579, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 582 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.0683) USER MOD Single : A 68 GLN : amide:sc= -0.363 X(o=-0.36,f=-0.2) USER MOD Single : A 71 LYS NZ :NH3+ 143:sc= 0 (180deg=-0.0679) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 85 GLN : amide:sc= -0.728 K(o=-0.73,f=-0.081) USER MOD Single : A 89 GLN : amide:sc= -0.277 X(o=-0.28,f=0) USER MOD Single : B 168 SER OG : rot -45:sc= 0.269 USER MOD Single : B 169 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 174 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : B 175 ASN : amide:sc= -0.561 K(o=-0.56,f=-1.4!) USER MOD Single : B 176 MET CE :methyl 141:sc= -6.83! (180deg=-13.1!) USER MOD Single : B 184 THR OG1 : rot 91:sc= 1.27 USER MOD Single : B 185 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 188 GLN : amide:sc= -0.572 K(o=-0.57,f=0) USER MOD Single : B 189 GLN : amide:sc= -0.312 X(o=-0.31,f=0) USER MOD Single : B 191 SER OG : rot -30:sc= 0.362 USER MOD Single : B 192 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 195 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 196 LYS NZ :NH3+ -137:sc= -0.085 (180deg=-2.05!) USER MOD Single : B 197 GLN : amide:sc= -4.9! K(o=-4.9!,f=-3.2) USER MOD Single : B 198 GLN : amide:sc= -0.366 X(o=-0.37,f=-0.097) USER MOD Single : B 199 GLN : amide:sc= -0.974 K(o=-0.97,f=-0.28) USER MOD ----------------------------------------------------------------- ATOM 161 N LEU A 62 0.470 -18.532 2.955 1.00 0.00 N ATOM 162 CA LEU A 62 0.147 -17.562 1.864 1.00 0.00 C ATOM 163 C LEU A 62 -1.195 -16.881 2.147 1.00 0.00 C ATOM 164 O LEU A 62 -1.414 -15.746 1.770 1.00 0.00 O ATOM 165 CB LEU A 62 0.063 -18.402 0.589 1.00 0.00 C ATOM 166 CG LEU A 62 0.617 -17.602 -0.591 1.00 0.00 C ATOM 167 CD1 LEU A 62 1.300 -18.553 -1.579 1.00 0.00 C ATOM 168 CD2 LEU A 62 -0.531 -16.874 -1.296 1.00 0.00 C ATOM 0 HA LEU A 62 0.895 -16.774 1.780 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.628 -19.326 0.712 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -0.972 -18.685 0.396 1.00 0.00 H new ATOM 0 HG LEU A 62 1.342 -16.874 -0.227 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.695 -17.982 -2.420 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.117 -19.073 -1.078 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.575 -19.281 -1.943 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.138 -16.303 -2.137 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.256 -17.603 -1.659 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -1.018 -16.197 -0.594 1.00 0.00 H new ATOM 180 N GLU A 63 -2.088 -17.571 2.809 1.00 0.00 N ATOM 181 CA GLU A 63 -3.422 -16.970 3.122 1.00 0.00 C ATOM 182 C GLU A 63 -3.274 -15.902 4.206 1.00 0.00 C ATOM 183 O GLU A 63 -3.969 -14.903 4.203 1.00 0.00 O ATOM 184 CB GLU A 63 -4.280 -18.134 3.624 1.00 0.00 C ATOM 185 CG GLU A 63 -5.760 -17.793 3.445 1.00 0.00 C ATOM 186 CD GLU A 63 -6.614 -18.991 3.862 1.00 0.00 C ATOM 187 OE1 GLU A 63 -6.316 -20.089 3.421 1.00 0.00 O ATOM 188 OE2 GLU A 63 -7.552 -18.791 4.618 1.00 0.00 O ATOM 0 H GLU A 63 -1.952 -18.524 3.147 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.870 -16.484 2.255 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -4.036 -19.043 3.074 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -4.066 -18.331 4.675 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -6.019 -16.922 4.047 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -5.961 -17.534 2.406 1.00 0.00 H new ATOM 195 N GLU A 64 -2.368 -16.104 5.126 1.00 0.00 N ATOM 196 CA GLU A 64 -2.160 -15.100 6.213 1.00 0.00 C ATOM 197 C GLU A 64 -1.413 -13.886 5.660 1.00 0.00 C ATOM 198 O GLU A 64 -1.608 -12.770 6.103 1.00 0.00 O ATOM 199 CB GLU A 64 -1.318 -15.818 7.269 1.00 0.00 C ATOM 200 CG GLU A 64 -1.557 -15.176 8.638 1.00 0.00 C ATOM 201 CD GLU A 64 -0.747 -13.882 8.744 1.00 0.00 C ATOM 202 OE1 GLU A 64 0.446 -13.931 8.492 1.00 0.00 O ATOM 203 OE2 GLU A 64 -1.334 -12.865 9.075 1.00 0.00 O ATOM 0 H GLU A 64 -1.761 -16.923 5.172 1.00 0.00 H new ATOM 0 HA GLU A 64 -3.100 -14.737 6.629 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -1.580 -16.875 7.301 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -0.261 -15.760 7.008 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -2.618 -14.965 8.772 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -1.266 -15.865 9.431 1.00 0.00 H new ATOM 210 N THR A 65 -0.567 -14.101 4.687 1.00 0.00 N ATOM 211 CA THR A 65 0.193 -12.965 4.086 1.00 0.00 C ATOM 212 C THR A 65 -0.745 -12.109 3.233 1.00 0.00 C ATOM 213 O THR A 65 -0.556 -10.915 3.094 1.00 0.00 O ATOM 214 CB THR A 65 1.270 -13.614 3.214 1.00 0.00 C ATOM 215 OG1 THR A 65 2.042 -14.507 4.005 1.00 0.00 O ATOM 216 CG2 THR A 65 2.178 -12.530 2.632 1.00 0.00 C ATOM 0 H THR A 65 -0.369 -15.016 4.282 1.00 0.00 H new ATOM 0 HA THR A 65 0.629 -12.313 4.842 1.00 0.00 H new ATOM 0 HB THR A 65 0.797 -14.164 2.400 1.00 0.00 H new ATOM 0 HG1 THR A 65 2.731 -14.925 3.448 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.945 -12.993 2.011 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.585 -11.845 2.026 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.652 -11.978 3.444 1.00 0.00 H new ATOM 224 N LYS A 66 -1.759 -12.714 2.667 1.00 0.00 N ATOM 225 CA LYS A 66 -2.721 -11.941 1.823 1.00 0.00 C ATOM 226 C LYS A 66 -3.547 -10.993 2.698 1.00 0.00 C ATOM 227 O LYS A 66 -4.013 -9.966 2.241 1.00 0.00 O ATOM 228 CB LYS A 66 -3.626 -12.992 1.174 1.00 0.00 C ATOM 229 CG LYS A 66 -3.118 -13.309 -0.234 1.00 0.00 C ATOM 230 CD LYS A 66 -3.579 -12.219 -1.202 1.00 0.00 C ATOM 231 CE LYS A 66 -3.412 -12.710 -2.642 1.00 0.00 C ATOM 232 NZ LYS A 66 -4.638 -13.509 -2.920 1.00 0.00 N ATOM 0 H LYS A 66 -1.962 -13.710 2.753 1.00 0.00 H new ATOM 0 HA LYS A 66 -2.212 -11.329 1.078 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -3.639 -13.898 1.779 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -4.651 -12.625 1.127 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -2.030 -13.373 -0.233 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -3.494 -14.280 -0.557 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -4.622 -11.966 -1.012 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -2.997 -11.310 -1.047 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -3.319 -11.875 -3.336 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -2.513 -13.316 -2.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -4.398 -14.309 -3.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -5.029 -13.868 -2.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -5.345 -12.908 -3.390 1.00 0.00 H new ATOM 246 N GLU A 67 -3.730 -11.332 3.951 1.00 0.00 N ATOM 247 CA GLU A 67 -4.528 -10.450 4.858 1.00 0.00 C ATOM 248 C GLU A 67 -3.758 -9.164 5.161 1.00 0.00 C ATOM 249 O GLU A 67 -4.341 -8.112 5.350 1.00 0.00 O ATOM 250 CB GLU A 67 -4.736 -11.265 6.136 1.00 0.00 C ATOM 251 CG GLU A 67 -6.026 -12.078 6.019 1.00 0.00 C ATOM 252 CD GLU A 67 -6.609 -12.317 7.414 1.00 0.00 C ATOM 253 OE1 GLU A 67 -6.509 -11.422 8.236 1.00 0.00 O ATOM 254 OE2 GLU A 67 -7.144 -13.390 7.635 1.00 0.00 O ATOM 0 H GLU A 67 -3.362 -12.179 4.384 1.00 0.00 H new ATOM 0 HA GLU A 67 -5.476 -10.154 4.409 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -3.888 -11.930 6.298 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.789 -10.601 6.999 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -6.748 -11.547 5.398 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -5.824 -13.031 5.530 1.00 0.00 H new ATOM 261 N GLN A 68 -2.453 -9.239 5.203 1.00 0.00 N ATOM 262 CA GLN A 68 -1.638 -8.019 5.488 1.00 0.00 C ATOM 263 C GLN A 68 -1.555 -7.147 4.237 1.00 0.00 C ATOM 264 O GLN A 68 -1.533 -5.933 4.315 1.00 0.00 O ATOM 265 CB GLN A 68 -0.254 -8.540 5.879 1.00 0.00 C ATOM 266 CG GLN A 68 0.628 -7.369 6.315 1.00 0.00 C ATOM 267 CD GLN A 68 0.081 -6.770 7.612 1.00 0.00 C ATOM 268 OE1 GLN A 68 0.359 -7.263 8.688 1.00 0.00 O ATOM 269 NE2 GLN A 68 -0.692 -5.720 7.558 1.00 0.00 N ATOM 0 H GLN A 68 -1.916 -10.093 5.052 1.00 0.00 H new ATOM 0 HA GLN A 68 -2.071 -7.405 6.278 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -0.342 -9.264 6.689 1.00 0.00 H new ATOM 0 HB3 GLN A 68 0.202 -9.059 5.036 1.00 0.00 H new ATOM 0 HG2 GLN A 68 1.653 -7.708 6.463 1.00 0.00 H new ATOM 0 HG3 GLN A 68 0.653 -6.609 5.534 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -0.926 -5.305 6.656 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -1.062 -5.314 8.418 1.00 0.00 H new ATOM 278 N ILE A 69 -1.520 -7.762 3.085 1.00 0.00 N ATOM 279 CA ILE A 69 -1.452 -6.978 1.815 1.00 0.00 C ATOM 280 C ILE A 69 -2.817 -6.344 1.530 1.00 0.00 C ATOM 281 O ILE A 69 -2.909 -5.315 0.886 1.00 0.00 O ATOM 282 CB ILE A 69 -1.084 -7.993 0.725 1.00 0.00 C ATOM 283 CG1 ILE A 69 0.249 -8.663 1.073 1.00 0.00 C ATOM 284 CG2 ILE A 69 -0.949 -7.275 -0.621 1.00 0.00 C ATOM 285 CD1 ILE A 69 0.527 -9.795 0.083 1.00 0.00 C ATOM 0 H ILE A 69 -1.536 -8.775 2.967 1.00 0.00 H new ATOM 0 HA ILE A 69 -0.723 -6.169 1.864 1.00 0.00 H new ATOM 0 HB ILE A 69 -1.867 -8.748 0.661 1.00 0.00 H new ATOM 0 HG12 ILE A 69 1.056 -7.931 1.040 1.00 0.00 H new ATOM 0 HG13 ILE A 69 0.216 -9.055 2.090 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -0.688 -7.997 -1.394 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -1.895 -6.798 -0.875 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -0.168 -6.518 -0.553 1.00 0.00 H new ATOM 0 HD11 ILE A 69 1.476 -10.271 0.332 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -0.274 -10.532 0.139 1.00 0.00 H new ATOM 0 HD13 ILE A 69 0.578 -9.390 -0.928 1.00 0.00 H new ATOM 297 N LEU A 70 -3.877 -6.948 2.012 1.00 0.00 N ATOM 298 CA LEU A 70 -5.239 -6.380 1.779 1.00 0.00 C ATOM 299 C LEU A 70 -5.430 -5.120 2.628 1.00 0.00 C ATOM 300 O LEU A 70 -6.043 -4.161 2.199 1.00 0.00 O ATOM 301 CB LEU A 70 -6.218 -7.477 2.218 1.00 0.00 C ATOM 302 CG LEU A 70 -6.839 -8.139 0.985 1.00 0.00 C ATOM 303 CD1 LEU A 70 -7.457 -9.480 1.384 1.00 0.00 C ATOM 304 CD2 LEU A 70 -7.927 -7.228 0.413 1.00 0.00 C ATOM 0 H LEU A 70 -3.856 -7.810 2.557 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.395 -6.096 0.738 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.698 -8.222 2.820 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -7.000 -7.050 2.846 1.00 0.00 H new ATOM 0 HG LEU A 70 -6.068 -8.303 0.232 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.899 -9.952 0.507 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -6.684 -10.129 1.794 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -8.229 -9.316 2.136 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -8.370 -7.698 -0.465 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -8.698 -7.065 1.166 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.489 -6.271 0.130 1.00 0.00 H new ATOM 316 N LYS A 71 -4.903 -5.117 3.828 1.00 0.00 N ATOM 317 CA LYS A 71 -5.047 -3.915 4.707 1.00 0.00 C ATOM 318 C LYS A 71 -4.302 -2.730 4.092 1.00 0.00 C ATOM 319 O LYS A 71 -4.684 -1.587 4.265 1.00 0.00 O ATOM 320 CB LYS A 71 -4.414 -4.310 6.043 1.00 0.00 C ATOM 321 CG LYS A 71 -5.096 -3.545 7.178 1.00 0.00 C ATOM 322 CD LYS A 71 -6.348 -4.301 7.624 1.00 0.00 C ATOM 323 CE LYS A 71 -6.832 -3.742 8.965 1.00 0.00 C ATOM 324 NZ LYS A 71 -6.010 -4.443 9.991 1.00 0.00 N ATOM 0 H LYS A 71 -4.381 -5.893 4.236 1.00 0.00 H new ATOM 0 HA LYS A 71 -6.088 -3.616 4.829 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -4.515 -5.384 6.202 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -3.347 -4.089 6.031 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -4.410 -3.430 8.017 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -5.363 -2.542 6.845 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -7.132 -4.203 6.873 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -6.129 -5.365 7.719 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -6.692 -2.662 9.017 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -7.895 -3.933 9.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -5.784 -3.785 10.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -6.543 -5.252 10.369 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -5.128 -4.782 9.557 1.00 0.00 H new ATOM 338 N LEU A 72 -3.242 -2.998 3.375 1.00 0.00 N ATOM 339 CA LEU A 72 -2.461 -1.895 2.738 1.00 0.00 C ATOM 340 C LEU A 72 -3.282 -1.249 1.619 1.00 0.00 C ATOM 341 O LEU A 72 -3.131 -0.078 1.324 1.00 0.00 O ATOM 342 CB LEU A 72 -1.204 -2.567 2.164 1.00 0.00 C ATOM 343 CG LEU A 72 0.017 -2.257 3.043 1.00 0.00 C ATOM 344 CD1 LEU A 72 0.252 -0.742 3.105 1.00 0.00 C ATOM 345 CD2 LEU A 72 -0.212 -2.800 4.459 1.00 0.00 C ATOM 0 H LEU A 72 -2.882 -3.937 3.202 1.00 0.00 H new ATOM 0 HA LEU A 72 -2.209 -1.107 3.447 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -1.354 -3.645 2.106 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -1.027 -2.215 1.148 1.00 0.00 H new ATOM 0 HG LEU A 72 0.895 -2.736 2.609 1.00 0.00 H new ATOM 0 HD11 LEU A 72 1.120 -0.534 3.731 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.429 -0.360 2.100 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.626 -0.255 3.529 1.00 0.00 H new ATOM 0 HD21 LEU A 72 0.657 -2.578 5.079 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -1.096 -2.330 4.891 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.360 -3.879 4.415 1.00 0.00 H new ATOM 357 N GLU A 73 -4.150 -2.006 0.996 1.00 0.00 N ATOM 358 CA GLU A 73 -4.986 -1.441 -0.108 1.00 0.00 C ATOM 359 C GLU A 73 -6.000 -0.447 0.459 1.00 0.00 C ATOM 360 O GLU A 73 -6.338 0.536 -0.174 1.00 0.00 O ATOM 361 CB GLU A 73 -5.702 -2.642 -0.730 1.00 0.00 C ATOM 362 CG GLU A 73 -4.809 -3.268 -1.804 1.00 0.00 C ATOM 363 CD GLU A 73 -5.491 -4.515 -2.369 1.00 0.00 C ATOM 364 OE1 GLU A 73 -5.580 -5.496 -1.649 1.00 0.00 O ATOM 365 OE2 GLU A 73 -5.912 -4.469 -3.514 1.00 0.00 O ATOM 0 H GLU A 73 -4.316 -2.991 1.204 1.00 0.00 H new ATOM 0 HA GLU A 73 -4.387 -0.904 -0.844 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -5.935 -3.378 0.039 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -6.649 -2.328 -1.168 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -4.623 -2.549 -2.602 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -3.840 -3.531 -1.379 1.00 0.00 H new ATOM 372 N GLU A 74 -6.482 -0.696 1.649 1.00 0.00 N ATOM 373 CA GLU A 74 -7.473 0.233 2.270 1.00 0.00 C ATOM 374 C GLU A 74 -6.762 1.488 2.777 1.00 0.00 C ATOM 375 O GLU A 74 -7.329 2.564 2.811 1.00 0.00 O ATOM 376 CB GLU A 74 -8.082 -0.548 3.437 1.00 0.00 C ATOM 377 CG GLU A 74 -9.434 -1.130 3.016 1.00 0.00 C ATOM 378 CD GLU A 74 -9.216 -2.194 1.938 1.00 0.00 C ATOM 379 OE1 GLU A 74 -8.959 -1.819 0.805 1.00 0.00 O ATOM 380 OE2 GLU A 74 -9.311 -3.366 2.263 1.00 0.00 O ATOM 0 H GLU A 74 -6.232 -1.504 2.219 1.00 0.00 H new ATOM 0 HA GLU A 74 -8.236 0.558 1.562 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -7.409 -1.349 3.742 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.209 0.107 4.299 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.938 -1.568 3.878 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.081 -0.339 2.636 1.00 0.00 H new ATOM 387 N LYS A 75 -5.520 1.353 3.166 1.00 0.00 N ATOM 388 CA LYS A 75 -4.756 2.533 3.669 1.00 0.00 C ATOM 389 C LYS A 75 -4.327 3.417 2.496 1.00 0.00 C ATOM 390 O LYS A 75 -4.188 4.617 2.632 1.00 0.00 O ATOM 391 CB LYS A 75 -3.532 1.947 4.376 1.00 0.00 C ATOM 392 CG LYS A 75 -3.189 2.804 5.597 1.00 0.00 C ATOM 393 CD LYS A 75 -2.596 1.915 6.692 1.00 0.00 C ATOM 394 CE LYS A 75 -1.970 2.793 7.777 1.00 0.00 C ATOM 395 NZ LYS A 75 -3.032 2.937 8.812 1.00 0.00 N ATOM 0 H LYS A 75 -5.002 0.475 3.157 1.00 0.00 H new ATOM 0 HA LYS A 75 -5.350 3.155 4.339 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -3.733 0.921 4.684 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -2.684 1.914 3.692 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -2.478 3.582 5.320 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -4.084 3.306 5.966 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -3.373 1.284 7.123 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -1.844 1.250 6.268 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -1.074 2.331 8.192 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.673 3.763 7.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -2.679 3.528 9.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.870 3.386 8.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.290 1.998 9.178 1.00 0.00 H new ATOM 409 N LEU A 76 -4.120 2.828 1.343 1.00 0.00 N ATOM 410 CA LEU A 76 -3.705 3.630 0.153 1.00 0.00 C ATOM 411 C LEU A 76 -4.912 4.375 -0.418 1.00 0.00 C ATOM 412 O LEU A 76 -4.786 5.463 -0.948 1.00 0.00 O ATOM 413 CB LEU A 76 -3.175 2.610 -0.856 1.00 0.00 C ATOM 414 CG LEU A 76 -2.525 3.343 -2.030 1.00 0.00 C ATOM 415 CD1 LEU A 76 -1.114 3.786 -1.638 1.00 0.00 C ATOM 416 CD2 LEU A 76 -2.447 2.406 -3.236 1.00 0.00 C ATOM 0 H LEU A 76 -4.221 1.827 1.176 1.00 0.00 H new ATOM 0 HA LEU A 76 -2.952 4.379 0.400 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -2.449 1.953 -0.377 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -3.989 1.979 -1.213 1.00 0.00 H new ATOM 0 HG LEU A 76 -3.122 4.218 -2.287 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -0.651 4.308 -2.475 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -1.168 4.454 -0.778 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -0.516 2.911 -1.381 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -1.984 2.928 -4.073 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.850 1.531 -2.979 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -3.452 2.090 -3.517 1.00 0.00 H new ATOM 428 N LEU A 77 -6.078 3.795 -0.307 1.00 0.00 N ATOM 429 CA LEU A 77 -7.304 4.464 -0.834 1.00 0.00 C ATOM 430 C LEU A 77 -7.736 5.579 0.120 1.00 0.00 C ATOM 431 O LEU A 77 -8.261 6.595 -0.295 1.00 0.00 O ATOM 432 CB LEU A 77 -8.369 3.366 -0.897 1.00 0.00 C ATOM 433 CG LEU A 77 -8.463 2.823 -2.325 1.00 0.00 C ATOM 434 CD1 LEU A 77 -7.199 2.028 -2.655 1.00 0.00 C ATOM 435 CD2 LEU A 77 -9.685 1.908 -2.442 1.00 0.00 C ATOM 0 H LEU A 77 -6.235 2.885 0.127 1.00 0.00 H new ATOM 0 HA LEU A 77 -7.140 4.920 -1.811 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -8.117 2.561 -0.207 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -9.334 3.763 -0.584 1.00 0.00 H new ATOM 0 HG LEU A 77 -8.561 3.654 -3.023 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -7.267 1.642 -3.672 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -6.328 2.678 -2.571 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -7.100 1.197 -1.957 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -9.753 1.520 -3.458 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -9.586 1.078 -1.743 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -10.587 2.474 -2.208 1.00 0.00 H new ATOM 447 N ALA A 78 -7.505 5.396 1.394 1.00 0.00 N ATOM 448 CA ALA A 78 -7.888 6.445 2.386 1.00 0.00 C ATOM 449 C ALA A 78 -6.915 7.623 2.297 1.00 0.00 C ATOM 450 O ALA A 78 -7.268 8.753 2.577 1.00 0.00 O ATOM 451 CB ALA A 78 -7.786 5.766 3.753 1.00 0.00 C ATOM 0 H ALA A 78 -7.067 4.565 1.791 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.889 6.838 2.207 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -8.054 6.478 4.534 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.467 4.915 3.788 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -6.765 5.420 3.912 1.00 0.00 H new ATOM 457 N LEU A 79 -5.693 7.363 1.903 1.00 0.00 N ATOM 458 CA LEU A 79 -4.689 8.464 1.786 1.00 0.00 C ATOM 459 C LEU A 79 -4.992 9.316 0.551 1.00 0.00 C ATOM 460 O LEU A 79 -4.830 10.521 0.565 1.00 0.00 O ATOM 461 CB LEU A 79 -3.328 7.763 1.642 1.00 0.00 C ATOM 462 CG LEU A 79 -2.475 7.982 2.903 1.00 0.00 C ATOM 463 CD1 LEU A 79 -2.256 9.483 3.133 1.00 0.00 C ATOM 464 CD2 LEU A 79 -3.178 7.369 4.120 1.00 0.00 C ATOM 0 H LEU A 79 -5.348 6.435 1.657 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.705 9.131 2.648 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.477 6.696 1.477 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -2.803 8.150 0.769 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.508 7.498 2.766 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.651 9.630 4.028 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.741 9.912 2.273 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -3.220 9.976 3.262 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -2.569 7.527 5.010 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -4.150 7.844 4.256 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -3.316 6.300 3.960 1.00 0.00 H new ATOM 476 N GLN A 80 -5.437 8.696 -0.513 1.00 0.00 N ATOM 477 CA GLN A 80 -5.759 9.466 -1.752 1.00 0.00 C ATOM 478 C GLN A 80 -6.998 10.334 -1.522 1.00 0.00 C ATOM 479 O GLN A 80 -7.156 11.377 -2.128 1.00 0.00 O ATOM 480 CB GLN A 80 -6.032 8.411 -2.826 1.00 0.00 C ATOM 481 CG GLN A 80 -4.745 8.134 -3.607 1.00 0.00 C ATOM 482 CD GLN A 80 -5.046 7.185 -4.767 1.00 0.00 C ATOM 483 OE1 GLN A 80 -6.056 7.317 -5.430 1.00 0.00 O ATOM 484 NE2 GLN A 80 -4.206 6.226 -5.044 1.00 0.00 N ATOM 0 H GLN A 80 -5.591 7.690 -0.577 1.00 0.00 H new ATOM 0 HA GLN A 80 -4.949 10.135 -2.043 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -6.395 7.493 -2.365 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -6.813 8.759 -3.502 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -4.329 9.068 -3.986 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -3.995 7.695 -2.949 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -3.358 6.114 -4.488 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -4.397 5.588 -5.816 1.00 0.00 H new ATOM 493 N GLU A 81 -7.874 9.911 -0.646 1.00 0.00 N ATOM 494 CA GLU A 81 -9.105 10.710 -0.366 1.00 0.00 C ATOM 495 C GLU A 81 -8.741 11.983 0.402 1.00 0.00 C ATOM 496 O GLU A 81 -9.419 12.989 0.307 1.00 0.00 O ATOM 497 CB GLU A 81 -9.991 9.802 0.491 1.00 0.00 C ATOM 498 CG GLU A 81 -10.620 8.722 -0.391 1.00 0.00 C ATOM 499 CD GLU A 81 -11.817 9.307 -1.142 1.00 0.00 C ATOM 500 OE1 GLU A 81 -12.795 9.637 -0.492 1.00 0.00 O ATOM 501 OE2 GLU A 81 -11.734 9.417 -2.354 1.00 0.00 O ATOM 0 H GLU A 81 -7.789 9.046 -0.112 1.00 0.00 H new ATOM 0 HA GLU A 81 -9.610 11.020 -1.281 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -9.400 9.341 1.282 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -10.770 10.390 0.976 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -9.884 8.342 -1.099 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -10.939 7.878 0.221 1.00 0.00 H new ATOM 508 N GLU A 82 -7.672 11.946 1.159 1.00 0.00 N ATOM 509 CA GLU A 82 -7.256 13.155 1.933 1.00 0.00 C ATOM 510 C GLU A 82 -6.701 14.216 0.979 1.00 0.00 C ATOM 511 O GLU A 82 -7.023 15.384 1.087 1.00 0.00 O ATOM 512 CB GLU A 82 -6.168 12.665 2.904 1.00 0.00 C ATOM 513 CG GLU A 82 -6.622 12.897 4.348 1.00 0.00 C ATOM 514 CD GLU A 82 -6.195 14.295 4.800 1.00 0.00 C ATOM 515 OE1 GLU A 82 -5.116 14.717 4.416 1.00 0.00 O ATOM 516 OE2 GLU A 82 -6.955 14.921 5.521 1.00 0.00 O ATOM 0 H GLU A 82 -7.070 11.131 1.274 1.00 0.00 H new ATOM 0 HA GLU A 82 -8.088 13.612 2.469 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -5.971 11.605 2.740 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -5.234 13.195 2.717 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.705 12.795 4.421 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.186 12.143 5.003 1.00 0.00 H new ATOM 523 N LYS A 83 -5.877 13.817 0.043 1.00 0.00 N ATOM 524 CA LYS A 83 -5.310 14.805 -0.928 1.00 0.00 C ATOM 525 C LYS A 83 -6.442 15.426 -1.752 1.00 0.00 C ATOM 526 O LYS A 83 -6.341 16.547 -2.214 1.00 0.00 O ATOM 527 CB LYS A 83 -4.367 14.002 -1.826 1.00 0.00 C ATOM 528 CG LYS A 83 -3.686 14.941 -2.824 1.00 0.00 C ATOM 529 CD LYS A 83 -2.305 14.391 -3.184 1.00 0.00 C ATOM 530 CE LYS A 83 -2.458 13.231 -4.171 1.00 0.00 C ATOM 531 NZ LYS A 83 -2.304 13.849 -5.517 1.00 0.00 N ATOM 0 H LYS A 83 -5.572 12.853 -0.092 1.00 0.00 H new ATOM 0 HA LYS A 83 -4.785 15.620 -0.430 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -3.617 13.493 -1.220 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -4.924 13.231 -2.358 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -4.296 15.038 -3.722 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -3.591 15.938 -2.394 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -1.692 15.178 -3.624 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -1.791 14.052 -2.285 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -1.702 12.464 -4.000 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -3.430 12.749 -4.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -2.397 13.115 -6.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -3.041 14.570 -5.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -1.367 14.294 -5.590 1.00 0.00 H new ATOM 545 N HIS A 84 -7.522 14.704 -1.932 1.00 0.00 N ATOM 546 CA HIS A 84 -8.669 15.248 -2.720 1.00 0.00 C ATOM 547 C HIS A 84 -9.261 16.467 -2.010 1.00 0.00 C ATOM 548 O HIS A 84 -9.735 17.393 -2.639 1.00 0.00 O ATOM 549 CB HIS A 84 -9.693 14.114 -2.782 1.00 0.00 C ATOM 550 CG HIS A 84 -10.845 14.526 -3.657 1.00 0.00 C ATOM 551 ND1 HIS A 84 -10.752 14.551 -5.040 1.00 0.00 N ATOM 552 CD2 HIS A 84 -12.124 14.930 -3.361 1.00 0.00 C ATOM 553 CE1 HIS A 84 -11.942 14.958 -5.520 1.00 0.00 C ATOM 554 NE2 HIS A 84 -12.814 15.203 -4.538 1.00 0.00 N ATOM 0 H HIS A 84 -7.657 13.761 -1.566 1.00 0.00 H new ATOM 0 HA HIS A 84 -8.366 15.571 -3.716 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -9.228 13.211 -3.176 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -10.050 13.877 -1.780 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -12.532 15.022 -2.365 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -12.165 15.072 -6.571 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -13.778 15.522 -4.631 1.00 0.00 H new ATOM 562 N GLN A 85 -9.230 16.473 -0.700 1.00 0.00 N ATOM 563 CA GLN A 85 -9.785 17.635 0.059 1.00 0.00 C ATOM 564 C GLN A 85 -8.964 18.890 -0.242 1.00 0.00 C ATOM 565 O GLN A 85 -9.489 19.986 -0.307 1.00 0.00 O ATOM 566 CB GLN A 85 -9.662 17.252 1.536 1.00 0.00 C ATOM 567 CG GLN A 85 -10.984 16.653 2.021 1.00 0.00 C ATOM 568 CD GLN A 85 -12.005 17.772 2.235 1.00 0.00 C ATOM 569 OE1 GLN A 85 -11.985 18.443 3.246 1.00 0.00 O ATOM 570 NE2 GLN A 85 -12.904 18.002 1.316 1.00 0.00 N ATOM 0 H GLN A 85 -8.845 15.724 -0.125 1.00 0.00 H new ATOM 0 HA GLN A 85 -10.818 17.851 -0.213 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -8.854 16.533 1.670 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -9.409 18.130 2.130 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -11.361 15.938 1.290 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -10.828 16.106 2.951 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -12.921 17.438 0.466 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -13.589 18.746 1.448 1.00 0.00 H new ATOM 579 N LEU A 86 -7.679 18.733 -0.432 1.00 0.00 N ATOM 580 CA LEU A 86 -6.811 19.912 -0.738 1.00 0.00 C ATOM 581 C LEU A 86 -7.217 20.523 -2.081 1.00 0.00 C ATOM 582 O LEU A 86 -7.169 21.724 -2.265 1.00 0.00 O ATOM 583 CB LEU A 86 -5.384 19.358 -0.811 1.00 0.00 C ATOM 584 CG LEU A 86 -4.626 19.711 0.470 1.00 0.00 C ATOM 585 CD1 LEU A 86 -3.542 18.663 0.728 1.00 0.00 C ATOM 586 CD2 LEU A 86 -3.976 21.087 0.312 1.00 0.00 C ATOM 0 H LEU A 86 -7.192 17.838 -0.389 1.00 0.00 H new ATOM 0 HA LEU A 86 -6.900 20.696 0.014 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -5.410 18.276 -0.943 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.867 19.772 -1.677 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.320 19.729 1.310 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.002 18.915 1.641 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -4.004 17.682 0.838 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -2.847 18.644 -0.111 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -3.435 21.341 1.224 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -3.282 21.067 -0.528 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -4.747 21.835 0.128 1.00 0.00 H new ATOM 598 N PHE A 87 -7.619 19.701 -3.018 1.00 0.00 N ATOM 599 CA PHE A 87 -8.034 20.226 -4.355 1.00 0.00 C ATOM 600 C PHE A 87 -9.224 21.175 -4.199 1.00 0.00 C ATOM 601 O PHE A 87 -9.340 22.160 -4.903 1.00 0.00 O ATOM 602 CB PHE A 87 -8.430 18.995 -5.172 1.00 0.00 C ATOM 603 CG PHE A 87 -7.214 18.452 -5.884 1.00 0.00 C ATOM 604 CD1 PHE A 87 -6.679 19.140 -6.980 1.00 0.00 C ATOM 605 CD2 PHE A 87 -6.621 17.262 -5.447 1.00 0.00 C ATOM 606 CE1 PHE A 87 -5.552 18.637 -7.640 1.00 0.00 C ATOM 607 CE2 PHE A 87 -5.493 16.759 -6.107 1.00 0.00 C ATOM 608 CZ PHE A 87 -4.959 17.446 -7.203 1.00 0.00 C ATOM 0 H PHE A 87 -7.678 18.688 -2.915 1.00 0.00 H new ATOM 0 HA PHE A 87 -7.237 20.789 -4.840 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -8.853 18.232 -4.518 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -9.201 19.258 -5.896 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -7.136 20.059 -7.316 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -7.033 16.732 -4.601 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -5.140 19.167 -8.486 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -5.035 15.841 -5.770 1.00 0.00 H new ATOM 0 HZ PHE A 87 -4.089 17.058 -7.712 1.00 0.00 H new ATOM 618 N LEU A 88 -10.102 20.886 -3.273 1.00 0.00 N ATOM 619 CA LEU A 88 -11.286 21.773 -3.056 1.00 0.00 C ATOM 620 C LEU A 88 -10.816 23.161 -2.615 1.00 0.00 C ATOM 621 O LEU A 88 -11.450 24.160 -2.895 1.00 0.00 O ATOM 622 CB LEU A 88 -12.100 21.103 -1.946 1.00 0.00 C ATOM 623 CG LEU A 88 -13.100 20.125 -2.564 1.00 0.00 C ATOM 624 CD1 LEU A 88 -13.351 18.968 -1.596 1.00 0.00 C ATOM 625 CD2 LEU A 88 -14.419 20.851 -2.840 1.00 0.00 C ATOM 0 H LEU A 88 -10.051 20.074 -2.657 1.00 0.00 H new ATOM 0 HA LEU A 88 -11.878 21.902 -3.962 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -11.436 20.576 -1.261 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -12.627 21.857 -1.361 1.00 0.00 H new ATOM 0 HG LEU A 88 -12.695 19.736 -3.498 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -14.064 18.272 -2.038 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -12.413 18.450 -1.398 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -13.755 19.357 -0.661 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -15.132 20.155 -3.281 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -14.822 21.241 -1.905 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -14.243 21.675 -3.531 1.00 0.00 H new ATOM 637 N GLN A 89 -9.702 23.223 -1.933 1.00 0.00 N ATOM 638 CA GLN A 89 -9.167 24.538 -1.472 1.00 0.00 C ATOM 639 C GLN A 89 -8.109 25.049 -2.454 1.00 0.00 C ATOM 640 O GLN A 89 -7.887 26.239 -2.577 1.00 0.00 O ATOM 641 CB GLN A 89 -8.535 24.255 -0.109 1.00 0.00 C ATOM 642 CG GLN A 89 -9.610 23.775 0.868 1.00 0.00 C ATOM 643 CD GLN A 89 -8.995 23.603 2.258 1.00 0.00 C ATOM 644 OE1 GLN A 89 -9.587 23.984 3.248 1.00 0.00 O ATOM 645 NE2 GLN A 89 -7.822 23.041 2.377 1.00 0.00 N ATOM 0 H GLN A 89 -9.137 22.414 -1.674 1.00 0.00 H new ATOM 0 HA GLN A 89 -9.944 25.300 -1.411 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -7.756 23.499 -0.208 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -8.057 25.156 0.275 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -10.428 24.494 0.907 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -10.032 22.830 0.526 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -7.323 22.720 1.547 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -7.405 22.923 3.300 1.00 0.00 H new ATOM 654 N LEU A 90 -7.453 24.155 -3.153 1.00 0.00 N ATOM 655 CA LEU A 90 -6.400 24.577 -4.133 1.00 0.00 C ATOM 656 C LEU A 90 -6.985 25.549 -5.164 1.00 0.00 C ATOM 657 O LEU A 90 -6.504 26.668 -5.233 1.00 0.00 O ATOM 658 CB LEU A 90 -5.945 23.282 -4.819 1.00 0.00 C ATOM 659 CG LEU A 90 -4.436 23.330 -5.112 1.00 0.00 C ATOM 660 CD1 LEU A 90 -4.116 24.525 -6.015 1.00 0.00 C ATOM 661 CD2 LEU A 90 -3.659 23.457 -3.797 1.00 0.00 C ATOM 662 OXT LEU A 90 -7.902 25.156 -5.866 1.00 0.00 O ATOM 0 H LEU A 90 -7.601 23.148 -3.088 1.00 0.00 H new ATOM 0 HA LEU A 90 -5.574 25.093 -3.644 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -6.171 22.427 -4.182 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -6.498 23.142 -5.748 1.00 0.00 H new ATOM 0 HG LEU A 90 -4.143 22.411 -5.619 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -3.045 24.552 -6.218 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -4.661 24.428 -6.954 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -4.414 25.448 -5.517 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -2.590 23.491 -4.008 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.957 24.372 -3.285 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -3.877 22.599 -3.161 1.00 0.00 H new ATOM 675 N GLY B 166 -8.363 28.427 -1.257 1.00 0.00 N ATOM 676 CA GLY B 166 -7.000 28.927 -1.595 1.00 0.00 C ATOM 677 C GLY B 166 -6.642 30.098 -0.678 1.00 0.00 C ATOM 678 O GLY B 166 -7.497 30.868 -0.279 1.00 0.00 O ATOM 0 HA2 GLY B 166 -6.269 28.126 -1.482 1.00 0.00 H new ATOM 0 HA3 GLY B 166 -6.966 29.244 -2.637 1.00 0.00 H new ATOM 684 N LEU B 167 -5.385 30.237 -0.344 1.00 0.00 N ATOM 685 CA LEU B 167 -4.960 31.363 0.551 1.00 0.00 C ATOM 686 C LEU B 167 -3.951 32.271 -0.165 1.00 0.00 C ATOM 687 O LEU B 167 -3.872 33.454 0.115 1.00 0.00 O ATOM 688 CB LEU B 167 -4.336 30.743 1.830 1.00 0.00 C ATOM 689 CG LEU B 167 -3.649 29.388 1.566 1.00 0.00 C ATOM 690 CD1 LEU B 167 -2.393 29.587 0.708 1.00 0.00 C ATOM 691 CD2 LEU B 167 -3.256 28.758 2.907 1.00 0.00 C ATOM 0 H LEU B 167 -4.632 29.621 -0.651 1.00 0.00 H new ATOM 0 HA LEU B 167 -5.818 31.981 0.816 1.00 0.00 H new ATOM 0 HB2 LEU B 167 -3.608 31.439 2.247 1.00 0.00 H new ATOM 0 HB3 LEU B 167 -5.115 30.610 2.580 1.00 0.00 H new ATOM 0 HG LEU B 167 -4.339 28.734 1.033 1.00 0.00 H new ATOM 0 HD11 LEU B 167 -1.918 28.622 0.529 1.00 0.00 H new ATOM 0 HD12 LEU B 167 -2.671 30.037 -0.245 1.00 0.00 H new ATOM 0 HD13 LEU B 167 -1.696 30.243 1.229 1.00 0.00 H new ATOM 0 HD21 LEU B 167 -2.769 27.799 2.730 1.00 0.00 H new ATOM 0 HD22 LEU B 167 -2.570 29.421 3.433 1.00 0.00 H new ATOM 0 HD23 LEU B 167 -4.149 28.605 3.513 1.00 0.00 H new ATOM 703 N SER B 168 -3.187 31.736 -1.084 1.00 0.00 N ATOM 704 CA SER B 168 -2.188 32.579 -1.817 1.00 0.00 C ATOM 705 C SER B 168 -1.652 31.863 -3.069 1.00 0.00 C ATOM 706 O SER B 168 -0.620 32.232 -3.598 1.00 0.00 O ATOM 707 CB SER B 168 -1.059 32.808 -0.814 1.00 0.00 C ATOM 708 OG SER B 168 -0.227 33.863 -1.278 1.00 0.00 O ATOM 0 H SER B 168 -3.210 30.754 -1.359 1.00 0.00 H new ATOM 0 HA SER B 168 -2.634 33.509 -2.169 1.00 0.00 H new ATOM 0 HB2 SER B 168 -1.471 33.057 0.164 1.00 0.00 H new ATOM 0 HB3 SER B 168 -0.475 31.896 -0.691 1.00 0.00 H new ATOM 0 HG SER B 168 -0.045 33.740 -2.233 1.00 0.00 H new ATOM 714 N LYS B 169 -2.337 30.847 -3.550 1.00 0.00 N ATOM 715 CA LYS B 169 -1.869 30.106 -4.769 1.00 0.00 C ATOM 716 C LYS B 169 -0.388 29.730 -4.657 1.00 0.00 C ATOM 717 O LYS B 169 0.298 29.575 -5.650 1.00 0.00 O ATOM 718 CB LYS B 169 -2.091 31.067 -5.936 1.00 0.00 C ATOM 719 CG LYS B 169 -2.168 30.271 -7.241 1.00 0.00 C ATOM 720 CD LYS B 169 -3.457 29.447 -7.263 1.00 0.00 C ATOM 721 CE LYS B 169 -3.723 28.953 -8.686 1.00 0.00 C ATOM 722 NZ LYS B 169 -5.206 28.829 -8.779 1.00 0.00 N ATOM 0 H LYS B 169 -3.206 30.498 -3.146 1.00 0.00 H new ATOM 0 HA LYS B 169 -2.413 29.170 -4.898 1.00 0.00 H new ATOM 0 HB2 LYS B 169 -3.011 31.632 -5.787 1.00 0.00 H new ATOM 0 HB3 LYS B 169 -1.277 31.791 -5.986 1.00 0.00 H new ATOM 0 HG2 LYS B 169 -2.143 30.949 -8.094 1.00 0.00 H new ATOM 0 HG3 LYS B 169 -1.303 29.614 -7.330 1.00 0.00 H new ATOM 0 HD2 LYS B 169 -3.371 28.600 -6.583 1.00 0.00 H new ATOM 0 HD3 LYS B 169 -4.294 30.052 -6.914 1.00 0.00 H new ATOM 0 HE2 LYS B 169 -3.338 29.655 -9.426 1.00 0.00 H new ATOM 0 HE3 LYS B 169 -3.234 27.996 -8.870 1.00 0.00 H new ATOM 0 HZ1 LYS B 169 -5.468 28.494 -9.728 1.00 0.00 H new ATOM 0 HZ2 LYS B 169 -5.543 28.150 -8.067 1.00 0.00 H new ATOM 0 HZ3 LYS B 169 -5.643 29.757 -8.606 1.00 0.00 H new ATOM 736 N GLU B 170 0.101 29.584 -3.455 1.00 0.00 N ATOM 737 CA GLU B 170 1.536 29.219 -3.266 1.00 0.00 C ATOM 738 C GLU B 170 1.725 28.508 -1.928 1.00 0.00 C ATOM 739 O GLU B 170 2.373 27.481 -1.849 1.00 0.00 O ATOM 740 CB GLU B 170 2.295 30.550 -3.284 1.00 0.00 C ATOM 741 CG GLU B 170 3.017 30.716 -4.624 1.00 0.00 C ATOM 742 CD GLU B 170 3.326 32.197 -4.859 1.00 0.00 C ATOM 743 OE1 GLU B 170 4.253 32.692 -4.240 1.00 0.00 O ATOM 744 OE2 GLU B 170 2.630 32.809 -5.652 1.00 0.00 O ATOM 0 H GLU B 170 -0.432 29.702 -2.593 1.00 0.00 H new ATOM 0 HA GLU B 170 1.895 28.540 -4.040 1.00 0.00 H new ATOM 0 HB2 GLU B 170 1.602 31.377 -3.129 1.00 0.00 H new ATOM 0 HB3 GLU B 170 3.015 30.580 -2.466 1.00 0.00 H new ATOM 0 HG2 GLU B 170 3.940 30.136 -4.626 1.00 0.00 H new ATOM 0 HG3 GLU B 170 2.397 30.330 -5.433 1.00 0.00 H new ATOM 751 N GLU B 171 1.157 29.043 -0.877 1.00 0.00 N ATOM 752 CA GLU B 171 1.298 28.393 0.455 1.00 0.00 C ATOM 753 C GLU B 171 0.419 27.145 0.503 1.00 0.00 C ATOM 754 O GLU B 171 0.781 26.143 1.090 1.00 0.00 O ATOM 755 CB GLU B 171 0.834 29.436 1.474 1.00 0.00 C ATOM 756 CG GLU B 171 2.046 30.192 2.020 1.00 0.00 C ATOM 757 CD GLU B 171 1.583 31.493 2.676 1.00 0.00 C ATOM 758 OE1 GLU B 171 1.237 32.410 1.949 1.00 0.00 O ATOM 759 OE2 GLU B 171 1.583 31.551 3.896 1.00 0.00 O ATOM 0 H GLU B 171 0.604 29.900 -0.886 1.00 0.00 H new ATOM 0 HA GLU B 171 2.320 28.077 0.662 1.00 0.00 H new ATOM 0 HB2 GLU B 171 0.138 30.133 1.006 1.00 0.00 H new ATOM 0 HB3 GLU B 171 0.298 28.950 2.289 1.00 0.00 H new ATOM 0 HG2 GLU B 171 2.576 29.575 2.746 1.00 0.00 H new ATOM 0 HG3 GLU B 171 2.747 30.408 1.213 1.00 0.00 H new ATOM 766 N LEU B 172 -0.722 27.197 -0.133 1.00 0.00 N ATOM 767 CA LEU B 172 -1.621 26.007 -0.157 1.00 0.00 C ATOM 768 C LEU B 172 -1.065 24.973 -1.140 1.00 0.00 C ATOM 769 O LEU B 172 -1.294 23.786 -0.999 1.00 0.00 O ATOM 770 CB LEU B 172 -2.979 26.526 -0.634 1.00 0.00 C ATOM 771 CG LEU B 172 -4.027 25.425 -0.473 1.00 0.00 C ATOM 772 CD1 LEU B 172 -4.380 25.266 1.007 1.00 0.00 C ATOM 773 CD2 LEU B 172 -5.285 25.802 -1.259 1.00 0.00 C ATOM 0 H LEU B 172 -1.070 28.013 -0.637 1.00 0.00 H new ATOM 0 HA LEU B 172 -1.702 25.527 0.818 1.00 0.00 H new ATOM 0 HB2 LEU B 172 -3.268 27.405 -0.058 1.00 0.00 H new ATOM 0 HB3 LEU B 172 -2.917 26.835 -1.678 1.00 0.00 H new ATOM 0 HG LEU B 172 -3.627 24.485 -0.853 1.00 0.00 H new ATOM 0 HD11 LEU B 172 -5.127 24.481 1.120 1.00 0.00 H new ATOM 0 HD12 LEU B 172 -3.485 24.999 1.568 1.00 0.00 H new ATOM 0 HD13 LEU B 172 -4.780 26.205 1.389 1.00 0.00 H new ATOM 0 HD21 LEU B 172 -6.034 25.018 -1.145 1.00 0.00 H new ATOM 0 HD22 LEU B 172 -5.684 26.742 -0.878 1.00 0.00 H new ATOM 0 HD23 LEU B 172 -5.035 25.915 -2.314 1.00 0.00 H new ATOM 785 N ILE B 173 -0.324 25.419 -2.126 1.00 0.00 N ATOM 786 CA ILE B 173 0.263 24.466 -3.115 1.00 0.00 C ATOM 787 C ILE B 173 1.343 23.631 -2.429 1.00 0.00 C ATOM 788 O ILE B 173 1.547 22.475 -2.750 1.00 0.00 O ATOM 789 CB ILE B 173 0.881 25.334 -4.220 1.00 0.00 C ATOM 790 CG1 ILE B 173 -0.174 26.281 -4.820 1.00 0.00 C ATOM 791 CG2 ILE B 173 1.441 24.430 -5.321 1.00 0.00 C ATOM 792 CD1 ILE B 173 -1.340 25.480 -5.411 1.00 0.00 C ATOM 0 H ILE B 173 -0.102 26.401 -2.287 1.00 0.00 H new ATOM 0 HA ILE B 173 -0.482 23.783 -3.522 1.00 0.00 H new ATOM 0 HB ILE B 173 1.682 25.934 -3.788 1.00 0.00 H new ATOM 0 HG12 ILE B 173 -0.544 26.958 -4.050 1.00 0.00 H new ATOM 0 HG13 ILE B 173 0.281 26.898 -5.595 1.00 0.00 H new ATOM 0 HG21 ILE B 173 1.881 25.044 -6.107 1.00 0.00 H new ATOM 0 HG22 ILE B 173 2.205 23.776 -4.901 1.00 0.00 H new ATOM 0 HG23 ILE B 173 0.636 23.826 -5.740 1.00 0.00 H new ATOM 0 HD11 ILE B 173 -2.076 26.165 -5.831 1.00 0.00 H new ATOM 0 HD12 ILE B 173 -0.968 24.822 -6.196 1.00 0.00 H new ATOM 0 HD13 ILE B 173 -1.806 24.883 -4.627 1.00 0.00 H new ATOM 804 N GLN B 174 2.032 24.214 -1.479 1.00 0.00 N ATOM 805 CA GLN B 174 3.100 23.461 -0.755 1.00 0.00 C ATOM 806 C GLN B 174 2.468 22.397 0.143 1.00 0.00 C ATOM 807 O GLN B 174 3.047 21.355 0.389 1.00 0.00 O ATOM 808 CB GLN B 174 3.834 24.508 0.087 1.00 0.00 C ATOM 809 CG GLN B 174 5.312 24.130 0.196 1.00 0.00 C ATOM 810 CD GLN B 174 5.933 24.840 1.400 1.00 0.00 C ATOM 811 OE1 GLN B 174 5.618 25.981 1.676 1.00 0.00 O ATOM 812 NE2 GLN B 174 6.811 24.210 2.133 1.00 0.00 N ATOM 0 H GLN B 174 1.900 25.179 -1.174 1.00 0.00 H new ATOM 0 HA GLN B 174 3.778 22.947 -1.437 1.00 0.00 H new ATOM 0 HB2 GLN B 174 3.732 25.493 -0.369 1.00 0.00 H new ATOM 0 HB3 GLN B 174 3.389 24.569 1.080 1.00 0.00 H new ATOM 0 HG2 GLN B 174 5.415 23.050 0.304 1.00 0.00 H new ATOM 0 HG3 GLN B 174 5.838 24.411 -0.716 1.00 0.00 H new ATOM 0 HE21 GLN B 174 7.076 23.252 1.902 1.00 0.00 H new ATOM 0 HE22 GLN B 174 7.232 24.675 2.937 1.00 0.00 H new ATOM 821 N ASN B 175 1.279 22.653 0.629 1.00 0.00 N ATOM 822 CA ASN B 175 0.596 21.658 1.510 1.00 0.00 C ATOM 823 C ASN B 175 0.239 20.408 0.703 1.00 0.00 C ATOM 824 O ASN B 175 0.238 19.306 1.220 1.00 0.00 O ATOM 825 CB ASN B 175 -0.672 22.358 2.007 1.00 0.00 C ATOM 826 CG ASN B 175 -0.300 23.406 3.057 1.00 0.00 C ATOM 827 OD1 ASN B 175 0.678 23.254 3.763 1.00 0.00 O ATOM 828 ND2 ASN B 175 -1.041 24.471 3.191 1.00 0.00 N ATOM 0 H ASN B 175 0.752 23.509 0.453 1.00 0.00 H new ATOM 0 HA ASN B 175 1.228 21.338 2.339 1.00 0.00 H new ATOM 0 HB2 ASN B 175 -1.189 22.832 1.173 1.00 0.00 H new ATOM 0 HB3 ASN B 175 -1.359 21.628 2.435 1.00 0.00 H new ATOM 0 HD21 ASN B 175 -0.800 25.176 3.888 1.00 0.00 H new ATOM 0 HD22 ASN B 175 -1.862 24.599 2.599 1.00 0.00 H new ATOM 835 N MET B 176 -0.055 20.575 -0.561 1.00 0.00 N ATOM 836 CA MET B 176 -0.405 19.398 -1.413 1.00 0.00 C ATOM 837 C MET B 176 0.846 18.554 -1.668 1.00 0.00 C ATOM 838 O MET B 176 0.775 17.348 -1.806 1.00 0.00 O ATOM 839 CB MET B 176 -0.937 19.986 -2.726 1.00 0.00 C ATOM 840 CG MET B 176 -2.460 19.810 -2.793 1.00 0.00 C ATOM 841 SD MET B 176 -2.963 19.459 -4.497 1.00 0.00 S ATOM 842 CE MET B 176 -4.583 20.263 -4.423 1.00 0.00 C ATOM 0 H MET B 176 -0.068 21.475 -1.040 1.00 0.00 H new ATOM 0 HA MET B 176 -1.142 18.750 -0.939 1.00 0.00 H new ATOM 0 HB2 MET B 176 -0.680 21.043 -2.792 1.00 0.00 H new ATOM 0 HB3 MET B 176 -0.466 19.490 -3.575 1.00 0.00 H new ATOM 0 HG2 MET B 176 -2.770 18.996 -2.138 1.00 0.00 H new ATOM 0 HG3 MET B 176 -2.956 20.713 -2.437 1.00 0.00 H new ATOM 0 HE1 MET B 176 -4.776 20.780 -5.363 1.00 0.00 H new ATOM 0 HE2 MET B 176 -5.355 19.511 -4.258 1.00 0.00 H new ATOM 0 HE3 MET B 176 -4.595 20.982 -3.604 1.00 0.00 H new ATOM 852 N ASP B 177 1.989 19.186 -1.725 1.00 0.00 N ATOM 853 CA ASP B 177 3.257 18.432 -1.964 1.00 0.00 C ATOM 854 C ASP B 177 3.636 17.642 -0.710 1.00 0.00 C ATOM 855 O ASP B 177 4.241 16.590 -0.786 1.00 0.00 O ATOM 856 CB ASP B 177 4.311 19.499 -2.267 1.00 0.00 C ATOM 857 CG ASP B 177 4.407 19.708 -3.778 1.00 0.00 C ATOM 858 OD1 ASP B 177 3.369 19.842 -4.405 1.00 0.00 O ATOM 859 OD2 ASP B 177 5.517 19.731 -4.285 1.00 0.00 O ATOM 0 H ASP B 177 2.100 20.194 -1.616 1.00 0.00 H new ATOM 0 HA ASP B 177 3.165 17.716 -2.781 1.00 0.00 H new ATOM 0 HB2 ASP B 177 4.047 20.436 -1.776 1.00 0.00 H new ATOM 0 HB3 ASP B 177 5.279 19.192 -1.870 1.00 0.00 H new ATOM 864 N ARG B 178 3.276 18.145 0.444 1.00 0.00 N ATOM 865 CA ARG B 178 3.605 17.430 1.714 1.00 0.00 C ATOM 866 C ARG B 178 2.690 16.217 1.881 1.00 0.00 C ATOM 867 O ARG B 178 3.116 15.159 2.301 1.00 0.00 O ATOM 868 CB ARG B 178 3.355 18.451 2.827 1.00 0.00 C ATOM 869 CG ARG B 178 4.678 19.118 3.218 1.00 0.00 C ATOM 870 CD ARG B 178 5.276 18.395 4.427 1.00 0.00 C ATOM 871 NE ARG B 178 5.850 17.136 3.876 1.00 0.00 N ATOM 872 CZ ARG B 178 7.142 17.010 3.746 1.00 0.00 C ATOM 873 NH1 ARG B 178 7.931 17.316 4.740 1.00 0.00 N ATOM 874 NH2 ARG B 178 7.647 16.577 2.624 1.00 0.00 N ATOM 0 H ARG B 178 2.768 19.021 0.561 1.00 0.00 H new ATOM 0 HA ARG B 178 4.631 17.062 1.728 1.00 0.00 H new ATOM 0 HB2 ARG B 178 2.642 19.204 2.491 1.00 0.00 H new ATOM 0 HB3 ARG B 178 2.914 17.959 3.694 1.00 0.00 H new ATOM 0 HG2 ARG B 178 5.375 19.086 2.381 1.00 0.00 H new ATOM 0 HG3 ARG B 178 4.512 20.169 3.455 1.00 0.00 H new ATOM 0 HD2 ARG B 178 6.043 19.001 4.910 1.00 0.00 H new ATOM 0 HD3 ARG B 178 4.515 18.186 5.179 1.00 0.00 H new ATOM 0 HE ARG B 178 5.233 16.372 3.600 1.00 0.00 H new ATOM 0 HH11 ARG B 178 7.537 17.654 5.618 1.00 0.00 H new ATOM 0 HH12 ARG B 178 8.941 17.217 4.638 1.00 0.00 H new ATOM 0 HH21 ARG B 178 7.032 16.336 1.847 1.00 0.00 H new ATOM 0 HH22 ARG B 178 8.657 16.479 2.524 1.00 0.00 H new ATOM 888 N VAL B 179 1.436 16.366 1.541 1.00 0.00 N ATOM 889 CA VAL B 179 0.482 15.223 1.664 1.00 0.00 C ATOM 890 C VAL B 179 0.785 14.187 0.579 1.00 0.00 C ATOM 891 O VAL B 179 0.591 13.001 0.768 1.00 0.00 O ATOM 892 CB VAL B 179 -0.911 15.830 1.464 1.00 0.00 C ATOM 893 CG1 VAL B 179 -1.974 14.733 1.575 1.00 0.00 C ATOM 894 CG2 VAL B 179 -1.167 16.889 2.540 1.00 0.00 C ATOM 0 H VAL B 179 1.031 17.231 1.183 1.00 0.00 H new ATOM 0 HA VAL B 179 0.558 14.717 2.627 1.00 0.00 H new ATOM 0 HB VAL B 179 -0.963 16.289 0.477 1.00 0.00 H new ATOM 0 HG11 VAL B 179 -2.963 15.169 1.432 1.00 0.00 H new ATOM 0 HG12 VAL B 179 -1.797 13.976 0.811 1.00 0.00 H new ATOM 0 HG13 VAL B 179 -1.920 14.272 2.561 1.00 0.00 H new ATOM 0 HG21 VAL B 179 -2.158 17.320 2.397 1.00 0.00 H new ATOM 0 HG22 VAL B 179 -1.111 16.427 3.526 1.00 0.00 H new ATOM 0 HG23 VAL B 179 -0.415 17.674 2.464 1.00 0.00 H new ATOM 904 N ASP B 180 1.269 14.632 -0.552 1.00 0.00 N ATOM 905 CA ASP B 180 1.599 13.681 -1.656 1.00 0.00 C ATOM 906 C ASP B 180 2.847 12.876 -1.289 1.00 0.00 C ATOM 907 O ASP B 180 3.006 11.740 -1.695 1.00 0.00 O ATOM 908 CB ASP B 180 1.867 14.560 -2.880 1.00 0.00 C ATOM 909 CG ASP B 180 1.999 13.678 -4.123 1.00 0.00 C ATOM 910 OD1 ASP B 180 1.008 13.075 -4.504 1.00 0.00 O ATOM 911 OD2 ASP B 180 3.085 13.620 -4.672 1.00 0.00 O ATOM 0 H ASP B 180 1.450 15.614 -0.759 1.00 0.00 H new ATOM 0 HA ASP B 180 0.796 12.967 -1.843 1.00 0.00 H new ATOM 0 HB2 ASP B 180 1.055 15.274 -3.013 1.00 0.00 H new ATOM 0 HB3 ASP B 180 2.779 15.138 -2.733 1.00 0.00 H new ATOM 916 N ARG B 181 3.730 13.460 -0.517 1.00 0.00 N ATOM 917 CA ARG B 181 4.971 12.734 -0.111 1.00 0.00 C ATOM 918 C ARG B 181 4.610 11.568 0.812 1.00 0.00 C ATOM 919 O ARG B 181 5.255 10.536 0.805 1.00 0.00 O ATOM 920 CB ARG B 181 5.820 13.766 0.634 1.00 0.00 C ATOM 921 CG ARG B 181 7.303 13.480 0.389 1.00 0.00 C ATOM 922 CD ARG B 181 7.675 13.899 -1.035 1.00 0.00 C ATOM 923 NE ARG B 181 8.252 15.264 -0.896 1.00 0.00 N ATOM 924 CZ ARG B 181 8.238 16.086 -1.910 1.00 0.00 C ATOM 925 NH1 ARG B 181 7.112 16.619 -2.302 1.00 0.00 N ATOM 926 NH2 ARG B 181 9.347 16.374 -2.532 1.00 0.00 N ATOM 0 H ARG B 181 3.644 14.408 -0.151 1.00 0.00 H new ATOM 0 HA ARG B 181 5.505 12.318 -0.965 1.00 0.00 H new ATOM 0 HB2 ARG B 181 5.572 14.771 0.293 1.00 0.00 H new ATOM 0 HB3 ARG B 181 5.603 13.729 1.702 1.00 0.00 H new ATOM 0 HG2 ARG B 181 7.913 14.023 1.110 1.00 0.00 H new ATOM 0 HG3 ARG B 181 7.508 12.419 0.533 1.00 0.00 H new ATOM 0 HD2 ARG B 181 8.395 13.209 -1.474 1.00 0.00 H new ATOM 0 HD3 ARG B 181 6.801 13.904 -1.686 1.00 0.00 H new ATOM 0 HE ARG B 181 8.659 15.557 -0.008 1.00 0.00 H new ATOM 0 HH11 ARG B 181 6.244 16.393 -1.816 1.00 0.00 H new ATOM 0 HH12 ARG B 181 7.100 17.261 -3.094 1.00 0.00 H new ATOM 0 HH21 ARG B 181 10.226 15.957 -2.226 1.00 0.00 H new ATOM 0 HH22 ARG B 181 9.335 17.016 -3.324 1.00 0.00 H new ATOM 940 N GLU B 182 3.578 11.727 1.604 1.00 0.00 N ATOM 941 CA GLU B 182 3.162 10.629 2.528 1.00 0.00 C ATOM 942 C GLU B 182 2.480 9.512 1.737 1.00 0.00 C ATOM 943 O GLU B 182 2.629 8.344 2.040 1.00 0.00 O ATOM 944 CB GLU B 182 2.178 11.274 3.504 1.00 0.00 C ATOM 945 CG GLU B 182 1.761 10.251 4.562 1.00 0.00 C ATOM 946 CD GLU B 182 1.305 10.980 5.827 1.00 0.00 C ATOM 947 OE1 GLU B 182 2.049 11.819 6.305 1.00 0.00 O ATOM 948 OE2 GLU B 182 0.217 10.687 6.296 1.00 0.00 O ATOM 0 H GLU B 182 3.006 12.570 1.650 1.00 0.00 H new ATOM 0 HA GLU B 182 4.010 10.183 3.048 1.00 0.00 H new ATOM 0 HB2 GLU B 182 2.638 12.139 3.981 1.00 0.00 H new ATOM 0 HB3 GLU B 182 1.301 11.635 2.967 1.00 0.00 H new ATOM 0 HG2 GLU B 182 0.955 9.625 4.180 1.00 0.00 H new ATOM 0 HG3 GLU B 182 2.596 9.589 4.792 1.00 0.00 H new ATOM 955 N ILE B 183 1.738 9.869 0.722 1.00 0.00 N ATOM 956 CA ILE B 183 1.044 8.835 -0.105 1.00 0.00 C ATOM 957 C ILE B 183 2.066 8.100 -0.977 1.00 0.00 C ATOM 958 O ILE B 183 1.898 6.940 -1.301 1.00 0.00 O ATOM 959 CB ILE B 183 0.046 9.607 -0.976 1.00 0.00 C ATOM 960 CG1 ILE B 183 -0.930 10.375 -0.080 1.00 0.00 C ATOM 961 CG2 ILE B 183 -0.741 8.626 -1.848 1.00 0.00 C ATOM 962 CD1 ILE B 183 -1.820 11.273 -0.943 1.00 0.00 C ATOM 0 H ILE B 183 1.582 10.833 0.429 1.00 0.00 H new ATOM 0 HA ILE B 183 0.541 8.086 0.507 1.00 0.00 H new ATOM 0 HB ILE B 183 0.590 10.306 -1.610 1.00 0.00 H new ATOM 0 HG12 ILE B 183 -1.544 9.677 0.489 1.00 0.00 H new ATOM 0 HG13 ILE B 183 -0.379 10.978 0.642 1.00 0.00 H new ATOM 0 HG21 ILE B 183 -1.450 9.177 -2.466 1.00 0.00 H new ATOM 0 HG22 ILE B 183 -0.052 8.075 -2.489 1.00 0.00 H new ATOM 0 HG23 ILE B 183 -1.282 7.926 -1.211 1.00 0.00 H new ATOM 0 HD11 ILE B 183 -2.514 11.819 -0.304 1.00 0.00 H new ATOM 0 HD12 ILE B 183 -1.199 11.981 -1.492 1.00 0.00 H new ATOM 0 HD13 ILE B 183 -2.381 10.660 -1.648 1.00 0.00 H new ATOM 974 N THR B 184 3.126 8.770 -1.350 1.00 0.00 N ATOM 975 CA THR B 184 4.172 8.118 -2.196 1.00 0.00 C ATOM 976 C THR B 184 4.991 7.143 -1.348 1.00 0.00 C ATOM 977 O THR B 184 5.445 6.121 -1.828 1.00 0.00 O ATOM 978 CB THR B 184 5.053 9.261 -2.704 1.00 0.00 C ATOM 979 OG1 THR B 184 4.244 10.222 -3.368 1.00 0.00 O ATOM 980 CG2 THR B 184 6.097 8.710 -3.675 1.00 0.00 C ATOM 0 H THR B 184 3.313 9.742 -1.105 1.00 0.00 H new ATOM 0 HA THR B 184 3.742 7.548 -3.019 1.00 0.00 H new ATOM 0 HB THR B 184 5.558 9.733 -1.861 1.00 0.00 H new ATOM 0 HG1 THR B 184 3.941 10.896 -2.724 1.00 0.00 H new ATOM 0 HG21 THR B 184 6.724 9.525 -4.036 1.00 0.00 H new ATOM 0 HG22 THR B 184 6.717 7.974 -3.163 1.00 0.00 H new ATOM 0 HG23 THR B 184 5.595 8.237 -4.519 1.00 0.00 H new ATOM 988 N MET B 185 5.175 7.452 -0.089 1.00 0.00 N ATOM 989 CA MET B 185 5.957 6.543 0.801 1.00 0.00 C ATOM 990 C MET B 185 5.118 5.312 1.146 1.00 0.00 C ATOM 991 O MET B 185 5.617 4.204 1.193 1.00 0.00 O ATOM 992 CB MET B 185 6.255 7.364 2.058 1.00 0.00 C ATOM 993 CG MET B 185 7.663 7.956 1.964 1.00 0.00 C ATOM 994 SD MET B 185 8.070 8.796 3.514 1.00 0.00 S ATOM 995 CE MET B 185 9.853 8.487 3.479 1.00 0.00 C ATOM 0 H MET B 185 4.817 8.295 0.360 1.00 0.00 H new ATOM 0 HA MET B 185 6.874 6.188 0.330 1.00 0.00 H new ATOM 0 HB2 MET B 185 5.521 8.162 2.166 1.00 0.00 H new ATOM 0 HB3 MET B 185 6.173 6.734 2.944 1.00 0.00 H new ATOM 0 HG2 MET B 185 8.388 7.167 1.765 1.00 0.00 H new ATOM 0 HG3 MET B 185 7.719 8.658 1.132 1.00 0.00 H new ATOM 0 HE1 MET B 185 10.316 8.928 4.362 1.00 0.00 H new ATOM 0 HE2 MET B 185 10.036 7.412 3.472 1.00 0.00 H new ATOM 0 HE3 MET B 185 10.282 8.934 2.582 1.00 0.00 H new ATOM 1005 N VAL B 186 3.843 5.500 1.375 1.00 0.00 N ATOM 1006 CA VAL B 186 2.958 4.343 1.706 1.00 0.00 C ATOM 1007 C VAL B 186 2.731 3.497 0.450 1.00 0.00 C ATOM 1008 O VAL B 186 2.559 2.296 0.522 1.00 0.00 O ATOM 1009 CB VAL B 186 1.642 4.960 2.192 1.00 0.00 C ATOM 1010 CG1 VAL B 186 0.661 3.848 2.572 1.00 0.00 C ATOM 1011 CG2 VAL B 186 1.907 5.838 3.419 1.00 0.00 C ATOM 0 H VAL B 186 3.376 6.407 1.347 1.00 0.00 H new ATOM 0 HA VAL B 186 3.391 3.690 2.464 1.00 0.00 H new ATOM 0 HB VAL B 186 1.215 5.567 1.393 1.00 0.00 H new ATOM 0 HG11 VAL B 186 -0.274 4.290 2.917 1.00 0.00 H new ATOM 0 HG12 VAL B 186 0.467 3.221 1.702 1.00 0.00 H new ATOM 0 HG13 VAL B 186 1.091 3.240 3.368 1.00 0.00 H new ATOM 0 HG21 VAL B 186 0.970 6.276 3.763 1.00 0.00 H new ATOM 0 HG22 VAL B 186 2.337 5.230 4.215 1.00 0.00 H new ATOM 0 HG23 VAL B 186 2.603 6.634 3.154 1.00 0.00 H new ATOM 1021 N GLU B 187 2.739 4.123 -0.699 1.00 0.00 N ATOM 1022 CA GLU B 187 2.534 3.366 -1.972 1.00 0.00 C ATOM 1023 C GLU B 187 3.781 2.539 -2.293 1.00 0.00 C ATOM 1024 O GLU B 187 3.699 1.490 -2.906 1.00 0.00 O ATOM 1025 CB GLU B 187 2.306 4.435 -3.044 1.00 0.00 C ATOM 1026 CG GLU B 187 1.995 3.759 -4.381 1.00 0.00 C ATOM 1027 CD GLU B 187 1.863 4.824 -5.472 1.00 0.00 C ATOM 1028 OE1 GLU B 187 0.852 5.507 -5.486 1.00 0.00 O ATOM 1029 OE2 GLU B 187 2.775 4.938 -6.274 1.00 0.00 O ATOM 0 H GLU B 187 2.879 5.127 -0.811 1.00 0.00 H new ATOM 0 HA GLU B 187 1.695 2.672 -1.911 1.00 0.00 H new ATOM 0 HB2 GLU B 187 1.482 5.087 -2.753 1.00 0.00 H new ATOM 0 HB3 GLU B 187 3.191 5.064 -3.140 1.00 0.00 H new ATOM 0 HG2 GLU B 187 2.787 3.056 -4.638 1.00 0.00 H new ATOM 0 HG3 GLU B 187 1.072 3.185 -4.304 1.00 0.00 H new ATOM 1036 N GLN B 188 4.932 3.004 -1.879 1.00 0.00 N ATOM 1037 CA GLN B 188 6.193 2.248 -2.150 1.00 0.00 C ATOM 1038 C GLN B 188 6.229 0.975 -1.303 1.00 0.00 C ATOM 1039 O GLN B 188 6.807 -0.023 -1.693 1.00 0.00 O ATOM 1040 CB GLN B 188 7.326 3.195 -1.747 1.00 0.00 C ATOM 1041 CG GLN B 188 8.566 2.903 -2.595 1.00 0.00 C ATOM 1042 CD GLN B 188 8.603 3.854 -3.794 1.00 0.00 C ATOM 1043 OE1 GLN B 188 9.649 4.359 -4.150 1.00 0.00 O ATOM 1044 NE2 GLN B 188 7.498 4.120 -4.436 1.00 0.00 N ATOM 0 H GLN B 188 5.054 3.876 -1.364 1.00 0.00 H new ATOM 0 HA GLN B 188 6.276 1.943 -3.193 1.00 0.00 H new ATOM 0 HB2 GLN B 188 7.014 4.230 -1.885 1.00 0.00 H new ATOM 0 HB3 GLN B 188 7.559 3.070 -0.689 1.00 0.00 H new ATOM 0 HG2 GLN B 188 9.467 3.024 -1.994 1.00 0.00 H new ATOM 0 HG3 GLN B 188 8.549 1.869 -2.939 1.00 0.00 H new ATOM 0 HE21 GLN B 188 6.620 3.696 -4.137 1.00 0.00 H new ATOM 0 HE22 GLN B 188 7.513 4.752 -5.237 1.00 0.00 H new ATOM 1053 N GLN B 189 5.613 1.006 -0.150 1.00 0.00 N ATOM 1054 CA GLN B 189 5.601 -0.200 0.731 1.00 0.00 C ATOM 1055 C GLN B 189 4.648 -1.253 0.163 1.00 0.00 C ATOM 1056 O GLN B 189 4.885 -2.442 0.277 1.00 0.00 O ATOM 1057 CB GLN B 189 5.099 0.297 2.089 1.00 0.00 C ATOM 1058 CG GLN B 189 5.845 -0.428 3.214 1.00 0.00 C ATOM 1059 CD GLN B 189 6.977 0.460 3.738 1.00 0.00 C ATOM 1060 OE1 GLN B 189 7.229 0.503 4.927 1.00 0.00 O ATOM 1061 NE2 GLN B 189 7.676 1.173 2.898 1.00 0.00 N ATOM 0 H GLN B 189 5.117 1.816 0.220 1.00 0.00 H new ATOM 0 HA GLN B 189 6.585 -0.663 0.808 1.00 0.00 H new ATOM 0 HB2 GLN B 189 5.253 1.373 2.172 1.00 0.00 H new ATOM 0 HB3 GLN B 189 4.027 0.120 2.178 1.00 0.00 H new ATOM 0 HG2 GLN B 189 5.156 -0.671 4.023 1.00 0.00 H new ATOM 0 HG3 GLN B 189 6.250 -1.371 2.846 1.00 0.00 H new ATOM 0 HE21 GLN B 189 7.465 1.138 1.901 1.00 0.00 H new ATOM 0 HE22 GLN B 189 8.433 1.766 3.239 1.00 0.00 H new ATOM 1070 N ILE B 190 3.575 -0.824 -0.450 1.00 0.00 N ATOM 1071 CA ILE B 190 2.600 -1.795 -1.032 1.00 0.00 C ATOM 1072 C ILE B 190 3.183 -2.413 -2.304 1.00 0.00 C ATOM 1073 O ILE B 190 2.921 -3.557 -2.626 1.00 0.00 O ATOM 1074 CB ILE B 190 1.344 -0.977 -1.350 1.00 0.00 C ATOM 1075 CG1 ILE B 190 0.823 -0.325 -0.063 1.00 0.00 C ATOM 1076 CG2 ILE B 190 0.266 -1.900 -1.927 1.00 0.00 C ATOM 1077 CD1 ILE B 190 -0.377 0.572 -0.381 1.00 0.00 C ATOM 0 H ILE B 190 3.331 0.159 -0.573 1.00 0.00 H new ATOM 0 HA ILE B 190 2.375 -2.614 -0.349 1.00 0.00 H new ATOM 0 HB ILE B 190 1.587 -0.204 -2.078 1.00 0.00 H new ATOM 0 HG12 ILE B 190 0.533 -1.094 0.653 1.00 0.00 H new ATOM 0 HG13 ILE B 190 1.614 0.263 0.403 1.00 0.00 H new ATOM 0 HG21 ILE B 190 -0.628 -1.319 -2.153 1.00 0.00 H new ATOM 0 HG22 ILE B 190 0.637 -2.366 -2.840 1.00 0.00 H new ATOM 0 HG23 ILE B 190 0.021 -2.673 -1.199 1.00 0.00 H new ATOM 0 HD11 ILE B 190 -0.741 1.031 0.538 1.00 0.00 H new ATOM 0 HD12 ILE B 190 -0.074 1.351 -1.081 1.00 0.00 H new ATOM 0 HD13 ILE B 190 -1.171 -0.027 -0.827 1.00 0.00 H new ATOM 1089 N SER B 191 3.983 -1.665 -3.020 1.00 0.00 N ATOM 1090 CA SER B 191 4.600 -2.204 -4.269 1.00 0.00 C ATOM 1091 C SER B 191 5.678 -3.225 -3.905 1.00 0.00 C ATOM 1092 O SER B 191 5.869 -4.211 -4.592 1.00 0.00 O ATOM 1093 CB SER B 191 5.215 -0.995 -4.973 1.00 0.00 C ATOM 1094 OG SER B 191 6.228 -0.436 -4.147 1.00 0.00 O ATOM 0 H SER B 191 4.236 -0.703 -2.793 1.00 0.00 H new ATOM 0 HA SER B 191 3.876 -2.709 -4.909 1.00 0.00 H new ATOM 0 HB2 SER B 191 5.636 -1.294 -5.933 1.00 0.00 H new ATOM 0 HB3 SER B 191 4.446 -0.250 -5.180 1.00 0.00 H new ATOM 0 HG SER B 191 6.007 -0.594 -3.206 1.00 0.00 H new ATOM 1100 N LYS B 192 6.374 -2.997 -2.819 1.00 0.00 N ATOM 1101 CA LYS B 192 7.435 -3.957 -2.393 1.00 0.00 C ATOM 1102 C LYS B 192 6.782 -5.188 -1.764 1.00 0.00 C ATOM 1103 O LYS B 192 7.279 -6.293 -1.880 1.00 0.00 O ATOM 1104 CB LYS B 192 8.273 -3.200 -1.361 1.00 0.00 C ATOM 1105 CG LYS B 192 8.911 -1.975 -2.019 1.00 0.00 C ATOM 1106 CD LYS B 192 10.294 -2.346 -2.557 1.00 0.00 C ATOM 1107 CE LYS B 192 11.258 -2.563 -1.387 1.00 0.00 C ATOM 1108 NZ LYS B 192 12.548 -1.970 -1.836 1.00 0.00 N ATOM 0 H LYS B 192 6.252 -2.188 -2.210 1.00 0.00 H new ATOM 0 HA LYS B 192 8.048 -4.303 -3.225 1.00 0.00 H new ATOM 0 HB2 LYS B 192 7.646 -2.891 -0.524 1.00 0.00 H new ATOM 0 HB3 LYS B 192 9.047 -3.853 -0.956 1.00 0.00 H new ATOM 0 HG2 LYS B 192 8.279 -1.614 -2.830 1.00 0.00 H new ATOM 0 HG3 LYS B 192 8.996 -1.164 -1.296 1.00 0.00 H new ATOM 0 HD2 LYS B 192 10.230 -3.251 -3.161 1.00 0.00 H new ATOM 0 HD3 LYS B 192 10.667 -1.555 -3.207 1.00 0.00 H new ATOM 0 HE2 LYS B 192 10.895 -2.078 -0.481 1.00 0.00 H new ATOM 0 HE3 LYS B 192 11.369 -3.623 -1.158 1.00 0.00 H new ATOM 0 HZ1 LYS B 192 13.260 -2.080 -1.086 1.00 0.00 H new ATOM 0 HZ2 LYS B 192 12.873 -2.456 -2.696 1.00 0.00 H new ATOM 0 HZ3 LYS B 192 12.413 -0.959 -2.040 1.00 0.00 H new ATOM 1122 N LEU B 193 5.662 -5.003 -1.111 1.00 0.00 N ATOM 1123 CA LEU B 193 4.957 -6.161 -0.483 1.00 0.00 C ATOM 1124 C LEU B 193 4.349 -7.036 -1.580 1.00 0.00 C ATOM 1125 O LEU B 193 4.245 -8.240 -1.440 1.00 0.00 O ATOM 1126 CB LEU B 193 3.858 -5.547 0.399 1.00 0.00 C ATOM 1127 CG LEU B 193 4.014 -6.039 1.840 1.00 0.00 C ATOM 1128 CD1 LEU B 193 3.443 -4.993 2.801 1.00 0.00 C ATOM 1129 CD2 LEU B 193 3.255 -7.357 2.015 1.00 0.00 C ATOM 0 H LEU B 193 5.206 -4.099 -0.986 1.00 0.00 H new ATOM 0 HA LEU B 193 5.626 -6.789 0.105 1.00 0.00 H new ATOM 0 HB2 LEU B 193 3.919 -4.459 0.368 1.00 0.00 H new ATOM 0 HB3 LEU B 193 2.875 -5.822 0.016 1.00 0.00 H new ATOM 0 HG LEU B 193 5.071 -6.196 2.057 1.00 0.00 H new ATOM 0 HD11 LEU B 193 3.554 -5.343 3.827 1.00 0.00 H new ATOM 0 HD12 LEU B 193 3.982 -4.053 2.678 1.00 0.00 H new ATOM 0 HD13 LEU B 193 2.386 -4.837 2.583 1.00 0.00 H new ATOM 0 HD21 LEU B 193 3.366 -7.707 3.041 1.00 0.00 H new ATOM 0 HD22 LEU B 193 2.199 -7.200 1.798 1.00 0.00 H new ATOM 0 HD23 LEU B 193 3.659 -8.103 1.331 1.00 0.00 H new ATOM 1141 N LYS B 194 3.958 -6.436 -2.678 1.00 0.00 N ATOM 1142 CA LYS B 194 3.366 -7.227 -3.797 1.00 0.00 C ATOM 1143 C LYS B 194 4.444 -8.104 -4.433 1.00 0.00 C ATOM 1144 O LYS B 194 4.243 -9.282 -4.662 1.00 0.00 O ATOM 1145 CB LYS B 194 2.852 -6.192 -4.801 1.00 0.00 C ATOM 1146 CG LYS B 194 1.707 -6.797 -5.616 1.00 0.00 C ATOM 1147 CD LYS B 194 0.438 -6.838 -4.763 1.00 0.00 C ATOM 1148 CE LYS B 194 -0.627 -7.680 -5.469 1.00 0.00 C ATOM 1149 NZ LYS B 194 -1.915 -6.990 -5.178 1.00 0.00 N ATOM 0 H LYS B 194 4.024 -5.432 -2.846 1.00 0.00 H new ATOM 0 HA LYS B 194 2.566 -7.887 -3.461 1.00 0.00 H new ATOM 0 HB2 LYS B 194 2.508 -5.301 -4.277 1.00 0.00 H new ATOM 0 HB3 LYS B 194 3.659 -5.880 -5.464 1.00 0.00 H new ATOM 0 HG2 LYS B 194 1.534 -6.205 -6.515 1.00 0.00 H new ATOM 0 HG3 LYS B 194 1.971 -7.803 -5.942 1.00 0.00 H new ATOM 0 HD2 LYS B 194 0.660 -7.261 -3.783 1.00 0.00 H new ATOM 0 HD3 LYS B 194 0.066 -5.827 -4.597 1.00 0.00 H new ATOM 0 HE2 LYS B 194 -0.441 -7.734 -6.542 1.00 0.00 H new ATOM 0 HE3 LYS B 194 -0.634 -8.704 -5.095 1.00 0.00 H new ATOM 0 HZ1 LYS B 194 -2.696 -7.508 -5.629 1.00 0.00 H new ATOM 0 HZ2 LYS B 194 -2.068 -6.960 -4.150 1.00 0.00 H new ATOM 0 HZ3 LYS B 194 -1.881 -6.020 -5.552 1.00 0.00 H new ATOM 1163 N LYS B 195 5.595 -7.538 -4.707 1.00 0.00 N ATOM 1164 CA LYS B 195 6.699 -8.341 -5.313 1.00 0.00 C ATOM 1165 C LYS B 195 7.176 -9.386 -4.304 1.00 0.00 C ATOM 1166 O LYS B 195 7.595 -10.469 -4.668 1.00 0.00 O ATOM 1167 CB LYS B 195 7.812 -7.337 -5.619 1.00 0.00 C ATOM 1168 CG LYS B 195 8.541 -7.757 -6.898 1.00 0.00 C ATOM 1169 CD LYS B 195 7.741 -7.292 -8.116 1.00 0.00 C ATOM 1170 CE LYS B 195 8.676 -7.166 -9.322 1.00 0.00 C ATOM 1171 NZ LYS B 195 8.808 -8.553 -9.851 1.00 0.00 N ATOM 0 H LYS B 195 5.816 -6.557 -4.537 1.00 0.00 H new ATOM 0 HA LYS B 195 6.387 -8.871 -6.213 1.00 0.00 H new ATOM 0 HB2 LYS B 195 7.393 -6.338 -5.738 1.00 0.00 H new ATOM 0 HB3 LYS B 195 8.514 -7.291 -4.786 1.00 0.00 H new ATOM 0 HG2 LYS B 195 9.541 -7.323 -6.919 1.00 0.00 H new ATOM 0 HG3 LYS B 195 8.663 -8.840 -6.921 1.00 0.00 H new ATOM 0 HD2 LYS B 195 6.943 -8.002 -8.333 1.00 0.00 H new ATOM 0 HD3 LYS B 195 7.266 -6.333 -7.908 1.00 0.00 H new ATOM 0 HE2 LYS B 195 8.263 -6.494 -10.074 1.00 0.00 H new ATOM 0 HE3 LYS B 195 9.645 -6.760 -9.030 1.00 0.00 H new ATOM 0 HZ1 LYS B 195 9.435 -8.550 -10.681 1.00 0.00 H new ATOM 0 HZ2 LYS B 195 9.210 -9.168 -9.115 1.00 0.00 H new ATOM 0 HZ3 LYS B 195 7.871 -8.910 -10.127 1.00 0.00 H new ATOM 1185 N LYS B 196 7.099 -9.068 -3.037 1.00 0.00 N ATOM 1186 CA LYS B 196 7.530 -10.040 -1.987 1.00 0.00 C ATOM 1187 C LYS B 196 6.604 -11.256 -2.012 1.00 0.00 C ATOM 1188 O LYS B 196 7.025 -12.375 -1.786 1.00 0.00 O ATOM 1189 CB LYS B 196 7.398 -9.281 -0.661 1.00 0.00 C ATOM 1190 CG LYS B 196 7.812 -10.188 0.504 1.00 0.00 C ATOM 1191 CD LYS B 196 6.881 -9.947 1.696 1.00 0.00 C ATOM 1192 CE LYS B 196 5.461 -10.396 1.340 1.00 0.00 C ATOM 1193 NZ LYS B 196 5.310 -11.733 1.978 1.00 0.00 N ATOM 0 H LYS B 196 6.755 -8.175 -2.684 1.00 0.00 H new ATOM 0 HA LYS B 196 8.547 -10.403 -2.138 1.00 0.00 H new ATOM 0 HB2 LYS B 196 8.024 -8.389 -0.679 1.00 0.00 H new ATOM 0 HB3 LYS B 196 6.370 -8.946 -0.525 1.00 0.00 H new ATOM 0 HG2 LYS B 196 7.766 -11.233 0.199 1.00 0.00 H new ATOM 0 HG3 LYS B 196 8.844 -9.984 0.788 1.00 0.00 H new ATOM 0 HD2 LYS B 196 7.239 -10.497 2.567 1.00 0.00 H new ATOM 0 HD3 LYS B 196 6.883 -8.890 1.963 1.00 0.00 H new ATOM 0 HE2 LYS B 196 4.718 -9.693 1.716 1.00 0.00 H new ATOM 0 HE3 LYS B 196 5.325 -10.456 0.260 1.00 0.00 H new ATOM 0 HZ1 LYS B 196 4.838 -12.382 1.317 1.00 0.00 H new ATOM 0 HZ2 LYS B 196 6.248 -12.109 2.221 1.00 0.00 H new ATOM 0 HZ3 LYS B 196 4.738 -11.643 2.842 1.00 0.00 H new ATOM 1207 N GLN B 197 5.346 -11.040 -2.299 1.00 0.00 N ATOM 1208 CA GLN B 197 4.381 -12.178 -2.354 1.00 0.00 C ATOM 1209 C GLN B 197 4.754 -13.115 -3.506 1.00 0.00 C ATOM 1210 O GLN B 197 4.508 -14.306 -3.455 1.00 0.00 O ATOM 1211 CB GLN B 197 3.012 -11.539 -2.601 1.00 0.00 C ATOM 1212 CG GLN B 197 1.929 -12.625 -2.604 1.00 0.00 C ATOM 1213 CD GLN B 197 0.676 -12.102 -1.898 1.00 0.00 C ATOM 1214 OE1 GLN B 197 -0.052 -11.297 -2.443 1.00 0.00 O ATOM 1215 NE2 GLN B 197 0.392 -12.530 -0.698 1.00 0.00 N ATOM 0 H GLN B 197 4.945 -10.123 -2.498 1.00 0.00 H new ATOM 0 HA GLN B 197 4.386 -12.770 -1.439 1.00 0.00 H new ATOM 0 HB2 GLN B 197 2.799 -10.801 -1.827 1.00 0.00 H new ATOM 0 HB3 GLN B 197 3.013 -11.010 -3.554 1.00 0.00 H new ATOM 0 HG2 GLN B 197 1.689 -12.911 -3.628 1.00 0.00 H new ATOM 0 HG3 GLN B 197 2.296 -13.520 -2.101 1.00 0.00 H new ATOM 0 HE21 GLN B 197 1.003 -13.206 -0.240 1.00 0.00 H new ATOM 0 HE22 GLN B 197 -0.441 -12.188 -0.219 1.00 0.00 H new ATOM 1224 N GLN B 198 5.356 -12.581 -4.541 1.00 0.00 N ATOM 1225 CA GLN B 198 5.761 -13.433 -5.700 1.00 0.00 C ATOM 1226 C GLN B 198 6.778 -14.477 -5.243 1.00 0.00 C ATOM 1227 O GLN B 198 6.734 -15.622 -5.653 1.00 0.00 O ATOM 1228 CB GLN B 198 6.395 -12.473 -6.708 1.00 0.00 C ATOM 1229 CG GLN B 198 6.324 -13.082 -8.110 1.00 0.00 C ATOM 1230 CD GLN B 198 6.087 -11.973 -9.137 1.00 0.00 C ATOM 1231 OE1 GLN B 198 6.793 -11.878 -10.121 1.00 0.00 O ATOM 1232 NE2 GLN B 198 5.114 -11.125 -8.946 1.00 0.00 N ATOM 0 H GLN B 198 5.584 -11.591 -4.632 1.00 0.00 H new ATOM 0 HA GLN B 198 4.917 -13.969 -6.134 1.00 0.00 H new ATOM 0 HB2 GLN B 198 5.875 -11.515 -6.690 1.00 0.00 H new ATOM 0 HB3 GLN B 198 7.433 -12.278 -6.437 1.00 0.00 H new ATOM 0 HG2 GLN B 198 7.251 -13.610 -8.336 1.00 0.00 H new ATOM 0 HG3 GLN B 198 5.519 -13.816 -8.159 1.00 0.00 H new ATOM 0 HE21 GLN B 198 4.522 -11.206 -8.119 1.00 0.00 H new ATOM 0 HE22 GLN B 198 4.945 -10.381 -9.623 1.00 0.00 H new ATOM 1241 N GLN B 199 7.689 -14.085 -4.392 1.00 0.00 N ATOM 1242 CA GLN B 199 8.715 -15.049 -3.891 1.00 0.00 C ATOM 1243 C GLN B 199 8.031 -16.179 -3.120 1.00 0.00 C ATOM 1244 O GLN B 199 8.457 -17.318 -3.161 1.00 0.00 O ATOM 1245 CB GLN B 199 9.619 -14.234 -2.961 1.00 0.00 C ATOM 1246 CG GLN B 199 10.658 -13.479 -3.792 1.00 0.00 C ATOM 1247 CD GLN B 199 11.183 -12.286 -2.991 1.00 0.00 C ATOM 1248 OE1 GLN B 199 12.128 -12.414 -2.238 1.00 0.00 O ATOM 1249 NE2 GLN B 199 10.607 -11.122 -3.123 1.00 0.00 N ATOM 0 H GLN B 199 7.768 -13.138 -4.021 1.00 0.00 H new ATOM 0 HA GLN B 199 9.283 -15.507 -4.701 1.00 0.00 H new ATOM 0 HB2 GLN B 199 9.022 -13.531 -2.380 1.00 0.00 H new ATOM 0 HB3 GLN B 199 10.116 -14.894 -2.250 1.00 0.00 H new ATOM 0 HG2 GLN B 199 11.481 -14.144 -4.056 1.00 0.00 H new ATOM 0 HG3 GLN B 199 10.213 -13.136 -4.726 1.00 0.00 H new ATOM 0 HE21 GLN B 199 9.814 -11.014 -3.755 1.00 0.00 H new ATOM 0 HE22 GLN B 199 10.950 -10.320 -2.594 1.00 0.00 H new ATOM 1258 N LEU B 200 6.965 -15.869 -2.427 1.00 0.00 N ATOM 1259 CA LEU B 200 6.234 -16.919 -1.657 1.00 0.00 C ATOM 1260 C LEU B 200 5.393 -17.767 -2.612 1.00 0.00 C ATOM 1261 O LEU B 200 5.173 -18.942 -2.385 1.00 0.00 O ATOM 1262 CB LEU B 200 5.336 -16.152 -0.683 1.00 0.00 C ATOM 1263 CG LEU B 200 4.832 -17.100 0.405 1.00 0.00 C ATOM 1264 CD1 LEU B 200 5.924 -17.295 1.459 1.00 0.00 C ATOM 1265 CD2 LEU B 200 3.589 -16.502 1.067 1.00 0.00 C ATOM 0 H LEU B 200 6.569 -14.931 -2.361 1.00 0.00 H new ATOM 0 HA LEU B 200 6.908 -17.596 -1.132 1.00 0.00 H new ATOM 0 HB2 LEU B 200 5.890 -15.328 -0.233 1.00 0.00 H new ATOM 0 HB3 LEU B 200 4.493 -15.715 -1.218 1.00 0.00 H new ATOM 0 HG LEU B 200 4.581 -18.062 -0.041 1.00 0.00 H new ATOM 0 HD11 LEU B 200 5.564 -17.971 2.235 1.00 0.00 H new ATOM 0 HD12 LEU B 200 6.811 -17.720 0.990 1.00 0.00 H new ATOM 0 HD13 LEU B 200 6.176 -16.333 1.905 1.00 0.00 H new ATOM 0 HD21 LEU B 200 3.229 -17.178 1.843 1.00 0.00 H new ATOM 0 HD22 LEU B 200 3.841 -15.540 1.512 1.00 0.00 H new ATOM 0 HD23 LEU B 200 2.810 -16.362 0.318 1.00 0.00 H new ATOM 1277 N GLU B 201 4.930 -17.177 -3.685 1.00 0.00 N ATOM 1278 CA GLU B 201 4.108 -17.940 -4.670 1.00 0.00 C ATOM 1279 C GLU B 201 5.021 -18.782 -5.561 1.00 0.00 C ATOM 1280 O GLU B 201 4.650 -19.850 -6.012 1.00 0.00 O ATOM 1281 CB GLU B 201 3.381 -16.878 -5.497 1.00 0.00 C ATOM 1282 CG GLU B 201 2.272 -16.243 -4.655 1.00 0.00 C ATOM 1283 CD GLU B 201 1.093 -15.875 -5.557 1.00 0.00 C ATOM 1284 OE1 GLU B 201 1.178 -14.858 -6.225 1.00 0.00 O ATOM 1285 OE2 GLU B 201 0.124 -16.617 -5.564 1.00 0.00 O ATOM 0 H GLU B 201 5.087 -16.197 -3.921 1.00 0.00 H new ATOM 0 HA GLU B 201 3.408 -18.621 -4.187 1.00 0.00 H new ATOM 0 HB2 GLU B 201 4.085 -16.114 -5.826 1.00 0.00 H new ATOM 0 HB3 GLU B 201 2.957 -17.328 -6.395 1.00 0.00 H new ATOM 0 HG2 GLU B 201 1.947 -16.937 -3.879 1.00 0.00 H new ATOM 0 HG3 GLU B 201 2.649 -15.354 -4.150 1.00 0.00 H new