USER MOD reduce.3.24.130724 H: found=0, std=0, add=618, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 619 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 198 TYR OH : rot 180:sc= 0.131 USER MOD Set 1.2: A 205 LYS NZ :NH3+ -155:sc= 0.134 (180deg=0) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 ASN : amide:sc= -0.245 K(o=-0.25,f=-2.9!) USER MOD Single : A 164 LYS NZ :NH3+ -162:sc= -0.0823 (180deg=-0.385) USER MOD Single : A 165 GLN : amide:sc= -0.0559 K(o=-0.056,f=-0.57) USER MOD Single : A 167 THR OG1 : rot 180:sc=-0.00152 USER MOD Single : A 173 CYS SG : rot 180:sc= 0 USER MOD Single : A 176 THR OG1 : rot -89:sc= 1.67 USER MOD Single : A 180 SER OG : rot 140:sc= 0.765 USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 MET CE :methyl -147:sc= -1.56 (180deg=-2.88!) USER MOD Single : A 187 MET CE :methyl -162:sc= -0.0812 (180deg=-0.482) USER MOD Single : A 194 CYS SG : rot -38:sc= 0.0522 USER MOD Single : A 195 CYS SG : rot 83:sc= 0.636 USER MOD Single : A 201 GLN : amide:sc= -0.0511 K(o=-0.051,f=-1.3) USER MOD Single : A 206 LYS NZ :NH3+ 159:sc= 0.745 (180deg=0.277) USER MOD Single : A 212 THR OG1 : rot 85:sc= 0.971 USER MOD Single : A 215 SER OG : rot 180:sc= 0 USER MOD Single : A 218 THR OG1 : rot 81:sc= 1.06 USER MOD Single : A 223 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 114 N LYS A 154 7.392 14.899 -5.961 1.00 24.54 N ATOM 115 CA LYS A 154 7.828 13.522 -6.215 1.00 61.30 C ATOM 116 C LYS A 154 6.648 12.652 -6.688 1.00 33.13 C ATOM 117 O LYS A 154 5.486 12.985 -6.441 1.00 30.40 O ATOM 118 CB LYS A 154 8.445 12.914 -4.938 1.00 60.13 C ATOM 119 CG LYS A 154 9.906 13.290 -4.692 1.00 54.31 C ATOM 120 CD LYS A 154 10.115 14.798 -4.577 1.00 51.01 C ATOM 121 CE LYS A 154 11.566 15.131 -4.256 1.00 13.12 C ATOM 122 NZ LYS A 154 11.826 16.595 -4.262 1.00 60.04 N ATOM 0 HA LYS A 154 8.581 13.545 -7.003 1.00 61.30 H new ATOM 0 HB2 LYS A 154 7.853 13.230 -4.079 1.00 60.13 H new ATOM 0 HB3 LYS A 154 8.368 11.828 -4.995 1.00 60.13 H new ATOM 0 HG2 LYS A 154 10.252 12.809 -3.777 1.00 54.31 H new ATOM 0 HG3 LYS A 154 10.518 12.904 -5.507 1.00 54.31 H new ATOM 0 HD2 LYS A 154 9.827 15.280 -5.511 1.00 51.01 H new ATOM 0 HD3 LYS A 154 9.466 15.199 -3.798 1.00 51.01 H new ATOM 0 HE2 LYS A 154 11.822 14.723 -3.278 1.00 13.12 H new ATOM 0 HE3 LYS A 154 12.217 14.646 -4.984 1.00 13.12 H new ATOM 0 HZ1 LYS A 154 12.826 16.771 -4.038 1.00 60.04 H new ATOM 0 HZ2 LYS A 154 11.608 16.982 -5.202 1.00 60.04 H new ATOM 0 HZ3 LYS A 154 11.226 17.057 -3.550 1.00 60.04 H new ATOM 136 N PRO A 155 6.919 11.535 -7.390 1.00 51.12 N ATOM 137 CA PRO A 155 5.868 10.577 -7.771 1.00 41.44 C ATOM 138 C PRO A 155 5.220 9.940 -6.531 1.00 23.20 C ATOM 139 O PRO A 155 5.917 9.580 -5.583 1.00 14.23 O ATOM 140 CB PRO A 155 6.621 9.526 -8.606 1.00 65.04 C ATOM 141 CG PRO A 155 8.046 9.655 -8.183 1.00 41.52 C ATOM 142 CD PRO A 155 8.250 11.113 -7.870 1.00 63.11 C ATOM 0 HA PRO A 155 5.050 11.045 -8.318 1.00 41.44 H new ATOM 0 HB2 PRO A 155 6.241 8.522 -8.415 1.00 65.04 H new ATOM 0 HB3 PRO A 155 6.507 9.713 -9.674 1.00 65.04 H new ATOM 0 HG2 PRO A 155 8.253 9.035 -7.311 1.00 41.52 H new ATOM 0 HG3 PRO A 155 8.720 9.327 -8.974 1.00 41.52 H new ATOM 0 HD2 PRO A 155 9.019 11.260 -7.111 1.00 63.11 H new ATOM 0 HD3 PRO A 155 8.559 11.676 -8.750 1.00 63.11 H new ATOM 150 N ILE A 156 3.895 9.809 -6.528 1.00 35.51 N ATOM 151 CA ILE A 156 3.178 9.314 -5.345 1.00 43.00 C ATOM 152 C ILE A 156 2.124 8.242 -5.683 1.00 12.03 C ATOM 153 O ILE A 156 1.751 8.048 -6.842 1.00 32.11 O ATOM 154 CB ILE A 156 2.515 10.488 -4.564 1.00 52.40 C ATOM 155 CG1 ILE A 156 1.660 11.385 -5.491 1.00 33.40 C ATOM 156 CG2 ILE A 156 3.577 11.322 -3.843 1.00 21.03 C ATOM 157 CD1 ILE A 156 0.285 10.831 -5.811 1.00 3.21 C ATOM 0 H ILE A 156 3.296 10.035 -7.322 1.00 35.51 H new ATOM 0 HA ILE A 156 3.928 8.838 -4.714 1.00 43.00 H new ATOM 0 HB ILE A 156 1.847 10.051 -3.822 1.00 52.40 H new ATOM 0 HG12 ILE A 156 1.544 12.363 -5.023 1.00 33.40 H new ATOM 0 HG13 ILE A 156 2.201 11.541 -6.424 1.00 33.40 H new ATOM 0 HG21 ILE A 156 3.095 12.137 -3.303 1.00 21.03 H new ATOM 0 HG22 ILE A 156 4.119 10.691 -3.139 1.00 21.03 H new ATOM 0 HG23 ILE A 156 4.274 11.733 -4.573 1.00 21.03 H new ATOM 0 HD11 ILE A 156 -0.243 11.524 -6.465 1.00 3.21 H new ATOM 0 HD12 ILE A 156 0.388 9.868 -6.310 1.00 3.21 H new ATOM 0 HD13 ILE A 156 -0.279 10.702 -4.887 1.00 3.21 H new ATOM 169 N VAL A 157 1.655 7.549 -4.645 1.00 64.40 N ATOM 170 CA VAL A 157 0.634 6.504 -4.777 1.00 52.54 C ATOM 171 C VAL A 157 -0.502 6.722 -3.762 1.00 62.02 C ATOM 172 O VAL A 157 -0.246 7.013 -2.592 1.00 42.32 O ATOM 173 CB VAL A 157 1.244 5.093 -4.548 1.00 51.42 C ATOM 174 CG1 VAL A 157 0.195 3.999 -4.747 1.00 20.01 C ATOM 175 CG2 VAL A 157 2.449 4.864 -5.458 1.00 60.44 C ATOM 0 H VAL A 157 1.972 7.695 -3.686 1.00 64.40 H new ATOM 0 HA VAL A 157 0.238 6.565 -5.791 1.00 52.54 H new ATOM 0 HB VAL A 157 1.587 5.043 -3.515 1.00 51.42 H new ATOM 0 HG11 VAL A 157 0.651 3.023 -4.580 1.00 20.01 H new ATOM 0 HG12 VAL A 157 -0.621 4.144 -4.039 1.00 20.01 H new ATOM 0 HG13 VAL A 157 -0.194 4.049 -5.764 1.00 20.01 H new ATOM 0 HG21 VAL A 157 2.857 3.869 -5.278 1.00 60.44 H new ATOM 0 HG22 VAL A 157 2.139 4.946 -6.500 1.00 60.44 H new ATOM 0 HG23 VAL A 157 3.212 5.613 -5.247 1.00 60.44 H new ATOM 185 N ARG A 158 -1.753 6.582 -4.208 1.00 14.22 N ATOM 186 CA ARG A 158 -2.913 6.746 -3.317 1.00 14.04 C ATOM 187 C ARG A 158 -3.305 5.413 -2.658 1.00 10.22 C ATOM 188 O ARG A 158 -3.967 4.577 -3.269 1.00 33.32 O ATOM 189 CB ARG A 158 -4.118 7.325 -4.080 1.00 71.13 C ATOM 190 CG ARG A 158 -4.053 8.834 -4.319 1.00 12.55 C ATOM 191 CD ARG A 158 -3.035 9.227 -5.381 1.00 53.23 C ATOM 192 NE ARG A 158 -3.428 8.797 -6.722 1.00 21.34 N ATOM 193 CZ ARG A 158 -3.255 9.515 -7.801 1.00 42.25 C ATOM 194 NH1 ARG A 158 -2.738 10.701 -7.733 1.00 63.33 N ATOM 195 NH2 ARG A 158 -3.622 9.047 -8.947 1.00 52.41 N ATOM 0 H ARG A 158 -1.992 6.357 -5.174 1.00 14.22 H new ATOM 0 HA ARG A 158 -2.622 7.447 -2.534 1.00 14.04 H new ATOM 0 HB2 ARG A 158 -4.198 6.821 -5.043 1.00 71.13 H new ATOM 0 HB3 ARG A 158 -5.027 7.097 -3.524 1.00 71.13 H new ATOM 0 HG2 ARG A 158 -5.038 9.191 -4.619 1.00 12.55 H new ATOM 0 HG3 ARG A 158 -3.804 9.334 -3.383 1.00 12.55 H new ATOM 0 HD2 ARG A 158 -2.907 10.309 -5.373 1.00 53.23 H new ATOM 0 HD3 ARG A 158 -2.068 8.790 -5.132 1.00 53.23 H new ATOM 0 HE ARG A 158 -3.864 7.880 -6.822 1.00 21.34 H new ATOM 0 HH11 ARG A 158 -2.460 11.085 -6.830 1.00 63.33 H new ATOM 0 HH12 ARG A 158 -2.609 11.250 -8.583 1.00 63.33 H new ATOM 0 HH21 ARG A 158 -4.045 8.121 -9.008 1.00 52.41 H new ATOM 0 HH22 ARG A 158 -3.489 9.603 -9.791 1.00 52.41 H new ATOM 209 N VAL A 159 -2.894 5.218 -1.410 1.00 0.43 N ATOM 210 CA VAL A 159 -3.194 3.980 -0.681 1.00 20.54 C ATOM 211 C VAL A 159 -4.444 4.131 0.205 1.00 33.41 C ATOM 212 O VAL A 159 -4.428 4.849 1.208 1.00 22.42 O ATOM 213 CB VAL A 159 -1.994 3.545 0.200 1.00 70.14 C ATOM 214 CG1 VAL A 159 -2.285 2.217 0.901 1.00 12.32 C ATOM 215 CG2 VAL A 159 -0.717 3.456 -0.636 1.00 40.43 C ATOM 0 H VAL A 159 -2.352 5.898 -0.877 1.00 0.43 H new ATOM 0 HA VAL A 159 -3.387 3.213 -1.431 1.00 20.54 H new ATOM 0 HB VAL A 159 -1.843 4.302 0.970 1.00 70.14 H new ATOM 0 HG11 VAL A 159 -1.429 1.933 1.513 1.00 12.32 H new ATOM 0 HG12 VAL A 159 -3.164 2.326 1.536 1.00 12.32 H new ATOM 0 HG13 VAL A 159 -2.470 1.444 0.155 1.00 12.32 H new ATOM 0 HG21 VAL A 159 0.114 3.149 -0.000 1.00 40.43 H new ATOM 0 HG22 VAL A 159 -0.854 2.724 -1.432 1.00 40.43 H new ATOM 0 HG23 VAL A 159 -0.499 4.431 -1.072 1.00 40.43 H new ATOM 225 N PHE A 160 -5.532 3.462 -0.175 1.00 72.21 N ATOM 226 CA PHE A 160 -6.757 3.459 0.630 1.00 61.03 C ATOM 227 C PHE A 160 -6.658 2.450 1.784 1.00 70.41 C ATOM 228 O PHE A 160 -6.520 1.244 1.562 1.00 10.43 O ATOM 229 CB PHE A 160 -7.976 3.135 -0.242 1.00 22.42 C ATOM 230 CG PHE A 160 -8.304 4.201 -1.261 1.00 22.44 C ATOM 231 CD1 PHE A 160 -8.891 5.396 -0.868 1.00 63.23 C ATOM 232 CD2 PHE A 160 -8.038 4.002 -2.610 1.00 2.24 C ATOM 233 CE1 PHE A 160 -9.203 6.369 -1.797 1.00 52.13 C ATOM 234 CE2 PHE A 160 -8.349 4.975 -3.540 1.00 51.31 C ATOM 235 CZ PHE A 160 -8.933 6.159 -3.135 1.00 14.53 C ATOM 0 H PHE A 160 -5.592 2.915 -1.034 1.00 72.21 H new ATOM 0 HA PHE A 160 -6.878 4.457 1.052 1.00 61.03 H new ATOM 0 HB2 PHE A 160 -7.798 2.193 -0.761 1.00 22.42 H new ATOM 0 HB3 PHE A 160 -8.842 2.985 0.403 1.00 22.42 H new ATOM 0 HD1 PHE A 160 -9.106 5.567 0.176 1.00 63.23 H new ATOM 0 HD2 PHE A 160 -7.584 3.078 -2.935 1.00 2.24 H new ATOM 0 HE1 PHE A 160 -9.658 7.295 -1.477 1.00 52.13 H new ATOM 0 HE2 PHE A 160 -8.135 4.809 -4.586 1.00 51.31 H new ATOM 0 HZ PHE A 160 -9.178 6.919 -3.863 1.00 14.53 H new ATOM 245 N LEU A 161 -6.730 2.955 3.010 1.00 42.12 N ATOM 246 CA LEU A 161 -6.658 2.117 4.209 1.00 63.35 C ATOM 247 C LEU A 161 -8.068 1.729 4.687 1.00 25.23 C ATOM 248 O LEU A 161 -9.045 2.404 4.361 1.00 11.24 O ATOM 249 CB LEU A 161 -5.906 2.865 5.323 1.00 41.45 C ATOM 250 CG LEU A 161 -4.470 3.288 4.972 1.00 22.25 C ATOM 251 CD1 LEU A 161 -3.838 4.070 6.121 1.00 2.15 C ATOM 252 CD2 LEU A 161 -3.615 2.070 4.617 1.00 33.24 C ATOM 0 H LEU A 161 -6.839 3.950 3.204 1.00 42.12 H new ATOM 0 HA LEU A 161 -6.117 1.203 3.964 1.00 63.35 H new ATOM 0 HB2 LEU A 161 -6.475 3.755 5.589 1.00 41.45 H new ATOM 0 HB3 LEU A 161 -5.875 2.230 6.208 1.00 41.45 H new ATOM 0 HG LEU A 161 -4.515 3.940 4.099 1.00 22.25 H new ATOM 0 HD11 LEU A 161 -2.823 4.358 5.850 1.00 2.15 H new ATOM 0 HD12 LEU A 161 -4.428 4.964 6.320 1.00 2.15 H new ATOM 0 HD13 LEU A 161 -3.811 3.446 7.014 1.00 2.15 H new ATOM 0 HD21 LEU A 161 -2.604 2.394 4.372 1.00 33.24 H new ATOM 0 HD22 LEU A 161 -3.582 1.388 5.467 1.00 33.24 H new ATOM 0 HD23 LEU A 161 -4.050 1.558 3.758 1.00 33.24 H new ATOM 264 N PRO A 162 -8.201 0.633 5.458 1.00 32.31 N ATOM 265 CA PRO A 162 -9.510 0.186 5.971 1.00 21.11 C ATOM 266 C PRO A 162 -10.159 1.202 6.931 1.00 72.31 C ATOM 267 O PRO A 162 -9.521 2.172 7.353 1.00 4.54 O ATOM 268 CB PRO A 162 -9.180 -1.126 6.706 1.00 34.13 C ATOM 269 CG PRO A 162 -7.720 -1.048 7.006 1.00 35.41 C ATOM 270 CD PRO A 162 -7.104 -0.257 5.884 1.00 45.42 C ATOM 0 HA PRO A 162 -10.237 0.068 5.167 1.00 21.11 H new ATOM 0 HB2 PRO A 162 -9.765 -1.224 7.620 1.00 34.13 H new ATOM 0 HB3 PRO A 162 -9.409 -1.993 6.087 1.00 34.13 H new ATOM 0 HG2 PRO A 162 -7.545 -0.563 7.966 1.00 35.41 H new ATOM 0 HG3 PRO A 162 -7.281 -2.044 7.067 1.00 35.41 H new ATOM 0 HD2 PRO A 162 -6.234 0.308 6.220 1.00 45.42 H new ATOM 0 HD3 PRO A 162 -6.771 -0.903 5.072 1.00 45.42 H new ATOM 278 N ASN A 163 -11.437 0.983 7.252 1.00 54.15 N ATOM 279 CA ASN A 163 -12.175 1.843 8.193 1.00 73.42 C ATOM 280 C ASN A 163 -12.273 3.299 7.696 1.00 10.22 C ATOM 281 O ASN A 163 -12.298 4.240 8.492 1.00 42.43 O ATOM 282 CB ASN A 163 -11.529 1.782 9.588 1.00 21.54 C ATOM 283 CG ASN A 163 -11.608 0.391 10.202 1.00 63.31 C ATOM 284 OD1 ASN A 163 -11.622 -0.616 9.501 1.00 65.42 O ATOM 285 ND2 ASN A 163 -11.663 0.321 11.517 1.00 52.43 N ATOM 0 H ASN A 163 -11.989 0.213 6.873 1.00 54.15 H new ATOM 0 HA ASN A 163 -13.194 1.461 8.258 1.00 73.42 H new ATOM 0 HB2 ASN A 163 -10.485 2.086 9.516 1.00 21.54 H new ATOM 0 HB3 ASN A 163 -12.024 2.496 10.246 1.00 21.54 H new ATOM 0 HD21 ASN A 163 -11.719 -0.587 11.977 1.00 52.43 H new ATOM 0 HD22 ASN A 163 -11.650 1.175 12.074 1.00 52.43 H new ATOM 292 N LYS A 164 -12.363 3.462 6.370 1.00 12.11 N ATOM 293 CA LYS A 164 -12.561 4.776 5.727 1.00 10.14 C ATOM 294 C LYS A 164 -11.317 5.677 5.836 1.00 31.43 C ATOM 295 O LYS A 164 -11.412 6.902 5.738 1.00 3.43 O ATOM 296 CB LYS A 164 -13.791 5.496 6.317 1.00 41.34 C ATOM 297 CG LYS A 164 -15.059 4.643 6.356 1.00 71.41 C ATOM 298 CD LYS A 164 -15.441 4.116 4.977 1.00 12.42 C ATOM 299 CE LYS A 164 -16.644 3.179 5.042 1.00 51.31 C ATOM 300 NZ LYS A 164 -16.390 2.012 5.931 1.00 1.53 N ATOM 0 H LYS A 164 -12.301 2.688 5.708 1.00 12.11 H new ATOM 0 HA LYS A 164 -12.733 4.583 4.668 1.00 10.14 H new ATOM 0 HB2 LYS A 164 -13.555 5.823 7.330 1.00 41.34 H new ATOM 0 HB3 LYS A 164 -13.988 6.393 5.731 1.00 41.34 H new ATOM 0 HG2 LYS A 164 -14.910 3.804 7.035 1.00 71.41 H new ATOM 0 HG3 LYS A 164 -15.881 5.235 6.757 1.00 71.41 H new ATOM 0 HD2 LYS A 164 -15.668 4.954 4.318 1.00 12.42 H new ATOM 0 HD3 LYS A 164 -14.592 3.588 4.542 1.00 12.42 H new ATOM 0 HE2 LYS A 164 -17.513 3.728 5.403 1.00 51.31 H new ATOM 0 HE3 LYS A 164 -16.884 2.826 4.039 1.00 51.31 H new ATOM 0 HZ1 LYS A 164 -17.078 1.260 5.722 1.00 1.53 H new ATOM 0 HZ2 LYS A 164 -15.427 1.655 5.769 1.00 1.53 H new ATOM 0 HZ3 LYS A 164 -16.488 2.304 6.924 1.00 1.53 H new ATOM 314 N GLN A 165 -10.144 5.071 6.007 1.00 35.21 N ATOM 315 CA GLN A 165 -8.886 5.826 6.100 1.00 65.41 C ATOM 316 C GLN A 165 -8.125 5.820 4.760 1.00 71.21 C ATOM 317 O GLN A 165 -8.425 5.027 3.868 1.00 74.12 O ATOM 318 CB GLN A 165 -8.006 5.240 7.214 1.00 42.02 C ATOM 319 CG GLN A 165 -8.678 5.229 8.585 1.00 61.31 C ATOM 320 CD GLN A 165 -9.064 6.617 9.072 1.00 10.12 C ATOM 321 OE1 GLN A 165 -8.422 7.610 8.742 1.00 23.03 O ATOM 322 NE2 GLN A 165 -10.122 6.704 9.854 1.00 71.22 N ATOM 0 H GLN A 165 -10.033 4.060 6.085 1.00 35.21 H new ATOM 0 HA GLN A 165 -9.129 6.861 6.339 1.00 65.41 H new ATOM 0 HB2 GLN A 165 -7.728 4.220 6.947 1.00 42.02 H new ATOM 0 HB3 GLN A 165 -7.083 5.816 7.276 1.00 42.02 H new ATOM 0 HG2 GLN A 165 -9.571 4.605 8.540 1.00 61.31 H new ATOM 0 HG3 GLN A 165 -8.005 4.771 9.309 1.00 61.31 H new ATOM 0 HE21 GLN A 165 -10.636 5.862 10.112 1.00 71.22 H new ATOM 0 HE22 GLN A 165 -10.426 7.614 10.201 1.00 71.22 H new ATOM 331 N ARG A 166 -7.160 6.727 4.604 1.00 34.31 N ATOM 332 CA ARG A 166 -6.348 6.783 3.377 1.00 61.45 C ATOM 333 C ARG A 166 -5.030 7.542 3.590 1.00 63.30 C ATOM 334 O ARG A 166 -4.894 8.327 4.529 1.00 14.11 O ATOM 335 CB ARG A 166 -7.152 7.426 2.237 1.00 12.21 C ATOM 336 CG ARG A 166 -7.663 8.831 2.550 1.00 51.14 C ATOM 337 CD ARG A 166 -8.603 9.338 1.462 1.00 42.24 C ATOM 338 NE ARG A 166 -9.751 8.450 1.274 1.00 11.42 N ATOM 339 CZ ARG A 166 -10.715 8.662 0.425 1.00 25.05 C ATOM 340 NH1 ARG A 166 -10.702 9.702 -0.345 1.00 30.13 N ATOM 341 NH2 ARG A 166 -11.682 7.811 0.332 1.00 12.00 N ATOM 0 H ARG A 166 -6.919 7.430 5.303 1.00 34.31 H new ATOM 0 HA ARG A 166 -6.094 5.758 3.108 1.00 61.45 H new ATOM 0 HB2 ARG A 166 -6.527 7.469 1.345 1.00 12.21 H new ATOM 0 HB3 ARG A 166 -8.002 6.786 2.000 1.00 12.21 H new ATOM 0 HG2 ARG A 166 -8.183 8.825 3.508 1.00 51.14 H new ATOM 0 HG3 ARG A 166 -6.818 9.513 2.650 1.00 51.14 H new ATOM 0 HD2 ARG A 166 -8.955 10.336 1.723 1.00 42.24 H new ATOM 0 HD3 ARG A 166 -8.056 9.428 0.523 1.00 42.24 H new ATOM 0 HE ARG A 166 -9.799 7.608 1.847 1.00 11.42 H new ATOM 0 HH11 ARG A 166 -9.930 10.367 -0.291 1.00 30.13 H new ATOM 0 HH12 ARG A 166 -11.463 9.857 -1.006 1.00 30.13 H new ATOM 0 HH21 ARG A 166 -11.687 6.979 0.922 1.00 12.00 H new ATOM 0 HH22 ARG A 166 -12.440 7.971 -0.331 1.00 12.00 H new ATOM 355 N THR A 167 -4.063 7.292 2.707 1.00 23.13 N ATOM 356 CA THR A 167 -2.754 7.967 2.752 1.00 63.53 C ATOM 357 C THR A 167 -2.085 7.979 1.370 1.00 3.23 C ATOM 358 O THR A 167 -2.317 7.086 0.554 1.00 42.14 O ATOM 359 CB THR A 167 -1.794 7.287 3.760 1.00 71.13 C ATOM 360 OG1 THR A 167 -0.507 7.933 3.735 1.00 25.31 O ATOM 361 CG2 THR A 167 -1.628 5.798 3.449 1.00 22.45 C ATOM 0 H THR A 167 -4.158 6.622 1.944 1.00 23.13 H new ATOM 0 HA THR A 167 -2.946 8.990 3.074 1.00 63.53 H new ATOM 0 HB THR A 167 -2.230 7.385 4.754 1.00 71.13 H new ATOM 0 HG1 THR A 167 0.091 7.496 4.377 1.00 25.31 H new ATOM 0 HG21 THR A 167 -0.949 5.349 4.173 1.00 22.45 H new ATOM 0 HG22 THR A 167 -2.598 5.304 3.506 1.00 22.45 H new ATOM 0 HG23 THR A 167 -1.219 5.679 2.446 1.00 22.45 H new ATOM 369 N VAL A 168 -1.263 8.991 1.102 1.00 20.35 N ATOM 370 CA VAL A 168 -0.525 9.065 -0.163 1.00 41.45 C ATOM 371 C VAL A 168 0.991 9.026 0.091 1.00 10.42 C ATOM 372 O VAL A 168 1.539 9.898 0.765 1.00 42.54 O ATOM 373 CB VAL A 168 -0.890 10.351 -0.955 1.00 34.25 C ATOM 374 CG1 VAL A 168 -0.220 10.357 -2.321 1.00 53.40 C ATOM 375 CG2 VAL A 168 -2.407 10.492 -1.093 1.00 65.44 C ATOM 0 H VAL A 168 -1.090 9.769 1.738 1.00 20.35 H new ATOM 0 HA VAL A 168 -0.810 8.199 -0.760 1.00 41.45 H new ATOM 0 HB VAL A 168 -0.519 11.209 -0.394 1.00 34.25 H new ATOM 0 HG11 VAL A 168 -0.491 11.267 -2.855 1.00 53.40 H new ATOM 0 HG12 VAL A 168 0.862 10.319 -2.196 1.00 53.40 H new ATOM 0 HG13 VAL A 168 -0.550 9.489 -2.892 1.00 53.40 H new ATOM 0 HG21 VAL A 168 -2.639 11.399 -1.651 1.00 65.44 H new ATOM 0 HG22 VAL A 168 -2.806 9.628 -1.624 1.00 65.44 H new ATOM 0 HG23 VAL A 168 -2.859 10.550 -0.103 1.00 65.44 H new ATOM 385 N VAL A 169 1.665 8.014 -0.454 1.00 23.34 N ATOM 386 CA VAL A 169 3.103 7.810 -0.206 1.00 43.41 C ATOM 387 C VAL A 169 3.941 7.956 -1.492 1.00 13.40 C ATOM 388 O VAL A 169 3.458 7.680 -2.589 1.00 71.42 O ATOM 389 CB VAL A 169 3.363 6.414 0.423 1.00 51.23 C ATOM 390 CG1 VAL A 169 2.691 6.302 1.793 1.00 45.12 C ATOM 391 CG2 VAL A 169 2.885 5.298 -0.507 1.00 11.45 C ATOM 0 H VAL A 169 1.244 7.319 -1.071 1.00 23.34 H new ATOM 0 HA VAL A 169 3.413 8.588 0.492 1.00 43.41 H new ATOM 0 HB VAL A 169 4.438 6.302 0.561 1.00 51.23 H new ATOM 0 HG11 VAL A 169 2.886 5.316 2.215 1.00 45.12 H new ATOM 0 HG12 VAL A 169 3.091 7.067 2.458 1.00 45.12 H new ATOM 0 HG13 VAL A 169 1.616 6.443 1.683 1.00 45.12 H new ATOM 0 HG21 VAL A 169 3.078 4.330 -0.044 1.00 11.45 H new ATOM 0 HG22 VAL A 169 1.815 5.407 -0.687 1.00 11.45 H new ATOM 0 HG23 VAL A 169 3.420 5.360 -1.455 1.00 11.45 H new ATOM 401 N PRO A 170 5.213 8.398 -1.375 1.00 45.34 N ATOM 402 CA PRO A 170 6.094 8.595 -2.541 1.00 34.45 C ATOM 403 C PRO A 170 6.557 7.277 -3.195 1.00 23.22 C ATOM 404 O PRO A 170 7.133 6.401 -2.538 1.00 62.15 O ATOM 405 CB PRO A 170 7.288 9.364 -1.954 1.00 20.10 C ATOM 406 CG PRO A 170 7.323 8.967 -0.516 1.00 1.40 C ATOM 407 CD PRO A 170 5.887 8.752 -0.108 1.00 22.41 C ATOM 0 HA PRO A 170 5.578 9.119 -3.346 1.00 34.45 H new ATOM 0 HB2 PRO A 170 8.217 9.101 -2.460 1.00 20.10 H new ATOM 0 HB3 PRO A 170 7.159 10.441 -2.065 1.00 20.10 H new ATOM 0 HG2 PRO A 170 7.908 8.058 -0.376 1.00 1.40 H new ATOM 0 HG3 PRO A 170 7.789 9.743 0.092 1.00 1.40 H new ATOM 0 HD2 PRO A 170 5.795 7.956 0.631 1.00 22.41 H new ATOM 0 HD3 PRO A 170 5.458 9.650 0.337 1.00 22.41 H new ATOM 415 N ALA A 171 6.307 7.149 -4.497 1.00 4.22 N ATOM 416 CA ALA A 171 6.730 5.981 -5.271 1.00 63.32 C ATOM 417 C ALA A 171 8.222 6.072 -5.627 1.00 51.41 C ATOM 418 O ALA A 171 8.621 6.825 -6.520 1.00 21.54 O ATOM 419 CB ALA A 171 5.884 5.847 -6.532 1.00 20.51 C ATOM 0 H ALA A 171 5.807 7.849 -5.045 1.00 4.22 H new ATOM 0 HA ALA A 171 6.583 5.092 -4.658 1.00 63.32 H new ATOM 0 HB1 ALA A 171 6.210 4.974 -7.098 1.00 20.51 H new ATOM 0 HB2 ALA A 171 4.836 5.730 -6.256 1.00 20.51 H new ATOM 0 HB3 ALA A 171 6.000 6.741 -7.145 1.00 20.51 H new ATOM 425 N ARG A 172 9.038 5.305 -4.917 1.00 14.52 N ATOM 426 CA ARG A 172 10.495 5.369 -5.054 1.00 42.40 C ATOM 427 C ARG A 172 11.074 4.054 -5.589 1.00 72.45 C ATOM 428 O ARG A 172 10.443 3.000 -5.501 1.00 1.31 O ATOM 429 CB ARG A 172 11.098 5.693 -3.688 1.00 11.55 C ATOM 430 CG ARG A 172 10.596 7.009 -3.109 1.00 1.13 C ATOM 431 CD ARG A 172 10.818 7.085 -1.606 1.00 60.12 C ATOM 432 NE ARG A 172 9.998 6.103 -0.889 1.00 0.22 N ATOM 433 CZ ARG A 172 9.652 6.201 0.365 1.00 0.22 C ATOM 434 NH1 ARG A 172 10.005 7.223 1.078 1.00 42.25 N ATOM 435 NH2 ARG A 172 8.931 5.274 0.905 1.00 63.13 N ATOM 0 H ARG A 172 8.715 4.622 -4.231 1.00 14.52 H new ATOM 0 HA ARG A 172 10.746 6.147 -5.775 1.00 42.40 H new ATOM 0 HB2 ARG A 172 10.865 4.885 -2.994 1.00 11.55 H new ATOM 0 HB3 ARG A 172 12.184 5.733 -3.777 1.00 11.55 H new ATOM 0 HG2 ARG A 172 11.109 7.839 -3.595 1.00 1.13 H new ATOM 0 HG3 ARG A 172 9.534 7.120 -3.326 1.00 1.13 H new ATOM 0 HD2 ARG A 172 11.871 6.912 -1.384 1.00 60.12 H new ATOM 0 HD3 ARG A 172 10.578 8.088 -1.252 1.00 60.12 H new ATOM 0 HE ARG A 172 9.676 5.286 -1.407 1.00 0.22 H new ATOM 0 HH11 ARG A 172 10.563 7.968 0.660 1.00 42.25 H new ATOM 0 HH12 ARG A 172 9.725 7.283 2.057 1.00 42.25 H new ATOM 0 HH21 ARG A 172 8.635 4.470 0.351 1.00 63.13 H new ATOM 0 HH22 ARG A 172 8.658 5.346 1.885 1.00 63.13 H new ATOM 449 N CYS A 173 12.288 4.122 -6.120 1.00 50.22 N ATOM 450 CA CYS A 173 12.951 2.940 -6.692 1.00 74.31 C ATOM 451 C CYS A 173 13.714 2.161 -5.615 1.00 32.02 C ATOM 452 O CYS A 173 14.363 2.752 -4.751 1.00 61.24 O ATOM 453 CB CYS A 173 13.915 3.340 -7.815 1.00 45.40 C ATOM 454 SG CYS A 173 14.739 1.940 -8.611 1.00 72.32 S ATOM 0 H CYS A 173 12.839 4.979 -6.170 1.00 50.22 H new ATOM 0 HA CYS A 173 12.172 2.299 -7.106 1.00 74.31 H new ATOM 0 HB2 CYS A 173 13.364 3.901 -8.570 1.00 45.40 H new ATOM 0 HB3 CYS A 173 14.672 4.011 -7.408 1.00 45.40 H new ATOM 0 HG CYS A 173 15.530 2.376 -9.546 1.00 72.32 H new ATOM 460 N GLY A 174 13.616 0.832 -5.656 1.00 60.32 N ATOM 461 CA GLY A 174 14.301 -0.007 -4.675 1.00 35.21 C ATOM 462 C GLY A 174 13.603 -0.059 -3.316 1.00 31.25 C ATOM 463 O GLY A 174 13.950 -0.878 -2.463 1.00 34.12 O ATOM 0 H GLY A 174 13.074 0.318 -6.351 1.00 60.32 H new ATOM 0 HA2 GLY A 174 14.383 -1.019 -5.070 1.00 35.21 H new ATOM 0 HA3 GLY A 174 15.316 0.365 -4.538 1.00 35.21 H new ATOM 467 N VAL A 175 12.630 0.821 -3.105 1.00 4.11 N ATOM 468 CA VAL A 175 11.887 0.866 -1.844 1.00 74.24 C ATOM 469 C VAL A 175 10.607 0.025 -1.931 1.00 50.42 C ATOM 470 O VAL A 175 9.765 0.241 -2.806 1.00 45.12 O ATOM 471 CB VAL A 175 11.521 2.321 -1.456 1.00 61.24 C ATOM 472 CG1 VAL A 175 10.805 2.365 -0.106 1.00 11.54 C ATOM 473 CG2 VAL A 175 12.767 3.207 -1.439 1.00 32.32 C ATOM 0 H VAL A 175 12.335 1.516 -3.791 1.00 4.11 H new ATOM 0 HA VAL A 175 12.537 0.451 -1.074 1.00 74.24 H new ATOM 0 HB VAL A 175 10.837 2.709 -2.211 1.00 61.24 H new ATOM 0 HG11 VAL A 175 10.560 3.398 0.142 1.00 11.54 H new ATOM 0 HG12 VAL A 175 9.889 1.777 -0.161 1.00 11.54 H new ATOM 0 HG13 VAL A 175 11.456 1.951 0.665 1.00 11.54 H new ATOM 0 HG21 VAL A 175 12.487 4.224 -1.164 1.00 32.32 H new ATOM 0 HG22 VAL A 175 13.480 2.818 -0.712 1.00 32.32 H new ATOM 0 HG23 VAL A 175 13.224 3.211 -2.429 1.00 32.32 H new ATOM 483 N THR A 176 10.464 -0.932 -1.020 1.00 14.32 N ATOM 484 CA THR A 176 9.302 -1.828 -1.016 1.00 21.13 C ATOM 485 C THR A 176 8.039 -1.125 -0.501 1.00 14.22 C ATOM 486 O THR A 176 8.101 -0.021 0.050 1.00 32.42 O ATOM 487 CB THR A 176 9.541 -3.070 -0.125 1.00 74.33 C ATOM 488 OG1 THR A 176 9.547 -2.688 1.260 1.00 53.11 O ATOM 489 CG2 THR A 176 10.860 -3.752 -0.472 1.00 43.24 C ATOM 0 H THR A 176 11.135 -1.111 -0.273 1.00 14.32 H new ATOM 0 HA THR A 176 9.161 -2.132 -2.053 1.00 21.13 H new ATOM 0 HB THR A 176 8.730 -3.775 -0.307 1.00 74.33 H new ATOM 0 HG1 THR A 176 10.459 -2.450 1.530 1.00 53.11 H new ATOM 0 HG21 THR A 176 11.000 -4.621 0.171 1.00 43.24 H new ATOM 0 HG22 THR A 176 10.842 -4.070 -1.514 1.00 43.24 H new ATOM 0 HG23 THR A 176 11.682 -3.052 -0.321 1.00 43.24 H new ATOM 497 N VAL A 177 6.891 -1.775 -0.680 1.00 73.43 N ATOM 498 CA VAL A 177 5.636 -1.295 -0.098 1.00 74.42 C ATOM 499 C VAL A 177 5.736 -1.272 1.438 1.00 12.31 C ATOM 500 O VAL A 177 5.185 -0.392 2.102 1.00 44.01 O ATOM 501 CB VAL A 177 4.440 -2.186 -0.534 1.00 30.43 C ATOM 502 CG1 VAL A 177 3.130 -1.682 0.070 1.00 2.55 C ATOM 503 CG2 VAL A 177 4.345 -2.250 -2.058 1.00 32.41 C ATOM 0 H VAL A 177 6.802 -2.634 -1.222 1.00 73.43 H new ATOM 0 HA VAL A 177 5.462 -0.283 -0.463 1.00 74.42 H new ATOM 0 HB VAL A 177 4.615 -3.194 -0.158 1.00 30.43 H new ATOM 0 HG11 VAL A 177 2.310 -2.324 -0.252 1.00 2.55 H new ATOM 0 HG12 VAL A 177 3.200 -1.700 1.158 1.00 2.55 H new ATOM 0 HG13 VAL A 177 2.944 -0.661 -0.264 1.00 2.55 H new ATOM 0 HG21 VAL A 177 3.502 -2.878 -2.344 1.00 32.41 H new ATOM 0 HG22 VAL A 177 4.200 -1.246 -2.456 1.00 32.41 H new ATOM 0 HG23 VAL A 177 5.265 -2.672 -2.463 1.00 32.41 H new ATOM 513 N ARG A 178 6.482 -2.235 1.987 1.00 14.24 N ATOM 514 CA ARG A 178 6.679 -2.350 3.435 1.00 33.14 C ATOM 515 C ARG A 178 7.478 -1.156 3.989 1.00 33.34 C ATOM 516 O ARG A 178 7.059 -0.507 4.950 1.00 22.21 O ATOM 517 CB ARG A 178 7.406 -3.665 3.760 1.00 72.41 C ATOM 518 CG ARG A 178 7.328 -4.082 5.234 1.00 23.24 C ATOM 519 CD ARG A 178 8.710 -4.316 5.843 1.00 50.41 C ATOM 520 NE ARG A 178 9.492 -5.298 5.092 1.00 55.23 N ATOM 521 CZ ARG A 178 10.606 -5.022 4.464 1.00 13.31 C ATOM 522 NH1 ARG A 178 11.085 -3.822 4.480 1.00 24.22 N ATOM 523 NH2 ARG A 178 11.243 -5.949 3.831 1.00 53.42 N ATOM 0 H ARG A 178 6.963 -2.952 1.445 1.00 14.24 H new ATOM 0 HA ARG A 178 5.699 -2.348 3.911 1.00 33.14 H new ATOM 0 HB2 ARG A 178 6.984 -4.461 3.147 1.00 72.41 H new ATOM 0 HB3 ARG A 178 8.454 -3.566 3.477 1.00 72.41 H new ATOM 0 HG2 ARG A 178 6.809 -3.309 5.801 1.00 23.24 H new ATOM 0 HG3 ARG A 178 6.736 -4.993 5.321 1.00 23.24 H new ATOM 0 HD2 ARG A 178 9.254 -3.372 5.877 1.00 50.41 H new ATOM 0 HD3 ARG A 178 8.597 -4.656 6.873 1.00 50.41 H new ATOM 0 HE ARG A 178 9.147 -6.257 5.056 1.00 55.23 H new ATOM 0 HH11 ARG A 178 10.594 -3.084 4.984 1.00 24.22 H new ATOM 0 HH12 ARG A 178 11.954 -3.613 3.988 1.00 24.22 H new ATOM 0 HH21 ARG A 178 10.878 -6.901 3.819 1.00 53.42 H new ATOM 0 HH22 ARG A 178 12.111 -5.729 3.343 1.00 53.42 H new ATOM 537 N ASP A 179 8.625 -0.867 3.375 1.00 74.02 N ATOM 538 CA ASP A 179 9.482 0.247 3.811 1.00 53.15 C ATOM 539 C ASP A 179 8.819 1.619 3.578 1.00 44.02 C ATOM 540 O ASP A 179 9.194 2.615 4.203 1.00 4.41 O ATOM 541 CB ASP A 179 10.837 0.192 3.094 1.00 12.43 C ATOM 542 CG ASP A 179 11.647 -1.029 3.488 1.00 60.43 C ATOM 543 OD1 ASP A 179 12.110 -1.088 4.647 1.00 11.22 O ATOM 544 OD2 ASP A 179 11.819 -1.935 2.649 1.00 32.14 O ATOM 0 H ASP A 179 8.986 -1.385 2.574 1.00 74.02 H new ATOM 0 HA ASP A 179 9.634 0.133 4.884 1.00 53.15 H new ATOM 0 HB2 ASP A 179 10.675 0.186 2.016 1.00 12.43 H new ATOM 0 HB3 ASP A 179 11.405 1.093 3.326 1.00 12.43 H new ATOM 549 N SER A 180 7.844 1.670 2.674 1.00 1.24 N ATOM 550 CA SER A 180 7.120 2.915 2.382 1.00 10.33 C ATOM 551 C SER A 180 5.942 3.130 3.344 1.00 23.42 C ATOM 552 O SER A 180 5.791 4.208 3.923 1.00 43.13 O ATOM 553 CB SER A 180 6.617 2.919 0.931 1.00 71.31 C ATOM 554 OG SER A 180 7.702 2.906 0.012 1.00 21.32 O ATOM 0 H SER A 180 7.533 0.866 2.128 1.00 1.24 H new ATOM 0 HA SER A 180 7.822 3.737 2.522 1.00 10.33 H new ATOM 0 HB2 SER A 180 5.982 2.050 0.761 1.00 71.31 H new ATOM 0 HB3 SER A 180 6.001 3.802 0.759 1.00 71.31 H new ATOM 0 HG SER A 180 7.488 2.312 -0.738 1.00 21.32 H new ATOM 560 N LEU A 181 5.116 2.099 3.524 1.00 44.13 N ATOM 561 CA LEU A 181 3.914 2.211 4.367 1.00 3.02 C ATOM 562 C LEU A 181 4.218 2.021 5.864 1.00 10.30 C ATOM 563 O LEU A 181 3.322 2.147 6.696 1.00 24.53 O ATOM 564 CB LEU A 181 2.841 1.205 3.919 1.00 51.43 C ATOM 565 CG LEU A 181 2.244 1.459 2.522 1.00 53.32 C ATOM 566 CD1 LEU A 181 1.182 0.413 2.189 1.00 71.10 C ATOM 567 CD2 LEU A 181 1.659 2.868 2.428 1.00 72.21 C ATOM 0 H LEU A 181 5.251 1.180 3.102 1.00 44.13 H new ATOM 0 HA LEU A 181 3.538 3.226 4.238 1.00 3.02 H new ATOM 0 HB2 LEU A 181 3.275 0.205 3.935 1.00 51.43 H new ATOM 0 HB3 LEU A 181 2.032 1.213 4.649 1.00 51.43 H new ATOM 0 HG LEU A 181 3.048 1.375 1.791 1.00 53.32 H new ATOM 0 HD11 LEU A 181 0.774 0.612 1.198 1.00 71.10 H new ATOM 0 HD12 LEU A 181 1.632 -0.580 2.204 1.00 71.10 H new ATOM 0 HD13 LEU A 181 0.381 0.460 2.927 1.00 71.10 H new ATOM 0 HD21 LEU A 181 1.243 3.024 1.432 1.00 72.21 H new ATOM 0 HD22 LEU A 181 0.871 2.985 3.172 1.00 72.21 H new ATOM 0 HD23 LEU A 181 2.444 3.601 2.612 1.00 72.21 H new ATOM 579 N LYS A 182 5.477 1.740 6.209 1.00 43.12 N ATOM 580 CA LYS A 182 5.874 1.567 7.620 1.00 73.33 C ATOM 581 C LYS A 182 5.500 2.795 8.474 1.00 40.04 C ATOM 582 O LYS A 182 5.316 2.691 9.688 1.00 74.21 O ATOM 583 CB LYS A 182 7.384 1.297 7.733 1.00 21.54 C ATOM 584 CG LYS A 182 8.260 2.467 7.296 1.00 50.21 C ATOM 585 CD LYS A 182 9.751 2.134 7.391 1.00 32.43 C ATOM 586 CE LYS A 182 10.167 1.754 8.810 1.00 52.51 C ATOM 587 NZ LYS A 182 11.624 1.475 8.906 1.00 33.35 N ATOM 0 H LYS A 182 6.239 1.627 5.540 1.00 43.12 H new ATOM 0 HA LYS A 182 5.326 0.706 8.003 1.00 73.33 H new ATOM 0 HB2 LYS A 182 7.621 1.046 8.767 1.00 21.54 H new ATOM 0 HB3 LYS A 182 7.633 0.425 7.128 1.00 21.54 H new ATOM 0 HG2 LYS A 182 8.014 2.740 6.270 1.00 50.21 H new ATOM 0 HG3 LYS A 182 8.042 3.335 7.918 1.00 50.21 H new ATOM 0 HD2 LYS A 182 9.982 1.312 6.714 1.00 32.43 H new ATOM 0 HD3 LYS A 182 10.335 2.993 7.060 1.00 32.43 H new ATOM 0 HE2 LYS A 182 9.907 2.562 9.493 1.00 52.51 H new ATOM 0 HE3 LYS A 182 9.607 0.875 9.129 1.00 52.51 H new ATOM 0 HZ1 LYS A 182 11.865 1.221 9.885 1.00 33.35 H new ATOM 0 HZ2 LYS A 182 11.869 0.687 8.273 1.00 33.35 H new ATOM 0 HZ3 LYS A 182 12.159 2.322 8.627 1.00 33.35 H new ATOM 601 N LYS A 183 5.403 3.960 7.829 1.00 30.50 N ATOM 602 CA LYS A 183 4.967 5.189 8.502 1.00 32.13 C ATOM 603 C LYS A 183 3.431 5.246 8.609 1.00 3.32 C ATOM 604 O LYS A 183 2.879 5.504 9.681 1.00 33.35 O ATOM 605 CB LYS A 183 5.479 6.420 7.736 1.00 35.34 C ATOM 606 CG LYS A 183 7.000 6.489 7.599 1.00 3.41 C ATOM 607 CD LYS A 183 7.693 6.611 8.955 1.00 33.02 C ATOM 608 CE LYS A 183 9.206 6.751 8.807 1.00 51.15 C ATOM 609 NZ LYS A 183 9.887 6.912 10.121 1.00 42.23 N ATOM 0 H LYS A 183 5.621 4.080 6.840 1.00 30.50 H new ATOM 0 HA LYS A 183 5.383 5.189 9.509 1.00 32.13 H new ATOM 0 HB2 LYS A 183 5.036 6.424 6.740 1.00 35.34 H new ATOM 0 HB3 LYS A 183 5.131 7.320 8.243 1.00 35.34 H new ATOM 0 HG2 LYS A 183 7.359 5.596 7.088 1.00 3.41 H new ATOM 0 HG3 LYS A 183 7.269 7.342 6.976 1.00 3.41 H new ATOM 0 HD2 LYS A 183 7.298 7.476 9.489 1.00 33.02 H new ATOM 0 HD3 LYS A 183 7.466 5.733 9.559 1.00 33.02 H new ATOM 0 HE2 LYS A 183 9.603 5.872 8.299 1.00 51.15 H new ATOM 0 HE3 LYS A 183 9.430 7.611 8.176 1.00 51.15 H new ATOM 0 HZ1 LYS A 183 10.912 7.003 9.972 1.00 42.23 H new ATOM 0 HZ2 LYS A 183 9.529 7.765 10.595 1.00 42.23 H new ATOM 0 HZ3 LYS A 183 9.696 6.080 10.715 1.00 42.23 H new ATOM 623 N ALA A 184 2.753 4.993 7.485 1.00 11.35 N ATOM 624 CA ALA A 184 1.285 5.040 7.417 1.00 51.11 C ATOM 625 C ALA A 184 0.633 4.041 8.383 1.00 3.51 C ATOM 626 O ALA A 184 -0.327 4.369 9.082 1.00 51.32 O ATOM 627 CB ALA A 184 0.825 4.773 5.987 1.00 33.24 C ATOM 0 H ALA A 184 3.201 4.751 6.601 1.00 11.35 H new ATOM 0 HA ALA A 184 0.968 6.038 7.721 1.00 51.11 H new ATOM 0 HB1 ALA A 184 -0.263 4.809 5.942 1.00 33.24 H new ATOM 0 HB2 ALA A 184 1.241 5.531 5.323 1.00 33.24 H new ATOM 0 HB3 ALA A 184 1.169 3.788 5.672 1.00 33.24 H new ATOM 633 N LEU A 185 1.158 2.823 8.416 1.00 10.24 N ATOM 634 CA LEU A 185 0.657 1.790 9.325 1.00 14.20 C ATOM 635 C LEU A 185 0.850 2.200 10.795 1.00 12.12 C ATOM 636 O LEU A 185 -0.071 2.096 11.606 1.00 24.33 O ATOM 637 CB LEU A 185 1.368 0.457 9.056 1.00 4.11 C ATOM 638 CG LEU A 185 1.188 -0.109 7.636 1.00 35.23 C ATOM 639 CD1 LEU A 185 2.011 -1.383 7.455 1.00 2.20 C ATOM 640 CD2 LEU A 185 -0.290 -0.372 7.344 1.00 51.55 C ATOM 0 H LEU A 185 1.932 2.522 7.824 1.00 10.24 H new ATOM 0 HA LEU A 185 -0.411 1.672 9.142 1.00 14.20 H new ATOM 0 HB2 LEU A 185 2.434 0.588 9.245 1.00 4.11 H new ATOM 0 HB3 LEU A 185 1.005 -0.280 9.772 1.00 4.11 H new ATOM 0 HG LEU A 185 1.549 0.633 6.924 1.00 35.23 H new ATOM 0 HD11 LEU A 185 1.870 -1.767 6.445 1.00 2.20 H new ATOM 0 HD12 LEU A 185 3.066 -1.160 7.614 1.00 2.20 H new ATOM 0 HD13 LEU A 185 1.685 -2.132 8.177 1.00 2.20 H new ATOM 0 HD21 LEU A 185 -0.396 -0.772 6.336 1.00 51.55 H new ATOM 0 HD22 LEU A 185 -0.680 -1.092 8.063 1.00 51.55 H new ATOM 0 HD23 LEU A 185 -0.848 0.561 7.425 1.00 51.55 H new ATOM 652 N MET A 186 2.049 2.688 11.120 1.00 61.13 N ATOM 653 CA MET A 186 2.390 3.075 12.497 1.00 53.32 C ATOM 654 C MET A 186 1.446 4.167 13.030 1.00 34.22 C ATOM 655 O MET A 186 0.926 4.058 14.140 1.00 25.20 O ATOM 656 CB MET A 186 3.847 3.553 12.572 1.00 43.22 C ATOM 657 CG MET A 186 4.358 3.810 13.991 1.00 15.55 C ATOM 658 SD MET A 186 4.515 2.298 14.984 1.00 3.24 S ATOM 659 CE MET A 186 2.862 2.107 15.661 1.00 15.14 C ATOM 0 H MET A 186 2.804 2.826 10.449 1.00 61.13 H new ATOM 0 HA MET A 186 2.269 2.193 13.127 1.00 53.32 H new ATOM 0 HB2 MET A 186 4.486 2.807 12.099 1.00 43.22 H new ATOM 0 HB3 MET A 186 3.945 4.471 11.992 1.00 43.22 H new ATOM 0 HG2 MET A 186 5.329 4.303 13.936 1.00 15.55 H new ATOM 0 HG3 MET A 186 3.679 4.498 14.495 1.00 15.55 H new ATOM 0 HE1 MET A 186 2.925 1.661 16.654 1.00 15.14 H new ATOM 0 HE2 MET A 186 2.383 3.083 15.732 1.00 15.14 H new ATOM 0 HE3 MET A 186 2.274 1.461 15.009 1.00 15.14 H new ATOM 669 N MET A 187 1.206 5.209 12.231 1.00 25.01 N ATOM 670 CA MET A 187 0.307 6.300 12.644 1.00 54.53 C ATOM 671 C MET A 187 -1.159 5.829 12.745 1.00 23.14 C ATOM 672 O MET A 187 -2.026 6.567 13.207 1.00 33.44 O ATOM 673 CB MET A 187 0.417 7.499 11.683 1.00 31.30 C ATOM 674 CG MET A 187 0.044 7.185 10.240 1.00 62.42 C ATOM 675 SD MET A 187 0.137 8.630 9.161 1.00 33.15 S ATOM 676 CE MET A 187 -1.184 9.642 9.824 1.00 45.11 C ATOM 0 H MET A 187 1.614 5.324 11.303 1.00 25.01 H new ATOM 0 HA MET A 187 0.625 6.617 13.637 1.00 54.53 H new ATOM 0 HB2 MET A 187 -0.227 8.300 12.046 1.00 31.30 H new ATOM 0 HB3 MET A 187 1.439 7.876 11.707 1.00 31.30 H new ATOM 0 HG2 MET A 187 0.708 6.410 9.859 1.00 62.42 H new ATOM 0 HG3 MET A 187 -0.968 6.781 10.211 1.00 62.42 H new ATOM 0 HE1 MET A 187 -1.464 10.399 9.092 1.00 45.11 H new ATOM 0 HE2 MET A 187 -2.047 9.014 10.046 1.00 45.11 H new ATOM 0 HE3 MET A 187 -0.845 10.129 10.738 1.00 45.11 H new ATOM 686 N ARG A 188 -1.437 4.605 12.290 1.00 22.33 N ATOM 687 CA ARG A 188 -2.773 4.007 12.433 1.00 41.25 C ATOM 688 C ARG A 188 -2.750 2.815 13.411 1.00 65.51 C ATOM 689 O ARG A 188 -3.767 2.154 13.622 1.00 34.45 O ATOM 690 CB ARG A 188 -3.309 3.551 11.065 1.00 73.12 C ATOM 691 CG ARG A 188 -3.345 4.652 10.006 1.00 44.43 C ATOM 692 CD ARG A 188 -4.057 5.911 10.497 1.00 72.21 C ATOM 693 NE ARG A 188 -5.410 5.642 10.976 1.00 22.10 N ATOM 694 CZ ARG A 188 -6.245 6.563 11.378 1.00 13.14 C ATOM 695 NH1 ARG A 188 -5.904 7.815 11.377 1.00 43.40 N ATOM 696 NH2 ARG A 188 -7.419 6.224 11.799 1.00 64.13 N ATOM 0 H ARG A 188 -0.758 4.007 11.820 1.00 22.33 H new ATOM 0 HA ARG A 188 -3.436 4.771 12.839 1.00 41.25 H new ATOM 0 HB2 ARG A 188 -2.690 2.732 10.700 1.00 73.12 H new ATOM 0 HB3 ARG A 188 -4.316 3.156 11.196 1.00 73.12 H new ATOM 0 HG2 ARG A 188 -2.326 4.905 9.714 1.00 44.43 H new ATOM 0 HG3 ARG A 188 -3.848 4.278 9.114 1.00 44.43 H new ATOM 0 HD2 ARG A 188 -3.475 6.363 11.300 1.00 72.21 H new ATOM 0 HD3 ARG A 188 -4.101 6.638 9.686 1.00 72.21 H new ATOM 0 HE ARG A 188 -5.724 4.672 10.998 1.00 22.10 H new ATOM 0 HH11 ARG A 188 -4.974 8.090 11.060 1.00 43.40 H new ATOM 0 HH12 ARG A 188 -6.566 8.524 11.693 1.00 43.40 H new ATOM 0 HH21 ARG A 188 -7.690 5.241 11.816 1.00 64.13 H new ATOM 0 HH22 ARG A 188 -8.074 6.940 12.114 1.00 64.13 H new ATOM 710 N GLY A 189 -1.582 2.548 13.999 1.00 41.52 N ATOM 711 CA GLY A 189 -1.440 1.452 14.958 1.00 54.22 C ATOM 712 C GLY A 189 -1.427 0.064 14.313 1.00 52.25 C ATOM 713 O GLY A 189 -1.504 -0.950 15.008 1.00 42.20 O ATOM 0 H GLY A 189 -0.725 3.073 13.829 1.00 41.52 H new ATOM 0 HA2 GLY A 189 -0.516 1.590 15.519 1.00 54.22 H new ATOM 0 HA3 GLY A 189 -2.259 1.501 15.676 1.00 54.22 H new ATOM 717 N LEU A 190 -1.300 0.017 12.987 1.00 2.25 N ATOM 718 CA LEU A 190 -1.348 -1.248 12.236 1.00 12.02 C ATOM 719 C LEU A 190 0.050 -1.878 12.084 1.00 61.12 C ATOM 720 O LEU A 190 1.057 -1.305 12.508 1.00 44.13 O ATOM 721 CB LEU A 190 -1.966 -1.000 10.852 1.00 12.53 C ATOM 722 CG LEU A 190 -3.359 -0.344 10.868 1.00 3.24 C ATOM 723 CD1 LEU A 190 -3.834 -0.038 9.449 1.00 3.02 C ATOM 724 CD2 LEU A 190 -4.370 -1.230 11.600 1.00 10.13 C ATOM 0 H LEU A 190 -1.162 0.842 12.404 1.00 2.25 H new ATOM 0 HA LEU A 190 -1.964 -1.950 12.797 1.00 12.02 H new ATOM 0 HB2 LEU A 190 -1.290 -0.367 10.277 1.00 12.53 H new ATOM 0 HB3 LEU A 190 -2.036 -1.952 10.326 1.00 12.53 H new ATOM 0 HG LEU A 190 -3.281 0.599 11.409 1.00 3.24 H new ATOM 0 HD11 LEU A 190 -4.820 0.425 9.487 1.00 3.02 H new ATOM 0 HD12 LEU A 190 -3.132 0.644 8.969 1.00 3.02 H new ATOM 0 HD13 LEU A 190 -3.890 -0.964 8.876 1.00 3.02 H new ATOM 0 HD21 LEU A 190 -5.346 -0.746 11.598 1.00 10.13 H new ATOM 0 HD22 LEU A 190 -4.442 -2.193 11.095 1.00 10.13 H new ATOM 0 HD23 LEU A 190 -4.043 -1.383 12.628 1.00 10.13 H new ATOM 736 N ILE A 191 0.098 -3.069 11.484 1.00 71.44 N ATOM 737 CA ILE A 191 1.363 -3.780 11.233 1.00 4.01 C ATOM 738 C ILE A 191 1.358 -4.463 9.849 1.00 40.42 C ATOM 739 O ILE A 191 0.329 -4.984 9.412 1.00 25.13 O ATOM 740 CB ILE A 191 1.651 -4.845 12.327 1.00 1.23 C ATOM 741 CG1 ILE A 191 0.423 -5.745 12.545 1.00 24.23 C ATOM 742 CG2 ILE A 191 2.083 -4.185 13.633 1.00 62.20 C ATOM 743 CD1 ILE A 191 0.641 -6.849 13.560 1.00 73.11 C ATOM 0 H ILE A 191 -0.730 -3.569 11.159 1.00 71.44 H new ATOM 0 HA ILE A 191 2.152 -3.028 11.259 1.00 4.01 H new ATOM 0 HB ILE A 191 2.474 -5.471 11.982 1.00 1.23 H new ATOM 0 HG12 ILE A 191 -0.414 -5.127 12.869 1.00 24.23 H new ATOM 0 HG13 ILE A 191 0.139 -6.192 11.592 1.00 24.23 H new ATOM 0 HG21 ILE A 191 2.278 -4.953 14.382 1.00 62.20 H new ATOM 0 HG22 ILE A 191 2.990 -3.604 13.464 1.00 62.20 H new ATOM 0 HG23 ILE A 191 1.290 -3.526 13.987 1.00 62.20 H new ATOM 0 HD11 ILE A 191 -0.270 -7.439 13.657 1.00 73.11 H new ATOM 0 HD12 ILE A 191 1.456 -7.492 13.229 1.00 73.11 H new ATOM 0 HD13 ILE A 191 0.894 -6.411 14.525 1.00 73.11 H new ATOM 755 N PRO A 192 2.517 -4.481 9.149 1.00 72.12 N ATOM 756 CA PRO A 192 2.624 -5.041 7.780 1.00 43.35 C ATOM 757 C PRO A 192 2.151 -6.502 7.666 1.00 3.31 C ATOM 758 O PRO A 192 1.333 -6.833 6.809 1.00 51.13 O ATOM 759 CB PRO A 192 4.128 -4.946 7.470 1.00 1.42 C ATOM 760 CG PRO A 192 4.641 -3.876 8.376 1.00 61.13 C ATOM 761 CD PRO A 192 3.813 -3.964 9.630 1.00 70.13 C ATOM 0 HA PRO A 192 1.984 -4.496 7.087 1.00 43.35 H new ATOM 0 HB2 PRO A 192 4.630 -5.895 7.656 1.00 1.42 H new ATOM 0 HB3 PRO A 192 4.300 -4.694 6.424 1.00 1.42 H new ATOM 0 HG2 PRO A 192 5.698 -4.024 8.595 1.00 61.13 H new ATOM 0 HG3 PRO A 192 4.546 -2.894 7.913 1.00 61.13 H new ATOM 0 HD2 PRO A 192 4.265 -4.632 10.364 1.00 70.13 H new ATOM 0 HD3 PRO A 192 3.705 -2.991 10.109 1.00 70.13 H new ATOM 769 N GLU A 193 2.641 -7.364 8.555 1.00 51.34 N ATOM 770 CA GLU A 193 2.355 -8.809 8.477 1.00 41.24 C ATOM 771 C GLU A 193 0.913 -9.156 8.896 1.00 73.23 C ATOM 772 O GLU A 193 0.556 -10.333 8.996 1.00 74.44 O ATOM 773 CB GLU A 193 3.361 -9.634 9.307 1.00 11.14 C ATOM 774 CG GLU A 193 3.526 -9.197 10.763 1.00 65.35 C ATOM 775 CD GLU A 193 4.429 -7.980 10.922 1.00 43.52 C ATOM 776 OE1 GLU A 193 5.662 -8.122 10.771 1.00 55.43 O ATOM 777 OE2 GLU A 193 3.914 -6.878 11.192 1.00 40.24 O ATOM 0 H GLU A 193 3.237 -7.095 9.338 1.00 51.34 H new ATOM 0 HA GLU A 193 2.464 -9.077 7.426 1.00 41.24 H new ATOM 0 HB2 GLU A 193 3.048 -10.678 9.292 1.00 11.14 H new ATOM 0 HB3 GLU A 193 4.334 -9.586 8.819 1.00 11.14 H new ATOM 0 HG2 GLU A 193 2.545 -8.972 11.182 1.00 65.35 H new ATOM 0 HG3 GLU A 193 3.937 -10.025 11.341 1.00 65.35 H new ATOM 784 N CYS A 194 0.092 -8.141 9.156 1.00 13.12 N ATOM 785 CA CYS A 194 -1.328 -8.358 9.470 1.00 55.22 C ATOM 786 C CYS A 194 -2.235 -7.491 8.585 1.00 65.44 C ATOM 787 O CYS A 194 -3.423 -7.324 8.864 1.00 51.10 O ATOM 788 CB CYS A 194 -1.596 -8.062 10.948 1.00 31.43 C ATOM 789 SG CYS A 194 -3.283 -8.418 11.487 1.00 23.15 S ATOM 0 H CYS A 194 0.379 -7.162 9.157 1.00 13.12 H new ATOM 0 HA CYS A 194 -1.559 -9.404 9.267 1.00 55.22 H new ATOM 0 HB2 CYS A 194 -0.903 -8.646 11.554 1.00 31.43 H new ATOM 0 HB3 CYS A 194 -1.380 -7.011 11.140 1.00 31.43 H new ATOM 0 HG CYS A 194 -4.118 -8.085 10.548 1.00 23.15 H new ATOM 795 N CYS A 195 -1.675 -6.948 7.503 1.00 12.02 N ATOM 796 CA CYS A 195 -2.444 -6.126 6.556 1.00 70.13 C ATOM 797 C CYS A 195 -2.231 -6.606 5.115 1.00 4.12 C ATOM 798 O CYS A 195 -1.110 -6.915 4.712 1.00 65.05 O ATOM 799 CB CYS A 195 -2.045 -4.649 6.679 1.00 33.14 C ATOM 800 SG CYS A 195 -2.348 -3.941 8.315 1.00 23.25 S ATOM 0 H CYS A 195 -0.691 -7.060 7.257 1.00 12.02 H new ATOM 0 HA CYS A 195 -3.501 -6.230 6.803 1.00 70.13 H new ATOM 0 HB2 CYS A 195 -0.986 -4.548 6.441 1.00 33.14 H new ATOM 0 HB3 CYS A 195 -2.595 -4.071 5.936 1.00 33.14 H new ATOM 0 HG CYS A 195 -1.355 -4.228 9.103 1.00 23.25 H new ATOM 806 N ALA A 196 -3.310 -6.671 4.341 1.00 45.34 N ATOM 807 CA ALA A 196 -3.238 -7.143 2.954 1.00 3.41 C ATOM 808 C ALA A 196 -3.462 -6.001 1.952 1.00 53.31 C ATOM 809 O ALA A 196 -4.504 -5.344 1.969 1.00 33.41 O ATOM 810 CB ALA A 196 -4.264 -8.249 2.724 1.00 14.43 C ATOM 0 H ALA A 196 -4.246 -6.404 4.646 1.00 45.34 H new ATOM 0 HA ALA A 196 -2.235 -7.537 2.789 1.00 3.41 H new ATOM 0 HB1 ALA A 196 -4.203 -8.593 1.691 1.00 14.43 H new ATOM 0 HB2 ALA A 196 -4.058 -9.082 3.397 1.00 14.43 H new ATOM 0 HB3 ALA A 196 -5.265 -7.863 2.919 1.00 14.43 H new ATOM 816 N VAL A 197 -2.475 -5.766 1.088 1.00 4.13 N ATOM 817 CA VAL A 197 -2.590 -4.769 0.017 1.00 42.03 C ATOM 818 C VAL A 197 -2.951 -5.445 -1.315 1.00 75.41 C ATOM 819 O VAL A 197 -2.431 -6.513 -1.631 1.00 23.01 O ATOM 820 CB VAL A 197 -1.265 -3.979 -0.177 1.00 2.52 C ATOM 821 CG1 VAL A 197 -1.429 -2.877 -1.225 1.00 52.33 C ATOM 822 CG2 VAL A 197 -0.769 -3.400 1.147 1.00 63.44 C ATOM 0 H VAL A 197 -1.580 -6.255 1.107 1.00 4.13 H new ATOM 0 HA VAL A 197 -3.378 -4.077 0.314 1.00 42.03 H new ATOM 0 HB VAL A 197 -0.513 -4.680 -0.540 1.00 2.52 H new ATOM 0 HG11 VAL A 197 -0.487 -2.341 -1.340 1.00 52.33 H new ATOM 0 HG12 VAL A 197 -1.712 -3.321 -2.179 1.00 52.33 H new ATOM 0 HG13 VAL A 197 -2.205 -2.182 -0.904 1.00 52.33 H new ATOM 0 HG21 VAL A 197 0.159 -2.853 0.980 1.00 63.44 H new ATOM 0 HG22 VAL A 197 -1.521 -2.723 1.553 1.00 63.44 H new ATOM 0 HG23 VAL A 197 -0.590 -4.210 1.854 1.00 63.44 H new ATOM 832 N TYR A 198 -3.842 -4.834 -2.092 1.00 2.54 N ATOM 833 CA TYR A 198 -4.171 -5.356 -3.423 1.00 55.23 C ATOM 834 C TYR A 198 -4.504 -4.231 -4.414 1.00 13.12 C ATOM 835 O TYR A 198 -4.944 -3.143 -4.028 1.00 13.31 O ATOM 836 CB TYR A 198 -5.330 -6.364 -3.345 1.00 4.53 C ATOM 837 CG TYR A 198 -6.635 -5.791 -2.821 1.00 43.24 C ATOM 838 CD1 TYR A 198 -7.544 -5.184 -3.680 1.00 72.52 C ATOM 839 CD2 TYR A 198 -6.963 -5.872 -1.472 1.00 73.12 C ATOM 840 CE1 TYR A 198 -8.737 -4.675 -3.210 1.00 30.44 C ATOM 841 CE2 TYR A 198 -8.157 -5.366 -0.997 1.00 74.12 C ATOM 842 CZ TYR A 198 -9.039 -4.769 -1.870 1.00 22.35 C ATOM 843 OH TYR A 198 -10.234 -4.265 -1.404 1.00 63.42 O ATOM 0 H TYR A 198 -4.346 -3.987 -1.831 1.00 2.54 H new ATOM 0 HA TYR A 198 -3.285 -5.870 -3.794 1.00 55.23 H new ATOM 0 HB2 TYR A 198 -5.503 -6.776 -4.339 1.00 4.53 H new ATOM 0 HB3 TYR A 198 -5.030 -7.193 -2.704 1.00 4.53 H new ATOM 0 HD1 TYR A 198 -7.313 -5.110 -4.732 1.00 72.52 H new ATOM 0 HD2 TYR A 198 -6.273 -6.338 -0.785 1.00 73.12 H new ATOM 0 HE1 TYR A 198 -9.431 -4.205 -3.891 1.00 30.44 H new ATOM 0 HE2 TYR A 198 -8.398 -5.438 0.053 1.00 74.12 H new ATOM 0 HH TYR A 198 -10.296 -4.411 -0.437 1.00 63.42 H new ATOM 853 N ARG A 199 -4.276 -4.506 -5.695 1.00 14.34 N ATOM 854 CA ARG A 199 -4.581 -3.557 -6.773 1.00 1.30 C ATOM 855 C ARG A 199 -5.700 -4.107 -7.673 1.00 10.20 C ATOM 856 O ARG A 199 -5.957 -5.312 -7.691 1.00 3.44 O ATOM 857 CB ARG A 199 -3.316 -3.283 -7.606 1.00 34.42 C ATOM 858 CG ARG A 199 -2.807 -4.499 -8.380 1.00 50.33 C ATOM 859 CD ARG A 199 -1.423 -4.264 -8.986 1.00 32.55 C ATOM 860 NE ARG A 199 -1.354 -3.031 -9.774 1.00 65.22 N ATOM 861 CZ ARG A 199 -0.877 -2.953 -10.988 1.00 63.23 C ATOM 862 NH1 ARG A 199 -0.484 -4.009 -11.622 1.00 53.42 N ATOM 863 NH2 ARG A 199 -0.798 -1.810 -11.570 1.00 21.13 N ATOM 0 H ARG A 199 -3.877 -5.387 -6.019 1.00 14.34 H new ATOM 0 HA ARG A 199 -4.923 -2.622 -6.329 1.00 1.30 H new ATOM 0 HB2 ARG A 199 -3.524 -2.478 -8.310 1.00 34.42 H new ATOM 0 HB3 ARG A 199 -2.526 -2.930 -6.943 1.00 34.42 H new ATOM 0 HG2 ARG A 199 -2.768 -5.361 -7.714 1.00 50.33 H new ATOM 0 HG3 ARG A 199 -3.512 -4.742 -9.174 1.00 50.33 H new ATOM 0 HD2 ARG A 199 -0.683 -4.222 -8.187 1.00 32.55 H new ATOM 0 HD3 ARG A 199 -1.160 -5.111 -9.620 1.00 32.55 H new ATOM 0 HE ARG A 199 -1.703 -2.174 -9.345 1.00 65.22 H new ATOM 0 HH11 ARG A 199 -0.543 -4.924 -11.175 1.00 53.42 H new ATOM 0 HH12 ARG A 199 -0.115 -3.927 -12.569 1.00 53.42 H new ATOM 0 HH21 ARG A 199 -1.107 -0.968 -11.084 1.00 21.13 H new ATOM 0 HH22 ARG A 199 -0.426 -1.745 -12.518 1.00 21.13 H new ATOM 877 N ILE A 200 -6.368 -3.228 -8.414 1.00 15.12 N ATOM 878 CA ILE A 200 -7.431 -3.653 -9.332 1.00 2.51 C ATOM 879 C ILE A 200 -6.922 -3.676 -10.781 1.00 13.13 C ATOM 880 O ILE A 200 -6.900 -2.654 -11.467 1.00 5.23 O ATOM 881 CB ILE A 200 -8.685 -2.747 -9.217 1.00 5.01 C ATOM 882 CG1 ILE A 200 -9.215 -2.761 -7.771 1.00 23.33 C ATOM 883 CG2 ILE A 200 -9.771 -3.203 -10.194 1.00 34.31 C ATOM 884 CD1 ILE A 200 -10.456 -1.917 -7.561 1.00 41.03 C ATOM 0 H ILE A 200 -6.197 -2.223 -8.401 1.00 15.12 H new ATOM 0 HA ILE A 200 -7.722 -4.663 -9.045 1.00 2.51 H new ATOM 0 HB ILE A 200 -8.404 -1.726 -9.476 1.00 5.01 H new ATOM 0 HG12 ILE A 200 -9.435 -3.790 -7.486 1.00 23.33 H new ATOM 0 HG13 ILE A 200 -8.430 -2.406 -7.104 1.00 23.33 H new ATOM 0 HG21 ILE A 200 -10.642 -2.555 -10.098 1.00 34.31 H new ATOM 0 HG22 ILE A 200 -9.389 -3.149 -11.214 1.00 34.31 H new ATOM 0 HG23 ILE A 200 -10.056 -4.230 -9.967 1.00 34.31 H new ATOM 0 HD11 ILE A 200 -10.766 -1.979 -6.518 1.00 41.03 H new ATOM 0 HD12 ILE A 200 -10.237 -0.879 -7.813 1.00 41.03 H new ATOM 0 HD13 ILE A 200 -11.258 -2.284 -8.201 1.00 41.03 H new ATOM 896 N GLN A 201 -6.498 -4.856 -11.228 1.00 4.22 N ATOM 897 CA GLN A 201 -5.899 -5.023 -12.555 1.00 64.11 C ATOM 898 C GLN A 201 -6.858 -5.781 -13.489 1.00 61.41 C ATOM 899 O GLN A 201 -7.358 -6.855 -13.142 1.00 43.40 O ATOM 900 CB GLN A 201 -4.559 -5.777 -12.430 1.00 1.53 C ATOM 901 CG GLN A 201 -3.420 -5.184 -13.259 1.00 55.21 C ATOM 902 CD GLN A 201 -3.680 -5.209 -14.760 1.00 45.14 C ATOM 903 OE1 GLN A 201 -4.347 -6.099 -15.279 1.00 20.54 O ATOM 904 NE2 GLN A 201 -3.160 -4.225 -15.470 1.00 10.12 N ATOM 0 H GLN A 201 -6.558 -5.719 -10.687 1.00 4.22 H new ATOM 0 HA GLN A 201 -5.714 -4.039 -12.985 1.00 64.11 H new ATOM 0 HB2 GLN A 201 -4.260 -5.790 -11.382 1.00 1.53 H new ATOM 0 HB3 GLN A 201 -4.710 -6.813 -12.732 1.00 1.53 H new ATOM 0 HG2 GLN A 201 -3.252 -4.154 -12.945 1.00 55.21 H new ATOM 0 HG3 GLN A 201 -2.504 -5.735 -13.048 1.00 55.21 H new ATOM 0 HE21 GLN A 201 -2.610 -3.499 -15.010 1.00 10.12 H new ATOM 0 HE22 GLN A 201 -3.308 -4.190 -16.479 1.00 10.12 H new ATOM 913 N ASP A 202 -7.112 -5.211 -14.668 1.00 64.31 N ATOM 914 CA ASP A 202 -8.011 -5.812 -15.663 1.00 52.53 C ATOM 915 C ASP A 202 -9.462 -5.877 -15.137 1.00 2.24 C ATOM 916 O ASP A 202 -10.293 -6.638 -15.635 1.00 62.14 O ATOM 917 CB ASP A 202 -7.505 -7.212 -16.057 1.00 45.31 C ATOM 918 CG ASP A 202 -8.091 -7.699 -17.370 1.00 53.30 C ATOM 919 OD1 ASP A 202 -7.551 -7.326 -18.434 1.00 50.15 O ATOM 920 OD2 ASP A 202 -9.080 -8.461 -17.351 1.00 62.12 O ATOM 0 H ASP A 202 -6.704 -4.324 -14.962 1.00 64.31 H new ATOM 0 HA ASP A 202 -8.012 -5.180 -16.551 1.00 52.53 H new ATOM 0 HB2 ASP A 202 -6.418 -7.192 -16.134 1.00 45.31 H new ATOM 0 HB3 ASP A 202 -7.756 -7.920 -15.267 1.00 45.31 H new ATOM 925 N GLY A 203 -9.762 -5.054 -14.131 1.00 45.01 N ATOM 926 CA GLY A 203 -11.102 -5.015 -13.557 1.00 44.11 C ATOM 927 C GLY A 203 -11.249 -5.858 -12.293 1.00 34.35 C ATOM 928 O GLY A 203 -12.165 -5.636 -11.499 1.00 25.04 O ATOM 0 H GLY A 203 -9.098 -4.410 -13.701 1.00 45.01 H new ATOM 0 HA2 GLY A 203 -11.360 -3.981 -13.326 1.00 44.11 H new ATOM 0 HA3 GLY A 203 -11.818 -5.364 -14.302 1.00 44.11 H new ATOM 932 N GLU A 204 -10.343 -6.814 -12.096 1.00 33.41 N ATOM 933 CA GLU A 204 -10.408 -7.719 -10.938 1.00 42.42 C ATOM 934 C GLU A 204 -9.302 -7.409 -9.915 1.00 23.42 C ATOM 935 O GLU A 204 -8.314 -6.744 -10.228 1.00 32.24 O ATOM 936 CB GLU A 204 -10.310 -9.181 -11.401 1.00 50.44 C ATOM 937 CG GLU A 204 -9.003 -9.523 -12.105 1.00 25.53 C ATOM 938 CD GLU A 204 -8.992 -10.931 -12.682 1.00 71.15 C ATOM 939 OE1 GLU A 204 -8.802 -11.894 -11.912 1.00 50.34 O ATOM 940 OE2 GLU A 204 -9.173 -11.079 -13.908 1.00 73.14 O ATOM 0 H GLU A 204 -9.554 -6.986 -12.719 1.00 33.41 H new ATOM 0 HA GLU A 204 -11.368 -7.563 -10.446 1.00 42.42 H new ATOM 0 HB2 GLU A 204 -10.426 -9.834 -10.536 1.00 50.44 H new ATOM 0 HB3 GLU A 204 -11.140 -9.394 -12.075 1.00 50.44 H new ATOM 0 HG2 GLU A 204 -8.830 -8.806 -12.907 1.00 25.53 H new ATOM 0 HG3 GLU A 204 -8.178 -9.418 -11.400 1.00 25.53 H new ATOM 947 N LYS A 205 -9.480 -7.900 -8.690 1.00 52.22 N ATOM 948 CA LYS A 205 -8.528 -7.642 -7.600 1.00 24.42 C ATOM 949 C LYS A 205 -7.319 -8.597 -7.654 1.00 13.52 C ATOM 950 O LYS A 205 -7.446 -9.772 -8.009 1.00 2.13 O ATOM 951 CB LYS A 205 -9.243 -7.747 -6.239 1.00 13.25 C ATOM 952 CG LYS A 205 -10.312 -6.671 -6.031 1.00 51.02 C ATOM 953 CD LYS A 205 -11.010 -6.791 -4.673 1.00 35.01 C ATOM 954 CE LYS A 205 -11.942 -5.609 -4.413 1.00 15.31 C ATOM 955 NZ LYS A 205 -12.581 -5.680 -3.069 1.00 14.51 N ATOM 0 H LYS A 205 -10.275 -8.480 -8.422 1.00 52.22 H new ATOM 0 HA LYS A 205 -8.144 -6.630 -7.725 1.00 24.42 H new ATOM 0 HB2 LYS A 205 -9.706 -8.730 -6.155 1.00 13.25 H new ATOM 0 HB3 LYS A 205 -8.504 -7.673 -5.442 1.00 13.25 H new ATOM 0 HG2 LYS A 205 -9.852 -5.686 -6.114 1.00 51.02 H new ATOM 0 HG3 LYS A 205 -11.055 -6.744 -6.825 1.00 51.02 H new ATOM 0 HD2 LYS A 205 -11.580 -7.719 -4.637 1.00 35.01 H new ATOM 0 HD3 LYS A 205 -10.262 -6.846 -3.882 1.00 35.01 H new ATOM 0 HE2 LYS A 205 -11.379 -4.679 -4.497 1.00 15.31 H new ATOM 0 HE3 LYS A 205 -12.716 -5.583 -5.180 1.00 15.31 H new ATOM 0 HZ1 LYS A 205 -13.476 -5.150 -3.082 1.00 14.51 H new ATOM 0 HZ2 LYS A 205 -12.770 -6.674 -2.827 1.00 14.51 H new ATOM 0 HZ3 LYS A 205 -11.944 -5.266 -2.359 1.00 14.51 H new ATOM 969 N LYS A 206 -6.144 -8.069 -7.309 1.00 30.22 N ATOM 970 CA LYS A 206 -4.890 -8.841 -7.310 1.00 40.43 C ATOM 971 C LYS A 206 -4.017 -8.487 -6.092 1.00 52.50 C ATOM 972 O LYS A 206 -3.627 -7.329 -5.919 1.00 61.31 O ATOM 973 CB LYS A 206 -4.110 -8.579 -8.611 1.00 51.55 C ATOM 974 CG LYS A 206 -4.694 -9.292 -9.827 1.00 3.34 C ATOM 975 CD LYS A 206 -4.405 -10.792 -9.788 1.00 61.05 C ATOM 976 CE LYS A 206 -5.228 -11.557 -10.815 1.00 24.35 C ATOM 977 NZ LYS A 206 -6.666 -11.610 -10.439 1.00 64.03 N ATOM 0 H LYS A 206 -6.029 -7.097 -7.021 1.00 30.22 H new ATOM 0 HA LYS A 206 -5.144 -9.899 -7.249 1.00 40.43 H new ATOM 0 HB2 LYS A 206 -4.091 -7.506 -8.804 1.00 51.55 H new ATOM 0 HB3 LYS A 206 -3.076 -8.897 -8.475 1.00 51.55 H new ATOM 0 HG2 LYS A 206 -5.771 -9.129 -9.864 1.00 3.34 H new ATOM 0 HG3 LYS A 206 -4.275 -8.863 -10.738 1.00 3.34 H new ATOM 0 HD2 LYS A 206 -3.344 -10.962 -9.974 1.00 61.05 H new ATOM 0 HD3 LYS A 206 -4.620 -11.177 -8.791 1.00 61.05 H new ATOM 0 HE2 LYS A 206 -5.124 -11.083 -11.791 1.00 24.35 H new ATOM 0 HE3 LYS A 206 -4.839 -12.571 -10.911 1.00 24.35 H new ATOM 0 HZ1 LYS A 206 -7.239 -11.806 -11.285 1.00 64.03 H new ATOM 0 HZ2 LYS A 206 -6.814 -12.364 -9.738 1.00 64.03 H new ATOM 0 HZ3 LYS A 206 -6.952 -10.697 -10.031 1.00 64.03 H new ATOM 991 N PRO A 207 -3.694 -9.482 -5.234 1.00 33.23 N ATOM 992 CA PRO A 207 -2.898 -9.253 -4.007 1.00 52.04 C ATOM 993 C PRO A 207 -1.447 -8.812 -4.289 1.00 42.31 C ATOM 994 O PRO A 207 -0.813 -9.265 -5.247 1.00 1.01 O ATOM 995 CB PRO A 207 -2.926 -10.619 -3.303 1.00 63.02 C ATOM 996 CG PRO A 207 -3.189 -11.608 -4.391 1.00 34.11 C ATOM 997 CD PRO A 207 -4.073 -10.903 -5.387 1.00 52.33 C ATOM 0 HA PRO A 207 -3.312 -8.439 -3.412 1.00 52.04 H new ATOM 0 HB2 PRO A 207 -1.980 -10.825 -2.803 1.00 63.02 H new ATOM 0 HB3 PRO A 207 -3.704 -10.654 -2.541 1.00 63.02 H new ATOM 0 HG2 PRO A 207 -2.258 -11.933 -4.856 1.00 34.11 H new ATOM 0 HG3 PRO A 207 -3.677 -12.500 -3.998 1.00 34.11 H new ATOM 0 HD2 PRO A 207 -3.898 -11.259 -6.402 1.00 52.33 H new ATOM 0 HD3 PRO A 207 -5.129 -11.063 -5.171 1.00 52.33 H new ATOM 1005 N ILE A 208 -0.927 -7.932 -3.436 1.00 72.41 N ATOM 1006 CA ILE A 208 0.428 -7.390 -3.585 1.00 54.32 C ATOM 1007 C ILE A 208 1.310 -7.745 -2.377 1.00 73.32 C ATOM 1008 O ILE A 208 0.961 -7.448 -1.234 1.00 4.34 O ATOM 1009 CB ILE A 208 0.394 -5.845 -3.738 1.00 72.24 C ATOM 1010 CG1 ILE A 208 -0.488 -5.436 -4.932 1.00 2.25 C ATOM 1011 CG2 ILE A 208 1.812 -5.284 -3.900 1.00 1.03 C ATOM 1012 CD1 ILE A 208 -0.641 -3.939 -5.092 1.00 62.45 C ATOM 0 H ILE A 208 -1.429 -7.573 -2.623 1.00 72.41 H new ATOM 0 HA ILE A 208 0.851 -7.839 -4.483 1.00 54.32 H new ATOM 0 HB ILE A 208 -0.039 -5.424 -2.831 1.00 72.24 H new ATOM 0 HG12 ILE A 208 -0.060 -5.848 -5.846 1.00 2.25 H new ATOM 0 HG13 ILE A 208 -1.475 -5.882 -4.813 1.00 2.25 H new ATOM 0 HG21 ILE A 208 1.765 -4.200 -4.006 1.00 1.03 H new ATOM 0 HG22 ILE A 208 2.406 -5.537 -3.022 1.00 1.03 H new ATOM 0 HG23 ILE A 208 2.275 -5.715 -4.788 1.00 1.03 H new ATOM 0 HD11 ILE A 208 -1.275 -3.728 -5.953 1.00 62.45 H new ATOM 0 HD12 ILE A 208 -1.098 -3.522 -4.194 1.00 62.45 H new ATOM 0 HD13 ILE A 208 0.339 -3.487 -5.244 1.00 62.45 H new ATOM 1024 N GLY A 209 2.445 -8.385 -2.637 1.00 60.21 N ATOM 1025 CA GLY A 209 3.400 -8.681 -1.576 1.00 65.43 C ATOM 1026 C GLY A 209 4.098 -7.428 -1.051 1.00 42.14 C ATOM 1027 O GLY A 209 4.432 -6.533 -1.826 1.00 60.24 O ATOM 0 H GLY A 209 2.724 -8.706 -3.564 1.00 60.21 H new ATOM 0 HA2 GLY A 209 2.883 -9.176 -0.754 1.00 65.43 H new ATOM 0 HA3 GLY A 209 4.148 -9.380 -1.950 1.00 65.43 H new ATOM 1031 N TRP A 210 4.328 -7.358 0.260 1.00 0.41 N ATOM 1032 CA TRP A 210 5.024 -6.212 0.864 1.00 14.10 C ATOM 1033 C TRP A 210 6.490 -6.134 0.390 1.00 45.01 C ATOM 1034 O TRP A 210 7.148 -5.100 0.525 1.00 22.21 O ATOM 1035 CB TRP A 210 4.950 -6.293 2.394 1.00 15.22 C ATOM 1036 CG TRP A 210 3.556 -6.102 2.936 1.00 3.12 C ATOM 1037 CD1 TRP A 210 2.601 -7.063 3.129 1.00 54.23 C ATOM 1038 CD2 TRP A 210 2.961 -4.865 3.355 1.00 44.23 C ATOM 1039 NE1 TRP A 210 1.456 -6.494 3.635 1.00 63.51 N ATOM 1040 CE2 TRP A 210 1.656 -5.151 3.788 1.00 12.41 C ATOM 1041 CE3 TRP A 210 3.413 -3.545 3.408 1.00 20.25 C ATOM 1042 CZ2 TRP A 210 0.794 -4.165 4.264 1.00 75.42 C ATOM 1043 CZ3 TRP A 210 2.559 -2.567 3.882 1.00 63.53 C ATOM 1044 CH2 TRP A 210 1.264 -2.881 4.305 1.00 2.02 C ATOM 0 H TRP A 210 4.045 -8.077 0.926 1.00 0.41 H new ATOM 0 HA TRP A 210 4.524 -5.300 0.538 1.00 14.10 H new ATOM 0 HB2 TRP A 210 5.328 -7.263 2.718 1.00 15.22 H new ATOM 0 HB3 TRP A 210 5.606 -5.535 2.823 1.00 15.22 H new ATOM 0 HD1 TRP A 210 2.728 -8.114 2.915 1.00 54.23 H new ATOM 0 HE1 TRP A 210 0.596 -6.994 3.860 1.00 63.51 H new ATOM 0 HE3 TRP A 210 4.412 -3.293 3.084 1.00 20.25 H new ATOM 0 HZ2 TRP A 210 -0.208 -4.406 4.588 1.00 75.42 H new ATOM 0 HZ3 TRP A 210 2.898 -1.543 3.926 1.00 63.53 H new ATOM 0 HH2 TRP A 210 0.622 -2.094 4.672 1.00 2.02 H new ATOM 1055 N ASP A 211 6.977 -7.239 -0.180 1.00 31.43 N ATOM 1056 CA ASP A 211 8.315 -7.305 -0.787 1.00 4.42 C ATOM 1057 C ASP A 211 8.374 -6.542 -2.123 1.00 75.54 C ATOM 1058 O ASP A 211 9.457 -6.243 -2.639 1.00 1.31 O ATOM 1059 CB ASP A 211 8.693 -8.771 -1.020 1.00 44.43 C ATOM 1060 CG ASP A 211 7.637 -9.504 -1.835 1.00 50.24 C ATOM 1061 OD1 ASP A 211 6.655 -9.991 -1.233 1.00 3.03 O ATOM 1062 OD2 ASP A 211 7.768 -9.572 -3.076 1.00 24.22 O ATOM 0 H ASP A 211 6.457 -8.115 -0.235 1.00 31.43 H new ATOM 0 HA ASP A 211 9.020 -6.835 -0.102 1.00 4.42 H new ATOM 0 HB2 ASP A 211 9.651 -8.822 -1.537 1.00 44.43 H new ATOM 0 HB3 ASP A 211 8.822 -9.270 -0.060 1.00 44.43 H new ATOM 1067 N THR A 212 7.204 -6.249 -2.685 1.00 73.44 N ATOM 1068 CA THR A 212 7.101 -5.565 -3.978 1.00 3.43 C ATOM 1069 C THR A 212 7.556 -4.104 -3.879 1.00 23.02 C ATOM 1070 O THR A 212 7.221 -3.403 -2.924 1.00 52.23 O ATOM 1071 CB THR A 212 5.649 -5.592 -4.516 1.00 11.33 C ATOM 1072 OG1 THR A 212 5.128 -6.926 -4.456 1.00 13.31 O ATOM 1073 CG2 THR A 212 5.576 -5.096 -5.954 1.00 3.04 C ATOM 0 H THR A 212 6.304 -6.476 -2.263 1.00 73.44 H new ATOM 0 HA THR A 212 7.755 -6.103 -4.665 1.00 3.43 H new ATOM 0 HB THR A 212 5.054 -4.928 -3.889 1.00 11.33 H new ATOM 0 HG1 THR A 212 4.762 -7.094 -3.563 1.00 13.31 H new ATOM 0 HG21 THR A 212 4.542 -5.129 -6.298 1.00 3.04 H new ATOM 0 HG22 THR A 212 5.943 -4.071 -6.004 1.00 3.04 H new ATOM 0 HG23 THR A 212 6.191 -5.733 -6.590 1.00 3.04 H new ATOM 1081 N ASP A 213 8.322 -3.656 -4.864 1.00 5.12 N ATOM 1082 CA ASP A 213 8.765 -2.262 -4.922 1.00 13.44 C ATOM 1083 C ASP A 213 7.586 -1.323 -5.224 1.00 14.24 C ATOM 1084 O ASP A 213 6.847 -1.528 -6.191 1.00 53.44 O ATOM 1085 CB ASP A 213 9.852 -2.108 -5.989 1.00 40.01 C ATOM 1086 CG ASP A 213 11.027 -3.042 -5.754 1.00 24.12 C ATOM 1087 OD1 ASP A 213 10.913 -4.244 -6.078 1.00 62.01 O ATOM 1088 OD2 ASP A 213 12.069 -2.582 -5.244 1.00 52.13 O ATOM 0 H ASP A 213 8.652 -4.235 -5.636 1.00 5.12 H new ATOM 0 HA ASP A 213 9.174 -1.988 -3.950 1.00 13.44 H new ATOM 0 HB2 ASP A 213 9.424 -2.306 -6.972 1.00 40.01 H new ATOM 0 HB3 ASP A 213 10.206 -1.077 -5.998 1.00 40.01 H new ATOM 1093 N ILE A 214 7.417 -0.291 -4.400 1.00 52.34 N ATOM 1094 CA ILE A 214 6.320 0.672 -4.565 1.00 30.34 C ATOM 1095 C ILE A 214 6.378 1.366 -5.943 1.00 53.24 C ATOM 1096 O ILE A 214 5.375 1.883 -6.439 1.00 54.21 O ATOM 1097 CB ILE A 214 6.346 1.730 -3.428 1.00 21.15 C ATOM 1098 CG1 ILE A 214 5.112 2.648 -3.494 1.00 43.34 C ATOM 1099 CG2 ILE A 214 7.634 2.554 -3.480 1.00 30.32 C ATOM 1100 CD1 ILE A 214 3.791 1.923 -3.312 1.00 11.30 C ATOM 0 H ILE A 214 8.027 -0.096 -3.606 1.00 52.34 H new ATOM 0 HA ILE A 214 5.384 0.117 -4.509 1.00 30.34 H new ATOM 0 HB ILE A 214 6.318 1.197 -2.478 1.00 21.15 H new ATOM 0 HG12 ILE A 214 5.202 3.416 -2.726 1.00 43.34 H new ATOM 0 HG13 ILE A 214 5.104 3.160 -4.456 1.00 43.34 H new ATOM 0 HG21 ILE A 214 7.629 3.288 -2.674 1.00 30.32 H new ATOM 0 HG22 ILE A 214 8.493 1.894 -3.364 1.00 30.32 H new ATOM 0 HG23 ILE A 214 7.698 3.068 -4.439 1.00 30.32 H new ATOM 0 HD11 ILE A 214 2.972 2.639 -3.372 1.00 11.30 H new ATOM 0 HD12 ILE A 214 3.676 1.174 -4.096 1.00 11.30 H new ATOM 0 HD13 ILE A 214 3.775 1.434 -2.338 1.00 11.30 H new ATOM 1112 N SER A 215 7.559 1.346 -6.564 1.00 34.05 N ATOM 1113 CA SER A 215 7.764 1.915 -7.906 1.00 64.31 C ATOM 1114 C SER A 215 6.870 1.241 -8.963 1.00 52.10 C ATOM 1115 O SER A 215 6.529 1.845 -9.984 1.00 32.21 O ATOM 1116 CB SER A 215 9.235 1.769 -8.316 1.00 65.44 C ATOM 1117 OG SER A 215 9.639 0.408 -8.275 1.00 53.51 O ATOM 0 H SER A 215 8.400 0.938 -6.156 1.00 34.05 H new ATOM 0 HA SER A 215 7.490 2.969 -7.858 1.00 64.31 H new ATOM 0 HB2 SER A 215 9.378 2.165 -9.322 1.00 65.44 H new ATOM 0 HB3 SER A 215 9.863 2.359 -7.649 1.00 65.44 H new ATOM 0 HG SER A 215 10.579 0.338 -8.542 1.00 53.51 H new ATOM 1123 N TRP A 216 6.496 -0.014 -8.718 1.00 12.41 N ATOM 1124 CA TRP A 216 5.594 -0.750 -9.617 1.00 45.23 C ATOM 1125 C TRP A 216 4.163 -0.188 -9.577 1.00 14.03 C ATOM 1126 O TRP A 216 3.382 -0.382 -10.509 1.00 22.14 O ATOM 1127 CB TRP A 216 5.563 -2.239 -9.235 1.00 52.40 C ATOM 1128 CG TRP A 216 6.808 -2.995 -9.598 1.00 12.41 C ATOM 1129 CD1 TRP A 216 8.066 -2.802 -9.103 1.00 0.02 C ATOM 1130 CD2 TRP A 216 6.906 -4.082 -10.525 1.00 22.13 C ATOM 1131 NE1 TRP A 216 8.939 -3.692 -9.681 1.00 33.34 N ATOM 1132 CE2 TRP A 216 8.250 -4.493 -10.549 1.00 1.41 C ATOM 1133 CE3 TRP A 216 5.984 -4.749 -11.338 1.00 53.05 C ATOM 1134 CZ2 TRP A 216 8.696 -5.534 -11.354 1.00 44.04 C ATOM 1135 CZ3 TRP A 216 6.428 -5.785 -12.137 1.00 43.53 C ATOM 1136 CH2 TRP A 216 7.774 -6.170 -12.139 1.00 60.20 C ATOM 0 H TRP A 216 6.802 -0.547 -7.904 1.00 12.41 H new ATOM 0 HA TRP A 216 5.980 -0.633 -10.630 1.00 45.23 H new ATOM 0 HB2 TRP A 216 5.401 -2.323 -8.160 1.00 52.40 H new ATOM 0 HB3 TRP A 216 4.710 -2.710 -9.724 1.00 52.40 H new ATOM 0 HD1 TRP A 216 8.335 -2.060 -8.366 1.00 0.02 H new ATOM 0 HE1 TRP A 216 9.940 -3.746 -9.493 1.00 33.34 H new ATOM 0 HE3 TRP A 216 4.944 -4.459 -11.341 1.00 53.05 H new ATOM 0 HZ2 TRP A 216 9.734 -5.831 -11.360 1.00 44.04 H new ATOM 0 HZ3 TRP A 216 5.725 -6.306 -12.770 1.00 43.53 H new ATOM 0 HH2 TRP A 216 8.091 -6.985 -12.773 1.00 60.20 H new ATOM 1147 N LEU A 217 3.838 0.511 -8.493 1.00 70.44 N ATOM 1148 CA LEU A 217 2.474 0.996 -8.246 1.00 42.32 C ATOM 1149 C LEU A 217 2.392 2.528 -8.369 1.00 3.23 C ATOM 1150 O LEU A 217 1.462 3.160 -7.864 1.00 24.53 O ATOM 1151 CB LEU A 217 2.041 0.543 -6.844 1.00 32.32 C ATOM 1152 CG LEU A 217 2.195 -0.966 -6.581 1.00 14.42 C ATOM 1153 CD1 LEU A 217 1.900 -1.293 -5.119 1.00 61.35 C ATOM 1154 CD2 LEU A 217 1.290 -1.770 -7.518 1.00 5.02 C ATOM 0 H LEU A 217 4.505 0.759 -7.762 1.00 70.44 H new ATOM 0 HA LEU A 217 1.804 0.578 -8.997 1.00 42.32 H new ATOM 0 HB2 LEU A 217 2.626 1.089 -6.104 1.00 32.32 H new ATOM 0 HB3 LEU A 217 0.998 0.820 -6.693 1.00 32.32 H new ATOM 0 HG LEU A 217 3.228 -1.247 -6.785 1.00 14.42 H new ATOM 0 HD11 LEU A 217 2.015 -2.365 -4.956 1.00 61.35 H new ATOM 0 HD12 LEU A 217 2.595 -0.752 -4.478 1.00 61.35 H new ATOM 0 HD13 LEU A 217 0.879 -0.997 -4.879 1.00 61.35 H new ATOM 0 HD21 LEU A 217 1.412 -2.834 -7.317 1.00 5.02 H new ATOM 0 HD22 LEU A 217 0.251 -1.487 -7.352 1.00 5.02 H new ATOM 0 HD23 LEU A 217 1.562 -1.562 -8.553 1.00 5.02 H new ATOM 1166 N THR A 218 3.361 3.114 -9.070 1.00 12.14 N ATOM 1167 CA THR A 218 3.466 4.576 -9.208 1.00 62.40 C ATOM 1168 C THR A 218 2.217 5.208 -9.843 1.00 40.12 C ATOM 1169 O THR A 218 1.834 4.861 -10.961 1.00 63.11 O ATOM 1170 CB THR A 218 4.704 4.976 -10.056 1.00 50.12 C ATOM 1171 OG1 THR A 218 5.902 4.471 -9.450 1.00 3.52 O ATOM 1172 CG2 THR A 218 4.814 6.495 -10.205 1.00 61.40 C ATOM 0 H THR A 218 4.094 2.598 -9.557 1.00 12.14 H new ATOM 0 HA THR A 218 3.568 4.957 -8.192 1.00 62.40 H new ATOM 0 HB THR A 218 4.579 4.540 -11.047 1.00 50.12 H new ATOM 0 HG1 THR A 218 6.018 3.528 -9.691 1.00 3.52 H new ATOM 0 HG21 THR A 218 5.691 6.739 -10.804 1.00 61.40 H new ATOM 0 HG22 THR A 218 3.920 6.878 -10.698 1.00 61.40 H new ATOM 0 HG23 THR A 218 4.909 6.951 -9.220 1.00 61.40 H new ATOM 1180 N GLY A 219 1.586 6.130 -9.115 1.00 71.34 N ATOM 1181 CA GLY A 219 0.511 6.942 -9.684 1.00 61.11 C ATOM 1182 C GLY A 219 -0.870 6.285 -9.691 1.00 30.34 C ATOM 1183 O GLY A 219 -1.823 6.862 -10.214 1.00 71.24 O ATOM 0 H GLY A 219 1.799 6.332 -8.138 1.00 71.34 H new ATOM 0 HA2 GLY A 219 0.448 7.876 -9.125 1.00 61.11 H new ATOM 0 HA3 GLY A 219 0.777 7.201 -10.709 1.00 61.11 H new ATOM 1187 N GLU A 220 -0.997 5.093 -9.114 1.00 42.02 N ATOM 1188 CA GLU A 220 -2.293 4.399 -9.073 1.00 22.02 C ATOM 1189 C GLU A 220 -2.848 4.315 -7.642 1.00 34.51 C ATOM 1190 O GLU A 220 -2.181 4.693 -6.674 1.00 4.11 O ATOM 1191 CB GLU A 220 -2.186 2.995 -9.689 1.00 50.14 C ATOM 1192 CG GLU A 220 -1.353 2.012 -8.880 1.00 43.40 C ATOM 1193 CD GLU A 220 -1.188 0.681 -9.590 1.00 50.21 C ATOM 1194 OE1 GLU A 220 -0.248 0.550 -10.399 1.00 64.31 O ATOM 1195 OE2 GLU A 220 -2.016 -0.232 -9.370 1.00 53.54 O ATOM 0 H GLU A 220 -0.230 4.587 -8.671 1.00 42.02 H new ATOM 0 HA GLU A 220 -2.992 4.987 -9.668 1.00 22.02 H new ATOM 0 HB2 GLU A 220 -3.190 2.588 -9.810 1.00 50.14 H new ATOM 0 HB3 GLU A 220 -1.755 3.082 -10.686 1.00 50.14 H new ATOM 0 HG2 GLU A 220 -0.371 2.443 -8.687 1.00 43.40 H new ATOM 0 HG3 GLU A 220 -1.825 1.849 -7.911 1.00 43.40 H new ATOM 1202 N GLU A 221 -4.088 3.838 -7.521 1.00 32.01 N ATOM 1203 CA GLU A 221 -4.757 3.728 -6.220 1.00 64.41 C ATOM 1204 C GLU A 221 -4.765 2.277 -5.709 1.00 22.42 C ATOM 1205 O GLU A 221 -5.189 1.354 -6.410 1.00 24.01 O ATOM 1206 CB GLU A 221 -6.197 4.268 -6.299 1.00 13.33 C ATOM 1207 CG GLU A 221 -6.298 5.775 -6.566 1.00 2.32 C ATOM 1208 CD GLU A 221 -5.907 6.166 -7.982 1.00 43.22 C ATOM 1209 OE1 GLU A 221 -6.688 5.896 -8.917 1.00 12.50 O ATOM 1210 OE2 GLU A 221 -4.819 6.745 -8.168 1.00 51.21 O ATOM 0 H GLU A 221 -4.652 3.520 -8.309 1.00 32.01 H new ATOM 0 HA GLU A 221 -4.191 4.333 -5.512 1.00 64.41 H new ATOM 0 HB2 GLU A 221 -6.728 3.736 -7.088 1.00 13.33 H new ATOM 0 HB3 GLU A 221 -6.708 4.043 -5.363 1.00 13.33 H new ATOM 0 HG2 GLU A 221 -7.320 6.102 -6.376 1.00 2.32 H new ATOM 0 HG3 GLU A 221 -5.658 6.305 -5.861 1.00 2.32 H new ATOM 1217 N LEU A 222 -4.290 2.089 -4.481 1.00 22.44 N ATOM 1218 CA LEU A 222 -4.251 0.770 -3.841 1.00 23.45 C ATOM 1219 C LEU A 222 -5.369 0.627 -2.798 1.00 30.32 C ATOM 1220 O LEU A 222 -5.911 1.619 -2.313 1.00 40.54 O ATOM 1221 CB LEU A 222 -2.893 0.558 -3.159 1.00 3.33 C ATOM 1222 CG LEU A 222 -1.665 0.728 -4.068 1.00 22.30 C ATOM 1223 CD1 LEU A 222 -0.376 0.558 -3.267 1.00 13.32 C ATOM 1224 CD2 LEU A 222 -1.719 -0.252 -5.239 1.00 22.32 C ATOM 0 H LEU A 222 -3.921 2.842 -3.900 1.00 22.44 H new ATOM 0 HA LEU A 222 -4.398 0.017 -4.615 1.00 23.45 H new ATOM 0 HB2 LEU A 222 -2.809 1.259 -2.329 1.00 3.33 H new ATOM 0 HB3 LEU A 222 -2.872 -0.445 -2.733 1.00 3.33 H new ATOM 0 HG LEU A 222 -1.677 1.738 -4.477 1.00 22.30 H new ATOM 0 HD11 LEU A 222 0.482 0.682 -3.928 1.00 13.32 H new ATOM 0 HD12 LEU A 222 -0.337 1.308 -2.477 1.00 13.32 H new ATOM 0 HD13 LEU A 222 -0.352 -0.437 -2.824 1.00 13.32 H new ATOM 0 HD21 LEU A 222 -0.841 -0.114 -5.869 1.00 22.32 H new ATOM 0 HD22 LEU A 222 -1.736 -1.273 -4.858 1.00 22.32 H new ATOM 0 HD23 LEU A 222 -2.619 -0.068 -5.826 1.00 22.32 H new ATOM 1236 N HIS A 223 -5.713 -0.612 -2.454 1.00 31.40 N ATOM 1237 CA HIS A 223 -6.712 -0.876 -1.410 1.00 74.20 C ATOM 1238 C HIS A 223 -6.163 -1.869 -0.374 1.00 55.13 C ATOM 1239 O HIS A 223 -5.679 -2.945 -0.730 1.00 25.22 O ATOM 1240 CB HIS A 223 -8.007 -1.420 -2.028 1.00 63.10 C ATOM 1241 CG HIS A 223 -8.633 -0.498 -3.038 1.00 74.44 C ATOM 1242 ND1 HIS A 223 -9.553 0.475 -2.708 1.00 71.12 N ATOM 1243 CD2 HIS A 223 -8.469 -0.412 -4.381 1.00 1.23 C ATOM 1244 CE1 HIS A 223 -9.927 1.114 -3.798 1.00 31.23 C ATOM 1245 NE2 HIS A 223 -9.282 0.600 -4.826 1.00 14.10 N ATOM 0 H HIS A 223 -5.318 -1.451 -2.880 1.00 31.40 H new ATOM 0 HA HIS A 223 -6.934 0.065 -0.907 1.00 74.20 H new ATOM 0 HB2 HIS A 223 -7.796 -2.377 -2.505 1.00 63.10 H new ATOM 0 HB3 HIS A 223 -8.726 -1.612 -1.231 1.00 63.10 H new ATOM 0 HD2 HIS A 223 -7.820 -1.026 -4.988 1.00 1.23 H new ATOM 0 HE1 HIS A 223 -10.642 1.923 -3.842 1.00 31.23 H new ATOM 0 HE2 HIS A 223 -9.372 0.905 -5.795 1.00 14.10 H new ATOM 1254 N VAL A 224 -6.226 -1.494 0.903 1.00 4.42 N ATOM 1255 CA VAL A 224 -5.706 -2.337 1.990 1.00 44.01 C ATOM 1256 C VAL A 224 -6.814 -2.765 2.971 1.00 31.21 C ATOM 1257 O VAL A 224 -7.771 -2.026 3.219 1.00 23.20 O ATOM 1258 CB VAL A 224 -4.593 -1.596 2.781 1.00 13.51 C ATOM 1259 CG1 VAL A 224 -3.986 -2.492 3.866 1.00 11.23 C ATOM 1260 CG2 VAL A 224 -3.511 -1.082 1.836 1.00 72.21 C ATOM 0 H VAL A 224 -6.632 -0.612 1.215 1.00 4.42 H new ATOM 0 HA VAL A 224 -5.294 -3.230 1.520 1.00 44.01 H new ATOM 0 HB VAL A 224 -5.052 -0.741 3.277 1.00 13.51 H new ATOM 0 HG11 VAL A 224 -3.211 -1.942 4.400 1.00 11.23 H new ATOM 0 HG12 VAL A 224 -4.765 -2.794 4.566 1.00 11.23 H new ATOM 0 HG13 VAL A 224 -3.550 -3.378 3.404 1.00 11.23 H new ATOM 0 HG21 VAL A 224 -2.741 -0.566 2.410 1.00 72.21 H new ATOM 0 HG22 VAL A 224 -3.065 -1.922 1.303 1.00 72.21 H new ATOM 0 HG23 VAL A 224 -3.953 -0.390 1.119 1.00 72.21 H new ATOM 1270 N GLU A 225 -6.678 -3.969 3.525 1.00 71.32 N ATOM 1271 CA GLU A 225 -7.589 -4.460 4.568 1.00 45.40 C ATOM 1272 C GLU A 225 -6.822 -5.267 5.631 1.00 11.31 C ATOM 1273 O GLU A 225 -5.900 -6.015 5.310 1.00 72.11 O ATOM 1274 CB GLU A 225 -8.715 -5.306 3.950 1.00 31.35 C ATOM 1275 CG GLU A 225 -8.237 -6.509 3.141 1.00 54.50 C ATOM 1276 CD GLU A 225 -9.384 -7.247 2.465 1.00 61.11 C ATOM 1277 OE1 GLU A 225 -10.080 -8.029 3.144 1.00 63.21 O ATOM 1278 OE2 GLU A 225 -9.610 -7.034 1.253 1.00 63.14 O ATOM 0 H GLU A 225 -5.943 -4.628 3.270 1.00 71.32 H new ATOM 0 HA GLU A 225 -8.039 -3.597 5.059 1.00 45.40 H new ATOM 0 HB2 GLU A 225 -9.367 -5.658 4.749 1.00 31.35 H new ATOM 0 HB3 GLU A 225 -9.318 -4.668 3.305 1.00 31.35 H new ATOM 0 HG2 GLU A 225 -7.527 -6.175 2.384 1.00 54.50 H new ATOM 0 HG3 GLU A 225 -7.703 -7.196 3.798 1.00 54.50 H new ATOM 1285 N VAL A 226 -7.198 -5.100 6.899 1.00 1.14 N ATOM 1286 CA VAL A 226 -6.501 -5.768 8.009 1.00 41.23 C ATOM 1287 C VAL A 226 -6.997 -7.211 8.212 1.00 50.11 C ATOM 1288 O VAL A 226 -8.201 -7.468 8.262 1.00 64.20 O ATOM 1289 CB VAL A 226 -6.667 -4.984 9.337 1.00 22.14 C ATOM 1290 CG1 VAL A 226 -5.939 -5.684 10.481 1.00 41.32 C ATOM 1291 CG2 VAL A 226 -6.168 -3.547 9.189 1.00 51.22 C ATOM 0 H VAL A 226 -7.979 -4.510 7.187 1.00 1.14 H new ATOM 0 HA VAL A 226 -5.446 -5.794 7.736 1.00 41.23 H new ATOM 0 HB VAL A 226 -7.730 -4.956 9.574 1.00 22.14 H new ATOM 0 HG11 VAL A 226 -6.072 -5.113 11.400 1.00 41.32 H new ATOM 0 HG12 VAL A 226 -6.348 -6.686 10.614 1.00 41.32 H new ATOM 0 HG13 VAL A 226 -4.877 -5.754 10.248 1.00 41.32 H new ATOM 0 HG21 VAL A 226 -6.295 -3.019 10.134 1.00 51.22 H new ATOM 0 HG22 VAL A 226 -5.113 -3.555 8.917 1.00 51.22 H new ATOM 0 HG23 VAL A 226 -6.740 -3.042 8.411 1.00 51.22 H new ATOM 1301 N LEU A 227 -6.057 -8.146 8.342 1.00 10.23 N ATOM 1302 CA LEU A 227 -6.383 -9.565 8.515 1.00 3.41 C ATOM 1303 C LEU A 227 -6.819 -9.870 9.957 1.00 24.12 C ATOM 1304 O LEU A 227 -7.883 -10.447 10.186 1.00 24.12 O ATOM 1305 CB LEU A 227 -5.170 -10.428 8.135 1.00 70.31 C ATOM 1306 CG LEU A 227 -4.596 -10.170 6.731 1.00 34.42 C ATOM 1307 CD1 LEU A 227 -3.439 -11.124 6.437 1.00 22.44 C ATOM 1308 CD2 LEU A 227 -5.687 -10.291 5.668 1.00 3.24 C ATOM 0 H LEU A 227 -5.057 -7.947 8.331 1.00 10.23 H new ATOM 0 HA LEU A 227 -7.219 -9.803 7.857 1.00 3.41 H new ATOM 0 HB2 LEU A 227 -4.381 -10.261 8.869 1.00 70.31 H new ATOM 0 HB3 LEU A 227 -5.455 -11.478 8.206 1.00 70.31 H new ATOM 0 HG LEU A 227 -4.210 -9.151 6.702 1.00 34.42 H new ATOM 0 HD11 LEU A 227 -3.048 -10.925 5.439 1.00 22.44 H new ATOM 0 HD12 LEU A 227 -2.649 -10.975 7.173 1.00 22.44 H new ATOM 0 HD13 LEU A 227 -3.794 -12.153 6.488 1.00 22.44 H new ATOM 0 HD21 LEU A 227 -5.258 -10.105 4.683 1.00 3.24 H new ATOM 0 HD22 LEU A 227 -6.111 -11.295 5.695 1.00 3.24 H new ATOM 0 HD23 LEU A 227 -6.471 -9.560 5.866 1.00 3.24 H new