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 20 SER OG : rot -86:sc= 1.19 USER MOD Set 1.2: A 164 ASN : amide:sc= -2.32 K(o=-3,f=-4.1!) USER MOD Set 1.3: A 201 SER OG : rot 4:sc= -1.86 USER MOD Set 2.1: A 24 SER OG : rot 83:sc= -0.0256 USER MOD Set 2.2: A 197 SER OG : rot 180:sc= 0.00238 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=-0.062) USER MOD Single : A 14 GLN : amide:sc= -0.387 K(o=-0.39,f=-2.2!) USER MOD Single : A 22 ASN : amide:sc= -0.0369 K(o=-0.037,f=-1.1) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 50:sc= 1.25 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.223 X(o=-0.22,f=-0.0081) USER MOD Single : A 104 SER OG : rot 73:sc= 0.00906 USER MOD Single : A 106 GLN : amide:sc= -1.75 K(o=-1.8,f=-2.8) 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 -137:sc= 1.17 USER MOD Single : A 150 GLN : amide:sc= -0.925 K(o=-0.93,f=-1.4) 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 202 TYR OH : rot 180:sc= 0 USER MOD Single : A 205 LYS NZ :NH3+ -148:sc= -0.0526 (180deg=-1.12) USER MOD ----------------------------------------------------------------- ATOM 177 N ASN A 13 31.844 -6.990 -2.678 1.00 20.03 N ATOM 178 CA ASN A 13 31.621 -6.289 -1.419 1.00 40.24 C ATOM 179 C ASN A 13 31.728 -7.246 -0.236 1.00 21.42 C ATOM 180 O ASN A 13 31.579 -8.458 -0.391 1.00 51.13 O ATOM 181 CB ASN A 13 30.246 -5.617 -1.423 1.00 23.02 C ATOM 182 CG ASN A 13 30.272 -4.250 -2.080 1.00 12.34 C ATOM 183 OD1 ASN A 13 31.023 -3.366 -1.668 1.00 40.43 O ATOM 184 ND2 ASN A 13 29.448 -4.071 -3.106 1.00 21.23 N ATOM 0 HA ASN A 13 32.392 -5.525 -1.316 1.00 40.24 H new ATOM 0 HB2 ASN A 13 29.534 -6.255 -1.947 1.00 23.02 H new ATOM 0 HB3 ASN A 13 29.890 -5.517 -0.397 1.00 23.02 H new ATOM 0 HD21 ASN A 13 29.420 -3.172 -3.587 1.00 21.23 H new ATOM 0 HD22 ASN A 13 28.843 -4.833 -3.413 1.00 21.23 H new ATOM 191 N GLN A 14 31.987 -6.693 0.944 1.00 32.34 N ATOM 192 CA GLN A 14 32.115 -7.498 2.153 1.00 1.31 C ATOM 193 C GLN A 14 30.834 -8.281 2.424 1.00 14.30 C ATOM 194 O GLN A 14 29.732 -7.744 2.312 1.00 34.54 O ATOM 195 CB GLN A 14 32.446 -6.608 3.352 1.00 55.42 C ATOM 196 CG GLN A 14 31.418 -5.515 3.601 1.00 75.34 C ATOM 197 CD GLN A 14 30.385 -5.910 4.637 1.00 31.23 C ATOM 198 OE1 GLN A 14 30.646 -6.743 5.505 1.00 23.22 O ATOM 199 NE2 GLN A 14 29.202 -5.313 4.552 1.00 12.21 N ATOM 0 H GLN A 14 32.112 -5.691 1.089 1.00 32.34 H new ATOM 0 HA GLN A 14 32.928 -8.208 2.002 1.00 1.31 H new ATOM 0 HB2 GLN A 14 32.527 -7.229 4.244 1.00 55.42 H new ATOM 0 HB3 GLN A 14 33.422 -6.148 3.194 1.00 55.42 H new ATOM 0 HG2 GLN A 14 31.928 -4.610 3.929 1.00 75.34 H new ATOM 0 HG3 GLN A 14 30.914 -5.275 2.665 1.00 75.34 H new ATOM 0 HE21 GLN A 14 29.028 -4.628 3.816 1.00 12.21 H new ATOM 0 HE22 GLN A 14 28.467 -5.539 5.222 1.00 12.21 H new ATOM 208 N GLY A 15 30.987 -9.553 2.781 1.00 41.44 N ATOM 209 CA GLY A 15 29.834 -10.388 3.060 1.00 31.53 C ATOM 210 C GLY A 15 29.546 -11.372 1.944 1.00 71.33 C ATOM 211 O GLY A 15 28.524 -12.059 1.961 1.00 13.20 O ATOM 0 H GLY A 15 31.889 -10.019 2.882 1.00 41.44 H new ATOM 0 HA2 GLY A 15 30.002 -10.935 3.988 1.00 31.53 H new ATOM 0 HA3 GLY A 15 28.960 -9.755 3.216 1.00 31.53 H new ATOM 215 N ASP A 16 30.447 -11.439 0.970 1.00 24.50 N ATOM 216 CA ASP A 16 30.284 -12.347 -0.160 1.00 71.02 C ATOM 217 C ASP A 16 30.604 -13.782 0.245 1.00 42.02 C ATOM 218 O ASP A 16 31.371 -14.018 1.179 1.00 60.13 O ATOM 219 CB ASP A 16 31.186 -11.917 -1.319 1.00 73.54 C ATOM 220 CG ASP A 16 30.427 -11.792 -2.627 1.00 21.44 C ATOM 221 OD1 ASP A 16 29.628 -10.842 -2.760 1.00 3.42 O ATOM 222 OD2 ASP A 16 30.631 -12.647 -3.515 1.00 1.31 O ATOM 0 H ASP A 16 31.297 -10.876 0.940 1.00 24.50 H new ATOM 0 HA ASP A 16 29.244 -12.304 -0.483 1.00 71.02 H new ATOM 0 HB2 ASP A 16 31.651 -10.961 -1.079 1.00 73.54 H new ATOM 0 HB3 ASP A 16 31.991 -12.642 -1.437 1.00 73.54 H new ATOM 227 N TRP A 17 30.011 -14.737 -0.463 1.00 0.40 N ATOM 228 CA TRP A 17 30.233 -16.149 -0.176 1.00 72.32 C ATOM 229 C TRP A 17 30.556 -16.920 -1.453 1.00 12.03 C ATOM 230 O TRP A 17 29.892 -16.751 -2.475 1.00 62.34 O ATOM 231 CB TRP A 17 29.001 -16.753 0.499 1.00 30.44 C ATOM 232 CG TRP A 17 28.469 -15.913 1.622 1.00 75.50 C ATOM 233 CD1 TRP A 17 29.194 -15.303 2.605 1.00 61.30 C ATOM 234 CD2 TRP A 17 27.096 -15.593 1.875 1.00 34.24 C ATOM 235 NE1 TRP A 17 28.355 -14.624 3.455 1.00 42.43 N ATOM 236 CE2 TRP A 17 27.063 -14.785 3.029 1.00 60.24 C ATOM 237 CE3 TRP A 17 25.892 -15.910 1.241 1.00 54.53 C ATOM 238 CZ2 TRP A 17 25.873 -14.291 3.558 1.00 45.02 C ATOM 239 CZ3 TRP A 17 24.712 -15.419 1.766 1.00 23.04 C ATOM 240 CH2 TRP A 17 24.710 -14.616 2.916 1.00 74.32 C ATOM 0 H TRP A 17 29.373 -14.559 -1.239 1.00 0.40 H new ATOM 0 HA TRP A 17 31.085 -16.227 0.500 1.00 72.32 H new ATOM 0 HB2 TRP A 17 28.217 -16.890 -0.246 1.00 30.44 H new ATOM 0 HB3 TRP A 17 29.253 -17.742 0.882 1.00 30.44 H new ATOM 0 HD1 TRP A 17 30.269 -15.348 2.700 1.00 61.30 H new ATOM 0 HE1 TRP A 17 28.647 -14.087 4.271 1.00 42.43 H new ATOM 0 HE3 TRP A 17 25.884 -16.528 0.356 1.00 54.53 H new ATOM 0 HZ2 TRP A 17 25.869 -13.673 4.444 1.00 45.02 H new ATOM 0 HZ3 TRP A 17 23.776 -15.657 1.283 1.00 23.04 H new ATOM 0 HH2 TRP A 17 23.771 -14.247 3.302 1.00 74.32 H new ATOM 251 N VAL A 18 31.579 -17.767 -1.385 1.00 54.50 N ATOM 252 CA VAL A 18 31.988 -18.563 -2.535 1.00 34.13 C ATOM 253 C VAL A 18 32.151 -20.031 -2.156 1.00 25.43 C ATOM 254 O VAL A 18 32.830 -20.359 -1.184 1.00 22.33 O ATOM 255 CB VAL A 18 33.311 -18.048 -3.132 1.00 74.40 C ATOM 256 CG1 VAL A 18 33.144 -16.629 -3.654 1.00 63.23 C ATOM 257 CG2 VAL A 18 34.424 -18.118 -2.099 1.00 25.14 C ATOM 0 H VAL A 18 32.139 -17.919 -0.546 1.00 54.50 H new ATOM 0 HA VAL A 18 31.200 -18.469 -3.282 1.00 34.13 H new ATOM 0 HB VAL A 18 33.585 -18.688 -3.971 1.00 74.40 H new ATOM 0 HG11 VAL A 18 34.089 -16.282 -4.072 1.00 63.23 H new ATOM 0 HG12 VAL A 18 32.377 -16.614 -4.428 1.00 63.23 H new ATOM 0 HG13 VAL A 18 32.846 -15.973 -2.836 1.00 63.23 H new ATOM 0 HG21 VAL A 18 35.351 -17.750 -2.538 1.00 25.14 H new ATOM 0 HG22 VAL A 18 34.161 -17.503 -1.238 1.00 25.14 H new ATOM 0 HG23 VAL A 18 34.559 -19.151 -1.779 1.00 25.14 H new ATOM 267 N ALA A 19 31.526 -20.910 -2.931 1.00 13.10 N ATOM 268 CA ALA A 19 31.603 -22.343 -2.679 1.00 60.52 C ATOM 269 C ALA A 19 32.662 -22.999 -3.559 1.00 72.35 C ATOM 270 O ALA A 19 32.541 -23.013 -4.784 1.00 64.23 O ATOM 271 CB ALA A 19 30.247 -22.995 -2.907 1.00 52.41 C ATOM 0 H ALA A 19 30.960 -20.654 -3.740 1.00 13.10 H new ATOM 0 HA ALA A 19 31.892 -22.488 -1.638 1.00 60.52 H new ATOM 0 HB1 ALA A 19 30.321 -24.065 -2.715 1.00 52.41 H new ATOM 0 HB2 ALA A 19 29.513 -22.555 -2.232 1.00 52.41 H new ATOM 0 HB3 ALA A 19 29.934 -22.832 -3.938 1.00 52.41 H new ATOM 277 N SER A 20 33.698 -23.541 -2.928 1.00 1.12 N ATOM 278 CA SER A 20 34.780 -24.194 -3.655 1.00 35.23 C ATOM 279 C SER A 20 34.817 -25.688 -3.346 1.00 31.41 C ATOM 280 O SER A 20 35.128 -26.096 -2.227 1.00 51.21 O ATOM 281 CB SER A 20 36.122 -23.555 -3.296 1.00 41.34 C ATOM 282 OG SER A 20 37.204 -24.342 -3.765 1.00 71.11 O ATOM 0 H SER A 20 33.811 -23.541 -1.914 1.00 1.12 H new ATOM 0 HA SER A 20 34.598 -24.065 -4.722 1.00 35.23 H new ATOM 0 HB2 SER A 20 36.180 -22.556 -3.729 1.00 41.34 H new ATOM 0 HB3 SER A 20 36.195 -23.438 -2.215 1.00 41.34 H new ATOM 0 HG SER A 20 37.418 -25.032 -3.103 1.00 71.11 H new ATOM 288 N PHE A 21 34.497 -26.501 -4.348 1.00 33.33 N ATOM 289 CA PHE A 21 34.492 -27.950 -4.185 1.00 34.04 C ATOM 290 C PHE A 21 35.543 -28.601 -5.078 1.00 74.11 C ATOM 291 O PHE A 21 35.545 -28.409 -6.293 1.00 71.23 O ATOM 292 CB PHE A 21 33.108 -28.517 -4.511 1.00 41.52 C ATOM 293 CG PHE A 21 31.985 -27.774 -3.845 1.00 14.21 C ATOM 294 CD1 PHE A 21 32.058 -27.438 -2.503 1.00 52.35 C ATOM 295 CD2 PHE A 21 30.855 -27.413 -4.562 1.00 41.31 C ATOM 296 CE1 PHE A 21 31.026 -26.754 -1.888 1.00 2.44 C ATOM 297 CE2 PHE A 21 29.820 -26.729 -3.952 1.00 5.00 C ATOM 298 CZ PHE A 21 29.905 -26.400 -2.613 1.00 0.02 C ATOM 0 H PHE A 21 34.238 -26.181 -5.281 1.00 33.33 H new ATOM 0 HA PHE A 21 34.733 -28.174 -3.146 1.00 34.04 H new ATOM 0 HB2 PHE A 21 32.959 -28.493 -5.591 1.00 41.52 H new ATOM 0 HB3 PHE A 21 33.072 -29.563 -4.207 1.00 41.52 H new ATOM 0 HD1 PHE A 21 32.931 -27.714 -1.931 1.00 52.35 H new ATOM 0 HD2 PHE A 21 30.782 -27.669 -5.609 1.00 41.31 H new ATOM 0 HE1 PHE A 21 31.096 -26.497 -0.841 1.00 2.44 H new ATOM 0 HE2 PHE A 21 28.945 -26.452 -4.522 1.00 5.00 H new ATOM 0 HZ PHE A 21 29.097 -25.867 -2.134 1.00 0.02 H new ATOM 308 N ASN A 22 36.436 -29.372 -4.466 1.00 12.34 N ATOM 309 CA ASN A 22 37.495 -30.051 -5.205 1.00 33.33 C ATOM 310 C ASN A 22 37.955 -31.304 -4.467 1.00 25.01 C ATOM 311 O ASN A 22 37.739 -31.443 -3.263 1.00 23.14 O ATOM 312 CB ASN A 22 38.680 -29.108 -5.422 1.00 12.45 C ATOM 313 CG ASN A 22 39.070 -28.370 -4.156 1.00 51.45 C ATOM 314 OD1 ASN A 22 39.377 -28.984 -3.135 1.00 13.20 O ATOM 315 ND2 ASN A 22 39.058 -27.042 -4.219 1.00 64.32 N ATOM 0 H ASN A 22 36.448 -29.542 -3.460 1.00 12.34 H new ATOM 0 HA ASN A 22 37.095 -30.348 -6.174 1.00 33.33 H new ATOM 0 HB2 ASN A 22 39.534 -29.680 -5.784 1.00 12.45 H new ATOM 0 HB3 ASN A 22 38.428 -28.385 -6.198 1.00 12.45 H new ATOM 0 HD21 ASN A 22 39.310 -26.490 -3.399 1.00 64.32 H new ATOM 0 HD22 ASN A 22 38.797 -26.575 -5.087 1.00 64.32 H new ATOM 322 N PHE A 23 38.592 -32.214 -5.197 1.00 11.22 N ATOM 323 CA PHE A 23 39.084 -33.455 -4.612 1.00 32.03 C ATOM 324 C PHE A 23 40.610 -33.468 -4.567 1.00 35.43 C ATOM 325 O PHE A 23 41.272 -32.909 -5.439 1.00 52.11 O ATOM 326 CB PHE A 23 38.576 -34.656 -5.412 1.00 32.45 C ATOM 327 CG PHE A 23 38.883 -34.573 -6.880 1.00 12.24 C ATOM 328 CD1 PHE A 23 37.908 -34.187 -7.784 1.00 31.41 C ATOM 329 CD2 PHE A 23 40.147 -34.881 -7.354 1.00 64.13 C ATOM 330 CE1 PHE A 23 38.187 -34.109 -9.135 1.00 52.12 C ATOM 331 CE2 PHE A 23 40.433 -34.804 -8.705 1.00 24.55 C ATOM 332 CZ PHE A 23 39.452 -34.419 -9.596 1.00 15.12 C ATOM 0 H PHE A 23 38.779 -32.115 -6.195 1.00 11.22 H new ATOM 0 HA PHE A 23 38.708 -33.521 -3.591 1.00 32.03 H new ATOM 0 HB2 PHE A 23 39.020 -35.566 -5.007 1.00 32.45 H new ATOM 0 HB3 PHE A 23 37.497 -34.741 -5.279 1.00 32.45 H new ATOM 0 HD1 PHE A 23 36.917 -33.944 -7.429 1.00 31.41 H new ATOM 0 HD2 PHE A 23 40.918 -35.185 -6.661 1.00 64.13 H new ATOM 0 HE1 PHE A 23 37.417 -33.806 -9.830 1.00 52.12 H new ATOM 0 HE2 PHE A 23 41.423 -35.045 -9.062 1.00 24.55 H new ATOM 0 HZ PHE A 23 39.673 -34.360 -10.652 1.00 15.12 H new ATOM 342 N SER A 24 41.159 -34.112 -3.541 1.00 2.11 N ATOM 343 CA SER A 24 42.606 -34.195 -3.378 1.00 73.13 C ATOM 344 C SER A 24 43.114 -35.589 -3.734 1.00 13.23 C ATOM 345 O SER A 24 42.376 -36.571 -3.651 1.00 31.11 O ATOM 346 CB SER A 24 43.000 -33.847 -1.941 1.00 54.01 C ATOM 347 OG SER A 24 44.401 -33.949 -1.757 1.00 74.02 O ATOM 0 H SER A 24 40.624 -34.583 -2.811 1.00 2.11 H new ATOM 0 HA SER A 24 43.065 -33.476 -4.057 1.00 73.13 H new ATOM 0 HB2 SER A 24 42.672 -32.834 -1.706 1.00 54.01 H new ATOM 0 HB3 SER A 24 42.490 -34.516 -1.248 1.00 54.01 H new ATOM 0 HG SER A 24 44.833 -33.126 -2.069 1.00 74.02 H new ATOM 353 N LYS A 25 44.379 -35.668 -4.130 1.00 1.25 N ATOM 354 CA LYS A 25 44.989 -36.941 -4.497 1.00 1.43 C ATOM 355 C LYS A 25 46.452 -36.987 -4.069 1.00 42.50 C ATOM 356 O LYS A 25 47.195 -36.025 -4.260 1.00 50.33 O ATOM 357 CB LYS A 25 44.881 -37.164 -6.007 1.00 30.35 C ATOM 358 CG LYS A 25 43.493 -36.897 -6.564 1.00 0.23 C ATOM 359 CD LYS A 25 43.452 -37.081 -8.071 1.00 31.31 C ATOM 360 CE LYS A 25 43.381 -38.552 -8.451 1.00 33.22 C ATOM 361 NZ LYS A 25 43.887 -38.794 -9.831 1.00 11.02 N ATOM 0 H LYS A 25 45.003 -34.865 -4.205 1.00 1.25 H new ATOM 0 HA LYS A 25 44.452 -37.736 -3.979 1.00 1.43 H new ATOM 0 HB2 LYS A 25 45.597 -36.517 -6.513 1.00 30.35 H new ATOM 0 HB3 LYS A 25 45.163 -38.192 -6.235 1.00 30.35 H new ATOM 0 HG2 LYS A 25 42.776 -37.571 -6.095 1.00 0.23 H new ATOM 0 HG3 LYS A 25 43.188 -35.881 -6.312 1.00 0.23 H new ATOM 0 HD2 LYS A 25 42.588 -36.557 -8.479 1.00 31.31 H new ATOM 0 HD3 LYS A 25 44.339 -36.631 -8.518 1.00 31.31 H new ATOM 0 HE2 LYS A 25 43.965 -39.139 -7.742 1.00 33.22 H new ATOM 0 HE3 LYS A 25 42.350 -38.897 -8.377 1.00 33.22 H new ATOM 0 HZ1 LYS A 25 43.822 -39.808 -10.052 1.00 11.02 H new ATOM 0 HZ2 LYS A 25 43.314 -38.254 -10.511 1.00 11.02 H new ATOM 0 HZ3 LYS A 25 44.879 -38.489 -9.895 1.00 11.02 H new ATOM 375 N VAL A 26 46.859 -38.112 -3.491 1.00 4.43 N ATOM 376 CA VAL A 26 48.235 -38.285 -3.038 1.00 42.22 C ATOM 377 C VAL A 26 49.111 -38.858 -4.147 1.00 53.53 C ATOM 378 O VAL A 26 48.934 -40.003 -4.562 1.00 64.32 O ATOM 379 CB VAL A 26 48.310 -39.210 -1.810 1.00 1.20 C ATOM 380 CG1 VAL A 26 49.742 -39.322 -1.312 1.00 44.52 C ATOM 381 CG2 VAL A 26 47.392 -38.707 -0.707 1.00 53.11 C ATOM 0 H VAL A 26 46.256 -38.918 -3.325 1.00 4.43 H new ATOM 0 HA VAL A 26 48.603 -37.297 -2.762 1.00 42.22 H new ATOM 0 HB VAL A 26 47.975 -40.204 -2.106 1.00 1.20 H new ATOM 0 HG11 VAL A 26 49.775 -39.980 -0.444 1.00 44.52 H new ATOM 0 HG12 VAL A 26 50.371 -39.732 -2.102 1.00 44.52 H new ATOM 0 HG13 VAL A 26 50.108 -38.334 -1.033 1.00 44.52 H new ATOM 0 HG21 VAL A 26 47.458 -39.373 0.153 1.00 53.11 H new ATOM 0 HG22 VAL A 26 47.694 -37.702 -0.412 1.00 53.11 H new ATOM 0 HG23 VAL A 26 46.365 -38.685 -1.071 1.00 53.11 H new ATOM 731 N THR A 53 41.682 -40.684 -4.676 1.00 14.32 N ATOM 732 CA THR A 53 40.887 -39.481 -4.887 1.00 5.53 C ATOM 733 C THR A 53 39.887 -39.277 -3.755 1.00 14.41 C ATOM 734 O THR A 53 39.041 -40.134 -3.497 1.00 72.15 O ATOM 735 CB THR A 53 40.127 -39.536 -6.225 1.00 41.41 C ATOM 736 OG1 THR A 53 39.284 -38.386 -6.358 1.00 33.44 O ATOM 737 CG2 THR A 53 39.288 -40.801 -6.318 1.00 14.33 C ATOM 0 HA THR A 53 41.583 -38.643 -4.908 1.00 5.53 H new ATOM 0 HB THR A 53 40.858 -39.544 -7.033 1.00 41.41 H new ATOM 0 HG1 THR A 53 38.806 -38.428 -7.212 1.00 33.44 H new ATOM 0 HG21 THR A 53 38.760 -40.818 -7.271 1.00 14.33 H new ATOM 0 HG22 THR A 53 39.937 -41.674 -6.247 1.00 14.33 H new ATOM 0 HG23 THR A 53 38.565 -40.819 -5.503 1.00 14.33 H new ATOM 745 N THR A 54 39.988 -38.135 -3.080 1.00 32.22 N ATOM 746 CA THR A 54 39.091 -37.820 -1.975 1.00 0.31 C ATOM 747 C THR A 54 38.405 -36.476 -2.190 1.00 53.15 C ATOM 748 O THR A 54 39.048 -35.425 -2.150 1.00 33.24 O ATOM 749 CB THR A 54 39.845 -37.788 -0.631 1.00 61.53 C ATOM 750 OG1 THR A 54 40.844 -38.815 -0.607 1.00 13.41 O ATOM 751 CG2 THR A 54 38.884 -37.981 0.532 1.00 13.13 C ATOM 0 H THR A 54 40.681 -37.414 -3.279 1.00 32.22 H new ATOM 0 HA THR A 54 38.339 -38.609 -1.944 1.00 0.31 H new ATOM 0 HB THR A 54 40.323 -36.814 -0.529 1.00 61.53 H new ATOM 0 HG1 THR A 54 41.320 -38.788 0.249 1.00 13.41 H new ATOM 0 HG21 THR A 54 39.438 -37.955 1.470 1.00 13.13 H new ATOM 0 HG22 THR A 54 38.142 -37.183 0.527 1.00 13.13 H new ATOM 0 HG23 THR A 54 38.382 -38.944 0.434 1.00 13.13 H new ATOM 759 N LEU A 55 37.097 -36.514 -2.419 1.00 1.14 N ATOM 760 CA LEU A 55 36.323 -35.298 -2.640 1.00 55.24 C ATOM 761 C LEU A 55 36.255 -34.457 -1.369 1.00 41.15 C ATOM 762 O LEU A 55 36.010 -34.976 -0.280 1.00 4.43 O ATOM 763 CB LEU A 55 34.910 -35.647 -3.111 1.00 21.33 C ATOM 764 CG LEU A 55 34.030 -36.384 -2.100 1.00 51.03 C ATOM 765 CD1 LEU A 55 33.291 -35.393 -1.213 1.00 31.31 C ATOM 766 CD2 LEU A 55 33.046 -37.298 -2.816 1.00 61.04 C ATOM 0 H LEU A 55 36.550 -37.374 -2.456 1.00 1.14 H new ATOM 0 HA LEU A 55 36.823 -34.715 -3.413 1.00 55.24 H new ATOM 0 HB2 LEU A 55 34.405 -34.724 -3.398 1.00 21.33 H new ATOM 0 HB3 LEU A 55 34.989 -36.259 -4.009 1.00 21.33 H new ATOM 0 HG LEU A 55 34.672 -36.998 -1.468 1.00 51.03 H new ATOM 0 HD11 LEU A 55 32.670 -35.936 -0.500 1.00 31.31 H new ATOM 0 HD12 LEU A 55 34.012 -34.780 -0.673 1.00 31.31 H new ATOM 0 HD13 LEU A 55 32.660 -34.753 -1.830 1.00 31.31 H new ATOM 0 HD21 LEU A 55 32.428 -37.814 -2.081 1.00 61.04 H new ATOM 0 HD22 LEU A 55 32.410 -36.705 -3.472 1.00 61.04 H new ATOM 0 HD23 LEU A 55 33.595 -38.031 -3.408 1.00 61.04 H new ATOM 778 N THR A 56 36.471 -33.153 -1.516 1.00 73.11 N ATOM 779 CA THR A 56 36.432 -32.240 -0.381 1.00 43.24 C ATOM 780 C THR A 56 35.699 -30.951 -0.737 1.00 24.40 C ATOM 781 O THR A 56 35.767 -30.479 -1.871 1.00 62.31 O ATOM 782 CB THR A 56 37.852 -31.891 0.107 1.00 35.41 C ATOM 783 OG1 THR A 56 38.791 -32.052 -0.963 1.00 0.34 O ATOM 784 CG2 THR A 56 38.253 -32.774 1.279 1.00 2.10 C ATOM 0 H THR A 56 36.675 -32.706 -2.410 1.00 73.11 H new ATOM 0 HA THR A 56 35.895 -32.751 0.418 1.00 43.24 H new ATOM 0 HB THR A 56 37.854 -30.852 0.438 1.00 35.41 H new ATOM 0 HG1 THR A 56 38.462 -31.585 -1.760 1.00 0.34 H new ATOM 0 HG21 THR A 56 39.259 -32.510 1.606 1.00 2.10 H new ATOM 0 HG22 THR A 56 37.553 -32.627 2.102 1.00 2.10 H new ATOM 0 HG23 THR A 56 38.235 -33.819 0.970 1.00 2.10 H new ATOM 792 N PHE A 57 34.998 -30.387 0.241 1.00 71.11 N ATOM 793 CA PHE A 57 34.251 -29.152 0.030 1.00 15.13 C ATOM 794 C PHE A 57 34.731 -28.057 0.978 1.00 65.21 C ATOM 795 O PHE A 57 34.861 -28.276 2.183 1.00 25.41 O ATOM 796 CB PHE A 57 32.754 -29.397 0.234 1.00 52.54 C ATOM 797 CG PHE A 57 32.247 -30.625 -0.466 1.00 70.32 C ATOM 798 CD1 PHE A 57 32.601 -30.886 -1.780 1.00 62.35 C ATOM 799 CD2 PHE A 57 31.416 -31.519 0.189 1.00 15.44 C ATOM 800 CE1 PHE A 57 32.136 -32.016 -2.426 1.00 64.13 C ATOM 801 CE2 PHE A 57 30.948 -32.650 -0.451 1.00 54.34 C ATOM 802 CZ PHE A 57 31.308 -32.898 -1.762 1.00 31.45 C ATOM 0 H PHE A 57 34.931 -30.765 1.186 1.00 71.11 H new ATOM 0 HA PHE A 57 34.423 -28.823 -0.995 1.00 15.13 H new ATOM 0 HB2 PHE A 57 32.551 -29.487 1.301 1.00 52.54 H new ATOM 0 HB3 PHE A 57 32.200 -28.529 -0.124 1.00 52.54 H new ATOM 0 HD1 PHE A 57 33.248 -30.199 -2.305 1.00 62.35 H new ATOM 0 HD2 PHE A 57 31.130 -31.329 1.213 1.00 15.44 H new ATOM 0 HE1 PHE A 57 32.421 -32.209 -3.450 1.00 64.13 H new ATOM 0 HE2 PHE A 57 30.302 -33.339 0.072 1.00 54.34 H new ATOM 0 HZ PHE A 57 30.942 -33.780 -2.266 1.00 31.45 H new ATOM 812 N ASP A 58 34.995 -26.878 0.426 1.00 33.41 N ATOM 813 CA ASP A 58 35.461 -25.748 1.220 1.00 33.13 C ATOM 814 C ASP A 58 34.676 -24.484 0.881 1.00 30.43 C ATOM 815 O ASP A 58 34.393 -24.213 -0.286 1.00 15.02 O ATOM 816 CB ASP A 58 36.955 -25.514 0.986 1.00 55.22 C ATOM 817 CG ASP A 58 37.223 -24.693 -0.260 1.00 52.21 C ATOM 818 OD1 ASP A 58 37.218 -23.448 -0.163 1.00 5.55 O ATOM 819 OD2 ASP A 58 37.439 -25.296 -1.332 1.00 2.41 O ATOM 0 H ASP A 58 34.894 -26.680 -0.570 1.00 33.41 H new ATOM 0 HA ASP A 58 35.298 -25.983 2.272 1.00 33.13 H new ATOM 0 HB2 ASP A 58 37.380 -25.006 1.851 1.00 55.22 H new ATOM 0 HB3 ASP A 58 37.462 -26.475 0.900 1.00 55.22 H new ATOM 824 N ILE A 59 34.327 -23.718 1.909 1.00 4.11 N ATOM 825 CA ILE A 59 33.575 -22.484 1.720 1.00 50.54 C ATOM 826 C ILE A 59 34.394 -21.270 2.147 1.00 71.22 C ATOM 827 O ILE A 59 34.905 -21.215 3.265 1.00 63.35 O ATOM 828 CB ILE A 59 32.254 -22.502 2.511 1.00 41.51 C ATOM 829 CG1 ILE A 59 32.507 -22.937 3.956 1.00 34.24 C ATOM 830 CG2 ILE A 59 31.248 -23.426 1.841 1.00 24.31 C ATOM 831 CD1 ILE A 59 31.255 -22.966 4.805 1.00 3.34 C ATOM 0 H ILE A 59 34.553 -23.930 2.881 1.00 4.11 H new ATOM 0 HA ILE A 59 33.350 -22.412 0.656 1.00 50.54 H new ATOM 0 HB ILE A 59 31.839 -21.494 2.522 1.00 41.51 H new ATOM 0 HG12 ILE A 59 32.959 -23.929 3.955 1.00 34.24 H new ATOM 0 HG13 ILE A 59 33.229 -22.258 4.410 1.00 34.24 H new ATOM 0 HG21 ILE A 59 30.319 -23.428 2.412 1.00 24.31 H new ATOM 0 HG22 ILE A 59 31.050 -23.075 0.828 1.00 24.31 H new ATOM 0 HG23 ILE A 59 31.652 -24.437 1.802 1.00 24.31 H new ATOM 0 HD11 ILE A 59 31.509 -23.283 5.817 1.00 3.34 H new ATOM 0 HD12 ILE A 59 30.814 -21.970 4.837 1.00 3.34 H new ATOM 0 HD13 ILE A 59 30.539 -23.666 4.374 1.00 3.34 H new ATOM 843 N ALA A 60 34.513 -20.297 1.249 1.00 74.10 N ATOM 844 CA ALA A 60 35.265 -19.081 1.534 1.00 74.53 C ATOM 845 C ALA A 60 34.336 -17.880 1.674 1.00 61.34 C ATOM 846 O ALA A 60 33.330 -17.777 0.972 1.00 2.14 O ATOM 847 CB ALA A 60 36.295 -18.831 0.441 1.00 13.14 C ATOM 0 H ALA A 60 34.098 -20.327 0.318 1.00 74.10 H new ATOM 0 HA ALA A 60 35.783 -19.217 2.483 1.00 74.53 H new ATOM 0 HB1 ALA A 60 36.850 -17.920 0.665 1.00 13.14 H new ATOM 0 HB2 ALA A 60 36.985 -19.673 0.392 1.00 13.14 H new ATOM 0 HB3 ALA A 60 35.789 -18.720 -0.518 1.00 13.14 H new ATOM 853 N TYR A 61 34.680 -16.976 2.585 1.00 75.42 N ATOM 854 CA TYR A 61 33.874 -15.784 2.819 1.00 51.32 C ATOM 855 C TYR A 61 34.644 -14.523 2.437 1.00 75.04 C ATOM 856 O TYR A 61 35.715 -14.248 2.977 1.00 4.44 O ATOM 857 CB TYR A 61 33.449 -15.711 4.286 1.00 53.20 C ATOM 858 CG TYR A 61 32.077 -16.289 4.549 1.00 75.12 C ATOM 859 CD1 TYR A 61 31.167 -15.628 5.363 1.00 13.25 C ATOM 860 CD2 TYR A 61 31.691 -17.498 3.983 1.00 12.10 C ATOM 861 CE1 TYR A 61 29.912 -16.152 5.607 1.00 22.33 C ATOM 862 CE2 TYR A 61 30.439 -18.031 4.219 1.00 0.44 C ATOM 863 CZ TYR A 61 29.553 -17.353 5.032 1.00 22.52 C ATOM 864 OH TYR A 61 28.304 -17.881 5.272 1.00 51.02 O ATOM 0 H TYR A 61 35.511 -17.046 3.173 1.00 75.42 H new ATOM 0 HA TYR A 61 32.984 -15.848 2.193 1.00 51.32 H new ATOM 0 HB2 TYR A 61 34.181 -16.243 4.894 1.00 53.20 H new ATOM 0 HB3 TYR A 61 33.463 -14.670 4.608 1.00 53.20 H new ATOM 0 HD1 TYR A 61 31.445 -14.687 5.814 1.00 13.25 H new ATOM 0 HD2 TYR A 61 32.383 -18.030 3.347 1.00 12.10 H new ATOM 0 HE1 TYR A 61 29.217 -15.625 6.244 1.00 22.33 H new ATOM 0 HE2 TYR A 61 30.155 -18.972 3.771 1.00 0.44 H new ATOM 0 HH TYR A 61 28.210 -18.730 4.792 1.00 51.02 H new ATOM 874 N PHE A 62 34.088 -13.760 1.502 1.00 41.31 N ATOM 875 CA PHE A 62 34.721 -12.527 1.046 1.00 70.21 C ATOM 876 C PHE A 62 34.234 -11.332 1.860 1.00 64.23 C ATOM 877 O PHE A 62 33.143 -10.812 1.628 1.00 32.10 O ATOM 878 CB PHE A 62 34.432 -12.299 -0.439 1.00 2.01 C ATOM 879 CG PHE A 62 35.620 -11.800 -1.211 1.00 74.32 C ATOM 880 CD1 PHE A 62 36.810 -12.507 -1.211 1.00 21.13 C ATOM 881 CD2 PHE A 62 35.544 -10.623 -1.939 1.00 12.22 C ATOM 882 CE1 PHE A 62 37.906 -12.051 -1.921 1.00 15.33 C ATOM 883 CE2 PHE A 62 36.635 -10.161 -2.650 1.00 72.34 C ATOM 884 CZ PHE A 62 37.817 -10.876 -2.641 1.00 1.32 C ATOM 0 H PHE A 62 33.201 -13.973 1.045 1.00 41.31 H new ATOM 0 HA PHE A 62 35.797 -12.627 1.188 1.00 70.21 H new ATOM 0 HB2 PHE A 62 34.088 -13.234 -0.882 1.00 2.01 H new ATOM 0 HB3 PHE A 62 33.618 -11.581 -0.536 1.00 2.01 H new ATOM 0 HD1 PHE A 62 36.884 -13.427 -0.649 1.00 21.13 H new ATOM 0 HD2 PHE A 62 34.622 -10.061 -1.951 1.00 12.22 H new ATOM 0 HE1 PHE A 62 38.829 -12.612 -1.912 1.00 15.33 H new ATOM 0 HE2 PHE A 62 36.564 -9.242 -3.212 1.00 72.34 H new ATOM 0 HZ PHE A 62 38.671 -10.516 -3.196 1.00 1.32 H new ATOM 894 N VAL A 63 35.051 -10.903 2.816 1.00 43.43 N ATOM 895 CA VAL A 63 34.705 -9.768 3.665 1.00 21.12 C ATOM 896 C VAL A 63 35.689 -8.620 3.475 1.00 5.34 C ATOM 897 O VAL A 63 35.310 -7.450 3.523 1.00 52.25 O ATOM 898 CB VAL A 63 34.679 -10.168 5.152 1.00 64.44 C ATOM 899 CG1 VAL A 63 36.025 -10.739 5.575 1.00 12.22 C ATOM 900 CG2 VAL A 63 34.301 -8.975 6.017 1.00 73.40 C ATOM 0 H VAL A 63 35.957 -11.324 3.023 1.00 43.43 H new ATOM 0 HA VAL A 63 33.709 -9.441 3.367 1.00 21.12 H new ATOM 0 HB VAL A 63 33.924 -10.942 5.290 1.00 64.44 H new ATOM 0 HG11 VAL A 63 35.988 -11.016 6.629 1.00 12.22 H new ATOM 0 HG12 VAL A 63 36.251 -11.621 4.976 1.00 12.22 H new ATOM 0 HG13 VAL A 63 36.802 -9.989 5.424 1.00 12.22 H new ATOM 0 HG21 VAL A 63 34.287 -9.275 7.065 1.00 73.40 H new ATOM 0 HG22 VAL A 63 35.032 -8.178 5.877 1.00 73.40 H new ATOM 0 HG23 VAL A 63 33.313 -8.616 5.730 1.00 73.40 H new ATOM 910 N SER A 64 36.956 -8.962 3.261 1.00 14.13 N ATOM 911 CA SER A 64 37.996 -7.959 3.067 1.00 1.54 C ATOM 912 C SER A 64 38.735 -8.189 1.752 1.00 51.10 C ATOM 913 O SER A 64 38.864 -9.322 1.290 1.00 73.00 O ATOM 914 CB SER A 64 38.986 -7.988 4.234 1.00 70.31 C ATOM 915 OG SER A 64 38.510 -7.222 5.326 1.00 22.55 O ATOM 0 H SER A 64 37.286 -9.926 3.218 1.00 14.13 H new ATOM 0 HA SER A 64 37.519 -6.980 3.029 1.00 1.54 H new ATOM 0 HB2 SER A 64 39.148 -9.018 4.552 1.00 70.31 H new ATOM 0 HB3 SER A 64 39.950 -7.600 3.906 1.00 70.31 H new ATOM 0 HG SER A 64 39.160 -7.258 6.059 1.00 22.55 H new ATOM 921 N SER A 65 39.218 -7.104 1.155 1.00 63.23 N ATOM 922 CA SER A 65 39.941 -7.185 -0.109 1.00 34.43 C ATOM 923 C SER A 65 41.383 -7.630 0.117 1.00 11.40 C ATOM 924 O SER A 65 41.950 -8.367 -0.688 1.00 21.24 O ATOM 925 CB SER A 65 39.919 -5.832 -0.822 1.00 12.05 C ATOM 926 OG SER A 65 41.006 -5.712 -1.722 1.00 61.31 O ATOM 0 H SER A 65 39.122 -6.159 1.526 1.00 63.23 H new ATOM 0 HA SER A 65 39.444 -7.926 -0.736 1.00 34.43 H new ATOM 0 HB2 SER A 65 38.980 -5.718 -1.364 1.00 12.05 H new ATOM 0 HB3 SER A 65 39.962 -5.029 -0.086 1.00 12.05 H new ATOM 0 HG SER A 65 40.968 -4.839 -2.166 1.00 61.31 H new ATOM 932 N ASN A 66 41.970 -7.175 1.220 1.00 33.21 N ATOM 933 CA ASN A 66 43.346 -7.525 1.554 1.00 53.33 C ATOM 934 C ASN A 66 43.467 -9.012 1.874 1.00 10.43 C ATOM 935 O ASN A 66 44.420 -9.670 1.458 1.00 71.32 O ATOM 936 CB ASN A 66 43.830 -6.694 2.743 1.00 5.21 C ATOM 937 CG ASN A 66 43.677 -5.203 2.509 1.00 62.43 C ATOM 938 OD1 ASN A 66 44.573 -4.554 1.970 1.00 43.32 O ATOM 939 ND2 ASN A 66 42.538 -4.655 2.913 1.00 34.33 N ATOM 0 H ASN A 66 41.514 -6.563 1.897 1.00 33.21 H new ATOM 0 HA ASN A 66 43.971 -7.307 0.688 1.00 53.33 H new ATOM 0 HB2 ASN A 66 43.269 -6.978 3.633 1.00 5.21 H new ATOM 0 HB3 ASN A 66 44.878 -6.922 2.940 1.00 5.21 H new ATOM 0 HD21 ASN A 66 42.378 -3.656 2.781 1.00 34.33 H new ATOM 0 HD22 ASN A 66 41.823 -5.232 3.355 1.00 34.33 H new ATOM 946 N ILE A 67 42.495 -9.532 2.616 1.00 74.10 N ATOM 947 CA ILE A 67 42.491 -10.941 2.990 1.00 65.31 C ATOM 948 C ILE A 67 41.084 -11.524 2.927 1.00 43.13 C ATOM 949 O ILE A 67 40.104 -10.837 3.212 1.00 31.25 O ATOM 950 CB ILE A 67 43.058 -11.148 4.407 1.00 22.21 C ATOM 951 CG1 ILE A 67 44.390 -10.411 4.561 1.00 52.30 C ATOM 952 CG2 ILE A 67 43.231 -12.631 4.697 1.00 31.15 C ATOM 953 CD1 ILE A 67 44.240 -8.989 5.056 1.00 34.24 C ATOM 0 H ILE A 67 41.701 -8.999 2.970 1.00 74.10 H new ATOM 0 HA ILE A 67 43.127 -11.459 2.273 1.00 65.31 H new ATOM 0 HB ILE A 67 42.352 -10.736 5.128 1.00 22.21 H new ATOM 0 HG12 ILE A 67 45.024 -10.964 5.255 1.00 52.30 H new ATOM 0 HG13 ILE A 67 44.903 -10.400 3.600 1.00 52.30 H new ATOM 0 HG21 ILE A 67 43.633 -12.761 5.702 1.00 31.15 H new ATOM 0 HG22 ILE A 67 42.265 -13.131 4.625 1.00 31.15 H new ATOM 0 HG23 ILE A 67 43.920 -13.066 3.972 1.00 31.15 H new ATOM 0 HD11 ILE A 67 45.224 -8.528 5.141 1.00 34.24 H new ATOM 0 HD12 ILE A 67 43.633 -8.421 4.351 1.00 34.24 H new ATOM 0 HD13 ILE A 67 43.755 -8.993 6.032 1.00 34.24 H new ATOM 965 N ALA A 68 40.993 -12.796 2.553 1.00 55.13 N ATOM 966 CA ALA A 68 39.705 -13.473 2.456 1.00 2.50 C ATOM 967 C ALA A 68 39.640 -14.667 3.402 1.00 3.24 C ATOM 968 O ALA A 68 40.669 -15.190 3.829 1.00 31.22 O ATOM 969 CB ALA A 68 39.448 -13.917 1.024 1.00 44.33 C ATOM 0 H ALA A 68 41.795 -13.378 2.312 1.00 55.13 H new ATOM 0 HA ALA A 68 38.928 -12.767 2.750 1.00 2.50 H new ATOM 0 HB1 ALA A 68 38.483 -14.421 0.967 1.00 44.33 H new ATOM 0 HB2 ALA A 68 39.442 -13.046 0.369 1.00 44.33 H new ATOM 0 HB3 ALA A 68 40.235 -14.603 0.709 1.00 44.33 H new ATOM 975 N VAL A 69 38.424 -15.092 3.727 1.00 20.14 N ATOM 976 CA VAL A 69 38.225 -16.225 4.623 1.00 20.05 C ATOM 977 C VAL A 69 38.045 -17.521 3.840 1.00 41.40 C ATOM 978 O VAL A 69 37.417 -17.536 2.781 1.00 11.43 O ATOM 979 CB VAL A 69 36.999 -16.014 5.531 1.00 12.45 C ATOM 980 CG1 VAL A 69 36.788 -17.219 6.434 1.00 20.52 C ATOM 981 CG2 VAL A 69 37.158 -14.744 6.354 1.00 65.11 C ATOM 0 H VAL A 69 37.562 -14.669 3.384 1.00 20.14 H new ATOM 0 HA VAL A 69 39.119 -16.299 5.242 1.00 20.05 H new ATOM 0 HB VAL A 69 36.117 -15.904 4.900 1.00 12.45 H new ATOM 0 HG11 VAL A 69 35.917 -17.051 7.068 1.00 20.52 H new ATOM 0 HG12 VAL A 69 36.626 -18.107 5.823 1.00 20.52 H new ATOM 0 HG13 VAL A 69 37.669 -17.364 7.059 1.00 20.52 H new ATOM 0 HG21 VAL A 69 36.283 -14.610 6.990 1.00 65.11 H new ATOM 0 HG22 VAL A 69 38.050 -14.823 6.976 1.00 65.11 H new ATOM 0 HG23 VAL A 69 37.256 -13.888 5.687 1.00 65.11 H new ATOM 991 N ASP A 70 38.601 -18.606 4.367 1.00 33.10 N ATOM 992 CA ASP A 70 38.501 -19.908 3.718 1.00 40.22 C ATOM 993 C ASP A 70 38.310 -21.016 4.748 1.00 2.41 C ATOM 994 O ASP A 70 39.045 -21.095 5.733 1.00 63.02 O ATOM 995 CB ASP A 70 39.752 -20.182 2.882 1.00 2.41 C ATOM 996 CG ASP A 70 39.830 -21.621 2.411 1.00 63.44 C ATOM 997 OD1 ASP A 70 39.041 -21.998 1.520 1.00 54.42 O ATOM 998 OD2 ASP A 70 40.682 -22.371 2.932 1.00 14.25 O ATOM 0 H ASP A 70 39.126 -18.610 5.242 1.00 33.10 H new ATOM 0 HA ASP A 70 37.631 -19.893 3.062 1.00 40.22 H new ATOM 0 HB2 ASP A 70 39.760 -19.519 2.017 1.00 2.41 H new ATOM 0 HB3 ASP A 70 40.638 -19.947 3.472 1.00 2.41 H new ATOM 1003 N PHE A 71 37.319 -21.869 4.516 1.00 12.14 N ATOM 1004 CA PHE A 71 37.030 -22.972 5.425 1.00 14.14 C ATOM 1005 C PHE A 71 37.005 -24.301 4.678 1.00 33.12 C ATOM 1006 O PHE A 71 36.208 -24.495 3.759 1.00 40.41 O ATOM 1007 CB PHE A 71 35.689 -22.744 6.128 1.00 44.42 C ATOM 1008 CG PHE A 71 35.523 -23.556 7.380 1.00 33.34 C ATOM 1009 CD1 PHE A 71 35.419 -22.936 8.615 1.00 65.41 C ATOM 1010 CD2 PHE A 71 35.469 -24.939 7.322 1.00 61.24 C ATOM 1011 CE1 PHE A 71 35.265 -23.681 9.769 1.00 30.24 C ATOM 1012 CE2 PHE A 71 35.315 -25.689 8.472 1.00 30.41 C ATOM 1013 CZ PHE A 71 35.214 -25.060 9.698 1.00 72.13 C ATOM 0 H PHE A 71 36.702 -21.818 3.706 1.00 12.14 H new ATOM 0 HA PHE A 71 37.823 -23.010 6.172 1.00 14.14 H new ATOM 0 HB2 PHE A 71 35.592 -21.687 6.375 1.00 44.42 H new ATOM 0 HB3 PHE A 71 34.880 -22.985 5.438 1.00 44.42 H new ATOM 0 HD1 PHE A 71 35.459 -21.858 8.676 1.00 65.41 H new ATOM 0 HD2 PHE A 71 35.548 -25.437 6.367 1.00 61.24 H new ATOM 0 HE1 PHE A 71 35.185 -23.186 10.725 1.00 30.24 H new ATOM 0 HE2 PHE A 71 35.274 -26.767 8.413 1.00 30.41 H new ATOM 0 HZ PHE A 71 35.096 -25.645 10.598 1.00 72.13 H new ATOM 1023 N PHE A 72 37.882 -25.215 5.079 1.00 62.33 N ATOM 1024 CA PHE A 72 37.963 -26.527 4.445 1.00 1.24 C ATOM 1025 C PHE A 72 37.138 -27.553 5.217 1.00 73.55 C ATOM 1026 O PHE A 72 37.203 -27.624 6.444 1.00 65.23 O ATOM 1027 CB PHE A 72 39.420 -26.987 4.360 1.00 51.51 C ATOM 1028 CG PHE A 72 39.723 -27.791 3.129 1.00 51.14 C ATOM 1029 CD1 PHE A 72 39.847 -29.169 3.199 1.00 52.45 C ATOM 1030 CD2 PHE A 72 39.884 -27.169 1.900 1.00 1.35 C ATOM 1031 CE1 PHE A 72 40.126 -29.913 2.067 1.00 11.43 C ATOM 1032 CE2 PHE A 72 40.162 -27.908 0.766 1.00 55.22 C ATOM 1033 CZ PHE A 72 40.284 -29.281 0.850 1.00 50.43 C ATOM 0 H PHE A 72 38.547 -25.072 5.840 1.00 62.33 H new ATOM 0 HA PHE A 72 37.557 -26.443 3.437 1.00 1.24 H new ATOM 0 HB2 PHE A 72 40.071 -26.113 4.383 1.00 51.51 H new ATOM 0 HB3 PHE A 72 39.657 -27.583 5.241 1.00 51.51 H new ATOM 0 HD1 PHE A 72 39.724 -29.668 4.149 1.00 52.45 H new ATOM 0 HD2 PHE A 72 39.791 -26.095 1.828 1.00 1.35 H new ATOM 0 HE1 PHE A 72 40.220 -30.987 2.135 1.00 11.43 H new ATOM 0 HE2 PHE A 72 40.284 -27.412 -0.186 1.00 55.22 H new ATOM 0 HZ PHE A 72 40.503 -29.860 -0.035 1.00 50.43 H new ATOM 1043 N VAL A 73 36.362 -28.349 4.487 1.00 11.41 N ATOM 1044 CA VAL A 73 35.524 -29.372 5.100 1.00 61.15 C ATOM 1045 C VAL A 73 35.562 -30.667 4.296 1.00 64.50 C ATOM 1046 O VAL A 73 35.292 -30.673 3.096 1.00 64.25 O ATOM 1047 CB VAL A 73 34.063 -28.902 5.225 1.00 0.44 C ATOM 1048 CG1 VAL A 73 33.247 -29.901 6.031 1.00 2.14 C ATOM 1049 CG2 VAL A 73 34.002 -27.519 5.856 1.00 20.15 C ATOM 0 H VAL A 73 36.297 -28.304 3.470 1.00 11.41 H new ATOM 0 HA VAL A 73 35.925 -29.553 6.097 1.00 61.15 H new ATOM 0 HB VAL A 73 33.632 -28.841 4.226 1.00 0.44 H new ATOM 0 HG11 VAL A 73 32.217 -29.552 6.108 1.00 2.14 H new ATOM 0 HG12 VAL A 73 33.265 -30.871 5.534 1.00 2.14 H new ATOM 0 HG13 VAL A 73 33.673 -29.998 7.029 1.00 2.14 H new ATOM 0 HG21 VAL A 73 32.962 -27.202 5.937 1.00 20.15 H new ATOM 0 HG22 VAL A 73 34.450 -27.552 6.849 1.00 20.15 H new ATOM 0 HG23 VAL A 73 34.550 -26.811 5.234 1.00 20.15 H new ATOM 1059 N GLY A 74 35.899 -31.765 4.968 1.00 43.12 N ATOM 1060 CA GLY A 74 35.967 -33.051 4.300 1.00 74.21 C ATOM 1061 C GLY A 74 34.832 -33.974 4.703 1.00 44.54 C ATOM 1062 O GLY A 74 33.865 -33.542 5.330 1.00 23.15 O ATOM 0 H GLY A 74 36.126 -31.786 5.962 1.00 43.12 H new ATOM 0 HA2 GLY A 74 35.942 -32.898 3.221 1.00 74.21 H new ATOM 0 HA3 GLY A 74 36.919 -33.528 4.532 1.00 74.21 H new ATOM 1457 N ALA A 101 37.348 -30.068 10.022 1.00 4.21 N ATOM 1458 CA ALA A 101 37.157 -28.655 9.721 1.00 34.13 C ATOM 1459 C ALA A 101 38.474 -27.891 9.809 1.00 55.14 C ATOM 1460 O ALA A 101 39.214 -28.023 10.783 1.00 1.41 O ATOM 1461 CB ALA A 101 36.128 -28.048 10.665 1.00 64.40 C ATOM 0 HA ALA A 101 36.788 -28.574 8.698 1.00 34.13 H new ATOM 0 HB1 ALA A 101 35.995 -26.992 10.429 1.00 64.40 H new ATOM 0 HB2 ALA A 101 35.177 -28.568 10.549 1.00 64.40 H new ATOM 0 HB3 ALA A 101 36.474 -28.149 11.694 1.00 64.40 H new ATOM 1467 N ILE A 102 38.758 -27.094 8.785 1.00 61.33 N ATOM 1468 CA ILE A 102 39.986 -26.310 8.747 1.00 44.41 C ATOM 1469 C ILE A 102 39.686 -24.828 8.542 1.00 22.03 C ATOM 1470 O ILE A 102 38.859 -24.461 7.706 1.00 44.31 O ATOM 1471 CB ILE A 102 40.928 -26.790 7.626 1.00 13.32 C ATOM 1472 CG1 ILE A 102 41.084 -28.311 7.680 1.00 41.41 C ATOM 1473 CG2 ILE A 102 42.283 -26.108 7.744 1.00 32.23 C ATOM 1474 CD1 ILE A 102 41.971 -28.865 6.588 1.00 62.44 C ATOM 0 H ILE A 102 38.155 -26.974 7.971 1.00 61.33 H new ATOM 0 HA ILE A 102 40.479 -26.450 9.709 1.00 44.41 H new ATOM 0 HB ILE A 102 40.492 -26.522 6.664 1.00 13.32 H new ATOM 0 HG12 ILE A 102 41.496 -28.592 8.649 1.00 41.41 H new ATOM 0 HG13 ILE A 102 40.099 -28.772 7.606 1.00 41.41 H new ATOM 0 HG21 ILE A 102 42.937 -26.458 6.945 1.00 32.23 H new ATOM 0 HG22 ILE A 102 42.155 -25.029 7.662 1.00 32.23 H new ATOM 0 HG23 ILE A 102 42.729 -26.349 8.709 1.00 32.23 H new ATOM 0 HD11 ILE A 102 42.037 -29.948 6.687 1.00 62.44 H new ATOM 0 HD12 ILE A 102 41.549 -28.615 5.615 1.00 62.44 H new ATOM 0 HD13 ILE A 102 42.967 -28.432 6.674 1.00 62.44 H new ATOM 1486 N LEU A 103 40.364 -23.982 9.311 1.00 53.04 N ATOM 1487 CA LEU A 103 40.171 -22.538 9.213 1.00 31.53 C ATOM 1488 C LEU A 103 41.445 -21.851 8.731 1.00 20.13 C ATOM 1489 O LEU A 103 42.485 -21.921 9.384 1.00 65.22 O ATOM 1490 CB LEU A 103 39.751 -21.968 10.569 1.00 43.31 C ATOM 1491 CG LEU A 103 38.920 -20.685 10.528 1.00 73.11 C ATOM 1492 CD1 LEU A 103 39.710 -19.557 9.886 1.00 54.52 C ATOM 1493 CD2 LEU A 103 37.615 -20.919 9.780 1.00 63.12 C ATOM 0 H LEU A 103 41.051 -24.270 10.008 1.00 53.04 H new ATOM 0 HA LEU A 103 39.381 -22.349 8.486 1.00 31.53 H new ATOM 0 HB2 LEU A 103 39.181 -22.730 11.100 1.00 43.31 H new ATOM 0 HB3 LEU A 103 40.650 -21.777 11.155 1.00 43.31 H new ATOM 0 HG LEU A 103 38.682 -20.396 11.552 1.00 73.11 H new ATOM 0 HD11 LEU A 103 39.102 -18.653 9.866 1.00 54.52 H new ATOM 0 HD12 LEU A 103 40.616 -19.373 10.464 1.00 54.52 H new ATOM 0 HD13 LEU A 103 39.980 -19.836 8.867 1.00 54.52 H new ATOM 0 HD21 LEU A 103 37.036 -19.996 9.761 1.00 63.12 H new ATOM 0 HD22 LEU A 103 37.832 -21.233 8.759 1.00 63.12 H new ATOM 0 HD23 LEU A 103 37.041 -21.696 10.284 1.00 63.12 H new ATOM 1505 N SER A 104 41.354 -21.185 7.584 1.00 12.13 N ATOM 1506 CA SER A 104 42.498 -20.485 7.014 1.00 25.24 C ATOM 1507 C SER A 104 42.044 -19.303 6.163 1.00 23.14 C ATOM 1508 O SER A 104 40.881 -19.218 5.768 1.00 31.32 O ATOM 1509 CB SER A 104 43.339 -21.443 6.168 1.00 34.05 C ATOM 1510 OG SER A 104 42.520 -22.211 5.302 1.00 50.14 O ATOM 0 H SER A 104 40.499 -21.116 7.032 1.00 12.13 H new ATOM 0 HA SER A 104 43.106 -20.106 7.835 1.00 25.24 H new ATOM 0 HB2 SER A 104 44.063 -20.876 5.582 1.00 34.05 H new ATOM 0 HB3 SER A 104 43.907 -22.107 6.820 1.00 34.05 H new ATOM 0 HG SER A 104 42.187 -21.642 4.577 1.00 50.14 H new ATOM 1516 N LEU A 105 42.970 -18.391 5.885 1.00 21.42 N ATOM 1517 CA LEU A 105 42.666 -17.213 5.082 1.00 61.34 C ATOM 1518 C LEU A 105 43.321 -17.308 3.707 1.00 4.20 C ATOM 1519 O LEU A 105 44.361 -17.947 3.549 1.00 64.14 O ATOM 1520 CB LEU A 105 43.139 -15.947 5.798 1.00 32.15 C ATOM 1521 CG LEU A 105 42.805 -15.855 7.287 1.00 32.02 C ATOM 1522 CD1 LEU A 105 43.889 -16.524 8.120 1.00 54.05 C ATOM 1523 CD2 LEU A 105 42.629 -14.403 7.706 1.00 2.33 C ATOM 0 H LEU A 105 43.937 -18.446 6.204 1.00 21.42 H new ATOM 0 HA LEU A 105 41.585 -17.164 4.947 1.00 61.34 H new ATOM 0 HB2 LEU A 105 44.220 -15.871 5.683 1.00 32.15 H new ATOM 0 HB3 LEU A 105 42.703 -15.084 5.294 1.00 32.15 H new ATOM 0 HG LEU A 105 41.865 -16.379 7.461 1.00 32.02 H new ATOM 0 HD11 LEU A 105 43.634 -16.449 9.177 1.00 54.05 H new ATOM 0 HD12 LEU A 105 43.967 -17.574 7.840 1.00 54.05 H new ATOM 0 HD13 LEU A 105 44.843 -16.029 7.941 1.00 54.05 H new ATOM 0 HD21 LEU A 105 42.392 -14.357 8.769 1.00 2.33 H new ATOM 0 HD22 LEU A 105 43.552 -13.855 7.516 1.00 2.33 H new ATOM 0 HD23 LEU A 105 41.817 -13.955 7.133 1.00 2.33 H new ATOM 1535 N GLN A 106 42.708 -16.665 2.719 1.00 71.21 N ATOM 1536 CA GLN A 106 43.232 -16.677 1.359 1.00 45.23 C ATOM 1537 C GLN A 106 43.799 -15.311 0.982 1.00 33.15 C ATOM 1538 O GLN A 106 43.262 -14.275 1.377 1.00 22.14 O ATOM 1539 CB GLN A 106 42.138 -17.078 0.370 1.00 33.32 C ATOM 1540 CG GLN A 106 42.661 -17.817 -0.851 1.00 70.43 C ATOM 1541 CD GLN A 106 41.632 -18.752 -1.454 1.00 11.11 C ATOM 1542 OE1 GLN A 106 41.681 -19.965 -1.248 1.00 20.13 O ATOM 1543 NE2 GLN A 106 40.690 -18.191 -2.203 1.00 72.32 N ATOM 0 H GLN A 106 41.848 -16.129 2.835 1.00 71.21 H new ATOM 0 HA GLN A 106 44.037 -17.410 1.314 1.00 45.23 H new ATOM 0 HB2 GLN A 106 41.411 -17.708 0.882 1.00 33.32 H new ATOM 0 HB3 GLN A 106 41.609 -16.182 0.043 1.00 33.32 H new ATOM 0 HG2 GLN A 106 42.973 -17.092 -1.603 1.00 70.43 H new ATOM 0 HG3 GLN A 106 43.547 -18.389 -0.573 1.00 70.43 H new ATOM 0 HE21 GLN A 106 40.687 -17.181 -2.347 1.00 72.32 H new ATOM 0 HE22 GLN A 106 39.969 -18.770 -2.634 1.00 72.32 H new ATOM 1552 N TYR A 107 44.884 -15.316 0.218 1.00 61.22 N ATOM 1553 CA TYR A 107 45.525 -14.077 -0.210 1.00 32.24 C ATOM 1554 C TYR A 107 45.736 -14.067 -1.721 1.00 13.24 C ATOM 1555 O TYR A 107 46.140 -15.069 -2.310 1.00 64.22 O ATOM 1556 CB TYR A 107 46.865 -13.898 0.506 1.00 73.42 C ATOM 1557 CG TYR A 107 46.750 -13.878 2.013 1.00 52.23 C ATOM 1558 CD1 TYR A 107 46.589 -15.055 2.733 1.00 22.41 C ATOM 1559 CD2 TYR A 107 46.801 -12.681 2.717 1.00 40.30 C ATOM 1560 CE1 TYR A 107 46.483 -15.041 4.111 1.00 10.31 C ATOM 1561 CE2 TYR A 107 46.696 -12.657 4.094 1.00 63.51 C ATOM 1562 CZ TYR A 107 46.537 -13.840 4.786 1.00 0.12 C ATOM 1563 OH TYR A 107 46.432 -13.821 6.158 1.00 4.54 O ATOM 0 H TYR A 107 45.340 -16.164 -0.119 1.00 61.22 H new ATOM 0 HA TYR A 107 44.868 -13.248 0.052 1.00 32.24 H new ATOM 0 HB2 TYR A 107 47.535 -14.706 0.212 1.00 73.42 H new ATOM 0 HB3 TYR A 107 47.323 -12.967 0.173 1.00 73.42 H new ATOM 0 HD1 TYR A 107 46.546 -15.997 2.207 1.00 22.41 H new ATOM 0 HD2 TYR A 107 46.925 -11.753 2.178 1.00 40.30 H new ATOM 0 HE1 TYR A 107 46.359 -15.965 4.656 1.00 10.31 H new ATOM 0 HE2 TYR A 107 46.738 -11.718 4.626 1.00 63.51 H new ATOM 0 HH TYR A 107 46.490 -12.896 6.478 1.00 4.54 H new ATOM 1712 N TYR A 116 43.443 -15.945 -11.679 1.00 32.32 N ATOM 1713 CA TYR A 116 44.705 -15.632 -11.020 1.00 62.25 C ATOM 1714 C TYR A 116 44.980 -16.606 -9.878 1.00 55.14 C ATOM 1715 O TYR A 116 44.081 -17.275 -9.369 1.00 13.33 O ATOM 1716 CB TYR A 116 44.685 -14.198 -10.488 1.00 62.23 C ATOM 1717 CG TYR A 116 45.139 -13.171 -11.500 1.00 45.33 C ATOM 1718 CD1 TYR A 116 44.352 -12.066 -11.801 1.00 64.40 C ATOM 1719 CD2 TYR A 116 46.357 -13.304 -12.156 1.00 3.01 C ATOM 1720 CE1 TYR A 116 44.763 -11.126 -12.726 1.00 3.15 C ATOM 1721 CE2 TYR A 116 46.778 -12.367 -13.081 1.00 10.15 C ATOM 1722 CZ TYR A 116 45.977 -11.280 -13.362 1.00 32.12 C ATOM 1723 OH TYR A 116 46.391 -10.345 -14.283 1.00 35.03 O ATOM 0 HA TYR A 116 45.503 -15.729 -11.756 1.00 62.25 H new ATOM 0 HB2 TYR A 116 43.673 -13.954 -10.164 1.00 62.23 H new ATOM 0 HB3 TYR A 116 45.325 -14.137 -9.608 1.00 62.23 H new ATOM 0 HD1 TYR A 116 43.402 -11.940 -11.303 1.00 64.40 H new ATOM 0 HD2 TYR A 116 46.986 -14.155 -11.939 1.00 3.01 H new ATOM 0 HE1 TYR A 116 44.137 -10.275 -12.950 1.00 3.15 H new ATOM 0 HE2 TYR A 116 47.728 -12.485 -13.581 1.00 10.15 H new ATOM 0 HH TYR A 116 47.268 -10.601 -14.638 1.00 35.03 H new ATOM 1733 N PRO A 117 46.253 -16.688 -9.466 1.00 25.31 N ATOM 1734 CA PRO A 117 46.678 -17.576 -8.380 1.00 33.03 C ATOM 1735 C PRO A 117 46.165 -17.114 -7.020 1.00 73.01 C ATOM 1736 O PRO A 117 45.706 -15.982 -6.871 1.00 23.12 O ATOM 1737 CB PRO A 117 48.205 -17.494 -8.431 1.00 43.02 C ATOM 1738 CG PRO A 117 48.493 -16.172 -9.052 1.00 52.15 C ATOM 1739 CD PRO A 117 47.377 -15.921 -10.029 1.00 62.22 C ATOM 0 HA PRO A 117 46.288 -18.586 -8.503 1.00 33.03 H new ATOM 0 HB2 PRO A 117 48.639 -17.566 -7.434 1.00 43.02 H new ATOM 0 HB3 PRO A 117 48.626 -18.308 -9.021 1.00 43.02 H new ATOM 0 HG2 PRO A 117 48.534 -15.387 -8.297 1.00 52.15 H new ATOM 0 HG3 PRO A 117 49.459 -16.180 -9.557 1.00 52.15 H new ATOM 0 HD2 PRO A 117 47.141 -14.860 -10.106 1.00 62.22 H new ATOM 0 HD3 PRO A 117 47.635 -16.263 -11.031 1.00 62.22 H new ATOM 1747 N TYR A 118 46.247 -17.998 -6.031 1.00 74.22 N ATOM 1748 CA TYR A 118 45.788 -17.681 -4.684 1.00 64.32 C ATOM 1749 C TYR A 118 46.492 -18.555 -3.650 1.00 3.10 C ATOM 1750 O TYR A 118 46.684 -19.752 -3.858 1.00 72.52 O ATOM 1751 CB TYR A 118 44.274 -17.868 -4.580 1.00 30.01 C ATOM 1752 CG TYR A 118 43.843 -19.318 -4.547 1.00 51.34 C ATOM 1753 CD1 TYR A 118 43.774 -20.015 -3.348 1.00 65.51 C ATOM 1754 CD2 TYR A 118 43.507 -19.989 -5.716 1.00 54.22 C ATOM 1755 CE1 TYR A 118 43.383 -21.339 -3.314 1.00 34.21 C ATOM 1756 CE2 TYR A 118 43.113 -21.312 -5.692 1.00 2.05 C ATOM 1757 CZ TYR A 118 43.052 -21.983 -4.487 1.00 75.15 C ATOM 1758 OH TYR A 118 42.661 -23.302 -4.459 1.00 71.01 O ATOM 0 H TYR A 118 46.627 -18.939 -6.137 1.00 74.22 H new ATOM 0 HA TYR A 118 46.032 -16.638 -4.480 1.00 64.32 H new ATOM 0 HB2 TYR A 118 43.916 -17.371 -3.678 1.00 30.01 H new ATOM 0 HB3 TYR A 118 43.797 -17.375 -5.427 1.00 30.01 H new ATOM 0 HD1 TYR A 118 44.030 -19.513 -2.427 1.00 65.51 H new ATOM 0 HD2 TYR A 118 43.555 -19.467 -6.660 1.00 54.22 H new ATOM 0 HE1 TYR A 118 43.337 -21.867 -2.373 1.00 34.21 H new ATOM 0 HE2 TYR A 118 42.854 -21.819 -6.610 1.00 2.05 H new ATOM 0 HH TYR A 118 43.090 -23.786 -5.196 1.00 71.01 H new ATOM 1768 N VAL A 119 46.875 -17.945 -2.532 1.00 32.24 N ATOM 1769 CA VAL A 119 47.556 -18.666 -1.463 1.00 35.31 C ATOM 1770 C VAL A 119 46.671 -18.780 -0.227 1.00 2.45 C ATOM 1771 O VAL A 119 45.930 -17.855 0.107 1.00 64.53 O ATOM 1772 CB VAL A 119 48.877 -17.977 -1.074 1.00 75.01 C ATOM 1773 CG1 VAL A 119 49.657 -18.834 -0.089 1.00 13.03 C ATOM 1774 CG2 VAL A 119 49.709 -17.683 -2.314 1.00 23.54 C ATOM 0 H VAL A 119 46.725 -16.954 -2.343 1.00 32.24 H new ATOM 0 HA VAL A 119 47.774 -19.664 -1.843 1.00 35.31 H new ATOM 0 HB VAL A 119 48.643 -17.030 -0.588 1.00 75.01 H new ATOM 0 HG11 VAL A 119 50.587 -18.331 0.174 1.00 13.03 H new ATOM 0 HG12 VAL A 119 49.061 -18.988 0.810 1.00 13.03 H new ATOM 0 HG13 VAL A 119 49.882 -19.798 -0.545 1.00 13.03 H new ATOM 0 HG21 VAL A 119 50.639 -17.196 -2.021 1.00 23.54 H new ATOM 0 HG22 VAL A 119 49.935 -18.616 -2.830 1.00 23.54 H new ATOM 0 HG23 VAL A 119 49.150 -17.026 -2.980 1.00 23.54 H new ATOM 1784 N GLY A 120 46.754 -19.920 0.451 1.00 5.23 N ATOM 1785 CA GLY A 120 45.956 -20.134 1.645 1.00 4.42 C ATOM 1786 C GLY A 120 46.798 -20.533 2.841 1.00 12.15 C ATOM 1787 O GLY A 120 47.642 -21.424 2.746 1.00 72.04 O ATOM 0 H GLY A 120 47.360 -20.700 0.195 1.00 5.23 H new ATOM 0 HA2 GLY A 120 45.406 -19.222 1.879 1.00 4.42 H new ATOM 0 HA3 GLY A 120 45.217 -20.911 1.450 1.00 4.42 H new ATOM 1791 N VAL A 121 46.568 -19.871 3.971 1.00 41.21 N ATOM 1792 CA VAL A 121 47.312 -20.162 5.191 1.00 43.42 C ATOM 1793 C VAL A 121 46.399 -20.130 6.411 1.00 5.43 C ATOM 1794 O VAL A 121 45.488 -19.308 6.497 1.00 71.43 O ATOM 1795 CB VAL A 121 48.464 -19.159 5.399 1.00 72.43 C ATOM 1796 CG1 VAL A 121 49.228 -19.480 6.674 1.00 64.24 C ATOM 1797 CG2 VAL A 121 49.393 -19.160 4.194 1.00 25.53 C ATOM 0 H VAL A 121 45.873 -19.130 4.067 1.00 41.21 H new ATOM 0 HA VAL A 121 47.728 -21.163 5.077 1.00 43.42 H new ATOM 0 HB VAL A 121 48.040 -18.160 5.501 1.00 72.43 H new ATOM 0 HG11 VAL A 121 50.037 -18.761 6.804 1.00 64.24 H new ATOM 0 HG12 VAL A 121 48.552 -19.423 7.527 1.00 64.24 H new ATOM 0 HG13 VAL A 121 49.643 -20.486 6.606 1.00 64.24 H new ATOM 0 HG21 VAL A 121 50.201 -18.447 4.357 1.00 25.53 H new ATOM 0 HG22 VAL A 121 49.811 -20.157 4.058 1.00 25.53 H new ATOM 0 HG23 VAL A 121 48.833 -18.877 3.303 1.00 25.53 H new ATOM 1807 N GLY A 122 46.652 -21.030 7.356 1.00 23.11 N ATOM 1808 CA GLY A 122 45.844 -21.088 8.561 1.00 22.22 C ATOM 1809 C GLY A 122 46.100 -22.344 9.370 1.00 24.51 C ATOM 1810 O GLY A 122 47.181 -22.930 9.296 1.00 74.43 O ATOM 0 H GLY A 122 47.402 -21.720 7.309 1.00 23.11 H new ATOM 0 HA2 GLY A 122 46.053 -20.214 9.177 1.00 22.22 H new ATOM 0 HA3 GLY A 122 44.789 -21.043 8.290 1.00 22.22 H new ATOM 1814 N VAL A 123 45.106 -22.758 10.149 1.00 51.42 N ATOM 1815 CA VAL A 123 45.228 -23.951 10.977 1.00 61.42 C ATOM 1816 C VAL A 123 44.050 -24.894 10.761 1.00 74.44 C ATOM 1817 O VAL A 123 42.928 -24.455 10.510 1.00 50.24 O ATOM 1818 CB VAL A 123 45.315 -23.591 12.472 1.00 73.34 C ATOM 1819 CG1 VAL A 123 46.596 -22.824 12.762 1.00 0.32 C ATOM 1820 CG2 VAL A 123 44.095 -22.789 12.898 1.00 73.21 C ATOM 0 H VAL A 123 44.206 -22.284 10.224 1.00 51.42 H new ATOM 0 HA VAL A 123 46.149 -24.450 10.677 1.00 61.42 H new ATOM 0 HB VAL A 123 45.334 -24.515 13.051 1.00 73.34 H new ATOM 0 HG11 VAL A 123 46.641 -22.578 13.823 1.00 0.32 H new ATOM 0 HG12 VAL A 123 47.456 -23.438 12.496 1.00 0.32 H new ATOM 0 HG13 VAL A 123 46.611 -21.905 12.176 1.00 0.32 H new ATOM 0 HG21 VAL A 123 44.173 -22.543 13.957 1.00 73.21 H new ATOM 0 HG22 VAL A 123 44.042 -21.870 12.315 1.00 73.21 H new ATOM 0 HG23 VAL A 123 43.194 -23.379 12.728 1.00 73.21 H new ATOM 1830 N GLY A 124 44.312 -26.194 10.859 1.00 53.30 N ATOM 1831 CA GLY A 124 43.263 -27.179 10.671 1.00 2.21 C ATOM 1832 C GLY A 124 42.896 -27.887 11.960 1.00 14.11 C ATOM 1833 O GLY A 124 43.683 -27.918 12.906 1.00 70.44 O ATOM 0 H GLY A 124 45.232 -26.582 11.065 1.00 53.30 H new ATOM 0 HA2 GLY A 124 42.378 -26.690 10.264 1.00 2.21 H new ATOM 0 HA3 GLY A 124 43.587 -27.915 9.935 1.00 2.21 H new ATOM 1837 N ARG A 125 41.695 -28.456 11.999 1.00 42.02 N ATOM 1838 CA ARG A 125 41.223 -29.165 13.183 1.00 2.21 C ATOM 1839 C ARG A 125 40.435 -30.411 12.793 1.00 71.44 C ATOM 1840 O ARG A 125 39.587 -30.368 11.902 1.00 75.33 O ATOM 1841 CB ARG A 125 40.352 -28.245 14.040 1.00 1.15 C ATOM 1842 CG ARG A 125 40.393 -28.576 15.523 1.00 54.21 C ATOM 1843 CD ARG A 125 39.355 -29.626 15.888 1.00 30.21 C ATOM 1844 NE ARG A 125 38.029 -29.044 16.076 1.00 32.01 N ATOM 1845 CZ ARG A 125 37.671 -28.366 17.161 1.00 52.32 C ATOM 1846 NH1 ARG A 125 38.535 -28.186 18.150 1.00 71.21 N ATOM 1847 NH2 ARG A 125 36.445 -27.866 17.257 1.00 44.12 N ATOM 0 H ARG A 125 41.031 -28.440 11.225 1.00 42.02 H new ATOM 0 HA ARG A 125 42.093 -29.474 13.762 1.00 2.21 H new ATOM 0 HB2 ARG A 125 40.677 -27.214 13.897 1.00 1.15 H new ATOM 0 HB3 ARG A 125 39.321 -28.306 13.691 1.00 1.15 H new ATOM 0 HG2 ARG A 125 41.386 -28.937 15.789 1.00 54.21 H new ATOM 0 HG3 ARG A 125 40.217 -27.671 16.104 1.00 54.21 H new ATOM 0 HD2 ARG A 125 39.311 -30.381 15.103 1.00 30.21 H new ATOM 0 HD3 ARG A 125 39.660 -30.135 16.802 1.00 30.21 H new ATOM 0 HE ARG A 125 37.340 -29.165 15.334 1.00 32.01 H new ATOM 0 HH11 ARG A 125 39.478 -28.568 18.079 1.00 71.21 H new ATOM 0 HH12 ARG A 125 38.257 -27.665 18.982 1.00 71.21 H new ATOM 0 HH21 ARG A 125 35.778 -28.002 16.498 1.00 44.12 H new ATOM 0 HH22 ARG A 125 36.170 -27.346 18.090 1.00 44.12 H new ATOM 2185 N ALA A 146 46.206 -27.683 14.189 1.00 2.22 N ATOM 2186 CA ALA A 146 47.475 -27.962 13.528 1.00 2.51 C ATOM 2187 C ALA A 146 47.754 -26.946 12.426 1.00 42.02 C ATOM 2188 O ALA A 146 46.855 -26.265 11.933 1.00 1.01 O ATOM 2189 CB ALA A 146 47.476 -29.373 12.960 1.00 32.11 C ATOM 0 HA ALA A 146 48.269 -27.881 14.271 1.00 2.51 H new ATOM 0 HB1 ALA A 146 48.430 -29.567 12.469 1.00 32.11 H new ATOM 0 HB2 ALA A 146 47.331 -30.090 13.768 1.00 32.11 H new ATOM 0 HB3 ALA A 146 46.668 -29.474 12.235 1.00 32.11 H new ATOM 2195 N PRO A 147 49.031 -26.840 12.028 1.00 53.43 N ATOM 2196 CA PRO A 147 49.458 -25.909 10.979 1.00 50.35 C ATOM 2197 C PRO A 147 48.960 -26.323 9.598 1.00 51.43 C ATOM 2198 O PRO A 147 49.101 -27.477 9.197 1.00 24.31 O ATOM 2199 CB PRO A 147 50.986 -25.982 11.040 1.00 62.53 C ATOM 2200 CG PRO A 147 51.278 -27.326 11.614 1.00 51.34 C ATOM 2201 CD PRO A 147 50.155 -27.620 12.571 1.00 64.33 C ATOM 0 HA PRO A 147 49.059 -24.907 11.137 1.00 50.35 H new ATOM 0 HB2 PRO A 147 51.428 -25.870 10.050 1.00 62.53 H new ATOM 0 HB3 PRO A 147 51.396 -25.188 11.664 1.00 62.53 H new ATOM 0 HG2 PRO A 147 51.331 -28.082 10.830 1.00 51.34 H new ATOM 0 HG3 PRO A 147 52.240 -27.331 12.127 1.00 51.34 H new ATOM 0 HD2 PRO A 147 49.925 -28.685 12.606 1.00 64.33 H new ATOM 0 HD3 PRO A 147 50.403 -27.314 13.587 1.00 64.33 H new ATOM 2209 N ALA A 148 48.377 -25.372 8.875 1.00 30.52 N ATOM 2210 CA ALA A 148 47.859 -25.638 7.539 1.00 43.42 C ATOM 2211 C ALA A 148 48.260 -24.535 6.565 1.00 2.31 C ATOM 2212 O ALA A 148 48.108 -23.348 6.859 1.00 74.30 O ATOM 2213 CB ALA A 148 46.345 -25.785 7.578 1.00 44.24 C ATOM 0 H ALA A 148 48.252 -24.411 9.192 1.00 30.52 H new ATOM 0 HA ALA A 148 48.294 -26.573 7.188 1.00 43.42 H new ATOM 0 HB1 ALA A 148 45.973 -25.983 6.573 1.00 44.24 H new ATOM 0 HB2 ALA A 148 46.077 -26.613 8.234 1.00 44.24 H new ATOM 0 HB3 ALA A 148 45.900 -24.864 7.955 1.00 44.24 H new ATOM 2219 N PHE A 149 48.775 -24.932 5.406 1.00 52.11 N ATOM 2220 CA PHE A 149 49.200 -23.976 4.390 1.00 13.12 C ATOM 2221 C PHE A 149 49.333 -24.653 3.029 1.00 54.42 C ATOM 2222 O PHE A 149 50.019 -25.666 2.894 1.00 52.12 O ATOM 2223 CB PHE A 149 50.531 -23.336 4.787 1.00 0.54 C ATOM 2224 CG PHE A 149 51.591 -24.334 5.154 1.00 75.42 C ATOM 2225 CD1 PHE A 149 51.679 -24.829 6.445 1.00 11.30 C ATOM 2226 CD2 PHE A 149 52.499 -24.780 4.206 1.00 2.51 C ATOM 2227 CE1 PHE A 149 52.655 -25.747 6.785 1.00 35.44 C ATOM 2228 CE2 PHE A 149 53.475 -25.699 4.540 1.00 25.03 C ATOM 2229 CZ PHE A 149 53.553 -26.184 5.831 1.00 70.23 C ATOM 0 H PHE A 149 48.908 -25.910 5.147 1.00 52.11 H new ATOM 0 HA PHE A 149 48.439 -23.199 4.317 1.00 13.12 H new ATOM 0 HB2 PHE A 149 50.891 -22.723 3.961 1.00 0.54 H new ATOM 0 HB3 PHE A 149 50.366 -22.667 5.631 1.00 0.54 H new ATOM 0 HD1 PHE A 149 50.977 -24.494 7.194 1.00 11.30 H new ATOM 0 HD2 PHE A 149 52.443 -24.405 3.195 1.00 2.51 H new ATOM 0 HE1 PHE A 149 52.715 -26.122 7.796 1.00 35.44 H new ATOM 0 HE2 PHE A 149 54.177 -26.038 3.792 1.00 25.03 H new ATOM 0 HZ PHE A 149 54.315 -26.903 6.094 1.00 70.23 H new ATOM 2239 N GLN A 150 48.672 -24.085 2.025 1.00 43.30 N ATOM 2240 CA GLN A 150 48.717 -24.634 0.675 1.00 11.14 C ATOM 2241 C GLN A 150 48.567 -23.530 -0.367 1.00 3.34 C ATOM 2242 O GLN A 150 48.138 -22.419 -0.052 1.00 63.24 O ATOM 2243 CB GLN A 150 47.615 -25.679 0.490 1.00 3.12 C ATOM 2244 CG GLN A 150 46.212 -25.124 0.681 1.00 41.31 C ATOM 2245 CD GLN A 150 45.152 -26.207 0.686 1.00 22.00 C ATOM 2246 OE1 GLN A 150 45.368 -27.306 0.173 1.00 14.02 O ATOM 2247 NE2 GLN A 150 43.998 -25.903 1.267 1.00 13.33 N ATOM 0 H GLN A 150 48.100 -23.246 2.121 1.00 43.30 H new ATOM 0 HA GLN A 150 49.687 -25.111 0.536 1.00 11.14 H new ATOM 0 HB2 GLN A 150 47.695 -26.106 -0.510 1.00 3.12 H new ATOM 0 HB3 GLN A 150 47.775 -26.492 1.198 1.00 3.12 H new ATOM 0 HG2 GLN A 150 46.168 -24.573 1.621 1.00 41.31 H new ATOM 0 HG3 GLN A 150 45.995 -24.412 -0.116 1.00 41.31 H new ATOM 0 HE21 GLN A 150 43.862 -24.980 1.680 1.00 13.33 H new ATOM 0 HE22 GLN A 150 43.247 -26.592 1.301 1.00 13.33 H new ATOM 2256 N VAL A 151 48.924 -23.842 -1.608 1.00 32.41 N ATOM 2257 CA VAL A 151 48.828 -22.877 -2.697 1.00 21.45 C ATOM 2258 C VAL A 151 47.997 -23.428 -3.849 1.00 34.30 C ATOM 2259 O VAL A 151 48.175 -24.573 -4.266 1.00 12.50 O ATOM 2260 CB VAL A 151 50.222 -22.488 -3.226 1.00 15.45 C ATOM 2261 CG1 VAL A 151 50.958 -23.713 -3.746 1.00 0.34 C ATOM 2262 CG2 VAL A 151 50.102 -21.427 -4.309 1.00 2.50 C ATOM 0 H VAL A 151 49.283 -24.756 -1.885 1.00 32.41 H new ATOM 0 HA VAL A 151 48.339 -21.991 -2.292 1.00 21.45 H new ATOM 0 HB VAL A 151 50.801 -22.070 -2.402 1.00 15.45 H new ATOM 0 HG11 VAL A 151 51.940 -23.418 -4.115 1.00 0.34 H new ATOM 0 HG12 VAL A 151 51.076 -24.436 -2.939 1.00 0.34 H new ATOM 0 HG13 VAL A 151 50.386 -24.164 -4.557 1.00 0.34 H new ATOM 0 HG21 VAL A 151 51.095 -21.163 -4.672 1.00 2.50 H new ATOM 0 HG22 VAL A 151 49.505 -21.815 -5.134 1.00 2.50 H new ATOM 0 HG23 VAL A 151 49.619 -20.541 -3.898 1.00 2.50 H new ATOM 2272 N GLY A 152 47.085 -22.607 -4.360 1.00 71.12 N ATOM 2273 CA GLY A 152 46.238 -23.030 -5.461 1.00 3.54 C ATOM 2274 C GLY A 152 46.041 -21.938 -6.494 1.00 25.22 C ATOM 2275 O GLY A 152 46.532 -20.821 -6.329 1.00 4.32 O ATOM 0 H GLY A 152 46.917 -21.656 -4.031 1.00 71.12 H new ATOM 0 HA2 GLY A 152 46.680 -23.904 -5.940 1.00 3.54 H new ATOM 0 HA3 GLY A 152 45.267 -23.337 -5.071 1.00 3.54 H new ATOM 2279 N LEU A 153 45.323 -22.261 -7.564 1.00 61.13 N ATOM 2280 CA LEU A 153 45.064 -21.300 -8.630 1.00 10.42 C ATOM 2281 C LEU A 153 43.572 -21.210 -8.931 1.00 2.31 C ATOM 2282 O LEU A 153 42.866 -22.218 -8.926 1.00 33.03 O ATOM 2283 CB LEU A 153 45.829 -21.693 -9.896 1.00 14.04 C ATOM 2284 CG LEU A 153 45.903 -23.191 -10.197 1.00 0.04 C ATOM 2285 CD1 LEU A 153 45.922 -23.433 -11.697 1.00 62.31 C ATOM 2286 CD2 LEU A 153 47.129 -23.807 -9.539 1.00 3.02 C ATOM 0 H LEU A 153 44.910 -23.181 -7.716 1.00 61.13 H new ATOM 0 HA LEU A 153 45.408 -20.322 -8.295 1.00 10.42 H new ATOM 0 HB2 LEU A 153 45.365 -21.194 -10.747 1.00 14.04 H new ATOM 0 HB3 LEU A 153 46.846 -21.308 -9.817 1.00 14.04 H new ATOM 0 HG LEU A 153 45.015 -23.670 -9.784 1.00 0.04 H new ATOM 0 HD11 LEU A 153 45.975 -24.504 -11.892 1.00 62.31 H new ATOM 0 HD12 LEU A 153 45.014 -23.027 -12.143 1.00 62.31 H new ATOM 0 HD13 LEU A 153 46.791 -22.941 -12.134 1.00 62.31 H new ATOM 0 HD21 LEU A 153 47.166 -24.873 -9.764 1.00 3.02 H new ATOM 0 HD22 LEU A 153 48.028 -23.324 -9.922 1.00 3.02 H new ATOM 0 HD23 LEU A 153 47.072 -23.665 -8.460 1.00 3.02 H new ATOM 2298 N ARG A 154 43.099 -19.996 -9.195 1.00 53.31 N ATOM 2299 CA ARG A 154 41.691 -19.774 -9.499 1.00 54.32 C ATOM 2300 C ARG A 154 41.510 -19.346 -10.953 1.00 34.03 C ATOM 2301 O ARG A 154 42.088 -18.353 -11.395 1.00 24.21 O ATOM 2302 CB ARG A 154 41.106 -18.711 -8.567 1.00 41.40 C ATOM 2303 CG ARG A 154 40.566 -19.275 -7.263 1.00 62.52 C ATOM 2304 CD ARG A 154 40.694 -18.273 -6.127 1.00 3.43 C ATOM 2305 NE ARG A 154 39.555 -17.361 -6.071 1.00 43.51 N ATOM 2306 CZ ARG A 154 38.391 -17.672 -5.513 1.00 32.14 C ATOM 2307 NH1 ARG A 154 38.213 -18.865 -4.964 1.00 10.05 N ATOM 2308 NH2 ARG A 154 37.402 -16.787 -5.501 1.00 34.33 N ATOM 0 H ARG A 154 43.671 -19.151 -9.204 1.00 53.31 H new ATOM 0 HA ARG A 154 41.160 -20.713 -9.345 1.00 54.32 H new ATOM 0 HB2 ARG A 154 41.876 -17.973 -8.343 1.00 41.40 H new ATOM 0 HB3 ARG A 154 40.304 -18.187 -9.086 1.00 41.40 H new ATOM 0 HG2 ARG A 154 39.519 -19.550 -7.390 1.00 62.52 H new ATOM 0 HG3 ARG A 154 41.107 -20.187 -7.008 1.00 62.52 H new ATOM 0 HD2 ARG A 154 40.778 -18.807 -5.180 1.00 3.43 H new ATOM 0 HD3 ARG A 154 41.612 -17.699 -6.252 1.00 3.43 H new ATOM 0 HE ARG A 154 39.659 -16.434 -6.483 1.00 43.51 H new ATOM 0 HH11 ARG A 154 38.971 -19.547 -4.969 1.00 10.05 H new ATOM 0 HH12 ARG A 154 37.318 -19.101 -4.536 1.00 10.05 H new ATOM 0 HH21 ARG A 154 37.536 -15.867 -5.921 1.00 34.33 H new ATOM 0 HH22 ARG A 154 36.508 -17.027 -5.072 1.00 34.33 H new ATOM 2322 N TYR A 155 40.702 -20.101 -11.690 1.00 41.23 N ATOM 2323 CA TYR A 155 40.447 -19.802 -13.094 1.00 2.31 C ATOM 2324 C TYR A 155 38.950 -19.818 -13.391 1.00 64.34 C ATOM 2325 O TYR A 155 38.333 -20.881 -13.468 1.00 43.42 O ATOM 2326 CB TYR A 155 41.168 -20.810 -13.991 1.00 32.34 C ATOM 2327 CG TYR A 155 42.631 -20.496 -14.201 1.00 63.13 C ATOM 2328 CD1 TYR A 155 43.529 -20.529 -13.141 1.00 61.51 C ATOM 2329 CD2 TYR A 155 43.117 -20.167 -15.461 1.00 12.45 C ATOM 2330 CE1 TYR A 155 44.867 -20.243 -13.329 1.00 62.04 C ATOM 2331 CE2 TYR A 155 44.453 -19.879 -15.658 1.00 25.11 C ATOM 2332 CZ TYR A 155 45.325 -19.918 -14.589 1.00 51.33 C ATOM 2333 OH TYR A 155 46.657 -19.633 -14.781 1.00 11.12 O ATOM 0 H TYR A 155 40.213 -20.924 -11.338 1.00 41.23 H new ATOM 0 HA TYR A 155 40.829 -18.803 -13.302 1.00 2.31 H new ATOM 0 HB2 TYR A 155 41.078 -21.804 -13.552 1.00 32.34 H new ATOM 0 HB3 TYR A 155 40.670 -20.843 -14.960 1.00 32.34 H new ATOM 0 HD1 TYR A 155 43.174 -20.783 -12.153 1.00 61.51 H new ATOM 0 HD2 TYR A 155 42.438 -20.136 -16.300 1.00 12.45 H new ATOM 0 HE1 TYR A 155 45.551 -20.274 -12.494 1.00 62.04 H new ATOM 0 HE2 TYR A 155 44.814 -19.625 -16.644 1.00 25.11 H new ATOM 0 HH TYR A 155 46.814 -19.425 -15.726 1.00 11.12 H new ATOM 2406 N TRP A 161 29.906 -22.024 -13.331 1.00 43.31 N ATOM 2407 CA TRP A 161 30.924 -22.807 -12.639 1.00 71.32 C ATOM 2408 C TRP A 161 32.322 -22.298 -12.971 1.00 64.14 C ATOM 2409 O TRP A 161 32.574 -21.830 -14.081 1.00 54.24 O ATOM 2410 CB TRP A 161 30.802 -24.285 -13.017 1.00 5.34 C ATOM 2411 CG TRP A 161 29.576 -24.942 -12.458 1.00 45.01 C ATOM 2412 CD1 TRP A 161 28.398 -25.167 -13.109 1.00 73.32 C ATOM 2413 CD2 TRP A 161 29.410 -25.457 -11.132 1.00 12.11 C ATOM 2414 NE1 TRP A 161 27.508 -25.792 -12.268 1.00 54.44 N ATOM 2415 CE2 TRP A 161 28.105 -25.981 -11.050 1.00 13.03 C ATOM 2416 CE3 TRP A 161 30.236 -25.528 -10.007 1.00 65.43 C ATOM 2417 CZ2 TRP A 161 27.609 -26.566 -9.888 1.00 3.41 C ATOM 2418 CZ3 TRP A 161 29.743 -26.108 -8.854 1.00 74.44 C ATOM 2419 CH2 TRP A 161 28.440 -26.621 -8.801 1.00 21.51 C ATOM 0 HA TRP A 161 30.765 -22.698 -11.566 1.00 71.32 H new ATOM 0 HB2 TRP A 161 30.790 -24.375 -14.103 1.00 5.34 H new ATOM 0 HB3 TRP A 161 31.685 -24.817 -12.662 1.00 5.34 H new ATOM 0 HD1 TRP A 161 28.195 -24.894 -14.134 1.00 73.32 H new ATOM 0 HE1 TRP A 161 26.557 -26.070 -12.512 1.00 54.44 H new ATOM 0 HE3 TRP A 161 31.242 -25.136 -10.038 1.00 65.43 H new ATOM 0 HZ2 TRP A 161 26.605 -26.962 -9.845 1.00 3.41 H new ATOM 0 HZ3 TRP A 161 30.373 -26.167 -7.979 1.00 74.44 H new ATOM 0 HH2 TRP A 161 28.084 -27.069 -7.885 1.00 21.51 H new ATOM 2430 N MET A 162 33.228 -22.394 -12.003 1.00 71.33 N ATOM 2431 CA MET A 162 34.602 -21.944 -12.195 1.00 73.13 C ATOM 2432 C MET A 162 35.588 -23.069 -11.900 1.00 11.13 C ATOM 2433 O MET A 162 35.225 -24.089 -11.313 1.00 23.15 O ATOM 2434 CB MET A 162 34.897 -20.741 -11.297 1.00 34.34 C ATOM 2435 CG MET A 162 33.798 -19.691 -11.307 1.00 62.42 C ATOM 2436 SD MET A 162 33.461 -19.054 -12.960 1.00 1.24 S ATOM 2437 CE MET A 162 32.014 -18.046 -12.646 1.00 22.23 C ATOM 0 H MET A 162 33.036 -22.779 -11.078 1.00 71.33 H new ATOM 0 HA MET A 162 34.719 -21.647 -13.237 1.00 73.13 H new ATOM 0 HB2 MET A 162 35.046 -21.089 -10.275 1.00 34.34 H new ATOM 0 HB3 MET A 162 35.832 -20.280 -11.617 1.00 34.34 H new ATOM 0 HG2 MET A 162 32.886 -20.122 -10.895 1.00 62.42 H new ATOM 0 HG3 MET A 162 34.084 -18.866 -10.655 1.00 62.42 H new ATOM 0 HE1 MET A 162 31.684 -17.583 -13.576 1.00 22.23 H new ATOM 0 HE2 MET A 162 31.214 -18.671 -12.249 1.00 22.23 H new ATOM 0 HE3 MET A 162 32.262 -17.270 -11.922 1.00 22.23 H new ATOM 2447 N LEU A 163 36.837 -22.878 -12.309 1.00 42.42 N ATOM 2448 CA LEU A 163 37.877 -23.877 -12.088 1.00 2.21 C ATOM 2449 C LEU A 163 38.780 -23.475 -10.926 1.00 1.22 C ATOM 2450 O LEU A 163 39.343 -22.381 -10.915 1.00 31.54 O ATOM 2451 CB LEU A 163 38.711 -24.062 -13.357 1.00 4.31 C ATOM 2452 CG LEU A 163 39.630 -25.284 -13.384 1.00 33.35 C ATOM 2453 CD1 LEU A 163 38.825 -26.551 -13.629 1.00 33.05 C ATOM 2454 CD2 LEU A 163 40.706 -25.120 -14.446 1.00 74.14 C ATOM 0 H LEU A 163 37.155 -22.040 -12.796 1.00 42.42 H new ATOM 0 HA LEU A 163 37.393 -24.821 -11.838 1.00 2.21 H new ATOM 0 HB2 LEU A 163 38.033 -24.124 -14.208 1.00 4.31 H new ATOM 0 HB3 LEU A 163 39.321 -23.170 -13.500 1.00 4.31 H new ATOM 0 HG LEU A 163 40.118 -25.369 -12.413 1.00 33.35 H new ATOM 0 HD11 LEU A 163 39.495 -27.410 -13.645 1.00 33.05 H new ATOM 0 HD12 LEU A 163 38.093 -26.677 -12.831 1.00 33.05 H new ATOM 0 HD13 LEU A 163 38.309 -26.475 -14.586 1.00 33.05 H new ATOM 0 HD21 LEU A 163 41.350 -25.999 -14.450 1.00 74.14 H new ATOM 0 HD22 LEU A 163 40.238 -25.008 -15.424 1.00 74.14 H new ATOM 0 HD23 LEU A 163 41.302 -24.234 -14.226 1.00 74.14 H new ATOM 2466 N ASN A 164 38.914 -24.369 -9.951 1.00 50.30 N ATOM 2467 CA ASN A 164 39.750 -24.108 -8.785 1.00 0.13 C ATOM 2468 C ASN A 164 40.678 -25.286 -8.507 1.00 43.24 C ATOM 2469 O ASN A 164 40.235 -26.431 -8.418 1.00 74.02 O ATOM 2470 CB ASN A 164 38.878 -23.830 -7.559 1.00 31.22 C ATOM 2471 CG ASN A 164 38.418 -22.387 -7.491 1.00 41.32 C ATOM 2472 OD1 ASN A 164 37.813 -21.872 -8.433 1.00 2.52 O ATOM 2473 ND2 ASN A 164 38.703 -21.726 -6.376 1.00 31.45 N ATOM 0 H ASN A 164 38.455 -25.280 -9.946 1.00 50.30 H new ATOM 0 HA ASN A 164 40.360 -23.230 -8.995 1.00 0.13 H new ATOM 0 HB2 ASN A 164 38.007 -24.485 -7.580 1.00 31.22 H new ATOM 0 HB3 ASN A 164 39.438 -24.073 -6.656 1.00 31.22 H new ATOM 0 HD21 ASN A 164 38.419 -20.752 -6.274 1.00 31.45 H new ATOM 0 HD22 ASN A 164 39.206 -22.192 -5.621 1.00 31.45 H new ATOM 2480 N SER A 165 41.968 -24.997 -8.370 1.00 12.34 N ATOM 2481 CA SER A 165 42.960 -26.033 -8.105 1.00 14.53 C ATOM 2482 C SER A 165 43.796 -25.682 -6.877 1.00 21.52 C ATOM 2483 O SER A 165 44.000 -24.509 -6.566 1.00 24.22 O ATOM 2484 CB SER A 165 43.871 -26.219 -9.320 1.00 11.14 C ATOM 2485 OG SER A 165 45.199 -26.513 -8.921 1.00 55.41 O ATOM 0 H SER A 165 42.351 -24.054 -8.438 1.00 12.34 H new ATOM 0 HA SER A 165 42.432 -26.966 -7.910 1.00 14.53 H new ATOM 0 HB2 SER A 165 43.489 -27.026 -9.945 1.00 11.14 H new ATOM 0 HB3 SER A 165 43.862 -25.314 -9.927 1.00 11.14 H new ATOM 0 HG SER A 165 45.761 -26.629 -9.715 1.00 55.41 H new ATOM 2491 N ASP A 166 44.275 -26.709 -6.184 1.00 61.55 N ATOM 2492 CA ASP A 166 45.091 -26.512 -4.991 1.00 54.21 C ATOM 2493 C ASP A 166 46.205 -27.551 -4.917 1.00 11.15 C ATOM 2494 O ASP A 166 46.070 -28.660 -5.434 1.00 2.24 O ATOM 2495 CB ASP A 166 44.220 -26.589 -3.735 1.00 44.33 C ATOM 2496 CG ASP A 166 44.751 -25.722 -2.610 1.00 21.23 C ATOM 2497 OD1 ASP A 166 45.958 -25.402 -2.626 1.00 14.42 O ATOM 2498 OD2 ASP A 166 43.959 -25.365 -1.712 1.00 41.54 O ATOM 0 H ASP A 166 44.113 -27.686 -6.427 1.00 61.55 H new ATOM 0 HA ASP A 166 45.545 -25.523 -5.050 1.00 54.21 H new ATOM 0 HB2 ASP A 166 43.204 -26.279 -3.981 1.00 44.33 H new ATOM 0 HB3 ASP A 166 44.164 -27.624 -3.397 1.00 44.33 H new ATOM 2503 N VAL A 167 47.307 -27.184 -4.270 1.00 52.31 N ATOM 2504 CA VAL A 167 48.446 -28.083 -4.128 1.00 12.52 C ATOM 2505 C VAL A 167 49.217 -27.794 -2.845 1.00 21.43 C ATOM 2506 O VAL A 167 49.315 -26.646 -2.412 1.00 35.00 O ATOM 2507 CB VAL A 167 49.405 -27.968 -5.327 1.00 73.10 C ATOM 2508 CG1 VAL A 167 48.709 -28.398 -6.610 1.00 41.10 C ATOM 2509 CG2 VAL A 167 49.937 -26.549 -5.450 1.00 1.14 C ATOM 0 H VAL A 167 47.435 -26.270 -3.836 1.00 52.31 H new ATOM 0 HA VAL A 167 48.046 -29.096 -4.088 1.00 12.52 H new ATOM 0 HB VAL A 167 50.251 -28.635 -5.159 1.00 73.10 H new ATOM 0 HG11 VAL A 167 49.402 -28.310 -7.447 1.00 41.10 H new ATOM 0 HG12 VAL A 167 48.382 -29.434 -6.517 1.00 41.10 H new ATOM 0 HG13 VAL A 167 47.844 -27.759 -6.787 1.00 41.10 H new ATOM 0 HG21 VAL A 167 50.613 -26.487 -6.303 1.00 1.14 H new ATOM 0 HG22 VAL A 167 49.105 -25.860 -5.595 1.00 1.14 H new ATOM 0 HG23 VAL A 167 50.475 -26.282 -4.540 1.00 1.14 H new ATOM 2519 N ARG A 168 49.765 -28.844 -2.241 1.00 51.13 N ATOM 2520 CA ARG A 168 50.529 -28.703 -1.007 1.00 34.22 C ATOM 2521 C ARG A 168 51.616 -29.769 -0.915 1.00 73.32 C ATOM 2522 O ARG A 168 51.445 -30.888 -1.404 1.00 5.51 O ATOM 2523 CB ARG A 168 49.600 -28.800 0.205 1.00 70.21 C ATOM 2524 CG ARG A 168 50.338 -28.879 1.532 1.00 72.34 C ATOM 2525 CD ARG A 168 49.434 -28.501 2.695 1.00 51.32 C ATOM 2526 NE ARG A 168 48.520 -29.582 3.052 1.00 53.01 N ATOM 2527 CZ ARG A 168 47.397 -29.398 3.738 1.00 25.31 C ATOM 2528 NH1 ARG A 168 47.052 -28.183 4.140 1.00 44.30 N ATOM 2529 NH2 ARG A 168 46.617 -30.433 4.025 1.00 51.11 N ATOM 0 H ARG A 168 49.694 -29.801 -2.586 1.00 51.13 H new ATOM 0 HA ARG A 168 51.006 -27.723 -1.014 1.00 34.22 H new ATOM 0 HB2 ARG A 168 48.940 -27.933 0.217 1.00 70.21 H new ATOM 0 HB3 ARG A 168 48.967 -29.681 0.098 1.00 70.21 H new ATOM 0 HG2 ARG A 168 50.718 -29.890 1.679 1.00 72.34 H new ATOM 0 HG3 ARG A 168 51.201 -28.214 1.510 1.00 72.34 H new ATOM 0 HD2 ARG A 168 50.045 -28.243 3.560 1.00 51.32 H new ATOM 0 HD3 ARG A 168 48.860 -27.612 2.434 1.00 51.32 H new ATOM 0 HE ARG A 168 48.756 -30.530 2.759 1.00 53.01 H new ATOM 0 HH11 ARG A 168 47.649 -27.385 3.923 1.00 44.30 H new ATOM 0 HH12 ARG A 168 46.189 -28.046 4.666 1.00 44.30 H new ATOM 0 HH21 ARG A 168 46.880 -31.370 3.719 1.00 51.11 H new ATOM 0 HH22 ARG A 168 45.755 -30.291 4.552 1.00 51.11 H new ATOM 2925 N PHE A 194 53.298 -35.825 -2.799 1.00 71.13 N ATOM 2926 CA PHE A 194 52.801 -34.475 -3.034 1.00 32.12 C ATOM 2927 C PHE A 194 51.275 -34.455 -3.071 1.00 63.11 C ATOM 2928 O PHE A 194 50.648 -35.325 -3.676 1.00 53.33 O ATOM 2929 CB PHE A 194 53.361 -33.923 -4.347 1.00 4.13 C ATOM 2930 CG PHE A 194 54.861 -33.836 -4.369 1.00 35.30 C ATOM 2931 CD1 PHE A 194 55.602 -34.646 -5.214 1.00 21.44 C ATOM 2932 CD2 PHE A 194 55.528 -32.945 -3.544 1.00 45.24 C ATOM 2933 CE1 PHE A 194 56.981 -34.569 -5.236 1.00 3.42 C ATOM 2934 CE2 PHE A 194 56.908 -32.863 -3.563 1.00 41.11 C ATOM 2935 CZ PHE A 194 57.635 -33.675 -4.410 1.00 52.13 C ATOM 0 HA PHE A 194 53.135 -33.844 -2.210 1.00 32.12 H new ATOM 0 HB2 PHE A 194 53.030 -34.557 -5.169 1.00 4.13 H new ATOM 0 HB3 PHE A 194 52.945 -32.931 -4.522 1.00 4.13 H new ATOM 0 HD1 PHE A 194 55.096 -35.345 -5.863 1.00 21.44 H new ATOM 0 HD2 PHE A 194 54.964 -32.308 -2.879 1.00 45.24 H new ATOM 0 HE1 PHE A 194 57.547 -35.207 -5.898 1.00 3.42 H new ATOM 0 HE2 PHE A 194 57.417 -32.164 -2.916 1.00 41.11 H new ATOM 0 HZ PHE A 194 58.713 -33.612 -4.427 1.00 52.13 H new ATOM 2945 N ILE A 195 50.686 -33.459 -2.418 1.00 73.03 N ATOM 2946 CA ILE A 195 49.236 -33.326 -2.376 1.00 74.25 C ATOM 2947 C ILE A 195 48.724 -32.513 -3.561 1.00 53.13 C ATOM 2948 O ILE A 195 48.992 -31.315 -3.668 1.00 0.13 O ATOM 2949 CB ILE A 195 48.768 -32.659 -1.070 1.00 43.33 C ATOM 2950 CG1 ILE A 195 49.239 -33.469 0.139 1.00 62.21 C ATOM 2951 CG2 ILE A 195 47.254 -32.514 -1.061 1.00 23.53 C ATOM 2952 CD1 ILE A 195 49.213 -32.691 1.436 1.00 25.01 C ATOM 0 H ILE A 195 51.191 -32.732 -1.911 1.00 73.03 H new ATOM 0 HA ILE A 195 48.826 -34.335 -2.425 1.00 74.25 H new ATOM 0 HB ILE A 195 49.208 -31.664 -1.010 1.00 43.33 H new ATOM 0 HG12 ILE A 195 48.609 -34.352 0.242 1.00 62.21 H new ATOM 0 HG13 ILE A 195 50.254 -33.821 -0.043 1.00 62.21 H new ATOM 0 HG21 ILE A 195 46.939 -32.041 -0.131 1.00 23.53 H new ATOM 0 HG22 ILE A 195 46.942 -31.898 -1.905 1.00 23.53 H new ATOM 0 HG23 ILE A 195 46.794 -33.499 -1.141 1.00 23.53 H new ATOM 0 HD11 ILE A 195 49.560 -33.328 2.250 1.00 25.01 H new ATOM 0 HD12 ILE A 195 49.866 -31.822 1.352 1.00 25.01 H new ATOM 0 HD13 ILE A 195 48.195 -32.361 1.642 1.00 25.01 H new ATOM 2964 N LEU A 196 47.984 -33.170 -4.448 1.00 5.44 N ATOM 2965 CA LEU A 196 47.432 -32.508 -5.624 1.00 52.54 C ATOM 2966 C LEU A 196 45.907 -32.504 -5.582 1.00 61.43 C ATOM 2967 O LEU A 196 45.273 -33.558 -5.650 1.00 51.44 O ATOM 2968 CB LEU A 196 47.918 -33.200 -6.898 1.00 53.23 C ATOM 2969 CG LEU A 196 49.294 -32.775 -7.411 1.00 2.52 C ATOM 2970 CD1 LEU A 196 49.284 -31.308 -7.811 1.00 42.44 C ATOM 2971 CD2 LEU A 196 50.359 -33.035 -6.356 1.00 44.03 C ATOM 0 H LEU A 196 47.753 -34.161 -4.375 1.00 5.44 H new ATOM 0 HA LEU A 196 47.779 -31.475 -5.625 1.00 52.54 H new ATOM 0 HB2 LEU A 196 47.936 -34.275 -6.719 1.00 53.23 H new ATOM 0 HB3 LEU A 196 47.187 -33.020 -7.686 1.00 53.23 H new ATOM 0 HG LEU A 196 49.532 -33.369 -8.293 1.00 2.52 H new ATOM 0 HD11 LEU A 196 50.272 -31.023 -8.174 1.00 42.44 H new ATOM 0 HD12 LEU A 196 48.548 -31.151 -8.600 1.00 42.44 H new ATOM 0 HD13 LEU A 196 49.025 -30.697 -6.946 1.00 42.44 H new ATOM 0 HD21 LEU A 196 51.332 -32.727 -6.738 1.00 44.03 H new ATOM 0 HD22 LEU A 196 50.126 -32.467 -5.456 1.00 44.03 H new ATOM 0 HD23 LEU A 196 50.383 -34.098 -6.118 1.00 44.03 H new ATOM 2983 N SER A 197 45.325 -31.314 -5.473 1.00 24.23 N ATOM 2984 CA SER A 197 43.874 -31.175 -5.420 1.00 45.32 C ATOM 2985 C SER A 197 43.370 -30.318 -6.577 1.00 70.14 C ATOM 2986 O SER A 197 44.044 -29.384 -7.014 1.00 74.32 O ATOM 2987 CB SER A 197 43.449 -30.556 -4.088 1.00 52.22 C ATOM 2988 OG SER A 197 44.257 -31.028 -3.024 1.00 64.32 O ATOM 0 H SER A 197 45.836 -30.433 -5.420 1.00 24.23 H new ATOM 0 HA SER A 197 43.433 -32.168 -5.507 1.00 45.32 H new ATOM 0 HB2 SER A 197 43.521 -29.470 -4.149 1.00 52.22 H new ATOM 0 HB3 SER A 197 42.404 -30.796 -3.889 1.00 52.22 H new ATOM 0 HG SER A 197 43.965 -30.616 -2.184 1.00 64.32 H new ATOM 2994 N LEU A 198 42.179 -30.642 -7.069 1.00 52.23 N ATOM 2995 CA LEU A 198 41.582 -29.903 -8.175 1.00 54.03 C ATOM 2996 C LEU A 198 40.064 -30.051 -8.173 1.00 15.44 C ATOM 2997 O LEU A 198 39.527 -31.048 -7.692 1.00 51.00 O ATOM 2998 CB LEU A 198 42.151 -30.392 -9.508 1.00 35.54 C ATOM 2999 CG LEU A 198 43.565 -29.922 -9.848 1.00 22.53 C ATOM 3000 CD1 LEU A 198 44.589 -30.966 -9.429 1.00 25.24 C ATOM 3001 CD2 LEU A 198 43.684 -29.622 -11.335 1.00 43.41 C ATOM 0 H LEU A 198 41.608 -31.412 -6.719 1.00 52.23 H new ATOM 0 HA LEU A 198 41.826 -28.848 -8.048 1.00 54.03 H new ATOM 0 HB2 LEU A 198 42.143 -31.482 -9.505 1.00 35.54 H new ATOM 0 HB3 LEU A 198 41.481 -30.070 -10.306 1.00 35.54 H new ATOM 0 HG LEU A 198 43.765 -29.004 -9.296 1.00 22.53 H new ATOM 0 HD11 LEU A 198 45.590 -30.614 -9.679 1.00 25.24 H new ATOM 0 HD12 LEU A 198 44.520 -31.132 -8.354 1.00 25.24 H new ATOM 0 HD13 LEU A 198 44.391 -31.901 -9.954 1.00 25.24 H new ATOM 0 HD21 LEU A 198 44.697 -29.289 -11.559 1.00 43.41 H new ATOM 0 HD22 LEU A 198 43.464 -30.523 -11.907 1.00 43.41 H new ATOM 0 HD23 LEU A 198 42.976 -28.839 -11.606 1.00 43.41 H new ATOM 3013 N GLY A 199 39.375 -29.050 -8.714 1.00 71.51 N ATOM 3014 CA GLY A 199 37.925 -29.089 -8.765 1.00 72.54 C ATOM 3015 C GLY A 199 37.330 -27.821 -9.345 1.00 44.30 C ATOM 3016 O GLY A 199 37.956 -27.155 -10.169 1.00 51.53 O ATOM 0 H GLY A 199 39.795 -28.213 -9.118 1.00 71.51 H new ATOM 0 HA2 GLY A 199 37.609 -29.942 -9.365 1.00 72.54 H new ATOM 0 HA3 GLY A 199 37.533 -29.243 -7.760 1.00 72.54 H new ATOM 3020 N ALA A 200 36.118 -27.487 -8.915 1.00 23.22 N ATOM 3021 CA ALA A 200 35.440 -26.290 -9.395 1.00 72.12 C ATOM 3022 C ALA A 200 34.908 -25.457 -8.234 1.00 42.40 C ATOM 3023 O ALA A 200 34.922 -25.897 -7.084 1.00 52.52 O ATOM 3024 CB ALA A 200 34.307 -26.669 -10.338 1.00 44.34 C ATOM 0 H ALA A 200 35.585 -28.029 -8.235 1.00 23.22 H new ATOM 0 HA ALA A 200 36.165 -25.685 -9.939 1.00 72.12 H new ATOM 0 HB1 ALA A 200 33.809 -25.766 -10.689 1.00 44.34 H new ATOM 0 HB2 ALA A 200 34.710 -27.216 -11.190 1.00 44.34 H new ATOM 0 HB3 ALA A 200 33.589 -27.297 -9.811 1.00 44.34 H new ATOM 3030 N SER A 201 34.440 -24.252 -8.543 1.00 10.13 N ATOM 3031 CA SER A 201 33.907 -23.355 -7.524 1.00 0.21 C ATOM 3032 C SER A 201 32.767 -22.511 -8.085 1.00 31.31 C ATOM 3033 O SER A 201 32.502 -22.526 -9.288 1.00 1.32 O ATOM 3034 CB SER A 201 35.014 -22.445 -6.987 1.00 13.33 C ATOM 3035 OG SER A 201 36.009 -23.195 -6.313 1.00 31.34 O ATOM 0 H SER A 201 34.419 -23.874 -9.490 1.00 10.13 H new ATOM 0 HA SER A 201 33.517 -23.963 -6.708 1.00 0.21 H new ATOM 0 HB2 SER A 201 35.466 -21.893 -7.811 1.00 13.33 H new ATOM 0 HB3 SER A 201 34.586 -21.709 -6.307 1.00 13.33 H new ATOM 0 HG SER A 201 35.803 -24.150 -6.384 1.00 31.34 H new ATOM 3041 N TYR A 202 32.095 -21.776 -7.206 1.00 64.01 N ATOM 3042 CA TYR A 202 30.982 -20.927 -7.612 1.00 14.21 C ATOM 3043 C TYR A 202 30.884 -19.693 -6.720 1.00 50.35 C ATOM 3044 O TYR A 202 31.102 -19.767 -5.511 1.00 32.01 O ATOM 3045 CB TYR A 202 29.669 -21.712 -7.560 1.00 51.51 C ATOM 3046 CG TYR A 202 28.453 -20.879 -7.895 1.00 35.42 C ATOM 3047 CD1 TYR A 202 27.323 -20.908 -7.087 1.00 30.10 C ATOM 3048 CD2 TYR A 202 28.433 -20.064 -9.020 1.00 12.34 C ATOM 3049 CE1 TYR A 202 26.208 -20.150 -7.390 1.00 23.22 C ATOM 3050 CE2 TYR A 202 27.323 -19.300 -9.330 1.00 31.54 C ATOM 3051 CZ TYR A 202 26.213 -19.348 -8.512 1.00 24.12 C ATOM 3052 OH TYR A 202 25.106 -18.590 -8.816 1.00 20.14 O ATOM 0 H TYR A 202 32.302 -21.751 -6.208 1.00 64.01 H new ATOM 0 HA TYR A 202 31.163 -20.600 -8.636 1.00 14.21 H new ATOM 0 HB2 TYR A 202 29.728 -22.549 -8.255 1.00 51.51 H new ATOM 0 HB3 TYR A 202 29.547 -22.134 -6.562 1.00 51.51 H new ATOM 0 HD1 TYR A 202 27.316 -21.534 -6.207 1.00 30.10 H new ATOM 0 HD2 TYR A 202 29.299 -20.027 -9.664 1.00 12.34 H new ATOM 0 HE1 TYR A 202 25.338 -20.185 -6.752 1.00 23.22 H new ATOM 0 HE2 TYR A 202 27.325 -18.670 -10.207 1.00 31.54 H new ATOM 0 HH TYR A 202 25.273 -18.081 -9.637 1.00 20.14 H new ATOM 3062 N VAL A 203 30.554 -18.557 -7.326 1.00 70.44 N ATOM 3063 CA VAL A 203 30.426 -17.306 -6.590 1.00 34.24 C ATOM 3064 C VAL A 203 28.975 -17.047 -6.195 1.00 22.45 C ATOM 3065 O VAL A 203 28.054 -17.302 -6.970 1.00 71.12 O ATOM 3066 CB VAL A 203 30.941 -16.113 -7.415 1.00 1.52 C ATOM 3067 CG1 VAL A 203 30.818 -14.820 -6.621 1.00 20.54 C ATOM 3068 CG2 VAL A 203 32.380 -16.347 -7.847 1.00 42.14 C ATOM 0 H VAL A 203 30.370 -18.478 -8.326 1.00 70.44 H new ATOM 0 HA VAL A 203 31.034 -17.405 -5.691 1.00 34.24 H new ATOM 0 HB VAL A 203 30.326 -16.021 -8.310 1.00 1.52 H new ATOM 0 HG11 VAL A 203 31.187 -13.988 -7.221 1.00 20.54 H new ATOM 0 HG12 VAL A 203 29.772 -14.648 -6.366 1.00 20.54 H new ATOM 0 HG13 VAL A 203 31.406 -14.897 -5.707 1.00 20.54 H new ATOM 0 HG21 VAL A 203 32.728 -15.494 -8.429 1.00 42.14 H new ATOM 0 HG22 VAL A 203 33.010 -16.466 -6.965 1.00 42.14 H new ATOM 0 HG23 VAL A 203 32.435 -17.249 -8.457 1.00 42.14 H new ATOM 3078 N PHE A 204 28.780 -16.540 -4.981 1.00 73.11 N ATOM 3079 CA PHE A 204 27.441 -16.247 -4.482 1.00 45.04 C ATOM 3080 C PHE A 204 27.426 -14.932 -3.708 1.00 50.02 C ATOM 3081 O PHE A 204 28.182 -14.751 -2.753 1.00 52.11 O ATOM 3082 CB PHE A 204 26.949 -17.385 -3.587 1.00 34.34 C ATOM 3083 CG PHE A 204 25.453 -17.535 -3.575 1.00 43.34 C ATOM 3084 CD1 PHE A 204 24.819 -18.349 -4.498 1.00 54.33 C ATOM 3085 CD2 PHE A 204 24.684 -16.861 -2.640 1.00 71.33 C ATOM 3086 CE1 PHE A 204 23.443 -18.487 -4.491 1.00 44.02 C ATOM 3087 CE2 PHE A 204 23.308 -16.996 -2.627 1.00 41.33 C ATOM 3088 CZ PHE A 204 22.688 -17.811 -3.554 1.00 12.44 C ATOM 0 H PHE A 204 29.531 -16.324 -4.326 1.00 73.11 H new ATOM 0 HA PHE A 204 26.772 -16.152 -5.338 1.00 45.04 H new ATOM 0 HB2 PHE A 204 27.397 -18.320 -3.923 1.00 34.34 H new ATOM 0 HB3 PHE A 204 27.297 -17.212 -2.569 1.00 34.34 H new ATOM 0 HD1 PHE A 204 25.405 -18.882 -5.232 1.00 54.33 H new ATOM 0 HD2 PHE A 204 25.165 -16.223 -1.913 1.00 71.33 H new ATOM 0 HE1 PHE A 204 22.960 -19.123 -5.218 1.00 44.02 H new ATOM 0 HE2 PHE A 204 22.719 -16.465 -1.894 1.00 41.33 H new ATOM 0 HZ PHE A 204 21.613 -17.919 -3.546 1.00 12.44 H new ATOM 3098 N LYS A 205 26.559 -14.017 -4.128 1.00 12.15 N ATOM 3099 CA LYS A 205 26.442 -12.718 -3.475 1.00 4.34 C ATOM 3100 C LYS A 205 24.998 -12.440 -3.071 1.00 52.15 C ATOM 3101 O LYS A 205 24.229 -11.858 -3.838 1.00 62.15 O ATOM 3102 CB LYS A 205 26.946 -11.610 -4.403 1.00 72.42 C ATOM 3103 CG LYS A 205 26.738 -10.212 -3.850 1.00 12.53 C ATOM 3104 CD LYS A 205 27.212 -9.149 -4.828 1.00 12.33 C ATOM 3105 CE LYS A 205 26.119 -8.778 -5.819 1.00 71.34 C ATOM 3106 NZ LYS A 205 26.142 -9.655 -7.022 1.00 75.42 N ATOM 0 H LYS A 205 25.927 -14.151 -4.917 1.00 12.15 H new ATOM 0 HA LYS A 205 27.055 -12.736 -2.574 1.00 4.34 H new ATOM 0 HB2 LYS A 205 28.009 -11.762 -4.593 1.00 72.42 H new ATOM 0 HB3 LYS A 205 26.436 -11.692 -5.363 1.00 72.42 H new ATOM 0 HG2 LYS A 205 25.681 -10.060 -3.630 1.00 12.53 H new ATOM 0 HG3 LYS A 205 27.278 -10.108 -2.909 1.00 12.53 H new ATOM 0 HD2 LYS A 205 27.524 -8.261 -4.279 1.00 12.33 H new ATOM 0 HD3 LYS A 205 28.086 -9.513 -5.368 1.00 12.33 H new ATOM 0 HE2 LYS A 205 25.146 -8.854 -5.333 1.00 71.34 H new ATOM 0 HE3 LYS A 205 26.243 -7.739 -6.124 1.00 71.34 H new ATOM 0 HZ1 LYS A 205 25.824 -9.115 -7.852 1.00 75.42 H new ATOM 0 HZ2 LYS A 205 27.110 -9.998 -7.183 1.00 75.42 H new ATOM 0 HZ3 LYS A 205 25.508 -10.466 -6.873 1.00 75.42 H new