USER MOD reduce.3.24.130724 H: found=0, std=0, add=637, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 644 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 22 ASN : amide:sc= -2.37 K(o=-2.4,f=-1.2) USER MOD Set 1.2: A 164 ASN : amide:sc= -0.0435 K(o=-2.4,f=-1.2) USER MOD Set 2.1: A 24 SER OG : rot 40:sc= 0.937 USER MOD Set 2.2: A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0.07) USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 SER OG : rot -131:sc= -0.135 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 38:sc= 1.18 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot -100:sc= -0.0997 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -1.26 K(o=-1.3,f=-0.47) USER MOD Single : A 104 SER OG : rot -158:sc= 0.00478! USER MOD Single : A 106 GLN : amide:sc= -0.168 K(o=-0.17,f=-2.1!) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 TYR OH : rot -159:sc= -0.106 USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 162 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 165 SER OG : rot 180:sc= 0 USER MOD Single : A 197 SER OG : rot 180:sc= -0.651 USER MOD Single : A 201 SER OG : rot 173:sc= -1.23 USER MOD Single : A 202 TYR OH : rot 180:sc= 0 USER MOD Single : A 205 LYS NZ :NH3+ 153:sc= -0.147 (180deg=-0.624) USER MOD ----------------------------------------------------------------- ATOM 177 N ASN A 13 31.922 -6.789 -2.721 1.00 41.31 N ATOM 178 CA ASN A 13 32.000 -6.144 -1.415 1.00 70.14 C ATOM 179 C ASN A 13 32.106 -7.181 -0.302 1.00 45.23 C ATOM 180 O ASN A 13 32.031 -8.383 -0.552 1.00 64.53 O ATOM 181 CB ASN A 13 30.773 -5.258 -1.187 1.00 33.12 C ATOM 182 CG ASN A 13 30.847 -3.956 -1.963 1.00 21.50 C ATOM 183 OD1 ASN A 13 30.943 -3.957 -3.190 1.00 23.41 O ATOM 184 ND2 ASN A 13 30.803 -2.839 -1.247 1.00 53.15 N ATOM 0 HA ASN A 13 32.896 -5.524 -1.396 1.00 70.14 H new ATOM 0 HB2 ASN A 13 29.876 -5.802 -1.481 1.00 33.12 H new ATOM 0 HB3 ASN A 13 30.679 -5.039 -0.123 1.00 33.12 H new ATOM 0 HD21 ASN A 13 30.849 -1.933 -1.713 1.00 53.15 H new ATOM 0 HD22 ASN A 13 30.723 -2.887 -0.231 1.00 53.15 H new ATOM 191 N GLN A 14 32.280 -6.706 0.927 1.00 22.23 N ATOM 192 CA GLN A 14 32.397 -7.592 2.079 1.00 34.44 C ATOM 193 C GLN A 14 31.071 -8.293 2.364 1.00 43.53 C ATOM 194 O GLN A 14 30.009 -7.676 2.310 1.00 53.13 O ATOM 195 CB GLN A 14 32.847 -6.806 3.311 1.00 32.52 C ATOM 196 CG GLN A 14 31.768 -5.901 3.882 1.00 12.51 C ATOM 197 CD GLN A 14 32.326 -4.844 4.815 1.00 25.32 C ATOM 198 OE1 GLN A 14 32.290 -4.996 6.036 1.00 12.32 O ATOM 199 NE2 GLN A 14 32.849 -3.765 4.243 1.00 3.23 N ATOM 0 H GLN A 14 32.343 -5.713 1.151 1.00 22.23 H new ATOM 0 HA GLN A 14 33.146 -8.350 1.848 1.00 34.44 H new ATOM 0 HB2 GLN A 14 33.167 -7.507 4.082 1.00 32.52 H new ATOM 0 HB3 GLN A 14 33.715 -6.202 3.049 1.00 32.52 H new ATOM 0 HG2 GLN A 14 31.237 -5.414 3.064 1.00 12.51 H new ATOM 0 HG3 GLN A 14 31.039 -6.506 4.420 1.00 12.51 H new ATOM 0 HE21 GLN A 14 32.858 -3.680 3.227 1.00 3.23 H new ATOM 0 HE22 GLN A 14 33.242 -3.021 4.820 1.00 3.23 H new ATOM 208 N GLY A 15 31.143 -9.585 2.666 1.00 3.33 N ATOM 209 CA GLY A 15 29.943 -10.347 2.955 1.00 74.31 C ATOM 210 C GLY A 15 29.598 -11.327 1.849 1.00 5.34 C ATOM 211 O GLY A 15 28.534 -11.944 1.869 1.00 74.21 O ATOM 0 H GLY A 15 32.011 -10.118 2.716 1.00 3.33 H new ATOM 0 HA2 GLY A 15 30.078 -10.891 3.890 1.00 74.31 H new ATOM 0 HA3 GLY A 15 29.108 -9.662 3.103 1.00 74.31 H new ATOM 215 N ASP A 16 30.499 -11.467 0.885 1.00 40.35 N ATOM 216 CA ASP A 16 30.285 -12.378 -0.235 1.00 5.32 C ATOM 217 C ASP A 16 30.592 -13.816 0.169 1.00 50.23 C ATOM 218 O ASP A 16 31.418 -14.062 1.047 1.00 2.53 O ATOM 219 CB ASP A 16 31.157 -11.971 -1.424 1.00 15.11 C ATOM 220 CG ASP A 16 31.235 -13.055 -2.481 1.00 61.03 C ATOM 221 OD1 ASP A 16 30.426 -13.017 -3.432 1.00 41.11 O ATOM 222 OD2 ASP A 16 32.106 -13.942 -2.358 1.00 72.13 O ATOM 0 H ASP A 16 31.385 -10.962 0.855 1.00 40.35 H new ATOM 0 HA ASP A 16 29.236 -12.318 -0.526 1.00 5.32 H new ATOM 0 HB2 ASP A 16 30.757 -11.061 -1.870 1.00 15.11 H new ATOM 0 HB3 ASP A 16 32.162 -11.738 -1.071 1.00 15.11 H new ATOM 227 N TRP A 17 29.920 -14.762 -0.477 1.00 65.14 N ATOM 228 CA TRP A 17 30.121 -16.177 -0.185 1.00 31.24 C ATOM 229 C TRP A 17 30.344 -16.972 -1.466 1.00 11.21 C ATOM 230 O TRP A 17 29.686 -16.732 -2.479 1.00 64.03 O ATOM 231 CB TRP A 17 28.916 -16.737 0.574 1.00 4.00 C ATOM 232 CG TRP A 17 27.601 -16.357 -0.035 1.00 53.42 C ATOM 233 CD1 TRP A 17 26.962 -15.154 0.077 1.00 65.20 C ATOM 234 CD2 TRP A 17 26.763 -17.184 -0.850 1.00 2.44 C ATOM 235 NE1 TRP A 17 25.778 -15.185 -0.619 1.00 4.43 N ATOM 236 CE2 TRP A 17 25.633 -16.418 -1.197 1.00 2.13 C ATOM 237 CE3 TRP A 17 26.857 -18.496 -1.321 1.00 4.41 C ATOM 238 CZ2 TRP A 17 24.607 -16.923 -1.992 1.00 4.13 C ATOM 239 CZ3 TRP A 17 25.839 -18.995 -2.110 1.00 21.33 C ATOM 240 CH2 TRP A 17 24.726 -18.210 -2.439 1.00 32.12 C ATOM 0 H TRP A 17 29.232 -14.575 -1.206 1.00 65.14 H new ATOM 0 HA TRP A 17 31.011 -16.271 0.437 1.00 31.24 H new ATOM 0 HB2 TRP A 17 28.991 -17.824 0.609 1.00 4.00 H new ATOM 0 HB3 TRP A 17 28.947 -16.382 1.604 1.00 4.00 H new ATOM 0 HD1 TRP A 17 27.333 -14.304 0.631 1.00 65.20 H new ATOM 0 HE1 TRP A 17 25.114 -14.414 -0.693 1.00 4.43 H new ATOM 0 HE3 TRP A 17 27.711 -19.109 -1.073 1.00 4.41 H new ATOM 0 HZ2 TRP A 17 23.748 -16.320 -2.246 1.00 4.13 H new ATOM 0 HZ3 TRP A 17 25.902 -20.008 -2.480 1.00 21.33 H new ATOM 0 HH2 TRP A 17 23.947 -18.630 -3.058 1.00 32.12 H new ATOM 251 N VAL A 18 31.276 -17.919 -1.416 1.00 32.03 N ATOM 252 CA VAL A 18 31.584 -18.750 -2.573 1.00 3.14 C ATOM 253 C VAL A 18 31.623 -20.227 -2.195 1.00 41.51 C ATOM 254 O VAL A 18 32.287 -20.615 -1.235 1.00 3.33 O ATOM 255 CB VAL A 18 32.934 -18.357 -3.202 1.00 71.43 C ATOM 256 CG1 VAL A 18 33.173 -19.139 -4.485 1.00 22.33 C ATOM 257 CG2 VAL A 18 32.984 -16.859 -3.464 1.00 75.30 C ATOM 0 H VAL A 18 31.831 -18.129 -0.586 1.00 32.03 H new ATOM 0 HA VAL A 18 30.790 -18.585 -3.301 1.00 3.14 H new ATOM 0 HB VAL A 18 33.729 -18.606 -2.499 1.00 71.43 H new ATOM 0 HG11 VAL A 18 34.131 -18.848 -4.915 1.00 22.33 H new ATOM 0 HG12 VAL A 18 33.183 -20.206 -4.264 1.00 22.33 H new ATOM 0 HG13 VAL A 18 32.376 -18.924 -5.196 1.00 22.33 H new ATOM 0 HG21 VAL A 18 33.945 -16.599 -3.908 1.00 75.30 H new ATOM 0 HG22 VAL A 18 32.181 -16.582 -4.147 1.00 75.30 H new ATOM 0 HG23 VAL A 18 32.862 -16.321 -2.524 1.00 75.30 H new ATOM 267 N ALA A 19 30.905 -21.046 -2.957 1.00 24.15 N ATOM 268 CA ALA A 19 30.860 -22.480 -2.703 1.00 34.33 C ATOM 269 C ALA A 19 31.917 -23.216 -3.519 1.00 11.25 C ATOM 270 O ALA A 19 31.772 -23.387 -4.729 1.00 44.24 O ATOM 271 CB ALA A 19 29.474 -23.027 -3.015 1.00 22.44 C ATOM 0 H ALA A 19 30.347 -20.741 -3.755 1.00 24.15 H new ATOM 0 HA ALA A 19 31.075 -22.644 -1.647 1.00 34.33 H new ATOM 0 HB1 ALA A 19 29.454 -24.099 -2.821 1.00 22.44 H new ATOM 0 HB2 ALA A 19 28.736 -22.530 -2.385 1.00 22.44 H new ATOM 0 HB3 ALA A 19 29.238 -22.843 -4.063 1.00 22.44 H new ATOM 277 N SER A 20 32.980 -23.649 -2.849 1.00 23.11 N ATOM 278 CA SER A 20 34.064 -24.364 -3.512 1.00 55.44 C ATOM 279 C SER A 20 33.991 -25.858 -3.217 1.00 62.51 C ATOM 280 O SER A 20 33.515 -26.272 -2.160 1.00 42.12 O ATOM 281 CB SER A 20 35.417 -23.808 -3.065 1.00 63.10 C ATOM 282 OG SER A 20 35.984 -24.610 -2.043 1.00 5.24 O ATOM 0 H SER A 20 33.114 -23.517 -1.846 1.00 23.11 H new ATOM 0 HA SER A 20 33.957 -24.220 -4.587 1.00 55.44 H new ATOM 0 HB2 SER A 20 36.096 -23.765 -3.917 1.00 63.10 H new ATOM 0 HB3 SER A 20 35.293 -22.787 -2.704 1.00 63.10 H new ATOM 0 HG SER A 20 36.281 -24.038 -1.305 1.00 5.24 H new ATOM 288 N PHE A 21 34.467 -26.665 -4.161 1.00 23.33 N ATOM 289 CA PHE A 21 34.456 -28.115 -4.004 1.00 2.54 C ATOM 290 C PHE A 21 35.436 -28.774 -4.969 1.00 61.31 C ATOM 291 O PHE A 21 35.383 -28.544 -6.177 1.00 34.22 O ATOM 292 CB PHE A 21 33.047 -28.663 -4.236 1.00 13.22 C ATOM 293 CG PHE A 21 32.406 -28.156 -5.497 1.00 11.45 C ATOM 294 CD1 PHE A 21 31.724 -26.949 -5.505 1.00 71.10 C ATOM 295 CD2 PHE A 21 32.485 -28.884 -6.672 1.00 64.22 C ATOM 296 CE1 PHE A 21 31.133 -26.480 -6.664 1.00 63.30 C ATOM 297 CE2 PHE A 21 31.898 -28.421 -7.833 1.00 13.53 C ATOM 298 CZ PHE A 21 31.221 -27.216 -7.829 1.00 62.43 C ATOM 0 H PHE A 21 34.865 -26.339 -5.042 1.00 23.33 H new ATOM 0 HA PHE A 21 34.766 -28.348 -2.985 1.00 2.54 H new ATOM 0 HB2 PHE A 21 33.091 -29.752 -4.272 1.00 13.22 H new ATOM 0 HB3 PHE A 21 32.418 -28.398 -3.386 1.00 13.22 H new ATOM 0 HD1 PHE A 21 31.654 -26.369 -4.597 1.00 71.10 H new ATOM 0 HD2 PHE A 21 33.013 -29.826 -6.681 1.00 64.22 H new ATOM 0 HE1 PHE A 21 30.603 -25.539 -6.658 1.00 63.30 H new ATOM 0 HE2 PHE A 21 31.968 -28.999 -8.742 1.00 13.53 H new ATOM 0 HZ PHE A 21 30.762 -26.851 -8.736 1.00 62.43 H new ATOM 308 N ASN A 22 36.331 -29.594 -4.427 1.00 10.24 N ATOM 309 CA ASN A 22 37.324 -30.286 -5.240 1.00 23.51 C ATOM 310 C ASN A 22 37.708 -31.621 -4.608 1.00 41.14 C ATOM 311 O ASN A 22 37.378 -31.892 -3.455 1.00 5.14 O ATOM 312 CB ASN A 22 38.569 -29.414 -5.413 1.00 52.23 C ATOM 313 CG ASN A 22 39.027 -28.793 -4.107 1.00 54.43 C ATOM 314 OD1 ASN A 22 38.886 -27.588 -3.898 1.00 4.41 O ATOM 315 ND2 ASN A 22 39.577 -29.615 -3.222 1.00 22.42 N ATOM 0 H ASN A 22 36.389 -29.795 -3.429 1.00 10.24 H new ATOM 0 HA ASN A 22 36.886 -30.480 -6.219 1.00 23.51 H new ATOM 0 HB2 ASN A 22 39.377 -30.017 -5.828 1.00 52.23 H new ATOM 0 HB3 ASN A 22 38.358 -28.624 -6.134 1.00 52.23 H new ATOM 0 HD21 ASN A 22 39.903 -29.255 -2.325 1.00 22.42 H new ATOM 0 HD22 ASN A 22 39.673 -30.607 -3.439 1.00 22.42 H new ATOM 322 N PHE A 23 38.409 -32.451 -5.375 1.00 31.45 N ATOM 323 CA PHE A 23 38.838 -33.759 -4.891 1.00 41.40 C ATOM 324 C PHE A 23 40.349 -33.788 -4.675 1.00 74.42 C ATOM 325 O PHE A 23 41.119 -33.383 -5.546 1.00 11.04 O ATOM 326 CB PHE A 23 38.431 -34.851 -5.881 1.00 53.42 C ATOM 327 CG PHE A 23 37.043 -34.677 -6.429 1.00 40.01 C ATOM 328 CD1 PHE A 23 35.994 -34.323 -5.596 1.00 2.20 C ATOM 329 CD2 PHE A 23 36.787 -34.867 -7.777 1.00 63.42 C ATOM 330 CE1 PHE A 23 34.716 -34.161 -6.096 1.00 41.04 C ATOM 331 CE2 PHE A 23 35.511 -34.707 -8.284 1.00 25.13 C ATOM 332 CZ PHE A 23 34.474 -34.355 -7.443 1.00 3.44 C ATOM 0 H PHE A 23 38.692 -32.242 -6.332 1.00 31.45 H new ATOM 0 HA PHE A 23 38.348 -33.945 -3.935 1.00 41.40 H new ATOM 0 HB2 PHE A 23 39.141 -34.863 -6.708 1.00 53.42 H new ATOM 0 HB3 PHE A 23 38.499 -35.821 -5.388 1.00 53.42 H new ATOM 0 HD1 PHE A 23 36.177 -34.172 -4.542 1.00 2.20 H new ATOM 0 HD2 PHE A 23 37.594 -35.143 -8.440 1.00 63.42 H new ATOM 0 HE1 PHE A 23 33.908 -33.883 -5.436 1.00 41.04 H new ATOM 0 HE2 PHE A 23 35.325 -34.857 -9.337 1.00 25.13 H new ATOM 0 HZ PHE A 23 33.476 -34.232 -7.837 1.00 3.44 H new ATOM 342 N SER A 24 40.765 -34.273 -3.509 1.00 35.10 N ATOM 343 CA SER A 24 42.182 -34.354 -3.177 1.00 10.54 C ATOM 344 C SER A 24 42.762 -35.702 -3.592 1.00 42.51 C ATOM 345 O SER A 24 42.060 -36.714 -3.611 1.00 43.41 O ATOM 346 CB SER A 24 42.388 -34.137 -1.676 1.00 54.54 C ATOM 347 OG SER A 24 41.231 -34.504 -0.944 1.00 64.20 O ATOM 0 H SER A 24 40.141 -34.616 -2.779 1.00 35.10 H new ATOM 0 HA SER A 24 42.704 -33.570 -3.726 1.00 10.54 H new ATOM 0 HB2 SER A 24 43.240 -34.725 -1.334 1.00 54.54 H new ATOM 0 HB3 SER A 24 42.626 -33.090 -1.486 1.00 54.54 H new ATOM 0 HG SER A 24 40.843 -35.316 -1.331 1.00 64.20 H new ATOM 353 N LYS A 25 44.048 -35.708 -3.923 1.00 42.15 N ATOM 354 CA LYS A 25 44.726 -36.930 -4.338 1.00 24.54 C ATOM 355 C LYS A 25 46.221 -36.853 -4.040 1.00 13.50 C ATOM 356 O LYS A 25 46.818 -35.777 -4.095 1.00 23.41 O ATOM 357 CB LYS A 25 44.505 -37.180 -5.832 1.00 5.32 C ATOM 358 CG LYS A 25 45.144 -36.130 -6.724 1.00 54.02 C ATOM 359 CD LYS A 25 46.554 -36.524 -7.129 1.00 64.13 C ATOM 360 CE LYS A 25 46.915 -35.976 -8.501 1.00 15.33 C ATOM 361 NZ LYS A 25 47.405 -34.572 -8.426 1.00 24.31 N ATOM 0 H LYS A 25 44.643 -34.879 -3.912 1.00 42.15 H new ATOM 0 HA LYS A 25 44.303 -37.759 -3.771 1.00 24.54 H new ATOM 0 HB2 LYS A 25 44.907 -38.159 -6.092 1.00 5.32 H new ATOM 0 HB3 LYS A 25 43.434 -37.212 -6.032 1.00 5.32 H new ATOM 0 HG2 LYS A 25 44.534 -35.990 -7.616 1.00 54.02 H new ATOM 0 HG3 LYS A 25 45.169 -35.174 -6.201 1.00 54.02 H new ATOM 0 HD2 LYS A 25 47.263 -36.152 -6.390 1.00 64.13 H new ATOM 0 HD3 LYS A 25 46.641 -37.610 -7.136 1.00 64.13 H new ATOM 0 HE2 LYS A 25 47.682 -36.605 -8.953 1.00 15.33 H new ATOM 0 HE3 LYS A 25 46.042 -36.022 -9.152 1.00 15.33 H new ATOM 0 HZ1 LYS A 25 47.641 -34.235 -9.381 1.00 24.31 H new ATOM 0 HZ2 LYS A 25 46.664 -33.967 -8.018 1.00 24.31 H new ATOM 0 HZ3 LYS A 25 48.253 -34.532 -7.826 1.00 24.31 H new ATOM 375 N VAL A 26 46.817 -37.997 -3.727 1.00 24.01 N ATOM 376 CA VAL A 26 48.242 -38.058 -3.423 1.00 63.03 C ATOM 377 C VAL A 26 49.063 -38.294 -4.686 1.00 24.14 C ATOM 378 O VAL A 26 48.681 -39.085 -5.548 1.00 45.44 O ATOM 379 CB VAL A 26 48.552 -39.174 -2.406 1.00 40.44 C ATOM 380 CG1 VAL A 26 47.766 -38.959 -1.121 1.00 42.55 C ATOM 381 CG2 VAL A 26 48.249 -40.539 -3.004 1.00 45.32 C ATOM 0 H VAL A 26 46.336 -38.895 -3.677 1.00 24.01 H new ATOM 0 HA VAL A 26 48.515 -37.096 -2.990 1.00 63.03 H new ATOM 0 HB VAL A 26 49.614 -39.137 -2.164 1.00 40.44 H new ATOM 0 HG11 VAL A 26 47.998 -39.757 -0.415 1.00 42.55 H new ATOM 0 HG12 VAL A 26 48.038 -37.998 -0.685 1.00 42.55 H new ATOM 0 HG13 VAL A 26 46.699 -38.968 -1.342 1.00 42.55 H new ATOM 0 HG21 VAL A 26 48.474 -41.315 -2.272 1.00 45.32 H new ATOM 0 HG22 VAL A 26 47.195 -40.591 -3.276 1.00 45.32 H new ATOM 0 HG23 VAL A 26 48.861 -40.691 -3.893 1.00 45.32 H new ATOM 731 N THR A 53 41.461 -41.519 -4.232 1.00 70.01 N ATOM 732 CA THR A 53 41.176 -40.094 -4.115 1.00 61.03 C ATOM 733 C THR A 53 40.084 -39.834 -3.084 1.00 30.53 C ATOM 734 O THR A 53 39.238 -40.692 -2.831 1.00 14.05 O ATOM 735 CB THR A 53 40.743 -39.495 -5.467 1.00 32.32 C ATOM 736 OG1 THR A 53 40.425 -38.109 -5.308 1.00 55.34 O ATOM 737 CG2 THR A 53 39.538 -40.237 -6.026 1.00 1.23 C ATOM 0 HA THR A 53 42.099 -39.613 -3.791 1.00 61.03 H new ATOM 0 HB THR A 53 41.571 -39.599 -6.168 1.00 32.32 H new ATOM 0 HG1 THR A 53 41.050 -37.701 -4.673 1.00 55.34 H new ATOM 0 HG21 THR A 53 39.250 -39.797 -6.981 1.00 1.23 H new ATOM 0 HG22 THR A 53 39.793 -41.287 -6.173 1.00 1.23 H new ATOM 0 HG23 THR A 53 38.706 -40.160 -5.326 1.00 1.23 H new ATOM 745 N THR A 54 40.108 -38.645 -2.490 1.00 34.44 N ATOM 746 CA THR A 54 39.120 -38.273 -1.486 1.00 11.21 C ATOM 747 C THR A 54 38.533 -36.896 -1.776 1.00 12.01 C ATOM 748 O THR A 54 39.262 -35.911 -1.894 1.00 5.10 O ATOM 749 CB THR A 54 39.730 -38.269 -0.072 1.00 23.52 C ATOM 750 OG1 THR A 54 41.001 -37.608 -0.088 1.00 14.05 O ATOM 751 CG2 THR A 54 39.898 -39.689 0.449 1.00 53.44 C ATOM 0 H THR A 54 40.801 -37.923 -2.687 1.00 34.44 H new ATOM 0 HA THR A 54 38.328 -39.020 -1.531 1.00 11.21 H new ATOM 0 HB THR A 54 39.051 -37.733 0.591 1.00 23.52 H new ATOM 0 HG1 THR A 54 41.381 -37.608 0.815 1.00 14.05 H new ATOM 0 HG21 THR A 54 40.330 -39.661 1.449 1.00 53.44 H new ATOM 0 HG22 THR A 54 38.925 -40.180 0.488 1.00 53.44 H new ATOM 0 HG23 THR A 54 40.559 -40.245 -0.216 1.00 53.44 H new ATOM 759 N LEU A 55 37.210 -36.834 -1.890 1.00 64.31 N ATOM 760 CA LEU A 55 36.524 -35.577 -2.167 1.00 43.21 C ATOM 761 C LEU A 55 36.578 -34.650 -0.957 1.00 25.03 C ATOM 762 O LEU A 55 36.674 -35.104 0.184 1.00 22.12 O ATOM 763 CB LEU A 55 35.068 -35.843 -2.555 1.00 43.34 C ATOM 764 CG LEU A 55 34.246 -36.659 -1.558 1.00 22.42 C ATOM 765 CD1 LEU A 55 33.609 -35.749 -0.519 1.00 4.13 C ATOM 766 CD2 LEU A 55 33.182 -37.470 -2.282 1.00 34.12 C ATOM 0 H LEU A 55 36.592 -37.640 -1.795 1.00 64.31 H new ATOM 0 HA LEU A 55 37.032 -35.089 -2.999 1.00 43.21 H new ATOM 0 HB2 LEU A 55 34.572 -34.884 -2.705 1.00 43.34 H new ATOM 0 HB3 LEU A 55 35.057 -36.361 -3.514 1.00 43.34 H new ATOM 0 HG LEU A 55 34.915 -37.350 -1.045 1.00 22.42 H new ATOM 0 HD11 LEU A 55 33.028 -36.348 0.182 1.00 4.13 H new ATOM 0 HD12 LEU A 55 34.389 -35.212 0.022 1.00 4.13 H new ATOM 0 HD13 LEU A 55 32.953 -35.033 -1.015 1.00 4.13 H new ATOM 0 HD21 LEU A 55 32.606 -38.045 -1.557 1.00 34.12 H new ATOM 0 HD22 LEU A 55 32.516 -36.797 -2.822 1.00 34.12 H new ATOM 0 HD23 LEU A 55 33.660 -38.150 -2.987 1.00 34.12 H new ATOM 778 N THR A 56 36.516 -33.346 -1.213 1.00 35.42 N ATOM 779 CA THR A 56 36.555 -32.356 -0.146 1.00 45.33 C ATOM 780 C THR A 56 35.839 -31.075 -0.557 1.00 10.33 C ATOM 781 O THR A 56 35.965 -30.618 -1.693 1.00 13.23 O ATOM 782 CB THR A 56 38.005 -32.013 0.249 1.00 24.51 C ATOM 783 OG1 THR A 56 38.011 -31.028 1.288 1.00 55.43 O ATOM 784 CG2 THR A 56 38.786 -31.499 -0.951 1.00 14.00 C ATOM 0 H THR A 56 36.439 -32.952 -2.151 1.00 35.42 H new ATOM 0 HA THR A 56 36.045 -32.796 0.711 1.00 45.33 H new ATOM 0 HB THR A 56 38.484 -32.923 0.611 1.00 24.51 H new ATOM 0 HG1 THR A 56 38.936 -30.817 1.534 1.00 55.43 H new ATOM 0 HG21 THR A 56 39.806 -31.264 -0.648 1.00 14.00 H new ATOM 0 HG22 THR A 56 38.806 -32.264 -1.727 1.00 14.00 H new ATOM 0 HG23 THR A 56 38.307 -30.600 -1.339 1.00 14.00 H new ATOM 792 N PHE A 57 35.085 -30.498 0.374 1.00 72.43 N ATOM 793 CA PHE A 57 34.346 -29.270 0.108 1.00 43.21 C ATOM 794 C PHE A 57 34.890 -28.117 0.946 1.00 13.21 C ATOM 795 O PHE A 57 35.465 -28.327 2.013 1.00 24.44 O ATOM 796 CB PHE A 57 32.858 -29.470 0.400 1.00 63.30 C ATOM 797 CG PHE A 57 32.299 -30.738 -0.180 1.00 61.52 C ATOM 798 CD1 PHE A 57 32.563 -31.090 -1.495 1.00 13.15 C ATOM 799 CD2 PHE A 57 31.510 -31.579 0.589 1.00 52.23 C ATOM 800 CE1 PHE A 57 32.049 -32.254 -2.031 1.00 21.33 C ATOM 801 CE2 PHE A 57 30.993 -32.745 0.057 1.00 73.33 C ATOM 802 CZ PHE A 57 31.264 -33.085 -1.254 1.00 41.43 C ATOM 0 H PHE A 57 34.970 -30.862 1.320 1.00 72.43 H new ATOM 0 HA PHE A 57 34.471 -29.022 -0.946 1.00 43.21 H new ATOM 0 HB2 PHE A 57 32.705 -29.475 1.479 1.00 63.30 H new ATOM 0 HB3 PHE A 57 32.301 -28.622 0.003 1.00 63.30 H new ATOM 0 HD1 PHE A 57 33.178 -30.446 -2.107 1.00 13.15 H new ATOM 0 HD2 PHE A 57 31.297 -31.320 1.616 1.00 52.23 H new ATOM 0 HE1 PHE A 57 32.260 -32.515 -3.057 1.00 21.33 H new ATOM 0 HE2 PHE A 57 30.377 -33.390 0.666 1.00 73.33 H new ATOM 0 HZ PHE A 57 30.864 -33.997 -1.671 1.00 41.43 H new ATOM 812 N ASP A 58 34.703 -26.897 0.453 1.00 3.40 N ATOM 813 CA ASP A 58 35.174 -25.709 1.156 1.00 2.45 C ATOM 814 C ASP A 58 34.356 -24.483 0.759 1.00 22.41 C ATOM 815 O ASP A 58 33.855 -24.396 -0.362 1.00 41.03 O ATOM 816 CB ASP A 58 36.654 -25.467 0.859 1.00 43.41 C ATOM 817 CG ASP A 58 37.083 -24.047 1.171 1.00 11.21 C ATOM 818 OD1 ASP A 58 37.722 -23.838 2.223 1.00 44.25 O ATOM 819 OD2 ASP A 58 36.780 -23.145 0.362 1.00 50.01 O ATOM 0 H ASP A 58 34.229 -26.705 -0.430 1.00 3.40 H new ATOM 0 HA ASP A 58 35.049 -25.877 2.226 1.00 2.45 H new ATOM 0 HB2 ASP A 58 37.257 -26.162 1.443 1.00 43.41 H new ATOM 0 HB3 ASP A 58 36.850 -25.680 -0.192 1.00 43.41 H new ATOM 824 N ILE A 59 34.224 -23.541 1.686 1.00 22.22 N ATOM 825 CA ILE A 59 33.468 -22.321 1.433 1.00 14.15 C ATOM 826 C ILE A 59 34.356 -21.088 1.554 1.00 71.22 C ATOM 827 O ILE A 59 34.949 -20.837 2.602 1.00 23.31 O ATOM 828 CB ILE A 59 32.281 -22.182 2.406 1.00 62.41 C ATOM 829 CG1 ILE A 59 31.464 -23.475 2.436 1.00 42.10 C ATOM 830 CG2 ILE A 59 31.405 -21.004 2.008 1.00 60.43 C ATOM 831 CD1 ILE A 59 30.884 -23.855 1.091 1.00 22.14 C ATOM 0 H ILE A 59 34.631 -23.599 2.620 1.00 22.22 H new ATOM 0 HA ILE A 59 33.087 -22.392 0.414 1.00 14.15 H new ATOM 0 HB ILE A 59 32.670 -21.998 3.407 1.00 62.41 H new ATOM 0 HG12 ILE A 59 32.098 -24.287 2.792 1.00 42.10 H new ATOM 0 HG13 ILE A 59 30.652 -23.366 3.155 1.00 42.10 H new ATOM 0 HG21 ILE A 59 30.571 -20.919 2.705 1.00 60.43 H new ATOM 0 HG22 ILE A 59 31.994 -20.087 2.034 1.00 60.43 H new ATOM 0 HG23 ILE A 59 31.021 -21.160 1.000 1.00 60.43 H new ATOM 0 HD11 ILE A 59 30.318 -24.781 1.188 1.00 22.14 H new ATOM 0 HD12 ILE A 59 30.224 -23.061 0.742 1.00 22.14 H new ATOM 0 HD13 ILE A 59 31.692 -23.997 0.373 1.00 22.14 H new ATOM 843 N ALA A 60 34.442 -20.320 0.473 1.00 41.20 N ATOM 844 CA ALA A 60 35.254 -19.110 0.458 1.00 1.11 C ATOM 845 C ALA A 60 34.413 -17.879 0.780 1.00 63.15 C ATOM 846 O ALA A 60 33.589 -17.451 -0.028 1.00 13.34 O ATOM 847 CB ALA A 60 35.935 -18.947 -0.893 1.00 61.14 C ATOM 0 H ALA A 60 33.959 -20.515 -0.404 1.00 41.20 H new ATOM 0 HA ALA A 60 36.019 -19.207 1.229 1.00 1.11 H new ATOM 0 HB1 ALA A 60 36.538 -18.039 -0.889 1.00 61.14 H new ATOM 0 HB2 ALA A 60 36.576 -19.808 -1.083 1.00 61.14 H new ATOM 0 HB3 ALA A 60 35.179 -18.877 -1.675 1.00 61.14 H new ATOM 853 N TYR A 61 34.627 -17.316 1.964 1.00 40.14 N ATOM 854 CA TYR A 61 33.885 -16.136 2.393 1.00 4.43 C ATOM 855 C TYR A 61 34.695 -14.865 2.151 1.00 34.50 C ATOM 856 O TYR A 61 35.792 -14.703 2.684 1.00 2.21 O ATOM 857 CB TYR A 61 33.523 -16.247 3.875 1.00 60.31 C ATOM 858 CG TYR A 61 32.069 -15.955 4.167 1.00 50.41 C ATOM 859 CD1 TYR A 61 31.518 -14.713 3.873 1.00 4.01 C ATOM 860 CD2 TYR A 61 31.246 -16.918 4.736 1.00 72.11 C ATOM 861 CE1 TYR A 61 30.190 -14.440 4.138 1.00 31.10 C ATOM 862 CE2 TYR A 61 29.916 -16.654 5.003 1.00 35.30 C ATOM 863 CZ TYR A 61 29.393 -15.414 4.703 1.00 55.25 C ATOM 864 OH TYR A 61 28.070 -15.147 4.968 1.00 35.13 O ATOM 0 H TYR A 61 35.307 -17.657 2.643 1.00 40.14 H new ATOM 0 HA TYR A 61 32.969 -16.080 1.804 1.00 4.43 H new ATOM 0 HB2 TYR A 61 33.760 -17.252 4.224 1.00 60.31 H new ATOM 0 HB3 TYR A 61 34.145 -15.557 4.445 1.00 60.31 H new ATOM 0 HD1 TYR A 61 32.139 -13.948 3.430 1.00 4.01 H new ATOM 0 HD2 TYR A 61 31.652 -17.890 4.974 1.00 72.11 H new ATOM 0 HE1 TYR A 61 29.778 -13.469 3.904 1.00 31.10 H new ATOM 0 HE2 TYR A 61 29.290 -17.415 5.444 1.00 35.30 H new ATOM 0 HH TYR A 61 27.649 -15.939 5.364 1.00 35.13 H new ATOM 874 N PHE A 62 34.144 -13.967 1.341 1.00 23.20 N ATOM 875 CA PHE A 62 34.814 -12.710 1.026 1.00 40.11 C ATOM 876 C PHE A 62 34.265 -11.572 1.882 1.00 50.14 C ATOM 877 O PHE A 62 33.224 -10.992 1.570 1.00 22.44 O ATOM 878 CB PHE A 62 34.644 -12.376 -0.457 1.00 43.12 C ATOM 879 CG PHE A 62 35.828 -12.759 -1.297 1.00 60.23 C ATOM 880 CD1 PHE A 62 36.183 -14.090 -1.452 1.00 74.14 C ATOM 881 CD2 PHE A 62 36.587 -11.790 -1.933 1.00 65.45 C ATOM 882 CE1 PHE A 62 37.272 -14.446 -2.224 1.00 60.44 C ATOM 883 CE2 PHE A 62 37.678 -12.140 -2.707 1.00 24.02 C ATOM 884 CZ PHE A 62 38.020 -13.470 -2.853 1.00 65.03 C ATOM 0 H PHE A 62 33.236 -14.086 0.891 1.00 23.20 H new ATOM 0 HA PHE A 62 35.875 -12.827 1.246 1.00 40.11 H new ATOM 0 HB2 PHE A 62 33.759 -12.886 -0.837 1.00 43.12 H new ATOM 0 HB3 PHE A 62 34.465 -11.306 -0.562 1.00 43.12 H new ATOM 0 HD1 PHE A 62 35.601 -14.858 -0.963 1.00 74.14 H new ATOM 0 HD2 PHE A 62 36.323 -10.749 -1.823 1.00 65.45 H new ATOM 0 HE1 PHE A 62 37.538 -15.487 -2.336 1.00 60.44 H new ATOM 0 HE2 PHE A 62 38.262 -11.375 -3.197 1.00 24.02 H new ATOM 0 HZ PHE A 62 38.871 -13.746 -3.458 1.00 65.03 H new ATOM 894 N VAL A 63 34.972 -11.258 2.962 1.00 21.11 N ATOM 895 CA VAL A 63 34.557 -10.190 3.863 1.00 1.20 C ATOM 896 C VAL A 63 35.746 -9.331 4.281 1.00 10.11 C ATOM 897 O VAL A 63 36.064 -9.226 5.465 1.00 21.33 O ATOM 898 CB VAL A 63 33.876 -10.752 5.125 1.00 24.12 C ATOM 899 CG1 VAL A 63 33.205 -9.637 5.912 1.00 1.24 C ATOM 900 CG2 VAL A 63 32.872 -11.832 4.751 1.00 3.11 C ATOM 0 H VAL A 63 35.835 -11.728 3.235 1.00 21.11 H new ATOM 0 HA VAL A 63 33.842 -9.575 3.316 1.00 1.20 H new ATOM 0 HB VAL A 63 34.640 -11.202 5.760 1.00 24.12 H new ATOM 0 HG11 VAL A 63 32.729 -10.054 6.800 1.00 1.24 H new ATOM 0 HG12 VAL A 63 33.952 -8.902 6.212 1.00 1.24 H new ATOM 0 HG13 VAL A 63 32.451 -9.155 5.289 1.00 1.24 H new ATOM 0 HG21 VAL A 63 32.400 -12.218 5.654 1.00 3.11 H new ATOM 0 HG22 VAL A 63 32.110 -11.409 4.096 1.00 3.11 H new ATOM 0 HG23 VAL A 63 33.385 -12.643 4.235 1.00 3.11 H new ATOM 910 N SER A 64 36.399 -8.716 3.300 1.00 74.30 N ATOM 911 CA SER A 64 37.554 -7.868 3.564 1.00 45.14 C ATOM 912 C SER A 64 38.009 -7.157 2.293 1.00 1.34 C ATOM 913 O SER A 64 37.320 -7.184 1.274 1.00 55.44 O ATOM 914 CB SER A 64 38.704 -8.700 4.135 1.00 51.31 C ATOM 915 OG SER A 64 39.385 -7.994 5.159 1.00 33.53 O ATOM 0 H SER A 64 36.147 -8.790 2.314 1.00 74.30 H new ATOM 0 HA SER A 64 37.261 -7.115 4.295 1.00 45.14 H new ATOM 0 HB2 SER A 64 38.316 -9.638 4.532 1.00 51.31 H new ATOM 0 HB3 SER A 64 39.403 -8.955 3.338 1.00 51.31 H new ATOM 0 HG SER A 64 40.207 -7.602 4.796 1.00 33.53 H new ATOM 921 N SER A 65 39.173 -6.520 2.363 1.00 65.01 N ATOM 922 CA SER A 65 39.719 -5.797 1.220 1.00 13.32 C ATOM 923 C SER A 65 40.462 -6.745 0.282 1.00 3.03 C ATOM 924 O SER A 65 40.273 -6.708 -0.932 1.00 72.21 O ATOM 925 CB SER A 65 40.661 -4.688 1.693 1.00 14.42 C ATOM 926 OG SER A 65 39.944 -3.661 2.357 1.00 44.15 O ATOM 0 H SER A 65 39.757 -6.490 3.199 1.00 65.01 H new ATOM 0 HA SER A 65 38.888 -5.350 0.674 1.00 13.32 H new ATOM 0 HB2 SER A 65 41.411 -5.105 2.365 1.00 14.42 H new ATOM 0 HB3 SER A 65 41.194 -4.270 0.839 1.00 14.42 H new ATOM 0 HG SER A 65 40.567 -2.965 2.652 1.00 44.15 H new ATOM 932 N ASN A 66 41.308 -7.593 0.857 1.00 1.35 N ATOM 933 CA ASN A 66 42.081 -8.550 0.075 1.00 14.03 C ATOM 934 C ASN A 66 42.102 -9.916 0.754 1.00 61.43 C ATOM 935 O ASN A 66 41.970 -10.950 0.096 1.00 3.33 O ATOM 936 CB ASN A 66 43.511 -8.044 -0.122 1.00 1.34 C ATOM 937 CG ASN A 66 44.036 -7.306 1.095 1.00 31.52 C ATOM 938 OD1 ASN A 66 43.839 -6.099 1.236 1.00 2.41 O ATOM 939 ND2 ASN A 66 44.707 -8.031 1.982 1.00 25.11 N ATOM 0 H ASN A 66 41.476 -7.637 1.862 1.00 1.35 H new ATOM 0 HA ASN A 66 41.603 -8.655 -0.899 1.00 14.03 H new ATOM 0 HB2 ASN A 66 44.165 -8.888 -0.342 1.00 1.34 H new ATOM 0 HB3 ASN A 66 43.543 -7.382 -0.987 1.00 1.34 H new ATOM 0 HD21 ASN A 66 45.083 -7.590 2.821 1.00 25.11 H new ATOM 0 HD22 ASN A 66 44.846 -9.029 1.824 1.00 25.11 H new ATOM 946 N ILE A 67 42.269 -9.914 2.072 1.00 44.41 N ATOM 947 CA ILE A 67 42.306 -11.152 2.840 1.00 3.13 C ATOM 948 C ILE A 67 40.927 -11.798 2.908 1.00 31.00 C ATOM 949 O ILE A 67 39.982 -11.214 3.438 1.00 1.33 O ATOM 950 CB ILE A 67 42.820 -10.911 4.272 1.00 73.04 C ATOM 951 CG1 ILE A 67 42.011 -9.801 4.947 1.00 23.10 C ATOM 952 CG2 ILE A 67 44.299 -10.559 4.252 1.00 60.14 C ATOM 953 CD1 ILE A 67 41.322 -10.243 6.219 1.00 62.32 C ATOM 0 H ILE A 67 42.381 -9.068 2.631 1.00 44.41 H new ATOM 0 HA ILE A 67 42.993 -11.823 2.325 1.00 3.13 H new ATOM 0 HB ILE A 67 42.693 -11.828 4.847 1.00 73.04 H new ATOM 0 HG12 ILE A 67 42.674 -8.966 5.174 1.00 23.10 H new ATOM 0 HG13 ILE A 67 41.262 -9.432 4.247 1.00 23.10 H new ATOM 0 HG21 ILE A 67 44.647 -10.392 5.271 1.00 60.14 H new ATOM 0 HG22 ILE A 67 44.862 -11.379 3.806 1.00 60.14 H new ATOM 0 HG23 ILE A 67 44.450 -9.654 3.664 1.00 60.14 H new ATOM 0 HD11 ILE A 67 40.768 -9.405 6.643 1.00 62.32 H new ATOM 0 HD12 ILE A 67 40.633 -11.058 5.996 1.00 62.32 H new ATOM 0 HD13 ILE A 67 42.068 -10.585 6.937 1.00 62.32 H new ATOM 965 N ALA A 68 40.819 -13.008 2.369 1.00 34.14 N ATOM 966 CA ALA A 68 39.555 -13.735 2.373 1.00 30.42 C ATOM 967 C ALA A 68 39.637 -14.974 3.257 1.00 21.22 C ATOM 968 O ALA A 68 40.728 -15.448 3.580 1.00 74.30 O ATOM 969 CB ALA A 68 39.165 -14.122 0.954 1.00 40.51 C ATOM 0 H ALA A 68 41.591 -13.505 1.924 1.00 34.14 H new ATOM 0 HA ALA A 68 38.788 -13.078 2.783 1.00 30.42 H new ATOM 0 HB1 ALA A 68 38.220 -14.664 0.972 1.00 40.51 H new ATOM 0 HB2 ALA A 68 39.056 -13.222 0.348 1.00 40.51 H new ATOM 0 HB3 ALA A 68 39.940 -14.757 0.524 1.00 40.51 H new ATOM 975 N VAL A 69 38.479 -15.495 3.647 1.00 33.42 N ATOM 976 CA VAL A 69 38.420 -16.681 4.495 1.00 53.45 C ATOM 977 C VAL A 69 38.017 -17.911 3.691 1.00 31.33 C ATOM 978 O VAL A 69 37.166 -17.835 2.804 1.00 65.42 O ATOM 979 CB VAL A 69 37.426 -16.492 5.656 1.00 42.33 C ATOM 980 CG1 VAL A 69 37.499 -17.668 6.618 1.00 1.21 C ATOM 981 CG2 VAL A 69 37.697 -15.181 6.380 1.00 25.54 C ATOM 0 H VAL A 69 37.568 -15.115 3.390 1.00 33.42 H new ATOM 0 HA VAL A 69 39.420 -16.829 4.903 1.00 53.45 H new ATOM 0 HB VAL A 69 36.417 -16.452 5.246 1.00 42.33 H new ATOM 0 HG11 VAL A 69 36.790 -17.517 7.432 1.00 1.21 H new ATOM 0 HG12 VAL A 69 37.252 -18.588 6.088 1.00 1.21 H new ATOM 0 HG13 VAL A 69 38.507 -17.743 7.025 1.00 1.21 H new ATOM 0 HG21 VAL A 69 36.986 -15.063 7.198 1.00 25.54 H new ATOM 0 HG22 VAL A 69 38.711 -15.189 6.780 1.00 25.54 H new ATOM 0 HG23 VAL A 69 37.589 -14.351 5.682 1.00 25.54 H new ATOM 991 N ASP A 70 38.632 -19.045 4.008 1.00 35.30 N ATOM 992 CA ASP A 70 38.336 -20.295 3.316 1.00 63.32 C ATOM 993 C ASP A 70 38.136 -21.433 4.312 1.00 74.43 C ATOM 994 O ASP A 70 39.098 -21.959 4.871 1.00 32.43 O ATOM 995 CB ASP A 70 39.465 -20.644 2.344 1.00 73.12 C ATOM 996 CG ASP A 70 38.951 -21.268 1.061 1.00 21.25 C ATOM 997 OD1 ASP A 70 37.992 -20.721 0.478 1.00 23.53 O ATOM 998 OD2 ASP A 70 39.509 -22.304 0.640 1.00 31.14 O ATOM 0 H ASP A 70 39.338 -19.125 4.739 1.00 35.30 H new ATOM 0 HA ASP A 70 37.412 -20.161 2.754 1.00 63.32 H new ATOM 0 HB2 ASP A 70 40.028 -19.741 2.106 1.00 73.12 H new ATOM 0 HB3 ASP A 70 40.157 -21.333 2.828 1.00 73.12 H new ATOM 1003 N PHE A 71 36.879 -21.808 4.529 1.00 55.14 N ATOM 1004 CA PHE A 71 36.551 -22.883 5.459 1.00 72.05 C ATOM 1005 C PHE A 71 36.631 -24.241 4.769 1.00 60.41 C ATOM 1006 O PHE A 71 35.797 -24.572 3.925 1.00 23.42 O ATOM 1007 CB PHE A 71 35.152 -22.673 6.039 1.00 74.53 C ATOM 1008 CG PHE A 71 34.945 -23.351 7.364 1.00 45.23 C ATOM 1009 CD1 PHE A 71 35.130 -22.655 8.548 1.00 52.42 C ATOM 1010 CD2 PHE A 71 34.565 -24.681 7.426 1.00 63.34 C ATOM 1011 CE1 PHE A 71 34.942 -23.276 9.769 1.00 55.12 C ATOM 1012 CE2 PHE A 71 34.375 -25.307 8.643 1.00 2.11 C ATOM 1013 CZ PHE A 71 34.563 -24.603 9.816 1.00 2.33 C ATOM 0 H PHE A 71 36.071 -21.383 4.074 1.00 55.14 H new ATOM 0 HA PHE A 71 37.279 -22.865 6.270 1.00 72.05 H new ATOM 0 HB2 PHE A 71 34.972 -21.604 6.155 1.00 74.53 H new ATOM 0 HB3 PHE A 71 34.413 -23.046 5.330 1.00 74.53 H new ATOM 0 HD1 PHE A 71 35.424 -21.616 8.517 1.00 52.42 H new ATOM 0 HD2 PHE A 71 34.415 -25.236 6.512 1.00 63.34 H new ATOM 0 HE1 PHE A 71 35.091 -22.724 10.685 1.00 55.12 H new ATOM 0 HE2 PHE A 71 34.080 -26.345 8.677 1.00 2.11 H new ATOM 0 HZ PHE A 71 34.414 -25.089 10.769 1.00 2.33 H new ATOM 1023 N PHE A 72 37.640 -25.025 5.133 1.00 1.02 N ATOM 1024 CA PHE A 72 37.831 -26.348 4.550 1.00 43.15 C ATOM 1025 C PHE A 72 37.064 -27.405 5.337 1.00 34.52 C ATOM 1026 O PHE A 72 37.078 -27.411 6.568 1.00 30.41 O ATOM 1027 CB PHE A 72 39.319 -26.703 4.513 1.00 43.30 C ATOM 1028 CG PHE A 72 39.998 -26.309 3.233 1.00 42.41 C ATOM 1029 CD1 PHE A 72 39.792 -27.035 2.072 1.00 72.31 C ATOM 1030 CD2 PHE A 72 40.844 -25.212 3.191 1.00 0.25 C ATOM 1031 CE1 PHE A 72 40.415 -26.676 0.892 1.00 40.43 C ATOM 1032 CE2 PHE A 72 41.469 -24.847 2.014 1.00 54.02 C ATOM 1033 CZ PHE A 72 41.256 -25.580 0.863 1.00 71.13 C ATOM 0 H PHE A 72 38.339 -24.767 5.830 1.00 1.02 H new ATOM 0 HA PHE A 72 37.444 -26.327 3.531 1.00 43.15 H new ATOM 0 HB2 PHE A 72 39.822 -26.214 5.347 1.00 43.30 H new ATOM 0 HB3 PHE A 72 39.432 -27.777 4.659 1.00 43.30 H new ATOM 0 HD1 PHE A 72 39.136 -27.893 2.089 1.00 72.31 H new ATOM 0 HD2 PHE A 72 41.017 -24.636 4.088 1.00 0.25 H new ATOM 0 HE1 PHE A 72 40.245 -27.251 -0.006 1.00 40.43 H new ATOM 0 HE2 PHE A 72 42.124 -23.989 1.994 1.00 54.02 H new ATOM 0 HZ PHE A 72 41.745 -25.297 -0.057 1.00 71.13 H new ATOM 1043 N VAL A 73 36.392 -28.299 4.618 1.00 61.43 N ATOM 1044 CA VAL A 73 35.619 -29.362 5.248 1.00 74.01 C ATOM 1045 C VAL A 73 35.638 -30.631 4.402 1.00 54.11 C ATOM 1046 O VAL A 73 35.269 -30.614 3.228 1.00 1.34 O ATOM 1047 CB VAL A 73 34.157 -28.933 5.476 1.00 30.34 C ATOM 1048 CG1 VAL A 73 34.059 -27.978 6.655 1.00 44.24 C ATOM 1049 CG2 VAL A 73 33.585 -28.300 4.217 1.00 40.42 C ATOM 0 H VAL A 73 36.368 -28.308 3.598 1.00 61.43 H new ATOM 0 HA VAL A 73 36.086 -29.564 6.212 1.00 74.01 H new ATOM 0 HB VAL A 73 33.568 -29.820 5.708 1.00 30.34 H new ATOM 0 HG11 VAL A 73 33.019 -27.686 6.801 1.00 44.24 H new ATOM 0 HG12 VAL A 73 34.427 -28.472 7.555 1.00 44.24 H new ATOM 0 HG13 VAL A 73 34.661 -27.091 6.456 1.00 44.24 H new ATOM 0 HG21 VAL A 73 32.552 -28.003 4.396 1.00 40.42 H new ATOM 0 HG22 VAL A 73 34.174 -27.422 3.951 1.00 40.42 H new ATOM 0 HG23 VAL A 73 33.619 -29.021 3.400 1.00 40.42 H new ATOM 1059 N GLY A 74 36.071 -31.733 5.008 1.00 50.24 N ATOM 1060 CA GLY A 74 36.131 -32.996 4.295 1.00 34.31 C ATOM 1061 C GLY A 74 35.620 -34.155 5.128 1.00 13.21 C ATOM 1062 O GLY A 74 35.201 -33.971 6.270 1.00 15.03 O ATOM 0 H GLY A 74 36.381 -31.774 5.979 1.00 50.24 H new ATOM 0 HA2 GLY A 74 35.542 -32.922 3.381 1.00 34.31 H new ATOM 0 HA3 GLY A 74 37.161 -33.193 3.996 1.00 34.31 H new ATOM 1457 N ALA A 101 37.063 -29.576 11.216 1.00 43.11 N ATOM 1458 CA ALA A 101 37.119 -28.600 10.135 1.00 62.35 C ATOM 1459 C ALA A 101 38.450 -27.853 10.138 1.00 31.20 C ATOM 1460 O ALA A 101 39.160 -27.836 11.143 1.00 63.44 O ATOM 1461 CB ALA A 101 35.962 -27.619 10.248 1.00 2.12 C ATOM 0 HA ALA A 101 37.035 -29.137 9.190 1.00 62.35 H new ATOM 0 HB1 ALA A 101 36.017 -26.896 9.434 1.00 2.12 H new ATOM 0 HB2 ALA A 101 35.018 -28.161 10.189 1.00 2.12 H new ATOM 0 HB3 ALA A 101 36.021 -27.096 11.202 1.00 2.12 H new ATOM 1467 N ILE A 102 38.780 -27.239 9.007 1.00 54.34 N ATOM 1468 CA ILE A 102 40.024 -26.490 8.880 1.00 25.20 C ATOM 1469 C ILE A 102 39.761 -25.058 8.426 1.00 32.22 C ATOM 1470 O ILE A 102 38.930 -24.816 7.550 1.00 72.31 O ATOM 1471 CB ILE A 102 40.987 -27.164 7.885 1.00 53.42 C ATOM 1472 CG1 ILE A 102 41.299 -28.594 8.331 1.00 11.21 C ATOM 1473 CG2 ILE A 102 42.267 -26.352 7.755 1.00 72.33 C ATOM 1474 CD1 ILE A 102 41.923 -29.444 7.247 1.00 50.44 C ATOM 0 H ILE A 102 38.203 -27.245 8.166 1.00 54.34 H new ATOM 0 HA ILE A 102 40.486 -26.476 9.867 1.00 25.20 H new ATOM 0 HB ILE A 102 40.506 -27.206 6.908 1.00 53.42 H new ATOM 0 HG12 ILE A 102 41.973 -28.560 9.187 1.00 11.21 H new ATOM 0 HG13 ILE A 102 40.378 -29.069 8.669 1.00 11.21 H new ATOM 0 HG21 ILE A 102 42.938 -26.841 7.048 1.00 72.33 H new ATOM 0 HG22 ILE A 102 42.028 -25.351 7.395 1.00 72.33 H new ATOM 0 HG23 ILE A 102 42.754 -26.281 8.728 1.00 72.33 H new ATOM 0 HD11 ILE A 102 42.116 -30.444 7.635 1.00 50.44 H new ATOM 0 HD12 ILE A 102 41.242 -29.509 6.399 1.00 50.44 H new ATOM 0 HD13 ILE A 102 42.861 -28.992 6.925 1.00 50.44 H new ATOM 1486 N LEU A 103 40.475 -24.113 9.025 1.00 1.24 N ATOM 1487 CA LEU A 103 40.321 -22.703 8.682 1.00 75.42 C ATOM 1488 C LEU A 103 41.557 -22.182 7.957 1.00 42.51 C ATOM 1489 O LEU A 103 42.608 -21.979 8.567 1.00 54.01 O ATOM 1490 CB LEU A 103 40.067 -21.876 9.943 1.00 44.32 C ATOM 1491 CG LEU A 103 38.613 -21.791 10.409 1.00 21.34 C ATOM 1492 CD1 LEU A 103 37.780 -20.992 9.419 1.00 71.44 C ATOM 1493 CD2 LEU A 103 38.031 -23.185 10.595 1.00 23.44 C ATOM 0 H LEU A 103 41.167 -24.297 9.751 1.00 1.24 H new ATOM 0 HA LEU A 103 39.464 -22.607 8.015 1.00 75.42 H new ATOM 0 HB2 LEU A 103 40.663 -22.294 10.754 1.00 44.32 H new ATOM 0 HB3 LEU A 103 40.431 -20.864 9.769 1.00 44.32 H new ATOM 0 HG LEU A 103 38.589 -21.277 11.370 1.00 21.34 H new ATOM 0 HD11 LEU A 103 36.749 -20.943 9.768 1.00 71.44 H new ATOM 0 HD12 LEU A 103 38.183 -19.983 9.335 1.00 71.44 H new ATOM 0 HD13 LEU A 103 37.810 -21.477 8.443 1.00 71.44 H new ATOM 0 HD21 LEU A 103 36.996 -23.106 10.927 1.00 23.44 H new ATOM 0 HD22 LEU A 103 38.068 -23.724 9.648 1.00 23.44 H new ATOM 0 HD23 LEU A 103 38.611 -23.725 11.343 1.00 23.44 H new ATOM 1505 N SER A 104 41.425 -21.963 6.653 1.00 53.22 N ATOM 1506 CA SER A 104 42.532 -21.466 5.845 1.00 74.24 C ATOM 1507 C SER A 104 42.184 -20.118 5.219 1.00 65.45 C ATOM 1508 O SER A 104 41.098 -19.936 4.670 1.00 30.23 O ATOM 1509 CB SER A 104 42.884 -22.474 4.749 1.00 52.43 C ATOM 1510 OG SER A 104 41.872 -22.525 3.758 1.00 22.25 O ATOM 0 H SER A 104 40.562 -22.122 6.133 1.00 53.22 H new ATOM 0 HA SER A 104 43.395 -21.333 6.497 1.00 74.24 H new ATOM 0 HB2 SER A 104 43.834 -22.199 4.290 1.00 52.43 H new ATOM 0 HB3 SER A 104 43.017 -23.462 5.189 1.00 52.43 H new ATOM 0 HG SER A 104 41.924 -23.380 3.281 1.00 22.25 H new ATOM 1516 N LEU A 105 43.117 -19.175 5.306 1.00 33.00 N ATOM 1517 CA LEU A 105 42.912 -17.842 4.749 1.00 34.42 C ATOM 1518 C LEU A 105 43.400 -17.775 3.306 1.00 52.34 C ATOM 1519 O LEU A 105 44.432 -18.351 2.962 1.00 33.55 O ATOM 1520 CB LEU A 105 43.640 -16.797 5.595 1.00 44.22 C ATOM 1521 CG LEU A 105 43.213 -15.344 5.382 1.00 72.44 C ATOM 1522 CD1 LEU A 105 42.040 -14.995 6.284 1.00 1.34 C ATOM 1523 CD2 LEU A 105 44.382 -14.402 5.633 1.00 31.43 C ATOM 0 H LEU A 105 44.022 -19.309 5.757 1.00 33.00 H new ATOM 0 HA LEU A 105 41.843 -17.630 4.762 1.00 34.42 H new ATOM 0 HB2 LEU A 105 43.497 -17.046 6.646 1.00 44.22 H new ATOM 0 HB3 LEU A 105 44.708 -16.874 5.392 1.00 44.22 H new ATOM 0 HG LEU A 105 42.895 -15.227 4.346 1.00 72.44 H new ATOM 0 HD11 LEU A 105 41.750 -13.957 6.119 1.00 1.34 H new ATOM 0 HD12 LEU A 105 41.198 -15.648 6.055 1.00 1.34 H new ATOM 0 HD13 LEU A 105 42.330 -15.129 7.326 1.00 1.34 H new ATOM 0 HD21 LEU A 105 44.060 -13.373 5.477 1.00 31.43 H new ATOM 0 HD22 LEU A 105 44.732 -14.521 6.659 1.00 31.43 H new ATOM 0 HD23 LEU A 105 45.193 -14.637 4.944 1.00 31.43 H new ATOM 1535 N GLN A 106 42.651 -17.066 2.466 1.00 25.11 N ATOM 1536 CA GLN A 106 43.010 -16.922 1.060 1.00 13.02 C ATOM 1537 C GLN A 106 43.630 -15.554 0.793 1.00 14.35 C ATOM 1538 O GLN A 106 43.114 -14.530 1.243 1.00 54.54 O ATOM 1539 CB GLN A 106 41.777 -17.117 0.176 1.00 20.30 C ATOM 1540 CG GLN A 106 42.041 -17.972 -1.054 1.00 14.51 C ATOM 1541 CD GLN A 106 40.788 -18.652 -1.571 1.00 23.33 C ATOM 1542 OE1 GLN A 106 39.837 -18.880 -0.823 1.00 4.54 O ATOM 1543 NE2 GLN A 106 40.780 -18.982 -2.857 1.00 45.14 N ATOM 0 H GLN A 106 41.793 -16.583 2.735 1.00 25.11 H new ATOM 0 HA GLN A 106 43.747 -17.688 0.819 1.00 13.02 H new ATOM 0 HB2 GLN A 106 40.986 -17.579 0.767 1.00 20.30 H new ATOM 0 HB3 GLN A 106 41.410 -16.141 -0.142 1.00 20.30 H new ATOM 0 HG2 GLN A 106 42.463 -17.348 -1.842 1.00 14.51 H new ATOM 0 HG3 GLN A 106 42.787 -18.729 -0.813 1.00 14.51 H new ATOM 0 HE21 GLN A 106 41.590 -18.775 -3.442 1.00 45.14 H new ATOM 0 HE22 GLN A 106 39.964 -19.443 -3.260 1.00 45.14 H new ATOM 1552 N TYR A 107 44.738 -15.545 0.061 1.00 13.42 N ATOM 1553 CA TYR A 107 45.429 -14.303 -0.263 1.00 41.34 C ATOM 1554 C TYR A 107 45.710 -14.210 -1.760 1.00 64.31 C ATOM 1555 O TYR A 107 46.181 -15.169 -2.375 1.00 11.31 O ATOM 1556 CB TYR A 107 46.738 -14.204 0.521 1.00 43.34 C ATOM 1557 CG TYR A 107 47.585 -13.011 0.139 1.00 74.14 C ATOM 1558 CD1 TYR A 107 47.295 -11.743 0.627 1.00 5.13 C ATOM 1559 CD2 TYR A 107 48.675 -13.153 -0.712 1.00 12.33 C ATOM 1560 CE1 TYR A 107 48.067 -10.651 0.280 1.00 14.54 C ATOM 1561 CE2 TYR A 107 49.451 -12.066 -1.064 1.00 45.23 C ATOM 1562 CZ TYR A 107 49.143 -10.817 -0.566 1.00 45.01 C ATOM 1563 OH TYR A 107 49.914 -9.732 -0.913 1.00 52.44 O ATOM 0 H TYR A 107 45.177 -16.384 -0.319 1.00 13.42 H new ATOM 0 HA TYR A 107 44.782 -13.472 0.018 1.00 41.34 H new ATOM 0 HB2 TYR A 107 46.511 -14.151 1.586 1.00 43.34 H new ATOM 0 HB3 TYR A 107 47.316 -15.115 0.363 1.00 43.34 H new ATOM 0 HD1 TYR A 107 46.452 -11.609 1.289 1.00 5.13 H new ATOM 0 HD2 TYR A 107 48.919 -14.129 -1.104 1.00 12.33 H new ATOM 0 HE1 TYR A 107 47.829 -9.672 0.669 1.00 14.54 H new ATOM 0 HE2 TYR A 107 50.295 -12.193 -1.726 1.00 45.23 H new ATOM 0 HH TYR A 107 50.632 -10.020 -1.514 1.00 52.44 H new ATOM 1712 N TYR A 116 44.515 -16.969 -12.063 1.00 2.33 N ATOM 1713 CA TYR A 116 45.856 -16.845 -11.503 1.00 35.15 C ATOM 1714 C TYR A 116 45.986 -17.654 -10.216 1.00 75.20 C ATOM 1715 O TYR A 116 44.996 -18.048 -9.598 1.00 20.23 O ATOM 1716 CB TYR A 116 46.183 -15.376 -11.229 1.00 11.42 C ATOM 1717 CG TYR A 116 46.887 -14.689 -12.377 1.00 51.40 C ATOM 1718 CD1 TYR A 116 46.502 -13.420 -12.795 1.00 64.51 C ATOM 1719 CD2 TYR A 116 47.937 -15.307 -13.044 1.00 43.22 C ATOM 1720 CE1 TYR A 116 47.141 -12.789 -13.844 1.00 2.31 C ATOM 1721 CE2 TYR A 116 48.583 -14.682 -14.094 1.00 24.32 C ATOM 1722 CZ TYR A 116 48.182 -13.424 -14.490 1.00 33.14 C ATOM 1723 OH TYR A 116 48.822 -12.798 -15.535 1.00 71.20 O ATOM 0 HA TYR A 116 46.564 -17.239 -12.232 1.00 35.15 H new ATOM 0 HB2 TYR A 116 45.259 -14.842 -11.008 1.00 11.42 H new ATOM 0 HB3 TYR A 116 46.809 -15.312 -10.339 1.00 11.42 H new ATOM 0 HD1 TYR A 116 45.689 -12.919 -12.290 1.00 64.51 H new ATOM 0 HD2 TYR A 116 48.254 -16.293 -12.737 1.00 43.22 H new ATOM 0 HE1 TYR A 116 46.828 -11.804 -14.157 1.00 2.31 H new ATOM 0 HE2 TYR A 116 49.398 -15.177 -14.602 1.00 24.32 H new ATOM 0 HH TYR A 116 49.532 -13.379 -15.879 1.00 71.20 H new ATOM 1733 N PRO A 117 47.235 -17.908 -9.801 1.00 71.53 N ATOM 1734 CA PRO A 117 47.526 -18.672 -8.585 1.00 22.21 C ATOM 1735 C PRO A 117 47.158 -17.907 -7.318 1.00 13.12 C ATOM 1736 O PRO A 117 47.295 -16.685 -7.258 1.00 34.24 O ATOM 1737 CB PRO A 117 49.039 -18.891 -8.656 1.00 5.21 C ATOM 1738 CG PRO A 117 49.546 -17.766 -9.490 1.00 53.22 C ATOM 1739 CD PRO A 117 48.461 -17.470 -10.490 1.00 22.33 C ATOM 0 HA PRO A 117 46.950 -19.596 -8.537 1.00 22.21 H new ATOM 0 HB2 PRO A 117 49.487 -18.881 -7.663 1.00 5.21 H new ATOM 0 HB3 PRO A 117 49.279 -19.855 -9.104 1.00 5.21 H new ATOM 0 HG2 PRO A 117 49.760 -16.891 -8.876 1.00 53.22 H new ATOM 0 HG3 PRO A 117 50.475 -18.039 -9.991 1.00 53.22 H new ATOM 0 HD2 PRO A 117 48.424 -16.410 -10.741 1.00 22.33 H new ATOM 0 HD3 PRO A 117 48.614 -18.013 -11.422 1.00 22.33 H new ATOM 1747 N TYR A 118 46.691 -18.634 -6.308 1.00 72.05 N ATOM 1748 CA TYR A 118 46.301 -18.022 -5.044 1.00 0.00 C ATOM 1749 C TYR A 118 47.051 -18.658 -3.878 1.00 4.24 C ATOM 1750 O TYR A 118 47.397 -19.840 -3.916 1.00 15.51 O ATOM 1751 CB TYR A 118 44.792 -18.160 -4.830 1.00 50.41 C ATOM 1752 CG TYR A 118 44.364 -19.548 -4.410 1.00 3.24 C ATOM 1753 CD1 TYR A 118 44.346 -19.913 -3.069 1.00 74.33 C ATOM 1754 CD2 TYR A 118 43.978 -20.493 -5.352 1.00 23.11 C ATOM 1755 CE1 TYR A 118 43.956 -21.181 -2.680 1.00 40.34 C ATOM 1756 CE2 TYR A 118 43.586 -21.762 -4.972 1.00 52.03 C ATOM 1757 CZ TYR A 118 43.577 -22.101 -3.635 1.00 2.32 C ATOM 1758 OH TYR A 118 43.187 -23.364 -3.251 1.00 63.22 O ATOM 0 H TYR A 118 46.574 -19.647 -6.341 1.00 72.05 H new ATOM 0 HA TYR A 118 46.560 -16.964 -5.086 1.00 0.00 H new ATOM 0 HB2 TYR A 118 44.475 -17.446 -4.070 1.00 50.41 H new ATOM 0 HB3 TYR A 118 44.277 -17.894 -5.753 1.00 50.41 H new ATOM 0 HD1 TYR A 118 44.641 -19.194 -2.319 1.00 74.33 H new ATOM 0 HD2 TYR A 118 43.984 -20.231 -6.400 1.00 23.11 H new ATOM 0 HE1 TYR A 118 43.948 -21.450 -1.634 1.00 40.34 H new ATOM 0 HE2 TYR A 118 43.288 -22.485 -5.717 1.00 52.03 H new ATOM 0 HH TYR A 118 43.274 -23.978 -4.010 1.00 63.22 H new ATOM 1768 N VAL A 119 47.299 -17.866 -2.839 1.00 60.13 N ATOM 1769 CA VAL A 119 48.006 -18.349 -1.660 1.00 21.53 C ATOM 1770 C VAL A 119 47.031 -18.724 -0.549 1.00 52.40 C ATOM 1771 O VAL A 119 46.000 -18.078 -0.371 1.00 73.01 O ATOM 1772 CB VAL A 119 48.994 -17.295 -1.126 1.00 24.41 C ATOM 1773 CG1 VAL A 119 49.800 -17.858 0.035 1.00 33.30 C ATOM 1774 CG2 VAL A 119 49.913 -16.815 -2.240 1.00 20.32 C ATOM 0 H VAL A 119 47.020 -16.886 -2.791 1.00 60.13 H new ATOM 0 HA VAL A 119 48.562 -19.235 -1.966 1.00 21.53 H new ATOM 0 HB VAL A 119 48.425 -16.440 -0.761 1.00 24.41 H new ATOM 0 HG11 VAL A 119 50.493 -17.099 0.399 1.00 33.30 H new ATOM 0 HG12 VAL A 119 49.125 -18.149 0.840 1.00 33.30 H new ATOM 0 HG13 VAL A 119 50.361 -18.730 -0.301 1.00 33.30 H new ATOM 0 HG21 VAL A 119 50.605 -16.071 -1.846 1.00 20.32 H new ATOM 0 HG22 VAL A 119 50.476 -17.660 -2.636 1.00 20.32 H new ATOM 0 HG23 VAL A 119 49.317 -16.370 -3.037 1.00 20.32 H new ATOM 1784 N GLY A 120 47.366 -19.773 0.196 1.00 31.34 N ATOM 1785 CA GLY A 120 46.509 -20.215 1.280 1.00 21.53 C ATOM 1786 C GLY A 120 47.282 -20.488 2.556 1.00 43.21 C ATOM 1787 O GLY A 120 48.214 -21.293 2.566 1.00 52.32 O ATOM 0 H GLY A 120 48.215 -20.324 0.068 1.00 31.34 H new ATOM 0 HA2 GLY A 120 45.752 -19.455 1.473 1.00 21.53 H new ATOM 0 HA3 GLY A 120 45.983 -21.120 0.977 1.00 21.53 H new ATOM 1791 N VAL A 121 46.897 -19.813 3.635 1.00 60.35 N ATOM 1792 CA VAL A 121 47.562 -19.986 4.922 1.00 75.15 C ATOM 1793 C VAL A 121 46.571 -19.855 6.072 1.00 3.23 C ATOM 1794 O VAL A 121 45.737 -18.951 6.088 1.00 12.32 O ATOM 1795 CB VAL A 121 48.692 -18.958 5.112 1.00 53.12 C ATOM 1796 CG1 VAL A 121 48.143 -17.540 5.038 1.00 63.33 C ATOM 1797 CG2 VAL A 121 49.409 -19.192 6.433 1.00 31.23 C ATOM 0 H VAL A 121 46.129 -19.142 3.644 1.00 60.35 H new ATOM 0 HA VAL A 121 47.990 -20.989 4.927 1.00 75.15 H new ATOM 0 HB VAL A 121 49.414 -19.085 4.305 1.00 53.12 H new ATOM 0 HG11 VAL A 121 48.956 -16.827 5.175 1.00 63.33 H new ATOM 0 HG12 VAL A 121 47.680 -17.380 4.065 1.00 63.33 H new ATOM 0 HG13 VAL A 121 47.399 -17.396 5.822 1.00 63.33 H new ATOM 0 HG21 VAL A 121 50.205 -18.456 6.550 1.00 31.23 H new ATOM 0 HG22 VAL A 121 48.699 -19.094 7.255 1.00 31.23 H new ATOM 0 HG23 VAL A 121 49.837 -20.194 6.442 1.00 31.23 H new ATOM 1807 N GLY A 122 46.670 -20.764 7.038 1.00 14.33 N ATOM 1808 CA GLY A 122 45.776 -20.732 8.182 1.00 50.13 C ATOM 1809 C GLY A 122 46.028 -21.874 9.145 1.00 34.22 C ATOM 1810 O GLY A 122 47.136 -22.407 9.214 1.00 55.44 O ATOM 0 H GLY A 122 47.353 -21.522 7.049 1.00 14.33 H new ATOM 0 HA2 GLY A 122 45.896 -19.784 8.707 1.00 50.13 H new ATOM 0 HA3 GLY A 122 44.744 -20.775 7.834 1.00 50.13 H new ATOM 1814 N VAL A 123 44.996 -22.253 9.893 1.00 4.54 N ATOM 1815 CA VAL A 123 45.110 -23.340 10.859 1.00 11.22 C ATOM 1816 C VAL A 123 44.011 -24.376 10.653 1.00 51.34 C ATOM 1817 O VAL A 123 43.112 -24.188 9.834 1.00 2.12 O ATOM 1818 CB VAL A 123 45.040 -22.815 12.306 1.00 51.33 C ATOM 1819 CG1 VAL A 123 46.119 -21.771 12.547 1.00 23.14 C ATOM 1820 CG2 VAL A 123 43.660 -22.246 12.599 1.00 44.42 C ATOM 0 H VAL A 123 44.072 -21.824 9.849 1.00 4.54 H new ATOM 0 HA VAL A 123 46.081 -23.807 10.696 1.00 11.22 H new ATOM 0 HB VAL A 123 45.216 -23.648 12.986 1.00 51.33 H new ATOM 0 HG11 VAL A 123 46.054 -21.411 13.574 1.00 23.14 H new ATOM 0 HG12 VAL A 123 47.100 -22.216 12.379 1.00 23.14 H new ATOM 0 HG13 VAL A 123 45.977 -20.936 11.861 1.00 23.14 H new ATOM 0 HG21 VAL A 123 43.628 -21.880 13.625 1.00 44.42 H new ATOM 0 HG22 VAL A 123 43.452 -21.424 11.914 1.00 44.42 H new ATOM 0 HG23 VAL A 123 42.910 -23.026 12.469 1.00 44.42 H new ATOM 1830 N GLY A 124 44.089 -25.472 11.401 1.00 1.40 N ATOM 1831 CA GLY A 124 43.095 -26.522 11.286 1.00 32.33 C ATOM 1832 C GLY A 124 42.798 -27.188 12.614 1.00 31.23 C ATOM 1833 O GLY A 124 43.641 -27.202 13.512 1.00 44.02 O ATOM 0 H GLY A 124 44.824 -25.651 12.085 1.00 1.40 H new ATOM 0 HA2 GLY A 124 42.174 -26.103 10.879 1.00 32.33 H new ATOM 0 HA3 GLY A 124 43.444 -27.273 10.577 1.00 32.33 H new ATOM 1837 N ARG A 125 41.596 -27.739 12.742 1.00 32.54 N ATOM 1838 CA ARG A 125 41.189 -28.408 13.973 1.00 71.22 C ATOM 1839 C ARG A 125 40.368 -29.657 13.667 1.00 32.51 C ATOM 1840 O ARG A 125 39.285 -29.576 13.087 1.00 61.14 O ATOM 1841 CB ARG A 125 40.377 -27.455 14.851 1.00 3.34 C ATOM 1842 CG ARG A 125 39.149 -26.886 14.161 1.00 33.34 C ATOM 1843 CD ARG A 125 38.686 -25.597 14.820 1.00 35.01 C ATOM 1844 NE ARG A 125 37.996 -25.843 16.083 1.00 71.51 N ATOM 1845 CZ ARG A 125 36.745 -26.283 16.164 1.00 32.04 C ATOM 1846 NH1 ARG A 125 36.051 -26.524 15.061 1.00 54.42 N ATOM 1847 NH2 ARG A 125 36.187 -26.484 17.351 1.00 14.13 N ATOM 0 H ARG A 125 40.887 -27.736 12.009 1.00 32.54 H new ATOM 0 HA ARG A 125 42.090 -28.708 14.509 1.00 71.22 H new ATOM 0 HB2 ARG A 125 40.065 -27.983 15.752 1.00 3.34 H new ATOM 0 HB3 ARG A 125 41.018 -26.633 15.169 1.00 3.34 H new ATOM 0 HG2 ARG A 125 39.375 -26.698 13.111 1.00 33.34 H new ATOM 0 HG3 ARG A 125 38.343 -27.619 14.188 1.00 33.34 H new ATOM 0 HD2 ARG A 125 39.546 -24.952 14.997 1.00 35.01 H new ATOM 0 HD3 ARG A 125 38.021 -25.062 14.142 1.00 35.01 H new ATOM 0 HE ARG A 125 38.502 -25.667 16.951 1.00 71.51 H new ATOM 0 HH11 ARG A 125 36.477 -26.372 14.147 1.00 54.42 H new ATOM 0 HH12 ARG A 125 35.091 -26.862 15.126 1.00 54.42 H new ATOM 0 HH21 ARG A 125 36.719 -26.301 18.202 1.00 14.13 H new ATOM 0 HH22 ARG A 125 35.227 -26.822 17.412 1.00 14.13 H new ATOM 2185 N ALA A 146 46.239 -26.893 14.764 1.00 4.31 N ATOM 2186 CA ALA A 146 47.610 -26.610 14.353 1.00 75.30 C ATOM 2187 C ALA A 146 47.639 -25.798 13.063 1.00 64.25 C ATOM 2188 O ALA A 146 46.669 -25.755 12.305 1.00 23.20 O ATOM 2189 CB ALA A 146 48.387 -27.908 14.180 1.00 14.32 C ATOM 0 HA ALA A 146 48.084 -26.017 15.135 1.00 75.30 H new ATOM 0 HB1 ALA A 146 49.408 -27.683 13.873 1.00 14.32 H new ATOM 0 HB2 ALA A 146 48.403 -28.451 15.125 1.00 14.32 H new ATOM 0 HB3 ALA A 146 47.906 -28.521 13.418 1.00 14.32 H new ATOM 2195 N PRO A 147 48.777 -25.138 12.804 1.00 61.43 N ATOM 2196 CA PRO A 147 48.960 -24.314 11.605 1.00 62.32 C ATOM 2197 C PRO A 147 49.043 -25.153 10.334 1.00 42.41 C ATOM 2198 O PRO A 147 49.216 -26.369 10.391 1.00 62.14 O ATOM 2199 CB PRO A 147 50.291 -23.603 11.863 1.00 14.24 C ATOM 2200 CG PRO A 147 51.024 -24.497 12.802 1.00 62.51 C ATOM 2201 CD PRO A 147 49.974 -25.145 13.662 1.00 4.33 C ATOM 0 HA PRO A 147 48.122 -23.635 11.445 1.00 62.32 H new ATOM 0 HB2 PRO A 147 50.848 -23.459 10.937 1.00 14.24 H new ATOM 0 HB3 PRO A 147 50.134 -22.616 12.298 1.00 14.24 H new ATOM 0 HG2 PRO A 147 51.600 -25.246 12.258 1.00 62.51 H new ATOM 0 HG3 PRO A 147 51.730 -23.931 13.409 1.00 62.51 H new ATOM 0 HD2 PRO A 147 50.258 -26.158 13.947 1.00 4.33 H new ATOM 0 HD3 PRO A 147 49.810 -24.588 14.584 1.00 4.33 H new ATOM 2209 N ALA A 148 48.919 -24.493 9.187 1.00 50.42 N ATOM 2210 CA ALA A 148 48.982 -25.177 7.901 1.00 65.04 C ATOM 2211 C ALA A 148 49.038 -24.178 6.750 1.00 72.24 C ATOM 2212 O ALA A 148 48.259 -23.225 6.703 1.00 32.35 O ATOM 2213 CB ALA A 148 47.789 -26.107 7.739 1.00 41.23 C ATOM 0 H ALA A 148 48.774 -23.485 9.122 1.00 50.42 H new ATOM 0 HA ALA A 148 49.896 -25.770 7.877 1.00 65.04 H new ATOM 0 HB1 ALA A 148 47.849 -26.611 6.774 1.00 41.23 H new ATOM 0 HB2 ALA A 148 47.795 -26.849 8.537 1.00 41.23 H new ATOM 0 HB3 ALA A 148 46.867 -25.528 7.789 1.00 41.23 H new ATOM 2219 N PHE A 149 49.964 -24.402 5.823 1.00 32.05 N ATOM 2220 CA PHE A 149 50.122 -23.520 4.672 1.00 41.21 C ATOM 2221 C PHE A 149 50.061 -24.311 3.369 1.00 51.45 C ATOM 2222 O PHE A 149 50.452 -25.478 3.321 1.00 13.31 O ATOM 2223 CB PHE A 149 51.448 -22.763 4.762 1.00 23.11 C ATOM 2224 CG PHE A 149 52.640 -23.660 4.943 1.00 12.25 C ATOM 2225 CD1 PHE A 149 53.075 -24.009 6.212 1.00 55.34 C ATOM 2226 CD2 PHE A 149 53.324 -24.154 3.845 1.00 74.41 C ATOM 2227 CE1 PHE A 149 54.170 -24.832 6.380 1.00 24.22 C ATOM 2228 CE2 PHE A 149 54.421 -24.979 4.008 1.00 72.35 C ATOM 2229 CZ PHE A 149 54.844 -25.320 5.277 1.00 22.21 C ATOM 0 H PHE A 149 50.616 -25.186 5.846 1.00 32.05 H new ATOM 0 HA PHE A 149 49.301 -22.803 4.679 1.00 41.21 H new ATOM 0 HB2 PHE A 149 51.582 -22.172 3.856 1.00 23.11 H new ATOM 0 HB3 PHE A 149 51.401 -22.062 5.595 1.00 23.11 H new ATOM 0 HD1 PHE A 149 52.551 -23.633 7.078 1.00 55.34 H new ATOM 0 HD2 PHE A 149 52.997 -23.892 2.850 1.00 74.41 H new ATOM 0 HE1 PHE A 149 54.500 -25.095 7.374 1.00 24.22 H new ATOM 0 HE2 PHE A 149 54.947 -25.356 3.143 1.00 72.35 H new ATOM 0 HZ PHE A 149 55.699 -25.966 5.407 1.00 22.21 H new ATOM 2239 N GLN A 150 49.570 -23.667 2.315 1.00 11.40 N ATOM 2240 CA GLN A 150 49.457 -24.311 1.012 1.00 53.10 C ATOM 2241 C GLN A 150 49.204 -23.280 -0.084 1.00 22.43 C ATOM 2242 O GLN A 150 48.828 -22.141 0.195 1.00 32.45 O ATOM 2243 CB GLN A 150 48.330 -25.345 1.026 1.00 51.14 C ATOM 2244 CG GLN A 150 46.941 -24.730 1.067 1.00 71.12 C ATOM 2245 CD GLN A 150 45.893 -25.689 1.597 1.00 21.51 C ATOM 2246 OE1 GLN A 150 45.166 -25.374 2.539 1.00 4.51 O ATOM 2247 NE2 GLN A 150 45.811 -26.869 0.994 1.00 11.24 N ATOM 0 H GLN A 150 49.244 -22.701 2.338 1.00 11.40 H new ATOM 0 HA GLN A 150 50.400 -24.815 0.801 1.00 53.10 H new ATOM 0 HB2 GLN A 150 48.414 -25.974 0.140 1.00 51.14 H new ATOM 0 HB3 GLN A 150 48.456 -25.996 1.891 1.00 51.14 H new ATOM 0 HG2 GLN A 150 46.961 -23.838 1.693 1.00 71.12 H new ATOM 0 HG3 GLN A 150 46.660 -24.409 0.064 1.00 71.12 H new ATOM 0 HE21 GLN A 150 46.434 -27.089 0.216 1.00 11.24 H new ATOM 0 HE22 GLN A 150 45.125 -27.556 1.308 1.00 11.24 H new ATOM 2256 N VAL A 151 49.414 -23.687 -1.332 1.00 71.21 N ATOM 2257 CA VAL A 151 49.208 -22.800 -2.470 1.00 11.51 C ATOM 2258 C VAL A 151 48.363 -23.472 -3.546 1.00 23.12 C ATOM 2259 O VAL A 151 48.599 -24.625 -3.905 1.00 72.20 O ATOM 2260 CB VAL A 151 50.549 -22.358 -3.088 1.00 34.43 C ATOM 2261 CG1 VAL A 151 50.321 -21.310 -4.166 1.00 73.21 C ATOM 2262 CG2 VAL A 151 51.483 -21.831 -2.009 1.00 70.34 C ATOM 0 H VAL A 151 49.727 -24.626 -1.580 1.00 71.21 H new ATOM 0 HA VAL A 151 48.682 -21.922 -2.095 1.00 11.51 H new ATOM 0 HB VAL A 151 51.019 -23.225 -3.553 1.00 34.43 H new ATOM 0 HG11 VAL A 151 51.279 -21.010 -4.591 1.00 73.21 H new ATOM 0 HG12 VAL A 151 49.691 -21.727 -4.951 1.00 73.21 H new ATOM 0 HG13 VAL A 151 49.830 -20.440 -3.730 1.00 73.21 H new ATOM 0 HG21 VAL A 151 52.425 -21.523 -2.462 1.00 70.34 H new ATOM 0 HG22 VAL A 151 51.022 -20.976 -1.514 1.00 70.34 H new ATOM 0 HG23 VAL A 151 51.672 -22.616 -1.276 1.00 70.34 H new ATOM 2272 N GLY A 152 47.375 -22.743 -4.057 1.00 45.25 N ATOM 2273 CA GLY A 152 46.510 -23.285 -5.087 1.00 74.35 C ATOM 2274 C GLY A 152 46.372 -22.357 -6.277 1.00 44.12 C ATOM 2275 O GLY A 152 47.079 -21.353 -6.377 1.00 31.32 O ATOM 0 H GLY A 152 47.159 -21.787 -3.775 1.00 45.25 H new ATOM 0 HA2 GLY A 152 46.906 -24.244 -5.422 1.00 74.35 H new ATOM 0 HA3 GLY A 152 45.524 -23.478 -4.664 1.00 74.35 H new ATOM 2279 N LEU A 153 45.460 -22.691 -7.185 1.00 24.53 N ATOM 2280 CA LEU A 153 45.234 -21.880 -8.375 1.00 53.03 C ATOM 2281 C LEU A 153 43.741 -21.685 -8.625 1.00 73.25 C ATOM 2282 O LEU A 153 42.947 -22.611 -8.453 1.00 50.53 O ATOM 2283 CB LEU A 153 45.885 -22.536 -9.595 1.00 52.10 C ATOM 2284 CG LEU A 153 47.170 -23.321 -9.329 1.00 13.13 C ATOM 2285 CD1 LEU A 153 47.609 -24.065 -10.580 1.00 50.43 C ATOM 2286 CD2 LEU A 153 48.272 -22.391 -8.843 1.00 64.03 C ATOM 0 H LEU A 153 44.866 -23.518 -7.119 1.00 24.53 H new ATOM 0 HA LEU A 153 45.688 -20.903 -8.210 1.00 53.03 H new ATOM 0 HB2 LEU A 153 45.159 -23.209 -10.051 1.00 52.10 H new ATOM 0 HB3 LEU A 153 46.103 -21.759 -10.328 1.00 52.10 H new ATOM 0 HG LEU A 153 46.971 -24.054 -8.547 1.00 13.13 H new ATOM 0 HD11 LEU A 153 48.525 -24.618 -10.372 1.00 50.43 H new ATOM 0 HD12 LEU A 153 46.826 -24.760 -10.883 1.00 50.43 H new ATOM 0 HD13 LEU A 153 47.791 -23.351 -11.383 1.00 50.43 H new ATOM 0 HD21 LEU A 153 49.179 -22.967 -8.659 1.00 64.03 H new ATOM 0 HD22 LEU A 153 48.470 -21.634 -9.602 1.00 64.03 H new ATOM 0 HD23 LEU A 153 47.957 -21.905 -7.920 1.00 64.03 H new ATOM 2298 N ARG A 154 43.368 -20.478 -9.034 1.00 3.55 N ATOM 2299 CA ARG A 154 41.972 -20.161 -9.308 1.00 34.13 C ATOM 2300 C ARG A 154 41.794 -19.690 -10.749 1.00 14.35 C ATOM 2301 O ARG A 154 42.316 -18.645 -11.139 1.00 34.20 O ATOM 2302 CB ARG A 154 41.470 -19.086 -8.342 1.00 0.31 C ATOM 2303 CG ARG A 154 42.434 -17.924 -8.171 1.00 51.32 C ATOM 2304 CD ARG A 154 42.004 -17.004 -7.039 1.00 34.02 C ATOM 2305 NE ARG A 154 40.631 -16.535 -7.207 1.00 52.22 N ATOM 2306 CZ ARG A 154 39.576 -17.144 -6.677 1.00 64.53 C ATOM 2307 NH1 ARG A 154 39.736 -18.241 -5.949 1.00 72.11 N ATOM 2308 NH2 ARG A 154 38.358 -16.657 -6.875 1.00 13.21 N ATOM 0 H ARG A 154 44.013 -19.702 -9.183 1.00 3.55 H new ATOM 0 HA ARG A 154 41.385 -21.069 -9.165 1.00 34.13 H new ATOM 0 HB2 ARG A 154 40.514 -18.704 -8.701 1.00 0.31 H new ATOM 0 HB3 ARG A 154 41.286 -19.541 -7.369 1.00 0.31 H new ATOM 0 HG2 ARG A 154 43.435 -18.307 -7.970 1.00 51.32 H new ATOM 0 HG3 ARG A 154 42.490 -17.357 -9.100 1.00 51.32 H new ATOM 0 HD2 ARG A 154 42.093 -17.531 -6.089 1.00 34.02 H new ATOM 0 HD3 ARG A 154 42.677 -16.148 -6.992 1.00 34.02 H new ATOM 0 HE ARG A 154 40.474 -15.694 -7.762 1.00 52.22 H new ATOM 0 HH11 ARG A 154 40.671 -18.619 -5.795 1.00 72.11 H new ATOM 0 HH12 ARG A 154 38.924 -18.707 -5.543 1.00 72.11 H new ATOM 0 HH21 ARG A 154 38.231 -15.814 -7.435 1.00 13.21 H new ATOM 0 HH22 ARG A 154 37.549 -17.126 -6.467 1.00 13.21 H new ATOM 2322 N TYR A 155 41.053 -20.466 -11.532 1.00 4.11 N ATOM 2323 CA TYR A 155 40.809 -20.130 -12.930 1.00 2.44 C ATOM 2324 C TYR A 155 39.316 -19.983 -13.202 1.00 12.12 C ATOM 2325 O TYR A 155 38.489 -20.168 -12.308 1.00 30.31 O ATOM 2326 CB TYR A 155 41.402 -21.202 -13.845 1.00 42.44 C ATOM 2327 CG TYR A 155 42.899 -21.082 -14.027 1.00 71.24 C ATOM 2328 CD1 TYR A 155 43.756 -21.118 -12.935 1.00 4.42 C ATOM 2329 CD2 TYR A 155 43.455 -20.932 -15.292 1.00 11.22 C ATOM 2330 CE1 TYR A 155 45.124 -21.009 -13.096 1.00 51.05 C ATOM 2331 CE2 TYR A 155 44.822 -20.824 -15.463 1.00 11.41 C ATOM 2332 CZ TYR A 155 45.651 -20.862 -14.362 1.00 4.54 C ATOM 2333 OH TYR A 155 47.014 -20.753 -14.528 1.00 14.04 O ATOM 0 H TYR A 155 40.611 -21.332 -11.223 1.00 4.11 H new ATOM 0 HA TYR A 155 41.294 -19.176 -13.138 1.00 2.44 H new ATOM 0 HB2 TYR A 155 41.172 -22.185 -13.435 1.00 42.44 H new ATOM 0 HB3 TYR A 155 40.920 -21.142 -14.821 1.00 42.44 H new ATOM 0 HD1 TYR A 155 43.346 -21.233 -11.942 1.00 4.42 H new ATOM 0 HD2 TYR A 155 42.808 -20.899 -16.156 1.00 11.22 H new ATOM 0 HE1 TYR A 155 45.776 -21.039 -12.236 1.00 51.05 H new ATOM 0 HE2 TYR A 155 45.238 -20.711 -16.453 1.00 11.41 H new ATOM 0 HH TYR A 155 47.221 -20.657 -15.481 1.00 14.04 H new ATOM 2406 N TRP A 161 30.449 -21.060 -12.932 1.00 23.10 N ATOM 2407 CA TRP A 161 31.405 -21.966 -12.305 1.00 63.32 C ATOM 2408 C TRP A 161 32.838 -21.506 -12.557 1.00 15.41 C ATOM 2409 O TRP A 161 33.126 -20.872 -13.571 1.00 54.53 O ATOM 2410 CB TRP A 161 31.213 -23.388 -12.835 1.00 4.42 C ATOM 2411 CG TRP A 161 30.228 -24.189 -12.039 1.00 10.04 C ATOM 2412 CD1 TRP A 161 30.306 -24.503 -10.712 1.00 63.01 C ATOM 2413 CD2 TRP A 161 29.016 -24.781 -12.522 1.00 4.43 C ATOM 2414 NE1 TRP A 161 29.217 -25.253 -10.340 1.00 73.14 N ATOM 2415 CE2 TRP A 161 28.410 -25.437 -11.432 1.00 40.51 C ATOM 2416 CE3 TRP A 161 28.383 -24.818 -13.767 1.00 2.03 C ATOM 2417 CZ2 TRP A 161 27.204 -26.121 -11.554 1.00 0.53 C ATOM 2418 CZ3 TRP A 161 27.186 -25.498 -13.886 1.00 11.25 C ATOM 2419 CH2 TRP A 161 26.605 -26.141 -12.784 1.00 42.25 C ATOM 0 HA TRP A 161 31.224 -21.958 -11.230 1.00 63.32 H new ATOM 0 HB2 TRP A 161 30.879 -23.340 -13.871 1.00 4.42 H new ATOM 0 HB3 TRP A 161 32.174 -23.902 -12.834 1.00 4.42 H new ATOM 0 HD1 TRP A 161 31.107 -24.205 -10.052 1.00 63.01 H new ATOM 0 HE1 TRP A 161 29.038 -25.614 -9.403 1.00 73.14 H new ATOM 0 HE3 TRP A 161 28.822 -24.324 -14.621 1.00 2.03 H new ATOM 0 HZ2 TRP A 161 26.756 -26.619 -10.707 1.00 0.53 H new ATOM 0 HZ3 TRP A 161 26.689 -25.535 -14.844 1.00 11.25 H new ATOM 0 HH2 TRP A 161 25.667 -26.662 -12.908 1.00 42.25 H new ATOM 2430 N MET A 162 33.730 -21.830 -11.627 1.00 51.42 N ATOM 2431 CA MET A 162 35.133 -21.450 -11.751 1.00 2.22 C ATOM 2432 C MET A 162 36.045 -22.616 -11.387 1.00 63.03 C ATOM 2433 O MET A 162 35.666 -23.497 -10.615 1.00 2.21 O ATOM 2434 CB MET A 162 35.439 -20.249 -10.854 1.00 42.24 C ATOM 2435 CG MET A 162 34.447 -19.106 -11.009 1.00 63.41 C ATOM 2436 SD MET A 162 34.564 -18.298 -12.616 1.00 24.02 S ATOM 2437 CE MET A 162 34.041 -16.636 -12.198 1.00 71.43 C ATOM 0 H MET A 162 33.507 -22.354 -10.781 1.00 51.42 H new ATOM 0 HA MET A 162 35.319 -21.176 -12.789 1.00 2.22 H new ATOM 0 HB2 MET A 162 35.446 -20.575 -9.814 1.00 42.24 H new ATOM 0 HB3 MET A 162 36.441 -19.883 -11.080 1.00 42.24 H new ATOM 0 HG2 MET A 162 33.435 -19.487 -10.871 1.00 63.41 H new ATOM 0 HG3 MET A 162 34.620 -18.371 -10.223 1.00 63.41 H new ATOM 0 HE1 MET A 162 34.060 -16.013 -13.092 1.00 71.43 H new ATOM 0 HE2 MET A 162 33.028 -16.663 -11.797 1.00 71.43 H new ATOM 0 HE3 MET A 162 34.716 -16.219 -11.451 1.00 71.43 H new ATOM 2447 N LEU A 163 37.250 -22.616 -11.948 1.00 34.21 N ATOM 2448 CA LEU A 163 38.218 -23.676 -11.684 1.00 3.45 C ATOM 2449 C LEU A 163 38.938 -23.435 -10.360 1.00 32.33 C ATOM 2450 O LEU A 163 39.350 -22.316 -10.061 1.00 10.35 O ATOM 2451 CB LEU A 163 39.234 -23.761 -12.823 1.00 24.21 C ATOM 2452 CG LEU A 163 38.972 -24.838 -13.877 1.00 2.33 C ATOM 2453 CD1 LEU A 163 39.686 -24.497 -15.176 1.00 71.42 C ATOM 2454 CD2 LEU A 163 39.411 -26.202 -13.367 1.00 52.10 C ATOM 0 H LEU A 163 37.580 -21.894 -12.588 1.00 34.21 H new ATOM 0 HA LEU A 163 37.678 -24.621 -11.617 1.00 3.45 H new ATOM 0 HB2 LEU A 163 39.271 -22.793 -13.323 1.00 24.21 H new ATOM 0 HB3 LEU A 163 40.220 -23.935 -12.392 1.00 24.21 H new ATOM 0 HG LEU A 163 37.900 -24.874 -14.073 1.00 2.33 H new ATOM 0 HD11 LEU A 163 39.489 -25.274 -15.915 1.00 71.42 H new ATOM 0 HD12 LEU A 163 39.323 -23.540 -15.550 1.00 71.42 H new ATOM 0 HD13 LEU A 163 40.759 -24.432 -14.995 1.00 71.42 H new ATOM 0 HD21 LEU A 163 39.217 -26.956 -14.130 1.00 52.10 H new ATOM 0 HD22 LEU A 163 40.477 -26.180 -13.141 1.00 52.10 H new ATOM 0 HD23 LEU A 163 38.854 -26.449 -12.463 1.00 52.10 H new ATOM 2466 N ASN A 164 39.088 -24.496 -9.574 1.00 61.13 N ATOM 2467 CA ASN A 164 39.761 -24.402 -8.283 1.00 64.22 C ATOM 2468 C ASN A 164 40.794 -25.514 -8.125 1.00 54.10 C ATOM 2469 O ASN A 164 40.505 -26.684 -8.380 1.00 4.33 O ATOM 2470 CB ASN A 164 38.740 -24.472 -7.146 1.00 20.53 C ATOM 2471 CG ASN A 164 39.251 -23.831 -5.870 1.00 41.23 C ATOM 2472 OD1 ASN A 164 39.920 -22.798 -5.905 1.00 75.34 O ATOM 2473 ND2 ASN A 164 38.936 -24.443 -4.734 1.00 61.02 N ATOM 0 H ASN A 164 38.753 -25.431 -9.808 1.00 61.13 H new ATOM 0 HA ASN A 164 40.277 -23.443 -8.239 1.00 64.22 H new ATOM 0 HB2 ASN A 164 37.821 -23.975 -7.456 1.00 20.53 H new ATOM 0 HB3 ASN A 164 38.489 -25.514 -6.950 1.00 20.53 H new ATOM 0 HD21 ASN A 164 39.251 -24.059 -3.843 1.00 61.02 H new ATOM 0 HD22 ASN A 164 38.379 -25.297 -4.752 1.00 61.02 H new ATOM 2480 N SER A 165 41.998 -25.142 -7.702 1.00 13.40 N ATOM 2481 CA SER A 165 43.074 -26.107 -7.512 1.00 55.33 C ATOM 2482 C SER A 165 43.827 -25.833 -6.214 1.00 51.01 C ATOM 2483 O SER A 165 43.938 -24.687 -5.778 1.00 10.31 O ATOM 2484 CB SER A 165 44.042 -26.061 -8.696 1.00 64.33 C ATOM 2485 OG SER A 165 43.344 -26.093 -9.928 1.00 13.22 O ATOM 0 H SER A 165 42.253 -24.179 -7.484 1.00 13.40 H new ATOM 0 HA SER A 165 42.631 -27.101 -7.451 1.00 55.33 H new ATOM 0 HB2 SER A 165 44.646 -25.156 -8.640 1.00 64.33 H new ATOM 0 HB3 SER A 165 44.728 -26.906 -8.641 1.00 64.33 H new ATOM 0 HG SER A 165 43.985 -26.061 -10.668 1.00 13.22 H new ATOM 2491 N ASP A 166 44.341 -26.893 -5.601 1.00 64.24 N ATOM 2492 CA ASP A 166 45.085 -26.769 -4.353 1.00 13.40 C ATOM 2493 C ASP A 166 46.343 -27.630 -4.381 1.00 73.33 C ATOM 2494 O ASP A 166 46.320 -28.765 -4.860 1.00 45.24 O ATOM 2495 CB ASP A 166 44.204 -27.169 -3.168 1.00 21.32 C ATOM 2496 CG ASP A 166 42.918 -26.370 -3.105 1.00 50.34 C ATOM 2497 OD1 ASP A 166 42.717 -25.646 -2.108 1.00 21.34 O ATOM 2498 OD2 ASP A 166 42.112 -26.467 -4.055 1.00 51.21 O ATOM 0 H ASP A 166 44.256 -27.848 -5.948 1.00 64.24 H new ATOM 0 HA ASP A 166 45.384 -25.727 -4.239 1.00 13.40 H new ATOM 0 HB2 ASP A 166 43.965 -28.230 -3.239 1.00 21.32 H new ATOM 0 HB3 ASP A 166 44.761 -27.029 -2.242 1.00 21.32 H new ATOM 2503 N VAL A 167 47.440 -27.084 -3.868 1.00 2.54 N ATOM 2504 CA VAL A 167 48.709 -27.801 -3.835 1.00 33.44 C ATOM 2505 C VAL A 167 49.397 -27.640 -2.484 1.00 20.25 C ATOM 2506 O VAL A 167 49.704 -26.526 -2.061 1.00 10.12 O ATOM 2507 CB VAL A 167 49.660 -27.313 -4.944 1.00 30.50 C ATOM 2508 CG1 VAL A 167 50.907 -28.182 -4.998 1.00 61.21 C ATOM 2509 CG2 VAL A 167 48.948 -27.303 -6.288 1.00 65.12 C ATOM 0 H VAL A 167 47.476 -26.146 -3.469 1.00 2.54 H new ATOM 0 HA VAL A 167 48.481 -28.854 -4.000 1.00 33.44 H new ATOM 0 HB VAL A 167 49.967 -26.293 -4.714 1.00 30.50 H new ATOM 0 HG11 VAL A 167 51.567 -27.822 -5.787 1.00 61.21 H new ATOM 0 HG12 VAL A 167 51.426 -28.134 -4.041 1.00 61.21 H new ATOM 0 HG13 VAL A 167 50.623 -29.214 -5.205 1.00 61.21 H new ATOM 0 HG21 VAL A 167 49.634 -26.956 -7.061 1.00 65.12 H new ATOM 0 HG22 VAL A 167 48.611 -28.311 -6.529 1.00 65.12 H new ATOM 0 HG23 VAL A 167 48.088 -26.635 -6.239 1.00 65.12 H new ATOM 2519 N ARG A 168 49.637 -28.761 -1.811 1.00 13.42 N ATOM 2520 CA ARG A 168 50.288 -28.744 -0.506 1.00 15.04 C ATOM 2521 C ARG A 168 51.318 -29.864 -0.399 1.00 44.13 C ATOM 2522 O ARG A 168 51.099 -30.973 -0.887 1.00 53.42 O ATOM 2523 CB ARG A 168 49.249 -28.884 0.608 1.00 21.22 C ATOM 2524 CG ARG A 168 49.855 -28.961 2.000 1.00 51.43 C ATOM 2525 CD ARG A 168 48.779 -29.016 3.073 1.00 23.24 C ATOM 2526 NE ARG A 168 49.232 -29.731 4.264 1.00 11.20 N ATOM 2527 CZ ARG A 168 48.460 -29.960 5.322 1.00 54.34 C ATOM 2528 NH1 ARG A 168 47.204 -29.534 5.335 1.00 43.23 N ATOM 2529 NH2 ARG A 168 48.945 -30.617 6.368 1.00 75.21 N ATOM 0 H ARG A 168 49.391 -29.692 -2.148 1.00 13.42 H new ATOM 0 HA ARG A 168 50.802 -27.789 -0.396 1.00 15.04 H new ATOM 0 HB2 ARG A 168 48.566 -28.036 0.565 1.00 21.22 H new ATOM 0 HB3 ARG A 168 48.656 -29.781 0.429 1.00 21.22 H new ATOM 0 HG2 ARG A 168 50.489 -29.844 2.074 1.00 51.43 H new ATOM 0 HG3 ARG A 168 50.494 -28.094 2.168 1.00 51.43 H new ATOM 0 HD2 ARG A 168 48.488 -28.002 3.347 1.00 23.24 H new ATOM 0 HD3 ARG A 168 47.891 -29.505 2.672 1.00 23.24 H new ATOM 0 HE ARG A 168 50.193 -30.073 4.285 1.00 11.20 H new ATOM 0 HH11 ARG A 168 46.828 -29.029 4.532 1.00 43.23 H new ATOM 0 HH12 ARG A 168 46.614 -29.711 6.148 1.00 43.23 H new ATOM 0 HH21 ARG A 168 49.910 -30.946 6.360 1.00 75.21 H new ATOM 0 HH22 ARG A 168 48.352 -30.792 7.180 1.00 75.21 H new ATOM 2925 N PHE A 194 53.533 -35.398 -2.366 1.00 2.05 N ATOM 2926 CA PHE A 194 52.687 -34.311 -1.888 1.00 33.33 C ATOM 2927 C PHE A 194 51.223 -34.568 -2.236 1.00 50.32 C ATOM 2928 O PHE A 194 50.892 -35.568 -2.873 1.00 31.31 O ATOM 2929 CB PHE A 194 53.141 -32.980 -2.490 1.00 32.13 C ATOM 2930 CG PHE A 194 53.406 -33.049 -3.966 1.00 74.01 C ATOM 2931 CD1 PHE A 194 52.378 -33.317 -4.857 1.00 44.41 C ATOM 2932 CD2 PHE A 194 54.683 -32.847 -4.463 1.00 72.24 C ATOM 2933 CE1 PHE A 194 52.620 -33.381 -6.216 1.00 34.32 C ATOM 2934 CE2 PHE A 194 54.930 -32.910 -5.822 1.00 71.51 C ATOM 2935 CZ PHE A 194 53.897 -33.179 -6.700 1.00 1.42 C ATOM 0 HA PHE A 194 52.781 -34.261 -0.803 1.00 33.33 H new ATOM 0 HB2 PHE A 194 52.377 -32.226 -2.301 1.00 32.13 H new ATOM 0 HB3 PHE A 194 54.047 -32.651 -1.981 1.00 32.13 H new ATOM 0 HD1 PHE A 194 51.377 -33.478 -4.485 1.00 44.41 H new ATOM 0 HD2 PHE A 194 55.495 -32.638 -3.782 1.00 72.24 H new ATOM 0 HE1 PHE A 194 51.810 -33.589 -6.899 1.00 34.32 H new ATOM 0 HE2 PHE A 194 55.930 -32.749 -6.197 1.00 71.51 H new ATOM 0 HZ PHE A 194 54.088 -33.231 -7.762 1.00 1.42 H new ATOM 2945 N ILE A 195 50.352 -33.657 -1.815 1.00 25.51 N ATOM 2946 CA ILE A 195 48.925 -33.784 -2.083 1.00 10.42 C ATOM 2947 C ILE A 195 48.416 -32.612 -2.915 1.00 42.01 C ATOM 2948 O ILE A 195 48.863 -31.477 -2.747 1.00 51.35 O ATOM 2949 CB ILE A 195 48.112 -33.864 -0.777 1.00 52.11 C ATOM 2950 CG1 ILE A 195 46.644 -34.165 -1.083 1.00 74.42 C ATOM 2951 CG2 ILE A 195 48.240 -32.566 0.006 1.00 14.12 C ATOM 2952 CD1 ILE A 195 45.786 -32.926 -1.214 1.00 61.13 C ATOM 0 H ILE A 195 50.610 -32.823 -1.287 1.00 25.51 H new ATOM 0 HA ILE A 195 48.790 -34.710 -2.643 1.00 10.42 H new ATOM 0 HB ILE A 195 48.510 -34.675 -0.167 1.00 52.11 H new ATOM 0 HG12 ILE A 195 46.585 -34.737 -2.009 1.00 74.42 H new ATOM 0 HG13 ILE A 195 46.239 -34.796 -0.292 1.00 74.42 H new ATOM 0 HG21 ILE A 195 47.660 -32.638 0.926 1.00 14.12 H new ATOM 0 HG22 ILE A 195 49.288 -32.390 0.250 1.00 14.12 H new ATOM 0 HG23 ILE A 195 47.864 -31.739 -0.596 1.00 14.12 H new ATOM 0 HD11 ILE A 195 44.758 -33.217 -1.431 1.00 61.13 H new ATOM 0 HD12 ILE A 195 45.815 -32.363 -0.281 1.00 61.13 H new ATOM 0 HD13 ILE A 195 46.166 -32.304 -2.025 1.00 61.13 H new ATOM 2964 N LEU A 196 47.477 -32.894 -3.811 1.00 13.14 N ATOM 2965 CA LEU A 196 46.904 -31.862 -4.669 1.00 20.24 C ATOM 2966 C LEU A 196 45.401 -32.065 -4.835 1.00 21.15 C ATOM 2967 O LEU A 196 44.923 -33.196 -4.918 1.00 75.12 O ATOM 2968 CB LEU A 196 47.585 -31.874 -6.038 1.00 50.32 C ATOM 2969 CG LEU A 196 48.679 -30.826 -6.253 1.00 15.43 C ATOM 2970 CD1 LEU A 196 50.025 -31.356 -5.785 1.00 63.31 C ATOM 2971 CD2 LEU A 196 48.743 -30.415 -7.716 1.00 60.15 C ATOM 0 H LEU A 196 47.096 -33.828 -3.963 1.00 13.14 H new ATOM 0 HA LEU A 196 47.072 -30.895 -4.195 1.00 20.24 H new ATOM 0 HB2 LEU A 196 48.019 -32.861 -6.197 1.00 50.32 H new ATOM 0 HB3 LEU A 196 46.821 -31.735 -6.803 1.00 50.32 H new ATOM 0 HG LEU A 196 48.434 -29.945 -5.660 1.00 15.43 H new ATOM 0 HD11 LEU A 196 50.791 -30.597 -5.946 1.00 63.31 H new ATOM 0 HD12 LEU A 196 49.972 -31.598 -4.724 1.00 63.31 H new ATOM 0 HD13 LEU A 196 50.279 -32.253 -6.350 1.00 63.31 H new ATOM 0 HD21 LEU A 196 49.526 -29.669 -7.850 1.00 60.15 H new ATOM 0 HD22 LEU A 196 48.964 -31.288 -8.330 1.00 60.15 H new ATOM 0 HD23 LEU A 196 47.784 -29.993 -8.018 1.00 60.15 H new ATOM 2983 N SER A 197 44.662 -30.961 -4.883 1.00 54.44 N ATOM 2984 CA SER A 197 43.214 -31.017 -5.038 1.00 15.24 C ATOM 2985 C SER A 197 42.777 -30.325 -6.326 1.00 32.14 C ATOM 2986 O SER A 197 43.329 -29.293 -6.707 1.00 50.22 O ATOM 2987 CB SER A 197 42.525 -30.366 -3.837 1.00 51.34 C ATOM 2988 OG SER A 197 43.371 -30.371 -2.700 1.00 40.03 O ATOM 0 H SER A 197 45.043 -30.017 -4.817 1.00 54.44 H new ATOM 0 HA SER A 197 42.920 -32.065 -5.092 1.00 15.24 H new ATOM 0 HB2 SER A 197 42.248 -29.341 -4.084 1.00 51.34 H new ATOM 0 HB3 SER A 197 41.602 -30.899 -3.610 1.00 51.34 H new ATOM 0 HG SER A 197 42.909 -29.948 -1.946 1.00 40.03 H new ATOM 2994 N LEU A 198 41.783 -30.901 -6.992 1.00 11.14 N ATOM 2995 CA LEU A 198 41.270 -30.341 -8.238 1.00 51.41 C ATOM 2996 C LEU A 198 39.744 -30.337 -8.246 1.00 64.04 C ATOM 2997 O LEU A 198 39.109 -31.333 -7.902 1.00 44.22 O ATOM 2998 CB LEU A 198 41.796 -31.138 -9.433 1.00 20.41 C ATOM 2999 CG LEU A 198 41.087 -32.462 -9.721 1.00 23.11 C ATOM 3000 CD1 LEU A 198 41.547 -33.035 -11.053 1.00 4.35 C ATOM 3001 CD2 LEU A 198 41.336 -33.456 -8.595 1.00 73.15 C ATOM 0 H LEU A 198 41.316 -31.756 -6.690 1.00 11.14 H new ATOM 0 HA LEU A 198 41.618 -29.311 -8.315 1.00 51.41 H new ATOM 0 HB2 LEU A 198 41.726 -30.511 -10.322 1.00 20.41 H new ATOM 0 HB3 LEU A 198 42.854 -31.343 -9.270 1.00 20.41 H new ATOM 0 HG LEU A 198 40.015 -32.273 -9.781 1.00 23.11 H new ATOM 0 HD11 LEU A 198 41.032 -33.977 -11.241 1.00 4.35 H new ATOM 0 HD12 LEU A 198 41.317 -32.330 -11.851 1.00 4.35 H new ATOM 0 HD13 LEU A 198 42.623 -33.209 -11.022 1.00 4.35 H new ATOM 0 HD21 LEU A 198 40.824 -34.392 -8.817 1.00 73.15 H new ATOM 0 HD22 LEU A 198 42.406 -33.641 -8.503 1.00 73.15 H new ATOM 0 HD23 LEU A 198 40.956 -33.048 -7.659 1.00 73.15 H new ATOM 3013 N GLY A 199 39.164 -29.210 -8.645 1.00 14.54 N ATOM 3014 CA GLY A 199 37.717 -29.098 -8.693 1.00 53.31 C ATOM 3015 C GLY A 199 37.257 -27.753 -9.220 1.00 22.24 C ATOM 3016 O GLY A 199 37.900 -27.166 -10.089 1.00 4.21 O ATOM 0 H GLY A 199 39.669 -28.373 -8.936 1.00 14.54 H new ATOM 0 HA2 GLY A 199 37.315 -29.889 -9.326 1.00 53.31 H new ATOM 0 HA3 GLY A 199 37.310 -29.252 -7.693 1.00 53.31 H new ATOM 3020 N ALA A 200 36.139 -27.265 -8.692 1.00 55.20 N ATOM 3021 CA ALA A 200 35.592 -25.981 -9.114 1.00 5.33 C ATOM 3022 C ALA A 200 34.910 -25.266 -7.953 1.00 5.52 C ATOM 3023 O ALA A 200 34.897 -25.764 -6.827 1.00 31.21 O ATOM 3024 CB ALA A 200 34.616 -26.174 -10.264 1.00 34.04 C ATOM 0 H ALA A 200 35.595 -27.739 -7.972 1.00 55.20 H new ATOM 0 HA ALA A 200 36.419 -25.358 -9.455 1.00 5.33 H new ATOM 0 HB1 ALA A 200 34.216 -25.207 -10.568 1.00 34.04 H new ATOM 0 HB2 ALA A 200 35.133 -26.634 -11.106 1.00 34.04 H new ATOM 0 HB3 ALA A 200 33.799 -26.820 -9.943 1.00 34.04 H new ATOM 3030 N SER A 201 34.347 -24.095 -8.233 1.00 22.00 N ATOM 3031 CA SER A 201 33.667 -23.310 -7.210 1.00 0.21 C ATOM 3032 C SER A 201 32.642 -22.370 -7.838 1.00 31.30 C ATOM 3033 O SER A 201 32.575 -22.233 -9.060 1.00 5.13 O ATOM 3034 CB SER A 201 34.682 -22.505 -6.397 1.00 1.43 C ATOM 3035 OG SER A 201 35.847 -23.268 -6.136 1.00 42.44 O ATOM 0 H SER A 201 34.348 -23.669 -9.160 1.00 22.00 H new ATOM 0 HA SER A 201 33.144 -23.999 -6.546 1.00 0.21 H new ATOM 0 HB2 SER A 201 34.951 -21.599 -6.940 1.00 1.43 H new ATOM 0 HB3 SER A 201 34.231 -22.190 -5.456 1.00 1.43 H new ATOM 0 HG SER A 201 36.524 -22.698 -5.715 1.00 42.44 H new ATOM 3041 N TYR A 202 31.843 -21.727 -6.993 1.00 11.31 N ATOM 3042 CA TYR A 202 30.818 -20.803 -7.464 1.00 44.25 C ATOM 3043 C TYR A 202 30.753 -19.564 -6.576 1.00 63.02 C ATOM 3044 O TYR A 202 30.440 -19.653 -5.389 1.00 0.04 O ATOM 3045 CB TYR A 202 29.454 -21.493 -7.497 1.00 24.33 C ATOM 3046 CG TYR A 202 28.344 -20.617 -8.033 1.00 65.22 C ATOM 3047 CD1 TYR A 202 27.079 -20.639 -7.461 1.00 33.20 C ATOM 3048 CD2 TYR A 202 28.562 -19.768 -9.110 1.00 41.03 C ATOM 3049 CE1 TYR A 202 26.061 -19.841 -7.947 1.00 54.22 C ATOM 3050 CE2 TYR A 202 27.551 -18.966 -9.602 1.00 44.23 C ATOM 3051 CZ TYR A 202 26.302 -19.006 -9.018 1.00 43.31 C ATOM 3052 OH TYR A 202 25.293 -18.209 -9.505 1.00 55.03 O ATOM 0 H TYR A 202 31.886 -21.829 -5.979 1.00 11.31 H new ATOM 0 HA TYR A 202 31.083 -20.491 -8.474 1.00 44.25 H new ATOM 0 HB2 TYR A 202 29.525 -22.391 -8.111 1.00 24.33 H new ATOM 0 HB3 TYR A 202 29.195 -21.816 -6.489 1.00 24.33 H new ATOM 0 HD1 TYR A 202 26.887 -21.291 -6.622 1.00 33.20 H new ATOM 0 HD2 TYR A 202 29.538 -19.734 -9.571 1.00 41.03 H new ATOM 0 HE1 TYR A 202 25.082 -19.871 -7.491 1.00 54.22 H new ATOM 0 HE2 TYR A 202 27.737 -18.311 -10.440 1.00 44.23 H new ATOM 0 HH TYR A 202 25.628 -17.681 -10.259 1.00 55.03 H new ATOM 3062 N VAL A 203 31.050 -18.408 -7.161 1.00 61.03 N ATOM 3063 CA VAL A 203 31.023 -17.149 -6.425 1.00 20.13 C ATOM 3064 C VAL A 203 29.618 -16.558 -6.398 1.00 24.52 C ATOM 3065 O VAL A 203 28.954 -16.461 -7.429 1.00 55.20 O ATOM 3066 CB VAL A 203 31.989 -16.119 -7.040 1.00 22.12 C ATOM 3067 CG1 VAL A 203 32.062 -14.871 -6.172 1.00 61.41 C ATOM 3068 CG2 VAL A 203 33.370 -16.729 -7.227 1.00 23.43 C ATOM 0 H VAL A 203 31.312 -18.317 -8.143 1.00 61.03 H new ATOM 0 HA VAL A 203 31.340 -17.371 -5.406 1.00 20.13 H new ATOM 0 HB VAL A 203 31.609 -15.830 -8.020 1.00 22.12 H new ATOM 0 HG11 VAL A 203 32.749 -14.154 -6.622 1.00 61.41 H new ATOM 0 HG12 VAL A 203 31.071 -14.424 -6.094 1.00 61.41 H new ATOM 0 HG13 VAL A 203 32.418 -15.140 -5.178 1.00 61.41 H new ATOM 0 HG21 VAL A 203 34.039 -15.987 -7.663 1.00 23.43 H new ATOM 0 HG22 VAL A 203 33.761 -17.048 -6.261 1.00 23.43 H new ATOM 0 HG23 VAL A 203 33.301 -17.590 -7.892 1.00 23.43 H new ATOM 3078 N PHE A 204 29.171 -16.165 -5.209 1.00 71.14 N ATOM 3079 CA PHE A 204 27.844 -15.584 -5.047 1.00 11.44 C ATOM 3080 C PHE A 204 27.878 -14.416 -4.064 1.00 62.03 C ATOM 3081 O PHE A 204 28.326 -14.559 -2.927 1.00 22.35 O ATOM 3082 CB PHE A 204 26.855 -16.645 -4.560 1.00 74.35 C ATOM 3083 CG PHE A 204 25.447 -16.414 -5.032 1.00 63.34 C ATOM 3084 CD1 PHE A 204 24.781 -17.383 -5.765 1.00 61.33 C ATOM 3085 CD2 PHE A 204 24.791 -15.229 -4.744 1.00 61.04 C ATOM 3086 CE1 PHE A 204 23.487 -17.175 -6.202 1.00 1.05 C ATOM 3087 CE2 PHE A 204 23.496 -15.015 -5.177 1.00 63.12 C ATOM 3088 CZ PHE A 204 22.843 -15.988 -5.908 1.00 23.31 C ATOM 0 H PHE A 204 29.708 -16.239 -4.345 1.00 71.14 H new ATOM 0 HA PHE A 204 27.517 -15.211 -6.018 1.00 11.44 H new ATOM 0 HB2 PHE A 204 27.188 -17.625 -4.902 1.00 74.35 H new ATOM 0 HB3 PHE A 204 26.865 -16.667 -3.470 1.00 74.35 H new ATOM 0 HD1 PHE A 204 25.280 -18.312 -5.998 1.00 61.33 H new ATOM 0 HD2 PHE A 204 25.297 -14.463 -4.175 1.00 61.04 H new ATOM 0 HE1 PHE A 204 22.979 -17.939 -6.772 1.00 1.05 H new ATOM 0 HE2 PHE A 204 22.995 -14.087 -4.944 1.00 63.12 H new ATOM 0 HZ PHE A 204 21.832 -15.822 -6.249 1.00 23.31 H new ATOM 3098 N LYS A 205 27.402 -13.259 -4.512 1.00 34.52 N ATOM 3099 CA LYS A 205 27.376 -12.066 -3.675 1.00 3.33 C ATOM 3100 C LYS A 205 25.945 -11.585 -3.457 1.00 1.34 C ATOM 3101 O LYS A 205 25.350 -10.956 -4.333 1.00 22.21 O ATOM 3102 CB LYS A 205 28.208 -10.952 -4.314 1.00 53.14 C ATOM 3103 CG LYS A 205 27.939 -10.766 -5.797 1.00 64.53 C ATOM 3104 CD LYS A 205 28.146 -9.323 -6.225 1.00 74.03 C ATOM 3105 CE LYS A 205 29.595 -9.056 -6.601 1.00 44.50 C ATOM 3106 NZ LYS A 205 30.019 -9.852 -7.786 1.00 20.45 N ATOM 0 H LYS A 205 27.029 -13.123 -5.451 1.00 34.52 H new ATOM 0 HA LYS A 205 27.806 -12.322 -2.707 1.00 3.33 H new ATOM 0 HB2 LYS A 205 28.004 -10.015 -3.796 1.00 53.14 H new ATOM 0 HB3 LYS A 205 29.266 -11.172 -4.170 1.00 53.14 H new ATOM 0 HG2 LYS A 205 28.600 -11.415 -6.372 1.00 64.53 H new ATOM 0 HG3 LYS A 205 26.917 -11.070 -6.023 1.00 64.53 H new ATOM 0 HD2 LYS A 205 27.501 -9.098 -7.075 1.00 74.03 H new ATOM 0 HD3 LYS A 205 27.850 -8.656 -5.415 1.00 74.03 H new ATOM 0 HE2 LYS A 205 29.725 -7.995 -6.812 1.00 44.50 H new ATOM 0 HE3 LYS A 205 30.239 -9.294 -5.755 1.00 44.50 H new ATOM 0 HZ1 LYS A 205 30.785 -9.354 -8.283 1.00 20.45 H new ATOM 0 HZ2 LYS A 205 30.358 -10.785 -7.475 1.00 20.45 H new ATOM 0 HZ3 LYS A 205 29.211 -9.974 -8.429 1.00 20.45 H new