USER MOD reduce.3.24.130724 H: found=0, std=0, add=591, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 593 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 175 TYR OH : rot -14:sc= 0.484 USER MOD Single : A 176 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 191 GLN : amide:sc=-0.000267 X(o=-0.00027,f=-0.00027) USER MOD Single : A 194 TYR OH : rot 150:sc= 0.812 USER MOD Single : A 196 THR OG1 : rot 180:sc= 0.022 USER MOD Single : A 209 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00663) USER MOD Single : A 213 MET CE :methyl 165:sc= -0.0815 (180deg=-0.701) USER MOD Single : A 214 THR OG1 : rot -27:sc= 1.2 USER MOD Single : A 227 THR OG1 : rot 108:sc= 0.534 USER MOD Single : A 228 GLN : amide:sc= -0.837 K(o=-0.84,f=-3.6!) USER MOD Single : A 232 LYS NZ :NH3+ -171:sc= -0.0041 (180deg=-0.104) USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 238 LYS NZ :NH3+ 164:sc= 1.09 (180deg=0.934) USER MOD Single : A 250 TYR OH : rot 180:sc= -0.761 USER MOD Single : A 256 THR OG1 : rot -37:sc= 0.337 USER MOD ----------------------------------------------------------------- ATOM 32 N ASP A 169 -7.023 13.226 0.577 1.00 62.12 N ATOM 33 CA ASP A 169 -5.566 13.281 0.333 1.00 50.53 C ATOM 34 C ASP A 169 -5.127 12.156 -0.620 1.00 12.21 C ATOM 35 O ASP A 169 -4.604 12.421 -1.709 1.00 23.32 O ATOM 36 CB ASP A 169 -4.794 13.201 1.672 1.00 52.32 C ATOM 37 CG ASP A 169 -3.255 13.253 1.502 1.00 3.43 C ATOM 38 OD1 ASP A 169 -2.717 14.332 1.198 1.00 0.20 O ATOM 39 OD2 ASP A 169 -2.575 12.223 1.708 1.00 43.21 O ATOM 0 HA ASP A 169 -5.332 14.233 -0.144 1.00 50.53 H new ATOM 0 HB2 ASP A 169 -5.109 14.024 2.313 1.00 52.32 H new ATOM 0 HB3 ASP A 169 -5.064 12.277 2.183 1.00 52.32 H new ATOM 44 N VAL A 170 -5.368 10.900 -0.203 1.00 43.21 N ATOM 45 CA VAL A 170 -5.055 9.702 -1.009 1.00 42.11 C ATOM 46 C VAL A 170 -6.348 9.039 -1.524 1.00 31.35 C ATOM 47 O VAL A 170 -7.460 9.396 -1.106 1.00 44.42 O ATOM 48 CB VAL A 170 -4.207 8.640 -0.194 1.00 73.44 C ATOM 49 CG1 VAL A 170 -2.870 9.233 0.292 1.00 35.05 C ATOM 50 CG2 VAL A 170 -4.999 8.034 0.987 1.00 61.22 C ATOM 0 H VAL A 170 -5.785 10.685 0.702 1.00 43.21 H new ATOM 0 HA VAL A 170 -4.455 10.039 -1.854 1.00 42.11 H new ATOM 0 HB VAL A 170 -3.986 7.828 -0.886 1.00 73.44 H new ATOM 0 HG11 VAL A 170 -2.316 8.476 0.847 1.00 35.05 H new ATOM 0 HG12 VAL A 170 -2.282 9.556 -0.567 1.00 35.05 H new ATOM 0 HG13 VAL A 170 -3.065 10.087 0.940 1.00 35.05 H new ATOM 0 HG21 VAL A 170 -4.373 7.313 1.513 1.00 61.22 H new ATOM 0 HG22 VAL A 170 -5.293 8.828 1.674 1.00 61.22 H new ATOM 0 HG23 VAL A 170 -5.890 7.533 0.609 1.00 61.22 H new ATOM 60 N ILE A 171 -6.181 8.087 -2.458 1.00 1.02 N ATOM 61 CA ILE A 171 -7.252 7.165 -2.872 1.00 45.40 C ATOM 62 C ILE A 171 -7.206 5.915 -1.956 1.00 41.50 C ATOM 63 O ILE A 171 -6.136 5.561 -1.429 1.00 14.34 O ATOM 64 CB ILE A 171 -7.116 6.764 -4.404 1.00 21.32 C ATOM 65 CG1 ILE A 171 -8.267 5.800 -4.856 1.00 53.15 C ATOM 66 CG2 ILE A 171 -5.724 6.171 -4.713 1.00 30.44 C ATOM 67 CD1 ILE A 171 -8.205 5.375 -6.314 1.00 10.33 C ATOM 0 H ILE A 171 -5.299 7.935 -2.947 1.00 1.02 H new ATOM 0 HA ILE A 171 -8.217 7.660 -2.767 1.00 45.40 H new ATOM 0 HB ILE A 171 -7.216 7.679 -4.987 1.00 21.32 H new ATOM 0 HG12 ILE A 171 -8.242 4.908 -4.230 1.00 53.15 H new ATOM 0 HG13 ILE A 171 -9.224 6.289 -4.675 1.00 53.15 H new ATOM 0 HG21 ILE A 171 -5.667 5.908 -5.769 1.00 30.44 H new ATOM 0 HG22 ILE A 171 -4.955 6.907 -4.480 1.00 30.44 H new ATOM 0 HG23 ILE A 171 -5.566 5.278 -4.108 1.00 30.44 H new ATOM 0 HD11 ILE A 171 -9.040 4.710 -6.535 1.00 10.33 H new ATOM 0 HD12 ILE A 171 -8.264 6.256 -6.953 1.00 10.33 H new ATOM 0 HD13 ILE A 171 -7.266 4.853 -6.501 1.00 10.33 H new ATOM 79 N ASP A 172 -8.389 5.295 -1.746 1.00 52.34 N ATOM 80 CA ASP A 172 -8.567 4.075 -0.935 1.00 13.12 C ATOM 81 C ASP A 172 -7.703 2.894 -1.466 1.00 40.21 C ATOM 82 O ASP A 172 -7.531 2.730 -2.680 1.00 35.55 O ATOM 83 CB ASP A 172 -10.082 3.696 -0.908 1.00 30.41 C ATOM 84 CG ASP A 172 -10.374 2.332 -0.242 1.00 65.43 C ATOM 85 OD1 ASP A 172 -10.119 2.184 0.974 1.00 14.12 O ATOM 86 OD2 ASP A 172 -10.862 1.404 -0.933 1.00 72.01 O ATOM 0 H ASP A 172 -9.263 5.638 -2.145 1.00 52.34 H new ATOM 0 HA ASP A 172 -8.225 4.278 0.080 1.00 13.12 H new ATOM 0 HB2 ASP A 172 -10.632 4.474 -0.377 1.00 30.41 H new ATOM 0 HB3 ASP A 172 -10.461 3.679 -1.930 1.00 30.41 H new ATOM 91 N ALA A 173 -7.166 2.107 -0.520 1.00 51.01 N ATOM 92 CA ALA A 173 -6.373 0.889 -0.773 1.00 62.42 C ATOM 93 C ALA A 173 -6.279 0.090 0.538 1.00 2.30 C ATOM 94 O ALA A 173 -6.267 0.692 1.621 1.00 61.25 O ATOM 95 CB ALA A 173 -4.954 1.231 -1.286 1.00 13.12 C ATOM 0 H ALA A 173 -7.274 2.306 0.475 1.00 51.01 H new ATOM 0 HA ALA A 173 -6.866 0.300 -1.547 1.00 62.42 H new ATOM 0 HB1 ALA A 173 -4.399 0.310 -1.462 1.00 13.12 H new ATOM 0 HB2 ALA A 173 -5.029 1.792 -2.217 1.00 13.12 H new ATOM 0 HB3 ALA A 173 -4.433 1.832 -0.541 1.00 13.12 H new ATOM 101 N ASP A 174 -6.187 -1.247 0.448 1.00 62.24 N ATOM 102 CA ASP A 174 -5.984 -2.136 1.628 1.00 3.13 C ATOM 103 C ASP A 174 -5.128 -3.352 1.225 1.00 65.24 C ATOM 104 O ASP A 174 -5.100 -3.726 0.055 1.00 73.34 O ATOM 105 CB ASP A 174 -7.344 -2.590 2.239 1.00 4.23 C ATOM 106 CG ASP A 174 -7.179 -3.389 3.551 1.00 1.34 C ATOM 107 OD1 ASP A 174 -6.599 -2.832 4.509 1.00 10.24 O ATOM 108 OD2 ASP A 174 -7.617 -4.563 3.634 1.00 1.15 O ATOM 0 H ASP A 174 -6.250 -1.751 -0.437 1.00 62.24 H new ATOM 0 HA ASP A 174 -5.456 -1.572 2.397 1.00 3.13 H new ATOM 0 HB2 ASP A 174 -7.962 -1.712 2.430 1.00 4.23 H new ATOM 0 HB3 ASP A 174 -7.877 -3.202 1.511 1.00 4.23 H new ATOM 113 N TYR A 175 -4.424 -3.958 2.203 1.00 23.50 N ATOM 114 CA TYR A 175 -3.525 -5.108 1.962 1.00 2.53 C ATOM 115 C TYR A 175 -3.997 -6.344 2.728 1.00 63.33 C ATOM 116 O TYR A 175 -4.954 -6.288 3.511 1.00 73.32 O ATOM 117 CB TYR A 175 -2.070 -4.756 2.384 1.00 73.45 C ATOM 118 CG TYR A 175 -1.846 -4.580 3.899 1.00 52.32 C ATOM 119 CD1 TYR A 175 -2.087 -3.365 4.520 1.00 43.00 C ATOM 120 CD2 TYR A 175 -1.388 -5.637 4.703 1.00 55.42 C ATOM 121 CE1 TYR A 175 -1.871 -3.205 5.866 1.00 50.02 C ATOM 122 CE2 TYR A 175 -1.178 -5.475 6.055 1.00 33.22 C ATOM 123 CZ TYR A 175 -1.422 -4.260 6.632 1.00 72.44 C ATOM 124 OH TYR A 175 -1.215 -4.088 7.983 1.00 11.30 O ATOM 0 H TYR A 175 -4.462 -3.666 3.180 1.00 23.50 H new ATOM 0 HA TYR A 175 -3.547 -5.331 0.895 1.00 2.53 H new ATOM 0 HB2 TYR A 175 -1.405 -5.541 2.024 1.00 73.45 H new ATOM 0 HB3 TYR A 175 -1.776 -3.835 1.881 1.00 73.45 H new ATOM 0 HD1 TYR A 175 -2.450 -2.532 3.937 1.00 43.00 H new ATOM 0 HD2 TYR A 175 -1.196 -6.599 4.251 1.00 55.42 H new ATOM 0 HE1 TYR A 175 -2.054 -2.246 6.328 1.00 50.02 H new ATOM 0 HE2 TYR A 175 -0.824 -6.301 6.654 1.00 33.22 H new ATOM 0 HH TYR A 175 -1.211 -3.131 8.194 1.00 11.30 H new ATOM 134 N LYS A 176 -3.260 -7.442 2.512 1.00 61.32 N ATOM 135 CA LYS A 176 -3.350 -8.685 3.296 1.00 22.04 C ATOM 136 C LYS A 176 -1.945 -9.304 3.396 1.00 44.12 C ATOM 137 O LYS A 176 -1.165 -9.179 2.454 1.00 44.12 O ATOM 138 CB LYS A 176 -4.346 -9.720 2.685 1.00 32.11 C ATOM 139 CG LYS A 176 -5.842 -9.400 2.923 1.00 73.13 C ATOM 140 CD LYS A 176 -6.746 -10.635 2.730 1.00 41.55 C ATOM 141 CE LYS A 176 -8.211 -10.371 3.111 1.00 61.02 C ATOM 142 NZ LYS A 176 -9.042 -11.602 3.016 1.00 22.33 N ATOM 0 H LYS A 176 -2.565 -7.493 1.767 1.00 61.32 H new ATOM 0 HA LYS A 176 -3.736 -8.431 4.283 1.00 22.04 H new ATOM 0 HB2 LYS A 176 -4.169 -9.783 1.611 1.00 32.11 H new ATOM 0 HB3 LYS A 176 -4.128 -10.703 3.103 1.00 32.11 H new ATOM 0 HG2 LYS A 176 -5.971 -9.013 3.934 1.00 73.13 H new ATOM 0 HG3 LYS A 176 -6.156 -8.613 2.237 1.00 73.13 H new ATOM 0 HD2 LYS A 176 -6.699 -10.954 1.689 1.00 41.55 H new ATOM 0 HD3 LYS A 176 -6.362 -11.458 3.333 1.00 41.55 H new ATOM 0 HE2 LYS A 176 -8.257 -9.980 4.128 1.00 61.02 H new ATOM 0 HE3 LYS A 176 -8.623 -9.604 2.456 1.00 61.02 H new ATOM 0 HZ1 LYS A 176 -10.023 -11.380 3.281 1.00 22.33 H new ATOM 0 HZ2 LYS A 176 -9.020 -11.961 2.040 1.00 22.33 H new ATOM 0 HZ3 LYS A 176 -8.665 -12.326 3.660 1.00 22.33 H new ATOM 156 N PRO A 177 -1.594 -9.974 4.546 1.00 75.10 N ATOM 157 CA PRO A 177 -0.308 -10.708 4.689 1.00 53.40 C ATOM 158 C PRO A 177 -0.168 -11.825 3.622 1.00 64.45 C ATOM 159 O PRO A 177 -1.078 -12.648 3.459 1.00 73.12 O ATOM 160 CB PRO A 177 -0.368 -11.277 6.139 1.00 40.21 C ATOM 161 CG PRO A 177 -1.818 -11.251 6.517 1.00 0.44 C ATOM 162 CD PRO A 177 -2.406 -10.058 5.798 1.00 33.23 C ATOM 0 HA PRO A 177 0.564 -10.073 4.532 1.00 53.40 H new ATOM 0 HB2 PRO A 177 0.031 -12.291 6.180 1.00 40.21 H new ATOM 0 HB3 PRO A 177 0.227 -10.672 6.823 1.00 40.21 H new ATOM 0 HG2 PRO A 177 -2.317 -12.173 6.219 1.00 0.44 H new ATOM 0 HG3 PRO A 177 -1.940 -11.157 7.596 1.00 0.44 H new ATOM 0 HD2 PRO A 177 -3.465 -10.201 5.582 1.00 33.23 H new ATOM 0 HD3 PRO A 177 -2.322 -9.149 6.393 1.00 33.23 H new ATOM 170 N ALA A 178 0.969 -11.811 2.892 1.00 44.14 N ATOM 171 CA ALA A 178 1.274 -12.776 1.809 1.00 74.44 C ATOM 172 C ALA A 178 1.333 -14.222 2.341 1.00 42.10 C ATOM 173 O ALA A 178 0.975 -15.174 1.641 1.00 72.33 O ATOM 174 CB ALA A 178 2.596 -12.391 1.130 1.00 64.00 C ATOM 0 H ALA A 178 1.708 -11.124 3.038 1.00 44.14 H new ATOM 0 HA ALA A 178 0.470 -12.734 1.075 1.00 74.44 H new ATOM 0 HB1 ALA A 178 2.817 -13.103 0.334 1.00 64.00 H new ATOM 0 HB2 ALA A 178 2.510 -11.390 0.708 1.00 64.00 H new ATOM 0 HB3 ALA A 178 3.401 -12.407 1.865 1.00 64.00 H new ATOM 285 N GLN A 191 3.797 4.688 14.930 1.00 23.35 N ATOM 286 CA GLN A 191 2.846 3.678 14.448 1.00 45.15 C ATOM 287 C GLN A 191 2.744 3.727 12.915 1.00 31.35 C ATOM 288 O GLN A 191 2.329 2.750 12.274 1.00 64.20 O ATOM 289 CB GLN A 191 1.456 3.917 15.096 1.00 54.10 C ATOM 290 CG GLN A 191 1.448 3.903 16.633 1.00 13.33 C ATOM 291 CD GLN A 191 1.864 2.563 17.240 1.00 63.44 C ATOM 292 OE1 GLN A 191 1.024 1.692 17.485 1.00 70.14 O ATOM 293 NE2 GLN A 191 3.160 2.385 17.488 1.00 74.53 N ATOM 0 HA GLN A 191 3.202 2.688 14.733 1.00 45.15 H new ATOM 0 HB2 GLN A 191 1.072 4.878 14.754 1.00 54.10 H new ATOM 0 HB3 GLN A 191 0.767 3.152 14.737 1.00 54.10 H new ATOM 0 HG2 GLN A 191 2.119 4.680 16.998 1.00 13.33 H new ATOM 0 HG3 GLN A 191 0.447 4.155 16.984 1.00 13.33 H new ATOM 0 HE21 GLN A 191 3.827 3.126 17.273 1.00 74.53 H new ATOM 0 HE22 GLN A 191 3.486 1.507 17.893 1.00 74.53 H new ATOM 302 N ASP A 192 3.135 4.879 12.343 1.00 65.22 N ATOM 303 CA ASP A 192 3.037 5.150 10.909 1.00 44.11 C ATOM 304 C ASP A 192 4.342 4.725 10.213 1.00 13.32 C ATOM 305 O ASP A 192 5.431 5.131 10.620 1.00 55.02 O ATOM 306 CB ASP A 192 2.734 6.655 10.665 1.00 45.43 C ATOM 307 CG ASP A 192 1.531 7.155 11.493 1.00 12.20 C ATOM 308 OD1 ASP A 192 1.706 8.043 12.364 1.00 55.32 O ATOM 309 OD2 ASP A 192 0.410 6.635 11.302 1.00 15.30 O ATOM 0 H ASP A 192 3.532 5.654 12.875 1.00 65.22 H new ATOM 0 HA ASP A 192 2.216 4.572 10.486 1.00 44.11 H new ATOM 0 HB2 ASP A 192 3.615 7.246 10.916 1.00 45.43 H new ATOM 0 HB3 ASP A 192 2.534 6.815 9.606 1.00 45.43 H new ATOM 314 N LEU A 193 4.212 3.905 9.161 1.00 62.44 N ATOM 315 CA LEU A 193 5.338 3.431 8.332 1.00 41.44 C ATOM 316 C LEU A 193 5.257 4.097 6.953 1.00 13.14 C ATOM 317 O LEU A 193 4.165 4.395 6.474 1.00 41.31 O ATOM 318 CB LEU A 193 5.280 1.878 8.184 1.00 64.21 C ATOM 319 CG LEU A 193 5.661 1.051 9.447 1.00 30.40 C ATOM 320 CD1 LEU A 193 5.398 -0.459 9.237 1.00 42.42 C ATOM 321 CD2 LEU A 193 7.132 1.311 9.831 1.00 40.00 C ATOM 0 H LEU A 193 3.309 3.544 8.854 1.00 62.44 H new ATOM 0 HA LEU A 193 6.281 3.696 8.810 1.00 41.44 H new ATOM 0 HB2 LEU A 193 4.269 1.600 7.885 1.00 64.21 H new ATOM 0 HB3 LEU A 193 5.945 1.587 7.371 1.00 64.21 H new ATOM 0 HG LEU A 193 5.025 1.377 10.270 1.00 30.40 H new ATOM 0 HD11 LEU A 193 5.675 -1.005 10.138 1.00 42.42 H new ATOM 0 HD12 LEU A 193 4.340 -0.618 9.027 1.00 42.42 H new ATOM 0 HD13 LEU A 193 5.993 -0.819 8.397 1.00 42.42 H new ATOM 0 HD21 LEU A 193 7.386 0.727 10.716 1.00 40.00 H new ATOM 0 HD22 LEU A 193 7.781 1.019 9.005 1.00 40.00 H new ATOM 0 HD23 LEU A 193 7.271 2.371 10.044 1.00 40.00 H new ATOM 333 N TYR A 194 6.420 4.363 6.343 1.00 23.43 N ATOM 334 CA TYR A 194 6.529 4.952 4.992 1.00 41.52 C ATOM 335 C TYR A 194 7.460 4.064 4.155 1.00 72.31 C ATOM 336 O TYR A 194 8.603 3.824 4.559 1.00 4.20 O ATOM 337 CB TYR A 194 7.072 6.417 5.064 1.00 74.31 C ATOM 338 CG TYR A 194 6.078 7.446 5.654 1.00 72.11 C ATOM 339 CD1 TYR A 194 5.765 7.460 7.019 1.00 31.14 C ATOM 340 CD2 TYR A 194 5.447 8.401 4.846 1.00 71.53 C ATOM 341 CE1 TYR A 194 4.867 8.370 7.545 1.00 23.51 C ATOM 342 CE2 TYR A 194 4.551 9.316 5.379 1.00 61.10 C ATOM 343 CZ TYR A 194 4.265 9.293 6.725 1.00 53.12 C ATOM 344 OH TYR A 194 3.366 10.194 7.251 1.00 33.31 O ATOM 0 H TYR A 194 7.325 4.175 6.775 1.00 23.43 H new ATOM 0 HA TYR A 194 5.544 4.997 4.528 1.00 41.52 H new ATOM 0 HB2 TYR A 194 7.981 6.424 5.665 1.00 74.31 H new ATOM 0 HB3 TYR A 194 7.351 6.736 4.060 1.00 74.31 H new ATOM 0 HD1 TYR A 194 6.236 6.744 7.676 1.00 31.14 H new ATOM 0 HD2 TYR A 194 5.662 8.425 3.788 1.00 71.53 H new ATOM 0 HE1 TYR A 194 4.639 8.355 8.601 1.00 23.51 H new ATOM 0 HE2 TYR A 194 4.078 10.046 4.738 1.00 61.10 H new ATOM 0 HH TYR A 194 3.389 11.022 6.728 1.00 33.31 H new ATOM 354 N ALA A 195 6.956 3.573 3.008 1.00 4.02 N ATOM 355 CA ALA A 195 7.700 2.673 2.103 1.00 31.22 C ATOM 356 C ALA A 195 7.202 2.839 0.655 1.00 14.22 C ATOM 357 O ALA A 195 6.122 3.390 0.423 1.00 3.22 O ATOM 358 CB ALA A 195 7.555 1.207 2.565 1.00 43.14 C ATOM 0 H ALA A 195 6.015 3.790 2.680 1.00 4.02 H new ATOM 0 HA ALA A 195 8.756 2.940 2.135 1.00 31.22 H new ATOM 0 HB1 ALA A 195 8.109 0.556 1.888 1.00 43.14 H new ATOM 0 HB2 ALA A 195 7.952 1.103 3.575 1.00 43.14 H new ATOM 0 HB3 ALA A 195 6.502 0.926 2.558 1.00 43.14 H new ATOM 364 N THR A 196 8.017 2.379 -0.309 1.00 25.13 N ATOM 365 CA THR A 196 7.661 2.344 -1.739 1.00 5.22 C ATOM 366 C THR A 196 6.878 1.056 -2.075 1.00 2.44 C ATOM 367 O THR A 196 7.087 0.008 -1.446 1.00 33.15 O ATOM 368 CB THR A 196 8.951 2.442 -2.626 1.00 71.44 C ATOM 369 OG1 THR A 196 9.959 1.555 -2.112 1.00 44.22 O ATOM 370 CG2 THR A 196 9.503 3.883 -2.689 1.00 41.20 C ATOM 0 H THR A 196 8.951 2.017 -0.116 1.00 25.13 H new ATOM 0 HA THR A 196 7.023 3.201 -1.953 1.00 5.22 H new ATOM 0 HB THR A 196 8.679 2.150 -3.641 1.00 71.44 H new ATOM 0 HG1 THR A 196 10.763 1.616 -2.668 1.00 44.22 H new ATOM 0 HG21 THR A 196 10.396 3.904 -3.314 1.00 41.20 H new ATOM 0 HG22 THR A 196 8.747 4.544 -3.114 1.00 41.20 H new ATOM 0 HG23 THR A 196 9.756 4.220 -1.684 1.00 41.20 H new ATOM 378 N LEU A 197 5.983 1.153 -3.076 1.00 12.24 N ATOM 379 CA LEU A 197 5.157 0.029 -3.553 1.00 64.04 C ATOM 380 C LEU A 197 5.548 -0.300 -5.004 1.00 43.14 C ATOM 381 O LEU A 197 5.352 0.527 -5.899 1.00 43.52 O ATOM 382 CB LEU A 197 3.646 0.387 -3.467 1.00 61.42 C ATOM 383 CG LEU A 197 2.655 -0.773 -3.810 1.00 70.14 C ATOM 384 CD1 LEU A 197 2.822 -1.945 -2.822 1.00 54.45 C ATOM 385 CD2 LEU A 197 1.194 -0.275 -3.852 1.00 20.41 C ATOM 0 H LEU A 197 5.812 2.023 -3.581 1.00 12.24 H new ATOM 0 HA LEU A 197 5.333 -0.842 -2.922 1.00 64.04 H new ATOM 0 HB2 LEU A 197 3.431 0.737 -2.457 1.00 61.42 H new ATOM 0 HB3 LEU A 197 3.450 1.220 -4.142 1.00 61.42 H new ATOM 0 HG LEU A 197 2.900 -1.137 -4.808 1.00 70.14 H new ATOM 0 HD11 LEU A 197 2.123 -2.740 -3.080 1.00 54.45 H new ATOM 0 HD12 LEU A 197 3.842 -2.326 -2.878 1.00 54.45 H new ATOM 0 HD13 LEU A 197 2.620 -1.598 -1.809 1.00 54.45 H new ATOM 0 HD21 LEU A 197 0.533 -1.107 -4.093 1.00 20.41 H new ATOM 0 HD22 LEU A 197 0.921 0.135 -2.880 1.00 20.41 H new ATOM 0 HD23 LEU A 197 1.095 0.499 -4.613 1.00 20.41 H new ATOM 397 N ASP A 198 6.114 -1.497 -5.223 1.00 53.34 N ATOM 398 CA ASP A 198 6.600 -1.932 -6.546 1.00 71.31 C ATOM 399 C ASP A 198 5.466 -2.620 -7.318 1.00 53.21 C ATOM 400 O ASP A 198 5.146 -3.792 -7.065 1.00 72.12 O ATOM 401 CB ASP A 198 7.817 -2.878 -6.381 1.00 73.42 C ATOM 402 CG ASP A 198 8.994 -2.177 -5.681 1.00 44.13 C ATOM 403 OD1 ASP A 198 9.873 -1.622 -6.377 1.00 40.13 O ATOM 404 OD2 ASP A 198 9.033 -2.165 -4.428 1.00 4.05 O ATOM 0 H ASP A 198 6.249 -2.192 -4.489 1.00 53.34 H new ATOM 0 HA ASP A 198 6.923 -1.061 -7.117 1.00 71.31 H new ATOM 0 HB2 ASP A 198 7.521 -3.754 -5.804 1.00 73.42 H new ATOM 0 HB3 ASP A 198 8.136 -3.234 -7.361 1.00 73.42 H new ATOM 409 N VAL A 199 4.857 -1.876 -8.255 1.00 51.03 N ATOM 410 CA VAL A 199 3.721 -2.347 -9.063 1.00 63.15 C ATOM 411 C VAL A 199 4.097 -2.356 -10.564 1.00 71.10 C ATOM 412 O VAL A 199 4.562 -1.346 -11.087 1.00 15.21 O ATOM 413 CB VAL A 199 2.434 -1.467 -8.801 1.00 12.53 C ATOM 414 CG1 VAL A 199 2.684 0.034 -9.063 1.00 51.32 C ATOM 415 CG2 VAL A 199 1.213 -1.983 -9.603 1.00 21.22 C ATOM 0 H VAL A 199 5.142 -0.922 -8.475 1.00 51.03 H new ATOM 0 HA VAL A 199 3.485 -3.368 -8.764 1.00 63.15 H new ATOM 0 HB VAL A 199 2.201 -1.569 -7.741 1.00 12.53 H new ATOM 0 HG11 VAL A 199 1.770 0.595 -8.869 1.00 51.32 H new ATOM 0 HG12 VAL A 199 3.476 0.391 -8.404 1.00 51.32 H new ATOM 0 HG13 VAL A 199 2.984 0.177 -10.101 1.00 51.32 H new ATOM 0 HG21 VAL A 199 0.349 -1.352 -9.396 1.00 21.22 H new ATOM 0 HG22 VAL A 199 1.438 -1.952 -10.669 1.00 21.22 H new ATOM 0 HG23 VAL A 199 0.992 -3.009 -9.309 1.00 21.22 H new ATOM 425 N PRO A 200 3.987 -3.531 -11.264 1.00 63.24 N ATOM 426 CA PRO A 200 4.070 -3.593 -12.747 1.00 2.14 C ATOM 427 C PRO A 200 3.006 -2.705 -13.432 1.00 44.45 C ATOM 428 O PRO A 200 1.887 -2.573 -12.919 1.00 31.23 O ATOM 429 CB PRO A 200 3.835 -5.097 -13.056 1.00 61.01 C ATOM 430 CG PRO A 200 4.269 -5.803 -11.809 1.00 44.03 C ATOM 431 CD PRO A 200 3.847 -4.891 -10.679 1.00 41.03 C ATOM 0 HA PRO A 200 5.021 -3.219 -13.125 1.00 2.14 H new ATOM 0 HB2 PRO A 200 2.788 -5.298 -13.283 1.00 61.01 H new ATOM 0 HB3 PRO A 200 4.416 -5.421 -13.919 1.00 61.01 H new ATOM 0 HG2 PRO A 200 3.797 -6.782 -11.724 1.00 44.03 H new ATOM 0 HG3 PRO A 200 5.347 -5.967 -11.803 1.00 44.03 H new ATOM 0 HD2 PRO A 200 2.823 -5.089 -10.364 1.00 41.03 H new ATOM 0 HD3 PRO A 200 4.481 -5.018 -9.802 1.00 41.03 H new ATOM 439 N ALA A 201 3.373 -2.128 -14.600 1.00 32.22 N ATOM 440 CA ALA A 201 2.488 -1.259 -15.411 1.00 62.23 C ATOM 441 C ALA A 201 1.098 -1.894 -15.721 1.00 23.32 C ATOM 442 O ALA A 201 0.080 -1.216 -15.517 1.00 64.31 O ATOM 443 CB ALA A 201 3.197 -0.813 -16.709 1.00 52.44 C ATOM 0 H ALA A 201 4.299 -2.253 -15.009 1.00 32.22 H new ATOM 0 HA ALA A 201 2.283 -0.381 -14.798 1.00 62.23 H new ATOM 0 HB1 ALA A 201 2.529 -0.176 -17.288 1.00 52.44 H new ATOM 0 HB2 ALA A 201 4.100 -0.257 -16.458 1.00 52.44 H new ATOM 0 HB3 ALA A 201 3.463 -1.691 -17.298 1.00 52.44 H new ATOM 449 N PRO A 202 1.006 -3.212 -16.178 1.00 21.21 N ATOM 450 CA PRO A 202 -0.305 -3.904 -16.362 1.00 62.30 C ATOM 451 C PRO A 202 -1.192 -3.867 -15.093 1.00 12.44 C ATOM 452 O PRO A 202 -2.359 -3.467 -15.165 1.00 3.33 O ATOM 453 CB PRO A 202 0.086 -5.365 -16.756 1.00 12.02 C ATOM 454 CG PRO A 202 1.545 -5.492 -16.418 1.00 22.34 C ATOM 455 CD PRO A 202 2.127 -4.113 -16.609 1.00 33.12 C ATOM 0 HA PRO A 202 -0.915 -3.412 -17.120 1.00 62.30 H new ATOM 0 HB2 PRO A 202 -0.510 -6.093 -16.206 1.00 12.02 H new ATOM 0 HB3 PRO A 202 -0.089 -5.546 -17.816 1.00 12.02 H new ATOM 0 HG2 PRO A 202 1.681 -5.837 -15.393 1.00 22.34 H new ATOM 0 HG3 PRO A 202 2.036 -6.218 -17.066 1.00 22.34 H new ATOM 0 HD2 PRO A 202 3.020 -3.964 -16.003 1.00 33.12 H new ATOM 0 HD3 PRO A 202 2.412 -3.935 -17.646 1.00 33.12 H new ATOM 463 N ILE A 203 -0.592 -4.225 -13.933 1.00 13.25 N ATOM 464 CA ILE A 203 -1.297 -4.311 -12.634 1.00 3.15 C ATOM 465 C ILE A 203 -1.768 -2.917 -12.155 1.00 2.11 C ATOM 466 O ILE A 203 -2.801 -2.792 -11.503 1.00 52.31 O ATOM 467 CB ILE A 203 -0.384 -4.993 -11.534 1.00 54.41 C ATOM 468 CG1 ILE A 203 0.039 -6.427 -11.998 1.00 72.33 C ATOM 469 CG2 ILE A 203 -1.077 -5.034 -10.139 1.00 74.11 C ATOM 470 CD1 ILE A 203 0.800 -7.243 -10.962 1.00 11.12 C ATOM 0 H ILE A 203 0.398 -4.463 -13.873 1.00 13.25 H new ATOM 0 HA ILE A 203 -2.179 -4.934 -12.783 1.00 3.15 H new ATOM 0 HB ILE A 203 0.512 -4.383 -11.420 1.00 54.41 H new ATOM 0 HG12 ILE A 203 -0.857 -6.978 -12.285 1.00 72.33 H new ATOM 0 HG13 ILE A 203 0.657 -6.335 -12.891 1.00 72.33 H new ATOM 0 HG21 ILE A 203 -0.414 -5.510 -9.417 1.00 74.11 H new ATOM 0 HG22 ILE A 203 -1.299 -4.018 -9.813 1.00 74.11 H new ATOM 0 HG23 ILE A 203 -2.004 -5.603 -10.210 1.00 74.11 H new ATOM 0 HD11 ILE A 203 1.048 -8.219 -11.378 1.00 11.12 H new ATOM 0 HD12 ILE A 203 1.717 -6.721 -10.690 1.00 11.12 H new ATOM 0 HD13 ILE A 203 0.180 -7.374 -10.075 1.00 11.12 H new ATOM 482 N ALA A 204 -1.011 -1.873 -12.510 1.00 21.01 N ATOM 483 CA ALA A 204 -1.352 -0.485 -12.154 1.00 70.23 C ATOM 484 C ALA A 204 -2.600 0.008 -12.924 1.00 73.45 C ATOM 485 O ALA A 204 -3.479 0.661 -12.347 1.00 42.52 O ATOM 486 CB ALA A 204 -0.142 0.415 -12.411 1.00 33.14 C ATOM 0 H ALA A 204 -0.149 -1.962 -13.049 1.00 21.01 H new ATOM 0 HA ALA A 204 -1.604 -0.444 -11.094 1.00 70.23 H new ATOM 0 HB1 ALA A 204 -0.391 1.443 -12.149 1.00 33.14 H new ATOM 0 HB2 ALA A 204 0.698 0.078 -11.803 1.00 33.14 H new ATOM 0 HB3 ALA A 204 0.131 0.366 -13.465 1.00 33.14 H new ATOM 492 N VAL A 205 -2.676 -0.344 -14.226 1.00 30.25 N ATOM 493 CA VAL A 205 -3.784 0.079 -15.111 1.00 43.12 C ATOM 494 C VAL A 205 -5.088 -0.675 -14.781 1.00 61.01 C ATOM 495 O VAL A 205 -6.137 -0.053 -14.584 1.00 11.00 O ATOM 496 CB VAL A 205 -3.412 -0.126 -16.631 1.00 33.13 C ATOM 497 CG1 VAL A 205 -4.569 0.287 -17.581 1.00 3.10 C ATOM 498 CG2 VAL A 205 -2.113 0.636 -16.972 1.00 63.53 C ATOM 0 H VAL A 205 -1.977 -0.924 -14.690 1.00 30.25 H new ATOM 0 HA VAL A 205 -3.947 1.142 -14.934 1.00 43.12 H new ATOM 0 HB VAL A 205 -3.245 -1.192 -16.787 1.00 33.13 H new ATOM 0 HG11 VAL A 205 -4.265 0.128 -18.615 1.00 3.10 H new ATOM 0 HG12 VAL A 205 -5.450 -0.317 -17.365 1.00 3.10 H new ATOM 0 HG13 VAL A 205 -4.805 1.340 -17.430 1.00 3.10 H new ATOM 0 HG21 VAL A 205 -1.868 0.486 -18.024 1.00 63.53 H new ATOM 0 HG22 VAL A 205 -2.254 1.700 -16.781 1.00 63.53 H new ATOM 0 HG23 VAL A 205 -1.298 0.261 -16.353 1.00 63.53 H new ATOM 508 N VAL A 206 -5.019 -2.015 -14.719 1.00 41.04 N ATOM 509 CA VAL A 206 -6.222 -2.865 -14.522 1.00 2.40 C ATOM 510 C VAL A 206 -6.584 -3.042 -13.027 1.00 40.20 C ATOM 511 O VAL A 206 -7.736 -3.357 -12.699 1.00 11.50 O ATOM 512 CB VAL A 206 -6.062 -4.275 -15.218 1.00 11.32 C ATOM 513 CG1 VAL A 206 -5.748 -4.109 -16.722 1.00 13.10 C ATOM 514 CG2 VAL A 206 -5.000 -5.157 -14.522 1.00 75.24 C ATOM 0 H VAL A 206 -4.148 -2.539 -14.801 1.00 41.04 H new ATOM 0 HA VAL A 206 -7.046 -2.336 -15.000 1.00 2.40 H new ATOM 0 HB VAL A 206 -7.016 -4.794 -15.118 1.00 11.32 H new ATOM 0 HG11 VAL A 206 -5.642 -5.091 -17.182 1.00 13.10 H new ATOM 0 HG12 VAL A 206 -6.561 -3.568 -17.206 1.00 13.10 H new ATOM 0 HG13 VAL A 206 -4.819 -3.551 -16.840 1.00 13.10 H new ATOM 0 HG21 VAL A 206 -4.928 -6.115 -15.038 1.00 75.24 H new ATOM 0 HG22 VAL A 206 -4.033 -4.655 -14.552 1.00 75.24 H new ATOM 0 HG23 VAL A 206 -5.289 -5.324 -13.485 1.00 75.24 H new ATOM 524 N GLY A 207 -5.610 -2.804 -12.129 1.00 63.11 N ATOM 525 CA GLY A 207 -5.763 -3.113 -10.694 1.00 62.11 C ATOM 526 C GLY A 207 -5.272 -4.525 -10.376 1.00 12.32 C ATOM 527 O GLY A 207 -5.096 -5.338 -11.288 1.00 10.12 O ATOM 0 H GLY A 207 -4.707 -2.398 -12.372 1.00 63.11 H new ATOM 0 HA2 GLY A 207 -5.203 -2.389 -10.102 1.00 62.11 H new ATOM 0 HA3 GLY A 207 -6.811 -3.017 -10.408 1.00 62.11 H new ATOM 531 N GLY A 208 -5.016 -4.819 -9.098 1.00 63.54 N ATOM 532 CA GLY A 208 -4.567 -6.156 -8.695 1.00 2.12 C ATOM 533 C GLY A 208 -3.930 -6.148 -7.323 1.00 5.51 C ATOM 534 O GLY A 208 -4.347 -5.369 -6.468 1.00 2.45 O ATOM 0 H GLY A 208 -5.111 -4.155 -8.329 1.00 63.54 H new ATOM 0 HA2 GLY A 208 -5.416 -6.840 -8.697 1.00 2.12 H new ATOM 0 HA3 GLY A 208 -3.851 -6.534 -9.425 1.00 2.12 H new ATOM 538 N LYS A 209 -2.937 -7.034 -7.094 1.00 31.25 N ATOM 539 CA LYS A 209 -2.165 -7.080 -5.830 1.00 51.40 C ATOM 540 C LYS A 209 -0.671 -7.171 -6.140 1.00 14.22 C ATOM 541 O LYS A 209 -0.265 -7.884 -7.062 1.00 62.24 O ATOM 542 CB LYS A 209 -2.577 -8.283 -4.932 1.00 61.31 C ATOM 543 CG LYS A 209 -3.912 -8.113 -4.163 1.00 10.33 C ATOM 544 CD LYS A 209 -4.194 -9.282 -3.186 1.00 30.23 C ATOM 545 CE LYS A 209 -4.181 -10.662 -3.873 1.00 22.21 C ATOM 546 NZ LYS A 209 -5.189 -10.754 -4.964 1.00 42.13 N ATOM 0 H LYS A 209 -2.648 -7.735 -7.776 1.00 31.25 H new ATOM 0 HA LYS A 209 -2.384 -6.164 -5.282 1.00 51.40 H new ATOM 0 HB2 LYS A 209 -2.648 -9.173 -5.557 1.00 61.31 H new ATOM 0 HB3 LYS A 209 -1.782 -8.464 -4.209 1.00 61.31 H new ATOM 0 HG2 LYS A 209 -3.888 -7.177 -3.605 1.00 10.33 H new ATOM 0 HG3 LYS A 209 -4.731 -8.037 -4.878 1.00 10.33 H new ATOM 0 HD2 LYS A 209 -3.448 -9.271 -2.392 1.00 30.23 H new ATOM 0 HD3 LYS A 209 -5.164 -9.127 -2.714 1.00 30.23 H new ATOM 0 HE2 LYS A 209 -3.188 -10.854 -4.280 1.00 22.21 H new ATOM 0 HE3 LYS A 209 -4.377 -11.437 -3.132 1.00 22.21 H new ATOM 0 HZ1 LYS A 209 -5.169 -11.709 -5.376 1.00 42.13 H new ATOM 0 HZ2 LYS A 209 -6.136 -10.563 -4.579 1.00 42.13 H new ATOM 0 HZ3 LYS A 209 -4.967 -10.055 -5.701 1.00 42.13 H new ATOM 560 N VAL A 210 0.141 -6.435 -5.362 1.00 71.01 N ATOM 561 CA VAL A 210 1.617 -6.477 -5.447 1.00 11.23 C ATOM 562 C VAL A 210 2.209 -6.531 -4.029 1.00 60.54 C ATOM 563 O VAL A 210 1.676 -5.914 -3.100 1.00 71.32 O ATOM 564 CB VAL A 210 2.205 -5.249 -6.238 1.00 73.42 C ATOM 565 CG1 VAL A 210 1.751 -5.252 -7.705 1.00 1.11 C ATOM 566 CG2 VAL A 210 1.852 -3.920 -5.560 1.00 65.33 C ATOM 0 H VAL A 210 -0.206 -5.790 -4.652 1.00 71.01 H new ATOM 0 HA VAL A 210 1.895 -7.374 -6.001 1.00 11.23 H new ATOM 0 HB VAL A 210 3.290 -5.352 -6.225 1.00 73.42 H new ATOM 0 HG11 VAL A 210 2.176 -4.390 -8.219 1.00 1.11 H new ATOM 0 HG12 VAL A 210 2.091 -6.168 -8.189 1.00 1.11 H new ATOM 0 HG13 VAL A 210 0.663 -5.200 -7.749 1.00 1.11 H new ATOM 0 HG21 VAL A 210 2.274 -3.095 -6.134 1.00 65.33 H new ATOM 0 HG22 VAL A 210 0.768 -3.812 -5.513 1.00 65.33 H new ATOM 0 HG23 VAL A 210 2.262 -3.907 -4.550 1.00 65.33 H new ATOM 576 N ARG A 211 3.317 -7.256 -3.877 1.00 35.14 N ATOM 577 CA ARG A 211 3.901 -7.564 -2.569 1.00 33.10 C ATOM 578 C ARG A 211 4.842 -6.428 -2.093 1.00 74.22 C ATOM 579 O ARG A 211 5.841 -6.126 -2.748 1.00 4.22 O ATOM 580 CB ARG A 211 4.635 -8.928 -2.678 1.00 32.23 C ATOM 581 CG ARG A 211 5.175 -9.495 -1.350 1.00 60.34 C ATOM 582 CD ARG A 211 5.734 -10.923 -1.508 1.00 32.53 C ATOM 583 NE ARG A 211 4.690 -11.905 -1.889 1.00 41.11 N ATOM 584 CZ ARG A 211 4.753 -13.236 -1.676 1.00 44.40 C ATOM 585 NH1 ARG A 211 5.804 -13.795 -1.071 1.00 43.21 N ATOM 586 NH2 ARG A 211 3.743 -14.002 -2.052 1.00 22.43 N ATOM 0 H ARG A 211 3.838 -7.649 -4.661 1.00 35.14 H new ATOM 0 HA ARG A 211 3.118 -7.638 -1.815 1.00 33.10 H new ATOM 0 HB2 ARG A 211 3.950 -9.656 -3.113 1.00 32.23 H new ATOM 0 HB3 ARG A 211 5.468 -8.819 -3.373 1.00 32.23 H new ATOM 0 HG2 ARG A 211 5.959 -8.840 -0.970 1.00 60.34 H new ATOM 0 HG3 ARG A 211 4.376 -9.500 -0.608 1.00 60.34 H new ATOM 0 HD2 ARG A 211 6.519 -10.920 -2.265 1.00 32.53 H new ATOM 0 HD3 ARG A 211 6.196 -11.234 -0.571 1.00 32.53 H new ATOM 0 HE ARG A 211 3.855 -11.544 -2.350 1.00 41.11 H new ATOM 0 HH11 ARG A 211 6.582 -13.213 -0.759 1.00 43.21 H new ATOM 0 HH12 ARG A 211 5.829 -14.804 -0.921 1.00 43.21 H new ATOM 0 HH21 ARG A 211 2.926 -13.586 -2.499 1.00 22.43 H new ATOM 0 HH22 ARG A 211 3.781 -15.009 -1.895 1.00 22.43 H new ATOM 600 N ALA A 212 4.470 -5.783 -0.975 1.00 21.31 N ATOM 601 CA ALA A 212 5.289 -4.762 -0.282 1.00 22.40 C ATOM 602 C ALA A 212 5.951 -5.372 0.970 1.00 61.40 C ATOM 603 O ALA A 212 5.556 -6.450 1.432 1.00 43.10 O ATOM 604 CB ALA A 212 4.406 -3.560 0.109 1.00 42.24 C ATOM 0 H ALA A 212 3.576 -5.956 -0.515 1.00 21.31 H new ATOM 0 HA ALA A 212 6.074 -4.418 -0.956 1.00 22.40 H new ATOM 0 HB1 ALA A 212 5.014 -2.812 0.618 1.00 42.24 H new ATOM 0 HB2 ALA A 212 3.969 -3.122 -0.789 1.00 42.24 H new ATOM 0 HB3 ALA A 212 3.610 -3.895 0.774 1.00 42.24 H new ATOM 610 N MET A 213 6.957 -4.666 1.504 1.00 41.31 N ATOM 611 CA MET A 213 7.730 -5.098 2.688 1.00 65.52 C ATOM 612 C MET A 213 7.316 -4.274 3.923 1.00 71.35 C ATOM 613 O MET A 213 7.374 -3.037 3.902 1.00 13.42 O ATOM 614 CB MET A 213 9.255 -4.936 2.405 1.00 1.43 C ATOM 615 CG MET A 213 9.814 -5.787 1.229 1.00 55.24 C ATOM 616 SD MET A 213 10.586 -7.348 1.738 1.00 60.24 S ATOM 617 CE MET A 213 9.238 -8.286 2.454 1.00 51.35 C ATOM 0 H MET A 213 7.264 -3.770 1.126 1.00 41.31 H new ATOM 0 HA MET A 213 7.520 -6.148 2.892 1.00 65.52 H new ATOM 0 HB2 MET A 213 9.458 -3.885 2.198 1.00 1.43 H new ATOM 0 HB3 MET A 213 9.804 -5.195 3.310 1.00 1.43 H new ATOM 0 HG2 MET A 213 9.002 -6.006 0.536 1.00 55.24 H new ATOM 0 HG3 MET A 213 10.547 -5.194 0.683 1.00 55.24 H new ATOM 0 HE1 MET A 213 9.532 -9.331 2.549 1.00 51.35 H new ATOM 0 HE2 MET A 213 8.999 -7.886 3.439 1.00 51.35 H new ATOM 0 HE3 MET A 213 8.361 -8.213 1.810 1.00 51.35 H new ATOM 627 N THR A 214 6.875 -4.975 4.990 1.00 13.42 N ATOM 628 CA THR A 214 6.524 -4.369 6.295 1.00 52.51 C ATOM 629 C THR A 214 7.328 -5.037 7.414 1.00 23.41 C ATOM 630 O THR A 214 8.082 -5.983 7.164 1.00 3.11 O ATOM 631 CB THR A 214 4.992 -4.499 6.612 1.00 21.33 C ATOM 632 OG1 THR A 214 4.605 -5.879 6.684 1.00 52.11 O ATOM 633 CG2 THR A 214 4.144 -3.784 5.563 1.00 72.01 C ATOM 0 H THR A 214 6.751 -5.987 4.970 1.00 13.42 H new ATOM 0 HA THR A 214 6.768 -3.308 6.236 1.00 52.51 H new ATOM 0 HB THR A 214 4.818 -4.026 7.579 1.00 21.33 H new ATOM 0 HG1 THR A 214 5.207 -6.417 6.128 1.00 52.11 H new ATOM 0 HG21 THR A 214 3.089 -3.893 5.812 1.00 72.01 H new ATOM 0 HG22 THR A 214 4.405 -2.726 5.544 1.00 72.01 H new ATOM 0 HG23 THR A 214 4.333 -4.222 4.583 1.00 72.01 H new ATOM 641 N LEU A 215 7.138 -4.551 8.656 1.00 4.21 N ATOM 642 CA LEU A 215 7.848 -5.072 9.843 1.00 43.31 C ATOM 643 C LEU A 215 7.225 -6.386 10.349 1.00 23.23 C ATOM 644 O LEU A 215 7.776 -7.038 11.236 1.00 54.25 O ATOM 645 CB LEU A 215 7.860 -4.011 10.972 1.00 45.34 C ATOM 646 CG LEU A 215 8.367 -2.578 10.589 1.00 71.22 C ATOM 647 CD1 LEU A 215 8.650 -1.744 11.852 1.00 72.43 C ATOM 648 CD2 LEU A 215 9.593 -2.607 9.644 1.00 11.25 C ATOM 0 H LEU A 215 6.492 -3.790 8.865 1.00 4.21 H new ATOM 0 HA LEU A 215 8.874 -5.287 9.546 1.00 43.31 H new ATOM 0 HB2 LEU A 215 6.847 -3.920 11.363 1.00 45.34 H new ATOM 0 HB3 LEU A 215 8.483 -4.386 11.784 1.00 45.34 H new ATOM 0 HG LEU A 215 7.564 -2.097 10.030 1.00 71.22 H new ATOM 0 HD11 LEU A 215 9.001 -0.753 11.563 1.00 72.43 H new ATOM 0 HD12 LEU A 215 7.736 -1.649 12.437 1.00 72.43 H new ATOM 0 HD13 LEU A 215 9.414 -2.239 12.451 1.00 72.43 H new ATOM 0 HD21 LEU A 215 9.899 -1.587 9.414 1.00 11.25 H new ATOM 0 HD22 LEU A 215 10.415 -3.131 10.131 1.00 11.25 H new ATOM 0 HD23 LEU A 215 9.329 -3.124 8.721 1.00 11.25 H new ATOM 660 N GLU A 216 6.052 -6.738 9.790 1.00 32.50 N ATOM 661 CA GLU A 216 5.346 -7.998 10.093 1.00 13.42 C ATOM 662 C GLU A 216 5.714 -9.087 9.063 1.00 30.20 C ATOM 663 O GLU A 216 5.524 -10.282 9.317 1.00 21.03 O ATOM 664 CB GLU A 216 3.816 -7.742 10.102 1.00 43.13 C ATOM 665 CG GLU A 216 3.384 -6.578 11.028 1.00 73.02 C ATOM 666 CD GLU A 216 1.863 -6.357 11.062 1.00 72.52 C ATOM 667 OE1 GLU A 216 1.180 -6.981 11.906 1.00 54.24 O ATOM 668 OE2 GLU A 216 1.350 -5.562 10.250 1.00 71.12 O ATOM 0 H GLU A 216 5.564 -6.153 9.111 1.00 32.50 H new ATOM 0 HA GLU A 216 5.652 -8.354 11.077 1.00 13.42 H new ATOM 0 HB2 GLU A 216 3.487 -7.527 9.085 1.00 43.13 H new ATOM 0 HB3 GLU A 216 3.306 -8.653 10.416 1.00 43.13 H new ATOM 0 HG2 GLU A 216 3.737 -6.778 12.040 1.00 73.02 H new ATOM 0 HG3 GLU A 216 3.870 -5.660 10.696 1.00 73.02 H new ATOM 675 N GLY A 217 6.249 -8.650 7.904 1.00 10.44 N ATOM 676 CA GLY A 217 6.658 -9.545 6.817 1.00 34.41 C ATOM 677 C GLY A 217 6.251 -9.010 5.446 1.00 45.50 C ATOM 678 O GLY A 217 5.960 -7.818 5.316 1.00 21.40 O ATOM 0 H GLY A 217 6.407 -7.663 7.701 1.00 10.44 H new ATOM 0 HA2 GLY A 217 7.739 -9.679 6.846 1.00 34.41 H new ATOM 0 HA3 GLY A 217 6.211 -10.527 6.969 1.00 34.41 H new ATOM 682 N PRO A 218 6.263 -9.859 4.377 1.00 24.20 N ATOM 683 CA PRO A 218 5.705 -9.484 3.060 1.00 32.01 C ATOM 684 C PRO A 218 4.160 -9.485 3.084 1.00 2.03 C ATOM 685 O PRO A 218 3.537 -10.413 3.613 1.00 41.14 O ATOM 686 CB PRO A 218 6.275 -10.568 2.121 1.00 71.34 C ATOM 687 CG PRO A 218 6.474 -11.766 2.993 1.00 13.35 C ATOM 688 CD PRO A 218 6.854 -11.231 4.359 1.00 61.13 C ATOM 0 HA PRO A 218 5.972 -8.475 2.746 1.00 32.01 H new ATOM 0 HB2 PRO A 218 5.587 -10.784 1.304 1.00 71.34 H new ATOM 0 HB3 PRO A 218 7.214 -10.247 1.671 1.00 71.34 H new ATOM 0 HG2 PRO A 218 5.564 -12.364 3.048 1.00 13.35 H new ATOM 0 HG3 PRO A 218 7.257 -12.412 2.596 1.00 13.35 H new ATOM 0 HD2 PRO A 218 6.450 -11.852 5.159 1.00 61.13 H new ATOM 0 HD3 PRO A 218 7.936 -11.203 4.492 1.00 61.13 H new ATOM 696 N VAL A 219 3.552 -8.427 2.525 1.00 43.31 N ATOM 697 CA VAL A 219 2.090 -8.260 2.465 1.00 2.44 C ATOM 698 C VAL A 219 1.690 -7.832 1.039 1.00 3.40 C ATOM 699 O VAL A 219 2.318 -6.953 0.462 1.00 75.31 O ATOM 700 CB VAL A 219 1.567 -7.204 3.531 1.00 40.42 C ATOM 701 CG1 VAL A 219 1.912 -7.629 4.981 1.00 0.04 C ATOM 702 CG2 VAL A 219 2.078 -5.765 3.248 1.00 72.12 C ATOM 0 H VAL A 219 4.065 -7.656 2.098 1.00 43.31 H new ATOM 0 HA VAL A 219 1.625 -9.215 2.711 1.00 2.44 H new ATOM 0 HB VAL A 219 0.482 -7.189 3.429 1.00 40.42 H new ATOM 0 HG11 VAL A 219 1.537 -6.880 5.679 1.00 0.04 H new ATOM 0 HG12 VAL A 219 1.449 -8.591 5.198 1.00 0.04 H new ATOM 0 HG13 VAL A 219 2.993 -7.715 5.087 1.00 0.04 H new ATOM 0 HG21 VAL A 219 1.690 -5.085 4.007 1.00 72.12 H new ATOM 0 HG22 VAL A 219 3.168 -5.754 3.274 1.00 72.12 H new ATOM 0 HG23 VAL A 219 1.735 -5.444 2.264 1.00 72.12 H new ATOM 712 N GLU A 220 0.668 -8.477 0.455 1.00 73.11 N ATOM 713 CA GLU A 220 0.187 -8.144 -0.898 1.00 63.03 C ATOM 714 C GLU A 220 -0.941 -7.100 -0.814 1.00 33.23 C ATOM 715 O GLU A 220 -2.009 -7.365 -0.251 1.00 24.21 O ATOM 716 CB GLU A 220 -0.271 -9.425 -1.628 1.00 25.13 C ATOM 717 CG GLU A 220 0.847 -10.494 -1.745 1.00 11.02 C ATOM 718 CD GLU A 220 0.486 -11.734 -2.578 1.00 22.33 C ATOM 719 OE1 GLU A 220 1.417 -12.440 -3.036 1.00 2.31 O ATOM 720 OE2 GLU A 220 -0.715 -12.003 -2.791 1.00 13.14 O ATOM 0 H GLU A 220 0.155 -9.237 0.901 1.00 73.11 H new ATOM 0 HA GLU A 220 1.001 -7.707 -1.476 1.00 63.03 H new ATOM 0 HB2 GLU A 220 -1.121 -9.854 -1.097 1.00 25.13 H new ATOM 0 HB3 GLU A 220 -0.619 -9.162 -2.627 1.00 25.13 H new ATOM 0 HG2 GLU A 220 1.729 -10.027 -2.183 1.00 11.02 H new ATOM 0 HG3 GLU A 220 1.123 -10.818 -0.742 1.00 11.02 H new ATOM 727 N VAL A 221 -0.670 -5.918 -1.386 1.00 40.42 N ATOM 728 CA VAL A 221 -1.532 -4.735 -1.318 1.00 3.21 C ATOM 729 C VAL A 221 -2.404 -4.650 -2.573 1.00 42.15 C ATOM 730 O VAL A 221 -1.874 -4.700 -3.692 1.00 73.02 O ATOM 731 CB VAL A 221 -0.654 -3.432 -1.200 1.00 2.12 C ATOM 732 CG1 VAL A 221 -1.524 -2.166 -0.985 1.00 11.44 C ATOM 733 CG2 VAL A 221 0.408 -3.589 -0.086 1.00 42.04 C ATOM 0 H VAL A 221 0.181 -5.757 -1.924 1.00 40.42 H new ATOM 0 HA VAL A 221 -2.171 -4.818 -0.439 1.00 3.21 H new ATOM 0 HB VAL A 221 -0.132 -3.296 -2.147 1.00 2.12 H new ATOM 0 HG11 VAL A 221 -0.880 -1.290 -0.909 1.00 11.44 H new ATOM 0 HG12 VAL A 221 -2.204 -2.044 -1.828 1.00 11.44 H new ATOM 0 HG13 VAL A 221 -2.101 -2.273 -0.066 1.00 11.44 H new ATOM 0 HG21 VAL A 221 1.004 -2.679 -0.021 1.00 42.04 H new ATOM 0 HG22 VAL A 221 -0.089 -3.767 0.868 1.00 42.04 H new ATOM 0 HG23 VAL A 221 1.058 -4.432 -0.319 1.00 42.04 H new ATOM 743 N ALA A 222 -3.727 -4.525 -2.374 1.00 13.31 N ATOM 744 CA ALA A 222 -4.690 -4.327 -3.455 1.00 64.01 C ATOM 745 C ALA A 222 -4.509 -2.926 -4.069 1.00 63.42 C ATOM 746 O ALA A 222 -4.933 -1.917 -3.489 1.00 55.33 O ATOM 747 CB ALA A 222 -6.122 -4.538 -2.937 1.00 14.12 C ATOM 0 H ALA A 222 -4.155 -4.560 -1.449 1.00 13.31 H new ATOM 0 HA ALA A 222 -4.511 -5.063 -4.239 1.00 64.01 H new ATOM 0 HB1 ALA A 222 -6.830 -4.388 -3.752 1.00 14.12 H new ATOM 0 HB2 ALA A 222 -6.224 -5.552 -2.551 1.00 14.12 H new ATOM 0 HB3 ALA A 222 -6.330 -3.824 -2.140 1.00 14.12 H new ATOM 753 N VAL A 223 -3.806 -2.899 -5.209 1.00 62.12 N ATOM 754 CA VAL A 223 -3.603 -1.703 -6.034 1.00 1.33 C ATOM 755 C VAL A 223 -4.921 -1.362 -6.751 1.00 52.53 C ATOM 756 O VAL A 223 -5.448 -2.224 -7.469 1.00 73.41 O ATOM 757 CB VAL A 223 -2.471 -1.944 -7.113 1.00 31.31 C ATOM 758 CG1 VAL A 223 -2.215 -0.690 -7.991 1.00 33.01 C ATOM 759 CG2 VAL A 223 -1.173 -2.416 -6.436 1.00 55.23 C ATOM 0 H VAL A 223 -3.352 -3.729 -5.591 1.00 62.12 H new ATOM 0 HA VAL A 223 -3.295 -0.881 -5.388 1.00 1.33 H new ATOM 0 HB VAL A 223 -2.824 -2.729 -7.782 1.00 31.31 H new ATOM 0 HG11 VAL A 223 -1.430 -0.907 -8.715 1.00 33.01 H new ATOM 0 HG12 VAL A 223 -3.131 -0.422 -8.518 1.00 33.01 H new ATOM 0 HG13 VAL A 223 -1.904 0.141 -7.357 1.00 33.01 H new ATOM 0 HG21 VAL A 223 -0.405 -2.577 -7.193 1.00 55.23 H new ATOM 0 HG22 VAL A 223 -0.834 -1.657 -5.731 1.00 55.23 H new ATOM 0 HG23 VAL A 223 -1.359 -3.349 -5.904 1.00 55.23 H new ATOM 769 N PRO A 224 -5.496 -0.129 -6.554 1.00 32.41 N ATOM 770 CA PRO A 224 -6.676 0.328 -7.328 1.00 22.20 C ATOM 771 C PRO A 224 -6.366 0.396 -8.854 1.00 60.03 C ATOM 772 O PRO A 224 -5.202 0.538 -9.240 1.00 62.14 O ATOM 773 CB PRO A 224 -6.985 1.737 -6.736 1.00 51.24 C ATOM 774 CG PRO A 224 -5.716 2.169 -6.061 1.00 33.22 C ATOM 775 CD PRO A 224 -5.070 0.897 -5.555 1.00 1.14 C ATOM 0 HA PRO A 224 -7.524 -0.352 -7.245 1.00 22.20 H new ATOM 0 HB2 PRO A 224 -7.273 2.438 -7.519 1.00 51.24 H new ATOM 0 HB3 PRO A 224 -7.812 1.693 -6.028 1.00 51.24 H new ATOM 0 HG2 PRO A 224 -5.060 2.691 -6.757 1.00 33.22 H new ATOM 0 HG3 PRO A 224 -5.923 2.857 -5.241 1.00 33.22 H new ATOM 0 HD2 PRO A 224 -3.985 0.988 -5.510 1.00 1.14 H new ATOM 0 HD3 PRO A 224 -5.411 0.645 -4.551 1.00 1.14 H new ATOM 783 N PRO A 225 -7.388 0.233 -9.751 1.00 13.40 N ATOM 784 CA PRO A 225 -7.208 0.460 -11.207 1.00 51.43 C ATOM 785 C PRO A 225 -6.880 1.936 -11.523 1.00 63.20 C ATOM 786 O PRO A 225 -7.172 2.834 -10.715 1.00 2.40 O ATOM 787 CB PRO A 225 -8.576 0.031 -11.821 1.00 2.24 C ATOM 788 CG PRO A 225 -9.220 -0.819 -10.763 1.00 30.03 C ATOM 789 CD PRO A 225 -8.770 -0.226 -9.449 1.00 35.33 C ATOM 0 HA PRO A 225 -6.369 -0.103 -11.615 1.00 51.43 H new ATOM 0 HB2 PRO A 225 -9.191 0.898 -12.061 1.00 2.24 H new ATOM 0 HB3 PRO A 225 -8.437 -0.527 -12.747 1.00 2.24 H new ATOM 0 HG2 PRO A 225 -10.306 -0.801 -10.851 1.00 30.03 H new ATOM 0 HG3 PRO A 225 -8.910 -1.860 -10.852 1.00 30.03 H new ATOM 0 HD2 PRO A 225 -9.411 0.599 -9.137 1.00 35.33 H new ATOM 0 HD3 PRO A 225 -8.785 -0.963 -8.646 1.00 35.33 H new ATOM 797 N ARG A 226 -6.249 2.149 -12.696 1.00 44.42 N ATOM 798 CA ARG A 226 -5.931 3.482 -13.258 1.00 0.23 C ATOM 799 C ARG A 226 -4.966 4.255 -12.331 1.00 31.42 C ATOM 800 O ARG A 226 -5.033 5.481 -12.223 1.00 51.11 O ATOM 801 CB ARG A 226 -7.231 4.305 -13.529 1.00 23.32 C ATOM 802 CG ARG A 226 -8.296 3.596 -14.406 1.00 10.30 C ATOM 803 CD ARG A 226 -9.563 4.457 -14.580 1.00 55.22 C ATOM 804 NE ARG A 226 -10.694 3.713 -15.165 1.00 32.21 N ATOM 805 CZ ARG A 226 -11.962 4.170 -15.229 1.00 13.42 C ATOM 806 NH1 ARG A 226 -12.289 5.375 -14.764 1.00 64.42 N ATOM 807 NH2 ARG A 226 -12.901 3.406 -15.747 1.00 12.14 N ATOM 0 H ARG A 226 -5.939 1.383 -13.294 1.00 44.42 H new ATOM 0 HA ARG A 226 -5.430 3.331 -14.214 1.00 0.23 H new ATOM 0 HB2 ARG A 226 -7.685 4.561 -12.572 1.00 23.32 H new ATOM 0 HB3 ARG A 226 -6.954 5.242 -14.011 1.00 23.32 H new ATOM 0 HG2 ARG A 226 -7.871 3.374 -15.385 1.00 10.30 H new ATOM 0 HG3 ARG A 226 -8.565 2.643 -13.951 1.00 10.30 H new ATOM 0 HD2 ARG A 226 -9.861 4.854 -13.610 1.00 55.22 H new ATOM 0 HD3 ARG A 226 -9.330 5.311 -15.216 1.00 55.22 H new ATOM 0 HE ARG A 226 -10.504 2.787 -15.549 1.00 32.21 H new ATOM 0 HH11 ARG A 226 -11.574 5.973 -14.349 1.00 64.42 H new ATOM 0 HH12 ARG A 226 -13.254 5.700 -14.823 1.00 64.42 H new ATOM 0 HH21 ARG A 226 -12.667 2.476 -16.096 1.00 12.14 H new ATOM 0 HH22 ARG A 226 -13.862 3.744 -15.799 1.00 12.14 H new ATOM 821 N THR A 227 -4.075 3.506 -11.666 1.00 72.12 N ATOM 822 CA THR A 227 -3.072 4.051 -10.749 1.00 1.41 C ATOM 823 C THR A 227 -1.782 4.420 -11.516 1.00 32.45 C ATOM 824 O THR A 227 -1.226 3.598 -12.245 1.00 73.42 O ATOM 825 CB THR A 227 -2.808 3.027 -9.593 1.00 55.53 C ATOM 826 OG1 THR A 227 -3.972 2.973 -8.752 1.00 1.02 O ATOM 827 CG2 THR A 227 -1.601 3.375 -8.721 1.00 52.41 C ATOM 0 H THR A 227 -4.033 2.491 -11.753 1.00 72.12 H new ATOM 0 HA THR A 227 -3.444 4.971 -10.299 1.00 1.41 H new ATOM 0 HB THR A 227 -2.593 2.069 -10.067 1.00 55.53 H new ATOM 0 HG1 THR A 227 -4.440 2.124 -8.895 1.00 1.02 H new ATOM 0 HG21 THR A 227 -1.484 2.620 -7.944 1.00 52.41 H new ATOM 0 HG22 THR A 227 -0.703 3.404 -9.338 1.00 52.41 H new ATOM 0 HG23 THR A 227 -1.755 4.350 -8.259 1.00 52.41 H new ATOM 835 N GLN A 228 -1.340 5.684 -11.346 1.00 20.43 N ATOM 836 CA GLN A 228 -0.164 6.256 -12.042 1.00 1.03 C ATOM 837 C GLN A 228 1.111 6.125 -11.189 1.00 15.22 C ATOM 838 O GLN A 228 1.039 5.895 -9.973 1.00 44.22 O ATOM 839 CB GLN A 228 -0.392 7.760 -12.381 1.00 72.20 C ATOM 840 CG GLN A 228 -1.606 8.080 -13.292 1.00 51.11 C ATOM 841 CD GLN A 228 -2.967 8.066 -12.579 1.00 61.33 C ATOM 842 OE1 GLN A 228 -3.063 8.360 -11.389 1.00 45.21 O ATOM 843 NE2 GLN A 228 -4.025 7.759 -13.304 1.00 61.03 N ATOM 0 H GLN A 228 -1.794 6.345 -10.715 1.00 20.43 H new ATOM 0 HA GLN A 228 -0.036 5.691 -12.965 1.00 1.03 H new ATOM 0 HB2 GLN A 228 -0.511 8.308 -11.446 1.00 72.20 H new ATOM 0 HB3 GLN A 228 0.508 8.143 -12.862 1.00 72.20 H new ATOM 0 HG2 GLN A 228 -1.457 9.062 -13.741 1.00 51.11 H new ATOM 0 HG3 GLN A 228 -1.631 7.357 -14.107 1.00 51.11 H new ATOM 0 HE21 GLN A 228 -3.916 7.519 -14.289 1.00 61.03 H new ATOM 0 HE22 GLN A 228 -4.952 7.762 -12.879 1.00 61.03 H new ATOM 852 N ALA A 229 2.267 6.297 -11.861 1.00 15.34 N ATOM 853 CA ALA A 229 3.587 6.347 -11.225 1.00 63.41 C ATOM 854 C ALA A 229 3.705 7.634 -10.406 1.00 12.41 C ATOM 855 O ALA A 229 3.658 8.736 -10.968 1.00 70.51 O ATOM 856 CB ALA A 229 4.690 6.274 -12.299 1.00 32.24 C ATOM 0 H ALA A 229 2.304 6.406 -12.874 1.00 15.34 H new ATOM 0 HA ALA A 229 3.708 5.494 -10.557 1.00 63.41 H new ATOM 0 HB1 ALA A 229 5.668 6.312 -11.819 1.00 32.24 H new ATOM 0 HB2 ALA A 229 4.595 5.342 -12.856 1.00 32.24 H new ATOM 0 HB3 ALA A 229 4.589 7.117 -12.983 1.00 32.24 H new ATOM 862 N GLY A 230 3.816 7.479 -9.082 1.00 14.04 N ATOM 863 CA GLY A 230 3.923 8.602 -8.154 1.00 63.22 C ATOM 864 C GLY A 230 2.641 8.849 -7.379 1.00 4.45 C ATOM 865 O GLY A 230 2.564 9.823 -6.624 1.00 23.54 O ATOM 0 H GLY A 230 3.834 6.567 -8.626 1.00 14.04 H new ATOM 0 HA2 GLY A 230 4.735 8.412 -7.453 1.00 63.22 H new ATOM 0 HA3 GLY A 230 4.186 9.502 -8.709 1.00 63.22 H new ATOM 869 N ARG A 231 1.621 7.970 -7.561 1.00 63.44 N ATOM 870 CA ARG A 231 0.401 7.998 -6.734 1.00 22.42 C ATOM 871 C ARG A 231 0.741 7.691 -5.260 1.00 34.35 C ATOM 872 O ARG A 231 1.722 6.999 -4.959 1.00 54.43 O ATOM 873 CB ARG A 231 -0.701 7.009 -7.250 1.00 71.24 C ATOM 874 CG ARG A 231 -1.796 7.646 -8.145 1.00 2.25 C ATOM 875 CD ARG A 231 -3.069 6.780 -8.191 1.00 74.10 C ATOM 876 NE ARG A 231 -4.146 7.392 -8.982 1.00 52.53 N ATOM 877 CZ ARG A 231 -5.333 6.820 -9.242 1.00 13.54 C ATOM 878 NH1 ARG A 231 -5.624 5.596 -8.786 1.00 25.31 N ATOM 879 NH2 ARG A 231 -6.222 7.467 -9.979 1.00 23.25 N ATOM 0 H ARG A 231 1.626 7.239 -8.272 1.00 63.44 H new ATOM 0 HA ARG A 231 -0.009 9.005 -6.811 1.00 22.42 H new ATOM 0 HB2 ARG A 231 -0.215 6.210 -7.811 1.00 71.24 H new ATOM 0 HB3 ARG A 231 -1.183 6.546 -6.389 1.00 71.24 H new ATOM 0 HG2 ARG A 231 -2.044 8.638 -7.767 1.00 2.25 H new ATOM 0 HG3 ARG A 231 -1.409 7.778 -9.155 1.00 2.25 H new ATOM 0 HD2 ARG A 231 -2.824 5.805 -8.612 1.00 74.10 H new ATOM 0 HD3 ARG A 231 -3.423 6.609 -7.175 1.00 74.10 H new ATOM 0 HE ARG A 231 -3.979 8.323 -9.363 1.00 52.53 H new ATOM 0 HH11 ARG A 231 -4.939 5.082 -8.231 1.00 25.31 H new ATOM 0 HH12 ARG A 231 -6.531 5.177 -8.993 1.00 25.31 H new ATOM 0 HH21 ARG A 231 -6.003 8.394 -10.345 1.00 23.25 H new ATOM 0 HH22 ARG A 231 -7.126 7.039 -10.181 1.00 23.25 H new ATOM 893 N LYS A 232 -0.087 8.210 -4.355 1.00 23.33 N ATOM 894 CA LYS A 232 0.083 8.041 -2.912 1.00 62.11 C ATOM 895 C LYS A 232 -1.094 7.239 -2.338 1.00 35.51 C ATOM 896 O LYS A 232 -2.263 7.511 -2.639 1.00 1.44 O ATOM 897 CB LYS A 232 0.247 9.430 -2.238 1.00 12.15 C ATOM 898 CG LYS A 232 -0.807 10.501 -2.616 1.00 43.15 C ATOM 899 CD LYS A 232 -0.489 11.889 -2.007 1.00 22.25 C ATOM 900 CE LYS A 232 -1.431 13.003 -2.482 1.00 60.41 C ATOM 901 NZ LYS A 232 -1.331 13.234 -3.950 1.00 65.32 N ATOM 0 H LYS A 232 -0.904 8.766 -4.606 1.00 23.33 H new ATOM 0 HA LYS A 232 0.989 7.472 -2.704 1.00 62.11 H new ATOM 0 HB2 LYS A 232 0.223 9.292 -1.157 1.00 12.15 H new ATOM 0 HB3 LYS A 232 1.235 9.818 -2.488 1.00 12.15 H new ATOM 0 HG2 LYS A 232 -0.859 10.588 -3.701 1.00 43.15 H new ATOM 0 HG3 LYS A 232 -1.790 10.175 -2.275 1.00 43.15 H new ATOM 0 HD2 LYS A 232 -0.542 11.820 -0.920 1.00 22.25 H new ATOM 0 HD3 LYS A 232 0.536 12.160 -2.260 1.00 22.25 H new ATOM 0 HE2 LYS A 232 -2.458 12.742 -2.226 1.00 60.41 H new ATOM 0 HE3 LYS A 232 -1.195 13.927 -1.953 1.00 60.41 H new ATOM 0 HZ1 LYS A 232 -1.865 14.089 -4.204 1.00 65.32 H new ATOM 0 HZ2 LYS A 232 -0.333 13.358 -4.215 1.00 65.32 H new ATOM 0 HZ3 LYS A 232 -1.725 12.416 -4.458 1.00 65.32 H new ATOM 915 N LEU A 233 -0.765 6.210 -1.552 1.00 61.24 N ATOM 916 CA LEU A 233 -1.733 5.361 -0.848 1.00 63.32 C ATOM 917 C LEU A 233 -1.443 5.465 0.647 1.00 25.31 C ATOM 918 O LEU A 233 -0.280 5.396 1.047 1.00 1.13 O ATOM 919 CB LEU A 233 -1.600 3.879 -1.317 1.00 33.33 C ATOM 920 CG LEU A 233 -1.868 3.602 -2.834 1.00 62.20 C ATOM 921 CD1 LEU A 233 -1.552 2.135 -3.200 1.00 4.52 C ATOM 922 CD2 LEU A 233 -3.312 3.975 -3.230 1.00 5.44 C ATOM 0 H LEU A 233 0.203 5.937 -1.383 1.00 61.24 H new ATOM 0 HA LEU A 233 -2.749 5.691 -1.064 1.00 63.32 H new ATOM 0 HB2 LEU A 233 -0.593 3.535 -1.080 1.00 33.33 H new ATOM 0 HB3 LEU A 233 -2.291 3.272 -0.732 1.00 33.33 H new ATOM 0 HG LEU A 233 -1.195 4.241 -3.406 1.00 62.20 H new ATOM 0 HD11 LEU A 233 -1.748 1.974 -4.260 1.00 4.52 H new ATOM 0 HD12 LEU A 233 -0.503 1.925 -2.989 1.00 4.52 H new ATOM 0 HD13 LEU A 233 -2.181 1.469 -2.609 1.00 4.52 H new ATOM 0 HD21 LEU A 233 -3.463 3.770 -4.290 1.00 5.44 H new ATOM 0 HD22 LEU A 233 -4.015 3.384 -2.642 1.00 5.44 H new ATOM 0 HD23 LEU A 233 -3.480 5.035 -3.038 1.00 5.44 H new ATOM 934 N ARG A 234 -2.478 5.676 1.464 1.00 23.24 N ATOM 935 CA ARG A 234 -2.364 5.598 2.922 1.00 5.24 C ATOM 936 C ARG A 234 -3.347 4.547 3.419 1.00 4.43 C ATOM 937 O ARG A 234 -4.568 4.750 3.372 1.00 62.10 O ATOM 938 CB ARG A 234 -2.605 6.971 3.608 1.00 15.12 C ATOM 939 CG ARG A 234 -2.412 6.943 5.148 1.00 73.13 C ATOM 940 CD ARG A 234 -2.425 8.339 5.793 1.00 3.12 C ATOM 941 NE ARG A 234 -1.201 9.095 5.494 1.00 44.33 N ATOM 942 CZ ARG A 234 -0.207 9.342 6.371 1.00 13.13 C ATOM 943 NH1 ARG A 234 -0.269 8.904 7.628 1.00 1.44 N ATOM 944 NH2 ARG A 234 0.845 10.039 5.973 1.00 11.54 N ATOM 0 H ARG A 234 -3.416 5.905 1.134 1.00 23.24 H new ATOM 0 HA ARG A 234 -1.346 5.312 3.186 1.00 5.24 H new ATOM 0 HB2 ARG A 234 -1.924 7.706 3.179 1.00 15.12 H new ATOM 0 HB3 ARG A 234 -3.618 7.306 3.384 1.00 15.12 H new ATOM 0 HG2 ARG A 234 -3.201 6.338 5.594 1.00 73.13 H new ATOM 0 HG3 ARG A 234 -1.466 6.454 5.379 1.00 73.13 H new ATOM 0 HD2 ARG A 234 -3.291 8.896 5.435 1.00 3.12 H new ATOM 0 HD3 ARG A 234 -2.534 8.238 6.873 1.00 3.12 H new ATOM 0 HE ARG A 234 -1.095 9.462 4.548 1.00 44.33 H new ATOM 0 HH11 ARG A 234 -1.079 8.371 7.943 1.00 1.44 H new ATOM 0 HH12 ARG A 234 0.494 9.102 8.275 1.00 1.44 H new ATOM 0 HH21 ARG A 234 0.896 10.382 5.014 1.00 11.54 H new ATOM 0 HH22 ARG A 234 1.604 10.234 6.626 1.00 11.54 H new ATOM 958 N LEU A 235 -2.793 3.407 3.825 1.00 15.53 N ATOM 959 CA LEU A 235 -3.529 2.314 4.452 1.00 11.51 C ATOM 960 C LEU A 235 -3.820 2.730 5.906 1.00 14.23 C ATOM 961 O LEU A 235 -3.053 2.405 6.828 1.00 34.25 O ATOM 962 CB LEU A 235 -2.660 1.024 4.359 1.00 2.45 C ATOM 963 CG LEU A 235 -2.050 0.723 2.940 1.00 33.41 C ATOM 964 CD1 LEU A 235 -0.945 -0.327 3.010 1.00 10.01 C ATOM 965 CD2 LEU A 235 -3.113 0.306 1.922 1.00 51.41 C ATOM 0 H LEU A 235 -1.797 3.214 3.724 1.00 15.53 H new ATOM 0 HA LEU A 235 -4.478 2.106 3.958 1.00 11.51 H new ATOM 0 HB2 LEU A 235 -1.844 1.103 5.077 1.00 2.45 H new ATOM 0 HB3 LEU A 235 -3.270 0.173 4.662 1.00 2.45 H new ATOM 0 HG LEU A 235 -1.613 1.661 2.596 1.00 33.41 H new ATOM 0 HD11 LEU A 235 -0.550 -0.507 2.010 1.00 10.01 H new ATOM 0 HD12 LEU A 235 -0.144 0.030 3.658 1.00 10.01 H new ATOM 0 HD13 LEU A 235 -1.350 -1.256 3.412 1.00 10.01 H new ATOM 0 HD21 LEU A 235 -2.639 0.110 0.960 1.00 51.41 H new ATOM 0 HD22 LEU A 235 -3.615 -0.597 2.269 1.00 51.41 H new ATOM 0 HD23 LEU A 235 -3.843 1.107 1.810 1.00 51.41 H new ATOM 977 N LYS A 236 -4.896 3.522 6.074 1.00 55.25 N ATOM 978 CA LYS A 236 -5.255 4.139 7.357 1.00 34.35 C ATOM 979 C LYS A 236 -5.771 3.087 8.338 1.00 64.40 C ATOM 980 O LYS A 236 -6.600 2.239 7.969 1.00 1.13 O ATOM 981 CB LYS A 236 -6.304 5.266 7.165 1.00 63.25 C ATOM 982 CG LYS A 236 -5.829 6.433 6.281 1.00 14.34 C ATOM 983 CD LYS A 236 -6.815 7.622 6.273 1.00 72.40 C ATOM 984 CE LYS A 236 -6.319 8.799 5.413 1.00 35.30 C ATOM 985 NZ LYS A 236 -7.279 9.938 5.411 1.00 11.21 N ATOM 0 H LYS A 236 -5.541 3.750 5.318 1.00 55.25 H new ATOM 0 HA LYS A 236 -4.353 4.587 7.774 1.00 34.35 H new ATOM 0 HB2 LYS A 236 -7.204 4.837 6.726 1.00 63.25 H new ATOM 0 HB3 LYS A 236 -6.582 5.657 8.144 1.00 63.25 H new ATOM 0 HG2 LYS A 236 -4.856 6.777 6.634 1.00 14.34 H new ATOM 0 HG3 LYS A 236 -5.690 6.076 5.261 1.00 14.34 H new ATOM 0 HD2 LYS A 236 -7.781 7.285 5.898 1.00 72.40 H new ATOM 0 HD3 LYS A 236 -6.972 7.965 7.296 1.00 72.40 H new ATOM 0 HE2 LYS A 236 -5.354 9.140 5.788 1.00 35.30 H new ATOM 0 HE3 LYS A 236 -6.160 8.458 4.390 1.00 35.30 H new ATOM 0 HZ1 LYS A 236 -6.904 10.707 4.820 1.00 11.21 H new ATOM 0 HZ2 LYS A 236 -8.193 9.621 5.028 1.00 11.21 H new ATOM 0 HZ3 LYS A 236 -7.411 10.282 6.383 1.00 11.21 H new ATOM 999 N GLY A 237 -5.252 3.144 9.577 1.00 23.23 N ATOM 1000 CA GLY A 237 -5.590 2.176 10.610 1.00 61.11 C ATOM 1001 C GLY A 237 -5.112 0.772 10.273 1.00 5.32 C ATOM 1002 O GLY A 237 -5.699 -0.206 10.737 1.00 41.55 O ATOM 0 H GLY A 237 -4.592 3.861 9.879 1.00 23.23 H new ATOM 0 HA2 GLY A 237 -5.148 2.490 11.556 1.00 61.11 H new ATOM 0 HA3 GLY A 237 -6.671 2.164 10.752 1.00 61.11 H new ATOM 1006 N LYS A 238 -4.036 0.681 9.447 1.00 25.23 N ATOM 1007 CA LYS A 238 -3.469 -0.599 8.963 1.00 14.44 C ATOM 1008 C LYS A 238 -1.918 -0.530 8.884 1.00 31.13 C ATOM 1009 O LYS A 238 -1.308 -1.124 7.997 1.00 53.11 O ATOM 1010 CB LYS A 238 -4.083 -0.996 7.572 1.00 52.44 C ATOM 1011 CG LYS A 238 -5.611 -1.274 7.565 1.00 35.21 C ATOM 1012 CD LYS A 238 -6.012 -2.489 8.448 1.00 75.35 C ATOM 1013 CE LYS A 238 -5.384 -3.830 8.014 1.00 24.11 C ATOM 1014 NZ LYS A 238 -6.006 -4.364 6.778 1.00 23.22 N ATOM 0 H LYS A 238 -3.538 1.500 9.099 1.00 25.23 H new ATOM 0 HA LYS A 238 -3.734 -1.374 9.683 1.00 14.44 H new ATOM 0 HB2 LYS A 238 -3.875 -0.196 6.862 1.00 52.44 H new ATOM 0 HB3 LYS A 238 -3.569 -1.886 7.209 1.00 52.44 H new ATOM 0 HG2 LYS A 238 -6.138 -0.387 7.917 1.00 35.21 H new ATOM 0 HG3 LYS A 238 -5.937 -1.453 6.541 1.00 35.21 H new ATOM 0 HD2 LYS A 238 -5.723 -2.284 9.479 1.00 75.35 H new ATOM 0 HD3 LYS A 238 -7.097 -2.589 8.435 1.00 75.35 H new ATOM 0 HE2 LYS A 238 -4.315 -3.693 7.851 1.00 24.11 H new ATOM 0 HE3 LYS A 238 -5.493 -4.558 8.818 1.00 24.11 H new ATOM 0 HZ1 LYS A 238 -5.395 -5.102 6.373 1.00 23.22 H new ATOM 0 HZ2 LYS A 238 -6.936 -4.771 7.005 1.00 23.22 H new ATOM 0 HZ3 LYS A 238 -6.124 -3.595 6.088 1.00 23.22 H new ATOM 1028 N GLY A 239 -1.290 0.164 9.848 1.00 32.40 N ATOM 1029 CA GLY A 239 0.183 0.237 9.952 1.00 45.23 C ATOM 1030 C GLY A 239 0.734 -0.702 11.020 1.00 43.44 C ATOM 1031 O GLY A 239 0.680 -1.921 10.845 1.00 3.41 O ATOM 0 H GLY A 239 -1.781 0.687 10.573 1.00 32.40 H new ATOM 0 HA2 GLY A 239 0.626 -0.013 8.988 1.00 45.23 H new ATOM 0 HA3 GLY A 239 0.479 1.260 10.183 1.00 45.23 H new ATOM 1035 N PHE A 240 1.275 -0.129 12.121 1.00 3.42 N ATOM 1036 CA PHE A 240 1.735 -0.901 13.306 1.00 44.04 C ATOM 1037 C PHE A 240 0.549 -1.640 13.966 1.00 64.41 C ATOM 1038 O PHE A 240 -0.489 -1.010 14.167 1.00 61.31 O ATOM 1039 CB PHE A 240 2.409 0.043 14.360 1.00 71.23 C ATOM 1040 CG PHE A 240 3.935 0.042 14.352 1.00 61.31 C ATOM 1041 CD1 PHE A 240 4.643 0.375 13.203 1.00 25.44 C ATOM 1042 CD2 PHE A 240 4.659 -0.292 15.501 1.00 24.11 C ATOM 1043 CE1 PHE A 240 6.023 0.384 13.205 1.00 32.02 C ATOM 1044 CE2 PHE A 240 6.038 -0.284 15.498 1.00 14.31 C ATOM 1045 CZ PHE A 240 6.721 0.049 14.351 1.00 60.25 C ATOM 0 H PHE A 240 1.406 0.878 12.215 1.00 3.42 H new ATOM 0 HA PHE A 240 2.468 -1.631 12.963 1.00 44.04 H new ATOM 0 HB2 PHE A 240 2.061 1.061 14.186 1.00 71.23 H new ATOM 0 HB3 PHE A 240 2.067 -0.246 15.354 1.00 71.23 H new ATOM 0 HD1 PHE A 240 4.108 0.629 12.300 1.00 25.44 H new ATOM 0 HD2 PHE A 240 4.130 -0.560 16.404 1.00 24.11 H new ATOM 0 HE1 PHE A 240 6.560 0.654 12.308 1.00 32.02 H new ATOM 0 HE2 PHE A 240 6.582 -0.539 16.396 1.00 14.31 H new ATOM 0 HZ PHE A 240 7.801 0.049 14.346 1.00 60.25 H new ATOM 1055 N PRO A 241 0.699 -2.965 14.323 1.00 14.25 N ATOM 1056 CA PRO A 241 -0.369 -3.751 15.002 1.00 61.04 C ATOM 1057 C PRO A 241 -0.728 -3.169 16.396 1.00 31.20 C ATOM 1058 O PRO A 241 0.164 -2.892 17.216 1.00 70.44 O ATOM 1059 CB PRO A 241 0.239 -5.186 15.106 1.00 1.34 C ATOM 1060 CG PRO A 241 1.721 -4.980 15.025 1.00 1.31 C ATOM 1061 CD PRO A 241 1.910 -3.810 14.081 1.00 54.14 C ATOM 0 HA PRO A 241 -1.311 -3.733 14.454 1.00 61.04 H new ATOM 0 HB2 PRO A 241 -0.043 -5.668 16.042 1.00 1.34 H new ATOM 0 HB3 PRO A 241 -0.116 -5.826 14.298 1.00 1.34 H new ATOM 0 HG2 PRO A 241 2.143 -4.765 16.007 1.00 1.31 H new ATOM 0 HG3 PRO A 241 2.222 -5.873 14.651 1.00 1.31 H new ATOM 0 HD2 PRO A 241 2.829 -3.265 14.297 1.00 54.14 H new ATOM 0 HD3 PRO A 241 1.970 -4.138 13.043 1.00 54.14 H new ATOM 1069 N GLY A 242 -2.036 -2.980 16.634 1.00 25.21 N ATOM 1070 CA GLY A 242 -2.542 -2.448 17.894 1.00 61.41 C ATOM 1071 C GLY A 242 -4.055 -2.658 18.023 1.00 13.25 C ATOM 1072 O GLY A 242 -4.795 -2.221 17.130 1.00 55.24 O ATOM 0 H GLY A 242 -2.766 -3.194 15.954 1.00 25.21 H new ATOM 0 HA2 GLY A 242 -2.033 -2.934 18.726 1.00 61.41 H new ATOM 0 HA3 GLY A 242 -2.314 -1.384 17.959 1.00 61.41 H new ATOM 1076 N PRO A 243 -4.558 -3.329 19.122 1.00 63.52 N ATOM 1077 CA PRO A 243 -6.009 -3.642 19.306 1.00 44.01 C ATOM 1078 C PRO A 243 -6.880 -2.384 19.558 1.00 55.42 C ATOM 1079 O PRO A 243 -8.079 -2.388 19.255 1.00 21.43 O ATOM 1080 CB PRO A 243 -6.013 -4.597 20.536 1.00 34.14 C ATOM 1081 CG PRO A 243 -4.777 -4.237 21.300 1.00 32.24 C ATOM 1082 CD PRO A 243 -3.746 -3.852 20.258 1.00 44.22 C ATOM 0 HA PRO A 243 -6.447 -4.082 18.410 1.00 44.01 H new ATOM 0 HB2 PRO A 243 -6.908 -4.458 21.142 1.00 34.14 H new ATOM 0 HB3 PRO A 243 -5.997 -5.642 20.226 1.00 34.14 H new ATOM 0 HG2 PRO A 243 -4.967 -3.411 21.986 1.00 32.24 H new ATOM 0 HG3 PRO A 243 -4.430 -5.077 21.902 1.00 32.24 H new ATOM 0 HD2 PRO A 243 -3.058 -3.097 20.638 1.00 44.22 H new ATOM 0 HD3 PRO A 243 -3.144 -4.709 19.957 1.00 44.22 H new ATOM 1090 N ALA A 244 -6.265 -1.325 20.126 1.00 32.21 N ATOM 1091 CA ALA A 244 -6.946 -0.037 20.399 1.00 13.44 C ATOM 1092 C ALA A 244 -7.016 0.831 19.132 1.00 44.45 C ATOM 1093 O ALA A 244 -7.896 1.690 19.007 1.00 40.12 O ATOM 1094 CB ALA A 244 -6.218 0.718 21.526 1.00 71.00 C ATOM 0 H ALA A 244 -5.285 -1.336 20.408 1.00 32.21 H new ATOM 0 HA ALA A 244 -7.966 -0.251 20.717 1.00 13.44 H new ATOM 0 HB1 ALA A 244 -6.726 1.663 21.719 1.00 71.00 H new ATOM 0 HB2 ALA A 244 -6.223 0.112 22.432 1.00 71.00 H new ATOM 0 HB3 ALA A 244 -5.189 0.914 21.226 1.00 71.00 H new ATOM 1100 N GLY A 245 -6.066 0.601 18.212 1.00 61.22 N ATOM 1101 CA GLY A 245 -5.973 1.350 16.967 1.00 3.21 C ATOM 1102 C GLY A 245 -4.598 1.207 16.341 1.00 35.33 C ATOM 1103 O GLY A 245 -3.595 1.592 16.955 1.00 70.52 O ATOM 0 H GLY A 245 -5.344 -0.112 18.319 1.00 61.22 H new ATOM 0 HA2 GLY A 245 -6.732 0.996 16.269 1.00 3.21 H new ATOM 0 HA3 GLY A 245 -6.181 2.403 17.157 1.00 3.21 H new ATOM 1107 N ARG A 246 -4.559 0.626 15.133 1.00 21.14 N ATOM 1108 CA ARG A 246 -3.328 0.472 14.341 1.00 60.31 C ATOM 1109 C ARG A 246 -2.837 1.847 13.829 1.00 62.03 C ATOM 1110 O ARG A 246 -3.596 2.825 13.825 1.00 13.44 O ATOM 1111 CB ARG A 246 -3.586 -0.468 13.119 1.00 64.35 C ATOM 1112 CG ARG A 246 -3.369 -1.974 13.374 1.00 75.41 C ATOM 1113 CD ARG A 246 -3.405 -2.797 12.068 1.00 1.40 C ATOM 1114 NE ARG A 246 -2.985 -4.193 12.278 1.00 4.43 N ATOM 1115 CZ ARG A 246 -1.884 -4.758 11.750 1.00 25.21 C ATOM 1116 NH1 ARG A 246 -1.057 -4.062 10.979 1.00 24.03 N ATOM 1117 NH2 ARG A 246 -1.603 -6.021 12.014 1.00 75.21 N ATOM 0 H ARG A 246 -5.387 0.247 14.674 1.00 21.14 H new ATOM 0 HA ARG A 246 -2.564 0.034 14.983 1.00 60.31 H new ATOM 0 HB2 ARG A 246 -4.612 -0.320 12.781 1.00 64.35 H new ATOM 0 HB3 ARG A 246 -2.933 -0.159 12.303 1.00 64.35 H new ATOM 0 HG2 ARG A 246 -2.409 -2.123 13.869 1.00 75.41 H new ATOM 0 HG3 ARG A 246 -4.138 -2.340 14.054 1.00 75.41 H new ATOM 0 HD2 ARG A 246 -4.415 -2.781 11.658 1.00 1.40 H new ATOM 0 HD3 ARG A 246 -2.754 -2.331 11.329 1.00 1.40 H new ATOM 0 HE ARG A 246 -3.575 -4.777 12.870 1.00 4.43 H new ATOM 0 HH11 ARG A 246 -1.251 -3.081 10.778 1.00 24.03 H new ATOM 0 HH12 ARG A 246 -0.227 -4.508 10.588 1.00 24.03 H new ATOM 0 HH21 ARG A 246 -2.220 -6.565 12.617 1.00 75.21 H new ATOM 0 HH22 ARG A 246 -0.769 -6.452 11.615 1.00 75.21 H new ATOM 1131 N GLY A 247 -1.575 1.885 13.368 1.00 74.32 N ATOM 1132 CA GLY A 247 -1.029 3.076 12.698 1.00 25.34 C ATOM 1133 C GLY A 247 -1.458 3.169 11.240 1.00 53.33 C ATOM 1134 O GLY A 247 -2.469 2.584 10.847 1.00 63.40 O ATOM 0 H GLY A 247 -0.918 1.109 13.447 1.00 74.32 H new ATOM 0 HA2 GLY A 247 -1.357 3.970 13.228 1.00 25.34 H new ATOM 0 HA3 GLY A 247 0.059 3.054 12.753 1.00 25.34 H new ATOM 1138 N ASP A 248 -0.704 3.913 10.427 1.00 44.21 N ATOM 1139 CA ASP A 248 -0.926 3.978 8.963 1.00 73.31 C ATOM 1140 C ASP A 248 0.283 3.388 8.252 1.00 34.53 C ATOM 1141 O ASP A 248 1.379 3.366 8.805 1.00 5.22 O ATOM 1142 CB ASP A 248 -1.153 5.445 8.483 1.00 41.11 C ATOM 1143 CG ASP A 248 -2.377 6.154 9.101 1.00 55.34 C ATOM 1144 OD1 ASP A 248 -3.269 5.489 9.670 1.00 75.51 O ATOM 1145 OD2 ASP A 248 -2.462 7.394 8.996 1.00 23.01 O ATOM 0 H ASP A 248 0.074 4.487 10.752 1.00 44.21 H new ATOM 0 HA ASP A 248 -1.823 3.407 8.724 1.00 73.31 H new ATOM 0 HB2 ASP A 248 -0.261 6.028 8.712 1.00 41.11 H new ATOM 0 HB3 ASP A 248 -1.263 5.443 7.399 1.00 41.11 H new ATOM 1150 N LEU A 249 0.070 2.868 7.041 1.00 63.05 N ATOM 1151 CA LEU A 249 1.157 2.419 6.158 1.00 23.21 C ATOM 1152 C LEU A 249 1.033 3.172 4.828 1.00 42.31 C ATOM 1153 O LEU A 249 0.117 2.929 4.040 1.00 0.43 O ATOM 1154 CB LEU A 249 1.111 0.881 5.975 1.00 52.13 C ATOM 1155 CG LEU A 249 2.123 0.256 4.946 1.00 30.14 C ATOM 1156 CD1 LEU A 249 3.592 0.591 5.280 1.00 40.41 C ATOM 1157 CD2 LEU A 249 1.908 -1.269 4.831 1.00 2.11 C ATOM 0 H LEU A 249 -0.860 2.745 6.642 1.00 63.05 H new ATOM 0 HA LEU A 249 2.129 2.643 6.598 1.00 23.21 H new ATOM 0 HB2 LEU A 249 1.286 0.418 6.946 1.00 52.13 H new ATOM 0 HB3 LEU A 249 0.102 0.606 5.668 1.00 52.13 H new ATOM 0 HG LEU A 249 1.917 0.710 3.977 1.00 30.14 H new ATOM 0 HD11 LEU A 249 4.247 0.135 4.538 1.00 40.41 H new ATOM 0 HD12 LEU A 249 3.730 1.672 5.270 1.00 40.41 H new ATOM 0 HD13 LEU A 249 3.838 0.203 6.268 1.00 40.41 H new ATOM 0 HD21 LEU A 249 2.617 -1.683 4.115 1.00 2.11 H new ATOM 0 HD22 LEU A 249 2.063 -1.733 5.805 1.00 2.11 H new ATOM 0 HD23 LEU A 249 0.891 -1.469 4.492 1.00 2.11 H new ATOM 1169 N TYR A 250 1.957 4.110 4.615 1.00 34.10 N ATOM 1170 CA TYR A 250 1.929 5.035 3.486 1.00 64.31 C ATOM 1171 C TYR A 250 2.830 4.488 2.370 1.00 23.31 C ATOM 1172 O TYR A 250 4.061 4.489 2.499 1.00 32.23 O ATOM 1173 CB TYR A 250 2.399 6.436 3.959 1.00 40.45 C ATOM 1174 CG TYR A 250 2.032 7.586 3.009 1.00 24.32 C ATOM 1175 CD1 TYR A 250 0.706 7.981 2.874 1.00 43.30 C ATOM 1176 CD2 TYR A 250 2.991 8.282 2.272 1.00 33.22 C ATOM 1177 CE1 TYR A 250 0.345 9.022 2.058 1.00 54.11 C ATOM 1178 CE2 TYR A 250 2.629 9.325 1.447 1.00 0.32 C ATOM 1179 CZ TYR A 250 1.307 9.690 1.348 1.00 0.14 C ATOM 1180 OH TYR A 250 0.952 10.746 0.555 1.00 71.15 O ATOM 0 H TYR A 250 2.757 4.249 5.232 1.00 34.10 H new ATOM 0 HA TYR A 250 0.916 5.132 3.095 1.00 64.31 H new ATOM 0 HB2 TYR A 250 1.966 6.639 4.939 1.00 40.45 H new ATOM 0 HB3 TYR A 250 3.481 6.418 4.086 1.00 40.45 H new ATOM 0 HD1 TYR A 250 -0.059 7.455 3.426 1.00 43.30 H new ATOM 0 HD2 TYR A 250 4.031 8.000 2.349 1.00 33.22 H new ATOM 0 HE1 TYR A 250 -0.692 9.313 1.976 1.00 54.11 H new ATOM 0 HE2 TYR A 250 3.381 9.854 0.880 1.00 0.32 H new ATOM 0 HH TYR A 250 1.751 11.112 0.120 1.00 71.15 H new ATOM 1190 N LEU A 251 2.201 4.002 1.292 1.00 1.24 N ATOM 1191 CA LEU A 251 2.890 3.379 0.159 1.00 33.52 C ATOM 1192 C LEU A 251 2.943 4.337 -1.033 1.00 20.51 C ATOM 1193 O LEU A 251 1.904 4.785 -1.533 1.00 15.32 O ATOM 1194 CB LEU A 251 2.185 2.057 -0.211 1.00 12.41 C ATOM 1195 CG LEU A 251 2.399 0.898 0.806 1.00 11.33 C ATOM 1196 CD1 LEU A 251 1.552 -0.313 0.425 1.00 71.54 C ATOM 1197 CD2 LEU A 251 3.895 0.517 0.931 1.00 73.02 C ATOM 0 H LEU A 251 1.187 4.032 1.183 1.00 1.24 H new ATOM 0 HA LEU A 251 3.918 3.155 0.442 1.00 33.52 H new ATOM 0 HB2 LEU A 251 1.116 2.246 -0.306 1.00 12.41 H new ATOM 0 HB3 LEU A 251 2.540 1.733 -1.190 1.00 12.41 H new ATOM 0 HG LEU A 251 2.073 1.249 1.785 1.00 11.33 H new ATOM 0 HD11 LEU A 251 1.715 -1.113 1.147 1.00 71.54 H new ATOM 0 HD12 LEU A 251 0.498 -0.034 0.424 1.00 71.54 H new ATOM 0 HD13 LEU A 251 1.837 -0.658 -0.569 1.00 71.54 H new ATOM 0 HD21 LEU A 251 4.005 -0.295 1.650 1.00 73.02 H new ATOM 0 HD22 LEU A 251 4.271 0.195 -0.040 1.00 73.02 H new ATOM 0 HD23 LEU A 251 4.464 1.382 1.272 1.00 73.02 H new ATOM 1209 N GLU A 252 4.170 4.646 -1.462 1.00 3.42 N ATOM 1210 CA GLU A 252 4.444 5.507 -2.614 1.00 73.45 C ATOM 1211 C GLU A 252 4.513 4.627 -3.874 1.00 2.22 C ATOM 1212 O GLU A 252 5.503 3.911 -4.068 1.00 13.54 O ATOM 1213 CB GLU A 252 5.795 6.245 -2.395 1.00 41.22 C ATOM 1214 CG GLU A 252 5.967 6.872 -0.984 1.00 40.41 C ATOM 1215 CD GLU A 252 7.392 7.376 -0.714 1.00 71.30 C ATOM 1216 OE1 GLU A 252 8.348 6.639 -1.027 1.00 63.43 O ATOM 1217 OE2 GLU A 252 7.571 8.494 -0.183 1.00 51.23 O ATOM 0 H GLU A 252 5.015 4.298 -1.010 1.00 3.42 H new ATOM 0 HA GLU A 252 3.656 6.251 -2.732 1.00 73.45 H new ATOM 0 HB2 GLU A 252 6.610 5.542 -2.568 1.00 41.22 H new ATOM 0 HB3 GLU A 252 5.889 7.033 -3.142 1.00 41.22 H new ATOM 0 HG2 GLU A 252 5.269 7.702 -0.875 1.00 40.41 H new ATOM 0 HG3 GLU A 252 5.702 6.131 -0.230 1.00 40.41 H new ATOM 1224 N VAL A 253 3.443 4.657 -4.686 1.00 10.43 N ATOM 1225 CA VAL A 253 3.332 3.862 -5.921 1.00 13.23 C ATOM 1226 C VAL A 253 4.484 4.180 -6.893 1.00 4.23 C ATOM 1227 O VAL A 253 4.641 5.319 -7.342 1.00 41.12 O ATOM 1228 CB VAL A 253 1.953 4.104 -6.643 1.00 53.14 C ATOM 1229 CG1 VAL A 253 1.889 3.392 -8.018 1.00 73.51 C ATOM 1230 CG2 VAL A 253 0.778 3.673 -5.731 1.00 31.22 C ATOM 0 H VAL A 253 2.625 5.238 -4.503 1.00 10.43 H new ATOM 0 HA VAL A 253 3.393 2.814 -5.629 1.00 13.23 H new ATOM 0 HB VAL A 253 1.863 5.173 -6.835 1.00 53.14 H new ATOM 0 HG11 VAL A 253 0.922 3.584 -8.483 1.00 73.51 H new ATOM 0 HG12 VAL A 253 2.683 3.772 -8.662 1.00 73.51 H new ATOM 0 HG13 VAL A 253 2.017 2.319 -7.878 1.00 73.51 H new ATOM 0 HG21 VAL A 253 -0.166 3.848 -6.247 1.00 31.22 H new ATOM 0 HG22 VAL A 253 0.871 2.613 -5.494 1.00 31.22 H new ATOM 0 HG23 VAL A 253 0.801 4.254 -4.809 1.00 31.22 H new ATOM 1240 N ARG A 254 5.303 3.163 -7.159 1.00 64.32 N ATOM 1241 CA ARG A 254 6.370 3.199 -8.161 1.00 52.34 C ATOM 1242 C ARG A 254 6.043 2.149 -9.233 1.00 20.03 C ATOM 1243 O ARG A 254 6.126 0.941 -8.960 1.00 23.12 O ATOM 1244 CB ARG A 254 7.748 2.895 -7.500 1.00 45.14 C ATOM 1245 CG ARG A 254 8.044 3.706 -6.216 1.00 31.14 C ATOM 1246 CD ARG A 254 8.039 5.236 -6.417 1.00 62.15 C ATOM 1247 NE ARG A 254 8.221 5.952 -5.142 1.00 72.32 N ATOM 1248 CZ ARG A 254 8.642 7.221 -5.018 1.00 60.30 C ATOM 1249 NH1 ARG A 254 8.938 7.955 -6.093 1.00 31.34 N ATOM 1250 NH2 ARG A 254 8.789 7.746 -3.808 1.00 13.05 N ATOM 0 H ARG A 254 5.242 2.269 -6.672 1.00 64.32 H new ATOM 0 HA ARG A 254 6.433 4.190 -8.611 1.00 52.34 H new ATOM 0 HB2 ARG A 254 7.794 1.833 -7.261 1.00 45.14 H new ATOM 0 HB3 ARG A 254 8.536 3.092 -8.227 1.00 45.14 H new ATOM 0 HG2 ARG A 254 7.304 3.448 -5.459 1.00 31.14 H new ATOM 0 HG3 ARG A 254 9.017 3.405 -5.826 1.00 31.14 H new ATOM 0 HD2 ARG A 254 8.834 5.515 -7.108 1.00 62.15 H new ATOM 0 HD3 ARG A 254 7.098 5.540 -6.874 1.00 62.15 H new ATOM 0 HE ARG A 254 8.010 5.442 -4.284 1.00 72.32 H new ATOM 0 HH11 ARG A 254 8.846 7.553 -7.026 1.00 31.34 H new ATOM 0 HH12 ARG A 254 9.257 8.918 -5.981 1.00 31.34 H new ATOM 0 HH21 ARG A 254 8.583 7.186 -2.981 1.00 13.05 H new ATOM 0 HH22 ARG A 254 9.108 8.709 -3.705 1.00 13.05 H new ATOM 1264 N ILE A 255 5.626 2.611 -10.429 1.00 10.40 N ATOM 1265 CA ILE A 255 5.368 1.730 -11.575 1.00 44.44 C ATOM 1266 C ILE A 255 6.715 1.283 -12.196 1.00 4.32 C ATOM 1267 O ILE A 255 7.637 2.094 -12.376 1.00 4.13 O ATOM 1268 CB ILE A 255 4.438 2.411 -12.660 1.00 22.14 C ATOM 1269 CG1 ILE A 255 3.001 2.650 -12.082 1.00 14.10 C ATOM 1270 CG2 ILE A 255 4.375 1.577 -13.969 1.00 51.54 C ATOM 1271 CD1 ILE A 255 1.996 3.206 -13.078 1.00 64.22 C ATOM 0 H ILE A 255 5.461 3.599 -10.622 1.00 10.40 H new ATOM 0 HA ILE A 255 4.828 0.855 -11.214 1.00 44.44 H new ATOM 0 HB ILE A 255 4.877 3.377 -12.911 1.00 22.14 H new ATOM 0 HG12 ILE A 255 2.620 1.706 -11.692 1.00 14.10 H new ATOM 0 HG13 ILE A 255 3.074 3.337 -11.239 1.00 14.10 H new ATOM 0 HG21 ILE A 255 3.727 2.078 -14.688 1.00 51.54 H new ATOM 0 HG22 ILE A 255 5.377 1.481 -14.388 1.00 51.54 H new ATOM 0 HG23 ILE A 255 3.977 0.586 -13.750 1.00 51.54 H new ATOM 0 HD11 ILE A 255 1.032 3.338 -12.587 1.00 64.22 H new ATOM 0 HD12 ILE A 255 2.348 4.168 -13.451 1.00 64.22 H new ATOM 0 HD13 ILE A 255 1.887 2.512 -13.911 1.00 64.22 H new ATOM 1283 N THR A 256 6.802 -0.019 -12.503 1.00 22.30 N ATOM 1284 CA THR A 256 8.007 -0.675 -13.033 1.00 34.21 C ATOM 1285 C THR A 256 7.601 -1.733 -14.111 1.00 62.41 C ATOM 1286 O THR A 256 6.396 -1.797 -14.472 1.00 43.00 O ATOM 1287 CB THR A 256 8.823 -1.308 -11.842 1.00 1.12 C ATOM 1288 OG1 THR A 256 10.086 -1.815 -12.302 1.00 30.33 O ATOM 1289 CG2 THR A 256 8.049 -2.432 -11.127 1.00 31.33 C ATOM 1290 OXT THR A 256 8.477 -2.475 -14.613 1.00 37.50 O ATOM 0 H THR A 256 6.018 -0.661 -12.387 1.00 22.30 H new ATOM 0 HA THR A 256 8.653 0.053 -13.524 1.00 34.21 H new ATOM 0 HB THR A 256 8.989 -0.507 -11.122 1.00 1.12 H new ATOM 0 HG1 THR A 256 9.975 -2.210 -13.192 1.00 30.33 H new ATOM 0 HG21 THR A 256 8.656 -2.833 -10.316 1.00 31.33 H new ATOM 0 HG22 THR A 256 7.120 -2.033 -10.721 1.00 31.33 H new ATOM 0 HG23 THR A 256 7.823 -3.227 -11.838 1.00 31.33 H new