USER MOD reduce.3.24.130724 H: found=0, std=0, add=597, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 598 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 92 LYS NZ :NH3+ 174:sc= 1.2 (180deg=0) USER MOD Set 1.2: B 194 GLN : amide:sc= 1.07 K(o=2.3,f=-2.9) USER MOD Single : A 85 TYR OH : rot -30:sc= 1.08 USER MOD Single : A 86 ASN : amide:sc= -0.269 X(o=-0.27,f=-0.33) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 160 SER OG : rot -88:sc= 0.399 USER MOD Single : B 168 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 170 THR OG1 : rot 86:sc= 1.21 USER MOD Single : B 172 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 177 ASN : amide:sc= 0.74 K(o=0.74,f=-0.23) USER MOD Single : B 180 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 183 THR OG1 : rot -137:sc= 0.374 USER MOD Single : B 184 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 186 MET CE :methyl 177:sc= -0.119 (180deg=-0.141) USER MOD Single : B 187 GLN : amide:sc= -0.138 X(o=-0.14,f=-0.37) USER MOD Single : B 188 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.252) USER MOD Single : B 190 GLN : amide:sc= 0.974 K(o=0.97,f=0) USER MOD Single : B 192 ASN : amide:sc= 1.42 K(o=1.4,f=-4.5!) USER MOD Single : B 193 TYR OH : rot 180:sc= 0 USER MOD Single : B 201 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 202 HIS : no HD1:sc= -0.0516 K(o=-0.052,f=-1.4) USER MOD Single : B 203 SER OG : rot 180:sc= 0.0148 USER MOD Single : B 206 ASN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : B 207 TYR OH : rot 100:sc= -0.11 USER MOD Single : B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : B 210 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 214 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 215 TYR OH : rot 180:sc= 0 USER MOD Single : B 216 THR OG1 : rot 27:sc= 0.0308 USER MOD ----------------------------------------------------------------- ATOM 131 N GLU A 80 -10.708 -12.219 2.372 1.00 0.00 N ATOM 132 CA GLU A 80 -10.392 -10.959 1.723 1.00 0.00 C ATOM 133 C GLU A 80 -9.637 -10.062 2.693 1.00 0.00 C ATOM 134 O GLU A 80 -8.713 -9.375 2.268 1.00 0.00 O ATOM 135 CB GLU A 80 -11.642 -10.246 1.174 1.00 0.00 C ATOM 136 CG GLU A 80 -12.779 -11.177 0.729 1.00 0.00 C ATOM 137 CD GLU A 80 -13.788 -11.366 1.863 1.00 0.00 C ATOM 138 OE1 GLU A 80 -13.460 -12.059 2.850 1.00 0.00 O ATOM 139 OE2 GLU A 80 -14.904 -10.797 1.775 1.00 0.00 O ATOM 0 HA GLU A 80 -9.761 -11.178 0.861 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -12.024 -9.573 1.941 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -11.346 -9.628 0.326 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -13.279 -10.759 -0.145 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -12.371 -12.143 0.432 1.00 0.00 H new ATOM 146 N PHE A 81 -9.994 -10.068 3.985 1.00 0.00 N ATOM 147 CA PHE A 81 -9.286 -9.243 4.955 1.00 0.00 C ATOM 148 C PHE A 81 -7.855 -9.748 5.110 1.00 0.00 C ATOM 149 O PHE A 81 -6.928 -8.942 5.126 1.00 0.00 O ATOM 150 CB PHE A 81 -9.978 -9.233 6.324 1.00 0.00 C ATOM 151 CG PHE A 81 -11.087 -8.212 6.420 1.00 0.00 C ATOM 152 CD1 PHE A 81 -10.800 -6.859 6.154 1.00 0.00 C ATOM 153 CD2 PHE A 81 -12.389 -8.595 6.789 1.00 0.00 C ATOM 154 CE1 PHE A 81 -11.826 -5.907 6.187 1.00 0.00 C ATOM 155 CE2 PHE A 81 -13.406 -7.627 6.855 1.00 0.00 C ATOM 156 CZ PHE A 81 -13.136 -6.295 6.512 1.00 0.00 C ATOM 0 H PHE A 81 -10.755 -10.626 4.371 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.287 -8.220 4.578 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -10.386 -10.224 6.526 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -9.237 -9.030 7.097 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.789 -6.556 5.925 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -12.606 -9.627 7.020 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -11.610 -4.873 5.962 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -14.399 -7.911 7.171 1.00 0.00 H new ATOM 0 HZ PHE A 81 -13.934 -5.568 6.498 1.00 0.00 H new ATOM 166 N ALA A 82 -7.680 -11.069 5.236 1.00 0.00 N ATOM 167 CA ALA A 82 -6.371 -11.687 5.383 1.00 0.00 C ATOM 168 C ALA A 82 -5.499 -11.281 4.208 1.00 0.00 C ATOM 169 O ALA A 82 -4.415 -10.741 4.410 1.00 0.00 O ATOM 170 CB ALA A 82 -6.478 -13.212 5.416 1.00 0.00 C ATOM 0 H ALA A 82 -8.451 -11.737 5.238 1.00 0.00 H new ATOM 0 HA ALA A 82 -5.935 -11.351 6.324 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.483 -13.644 5.527 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.101 -13.515 6.258 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -6.926 -13.565 4.487 1.00 0.00 H new ATOM 176 N GLU A 83 -5.979 -11.532 2.992 1.00 0.00 N ATOM 177 CA GLU A 83 -5.254 -11.204 1.784 1.00 0.00 C ATOM 178 C GLU A 83 -4.986 -9.702 1.736 1.00 0.00 C ATOM 179 O GLU A 83 -3.860 -9.312 1.461 1.00 0.00 O ATOM 180 CB GLU A 83 -6.026 -11.687 0.557 1.00 0.00 C ATOM 181 CG GLU A 83 -5.211 -11.451 -0.731 1.00 0.00 C ATOM 182 CD GLU A 83 -4.011 -12.398 -0.811 1.00 0.00 C ATOM 183 OE1 GLU A 83 -4.235 -13.614 -1.020 1.00 0.00 O ATOM 184 OE2 GLU A 83 -2.860 -11.952 -0.585 1.00 0.00 O ATOM 0 H GLU A 83 -6.885 -11.970 2.825 1.00 0.00 H new ATOM 0 HA GLU A 83 -4.291 -11.715 1.783 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -6.253 -12.748 0.659 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -6.979 -11.162 0.491 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -5.851 -11.597 -1.601 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -4.864 -10.418 -0.761 1.00 0.00 H new ATOM 191 N PHE A 84 -5.962 -8.844 2.036 1.00 0.00 N ATOM 192 CA PHE A 84 -5.747 -7.406 1.999 1.00 0.00 C ATOM 193 C PHE A 84 -4.592 -7.008 2.918 1.00 0.00 C ATOM 194 O PHE A 84 -3.688 -6.291 2.488 1.00 0.00 O ATOM 195 CB PHE A 84 -7.032 -6.644 2.340 1.00 0.00 C ATOM 196 CG PHE A 84 -6.845 -5.143 2.277 1.00 0.00 C ATOM 197 CD1 PHE A 84 -6.309 -4.555 1.115 1.00 0.00 C ATOM 198 CD2 PHE A 84 -7.170 -4.336 3.384 1.00 0.00 C ATOM 199 CE1 PHE A 84 -6.071 -3.171 1.071 1.00 0.00 C ATOM 200 CE2 PHE A 84 -6.971 -2.947 3.319 1.00 0.00 C ATOM 201 CZ PHE A 84 -6.413 -2.369 2.166 1.00 0.00 C ATOM 0 H PHE A 84 -6.905 -9.124 2.306 1.00 0.00 H new ATOM 0 HA PHE A 84 -5.470 -7.129 0.982 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -7.821 -6.939 1.648 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -7.364 -6.925 3.340 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -6.081 -5.169 0.256 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -7.571 -4.784 4.281 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -5.625 -2.727 0.194 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -7.247 -2.323 4.156 1.00 0.00 H new ATOM 0 HZ PHE A 84 -6.248 -1.303 2.125 1.00 0.00 H new ATOM 211 N TYR A 85 -4.586 -7.480 4.166 1.00 0.00 N ATOM 212 CA TYR A 85 -3.515 -7.161 5.097 1.00 0.00 C ATOM 213 C TYR A 85 -2.195 -7.819 4.661 1.00 0.00 C ATOM 214 O TYR A 85 -1.140 -7.202 4.841 1.00 0.00 O ATOM 215 CB TYR A 85 -3.944 -7.454 6.538 1.00 0.00 C ATOM 216 CG TYR A 85 -5.008 -6.496 7.060 1.00 0.00 C ATOM 217 CD1 TYR A 85 -4.755 -5.109 7.119 1.00 0.00 C ATOM 218 CD2 TYR A 85 -6.263 -6.987 7.465 1.00 0.00 C ATOM 219 CE1 TYR A 85 -5.756 -4.218 7.553 1.00 0.00 C ATOM 220 CE2 TYR A 85 -7.270 -6.106 7.892 1.00 0.00 C ATOM 221 CZ TYR A 85 -7.022 -4.716 7.933 1.00 0.00 C ATOM 222 OH TYR A 85 -8.023 -3.883 8.326 1.00 0.00 O ATOM 0 H TYR A 85 -5.313 -8.084 4.550 1.00 0.00 H new ATOM 0 HA TYR A 85 -3.313 -6.090 5.075 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -4.324 -8.474 6.596 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -3.070 -7.403 7.187 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -3.787 -4.728 6.829 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -6.453 -8.050 7.447 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -5.556 -3.157 7.595 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -8.234 -6.491 8.189 1.00 0.00 H new ATOM 0 HH TYR A 85 -7.639 -3.086 8.748 1.00 0.00 H new ATOM 232 N ASN A 86 -2.218 -9.002 4.029 1.00 0.00 N ATOM 233 CA ASN A 86 -1.046 -9.706 3.535 1.00 0.00 C ATOM 234 C ASN A 86 -0.440 -8.871 2.395 1.00 0.00 C ATOM 235 O ASN A 86 0.779 -8.690 2.321 1.00 0.00 O ATOM 236 CB ASN A 86 -1.428 -11.094 2.979 1.00 0.00 C ATOM 237 CG ASN A 86 -1.886 -12.180 3.955 1.00 0.00 C ATOM 238 OD1 ASN A 86 -1.777 -12.084 5.176 1.00 0.00 O ATOM 239 ND2 ASN A 86 -2.423 -13.275 3.440 1.00 0.00 N ATOM 0 H ASN A 86 -3.087 -9.504 3.846 1.00 0.00 H new ATOM 0 HA ASN A 86 -0.338 -9.843 4.353 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.225 -10.949 2.249 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -0.565 -11.481 2.436 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -2.740 -14.025 4.054 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -2.520 -13.369 2.429 1.00 0.00 H new ATOM 246 N ARG A 87 -1.277 -8.364 1.484 1.00 0.00 N ATOM 247 CA ARG A 87 -0.896 -7.533 0.341 1.00 0.00 C ATOM 248 C ARG A 87 -0.347 -6.221 0.876 1.00 0.00 C ATOM 249 O ARG A 87 0.682 -5.761 0.382 1.00 0.00 O ATOM 250 CB ARG A 87 -2.104 -7.312 -0.591 1.00 0.00 C ATOM 251 CG ARG A 87 -2.529 -8.574 -1.353 1.00 0.00 C ATOM 252 CD ARG A 87 -1.554 -8.977 -2.463 1.00 0.00 C ATOM 253 NE ARG A 87 -1.299 -10.423 -2.436 1.00 0.00 N ATOM 254 CZ ARG A 87 -0.529 -11.104 -3.290 1.00 0.00 C ATOM 255 NH1 ARG A 87 -0.031 -10.526 -4.378 1.00 0.00 N ATOM 256 NH2 ARG A 87 -0.250 -12.373 -3.037 1.00 0.00 N ATOM 0 H ARG A 87 -2.283 -8.530 1.527 1.00 0.00 H new ATOM 0 HA ARG A 87 -0.128 -8.027 -0.254 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -2.947 -6.953 -0.001 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -1.860 -6.529 -1.309 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -2.625 -9.399 -0.648 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -3.515 -8.411 -1.788 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -1.963 -8.694 -3.433 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -0.616 -8.436 -2.343 1.00 0.00 H new ATOM 0 HE ARG A 87 -1.752 -10.958 -1.695 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -0.234 -9.546 -4.573 1.00 0.00 H new ATOM 0 HH12 ARG A 87 0.555 -11.063 -5.018 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -0.622 -12.819 -2.199 1.00 0.00 H new ATOM 0 HH22 ARG A 87 0.336 -12.904 -3.681 1.00 0.00 H new ATOM 270 N LEU A 88 -0.987 -5.632 1.896 1.00 0.00 N ATOM 271 CA LEU A 88 -0.523 -4.395 2.511 1.00 0.00 C ATOM 272 C LEU A 88 0.885 -4.613 3.029 1.00 0.00 C ATOM 273 O LEU A 88 1.746 -3.776 2.773 1.00 0.00 O ATOM 274 CB LEU A 88 -1.429 -3.953 3.673 1.00 0.00 C ATOM 275 CG LEU A 88 -2.561 -3.020 3.233 1.00 0.00 C ATOM 276 CD1 LEU A 88 -3.662 -3.004 4.292 1.00 0.00 C ATOM 277 CD2 LEU A 88 -1.999 -1.602 3.077 1.00 0.00 C ATOM 0 H LEU A 88 -1.840 -6.005 2.313 1.00 0.00 H new ATOM 0 HA LEU A 88 -0.547 -3.608 1.758 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.858 -4.836 4.147 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.823 -3.449 4.426 1.00 0.00 H new ATOM 0 HG LEU A 88 -2.975 -3.371 2.288 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -4.464 -2.338 3.973 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.057 -4.012 4.422 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.252 -2.650 5.238 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -2.796 -0.927 2.764 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.592 -1.265 4.030 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.209 -1.604 2.326 1.00 0.00 H new ATOM 289 N LYS A 89 1.118 -5.714 3.760 1.00 0.00 N ATOM 290 CA LYS A 89 2.433 -6.040 4.300 1.00 0.00 C ATOM 291 C LYS A 89 3.450 -5.988 3.165 1.00 0.00 C ATOM 292 O LYS A 89 4.460 -5.312 3.334 1.00 0.00 O ATOM 293 CB LYS A 89 2.432 -7.391 5.046 1.00 0.00 C ATOM 294 CG LYS A 89 3.861 -7.766 5.463 1.00 0.00 C ATOM 295 CD LYS A 89 3.962 -9.061 6.267 1.00 0.00 C ATOM 296 CE LYS A 89 5.439 -9.306 6.591 1.00 0.00 C ATOM 297 NZ LYS A 89 5.637 -10.485 7.452 1.00 0.00 N ATOM 0 H LYS A 89 0.397 -6.398 3.989 1.00 0.00 H new ATOM 0 HA LYS A 89 2.714 -5.303 5.053 1.00 0.00 H new ATOM 0 HB2 LYS A 89 1.793 -7.328 5.927 1.00 0.00 H new ATOM 0 HB3 LYS A 89 2.016 -8.169 4.405 1.00 0.00 H new ATOM 0 HG2 LYS A 89 4.476 -7.859 4.568 1.00 0.00 H new ATOM 0 HG3 LYS A 89 4.280 -6.952 6.054 1.00 0.00 H new ATOM 0 HD2 LYS A 89 3.378 -8.986 7.185 1.00 0.00 H new ATOM 0 HD3 LYS A 89 3.554 -9.896 5.697 1.00 0.00 H new ATOM 0 HE2 LYS A 89 5.994 -9.440 5.663 1.00 0.00 H new ATOM 0 HE3 LYS A 89 5.851 -8.426 7.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 6.652 -10.609 7.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 5.130 -10.348 8.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 5.269 -11.331 6.972 1.00 0.00 H new ATOM 311 N GLN A 90 3.181 -6.647 2.033 1.00 0.00 N ATOM 312 CA GLN A 90 4.080 -6.649 0.885 1.00 0.00 C ATOM 313 C GLN A 90 4.493 -5.218 0.506 1.00 0.00 C ATOM 314 O GLN A 90 5.678 -4.985 0.287 1.00 0.00 O ATOM 315 CB GLN A 90 3.459 -7.428 -0.296 1.00 0.00 C ATOM 316 CG GLN A 90 4.097 -8.814 -0.440 1.00 0.00 C ATOM 317 CD GLN A 90 3.729 -9.505 -1.755 1.00 0.00 C ATOM 318 OE1 GLN A 90 4.450 -9.399 -2.747 1.00 0.00 O ATOM 319 NE2 GLN A 90 2.610 -10.207 -1.826 1.00 0.00 N ATOM 0 H GLN A 90 2.331 -7.193 1.892 1.00 0.00 H new ATOM 0 HA GLN A 90 4.996 -7.172 1.158 1.00 0.00 H new ATOM 0 HB2 GLN A 90 2.385 -7.533 -0.142 1.00 0.00 H new ATOM 0 HB3 GLN A 90 3.595 -6.864 -1.219 1.00 0.00 H new ATOM 0 HG2 GLN A 90 5.181 -8.718 -0.377 1.00 0.00 H new ATOM 0 HG3 GLN A 90 3.783 -9.441 0.394 1.00 0.00 H new ATOM 0 HE21 GLN A 90 2.011 -10.296 -1.005 1.00 0.00 H new ATOM 0 HE22 GLN A 90 2.346 -10.659 -2.701 1.00 0.00 H new ATOM 328 N ILE A 91 3.572 -4.250 0.468 1.00 0.00 N ATOM 329 CA ILE A 91 3.886 -2.858 0.124 1.00 0.00 C ATOM 330 C ILE A 91 4.821 -2.255 1.180 1.00 0.00 C ATOM 331 O ILE A 91 5.830 -1.628 0.852 1.00 0.00 O ATOM 332 CB ILE A 91 2.596 -2.002 -0.007 1.00 0.00 C ATOM 333 CG1 ILE A 91 1.629 -2.631 -1.029 1.00 0.00 C ATOM 334 CG2 ILE A 91 2.947 -0.557 -0.422 1.00 0.00 C ATOM 335 CD1 ILE A 91 0.245 -1.979 -1.097 1.00 0.00 C ATOM 0 H ILE A 91 2.586 -4.409 0.675 1.00 0.00 H new ATOM 0 HA ILE A 91 4.388 -2.853 -0.844 1.00 0.00 H new ATOM 0 HB ILE A 91 2.103 -1.976 0.965 1.00 0.00 H new ATOM 0 HG12 ILE A 91 2.086 -2.582 -2.017 1.00 0.00 H new ATOM 0 HG13 ILE A 91 1.505 -3.687 -0.787 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.032 0.029 -0.509 1.00 0.00 H new ATOM 0 HG22 ILE A 91 3.594 -0.109 0.332 1.00 0.00 H new ATOM 0 HG23 ILE A 91 3.463 -0.569 -1.382 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -0.362 -2.491 -1.844 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -0.240 -2.052 -0.123 1.00 0.00 H new ATOM 0 HD13 ILE A 91 0.350 -0.930 -1.372 1.00 0.00 H new ATOM 347 N LYS A 92 4.494 -2.434 2.462 1.00 0.00 N ATOM 348 CA LYS A 92 5.292 -1.887 3.557 1.00 0.00 C ATOM 349 C LYS A 92 6.722 -2.414 3.506 1.00 0.00 C ATOM 350 O LYS A 92 7.676 -1.644 3.566 1.00 0.00 O ATOM 351 CB LYS A 92 4.638 -2.164 4.929 1.00 0.00 C ATOM 352 CG LYS A 92 3.125 -1.875 4.963 1.00 0.00 C ATOM 353 CD LYS A 92 2.630 -1.332 6.304 1.00 0.00 C ATOM 354 CE LYS A 92 1.224 -0.731 6.116 1.00 0.00 C ATOM 355 NZ LYS A 92 0.888 0.301 7.119 1.00 0.00 N ATOM 0 H LYS A 92 3.674 -2.959 2.767 1.00 0.00 H new ATOM 0 HA LYS A 92 5.330 -0.805 3.430 1.00 0.00 H new ATOM 0 HB2 LYS A 92 4.806 -3.207 5.198 1.00 0.00 H new ATOM 0 HB3 LYS A 92 5.132 -1.556 5.687 1.00 0.00 H new ATOM 0 HG2 LYS A 92 2.884 -1.156 4.180 1.00 0.00 H new ATOM 0 HG3 LYS A 92 2.584 -2.792 4.731 1.00 0.00 H new ATOM 0 HD2 LYS A 92 2.602 -2.130 7.046 1.00 0.00 H new ATOM 0 HD3 LYS A 92 3.316 -0.573 6.679 1.00 0.00 H new ATOM 0 HE2 LYS A 92 1.154 -0.295 5.119 1.00 0.00 H new ATOM 0 HE3 LYS A 92 0.485 -1.531 6.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.025 0.736 6.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 0.825 -0.137 8.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 1.628 1.032 7.126 1.00 0.00 H new ATOM 1028 N SER B 160 3.250 9.168 -2.180 1.00 0.00 N ATOM 1029 CA SER B 160 4.408 8.289 -2.067 1.00 0.00 C ATOM 1030 C SER B 160 4.107 7.019 -2.870 1.00 0.00 C ATOM 1031 O SER B 160 2.949 6.747 -3.203 1.00 0.00 O ATOM 1032 CB SER B 160 4.685 7.985 -0.590 1.00 0.00 C ATOM 1033 OG SER B 160 3.590 7.332 0.021 1.00 0.00 O ATOM 0 HA SER B 160 5.306 8.759 -2.468 1.00 0.00 H new ATOM 0 HB2 SER B 160 5.574 7.360 -0.507 1.00 0.00 H new ATOM 0 HB3 SER B 160 4.897 8.914 -0.060 1.00 0.00 H new ATOM 0 HG SER B 160 2.963 8.000 0.369 1.00 0.00 H new ATOM 1039 N ALA B 161 5.128 6.231 -3.212 1.00 0.00 N ATOM 1040 CA ALA B 161 4.906 4.992 -3.950 1.00 0.00 C ATOM 1041 C ALA B 161 4.133 4.005 -3.062 1.00 0.00 C ATOM 1042 O ALA B 161 3.381 3.164 -3.560 1.00 0.00 O ATOM 1043 CB ALA B 161 6.250 4.396 -4.353 1.00 0.00 C ATOM 0 H ALA B 161 6.104 6.427 -2.992 1.00 0.00 H new ATOM 0 HA ALA B 161 4.324 5.194 -4.849 1.00 0.00 H new ATOM 0 HB1 ALA B 161 6.087 3.470 -4.905 1.00 0.00 H new ATOM 0 HB2 ALA B 161 6.788 5.104 -4.984 1.00 0.00 H new ATOM 0 HB3 ALA B 161 6.838 4.187 -3.459 1.00 0.00 H new ATOM 1049 N PHE B 162 4.319 4.119 -1.747 1.00 0.00 N ATOM 1050 CA PHE B 162 3.677 3.312 -0.733 1.00 0.00 C ATOM 1051 C PHE B 162 2.183 3.628 -0.768 1.00 0.00 C ATOM 1052 O PHE B 162 1.386 2.736 -1.046 1.00 0.00 O ATOM 1053 CB PHE B 162 4.333 3.641 0.620 1.00 0.00 C ATOM 1054 CG PHE B 162 3.942 2.823 1.843 1.00 0.00 C ATOM 1055 CD1 PHE B 162 2.595 2.612 2.208 1.00 0.00 C ATOM 1056 CD2 PHE B 162 4.961 2.378 2.707 1.00 0.00 C ATOM 1057 CE1 PHE B 162 2.281 1.992 3.427 1.00 0.00 C ATOM 1058 CE2 PHE B 162 4.648 1.761 3.930 1.00 0.00 C ATOM 1059 CZ PHE B 162 3.305 1.587 4.294 1.00 0.00 C ATOM 0 H PHE B 162 4.953 4.812 -1.351 1.00 0.00 H new ATOM 0 HA PHE B 162 3.795 2.242 -0.902 1.00 0.00 H new ATOM 0 HB2 PHE B 162 5.412 3.551 0.494 1.00 0.00 H new ATOM 0 HB3 PHE B 162 4.124 4.687 0.842 1.00 0.00 H new ATOM 0 HD1 PHE B 162 1.803 2.929 1.546 1.00 0.00 H new ATOM 0 HD2 PHE B 162 5.995 2.513 2.426 1.00 0.00 H new ATOM 0 HE1 PHE B 162 1.249 1.827 3.698 1.00 0.00 H new ATOM 0 HE2 PHE B 162 5.437 1.423 4.586 1.00 0.00 H new ATOM 0 HZ PHE B 162 3.059 1.139 5.246 1.00 0.00 H new ATOM 1069 N ASP B 163 1.800 4.879 -0.488 1.00 0.00 N ATOM 1070 CA ASP B 163 0.400 5.315 -0.465 1.00 0.00 C ATOM 1071 C ASP B 163 -0.270 5.009 -1.802 1.00 0.00 C ATOM 1072 O ASP B 163 -1.411 4.556 -1.835 1.00 0.00 O ATOM 1073 CB ASP B 163 0.279 6.824 -0.201 1.00 0.00 C ATOM 1074 CG ASP B 163 0.474 7.283 1.239 1.00 0.00 C ATOM 1075 OD1 ASP B 163 0.074 6.579 2.194 1.00 0.00 O ATOM 1076 OD2 ASP B 163 0.988 8.410 1.417 1.00 0.00 O ATOM 0 H ASP B 163 2.461 5.625 -0.269 1.00 0.00 H new ATOM 0 HA ASP B 163 -0.090 4.772 0.343 1.00 0.00 H new ATOM 0 HB2 ASP B 163 1.010 7.339 -0.824 1.00 0.00 H new ATOM 0 HB3 ASP B 163 -0.707 7.150 -0.532 1.00 0.00 H new ATOM 1081 N LEU B 164 0.435 5.233 -2.915 1.00 0.00 N ATOM 1082 CA LEU B 164 -0.070 4.981 -4.257 1.00 0.00 C ATOM 1083 C LEU B 164 -0.534 3.542 -4.409 1.00 0.00 C ATOM 1084 O LEU B 164 -1.636 3.300 -4.906 1.00 0.00 O ATOM 1085 CB LEU B 164 1.039 5.273 -5.276 1.00 0.00 C ATOM 1086 CG LEU B 164 0.682 4.895 -6.723 1.00 0.00 C ATOM 1087 CD1 LEU B 164 -0.476 5.742 -7.252 1.00 0.00 C ATOM 1088 CD2 LEU B 164 1.922 5.113 -7.585 1.00 0.00 C ATOM 0 H LEU B 164 1.387 5.600 -2.903 1.00 0.00 H new ATOM 0 HA LEU B 164 -0.925 5.634 -4.433 1.00 0.00 H new ATOM 0 HB2 LEU B 164 1.280 6.335 -5.239 1.00 0.00 H new ATOM 0 HB3 LEU B 164 1.938 4.732 -4.982 1.00 0.00 H new ATOM 0 HG LEU B 164 0.364 3.853 -6.756 1.00 0.00 H new ATOM 0 HD11 LEU B 164 -0.703 5.449 -8.277 1.00 0.00 H new ATOM 0 HD12 LEU B 164 -1.356 5.586 -6.627 1.00 0.00 H new ATOM 0 HD13 LEU B 164 -0.196 6.795 -7.229 1.00 0.00 H new ATOM 0 HD21 LEU B 164 1.697 4.852 -8.619 1.00 0.00 H new ATOM 0 HD22 LEU B 164 2.223 6.159 -7.532 1.00 0.00 H new ATOM 0 HD23 LEU B 164 2.734 4.484 -7.220 1.00 0.00 H new ATOM 1100 N ASP B 165 0.323 2.597 -4.028 1.00 0.00 N ATOM 1101 CA ASP B 165 -0.026 1.196 -4.145 1.00 0.00 C ATOM 1102 C ASP B 165 -1.120 0.837 -3.146 1.00 0.00 C ATOM 1103 O ASP B 165 -1.970 0.015 -3.466 1.00 0.00 O ATOM 1104 CB ASP B 165 1.214 0.305 -4.050 1.00 0.00 C ATOM 1105 CG ASP B 165 0.949 -1.104 -4.598 1.00 0.00 C ATOM 1106 OD1 ASP B 165 0.053 -1.277 -5.454 1.00 0.00 O ATOM 1107 OD2 ASP B 165 1.728 -2.033 -4.307 1.00 0.00 O ATOM 0 H ASP B 165 1.249 2.779 -3.642 1.00 0.00 H new ATOM 0 HA ASP B 165 -0.440 1.011 -5.136 1.00 0.00 H new ATOM 0 HB2 ASP B 165 2.033 0.762 -4.605 1.00 0.00 H new ATOM 0 HB3 ASP B 165 1.533 0.236 -3.010 1.00 0.00 H new ATOM 1112 N VAL B 166 -1.165 1.459 -1.960 1.00 0.00 N ATOM 1113 CA VAL B 166 -2.214 1.185 -0.974 1.00 0.00 C ATOM 1114 C VAL B 166 -3.552 1.576 -1.616 1.00 0.00 C ATOM 1115 O VAL B 166 -4.508 0.797 -1.582 1.00 0.00 O ATOM 1116 CB VAL B 166 -1.950 1.946 0.345 1.00 0.00 C ATOM 1117 CG1 VAL B 166 -3.160 1.922 1.293 1.00 0.00 C ATOM 1118 CG2 VAL B 166 -0.749 1.346 1.087 1.00 0.00 C ATOM 0 H VAL B 166 -0.484 2.157 -1.661 1.00 0.00 H new ATOM 0 HA VAL B 166 -2.231 0.129 -0.705 1.00 0.00 H new ATOM 0 HB VAL B 166 -1.749 2.979 0.061 1.00 0.00 H new ATOM 0 HG11 VAL B 166 -2.920 2.471 2.204 1.00 0.00 H new ATOM 0 HG12 VAL B 166 -4.015 2.388 0.803 1.00 0.00 H new ATOM 0 HG13 VAL B 166 -3.404 0.890 1.545 1.00 0.00 H new ATOM 0 HG21 VAL B 166 -0.581 1.897 2.012 1.00 0.00 H new ATOM 0 HG22 VAL B 166 -0.950 0.300 1.319 1.00 0.00 H new ATOM 0 HG23 VAL B 166 0.139 1.414 0.458 1.00 0.00 H new ATOM 1128 N VAL B 167 -3.621 2.762 -2.221 1.00 0.00 N ATOM 1129 CA VAL B 167 -4.793 3.298 -2.892 1.00 0.00 C ATOM 1130 C VAL B 167 -5.204 2.343 -4.019 1.00 0.00 C ATOM 1131 O VAL B 167 -6.364 1.933 -4.058 1.00 0.00 O ATOM 1132 CB VAL B 167 -4.470 4.740 -3.353 1.00 0.00 C ATOM 1133 CG1 VAL B 167 -5.463 5.319 -4.369 1.00 0.00 C ATOM 1134 CG2 VAL B 167 -4.436 5.692 -2.146 1.00 0.00 C ATOM 0 H VAL B 167 -2.825 3.398 -2.255 1.00 0.00 H new ATOM 0 HA VAL B 167 -5.657 3.368 -2.232 1.00 0.00 H new ATOM 0 HB VAL B 167 -3.499 4.664 -3.843 1.00 0.00 H new ATOM 0 HG11 VAL B 167 -5.161 6.331 -4.637 1.00 0.00 H new ATOM 0 HG12 VAL B 167 -5.474 4.695 -5.263 1.00 0.00 H new ATOM 0 HG13 VAL B 167 -6.461 5.342 -3.930 1.00 0.00 H new ATOM 0 HG21 VAL B 167 -4.208 6.702 -2.486 1.00 0.00 H new ATOM 0 HG22 VAL B 167 -5.407 5.686 -1.651 1.00 0.00 H new ATOM 0 HG23 VAL B 167 -3.669 5.363 -1.445 1.00 0.00 H new ATOM 1144 N LYS B 168 -4.286 1.962 -4.917 1.00 0.00 N ATOM 1145 CA LYS B 168 -4.599 1.060 -6.029 1.00 0.00 C ATOM 1146 C LYS B 168 -5.049 -0.322 -5.562 1.00 0.00 C ATOM 1147 O LYS B 168 -6.018 -0.845 -6.113 1.00 0.00 O ATOM 1148 CB LYS B 168 -3.404 0.956 -6.987 1.00 0.00 C ATOM 1149 CG LYS B 168 -3.368 2.177 -7.918 1.00 0.00 C ATOM 1150 CD LYS B 168 -2.320 2.014 -9.020 1.00 0.00 C ATOM 1151 CE LYS B 168 -2.547 3.075 -10.105 1.00 0.00 C ATOM 1152 NZ LYS B 168 -2.032 2.644 -11.419 1.00 0.00 N ATOM 0 H LYS B 168 -3.313 2.268 -4.893 1.00 0.00 H new ATOM 0 HA LYS B 168 -5.444 1.494 -6.563 1.00 0.00 H new ATOM 0 HB2 LYS B 168 -2.476 0.895 -6.418 1.00 0.00 H new ATOM 0 HB3 LYS B 168 -3.478 0.042 -7.576 1.00 0.00 H new ATOM 0 HG2 LYS B 168 -4.350 2.321 -8.368 1.00 0.00 H new ATOM 0 HG3 LYS B 168 -3.149 3.072 -7.336 1.00 0.00 H new ATOM 0 HD2 LYS B 168 -1.319 2.115 -8.602 1.00 0.00 H new ATOM 0 HD3 LYS B 168 -2.385 1.016 -9.453 1.00 0.00 H new ATOM 0 HE2 LYS B 168 -3.613 3.288 -10.186 1.00 0.00 H new ATOM 0 HE3 LYS B 168 -2.058 4.004 -9.811 1.00 0.00 H new ATOM 0 HZ1 LYS B 168 -2.206 3.390 -12.122 1.00 0.00 H new ATOM 0 HZ2 LYS B 168 -1.010 2.465 -11.350 1.00 0.00 H new ATOM 0 HZ3 LYS B 168 -2.517 1.772 -11.713 1.00 0.00 H new ATOM 1166 N LEU B 169 -4.368 -0.914 -4.582 1.00 0.00 N ATOM 1167 CA LEU B 169 -4.683 -2.223 -4.018 1.00 0.00 C ATOM 1168 C LEU B 169 -6.108 -2.164 -3.473 1.00 0.00 C ATOM 1169 O LEU B 169 -6.960 -2.964 -3.861 1.00 0.00 O ATOM 1170 CB LEU B 169 -3.645 -2.538 -2.915 1.00 0.00 C ATOM 1171 CG LEU B 169 -3.618 -3.940 -2.266 1.00 0.00 C ATOM 1172 CD1 LEU B 169 -3.010 -3.851 -0.856 1.00 0.00 C ATOM 1173 CD2 LEU B 169 -4.955 -4.671 -2.179 1.00 0.00 C ATOM 0 H LEU B 169 -3.555 -0.480 -4.145 1.00 0.00 H new ATOM 0 HA LEU B 169 -4.632 -3.019 -4.761 1.00 0.00 H new ATOM 0 HB2 LEU B 169 -2.657 -2.355 -3.337 1.00 0.00 H new ATOM 0 HB3 LEU B 169 -3.789 -1.812 -2.115 1.00 0.00 H new ATOM 0 HG LEU B 169 -3.008 -4.536 -2.945 1.00 0.00 H new ATOM 0 HD11 LEU B 169 -2.994 -4.843 -0.404 1.00 0.00 H new ATOM 0 HD12 LEU B 169 -1.993 -3.466 -0.922 1.00 0.00 H new ATOM 0 HD13 LEU B 169 -3.612 -3.182 -0.242 1.00 0.00 H new ATOM 0 HD21 LEU B 169 -4.809 -5.642 -1.706 1.00 0.00 H new ATOM 0 HD22 LEU B 169 -5.655 -4.081 -1.587 1.00 0.00 H new ATOM 0 HD23 LEU B 169 -5.358 -4.813 -3.182 1.00 0.00 H new ATOM 1185 N THR B 170 -6.374 -1.194 -2.598 1.00 0.00 N ATOM 1186 CA THR B 170 -7.678 -1.014 -1.987 1.00 0.00 C ATOM 1187 C THR B 170 -8.749 -0.835 -3.065 1.00 0.00 C ATOM 1188 O THR B 170 -9.774 -1.512 -3.005 1.00 0.00 O ATOM 1189 CB THR B 170 -7.639 0.149 -0.978 1.00 0.00 C ATOM 1190 OG1 THR B 170 -6.542 0.017 -0.098 1.00 0.00 O ATOM 1191 CG2 THR B 170 -8.898 0.206 -0.109 1.00 0.00 C ATOM 0 H THR B 170 -5.681 -0.509 -2.295 1.00 0.00 H new ATOM 0 HA THR B 170 -7.946 -1.908 -1.425 1.00 0.00 H new ATOM 0 HB THR B 170 -7.559 1.056 -1.577 1.00 0.00 H new ATOM 0 HG1 THR B 170 -5.746 0.417 -0.506 1.00 0.00 H new ATOM 0 HG21 THR B 170 -8.823 1.042 0.586 1.00 0.00 H new ATOM 0 HG22 THR B 170 -9.773 0.340 -0.745 1.00 0.00 H new ATOM 0 HG23 THR B 170 -8.996 -0.724 0.451 1.00 0.00 H new ATOM 1199 N ALA B 171 -8.507 0.028 -4.062 1.00 0.00 N ATOM 1200 CA ALA B 171 -9.447 0.297 -5.145 1.00 0.00 C ATOM 1201 C ALA B 171 -9.780 -0.991 -5.915 1.00 0.00 C ATOM 1202 O ALA B 171 -10.911 -1.152 -6.368 1.00 0.00 O ATOM 1203 CB ALA B 171 -8.908 1.406 -6.063 1.00 0.00 C ATOM 0 H ALA B 171 -7.641 0.562 -4.134 1.00 0.00 H new ATOM 0 HA ALA B 171 -10.382 0.659 -4.717 1.00 0.00 H new ATOM 0 HB1 ALA B 171 -9.622 1.593 -6.865 1.00 0.00 H new ATOM 0 HB2 ALA B 171 -8.764 2.319 -5.485 1.00 0.00 H new ATOM 0 HB3 ALA B 171 -7.956 1.093 -6.491 1.00 0.00 H new ATOM 1209 N GLN B 172 -8.826 -1.914 -6.069 1.00 0.00 N ATOM 1210 CA GLN B 172 -9.069 -3.174 -6.759 1.00 0.00 C ATOM 1211 C GLN B 172 -10.004 -4.045 -5.917 1.00 0.00 C ATOM 1212 O GLN B 172 -11.017 -4.517 -6.430 1.00 0.00 O ATOM 1213 CB GLN B 172 -7.749 -3.900 -7.060 1.00 0.00 C ATOM 1214 CG GLN B 172 -7.165 -3.466 -8.410 1.00 0.00 C ATOM 1215 CD GLN B 172 -6.038 -4.387 -8.858 1.00 0.00 C ATOM 1216 OE1 GLN B 172 -6.197 -5.185 -9.780 1.00 0.00 O ATOM 1217 NE2 GLN B 172 -4.876 -4.281 -8.235 1.00 0.00 N ATOM 0 H GLN B 172 -7.873 -1.806 -5.721 1.00 0.00 H new ATOM 0 HA GLN B 172 -9.549 -2.969 -7.716 1.00 0.00 H new ATOM 0 HB2 GLN B 172 -7.030 -3.693 -6.268 1.00 0.00 H new ATOM 0 HB3 GLN B 172 -7.917 -4.977 -7.064 1.00 0.00 H new ATOM 0 HG2 GLN B 172 -7.953 -3.462 -9.163 1.00 0.00 H new ATOM 0 HG3 GLN B 172 -6.792 -2.445 -8.334 1.00 0.00 H new ATOM 0 HE21 GLN B 172 -4.765 -3.613 -7.473 1.00 0.00 H new ATOM 0 HE22 GLN B 172 -4.091 -4.868 -8.517 1.00 0.00 H new ATOM 1226 N PHE B 173 -9.705 -4.247 -4.629 1.00 0.00 N ATOM 1227 CA PHE B 173 -10.532 -5.074 -3.755 1.00 0.00 C ATOM 1228 C PHE B 173 -11.976 -4.558 -3.681 1.00 0.00 C ATOM 1229 O PHE B 173 -12.903 -5.359 -3.821 1.00 0.00 O ATOM 1230 CB PHE B 173 -9.888 -5.152 -2.363 1.00 0.00 C ATOM 1231 CG PHE B 173 -8.810 -6.217 -2.202 1.00 0.00 C ATOM 1232 CD1 PHE B 173 -7.726 -6.301 -3.099 1.00 0.00 C ATOM 1233 CD2 PHE B 173 -8.891 -7.142 -1.139 1.00 0.00 C ATOM 1234 CE1 PHE B 173 -6.768 -7.319 -2.963 1.00 0.00 C ATOM 1235 CE2 PHE B 173 -7.913 -8.142 -0.988 1.00 0.00 C ATOM 1236 CZ PHE B 173 -6.859 -8.238 -1.908 1.00 0.00 C ATOM 0 H PHE B 173 -8.889 -3.844 -4.170 1.00 0.00 H new ATOM 0 HA PHE B 173 -10.585 -6.078 -4.175 1.00 0.00 H new ATOM 0 HB2 PHE B 173 -9.454 -4.181 -2.127 1.00 0.00 H new ATOM 0 HB3 PHE B 173 -10.672 -5.338 -1.628 1.00 0.00 H new ATOM 0 HD1 PHE B 173 -7.631 -5.578 -3.896 1.00 0.00 H new ATOM 0 HD2 PHE B 173 -9.709 -7.082 -0.437 1.00 0.00 H new ATOM 0 HE1 PHE B 173 -5.958 -7.394 -3.674 1.00 0.00 H new ATOM 0 HE2 PHE B 173 -7.974 -8.836 -0.163 1.00 0.00 H new ATOM 0 HZ PHE B 173 -6.119 -9.018 -1.804 1.00 0.00 H new ATOM 1246 N VAL B 174 -12.184 -3.251 -3.492 1.00 0.00 N ATOM 1247 CA VAL B 174 -13.523 -2.658 -3.403 1.00 0.00 C ATOM 1248 C VAL B 174 -14.266 -2.776 -4.740 1.00 0.00 C ATOM 1249 O VAL B 174 -15.457 -3.059 -4.731 1.00 0.00 O ATOM 1250 CB VAL B 174 -13.448 -1.189 -2.918 1.00 0.00 C ATOM 1251 CG1 VAL B 174 -12.802 -1.090 -1.530 1.00 0.00 C ATOM 1252 CG2 VAL B 174 -12.710 -0.275 -3.874 1.00 0.00 C ATOM 0 H VAL B 174 -11.428 -2.573 -3.396 1.00 0.00 H new ATOM 0 HA VAL B 174 -14.094 -3.218 -2.662 1.00 0.00 H new ATOM 0 HB VAL B 174 -14.483 -0.851 -2.870 1.00 0.00 H new ATOM 0 HG11 VAL B 174 -12.765 -0.046 -1.220 1.00 0.00 H new ATOM 0 HG12 VAL B 174 -13.392 -1.661 -0.813 1.00 0.00 H new ATOM 0 HG13 VAL B 174 -11.790 -1.493 -1.570 1.00 0.00 H new ATOM 0 HG21 VAL B 174 -12.696 0.738 -3.471 1.00 0.00 H new ATOM 0 HG22 VAL B 174 -11.687 -0.630 -4.000 1.00 0.00 H new ATOM 0 HG23 VAL B 174 -13.215 -0.274 -4.840 1.00 0.00 H new ATOM 1262 N ALA B 175 -13.595 -2.618 -5.889 1.00 0.00 N ATOM 1263 CA ALA B 175 -14.242 -2.713 -7.199 1.00 0.00 C ATOM 1264 C ALA B 175 -14.649 -4.140 -7.566 1.00 0.00 C ATOM 1265 O ALA B 175 -15.469 -4.342 -8.460 1.00 0.00 O ATOM 1266 CB ALA B 175 -13.284 -2.203 -8.274 1.00 0.00 C ATOM 0 H ALA B 175 -12.595 -2.422 -5.934 1.00 0.00 H new ATOM 0 HA ALA B 175 -15.148 -2.109 -7.144 1.00 0.00 H new ATOM 0 HB1 ALA B 175 -13.763 -2.272 -9.251 1.00 0.00 H new ATOM 0 HB2 ALA B 175 -13.027 -1.164 -8.069 1.00 0.00 H new ATOM 0 HB3 ALA B 175 -12.378 -2.808 -8.270 1.00 0.00 H new ATOM 1272 N ARG B 176 -14.052 -5.135 -6.913 1.00 0.00 N ATOM 1273 CA ARG B 176 -14.313 -6.545 -7.151 1.00 0.00 C ATOM 1274 C ARG B 176 -15.393 -7.049 -6.210 1.00 0.00 C ATOM 1275 O ARG B 176 -16.446 -7.510 -6.655 1.00 0.00 O ATOM 1276 CB ARG B 176 -12.994 -7.310 -6.964 1.00 0.00 C ATOM 1277 CG ARG B 176 -12.058 -7.064 -8.157 1.00 0.00 C ATOM 1278 CD ARG B 176 -10.656 -7.611 -7.893 1.00 0.00 C ATOM 1279 NE ARG B 176 -10.637 -9.071 -7.691 1.00 0.00 N ATOM 1280 CZ ARG B 176 -10.129 -9.974 -8.536 1.00 0.00 C ATOM 1281 NH1 ARG B 176 -9.930 -9.688 -9.818 1.00 0.00 N ATOM 1282 NH2 ARG B 176 -9.806 -11.167 -8.060 1.00 0.00 N ATOM 0 H ARG B 176 -13.356 -4.974 -6.185 1.00 0.00 H new ATOM 0 HA ARG B 176 -14.679 -6.702 -8.165 1.00 0.00 H new ATOM 0 HB2 ARG B 176 -12.509 -6.991 -6.041 1.00 0.00 H new ATOM 0 HB3 ARG B 176 -13.196 -8.377 -6.866 1.00 0.00 H new ATOM 0 HG2 ARG B 176 -12.472 -7.536 -9.048 1.00 0.00 H new ATOM 0 HG3 ARG B 176 -12.000 -5.995 -8.360 1.00 0.00 H new ATOM 0 HD2 ARG B 176 -10.009 -7.357 -8.733 1.00 0.00 H new ATOM 0 HD3 ARG B 176 -10.241 -7.122 -7.012 1.00 0.00 H new ATOM 0 HE ARG B 176 -11.049 -9.425 -6.828 1.00 0.00 H new ATOM 0 HH11 ARG B 176 -10.166 -8.763 -10.177 1.00 0.00 H new ATOM 0 HH12 ARG B 176 -9.541 -10.394 -10.444 1.00 0.00 H new ATOM 0 HH21 ARG B 176 -9.947 -11.377 -7.072 1.00 0.00 H new ATOM 0 HH22 ARG B 176 -9.416 -11.876 -8.682 1.00 0.00 H new ATOM 1296 N ASN B 177 -15.134 -6.950 -4.910 1.00 0.00 N ATOM 1297 CA ASN B 177 -16.040 -7.408 -3.864 1.00 0.00 C ATOM 1298 C ASN B 177 -17.274 -6.518 -3.792 1.00 0.00 C ATOM 1299 O ASN B 177 -18.389 -7.033 -3.694 1.00 0.00 O ATOM 1300 CB ASN B 177 -15.301 -7.497 -2.527 1.00 0.00 C ATOM 1301 CG ASN B 177 -14.198 -8.550 -2.588 1.00 0.00 C ATOM 1302 OD1 ASN B 177 -14.391 -9.703 -2.203 1.00 0.00 O ATOM 1303 ND2 ASN B 177 -13.014 -8.184 -3.050 1.00 0.00 N ATOM 0 H ASN B 177 -14.272 -6.542 -4.548 1.00 0.00 H new ATOM 0 HA ASN B 177 -16.391 -8.411 -4.107 1.00 0.00 H new ATOM 0 HB2 ASN B 177 -14.871 -6.527 -2.279 1.00 0.00 H new ATOM 0 HB3 ASN B 177 -16.005 -7.746 -1.733 1.00 0.00 H new ATOM 0 HD21 ASN B 177 -12.251 -8.860 -3.090 1.00 0.00 H new ATOM 0 HD22 ASN B 177 -12.864 -7.226 -3.367 1.00 0.00 H new ATOM 1310 N GLY B 178 -17.091 -5.200 -3.849 1.00 0.00 N ATOM 1311 CA GLY B 178 -18.145 -4.197 -3.827 1.00 0.00 C ATOM 1312 C GLY B 178 -18.000 -3.195 -2.691 1.00 0.00 C ATOM 1313 O GLY B 178 -17.163 -3.336 -1.793 1.00 0.00 O ATOM 0 H GLY B 178 -16.160 -4.787 -3.915 1.00 0.00 H new ATOM 0 HA2 GLY B 178 -18.147 -3.661 -4.776 1.00 0.00 H new ATOM 0 HA3 GLY B 178 -19.110 -4.696 -3.741 1.00 0.00 H new ATOM 1317 N ARG B 179 -18.860 -2.173 -2.729 1.00 0.00 N ATOM 1318 CA ARG B 179 -18.914 -1.078 -1.761 1.00 0.00 C ATOM 1319 C ARG B 179 -19.044 -1.587 -0.344 1.00 0.00 C ATOM 1320 O ARG B 179 -18.448 -0.997 0.553 1.00 0.00 O ATOM 1321 CB ARG B 179 -20.107 -0.170 -2.091 1.00 0.00 C ATOM 1322 CG ARG B 179 -20.159 1.168 -1.325 1.00 0.00 C ATOM 1323 CD ARG B 179 -20.725 1.185 0.097 1.00 0.00 C ATOM 1324 NE ARG B 179 -22.137 0.773 0.112 1.00 0.00 N ATOM 1325 CZ ARG B 179 -22.737 0.014 1.030 1.00 0.00 C ATOM 1326 NH1 ARG B 179 -22.121 -0.316 2.163 1.00 0.00 N ATOM 1327 NH2 ARG B 179 -23.964 -0.422 0.790 1.00 0.00 N ATOM 0 H ARG B 179 -19.563 -2.084 -3.463 1.00 0.00 H new ATOM 0 HA ARG B 179 -17.980 -0.520 -1.830 1.00 0.00 H new ATOM 0 HB2 ARG B 179 -20.093 0.044 -3.160 1.00 0.00 H new ATOM 0 HB3 ARG B 179 -21.026 -0.720 -1.888 1.00 0.00 H new ATOM 0 HG2 ARG B 179 -19.144 1.562 -1.280 1.00 0.00 H new ATOM 0 HG3 ARG B 179 -20.746 1.867 -1.922 1.00 0.00 H new ATOM 0 HD2 ARG B 179 -20.142 0.518 0.731 1.00 0.00 H new ATOM 0 HD3 ARG B 179 -20.631 2.187 0.517 1.00 0.00 H new ATOM 0 HE ARG B 179 -22.717 1.102 -0.660 1.00 0.00 H new ATOM 0 HH11 ARG B 179 -21.172 0.013 2.342 1.00 0.00 H new ATOM 0 HH12 ARG B 179 -22.598 -0.898 2.852 1.00 0.00 H new ATOM 0 HH21 ARG B 179 -24.431 -0.176 -0.083 1.00 0.00 H new ATOM 0 HH22 ARG B 179 -24.442 -1.004 1.478 1.00 0.00 H new ATOM 1341 N GLN B 180 -19.789 -2.675 -0.130 1.00 0.00 N ATOM 1342 CA GLN B 180 -19.987 -3.229 1.198 1.00 0.00 C ATOM 1343 C GLN B 180 -18.648 -3.375 1.927 1.00 0.00 C ATOM 1344 O GLN B 180 -18.545 -2.980 3.091 1.00 0.00 O ATOM 1345 CB GLN B 180 -20.672 -4.599 1.086 1.00 0.00 C ATOM 1346 CG GLN B 180 -20.943 -5.327 2.410 1.00 0.00 C ATOM 1347 CD GLN B 180 -21.170 -6.820 2.157 1.00 0.00 C ATOM 1348 OE1 GLN B 180 -22.164 -7.233 1.562 1.00 0.00 O ATOM 1349 NE2 GLN B 180 -20.231 -7.663 2.561 1.00 0.00 N ATOM 0 H GLN B 180 -20.266 -3.188 -0.871 1.00 0.00 H new ATOM 0 HA GLN B 180 -20.619 -2.550 1.771 1.00 0.00 H new ATOM 0 HB2 GLN B 180 -21.621 -4.467 0.566 1.00 0.00 H new ATOM 0 HB3 GLN B 180 -20.053 -5.242 0.461 1.00 0.00 H new ATOM 0 HG2 GLN B 180 -20.100 -5.190 3.088 1.00 0.00 H new ATOM 0 HG3 GLN B 180 -21.818 -4.896 2.898 1.00 0.00 H new ATOM 0 HE21 GLN B 180 -19.409 -7.313 3.054 1.00 0.00 H new ATOM 0 HE22 GLN B 180 -20.330 -8.662 2.379 1.00 0.00 H new ATOM 1358 N PHE B 181 -17.647 -3.947 1.245 1.00 0.00 N ATOM 1359 CA PHE B 181 -16.313 -4.151 1.781 1.00 0.00 C ATOM 1360 C PHE B 181 -15.674 -2.794 2.088 1.00 0.00 C ATOM 1361 O PHE B 181 -15.070 -2.647 3.145 1.00 0.00 O ATOM 1362 CB PHE B 181 -15.469 -4.960 0.786 1.00 0.00 C ATOM 1363 CG PHE B 181 -14.048 -5.171 1.263 1.00 0.00 C ATOM 1364 CD1 PHE B 181 -13.706 -6.202 2.166 1.00 0.00 C ATOM 1365 CD2 PHE B 181 -13.060 -4.274 0.833 1.00 0.00 C ATOM 1366 CE1 PHE B 181 -12.384 -6.331 2.631 1.00 0.00 C ATOM 1367 CE2 PHE B 181 -11.754 -4.388 1.321 1.00 0.00 C ATOM 1368 CZ PHE B 181 -11.404 -5.413 2.217 1.00 0.00 C ATOM 0 H PHE B 181 -17.753 -4.284 0.288 1.00 0.00 H new ATOM 0 HA PHE B 181 -16.368 -4.719 2.710 1.00 0.00 H new ATOM 0 HB2 PHE B 181 -15.940 -5.929 0.620 1.00 0.00 H new ATOM 0 HB3 PHE B 181 -15.453 -4.444 -0.174 1.00 0.00 H new ATOM 0 HD1 PHE B 181 -14.463 -6.895 2.501 1.00 0.00 H new ATOM 0 HD2 PHE B 181 -13.307 -3.496 0.126 1.00 0.00 H new ATOM 0 HE1 PHE B 181 -12.123 -7.134 3.305 1.00 0.00 H new ATOM 0 HE2 PHE B 181 -11.004 -3.678 1.005 1.00 0.00 H new ATOM 0 HZ PHE B 181 -10.391 -5.494 2.584 1.00 0.00 H new ATOM 1378 N LEU B 182 -15.781 -1.801 1.197 1.00 0.00 N ATOM 1379 CA LEU B 182 -15.214 -0.467 1.421 1.00 0.00 C ATOM 1380 C LEU B 182 -15.682 0.033 2.791 1.00 0.00 C ATOM 1381 O LEU B 182 -14.880 0.420 3.641 1.00 0.00 O ATOM 1382 CB LEU B 182 -15.650 0.503 0.300 1.00 0.00 C ATOM 1383 CG LEU B 182 -14.732 1.726 0.099 1.00 0.00 C ATOM 1384 CD1 LEU B 182 -15.324 2.620 -0.990 1.00 0.00 C ATOM 1385 CD2 LEU B 182 -14.499 2.566 1.355 1.00 0.00 C ATOM 0 H LEU B 182 -16.262 -1.900 0.303 1.00 0.00 H new ATOM 0 HA LEU B 182 -14.125 -0.517 1.403 1.00 0.00 H new ATOM 0 HB2 LEU B 182 -15.703 -0.050 -0.638 1.00 0.00 H new ATOM 0 HB3 LEU B 182 -16.658 0.857 0.518 1.00 0.00 H new ATOM 0 HG LEU B 182 -13.758 1.325 -0.182 1.00 0.00 H new ATOM 0 HD11 LEU B 182 -14.681 3.487 -1.138 1.00 0.00 H new ATOM 0 HD12 LEU B 182 -15.397 2.059 -1.922 1.00 0.00 H new ATOM 0 HD13 LEU B 182 -16.317 2.952 -0.688 1.00 0.00 H new ATOM 0 HD21 LEU B 182 -13.842 3.403 1.117 1.00 0.00 H new ATOM 0 HD22 LEU B 182 -15.453 2.946 1.721 1.00 0.00 H new ATOM 0 HD23 LEU B 182 -14.036 1.949 2.125 1.00 0.00 H new ATOM 1397 N THR B 183 -16.989 -0.037 3.035 1.00 0.00 N ATOM 1398 CA THR B 183 -17.580 0.401 4.280 1.00 0.00 C ATOM 1399 C THR B 183 -17.019 -0.345 5.491 1.00 0.00 C ATOM 1400 O THR B 183 -16.697 0.315 6.479 1.00 0.00 O ATOM 1401 CB THR B 183 -19.103 0.263 4.178 1.00 0.00 C ATOM 1402 OG1 THR B 183 -19.603 1.019 3.092 1.00 0.00 O ATOM 1403 CG2 THR B 183 -19.786 0.728 5.458 1.00 0.00 C ATOM 0 H THR B 183 -17.665 -0.403 2.365 1.00 0.00 H new ATOM 0 HA THR B 183 -17.321 1.447 4.441 1.00 0.00 H new ATOM 0 HB THR B 183 -19.321 -0.793 4.020 1.00 0.00 H new ATOM 0 HG1 THR B 183 -20.418 1.489 3.368 1.00 0.00 H new ATOM 0 HG21 THR B 183 -20.866 0.618 5.355 1.00 0.00 H new ATOM 0 HG22 THR B 183 -19.438 0.124 6.296 1.00 0.00 H new ATOM 0 HG23 THR B 183 -19.544 1.775 5.640 1.00 0.00 H new ATOM 1411 N GLN B 184 -16.885 -1.676 5.452 1.00 0.00 N ATOM 1412 CA GLN B 184 -16.364 -2.405 6.608 1.00 0.00 C ATOM 1413 C GLN B 184 -14.963 -1.897 6.970 1.00 0.00 C ATOM 1414 O GLN B 184 -14.678 -1.723 8.159 1.00 0.00 O ATOM 1415 CB GLN B 184 -16.475 -3.925 6.424 1.00 0.00 C ATOM 1416 CG GLN B 184 -17.940 -4.352 6.240 1.00 0.00 C ATOM 1417 CD GLN B 184 -18.244 -5.712 6.865 1.00 0.00 C ATOM 1418 OE1 GLN B 184 -18.422 -5.828 8.078 1.00 0.00 O ATOM 1419 NE2 GLN B 184 -18.367 -6.752 6.066 1.00 0.00 N ATOM 0 H GLN B 184 -17.125 -2.258 4.649 1.00 0.00 H new ATOM 0 HA GLN B 184 -16.989 -2.198 7.477 1.00 0.00 H new ATOM 0 HB2 GLN B 184 -15.891 -4.234 5.557 1.00 0.00 H new ATOM 0 HB3 GLN B 184 -16.051 -4.432 7.291 1.00 0.00 H new ATOM 0 HG2 GLN B 184 -18.591 -3.599 6.684 1.00 0.00 H new ATOM 0 HG3 GLN B 184 -18.173 -4.386 5.176 1.00 0.00 H new ATOM 0 HE21 GLN B 184 -18.217 -6.645 5.063 1.00 0.00 H new ATOM 0 HE22 GLN B 184 -18.612 -7.664 6.451 1.00 0.00 H new ATOM 1428 N LEU B 185 -14.113 -1.599 5.979 1.00 0.00 N ATOM 1429 CA LEU B 185 -12.778 -1.058 6.233 1.00 0.00 C ATOM 1430 C LEU B 185 -12.907 0.296 6.913 1.00 0.00 C ATOM 1431 O LEU B 185 -12.243 0.520 7.922 1.00 0.00 O ATOM 1432 CB LEU B 185 -11.952 -0.871 4.948 1.00 0.00 C ATOM 1433 CG LEU B 185 -11.067 -2.049 4.534 1.00 0.00 C ATOM 1434 CD1 LEU B 185 -10.523 -1.754 3.132 1.00 0.00 C ATOM 1435 CD2 LEU B 185 -9.893 -2.246 5.503 1.00 0.00 C ATOM 0 H LEU B 185 -14.331 -1.725 4.991 1.00 0.00 H new ATOM 0 HA LEU B 185 -12.260 -1.780 6.864 1.00 0.00 H new ATOM 0 HB2 LEU B 185 -12.638 -0.654 4.129 1.00 0.00 H new ATOM 0 HB3 LEU B 185 -11.317 0.006 5.074 1.00 0.00 H new ATOM 0 HG LEU B 185 -11.661 -2.963 4.548 1.00 0.00 H new ATOM 0 HD11 LEU B 185 -9.887 -2.577 2.808 1.00 0.00 H new ATOM 0 HD12 LEU B 185 -11.354 -1.642 2.436 1.00 0.00 H new ATOM 0 HD13 LEU B 185 -9.941 -0.833 3.154 1.00 0.00 H new ATOM 0 HD21 LEU B 185 -9.288 -3.092 5.175 1.00 0.00 H new ATOM 0 HD22 LEU B 185 -9.279 -1.345 5.519 1.00 0.00 H new ATOM 0 HD23 LEU B 185 -10.277 -2.441 6.504 1.00 0.00 H new ATOM 1447 N MET B 186 -13.763 1.190 6.400 1.00 0.00 N ATOM 1448 CA MET B 186 -13.940 2.519 6.983 1.00 0.00 C ATOM 1449 C MET B 186 -14.345 2.459 8.454 1.00 0.00 C ATOM 1450 O MET B 186 -14.140 3.443 9.165 1.00 0.00 O ATOM 1451 CB MET B 186 -14.979 3.341 6.210 1.00 0.00 C ATOM 1452 CG MET B 186 -14.535 3.626 4.779 1.00 0.00 C ATOM 1453 SD MET B 186 -15.611 4.766 3.882 1.00 0.00 S ATOM 1454 CE MET B 186 -15.027 6.335 4.558 1.00 0.00 C ATOM 0 H MET B 186 -14.343 1.012 5.580 1.00 0.00 H new ATOM 0 HA MET B 186 -12.968 3.007 6.911 1.00 0.00 H new ATOM 0 HB2 MET B 186 -15.927 2.804 6.195 1.00 0.00 H new ATOM 0 HB3 MET B 186 -15.155 4.283 6.729 1.00 0.00 H new ATOM 0 HG2 MET B 186 -13.526 4.037 4.799 1.00 0.00 H new ATOM 0 HG3 MET B 186 -14.485 2.685 4.232 1.00 0.00 H new ATOM 0 HE1 MET B 186 -15.550 7.158 4.072 1.00 0.00 H new ATOM 0 HE2 MET B 186 -15.222 6.364 5.630 1.00 0.00 H new ATOM 0 HE3 MET B 186 -13.956 6.431 4.381 1.00 0.00 H new ATOM 1464 N GLN B 187 -14.932 1.350 8.909 1.00 0.00 N ATOM 1465 CA GLN B 187 -15.354 1.163 10.283 1.00 0.00 C ATOM 1466 C GLN B 187 -14.207 0.560 11.099 1.00 0.00 C ATOM 1467 O GLN B 187 -13.871 1.114 12.149 1.00 0.00 O ATOM 1468 CB GLN B 187 -16.629 0.310 10.327 1.00 0.00 C ATOM 1469 CG GLN B 187 -17.828 0.989 9.636 1.00 0.00 C ATOM 1470 CD GLN B 187 -18.222 2.327 10.258 1.00 0.00 C ATOM 1471 OE1 GLN B 187 -18.108 2.528 11.463 1.00 0.00 O ATOM 1472 NE2 GLN B 187 -18.664 3.283 9.455 1.00 0.00 N ATOM 0 H GLN B 187 -15.128 0.545 8.314 1.00 0.00 H new ATOM 0 HA GLN B 187 -15.599 2.124 10.735 1.00 0.00 H new ATOM 0 HB2 GLN B 187 -16.435 -0.649 9.847 1.00 0.00 H new ATOM 0 HB3 GLN B 187 -16.885 0.101 11.366 1.00 0.00 H new ATOM 0 HG2 GLN B 187 -17.589 1.145 8.584 1.00 0.00 H new ATOM 0 HG3 GLN B 187 -18.685 0.316 9.672 1.00 0.00 H new ATOM 0 HE21 GLN B 187 -18.756 3.107 8.455 1.00 0.00 H new ATOM 0 HE22 GLN B 187 -18.913 4.195 9.837 1.00 0.00 H new ATOM 1481 N LYS B 188 -13.573 -0.542 10.666 1.00 0.00 N ATOM 1482 CA LYS B 188 -12.467 -1.119 11.449 1.00 0.00 C ATOM 1483 C LYS B 188 -11.212 -0.236 11.441 1.00 0.00 C ATOM 1484 O LYS B 188 -10.372 -0.379 12.329 1.00 0.00 O ATOM 1485 CB LYS B 188 -12.195 -2.599 11.136 1.00 0.00 C ATOM 1486 CG LYS B 188 -11.662 -2.903 9.730 1.00 0.00 C ATOM 1487 CD LYS B 188 -11.098 -4.326 9.594 1.00 0.00 C ATOM 1488 CE LYS B 188 -12.098 -5.453 9.304 1.00 0.00 C ATOM 1489 NZ LYS B 188 -12.995 -5.829 10.409 1.00 0.00 N ATOM 0 H LYS B 188 -13.798 -1.039 9.804 1.00 0.00 H new ATOM 0 HA LYS B 188 -12.808 -1.125 12.484 1.00 0.00 H new ATOM 0 HB2 LYS B 188 -11.478 -2.978 11.864 1.00 0.00 H new ATOM 0 HB3 LYS B 188 -13.121 -3.156 11.280 1.00 0.00 H new ATOM 0 HG2 LYS B 188 -12.465 -2.766 9.006 1.00 0.00 H new ATOM 0 HG3 LYS B 188 -10.882 -2.184 9.480 1.00 0.00 H new ATOM 0 HD2 LYS B 188 -10.355 -4.320 8.796 1.00 0.00 H new ATOM 0 HD3 LYS B 188 -10.572 -4.570 10.517 1.00 0.00 H new ATOM 0 HE2 LYS B 188 -12.710 -5.157 8.452 1.00 0.00 H new ATOM 0 HE3 LYS B 188 -11.538 -6.338 9.002 1.00 0.00 H new ATOM 0 HZ1 LYS B 188 -13.440 -6.745 10.198 1.00 0.00 H new ATOM 0 HZ2 LYS B 188 -12.448 -5.904 11.290 1.00 0.00 H new ATOM 0 HZ3 LYS B 188 -13.732 -5.104 10.520 1.00 0.00 H new ATOM 1503 N GLU B 189 -11.118 0.730 10.531 1.00 0.00 N ATOM 1504 CA GLU B 189 -10.014 1.678 10.392 1.00 0.00 C ATOM 1505 C GLU B 189 -10.511 3.114 10.664 1.00 0.00 C ATOM 1506 O GLU B 189 -9.828 4.070 10.299 1.00 0.00 O ATOM 1507 CB GLU B 189 -9.388 1.574 8.988 1.00 0.00 C ATOM 1508 CG GLU B 189 -8.893 0.178 8.578 1.00 0.00 C ATOM 1509 CD GLU B 189 -7.738 -0.361 9.429 1.00 0.00 C ATOM 1510 OE1 GLU B 189 -6.913 0.406 9.969 1.00 0.00 O ATOM 1511 OE2 GLU B 189 -7.634 -1.605 9.564 1.00 0.00 O ATOM 0 H GLU B 189 -11.847 0.881 9.834 1.00 0.00 H new ATOM 0 HA GLU B 189 -9.246 1.433 11.125 1.00 0.00 H new ATOM 0 HB2 GLU B 189 -10.125 1.907 8.257 1.00 0.00 H new ATOM 0 HB3 GLU B 189 -8.549 2.267 8.933 1.00 0.00 H new ATOM 0 HG2 GLU B 189 -9.727 -0.521 8.636 1.00 0.00 H new ATOM 0 HG3 GLU B 189 -8.576 0.210 7.536 1.00 0.00 H new ATOM 1518 N GLN B 190 -11.677 3.304 11.305 1.00 0.00 N ATOM 1519 CA GLN B 190 -12.274 4.618 11.602 1.00 0.00 C ATOM 1520 C GLN B 190 -11.397 5.604 12.391 1.00 0.00 C ATOM 1521 O GLN B 190 -11.790 6.763 12.542 1.00 0.00 O ATOM 1522 CB GLN B 190 -13.655 4.455 12.259 1.00 0.00 C ATOM 1523 CG GLN B 190 -13.603 4.083 13.744 1.00 0.00 C ATOM 1524 CD GLN B 190 -14.994 3.762 14.272 1.00 0.00 C ATOM 1525 OE1 GLN B 190 -15.628 4.583 14.930 1.00 0.00 O ATOM 1526 NE2 GLN B 190 -15.484 2.569 13.988 1.00 0.00 N ATOM 0 H GLN B 190 -12.246 2.527 11.640 1.00 0.00 H new ATOM 0 HA GLN B 190 -12.377 5.090 10.625 1.00 0.00 H new ATOM 0 HB2 GLN B 190 -14.210 5.387 12.148 1.00 0.00 H new ATOM 0 HB3 GLN B 190 -14.212 3.687 11.723 1.00 0.00 H new ATOM 0 HG2 GLN B 190 -12.949 3.223 13.885 1.00 0.00 H new ATOM 0 HG3 GLN B 190 -13.174 4.907 14.315 1.00 0.00 H new ATOM 0 HE21 GLN B 190 -14.933 1.909 13.439 1.00 0.00 H new ATOM 0 HE22 GLN B 190 -16.413 2.308 14.317 1.00 0.00 H new ATOM 1535 N ARG B 191 -10.265 5.167 12.946 1.00 0.00 N ATOM 1536 CA ARG B 191 -9.321 6.006 13.689 1.00 0.00 C ATOM 1537 C ARG B 191 -7.901 5.834 13.143 1.00 0.00 C ATOM 1538 O ARG B 191 -6.966 6.378 13.719 1.00 0.00 O ATOM 1539 CB ARG B 191 -9.359 5.719 15.199 1.00 0.00 C ATOM 1540 CG ARG B 191 -10.688 6.103 15.863 1.00 0.00 C ATOM 1541 CD ARG B 191 -10.497 6.425 17.357 1.00 0.00 C ATOM 1542 NE ARG B 191 -10.906 7.800 17.693 1.00 0.00 N ATOM 1543 CZ ARG B 191 -10.343 8.950 17.293 1.00 0.00 C ATOM 1544 NH1 ARG B 191 -9.287 8.960 16.490 1.00 0.00 N ATOM 1545 NH2 ARG B 191 -10.860 10.102 17.701 1.00 0.00 N ATOM 0 H ARG B 191 -9.971 4.192 12.890 1.00 0.00 H new ATOM 0 HA ARG B 191 -9.628 7.042 13.548 1.00 0.00 H new ATOM 0 HB2 ARG B 191 -9.173 4.658 15.364 1.00 0.00 H new ATOM 0 HB3 ARG B 191 -8.549 6.263 15.685 1.00 0.00 H new ATOM 0 HG2 ARG B 191 -11.114 6.968 15.354 1.00 0.00 H new ATOM 0 HG3 ARG B 191 -11.401 5.286 15.754 1.00 0.00 H new ATOM 0 HD2 ARG B 191 -11.076 5.721 17.954 1.00 0.00 H new ATOM 0 HD3 ARG B 191 -9.450 6.285 17.625 1.00 0.00 H new ATOM 0 HE ARG B 191 -11.717 7.888 18.305 1.00 0.00 H new ATOM 0 HH11 ARG B 191 -8.886 8.081 16.164 1.00 0.00 H new ATOM 0 HH12 ARG B 191 -8.876 9.847 16.199 1.00 0.00 H new ATOM 0 HH21 ARG B 191 -11.677 10.107 18.312 1.00 0.00 H new ATOM 0 HH22 ARG B 191 -10.441 10.983 17.404 1.00 0.00 H new ATOM 1559 N ASN B 192 -7.708 5.028 12.097 1.00 0.00 N ATOM 1560 CA ASN B 192 -6.398 4.817 11.512 1.00 0.00 C ATOM 1561 C ASN B 192 -6.254 5.821 10.382 1.00 0.00 C ATOM 1562 O ASN B 192 -6.824 5.614 9.307 1.00 0.00 O ATOM 1563 CB ASN B 192 -6.242 3.386 10.990 1.00 0.00 C ATOM 1564 CG ASN B 192 -4.856 3.153 10.403 1.00 0.00 C ATOM 1565 OD1 ASN B 192 -3.976 4.008 10.438 1.00 0.00 O ATOM 1566 ND2 ASN B 192 -4.618 1.965 9.882 1.00 0.00 N ATOM 0 H ASN B 192 -8.457 4.509 11.639 1.00 0.00 H new ATOM 0 HA ASN B 192 -5.620 4.958 12.262 1.00 0.00 H new ATOM 0 HB2 ASN B 192 -6.417 2.680 11.802 1.00 0.00 H new ATOM 0 HB3 ASN B 192 -6.998 3.191 10.229 1.00 0.00 H new ATOM 0 HD21 ASN B 192 -3.696 1.750 9.503 1.00 0.00 H new ATOM 0 HD22 ASN B 192 -5.356 1.262 9.858 1.00 0.00 H new ATOM 1573 N TYR B 193 -5.501 6.895 10.621 1.00 0.00 N ATOM 1574 CA TYR B 193 -5.272 7.935 9.624 1.00 0.00 C ATOM 1575 C TYR B 193 -4.694 7.367 8.323 1.00 0.00 C ATOM 1576 O TYR B 193 -4.888 7.976 7.283 1.00 0.00 O ATOM 1577 CB TYR B 193 -4.369 9.041 10.191 1.00 0.00 C ATOM 1578 CG TYR B 193 -2.970 8.577 10.550 1.00 0.00 C ATOM 1579 CD1 TYR B 193 -1.999 8.426 9.542 1.00 0.00 C ATOM 1580 CD2 TYR B 193 -2.640 8.278 11.884 1.00 0.00 C ATOM 1581 CE1 TYR B 193 -0.719 7.942 9.856 1.00 0.00 C ATOM 1582 CE2 TYR B 193 -1.351 7.821 12.208 1.00 0.00 C ATOM 1583 CZ TYR B 193 -0.381 7.649 11.195 1.00 0.00 C ATOM 1584 OH TYR B 193 0.874 7.214 11.497 1.00 0.00 O ATOM 0 H TYR B 193 -5.034 7.066 11.511 1.00 0.00 H new ATOM 0 HA TYR B 193 -6.241 8.371 9.380 1.00 0.00 H new ATOM 0 HB2 TYR B 193 -4.296 9.846 9.460 1.00 0.00 H new ATOM 0 HB3 TYR B 193 -4.840 9.460 11.080 1.00 0.00 H new ATOM 0 HD1 TYR B 193 -2.240 8.684 8.521 1.00 0.00 H new ATOM 0 HD2 TYR B 193 -3.379 8.400 12.662 1.00 0.00 H new ATOM 0 HE1 TYR B 193 0.008 7.794 9.072 1.00 0.00 H new ATOM 0 HE2 TYR B 193 -1.101 7.600 13.235 1.00 0.00 H new ATOM 0 HH TYR B 193 0.943 7.059 12.462 1.00 0.00 H new ATOM 1594 N GLN B 194 -4.038 6.196 8.326 1.00 0.00 N ATOM 1595 CA GLN B 194 -3.485 5.631 7.099 1.00 0.00 C ATOM 1596 C GLN B 194 -4.589 5.386 6.056 1.00 0.00 C ATOM 1597 O GLN B 194 -4.304 5.379 4.863 1.00 0.00 O ATOM 1598 CB GLN B 194 -2.718 4.331 7.405 1.00 0.00 C ATOM 1599 CG GLN B 194 -1.546 4.108 6.432 1.00 0.00 C ATOM 1600 CD GLN B 194 -1.499 2.693 5.858 1.00 0.00 C ATOM 1601 OE1 GLN B 194 -1.486 1.701 6.591 1.00 0.00 O ATOM 1602 NE2 GLN B 194 -1.471 2.547 4.546 1.00 0.00 N ATOM 0 H GLN B 194 -3.882 5.631 9.160 1.00 0.00 H new ATOM 0 HA GLN B 194 -2.785 6.352 6.676 1.00 0.00 H new ATOM 0 HB2 GLN B 194 -2.339 4.366 8.426 1.00 0.00 H new ATOM 0 HB3 GLN B 194 -3.402 3.485 7.348 1.00 0.00 H new ATOM 0 HG2 GLN B 194 -1.622 4.823 5.613 1.00 0.00 H new ATOM 0 HG3 GLN B 194 -0.609 4.314 6.949 1.00 0.00 H new ATOM 0 HE21 GLN B 194 -1.482 3.368 3.941 1.00 0.00 H new ATOM 0 HE22 GLN B 194 -1.439 1.613 4.137 1.00 0.00 H new ATOM 1611 N PHE B 195 -5.840 5.199 6.494 1.00 0.00 N ATOM 1612 CA PHE B 195 -7.007 4.961 5.653 1.00 0.00 C ATOM 1613 C PHE B 195 -7.885 6.209 5.515 1.00 0.00 C ATOM 1614 O PHE B 195 -9.058 6.088 5.155 1.00 0.00 O ATOM 1615 CB PHE B 195 -7.791 3.768 6.213 1.00 0.00 C ATOM 1616 CG PHE B 195 -7.096 2.445 6.004 1.00 0.00 C ATOM 1617 CD1 PHE B 195 -7.187 1.798 4.761 1.00 0.00 C ATOM 1618 CD2 PHE B 195 -6.385 1.844 7.054 1.00 0.00 C ATOM 1619 CE1 PHE B 195 -6.604 0.534 4.589 1.00 0.00 C ATOM 1620 CE2 PHE B 195 -5.812 0.572 6.887 1.00 0.00 C ATOM 1621 CZ PHE B 195 -5.933 -0.090 5.655 1.00 0.00 C ATOM 0 H PHE B 195 -6.071 5.211 7.488 1.00 0.00 H new ATOM 0 HA PHE B 195 -6.671 4.724 4.644 1.00 0.00 H new ATOM 0 HB2 PHE B 195 -7.956 3.919 7.280 1.00 0.00 H new ATOM 0 HB3 PHE B 195 -8.773 3.733 5.740 1.00 0.00 H new ATOM 0 HD1 PHE B 195 -7.704 2.272 3.940 1.00 0.00 H new ATOM 0 HD2 PHE B 195 -6.278 2.362 7.996 1.00 0.00 H new ATOM 0 HE1 PHE B 195 -6.671 0.037 3.632 1.00 0.00 H new ATOM 0 HE2 PHE B 195 -5.281 0.105 7.703 1.00 0.00 H new ATOM 0 HZ PHE B 195 -5.512 -1.076 5.527 1.00 0.00 H new ATOM 1631 N ASP B 196 -7.394 7.401 5.859 1.00 0.00 N ATOM 1632 CA ASP B 196 -8.176 8.632 5.727 1.00 0.00 C ATOM 1633 C ASP B 196 -8.490 8.938 4.260 1.00 0.00 C ATOM 1634 O ASP B 196 -9.501 9.585 3.995 1.00 0.00 O ATOM 1635 CB ASP B 196 -7.528 9.830 6.431 1.00 0.00 C ATOM 1636 CG ASP B 196 -6.152 10.256 5.918 1.00 0.00 C ATOM 1637 OD1 ASP B 196 -5.625 9.628 4.974 1.00 0.00 O ATOM 1638 OD2 ASP B 196 -5.621 11.218 6.520 1.00 0.00 O ATOM 0 H ASP B 196 -6.455 7.540 6.232 1.00 0.00 H new ATOM 0 HA ASP B 196 -9.121 8.455 6.241 1.00 0.00 H new ATOM 0 HB2 ASP B 196 -8.203 10.682 6.347 1.00 0.00 H new ATOM 0 HB3 ASP B 196 -7.440 9.596 7.492 1.00 0.00 H new ATOM 1643 N PHE B 197 -7.728 8.392 3.302 1.00 0.00 N ATOM 1644 CA PHE B 197 -7.953 8.590 1.871 1.00 0.00 C ATOM 1645 C PHE B 197 -9.325 8.034 1.454 1.00 0.00 C ATOM 1646 O PHE B 197 -9.837 8.381 0.387 1.00 0.00 O ATOM 1647 CB PHE B 197 -6.820 7.962 1.042 1.00 0.00 C ATOM 1648 CG PHE B 197 -6.784 6.441 1.047 1.00 0.00 C ATOM 1649 CD1 PHE B 197 -7.528 5.704 0.104 1.00 0.00 C ATOM 1650 CD2 PHE B 197 -5.998 5.755 1.990 1.00 0.00 C ATOM 1651 CE1 PHE B 197 -7.486 4.298 0.112 1.00 0.00 C ATOM 1652 CE2 PHE B 197 -5.963 4.350 2.005 1.00 0.00 C ATOM 1653 CZ PHE B 197 -6.713 3.620 1.069 1.00 0.00 C ATOM 0 H PHE B 197 -6.928 7.793 3.506 1.00 0.00 H new ATOM 0 HA PHE B 197 -7.951 9.662 1.671 1.00 0.00 H new ATOM 0 HB2 PHE B 197 -6.912 8.304 0.011 1.00 0.00 H new ATOM 0 HB3 PHE B 197 -5.867 8.334 1.418 1.00 0.00 H new ATOM 0 HD1 PHE B 197 -8.132 6.220 -0.627 1.00 0.00 H new ATOM 0 HD2 PHE B 197 -5.416 6.313 2.709 1.00 0.00 H new ATOM 0 HE1 PHE B 197 -8.050 3.738 -0.620 1.00 0.00 H new ATOM 0 HE2 PHE B 197 -5.360 3.832 2.736 1.00 0.00 H new ATOM 0 HZ PHE B 197 -6.696 2.540 1.085 1.00 0.00 H new ATOM 1663 N LEU B 198 -9.921 7.145 2.263 1.00 0.00 N ATOM 1664 CA LEU B 198 -11.233 6.552 2.015 1.00 0.00 C ATOM 1665 C LEU B 198 -12.348 7.561 2.299 1.00 0.00 C ATOM 1666 O LEU B 198 -13.495 7.312 1.928 1.00 0.00 O ATOM 1667 CB LEU B 198 -11.458 5.310 2.900 1.00 0.00 C ATOM 1668 CG LEU B 198 -10.511 4.131 2.618 1.00 0.00 C ATOM 1669 CD1 LEU B 198 -10.847 2.971 3.567 1.00 0.00 C ATOM 1670 CD2 LEU B 198 -10.633 3.645 1.169 1.00 0.00 C ATOM 0 H LEU B 198 -9.490 6.814 3.126 1.00 0.00 H new ATOM 0 HA LEU B 198 -11.260 6.259 0.965 1.00 0.00 H new ATOM 0 HB2 LEU B 198 -11.349 5.602 3.944 1.00 0.00 H new ATOM 0 HB3 LEU B 198 -12.486 4.971 2.769 1.00 0.00 H new ATOM 0 HG LEU B 198 -9.489 4.473 2.779 1.00 0.00 H new ATOM 0 HD11 LEU B 198 -10.178 2.134 3.370 1.00 0.00 H new ATOM 0 HD12 LEU B 198 -10.724 3.298 4.599 1.00 0.00 H new ATOM 0 HD13 LEU B 198 -11.878 2.657 3.406 1.00 0.00 H new ATOM 0 HD21 LEU B 198 -9.950 2.812 1.006 1.00 0.00 H new ATOM 0 HD22 LEU B 198 -11.655 3.318 0.980 1.00 0.00 H new ATOM 0 HD23 LEU B 198 -10.381 4.459 0.490 1.00 0.00 H new ATOM 1682 N ARG B 199 -12.062 8.669 2.987 1.00 0.00 N ATOM 1683 CA ARG B 199 -13.042 9.691 3.326 1.00 0.00 C ATOM 1684 C ARG B 199 -12.919 10.857 2.349 1.00 0.00 C ATOM 1685 O ARG B 199 -11.810 11.161 1.904 1.00 0.00 O ATOM 1686 CB ARG B 199 -12.808 10.138 4.778 1.00 0.00 C ATOM 1687 CG ARG B 199 -13.229 9.035 5.751 1.00 0.00 C ATOM 1688 CD ARG B 199 -13.030 9.433 7.216 1.00 0.00 C ATOM 1689 NE ARG B 199 -13.969 8.689 8.068 1.00 0.00 N ATOM 1690 CZ ARG B 199 -15.253 9.007 8.273 1.00 0.00 C ATOM 1691 NH1 ARG B 199 -15.773 10.123 7.771 1.00 0.00 N ATOM 1692 NH2 ARG B 199 -16.027 8.191 8.971 1.00 0.00 N ATOM 0 H ARG B 199 -11.124 8.880 3.328 1.00 0.00 H new ATOM 0 HA ARG B 199 -14.055 9.296 3.246 1.00 0.00 H new ATOM 0 HB2 ARG B 199 -11.755 10.379 4.926 1.00 0.00 H new ATOM 0 HB3 ARG B 199 -13.375 11.047 4.981 1.00 0.00 H new ATOM 0 HG2 ARG B 199 -14.278 8.790 5.584 1.00 0.00 H new ATOM 0 HG3 ARG B 199 -12.654 8.133 5.542 1.00 0.00 H new ATOM 0 HD2 ARG B 199 -12.005 9.226 7.522 1.00 0.00 H new ATOM 0 HD3 ARG B 199 -13.188 10.505 7.335 1.00 0.00 H new ATOM 0 HE ARG B 199 -13.612 7.860 8.543 1.00 0.00 H new ATOM 0 HH11 ARG B 199 -15.191 10.753 7.219 1.00 0.00 H new ATOM 0 HH12 ARG B 199 -16.754 10.349 7.938 1.00 0.00 H new ATOM 0 HH21 ARG B 199 -15.644 7.325 9.350 1.00 0.00 H new ATOM 0 HH22 ARG B 199 -17.006 8.429 9.130 1.00 0.00 H new ATOM 1706 N PRO B 200 -14.020 11.572 2.063 1.00 0.00 N ATOM 1707 CA PRO B 200 -14.010 12.703 1.139 1.00 0.00 C ATOM 1708 C PRO B 200 -13.127 13.859 1.616 1.00 0.00 C ATOM 1709 O PRO B 200 -12.818 14.752 0.829 1.00 0.00 O ATOM 1710 CB PRO B 200 -15.471 13.118 0.964 1.00 0.00 C ATOM 1711 CG PRO B 200 -16.157 12.580 2.213 1.00 0.00 C ATOM 1712 CD PRO B 200 -15.373 11.316 2.537 1.00 0.00 C ATOM 0 HA PRO B 200 -13.567 12.413 0.186 1.00 0.00 H new ATOM 0 HB2 PRO B 200 -15.572 14.201 0.887 1.00 0.00 H new ATOM 0 HB3 PRO B 200 -15.901 12.693 0.057 1.00 0.00 H new ATOM 0 HG2 PRO B 200 -16.117 13.297 3.033 1.00 0.00 H new ATOM 0 HG3 PRO B 200 -17.209 12.363 2.030 1.00 0.00 H new ATOM 0 HD2 PRO B 200 -15.383 11.111 3.607 1.00 0.00 H new ATOM 0 HD3 PRO B 200 -15.806 10.447 2.042 1.00 0.00 H new ATOM 1720 N GLN B 201 -12.708 13.840 2.884 1.00 0.00 N ATOM 1721 CA GLN B 201 -11.843 14.855 3.464 1.00 0.00 C ATOM 1722 C GLN B 201 -10.491 14.927 2.746 1.00 0.00 C ATOM 1723 O GLN B 201 -9.820 15.951 2.839 1.00 0.00 O ATOM 1724 CB GLN B 201 -11.621 14.588 4.968 1.00 0.00 C ATOM 1725 CG GLN B 201 -10.745 13.360 5.289 1.00 0.00 C ATOM 1726 CD GLN B 201 -10.585 13.118 6.792 1.00 0.00 C ATOM 1727 OE1 GLN B 201 -9.482 13.102 7.334 1.00 0.00 O ATOM 1728 NE2 GLN B 201 -11.666 12.899 7.520 1.00 0.00 N ATOM 0 H GLN B 201 -12.968 13.105 3.542 1.00 0.00 H new ATOM 0 HA GLN B 201 -12.345 15.814 3.339 1.00 0.00 H new ATOM 0 HB2 GLN B 201 -11.162 15.470 5.414 1.00 0.00 H new ATOM 0 HB3 GLN B 201 -12.592 14.458 5.446 1.00 0.00 H new ATOM 0 HG2 GLN B 201 -11.186 12.476 4.829 1.00 0.00 H new ATOM 0 HG3 GLN B 201 -9.760 13.495 4.841 1.00 0.00 H new ATOM 0 HE21 GLN B 201 -12.587 12.910 7.082 1.00 0.00 H new ATOM 0 HE22 GLN B 201 -11.579 12.719 8.520 1.00 0.00 H new ATOM 1737 N HIS B 202 -10.079 13.867 2.044 1.00 0.00 N ATOM 1738 CA HIS B 202 -8.809 13.803 1.347 1.00 0.00 C ATOM 1739 C HIS B 202 -8.976 14.027 -0.150 1.00 0.00 C ATOM 1740 O HIS B 202 -9.855 13.438 -0.787 1.00 0.00 O ATOM 1741 CB HIS B 202 -8.212 12.409 1.602 1.00 0.00 C ATOM 1742 CG HIS B 202 -6.705 12.371 1.614 1.00 0.00 C ATOM 1743 ND1 HIS B 202 -5.844 12.925 0.689 1.00 0.00 N ATOM 1744 CD2 HIS B 202 -5.946 11.812 2.605 1.00 0.00 C ATOM 1745 CE1 HIS B 202 -4.590 12.698 1.113 1.00 0.00 C ATOM 1746 NE2 HIS B 202 -4.604 12.022 2.272 1.00 0.00 N ATOM 0 H HIS B 202 -10.636 13.018 1.948 1.00 0.00 H new ATOM 0 HA HIS B 202 -8.152 14.590 1.717 1.00 0.00 H new ATOM 0 HB2 HIS B 202 -8.581 12.038 2.559 1.00 0.00 H new ATOM 0 HB3 HIS B 202 -8.575 11.726 0.834 1.00 0.00 H new ATOM 0 HD2 HIS B 202 -6.315 11.302 3.483 1.00 0.00 H new ATOM 0 HE1 HIS B 202 -3.697 13.015 0.595 1.00 0.00 H new ATOM 0 HE2 HIS B 202 -3.791 11.719 2.808 1.00 0.00 H new ATOM 1754 N SER B 203 -8.052 14.777 -0.750 1.00 0.00 N ATOM 1755 CA SER B 203 -8.041 15.061 -2.181 1.00 0.00 C ATOM 1756 C SER B 203 -7.991 13.741 -2.976 1.00 0.00 C ATOM 1757 O SER B 203 -8.665 13.580 -3.996 1.00 0.00 O ATOM 1758 CB SER B 203 -6.805 15.919 -2.484 1.00 0.00 C ATOM 1759 OG SER B 203 -6.657 16.968 -1.542 1.00 0.00 O ATOM 0 H SER B 203 -7.279 15.210 -0.246 1.00 0.00 H new ATOM 0 HA SER B 203 -8.945 15.596 -2.472 1.00 0.00 H new ATOM 0 HB2 SER B 203 -5.914 15.291 -2.474 1.00 0.00 H new ATOM 0 HB3 SER B 203 -6.889 16.338 -3.487 1.00 0.00 H new ATOM 0 HG SER B 203 -5.860 17.495 -1.761 1.00 0.00 H new ATOM 1765 N LEU B 204 -7.242 12.756 -2.458 1.00 0.00 N ATOM 1766 CA LEU B 204 -7.034 11.426 -3.021 1.00 0.00 C ATOM 1767 C LEU B 204 -8.323 10.645 -3.237 1.00 0.00 C ATOM 1768 O LEU B 204 -8.324 9.749 -4.082 1.00 0.00 O ATOM 1769 CB LEU B 204 -6.103 10.603 -2.111 1.00 0.00 C ATOM 1770 CG LEU B 204 -4.626 11.022 -2.159 1.00 0.00 C ATOM 1771 CD1 LEU B 204 -3.816 10.137 -1.207 1.00 0.00 C ATOM 1772 CD2 LEU B 204 -4.067 10.906 -3.581 1.00 0.00 C ATOM 0 H LEU B 204 -6.737 12.881 -1.581 1.00 0.00 H new ATOM 0 HA LEU B 204 -6.583 11.585 -4.000 1.00 0.00 H new ATOM 0 HB2 LEU B 204 -6.457 10.684 -1.083 1.00 0.00 H new ATOM 0 HB3 LEU B 204 -6.178 9.552 -2.392 1.00 0.00 H new ATOM 0 HG LEU B 204 -4.550 12.064 -1.849 1.00 0.00 H new ATOM 0 HD11 LEU B 204 -2.767 10.432 -1.239 1.00 0.00 H new ATOM 0 HD12 LEU B 204 -4.195 10.253 -0.191 1.00 0.00 H new ATOM 0 HD13 LEU B 204 -3.909 9.095 -1.512 1.00 0.00 H new ATOM 0 HD21 LEU B 204 -3.020 11.209 -3.586 1.00 0.00 H new ATOM 0 HD22 LEU B 204 -4.148 9.873 -3.921 1.00 0.00 H new ATOM 0 HD23 LEU B 204 -4.635 11.553 -4.249 1.00 0.00 H new ATOM 1784 N PHE B 205 -9.399 10.970 -2.517 1.00 0.00 N ATOM 1785 CA PHE B 205 -10.683 10.289 -2.665 1.00 0.00 C ATOM 1786 C PHE B 205 -11.122 10.314 -4.130 1.00 0.00 C ATOM 1787 O PHE B 205 -11.672 9.328 -4.617 1.00 0.00 O ATOM 1788 CB PHE B 205 -11.713 10.952 -1.745 1.00 0.00 C ATOM 1789 CG PHE B 205 -13.159 10.496 -1.865 1.00 0.00 C ATOM 1790 CD1 PHE B 205 -13.947 10.899 -2.963 1.00 0.00 C ATOM 1791 CD2 PHE B 205 -13.760 9.783 -0.813 1.00 0.00 C ATOM 1792 CE1 PHE B 205 -15.323 10.623 -2.989 1.00 0.00 C ATOM 1793 CE2 PHE B 205 -15.141 9.519 -0.834 1.00 0.00 C ATOM 1794 CZ PHE B 205 -15.927 9.943 -1.918 1.00 0.00 C ATOM 0 H PHE B 205 -9.403 11.712 -1.817 1.00 0.00 H new ATOM 0 HA PHE B 205 -10.591 9.243 -2.373 1.00 0.00 H new ATOM 0 HB2 PHE B 205 -11.395 10.793 -0.715 1.00 0.00 H new ATOM 0 HB3 PHE B 205 -11.683 12.026 -1.926 1.00 0.00 H new ATOM 0 HD1 PHE B 205 -13.489 11.423 -3.789 1.00 0.00 H new ATOM 0 HD2 PHE B 205 -13.159 9.437 0.015 1.00 0.00 H new ATOM 0 HE1 PHE B 205 -15.919 10.934 -3.834 1.00 0.00 H new ATOM 0 HE2 PHE B 205 -15.599 8.988 -0.013 1.00 0.00 H new ATOM 0 HZ PHE B 205 -16.989 9.748 -1.928 1.00 0.00 H new ATOM 1804 N ASN B 206 -10.873 11.428 -4.834 1.00 0.00 N ATOM 1805 CA ASN B 206 -11.227 11.585 -6.243 1.00 0.00 C ATOM 1806 C ASN B 206 -10.492 10.540 -7.078 1.00 0.00 C ATOM 1807 O ASN B 206 -11.127 9.703 -7.714 1.00 0.00 O ATOM 1808 CB ASN B 206 -10.926 13.008 -6.735 1.00 0.00 C ATOM 1809 CG ASN B 206 -12.189 13.839 -6.768 1.00 0.00 C ATOM 1810 OD1 ASN B 206 -12.823 13.941 -7.811 1.00 0.00 O ATOM 1811 ND2 ASN B 206 -12.594 14.405 -5.643 1.00 0.00 N ATOM 0 H ASN B 206 -10.417 12.248 -4.434 1.00 0.00 H new ATOM 0 HA ASN B 206 -12.300 11.428 -6.356 1.00 0.00 H new ATOM 0 HB2 ASN B 206 -10.193 13.478 -6.079 1.00 0.00 H new ATOM 0 HB3 ASN B 206 -10.484 12.968 -7.731 1.00 0.00 H new ATOM 0 HD21 ASN B 206 -13.458 14.946 -5.627 1.00 0.00 H new ATOM 0 HD22 ASN B 206 -12.042 14.300 -4.792 1.00 0.00 H new ATOM 1818 N TYR B 207 -9.156 10.557 -7.061 1.00 0.00 N ATOM 1819 CA TYR B 207 -8.329 9.609 -7.801 1.00 0.00 C ATOM 1820 C TYR B 207 -8.742 8.164 -7.478 1.00 0.00 C ATOM 1821 O TYR B 207 -8.889 7.346 -8.390 1.00 0.00 O ATOM 1822 CB TYR B 207 -6.855 9.880 -7.463 1.00 0.00 C ATOM 1823 CG TYR B 207 -5.873 8.905 -8.081 1.00 0.00 C ATOM 1824 CD1 TYR B 207 -5.515 9.023 -9.435 1.00 0.00 C ATOM 1825 CD2 TYR B 207 -5.310 7.881 -7.297 1.00 0.00 C ATOM 1826 CE1 TYR B 207 -4.594 8.130 -10.006 1.00 0.00 C ATOM 1827 CE2 TYR B 207 -4.386 6.981 -7.859 1.00 0.00 C ATOM 1828 CZ TYR B 207 -4.027 7.098 -9.222 1.00 0.00 C ATOM 1829 OH TYR B 207 -3.162 6.205 -9.782 1.00 0.00 O ATOM 0 H TYR B 207 -8.616 11.238 -6.527 1.00 0.00 H new ATOM 0 HA TYR B 207 -8.471 9.740 -8.874 1.00 0.00 H new ATOM 0 HB2 TYR B 207 -6.601 10.888 -7.791 1.00 0.00 H new ATOM 0 HB3 TYR B 207 -6.735 9.858 -6.380 1.00 0.00 H new ATOM 0 HD1 TYR B 207 -5.951 9.805 -10.040 1.00 0.00 H new ATOM 0 HD2 TYR B 207 -5.589 7.785 -6.258 1.00 0.00 H new ATOM 0 HE1 TYR B 207 -4.318 8.231 -11.045 1.00 0.00 H new ATOM 0 HE2 TYR B 207 -3.951 6.202 -7.250 1.00 0.00 H new ATOM 0 HH TYR B 207 -2.241 6.461 -9.565 1.00 0.00 H new ATOM 1839 N PHE B 208 -8.965 7.863 -6.194 1.00 0.00 N ATOM 1840 CA PHE B 208 -9.373 6.552 -5.715 1.00 0.00 C ATOM 1841 C PHE B 208 -10.714 6.143 -6.322 1.00 0.00 C ATOM 1842 O PHE B 208 -10.773 5.098 -6.964 1.00 0.00 O ATOM 1843 CB PHE B 208 -9.419 6.535 -4.179 1.00 0.00 C ATOM 1844 CG PHE B 208 -10.062 5.296 -3.570 1.00 0.00 C ATOM 1845 CD1 PHE B 208 -11.452 5.271 -3.337 1.00 0.00 C ATOM 1846 CD2 PHE B 208 -9.291 4.169 -3.223 1.00 0.00 C ATOM 1847 CE1 PHE B 208 -12.056 4.158 -2.731 1.00 0.00 C ATOM 1848 CE2 PHE B 208 -9.899 3.054 -2.619 1.00 0.00 C ATOM 1849 CZ PHE B 208 -11.278 3.054 -2.354 1.00 0.00 C ATOM 0 H PHE B 208 -8.862 8.548 -5.445 1.00 0.00 H new ATOM 0 HA PHE B 208 -8.634 5.818 -6.036 1.00 0.00 H new ATOM 0 HB2 PHE B 208 -8.401 6.622 -3.799 1.00 0.00 H new ATOM 0 HB3 PHE B 208 -9.964 7.415 -3.837 1.00 0.00 H new ATOM 0 HD1 PHE B 208 -12.058 6.116 -3.628 1.00 0.00 H new ATOM 0 HD2 PHE B 208 -8.229 4.161 -3.422 1.00 0.00 H new ATOM 0 HE1 PHE B 208 -13.122 4.152 -2.555 1.00 0.00 H new ATOM 0 HE2 PHE B 208 -9.302 2.193 -2.357 1.00 0.00 H new ATOM 0 HZ PHE B 208 -11.737 2.209 -1.863 1.00 0.00 H new ATOM 1859 N THR B 209 -11.787 6.927 -6.151 1.00 0.00 N ATOM 1860 CA THR B 209 -13.092 6.559 -6.696 1.00 0.00 C ATOM 1861 C THR B 209 -13.002 6.379 -8.210 1.00 0.00 C ATOM 1862 O THR B 209 -13.529 5.405 -8.735 1.00 0.00 O ATOM 1863 CB THR B 209 -14.207 7.509 -6.212 1.00 0.00 C ATOM 1864 OG1 THR B 209 -15.462 6.888 -6.381 1.00 0.00 O ATOM 1865 CG2 THR B 209 -14.279 8.892 -6.862 1.00 0.00 C ATOM 0 H THR B 209 -11.774 7.812 -5.644 1.00 0.00 H new ATOM 0 HA THR B 209 -13.389 5.587 -6.301 1.00 0.00 H new ATOM 0 HB THR B 209 -13.947 7.694 -5.170 1.00 0.00 H new ATOM 0 HG1 THR B 209 -16.170 7.491 -6.072 1.00 0.00 H new ATOM 0 HG21 THR B 209 -15.106 9.455 -6.430 1.00 0.00 H new ATOM 0 HG22 THR B 209 -13.345 9.426 -6.685 1.00 0.00 H new ATOM 0 HG23 THR B 209 -14.437 8.782 -7.935 1.00 0.00 H new ATOM 1873 N LYS B 210 -12.268 7.243 -8.914 1.00 0.00 N ATOM 1874 CA LYS B 210 -12.118 7.138 -10.362 1.00 0.00 C ATOM 1875 C LYS B 210 -11.478 5.803 -10.743 1.00 0.00 C ATOM 1876 O LYS B 210 -11.793 5.266 -11.807 1.00 0.00 O ATOM 1877 CB LYS B 210 -11.318 8.338 -10.858 1.00 0.00 C ATOM 1878 CG LYS B 210 -12.166 9.614 -10.746 1.00 0.00 C ATOM 1879 CD LYS B 210 -11.276 10.830 -10.952 1.00 0.00 C ATOM 1880 CE LYS B 210 -12.159 12.074 -11.112 1.00 0.00 C ATOM 1881 NZ LYS B 210 -11.371 13.264 -11.464 1.00 0.00 N ATOM 0 H LYS B 210 -11.766 8.028 -8.499 1.00 0.00 H new ATOM 0 HA LYS B 210 -13.094 7.155 -10.847 1.00 0.00 H new ATOM 0 HB2 LYS B 210 -10.405 8.445 -10.272 1.00 0.00 H new ATOM 0 HB3 LYS B 210 -11.016 8.182 -11.893 1.00 0.00 H new ATOM 0 HG2 LYS B 210 -12.962 9.602 -11.490 1.00 0.00 H new ATOM 0 HG3 LYS B 210 -12.645 9.661 -9.768 1.00 0.00 H new ATOM 0 HD2 LYS B 210 -10.603 10.952 -10.103 1.00 0.00 H new ATOM 0 HD3 LYS B 210 -10.652 10.695 -11.836 1.00 0.00 H new ATOM 0 HE2 LYS B 210 -12.906 11.892 -11.884 1.00 0.00 H new ATOM 0 HE3 LYS B 210 -12.699 12.258 -10.183 1.00 0.00 H new ATOM 0 HZ1 LYS B 210 -12.004 14.083 -11.563 1.00 0.00 H new ATOM 0 HZ2 LYS B 210 -10.675 13.453 -10.715 1.00 0.00 H new ATOM 0 HZ3 LYS B 210 -10.876 13.099 -12.363 1.00 0.00 H new ATOM 1895 N LEU B 211 -10.546 5.294 -9.930 1.00 0.00 N ATOM 1896 CA LEU B 211 -9.904 4.003 -10.169 1.00 0.00 C ATOM 1897 C LEU B 211 -10.943 2.908 -9.934 1.00 0.00 C ATOM 1898 O LEU B 211 -11.040 2.028 -10.781 1.00 0.00 O ATOM 1899 CB LEU B 211 -8.697 3.747 -9.251 1.00 0.00 C ATOM 1900 CG LEU B 211 -7.403 4.482 -9.629 1.00 0.00 C ATOM 1901 CD1 LEU B 211 -6.407 4.289 -8.483 1.00 0.00 C ATOM 1902 CD2 LEU B 211 -6.789 3.961 -10.936 1.00 0.00 C ATOM 0 H LEU B 211 -10.218 5.768 -9.089 1.00 0.00 H new ATOM 0 HA LEU B 211 -9.529 4.003 -11.193 1.00 0.00 H new ATOM 0 HB2 LEU B 211 -8.970 4.031 -8.235 1.00 0.00 H new ATOM 0 HB3 LEU B 211 -8.494 2.676 -9.239 1.00 0.00 H new ATOM 0 HG LEU B 211 -7.635 5.535 -9.789 1.00 0.00 H new ATOM 0 HD11 LEU B 211 -5.475 4.801 -8.721 1.00 0.00 H new ATOM 0 HD12 LEU B 211 -6.824 4.703 -7.565 1.00 0.00 H new ATOM 0 HD13 LEU B 211 -6.212 3.225 -8.345 1.00 0.00 H new ATOM 0 HD21 LEU B 211 -5.877 4.515 -11.156 1.00 0.00 H new ATOM 0 HD22 LEU B 211 -6.554 2.902 -10.831 1.00 0.00 H new ATOM 0 HD23 LEU B 211 -7.500 4.095 -11.751 1.00 0.00 H new ATOM 1914 N VAL B 212 -11.706 2.941 -8.830 1.00 0.00 N ATOM 1915 CA VAL B 212 -12.736 1.936 -8.544 1.00 0.00 C ATOM 1916 C VAL B 212 -13.676 1.867 -9.744 1.00 0.00 C ATOM 1917 O VAL B 212 -13.863 0.796 -10.302 1.00 0.00 O ATOM 1918 CB VAL B 212 -13.511 2.260 -7.245 1.00 0.00 C ATOM 1919 CG1 VAL B 212 -14.628 1.251 -6.938 1.00 0.00 C ATOM 1920 CG2 VAL B 212 -12.579 2.291 -6.027 1.00 0.00 C ATOM 0 H VAL B 212 -11.625 3.663 -8.114 1.00 0.00 H new ATOM 0 HA VAL B 212 -12.263 0.968 -8.382 1.00 0.00 H new ATOM 0 HB VAL B 212 -13.953 3.240 -7.424 1.00 0.00 H new ATOM 0 HG11 VAL B 212 -15.132 1.536 -6.014 1.00 0.00 H new ATOM 0 HG12 VAL B 212 -15.347 1.244 -7.757 1.00 0.00 H new ATOM 0 HG13 VAL B 212 -14.198 0.256 -6.825 1.00 0.00 H new ATOM 0 HG21 VAL B 212 -13.157 2.522 -5.132 1.00 0.00 H new ATOM 0 HG22 VAL B 212 -12.101 1.318 -5.910 1.00 0.00 H new ATOM 0 HG23 VAL B 212 -11.815 3.055 -6.172 1.00 0.00 H new ATOM 1930 N GLU B 213 -14.187 3.017 -10.185 1.00 0.00 N ATOM 1931 CA GLU B 213 -15.103 3.176 -11.309 1.00 0.00 C ATOM 1932 C GLU B 213 -14.521 2.592 -12.603 1.00 0.00 C ATOM 1933 O GLU B 213 -15.250 2.098 -13.462 1.00 0.00 O ATOM 1934 CB GLU B 213 -15.370 4.680 -11.470 1.00 0.00 C ATOM 1935 CG GLU B 213 -16.216 5.252 -10.322 1.00 0.00 C ATOM 1936 CD GLU B 213 -17.720 5.039 -10.487 1.00 0.00 C ATOM 1937 OE1 GLU B 213 -18.153 4.328 -11.416 1.00 0.00 O ATOM 1938 OE2 GLU B 213 -18.495 5.605 -9.683 1.00 0.00 O ATOM 0 H GLU B 213 -13.960 3.908 -9.743 1.00 0.00 H new ATOM 0 HA GLU B 213 -16.027 2.633 -11.112 1.00 0.00 H new ATOM 0 HB2 GLU B 213 -14.420 5.212 -11.517 1.00 0.00 H new ATOM 0 HB3 GLU B 213 -15.881 4.856 -12.417 1.00 0.00 H new ATOM 0 HG2 GLU B 213 -15.896 4.794 -9.386 1.00 0.00 H new ATOM 0 HG3 GLU B 213 -16.019 6.321 -10.238 1.00 0.00 H new ATOM 1945 N GLN B 214 -13.203 2.676 -12.777 1.00 0.00 N ATOM 1946 CA GLN B 214 -12.517 2.157 -13.950 1.00 0.00 C ATOM 1947 C GLN B 214 -12.390 0.634 -13.867 1.00 0.00 C ATOM 1948 O GLN B 214 -12.501 -0.062 -14.882 1.00 0.00 O ATOM 1949 CB GLN B 214 -11.165 2.873 -14.050 1.00 0.00 C ATOM 1950 CG GLN B 214 -10.357 2.550 -15.306 1.00 0.00 C ATOM 1951 CD GLN B 214 -9.231 3.570 -15.448 1.00 0.00 C ATOM 1952 OE1 GLN B 214 -9.463 4.729 -15.790 1.00 0.00 O ATOM 1953 NE2 GLN B 214 -8.011 3.217 -15.091 1.00 0.00 N ATOM 0 H GLN B 214 -12.579 3.112 -12.098 1.00 0.00 H new ATOM 0 HA GLN B 214 -13.082 2.353 -14.861 1.00 0.00 H new ATOM 0 HB2 GLN B 214 -11.336 3.949 -14.013 1.00 0.00 H new ATOM 0 HB3 GLN B 214 -10.568 2.615 -13.175 1.00 0.00 H new ATOM 0 HG2 GLN B 214 -9.946 1.542 -15.241 1.00 0.00 H new ATOM 0 HG3 GLN B 214 -11.001 2.575 -16.185 1.00 0.00 H new ATOM 0 HE21 GLN B 214 -7.821 2.256 -14.808 1.00 0.00 H new ATOM 0 HE22 GLN B 214 -7.258 3.905 -15.098 1.00 0.00 H new ATOM 1962 N TYR B 215 -12.147 0.113 -12.668 1.00 0.00 N ATOM 1963 CA TYR B 215 -12.001 -1.307 -12.403 1.00 0.00 C ATOM 1964 C TYR B 215 -13.361 -2.021 -12.412 1.00 0.00 C ATOM 1965 O TYR B 215 -13.427 -3.140 -12.919 1.00 0.00 O ATOM 1966 CB TYR B 215 -11.305 -1.501 -11.052 1.00 0.00 C ATOM 1967 CG TYR B 215 -9.895 -0.949 -10.888 1.00 0.00 C ATOM 1968 CD1 TYR B 215 -9.057 -0.658 -11.985 1.00 0.00 C ATOM 1969 CD2 TYR B 215 -9.414 -0.751 -9.583 1.00 0.00 C ATOM 1970 CE1 TYR B 215 -7.744 -0.200 -11.772 1.00 0.00 C ATOM 1971 CE2 TYR B 215 -8.098 -0.319 -9.357 1.00 0.00 C ATOM 1972 CZ TYR B 215 -7.250 -0.060 -10.455 1.00 0.00 C ATOM 1973 OH TYR B 215 -5.954 0.298 -10.232 1.00 0.00 O ATOM 0 H TYR B 215 -12.044 0.688 -11.832 1.00 0.00 H new ATOM 0 HA TYR B 215 -11.394 -1.748 -13.194 1.00 0.00 H new ATOM 0 HB2 TYR B 215 -11.933 -1.047 -10.285 1.00 0.00 H new ATOM 0 HB3 TYR B 215 -11.271 -2.571 -10.844 1.00 0.00 H new ATOM 0 HD1 TYR B 215 -9.425 -0.787 -12.992 1.00 0.00 H new ATOM 0 HD2 TYR B 215 -10.066 -0.934 -8.742 1.00 0.00 H new ATOM 0 HE1 TYR B 215 -7.114 0.045 -12.614 1.00 0.00 H new ATOM 0 HE2 TYR B 215 -7.736 -0.185 -8.348 1.00 0.00 H new ATOM 0 HH TYR B 215 -5.790 0.347 -9.267 1.00 0.00 H new ATOM 1983 N THR B 216 -14.435 -1.400 -11.911 1.00 0.00 N ATOM 1984 CA THR B 216 -15.767 -2.001 -11.870 1.00 0.00 C ATOM 1985 C THR B 216 -16.269 -2.398 -13.254 1.00 0.00 C ATOM 1986 O THR B 216 -15.915 -1.767 -14.256 1.00 0.00 O ATOM 1987 CB THR B 216 -16.788 -1.029 -11.252 1.00 0.00 C ATOM 1988 OG1 THR B 216 -16.607 0.300 -11.707 1.00 0.00 O ATOM 1989 CG2 THR B 216 -16.734 -1.049 -9.729 1.00 0.00 C ATOM 0 H THR B 216 -14.401 -0.458 -11.520 1.00 0.00 H new ATOM 0 HA THR B 216 -15.674 -2.898 -11.258 1.00 0.00 H new ATOM 0 HB THR B 216 -17.768 -1.377 -11.580 1.00 0.00 H new ATOM 0 HG1 THR B 216 -16.190 0.288 -12.594 1.00 0.00 H new ATOM 0 HG21 THR B 216 -17.469 -0.350 -9.330 1.00 0.00 H new ATOM 0 HG22 THR B 216 -16.956 -2.054 -9.370 1.00 0.00 H new ATOM 0 HG23 THR B 216 -15.738 -0.757 -9.396 1.00 0.00 H new