USER MOD reduce.3.24.130724 H: found=0, std=0, add=637, rem=0, adj=20 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= -1.81 K(o=-4.7,f=-0.049) USER MOD Set 1.2: A 164 ASN : amide:sc= -2.22 K(o=-4.7,f=-0.74) USER MOD Set 1.3: A 197 SER OG : rot -156:sc= -0.714 USER MOD Single : A 13 ASN : amide:sc= -0.0215 X(o=-0.022,f=-0.14) USER MOD Single : A 14 GLN : amide:sc= -0.895 K(o=-0.89,f=-2.5!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -163:sc= 0.363 (180deg=0.244) USER MOD Single : A 53 THR OG1 : rot -24:sc= 0.181 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 54:sc= 1.25 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0.00331 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.696 K(o=-0.7,f=-1.6) USER MOD Single : A 104 SER OG : rot 43:sc= 1.16 USER MOD Single : A 106 GLN : amide:sc= -2.38 K(o=-2.4,f=-3.5!) 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 -139:sc= 0.881 USER MOD Single : A 150 GLN : amide:sc= -0.877 K(o=-0.88,f=-1.7) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 162 MET CE :methyl -120:sc= -0.289 (180deg=-0.591) USER MOD Single : A 165 SER OG : rot 130:sc= -0.247 USER MOD Single : A 201 SER OG : rot 30:sc= 0.178 USER MOD Single : A 202 TYR OH : rot 180:sc= 0 USER MOD Single : A 205 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0295) USER MOD ----------------------------------------------------------------- ATOM 177 N ASN A 13 31.331 -6.743 -3.194 1.00 52.30 N ATOM 178 CA ASN A 13 31.776 -6.067 -1.980 1.00 30.44 C ATOM 179 C ASN A 13 31.885 -7.052 -0.819 1.00 51.13 C ATOM 180 O ASN A 13 31.517 -8.219 -0.946 1.00 75.20 O ATOM 181 CB ASN A 13 30.809 -4.939 -1.616 1.00 44.24 C ATOM 182 CG ASN A 13 29.368 -5.409 -1.554 1.00 4.51 C ATOM 183 OD1 ASN A 13 28.981 -6.137 -0.641 1.00 62.54 O ATOM 184 ND2 ASN A 13 28.568 -4.991 -2.527 1.00 53.34 N ATOM 0 HA ASN A 13 32.763 -5.644 -2.170 1.00 30.44 H new ATOM 0 HB2 ASN A 13 31.093 -4.518 -0.651 1.00 44.24 H new ATOM 0 HB3 ASN A 13 30.896 -4.139 -2.351 1.00 44.24 H new ATOM 0 HD21 ASN A 13 27.588 -5.273 -2.538 1.00 53.34 H new ATOM 0 HD22 ASN A 13 28.933 -4.388 -3.264 1.00 53.34 H new ATOM 191 N GLN A 14 32.394 -6.572 0.310 1.00 3.51 N ATOM 192 CA GLN A 14 32.553 -7.409 1.494 1.00 32.50 C ATOM 193 C GLN A 14 31.247 -8.118 1.837 1.00 70.21 C ATOM 194 O GLN A 14 30.165 -7.551 1.694 1.00 14.33 O ATOM 195 CB GLN A 14 33.017 -6.567 2.683 1.00 63.24 C ATOM 196 CG GLN A 14 31.949 -5.627 3.216 1.00 2.45 C ATOM 197 CD GLN A 14 31.630 -4.499 2.255 1.00 43.23 C ATOM 198 OE1 GLN A 14 32.528 -3.906 1.655 1.00 63.04 O ATOM 199 NE2 GLN A 14 30.347 -4.196 2.101 1.00 2.21 N ATOM 0 H GLN A 14 32.704 -5.608 0.431 1.00 3.51 H new ATOM 0 HA GLN A 14 33.309 -8.163 1.276 1.00 32.50 H new ATOM 0 HB2 GLN A 14 33.337 -7.232 3.485 1.00 63.24 H new ATOM 0 HB3 GLN A 14 33.888 -5.983 2.386 1.00 63.24 H new ATOM 0 HG2 GLN A 14 31.040 -6.194 3.419 1.00 2.45 H new ATOM 0 HG3 GLN A 14 32.281 -5.207 4.165 1.00 2.45 H new ATOM 0 HE21 GLN A 14 29.635 -4.713 2.618 1.00 2.21 H new ATOM 0 HE22 GLN A 14 30.073 -3.446 1.466 1.00 2.21 H new ATOM 208 N GLY A 15 31.356 -9.363 2.291 1.00 51.03 N ATOM 209 CA GLY A 15 30.177 -10.129 2.647 1.00 72.42 C ATOM 210 C GLY A 15 29.811 -11.154 1.592 1.00 74.22 C ATOM 211 O GLY A 15 28.754 -11.781 1.667 1.00 73.35 O ATOM 0 H GLY A 15 32.241 -9.855 2.418 1.00 51.03 H new ATOM 0 HA2 GLY A 15 30.350 -10.635 3.597 1.00 72.42 H new ATOM 0 HA3 GLY A 15 29.338 -9.450 2.796 1.00 72.42 H new ATOM 215 N ASP A 16 30.684 -11.325 0.607 1.00 42.44 N ATOM 216 CA ASP A 16 30.447 -12.281 -0.469 1.00 40.44 C ATOM 217 C ASP A 16 30.639 -13.712 0.024 1.00 51.42 C ATOM 218 O ASP A 16 31.464 -13.972 0.900 1.00 11.52 O ATOM 219 CB ASP A 16 31.387 -12.002 -1.644 1.00 1.13 C ATOM 220 CG ASP A 16 30.669 -11.383 -2.825 1.00 74.15 C ATOM 221 OD1 ASP A 16 29.717 -10.607 -2.601 1.00 11.43 O ATOM 222 OD2 ASP A 16 31.057 -11.675 -3.977 1.00 11.05 O ATOM 0 H ASP A 16 31.563 -10.814 0.530 1.00 42.44 H new ATOM 0 HA ASP A 16 29.416 -12.166 -0.804 1.00 40.44 H new ATOM 0 HB2 ASP A 16 32.184 -11.335 -1.317 1.00 1.13 H new ATOM 0 HB3 ASP A 16 31.859 -12.933 -1.957 1.00 1.13 H new ATOM 227 N TRP A 17 29.871 -14.634 -0.545 1.00 22.43 N ATOM 228 CA TRP A 17 29.956 -16.039 -0.161 1.00 73.24 C ATOM 229 C TRP A 17 30.113 -16.930 -1.389 1.00 45.54 C ATOM 230 O TRP A 17 29.196 -17.055 -2.200 1.00 1.32 O ATOM 231 CB TRP A 17 28.711 -16.451 0.625 1.00 31.31 C ATOM 232 CG TRP A 17 28.590 -17.932 0.816 1.00 24.21 C ATOM 233 CD1 TRP A 17 29.611 -18.820 1.007 1.00 44.52 C ATOM 234 CD2 TRP A 17 27.382 -18.700 0.832 1.00 34.24 C ATOM 235 NE1 TRP A 17 29.110 -20.092 1.140 1.00 3.12 N ATOM 236 CE2 TRP A 17 27.745 -20.045 1.038 1.00 64.12 C ATOM 237 CE3 TRP A 17 26.028 -18.381 0.694 1.00 1.21 C ATOM 238 CZ2 TRP A 17 26.803 -21.067 1.108 1.00 63.42 C ATOM 239 CZ3 TRP A 17 25.095 -19.397 0.764 1.00 72.10 C ATOM 240 CH2 TRP A 17 25.484 -20.727 0.970 1.00 42.12 C ATOM 0 H TRP A 17 29.184 -14.435 -1.272 1.00 22.43 H new ATOM 0 HA TRP A 17 30.835 -16.164 0.472 1.00 73.24 H new ATOM 0 HB2 TRP A 17 28.730 -15.967 1.601 1.00 31.31 H new ATOM 0 HB3 TRP A 17 27.825 -16.086 0.105 1.00 31.31 H new ATOM 0 HD1 TRP A 17 30.658 -18.560 1.047 1.00 44.52 H new ATOM 0 HE1 TRP A 17 29.665 -20.935 1.290 1.00 3.12 H new ATOM 0 HE3 TRP A 17 25.717 -17.359 0.536 1.00 1.21 H new ATOM 0 HZ2 TRP A 17 27.102 -22.093 1.266 1.00 63.42 H new ATOM 0 HZ3 TRP A 17 24.046 -19.162 0.658 1.00 72.10 H new ATOM 0 HH2 TRP A 17 24.730 -21.498 1.021 1.00 42.12 H new ATOM 251 N VAL A 18 31.284 -17.547 -1.521 1.00 55.01 N ATOM 252 CA VAL A 18 31.561 -18.427 -2.649 1.00 52.55 C ATOM 253 C VAL A 18 31.843 -19.850 -2.181 1.00 54.23 C ATOM 254 O VAL A 18 32.640 -20.068 -1.270 1.00 21.44 O ATOM 255 CB VAL A 18 32.761 -17.922 -3.473 1.00 24.04 C ATOM 256 CG1 VAL A 18 33.960 -17.668 -2.570 1.00 13.32 C ATOM 257 CG2 VAL A 18 33.111 -18.918 -4.569 1.00 23.15 C ATOM 0 H VAL A 18 32.055 -17.453 -0.860 1.00 55.01 H new ATOM 0 HA VAL A 18 30.671 -18.425 -3.278 1.00 52.55 H new ATOM 0 HB VAL A 18 32.485 -16.979 -3.945 1.00 24.04 H new ATOM 0 HG11 VAL A 18 34.798 -17.312 -3.169 1.00 13.32 H new ATOM 0 HG12 VAL A 18 33.701 -16.916 -1.825 1.00 13.32 H new ATOM 0 HG13 VAL A 18 34.240 -18.594 -2.068 1.00 13.32 H new ATOM 0 HG21 VAL A 18 33.961 -18.546 -5.141 1.00 23.15 H new ATOM 0 HG22 VAL A 18 33.368 -19.877 -4.120 1.00 23.15 H new ATOM 0 HG23 VAL A 18 32.255 -19.045 -5.232 1.00 23.15 H new ATOM 267 N ALA A 19 31.181 -20.816 -2.811 1.00 50.20 N ATOM 268 CA ALA A 19 31.362 -22.219 -2.461 1.00 62.11 C ATOM 269 C ALA A 19 32.418 -22.874 -3.344 1.00 62.30 C ATOM 270 O ALA A 19 32.275 -22.925 -4.565 1.00 73.22 O ATOM 271 CB ALA A 19 30.040 -22.965 -2.572 1.00 45.41 C ATOM 0 H ALA A 19 30.515 -20.652 -3.566 1.00 50.20 H new ATOM 0 HA ALA A 19 31.709 -22.269 -1.429 1.00 62.11 H new ATOM 0 HB1 ALA A 19 30.190 -24.012 -2.308 1.00 45.41 H new ATOM 0 HB2 ALA A 19 29.313 -22.520 -1.893 1.00 45.41 H new ATOM 0 HB3 ALA A 19 29.669 -22.898 -3.595 1.00 45.41 H new ATOM 277 N SER A 20 33.479 -23.374 -2.719 1.00 3.02 N ATOM 278 CA SER A 20 34.561 -24.022 -3.449 1.00 62.33 C ATOM 279 C SER A 20 34.604 -25.517 -3.145 1.00 21.12 C ATOM 280 O SER A 20 34.867 -25.924 -2.013 1.00 22.20 O ATOM 281 CB SER A 20 35.903 -23.380 -3.093 1.00 11.43 C ATOM 282 OG SER A 20 36.970 -24.006 -3.784 1.00 72.50 O ATOM 0 H SER A 20 33.612 -23.343 -1.708 1.00 3.02 H new ATOM 0 HA SER A 20 34.375 -23.890 -4.515 1.00 62.33 H new ATOM 0 HB2 SER A 20 35.879 -22.319 -3.341 1.00 11.43 H new ATOM 0 HB3 SER A 20 36.070 -23.452 -2.018 1.00 11.43 H new ATOM 0 HG SER A 20 37.816 -23.575 -3.539 1.00 72.50 H new ATOM 288 N PHE A 21 34.343 -26.330 -4.164 1.00 43.43 N ATOM 289 CA PHE A 21 34.349 -27.779 -4.007 1.00 5.11 C ATOM 290 C PHE A 21 35.390 -28.420 -4.920 1.00 63.44 C ATOM 291 O PHE A 21 35.426 -28.153 -6.120 1.00 24.51 O ATOM 292 CB PHE A 21 32.965 -28.353 -4.311 1.00 54.52 C ATOM 293 CG PHE A 21 32.543 -28.176 -5.741 1.00 43.54 C ATOM 294 CD1 PHE A 21 32.081 -26.950 -6.195 1.00 61.33 C ATOM 295 CD2 PHE A 21 32.609 -29.234 -6.633 1.00 61.22 C ATOM 296 CE1 PHE A 21 31.694 -26.785 -7.511 1.00 15.33 C ATOM 297 CE2 PHE A 21 32.223 -29.073 -7.951 1.00 32.45 C ATOM 298 CZ PHE A 21 31.764 -27.848 -8.390 1.00 14.31 C ATOM 0 H PHE A 21 34.125 -26.009 -5.107 1.00 43.43 H new ATOM 0 HA PHE A 21 34.609 -28.006 -2.973 1.00 5.11 H new ATOM 0 HB2 PHE A 21 32.960 -29.416 -4.068 1.00 54.52 H new ATOM 0 HB3 PHE A 21 32.232 -27.874 -3.662 1.00 54.52 H new ATOM 0 HD1 PHE A 21 32.023 -26.115 -5.512 1.00 61.33 H new ATOM 0 HD2 PHE A 21 32.966 -30.196 -6.295 1.00 61.22 H new ATOM 0 HE1 PHE A 21 31.337 -25.825 -7.852 1.00 15.33 H new ATOM 0 HE2 PHE A 21 32.281 -29.906 -8.636 1.00 32.45 H new ATOM 0 HZ PHE A 21 31.460 -27.721 -9.419 1.00 14.31 H new ATOM 308 N ASN A 22 36.235 -29.268 -4.341 1.00 41.33 N ATOM 309 CA ASN A 22 37.278 -29.947 -5.103 1.00 12.35 C ATOM 310 C ASN A 22 37.719 -31.226 -4.398 1.00 74.03 C ATOM 311 O ASN A 22 37.401 -31.446 -3.230 1.00 3.13 O ATOM 312 CB ASN A 22 38.479 -29.020 -5.300 1.00 54.12 C ATOM 313 CG ASN A 22 38.987 -28.445 -3.993 1.00 62.42 C ATOM 314 OD1 ASN A 22 38.799 -27.262 -3.707 1.00 63.30 O ATOM 315 ND2 ASN A 22 39.637 -29.282 -3.192 1.00 5.54 N ATOM 0 H ASN A 22 36.218 -29.501 -3.348 1.00 41.33 H new ATOM 0 HA ASN A 22 36.869 -30.212 -6.078 1.00 12.35 H new ATOM 0 HB2 ASN A 22 39.283 -29.571 -5.788 1.00 54.12 H new ATOM 0 HB3 ASN A 22 38.200 -28.205 -5.968 1.00 54.12 H new ATOM 0 HD21 ASN A 22 40.004 -28.952 -2.299 1.00 5.54 H new ATOM 0 HD22 ASN A 22 39.769 -30.254 -3.470 1.00 5.54 H new ATOM 322 N PHE A 23 38.455 -32.068 -5.118 1.00 15.53 N ATOM 323 CA PHE A 23 38.940 -33.325 -4.563 1.00 73.41 C ATOM 324 C PHE A 23 40.463 -33.333 -4.482 1.00 52.13 C ATOM 325 O PHE A 23 41.144 -32.807 -5.362 1.00 43.42 O ATOM 326 CB PHE A 23 38.457 -34.503 -5.414 1.00 4.32 C ATOM 327 CG PHE A 23 38.847 -34.396 -6.860 1.00 61.25 C ATOM 328 CD1 PHE A 23 38.005 -33.785 -7.775 1.00 64.23 C ATOM 329 CD2 PHE A 23 40.056 -34.907 -7.305 1.00 34.50 C ATOM 330 CE1 PHE A 23 38.361 -33.684 -9.108 1.00 21.43 C ATOM 331 CE2 PHE A 23 40.417 -34.810 -8.635 1.00 42.24 C ATOM 332 CZ PHE A 23 39.568 -34.198 -9.538 1.00 23.41 C ATOM 0 H PHE A 23 38.728 -31.901 -6.087 1.00 15.53 H new ATOM 0 HA PHE A 23 38.540 -33.426 -3.554 1.00 73.41 H new ATOM 0 HB2 PHE A 23 38.863 -35.428 -5.004 1.00 4.32 H new ATOM 0 HB3 PHE A 23 37.372 -34.572 -5.343 1.00 4.32 H new ATOM 0 HD1 PHE A 23 37.059 -33.383 -7.444 1.00 64.23 H new ATOM 0 HD2 PHE A 23 40.723 -35.386 -6.604 1.00 34.50 H new ATOM 0 HE1 PHE A 23 37.696 -33.204 -9.811 1.00 21.43 H new ATOM 0 HE2 PHE A 23 41.362 -35.212 -8.969 1.00 42.24 H new ATOM 0 HZ PHE A 23 39.848 -34.122 -10.578 1.00 23.41 H new ATOM 342 N SER A 24 40.991 -33.933 -3.419 1.00 53.45 N ATOM 343 CA SER A 24 42.433 -34.004 -3.220 1.00 23.04 C ATOM 344 C SER A 24 43.006 -35.272 -3.847 1.00 31.22 C ATOM 345 O SER A 24 42.331 -36.298 -3.929 1.00 33.45 O ATOM 346 CB SER A 24 42.765 -33.965 -1.727 1.00 61.05 C ATOM 347 OG SER A 24 44.006 -34.599 -1.465 1.00 13.15 O ATOM 0 H SER A 24 40.441 -34.376 -2.683 1.00 53.45 H new ATOM 0 HA SER A 24 42.886 -33.141 -3.709 1.00 23.04 H new ATOM 0 HB2 SER A 24 42.802 -32.930 -1.386 1.00 61.05 H new ATOM 0 HB3 SER A 24 41.974 -34.458 -1.162 1.00 61.05 H new ATOM 0 HG SER A 24 44.197 -34.560 -0.505 1.00 13.15 H new ATOM 353 N LYS A 25 44.256 -35.193 -4.290 1.00 31.31 N ATOM 354 CA LYS A 25 44.922 -36.332 -4.909 1.00 71.14 C ATOM 355 C LYS A 25 46.386 -36.401 -4.489 1.00 43.40 C ATOM 356 O LYS A 25 47.145 -35.451 -4.688 1.00 11.20 O ATOM 357 CB LYS A 25 44.822 -36.241 -6.434 1.00 11.13 C ATOM 358 CG LYS A 25 45.489 -37.398 -7.157 1.00 72.42 C ATOM 359 CD LYS A 25 46.941 -37.090 -7.483 1.00 54.01 C ATOM 360 CE LYS A 25 47.456 -37.966 -8.614 1.00 23.45 C ATOM 361 NZ LYS A 25 47.492 -39.404 -8.228 1.00 64.35 N ATOM 0 H LYS A 25 44.829 -34.351 -4.232 1.00 31.31 H new ATOM 0 HA LYS A 25 44.422 -37.240 -4.571 1.00 71.14 H new ATOM 0 HB2 LYS A 25 43.771 -36.203 -6.719 1.00 11.13 H new ATOM 0 HB3 LYS A 25 45.276 -35.307 -6.764 1.00 11.13 H new ATOM 0 HG2 LYS A 25 45.436 -38.294 -6.538 1.00 72.42 H new ATOM 0 HG3 LYS A 25 44.947 -37.614 -8.077 1.00 72.42 H new ATOM 0 HD2 LYS A 25 47.038 -36.041 -7.761 1.00 54.01 H new ATOM 0 HD3 LYS A 25 47.555 -37.242 -6.595 1.00 54.01 H new ATOM 0 HE2 LYS A 25 46.819 -37.841 -9.490 1.00 23.45 H new ATOM 0 HE3 LYS A 25 48.457 -37.641 -8.899 1.00 23.45 H new ATOM 0 HZ1 LYS A 25 48.101 -39.926 -8.890 1.00 64.35 H new ATOM 0 HZ2 LYS A 25 47.870 -39.495 -7.264 1.00 64.35 H new ATOM 0 HZ3 LYS A 25 46.529 -39.796 -8.261 1.00 64.35 H new ATOM 375 N VAL A 26 46.779 -37.529 -3.907 1.00 60.10 N ATOM 376 CA VAL A 26 48.154 -37.723 -3.462 1.00 50.31 C ATOM 377 C VAL A 26 49.054 -38.139 -4.620 1.00 34.23 C ATOM 378 O VAL A 26 48.686 -38.989 -5.430 1.00 70.32 O ATOM 379 CB VAL A 26 48.239 -38.786 -2.350 1.00 40.44 C ATOM 380 CG1 VAL A 26 47.781 -40.140 -2.871 1.00 14.54 C ATOM 381 CG2 VAL A 26 49.655 -38.868 -1.801 1.00 23.54 C ATOM 0 H VAL A 26 46.164 -38.324 -3.732 1.00 60.10 H new ATOM 0 HA VAL A 26 48.497 -36.767 -3.067 1.00 50.31 H new ATOM 0 HB VAL A 26 47.575 -38.492 -1.537 1.00 40.44 H new ATOM 0 HG11 VAL A 26 47.848 -40.879 -2.072 1.00 14.54 H new ATOM 0 HG12 VAL A 26 46.749 -40.068 -3.213 1.00 14.54 H new ATOM 0 HG13 VAL A 26 48.418 -40.445 -3.701 1.00 14.54 H new ATOM 0 HG21 VAL A 26 49.698 -39.623 -1.016 1.00 23.54 H new ATOM 0 HG22 VAL A 26 50.341 -39.139 -2.603 1.00 23.54 H new ATOM 0 HG23 VAL A 26 49.942 -37.901 -1.389 1.00 23.54 H new ATOM 731 N THR A 53 41.361 -40.183 -5.597 1.00 23.35 N ATOM 732 CA THR A 53 40.874 -38.836 -5.328 1.00 73.32 C ATOM 733 C THR A 53 39.844 -38.837 -4.204 1.00 64.12 C ATOM 734 O THR A 53 39.040 -39.762 -4.085 1.00 24.11 O ATOM 735 CB THR A 53 40.245 -38.206 -6.585 1.00 14.12 C ATOM 736 OG1 THR A 53 39.318 -39.121 -7.180 1.00 60.21 O ATOM 737 CG2 THR A 53 41.316 -37.832 -7.598 1.00 24.31 C ATOM 0 HA THR A 53 41.737 -38.242 -5.025 1.00 73.32 H new ATOM 0 HB THR A 53 39.719 -37.300 -6.285 1.00 14.12 H new ATOM 0 HG1 THR A 53 39.555 -40.038 -6.928 1.00 60.21 H new ATOM 0 HG21 THR A 53 40.847 -37.389 -8.477 1.00 24.31 H new ATOM 0 HG22 THR A 53 42.003 -37.113 -7.152 1.00 24.31 H new ATOM 0 HG23 THR A 53 41.866 -38.726 -7.892 1.00 24.31 H new ATOM 745 N THR A 54 39.874 -37.794 -3.381 1.00 1.14 N ATOM 746 CA THR A 54 38.943 -37.674 -2.265 1.00 74.35 C ATOM 747 C THR A 54 38.172 -36.361 -2.331 1.00 23.04 C ATOM 748 O THR A 54 38.757 -35.281 -2.230 1.00 35.13 O ATOM 749 CB THR A 54 39.674 -37.761 -0.912 1.00 52.33 C ATOM 750 OG1 THR A 54 40.682 -38.775 -0.965 1.00 24.43 O ATOM 751 CG2 THR A 54 38.696 -38.068 0.212 1.00 1.45 C ATOM 0 H THR A 54 40.533 -37.020 -3.466 1.00 1.14 H new ATOM 0 HA THR A 54 38.244 -38.506 -2.345 1.00 74.35 H new ATOM 0 HB THR A 54 40.140 -36.796 -0.713 1.00 52.33 H new ATOM 0 HG1 THR A 54 41.143 -38.823 -0.102 1.00 24.43 H new ATOM 0 HG21 THR A 54 39.235 -38.125 1.158 1.00 1.45 H new ATOM 0 HG22 THR A 54 37.947 -37.278 0.268 1.00 1.45 H new ATOM 0 HG23 THR A 54 38.205 -39.021 0.017 1.00 1.45 H new ATOM 759 N LEU A 55 36.858 -36.459 -2.498 1.00 72.33 N ATOM 760 CA LEU A 55 36.006 -35.278 -2.576 1.00 53.42 C ATOM 761 C LEU A 55 36.105 -34.450 -1.299 1.00 20.52 C ATOM 762 O LEU A 55 36.115 -34.993 -0.193 1.00 2.41 O ATOM 763 CB LEU A 55 34.553 -35.688 -2.821 1.00 34.12 C ATOM 764 CG LEU A 55 34.134 -35.834 -4.284 1.00 33.21 C ATOM 765 CD1 LEU A 55 34.601 -37.169 -4.842 1.00 33.45 C ATOM 766 CD2 LEU A 55 32.625 -35.694 -4.423 1.00 40.13 C ATOM 0 H LEU A 55 36.359 -37.345 -2.582 1.00 72.33 H new ATOM 0 HA LEU A 55 36.350 -34.667 -3.411 1.00 53.42 H new ATOM 0 HB2 LEU A 55 34.375 -36.638 -2.316 1.00 34.12 H new ATOM 0 HB3 LEU A 55 33.904 -34.950 -2.350 1.00 34.12 H new ATOM 0 HG LEU A 55 34.607 -35.038 -4.859 1.00 33.21 H new ATOM 0 HD11 LEU A 55 34.294 -37.255 -5.884 1.00 33.45 H new ATOM 0 HD12 LEU A 55 35.687 -37.230 -4.778 1.00 33.45 H new ATOM 0 HD13 LEU A 55 34.157 -37.980 -4.265 1.00 33.45 H new ATOM 0 HD21 LEU A 55 32.345 -35.801 -5.471 1.00 40.13 H new ATOM 0 HD22 LEU A 55 32.132 -36.468 -3.835 1.00 40.13 H new ATOM 0 HD23 LEU A 55 32.316 -34.713 -4.063 1.00 40.13 H new ATOM 778 N THR A 56 36.175 -33.132 -1.458 1.00 23.14 N ATOM 779 CA THR A 56 36.273 -32.229 -0.317 1.00 52.03 C ATOM 780 C THR A 56 35.545 -30.917 -0.592 1.00 31.43 C ATOM 781 O THR A 56 35.587 -30.394 -1.705 1.00 34.20 O ATOM 782 CB THR A 56 37.741 -31.924 0.035 1.00 61.13 C ATOM 783 OG1 THR A 56 38.593 -32.287 -1.058 1.00 33.21 O ATOM 784 CG2 THR A 56 38.164 -32.679 1.286 1.00 2.34 C ATOM 0 H THR A 56 36.166 -32.666 -2.365 1.00 23.14 H new ATOM 0 HA THR A 56 35.803 -32.734 0.527 1.00 52.03 H new ATOM 0 HB THR A 56 37.832 -30.855 0.226 1.00 61.13 H new ATOM 0 HG1 THR A 56 38.282 -31.846 -1.876 1.00 33.21 H new ATOM 0 HG21 THR A 56 39.204 -32.448 1.516 1.00 2.34 H new ATOM 0 HG22 THR A 56 37.533 -32.380 2.123 1.00 2.34 H new ATOM 0 HG23 THR A 56 38.059 -33.751 1.117 1.00 2.34 H new ATOM 792 N PHE A 57 34.880 -30.390 0.430 1.00 72.21 N ATOM 793 CA PHE A 57 34.142 -29.140 0.299 1.00 3.33 C ATOM 794 C PHE A 57 34.815 -28.026 1.096 1.00 12.23 C ATOM 795 O PHE A 57 35.394 -28.269 2.156 1.00 53.04 O ATOM 796 CB PHE A 57 32.698 -29.321 0.772 1.00 23.35 C ATOM 797 CG PHE A 57 31.947 -30.377 0.012 1.00 13.41 C ATOM 798 CD1 PHE A 57 31.948 -30.384 -1.373 1.00 63.22 C ATOM 799 CD2 PHE A 57 31.239 -31.361 0.684 1.00 43.14 C ATOM 800 CE1 PHE A 57 31.258 -31.354 -2.075 1.00 32.54 C ATOM 801 CE2 PHE A 57 30.546 -32.333 -0.013 1.00 42.21 C ATOM 802 CZ PHE A 57 30.557 -32.331 -1.394 1.00 13.43 C ATOM 0 H PHE A 57 34.837 -30.810 1.359 1.00 72.21 H new ATOM 0 HA PHE A 57 34.138 -28.859 -0.754 1.00 3.33 H new ATOM 0 HB2 PHE A 57 32.700 -29.579 1.831 1.00 23.35 H new ATOM 0 HB3 PHE A 57 32.171 -28.372 0.677 1.00 23.35 H new ATOM 0 HD1 PHE A 57 32.494 -29.623 -1.910 1.00 63.22 H new ATOM 0 HD2 PHE A 57 31.229 -31.368 1.764 1.00 43.14 H new ATOM 0 HE1 PHE A 57 31.267 -31.349 -3.155 1.00 32.54 H new ATOM 0 HE2 PHE A 57 29.996 -33.093 0.522 1.00 42.21 H new ATOM 0 HZ PHE A 57 30.019 -33.091 -1.941 1.00 13.43 H new ATOM 812 N ASP A 58 34.732 -26.804 0.580 1.00 5.15 N ATOM 813 CA ASP A 58 35.332 -25.652 1.244 1.00 24.12 C ATOM 814 C ASP A 58 34.523 -24.388 0.973 1.00 25.14 C ATOM 815 O ASP A 58 34.164 -24.102 -0.169 1.00 51.03 O ATOM 816 CB ASP A 58 36.775 -25.460 0.774 1.00 50.24 C ATOM 817 CG ASP A 58 37.319 -24.089 1.124 1.00 45.40 C ATOM 818 OD1 ASP A 58 37.949 -23.957 2.194 1.00 70.11 O ATOM 819 OD2 ASP A 58 37.116 -23.148 0.328 1.00 53.14 O ATOM 0 H ASP A 58 34.256 -26.586 -0.295 1.00 5.15 H new ATOM 0 HA ASP A 58 35.330 -25.840 2.318 1.00 24.12 H new ATOM 0 HB2 ASP A 58 37.406 -26.225 1.226 1.00 50.24 H new ATOM 0 HB3 ASP A 58 36.825 -25.603 -0.305 1.00 50.24 H new ATOM 824 N ILE A 59 34.238 -23.636 2.031 1.00 4.14 N ATOM 825 CA ILE A 59 33.472 -22.403 1.907 1.00 1.42 C ATOM 826 C ILE A 59 34.378 -21.180 2.004 1.00 40.32 C ATOM 827 O ILE A 59 35.140 -21.034 2.959 1.00 44.43 O ATOM 828 CB ILE A 59 32.382 -22.306 2.991 1.00 22.01 C ATOM 829 CG1 ILE A 59 31.415 -23.486 2.879 1.00 23.41 C ATOM 830 CG2 ILE A 59 31.632 -20.988 2.873 1.00 51.42 C ATOM 831 CD1 ILE A 59 30.709 -23.564 1.544 1.00 35.41 C ATOM 0 H ILE A 59 34.526 -23.860 2.984 1.00 4.14 H new ATOM 0 HA ILE A 59 32.998 -22.424 0.926 1.00 1.42 H new ATOM 0 HB ILE A 59 32.860 -22.343 3.970 1.00 22.01 H new ATOM 0 HG12 ILE A 59 31.965 -24.413 3.045 1.00 23.41 H new ATOM 0 HG13 ILE A 59 30.670 -23.411 3.671 1.00 23.41 H new ATOM 0 HG21 ILE A 59 30.865 -20.935 3.646 1.00 51.42 H new ATOM 0 HG22 ILE A 59 32.330 -20.160 2.997 1.00 51.42 H new ATOM 0 HG23 ILE A 59 31.163 -20.923 1.891 1.00 51.42 H new ATOM 0 HD11 ILE A 59 30.040 -24.424 1.536 1.00 35.41 H new ATOM 0 HD12 ILE A 59 30.132 -22.653 1.384 1.00 35.41 H new ATOM 0 HD13 ILE A 59 31.446 -23.671 0.748 1.00 35.41 H new ATOM 843 N ALA A 60 34.288 -20.303 1.009 1.00 2.14 N ATOM 844 CA ALA A 60 35.097 -19.090 0.983 1.00 24.35 C ATOM 845 C ALA A 60 34.239 -17.853 1.222 1.00 30.43 C ATOM 846 O ALA A 60 33.185 -17.689 0.607 1.00 50.42 O ATOM 847 CB ALA A 60 35.834 -18.977 -0.342 1.00 44.42 C ATOM 0 H ALA A 60 33.663 -20.410 0.210 1.00 2.14 H new ATOM 0 HA ALA A 60 35.829 -19.152 1.789 1.00 24.35 H new ATOM 0 HB1 ALA A 60 36.434 -18.067 -0.348 1.00 44.42 H new ATOM 0 HB2 ALA A 60 36.485 -19.842 -0.471 1.00 44.42 H new ATOM 0 HB3 ALA A 60 35.112 -18.941 -1.158 1.00 44.42 H new ATOM 853 N TYR A 61 34.695 -16.987 2.120 1.00 40.32 N ATOM 854 CA TYR A 61 33.967 -15.765 2.442 1.00 51.34 C ATOM 855 C TYR A 61 34.794 -14.530 2.094 1.00 32.22 C ATOM 856 O TYR A 61 35.852 -14.293 2.676 1.00 22.12 O ATOM 857 CB TYR A 61 33.597 -15.743 3.926 1.00 72.22 C ATOM 858 CG TYR A 61 32.155 -15.370 4.184 1.00 33.42 C ATOM 859 CD1 TYR A 61 31.657 -14.133 3.796 1.00 11.24 C ATOM 860 CD2 TYR A 61 31.290 -16.255 4.818 1.00 2.41 C ATOM 861 CE1 TYR A 61 30.340 -13.787 4.031 1.00 50.11 C ATOM 862 CE2 TYR A 61 29.972 -15.918 5.056 1.00 14.41 C ATOM 863 CZ TYR A 61 29.501 -14.683 4.660 1.00 5.43 C ATOM 864 OH TYR A 61 28.189 -14.343 4.897 1.00 65.30 O ATOM 0 H TYR A 61 35.565 -17.108 2.638 1.00 40.32 H new ATOM 0 HA TYR A 61 33.054 -15.748 1.846 1.00 51.34 H new ATOM 0 HB2 TYR A 61 33.792 -16.726 4.355 1.00 72.22 H new ATOM 0 HB3 TYR A 61 34.245 -15.035 4.443 1.00 72.22 H new ATOM 0 HD1 TYR A 61 32.310 -13.429 3.302 1.00 11.24 H new ATOM 0 HD2 TYR A 61 31.655 -17.222 5.130 1.00 2.41 H new ATOM 0 HE1 TYR A 61 29.970 -12.820 3.724 1.00 50.11 H new ATOM 0 HE2 TYR A 61 29.313 -16.617 5.549 1.00 14.41 H new ATOM 0 HH TYR A 61 27.735 -15.086 5.347 1.00 65.30 H new ATOM 874 N PHE A 62 34.302 -13.747 1.140 1.00 75.11 N ATOM 875 CA PHE A 62 34.993 -12.536 0.713 1.00 21.50 C ATOM 876 C PHE A 62 34.492 -11.321 1.489 1.00 21.50 C ATOM 877 O PHE A 62 33.424 -10.784 1.201 1.00 74.41 O ATOM 878 CB PHE A 62 34.796 -12.313 -0.788 1.00 3.44 C ATOM 879 CG PHE A 62 35.821 -13.010 -1.637 1.00 12.44 C ATOM 880 CD1 PHE A 62 36.173 -14.325 -1.381 1.00 42.54 C ATOM 881 CD2 PHE A 62 36.432 -12.348 -2.690 1.00 52.13 C ATOM 882 CE1 PHE A 62 37.116 -14.968 -2.162 1.00 31.43 C ATOM 883 CE2 PHE A 62 37.375 -12.986 -3.474 1.00 30.04 C ATOM 884 CZ PHE A 62 37.718 -14.298 -3.208 1.00 40.33 C ATOM 0 H PHE A 62 33.427 -13.929 0.648 1.00 75.11 H new ATOM 0 HA PHE A 62 36.056 -12.663 0.918 1.00 21.50 H new ATOM 0 HB2 PHE A 62 33.803 -12.662 -1.072 1.00 3.44 H new ATOM 0 HB3 PHE A 62 34.830 -11.244 -0.996 1.00 3.44 H new ATOM 0 HD1 PHE A 62 35.706 -14.854 -0.563 1.00 42.54 H new ATOM 0 HD2 PHE A 62 36.168 -11.322 -2.901 1.00 52.13 H new ATOM 0 HE1 PHE A 62 37.381 -15.994 -1.954 1.00 31.43 H new ATOM 0 HE2 PHE A 62 37.843 -12.460 -4.293 1.00 30.04 H new ATOM 0 HZ PHE A 62 38.456 -14.798 -3.818 1.00 40.33 H new ATOM 894 N VAL A 63 35.274 -10.894 2.477 1.00 60.23 N ATOM 895 CA VAL A 63 34.912 -9.743 3.295 1.00 53.11 C ATOM 896 C VAL A 63 36.116 -8.840 3.536 1.00 12.13 C ATOM 897 O VAL A 63 36.383 -8.436 4.668 1.00 44.14 O ATOM 898 CB VAL A 63 34.330 -10.180 4.652 1.00 13.33 C ATOM 899 CG1 VAL A 63 33.638 -9.012 5.338 1.00 75.25 C ATOM 900 CG2 VAL A 63 33.371 -11.347 4.470 1.00 71.42 C ATOM 0 H VAL A 63 36.162 -11.328 2.729 1.00 60.23 H new ATOM 0 HA VAL A 63 34.152 -9.189 2.744 1.00 53.11 H new ATOM 0 HB VAL A 63 35.150 -10.510 5.290 1.00 13.33 H new ATOM 0 HG11 VAL A 63 33.233 -9.340 6.295 1.00 75.25 H new ATOM 0 HG12 VAL A 63 34.357 -8.210 5.504 1.00 75.25 H new ATOM 0 HG13 VAL A 63 32.827 -8.648 4.707 1.00 75.25 H new ATOM 0 HG21 VAL A 63 32.969 -11.642 5.439 1.00 71.42 H new ATOM 0 HG22 VAL A 63 32.553 -11.047 3.815 1.00 71.42 H new ATOM 0 HG23 VAL A 63 33.902 -12.189 4.026 1.00 71.42 H new ATOM 910 N SER A 64 36.839 -8.528 2.466 1.00 11.22 N ATOM 911 CA SER A 64 38.017 -7.675 2.562 1.00 44.50 C ATOM 912 C SER A 64 38.517 -7.279 1.176 1.00 72.14 C ATOM 913 O SER A 64 37.851 -7.525 0.170 1.00 15.13 O ATOM 914 CB SER A 64 39.129 -8.390 3.333 1.00 51.21 C ATOM 915 OG SER A 64 39.921 -7.467 4.061 1.00 32.12 O ATOM 0 H SER A 64 36.630 -8.853 1.522 1.00 11.22 H new ATOM 0 HA SER A 64 37.736 -6.769 3.099 1.00 44.50 H new ATOM 0 HB2 SER A 64 38.692 -9.117 4.017 1.00 51.21 H new ATOM 0 HB3 SER A 64 39.759 -8.945 2.638 1.00 51.21 H new ATOM 0 HG SER A 64 40.623 -7.949 4.546 1.00 32.12 H new ATOM 921 N SER A 65 39.695 -6.664 1.131 1.00 20.53 N ATOM 922 CA SER A 65 40.283 -6.231 -0.131 1.00 60.30 C ATOM 923 C SER A 65 41.049 -7.372 -0.793 1.00 63.51 C ATOM 924 O SER A 65 40.899 -7.623 -1.988 1.00 70.02 O ATOM 925 CB SER A 65 41.217 -5.042 0.100 1.00 50.44 C ATOM 926 OG SER A 65 40.598 -4.056 0.908 1.00 35.31 O ATOM 0 H SER A 65 40.260 -6.455 1.954 1.00 20.53 H new ATOM 0 HA SER A 65 39.474 -5.926 -0.795 1.00 60.30 H new ATOM 0 HB2 SER A 65 42.135 -5.384 0.578 1.00 50.44 H new ATOM 0 HB3 SER A 65 41.500 -4.606 -0.858 1.00 50.44 H new ATOM 0 HG SER A 65 41.216 -3.308 1.042 1.00 35.31 H new ATOM 932 N ASN A 66 41.871 -8.060 -0.007 1.00 31.23 N ATOM 933 CA ASN A 66 42.662 -9.174 -0.516 1.00 72.32 C ATOM 934 C ASN A 66 42.573 -10.377 0.419 1.00 50.43 C ATOM 935 O ASN A 66 42.448 -11.517 -0.030 1.00 14.04 O ATOM 936 CB ASN A 66 44.123 -8.754 -0.687 1.00 64.43 C ATOM 937 CG ASN A 66 44.707 -8.161 0.581 1.00 75.44 C ATOM 938 OD1 ASN A 66 44.329 -7.066 0.998 1.00 72.41 O ATOM 939 ND2 ASN A 66 45.632 -8.884 1.200 1.00 30.42 N ATOM 0 H ASN A 66 42.006 -7.865 0.985 1.00 31.23 H new ATOM 0 HA ASN A 66 42.257 -9.460 -1.487 1.00 72.32 H new ATOM 0 HB2 ASN A 66 44.714 -9.620 -0.986 1.00 64.43 H new ATOM 0 HB3 ASN A 66 44.196 -8.024 -1.493 1.00 64.43 H new ATOM 0 HD21 ASN A 66 46.061 -8.537 2.058 1.00 30.42 H new ATOM 0 HD22 ASN A 66 45.914 -9.786 0.818 1.00 30.42 H new ATOM 946 N ILE A 67 42.639 -10.113 1.720 1.00 71.43 N ATOM 947 CA ILE A 67 42.564 -11.173 2.717 1.00 31.21 C ATOM 948 C ILE A 67 41.148 -11.728 2.826 1.00 51.13 C ATOM 949 O ILE A 67 40.247 -11.061 3.336 1.00 34.54 O ATOM 950 CB ILE A 67 43.015 -10.675 4.103 1.00 45.43 C ATOM 951 CG1 ILE A 67 44.335 -9.909 3.989 1.00 71.23 C ATOM 952 CG2 ILE A 67 43.158 -11.843 5.066 1.00 35.44 C ATOM 953 CD1 ILE A 67 44.810 -9.324 5.300 1.00 23.33 C ATOM 0 H ILE A 67 42.744 -9.175 2.107 1.00 71.43 H new ATOM 0 HA ILE A 67 43.237 -11.964 2.386 1.00 31.21 H new ATOM 0 HB ILE A 67 42.255 -9.998 4.493 1.00 45.43 H new ATOM 0 HG12 ILE A 67 45.102 -10.579 3.601 1.00 71.23 H new ATOM 0 HG13 ILE A 67 44.217 -9.104 3.263 1.00 71.23 H new ATOM 0 HG21 ILE A 67 43.477 -11.474 6.041 1.00 35.44 H new ATOM 0 HG22 ILE A 67 42.199 -12.351 5.167 1.00 35.44 H new ATOM 0 HG23 ILE A 67 43.900 -12.542 4.682 1.00 35.44 H new ATOM 0 HD11 ILE A 67 45.750 -8.796 5.143 1.00 23.33 H new ATOM 0 HD12 ILE A 67 44.062 -8.628 5.680 1.00 23.33 H new ATOM 0 HD13 ILE A 67 44.961 -10.126 6.023 1.00 23.33 H new ATOM 965 N ALA A 68 40.959 -12.952 2.343 1.00 12.23 N ATOM 966 CA ALA A 68 39.652 -13.597 2.389 1.00 24.34 C ATOM 967 C ALA A 68 39.662 -14.786 3.344 1.00 34.43 C ATOM 968 O ALA A 68 40.718 -15.209 3.816 1.00 53.42 O ATOM 969 CB ALA A 68 39.234 -14.040 0.996 1.00 74.35 C ATOM 0 H ALA A 68 41.694 -13.516 1.916 1.00 12.23 H new ATOM 0 HA ALA A 68 38.928 -12.872 2.760 1.00 24.34 H new ATOM 0 HB1 ALA A 68 38.257 -14.520 1.045 1.00 74.35 H new ATOM 0 HB2 ALA A 68 39.180 -13.172 0.339 1.00 74.35 H new ATOM 0 HB3 ALA A 68 39.966 -14.746 0.604 1.00 74.35 H new ATOM 975 N VAL A 69 38.478 -15.322 3.626 1.00 2.43 N ATOM 976 CA VAL A 69 38.350 -16.462 4.525 1.00 21.50 C ATOM 977 C VAL A 69 37.980 -17.727 3.758 1.00 33.12 C ATOM 978 O VAL A 69 37.259 -17.673 2.762 1.00 52.12 O ATOM 979 CB VAL A 69 37.288 -16.205 5.612 1.00 64.32 C ATOM 980 CG1 VAL A 69 37.312 -17.313 6.654 1.00 42.41 C ATOM 981 CG2 VAL A 69 37.509 -14.847 6.260 1.00 4.43 C ATOM 0 H VAL A 69 37.594 -14.984 3.244 1.00 2.43 H new ATOM 0 HA VAL A 69 39.321 -16.599 5.002 1.00 21.50 H new ATOM 0 HB VAL A 69 36.304 -16.202 5.142 1.00 64.32 H new ATOM 0 HG11 VAL A 69 36.556 -17.115 7.413 1.00 42.41 H new ATOM 0 HG12 VAL A 69 37.102 -18.269 6.174 1.00 42.41 H new ATOM 0 HG13 VAL A 69 38.295 -17.351 7.123 1.00 42.41 H new ATOM 0 HG21 VAL A 69 36.751 -14.681 7.025 1.00 4.43 H new ATOM 0 HG22 VAL A 69 38.498 -14.819 6.717 1.00 4.43 H new ATOM 0 HG23 VAL A 69 37.437 -14.066 5.503 1.00 4.43 H new ATOM 991 N ASP A 70 38.477 -18.865 4.230 1.00 25.04 N ATOM 992 CA ASP A 70 38.197 -20.145 3.590 1.00 25.11 C ATOM 993 C ASP A 70 38.187 -21.275 4.615 1.00 41.10 C ATOM 994 O ASP A 70 39.166 -21.485 5.333 1.00 34.23 O ATOM 995 CB ASP A 70 39.235 -20.435 2.504 1.00 12.03 C ATOM 996 CG ASP A 70 40.613 -20.701 3.077 1.00 45.05 C ATOM 997 OD1 ASP A 70 40.892 -21.865 3.435 1.00 1.12 O ATOM 998 OD2 ASP A 70 41.413 -19.746 3.167 1.00 65.33 O ATOM 0 H ASP A 70 39.076 -18.927 5.053 1.00 25.04 H new ATOM 0 HA ASP A 70 37.210 -20.085 3.132 1.00 25.11 H new ATOM 0 HB2 ASP A 70 38.915 -21.298 1.920 1.00 12.03 H new ATOM 0 HB3 ASP A 70 39.287 -19.588 1.819 1.00 12.03 H new ATOM 1003 N PHE A 71 37.075 -21.999 4.679 1.00 25.40 N ATOM 1004 CA PHE A 71 36.937 -23.107 5.618 1.00 73.25 C ATOM 1005 C PHE A 71 36.848 -24.439 4.878 1.00 22.04 C ATOM 1006 O PHE A 71 35.858 -24.722 4.203 1.00 71.52 O ATOM 1007 CB PHE A 71 35.696 -22.911 6.490 1.00 34.45 C ATOM 1008 CG PHE A 71 35.692 -21.613 7.246 1.00 30.25 C ATOM 1009 CD1 PHE A 71 34.580 -20.787 7.226 1.00 15.03 C ATOM 1010 CD2 PHE A 71 36.802 -21.219 7.976 1.00 74.13 C ATOM 1011 CE1 PHE A 71 34.574 -19.592 7.921 1.00 30.35 C ATOM 1012 CE2 PHE A 71 36.802 -20.025 8.673 1.00 20.34 C ATOM 1013 CZ PHE A 71 35.687 -19.211 8.645 1.00 53.02 C ATOM 0 H PHE A 71 36.256 -21.839 4.092 1.00 25.40 H new ATOM 0 HA PHE A 71 37.821 -23.124 6.255 1.00 73.25 H new ATOM 0 HB2 PHE A 71 34.808 -22.958 5.860 1.00 34.45 H new ATOM 0 HB3 PHE A 71 35.627 -23.735 7.200 1.00 34.45 H new ATOM 0 HD1 PHE A 71 33.708 -21.080 6.661 1.00 15.03 H new ATOM 0 HD2 PHE A 71 37.677 -21.852 8.001 1.00 74.13 H new ATOM 0 HE1 PHE A 71 33.700 -18.957 7.898 1.00 30.35 H new ATOM 0 HE2 PHE A 71 37.673 -19.729 9.239 1.00 20.34 H new ATOM 0 HZ PHE A 71 35.685 -18.278 9.188 1.00 53.02 H new ATOM 1023 N PHE A 72 37.889 -25.253 5.012 1.00 63.23 N ATOM 1024 CA PHE A 72 37.931 -26.555 4.355 1.00 52.21 C ATOM 1025 C PHE A 72 37.306 -27.629 5.240 1.00 3.01 C ATOM 1026 O PHE A 72 37.459 -27.610 6.461 1.00 21.14 O ATOM 1027 CB PHE A 72 39.375 -26.933 4.017 1.00 53.23 C ATOM 1028 CG PHE A 72 39.633 -27.052 2.542 1.00 55.53 C ATOM 1029 CD1 PHE A 72 39.456 -28.260 1.889 1.00 74.31 C ATOM 1030 CD2 PHE A 72 40.054 -25.953 1.808 1.00 31.45 C ATOM 1031 CE1 PHE A 72 39.692 -28.373 0.532 1.00 70.23 C ATOM 1032 CE2 PHE A 72 40.292 -26.060 0.451 1.00 71.15 C ATOM 1033 CZ PHE A 72 40.111 -27.272 -0.188 1.00 25.21 C ATOM 0 H PHE A 72 38.715 -25.035 5.569 1.00 63.23 H new ATOM 0 HA PHE A 72 37.355 -26.488 3.432 1.00 52.21 H new ATOM 0 HB2 PHE A 72 40.046 -26.183 4.436 1.00 53.23 H new ATOM 0 HB3 PHE A 72 39.616 -27.881 4.498 1.00 53.23 H new ATOM 0 HD1 PHE A 72 39.129 -29.125 2.447 1.00 74.31 H new ATOM 0 HD2 PHE A 72 40.197 -25.004 2.302 1.00 31.45 H new ATOM 0 HE1 PHE A 72 39.549 -29.321 0.035 1.00 70.23 H new ATOM 0 HE2 PHE A 72 40.619 -25.197 -0.110 1.00 71.15 H new ATOM 0 HZ PHE A 72 40.297 -27.358 -1.248 1.00 25.21 H new ATOM 1043 N VAL A 73 36.601 -28.566 4.614 1.00 51.32 N ATOM 1044 CA VAL A 73 35.953 -29.649 5.343 1.00 73.54 C ATOM 1045 C VAL A 73 35.623 -30.815 4.416 1.00 43.04 C ATOM 1046 O VAL A 73 35.344 -30.622 3.233 1.00 24.24 O ATOM 1047 CB VAL A 73 34.659 -29.171 6.026 1.00 12.02 C ATOM 1048 CG1 VAL A 73 33.628 -28.756 4.988 1.00 14.24 C ATOM 1049 CG2 VAL A 73 34.104 -30.256 6.936 1.00 32.51 C ATOM 0 H VAL A 73 36.464 -28.597 3.604 1.00 51.32 H new ATOM 0 HA VAL A 73 36.657 -29.982 6.106 1.00 73.54 H new ATOM 0 HB VAL A 73 34.893 -28.300 6.638 1.00 12.02 H new ATOM 0 HG11 VAL A 73 32.720 -28.421 5.490 1.00 14.24 H new ATOM 0 HG12 VAL A 73 34.028 -27.943 4.382 1.00 14.24 H new ATOM 0 HG13 VAL A 73 33.395 -29.606 4.346 1.00 14.24 H new ATOM 0 HG21 VAL A 73 33.189 -29.900 7.410 1.00 32.51 H new ATOM 0 HG22 VAL A 73 33.885 -31.147 6.348 1.00 32.51 H new ATOM 0 HG23 VAL A 73 34.839 -30.499 7.703 1.00 32.51 H new ATOM 1059 N GLY A 74 35.657 -32.026 4.962 1.00 22.11 N ATOM 1060 CA GLY A 74 35.359 -33.206 4.170 1.00 23.25 C ATOM 1061 C GLY A 74 34.020 -33.820 4.527 1.00 72.20 C ATOM 1062 O GLY A 74 33.140 -33.144 5.060 1.00 40.14 O ATOM 0 H GLY A 74 35.885 -32.212 5.939 1.00 22.11 H new ATOM 0 HA2 GLY A 74 35.364 -32.941 3.113 1.00 23.25 H new ATOM 0 HA3 GLY A 74 36.145 -33.946 4.316 1.00 23.25 H new ATOM 1457 N ALA A 101 38.045 -30.718 10.155 1.00 53.12 N ATOM 1458 CA ALA A 101 37.812 -29.414 9.544 1.00 5.21 C ATOM 1459 C ALA A 101 38.988 -28.475 9.792 1.00 70.04 C ATOM 1460 O ALA A 101 39.605 -28.506 10.856 1.00 2.14 O ATOM 1461 CB ALA A 101 36.525 -28.804 10.079 1.00 34.11 C ATOM 0 HA ALA A 101 37.714 -29.556 8.468 1.00 5.21 H new ATOM 0 HB1 ALA A 101 36.363 -27.831 9.615 1.00 34.11 H new ATOM 0 HB2 ALA A 101 35.687 -29.461 9.847 1.00 34.11 H new ATOM 0 HB3 ALA A 101 36.602 -28.682 11.159 1.00 34.11 H new ATOM 1467 N ILE A 102 39.292 -27.642 8.802 1.00 23.35 N ATOM 1468 CA ILE A 102 40.393 -26.694 8.914 1.00 61.44 C ATOM 1469 C ILE A 102 39.964 -25.298 8.475 1.00 60.04 C ATOM 1470 O ILE A 102 39.285 -25.137 7.459 1.00 3.41 O ATOM 1471 CB ILE A 102 41.604 -27.136 8.070 1.00 13.45 C ATOM 1472 CG1 ILE A 102 42.708 -26.079 8.129 1.00 1.52 C ATOM 1473 CG2 ILE A 102 41.182 -27.388 6.630 1.00 23.24 C ATOM 1474 CD1 ILE A 102 42.665 -25.095 6.981 1.00 44.12 C ATOM 0 H ILE A 102 38.791 -27.605 7.914 1.00 23.35 H new ATOM 0 HA ILE A 102 40.682 -26.669 9.965 1.00 61.44 H new ATOM 0 HB ILE A 102 41.995 -28.066 8.482 1.00 13.45 H new ATOM 0 HG12 ILE A 102 42.627 -25.532 9.069 1.00 1.52 H new ATOM 0 HG13 ILE A 102 43.677 -26.578 8.133 1.00 1.52 H new ATOM 0 HG21 ILE A 102 42.048 -27.699 6.046 1.00 23.24 H new ATOM 0 HG22 ILE A 102 40.426 -28.173 6.604 1.00 23.24 H new ATOM 0 HG23 ILE A 102 40.769 -26.473 6.206 1.00 23.24 H new ATOM 0 HD11 ILE A 102 43.476 -24.375 7.088 1.00 44.12 H new ATOM 0 HD12 ILE A 102 42.777 -25.631 6.038 1.00 44.12 H new ATOM 0 HD13 ILE A 102 41.710 -24.569 6.988 1.00 44.12 H new ATOM 1486 N LEU A 103 40.365 -24.293 9.244 1.00 42.50 N ATOM 1487 CA LEU A 103 40.024 -22.909 8.933 1.00 1.11 C ATOM 1488 C LEU A 103 41.272 -22.106 8.583 1.00 52.25 C ATOM 1489 O LEU A 103 42.250 -22.098 9.330 1.00 33.35 O ATOM 1490 CB LEU A 103 39.305 -22.263 10.118 1.00 1.53 C ATOM 1491 CG LEU A 103 38.163 -23.072 10.734 1.00 42.24 C ATOM 1492 CD1 LEU A 103 38.681 -23.956 11.858 1.00 71.41 C ATOM 1493 CD2 LEU A 103 37.066 -22.148 11.242 1.00 42.01 C ATOM 0 H LEU A 103 40.927 -24.410 10.087 1.00 42.50 H new ATOM 0 HA LEU A 103 39.360 -22.910 8.068 1.00 1.11 H new ATOM 0 HB2 LEU A 103 40.041 -22.060 10.896 1.00 1.53 H new ATOM 0 HB3 LEU A 103 38.908 -21.300 9.795 1.00 1.53 H new ATOM 0 HG LEU A 103 37.740 -23.713 9.960 1.00 42.24 H new ATOM 0 HD11 LEU A 103 37.854 -24.524 12.284 1.00 71.41 H new ATOM 0 HD12 LEU A 103 39.429 -24.644 11.464 1.00 71.41 H new ATOM 0 HD13 LEU A 103 39.131 -23.334 12.632 1.00 71.41 H new ATOM 0 HD21 LEU A 103 36.262 -22.742 11.677 1.00 42.01 H new ATOM 0 HD22 LEU A 103 37.475 -21.480 12.000 1.00 42.01 H new ATOM 0 HD23 LEU A 103 36.674 -21.559 10.413 1.00 42.01 H new ATOM 1505 N SER A 104 41.232 -21.428 7.439 1.00 34.22 N ATOM 1506 CA SER A 104 42.360 -20.622 6.988 1.00 61.42 C ATOM 1507 C SER A 104 41.888 -19.479 6.094 1.00 60.42 C ATOM 1508 O SER A 104 40.737 -19.453 5.656 1.00 71.12 O ATOM 1509 CB SER A 104 43.366 -21.493 6.233 1.00 23.31 C ATOM 1510 OG SER A 104 42.714 -22.326 5.291 1.00 61.41 O ATOM 0 H SER A 104 40.430 -21.421 6.808 1.00 34.22 H new ATOM 0 HA SER A 104 42.845 -20.196 7.866 1.00 61.42 H new ATOM 0 HB2 SER A 104 44.090 -20.858 5.722 1.00 23.31 H new ATOM 0 HB3 SER A 104 43.924 -22.106 6.941 1.00 23.31 H new ATOM 0 HG SER A 104 42.031 -21.809 4.815 1.00 61.41 H new ATOM 1516 N LEU A 105 42.785 -18.537 5.826 1.00 63.52 N ATOM 1517 CA LEU A 105 42.463 -17.391 4.984 1.00 51.54 C ATOM 1518 C LEU A 105 43.078 -17.544 3.596 1.00 20.34 C ATOM 1519 O LEU A 105 44.125 -18.171 3.438 1.00 51.43 O ATOM 1520 CB LEU A 105 42.961 -16.099 5.634 1.00 32.44 C ATOM 1521 CG LEU A 105 44.340 -16.166 6.290 1.00 44.32 C ATOM 1522 CD1 LEU A 105 45.423 -16.353 5.237 1.00 33.02 C ATOM 1523 CD2 LEU A 105 44.603 -14.911 7.110 1.00 55.34 C ATOM 0 H LEU A 105 43.742 -18.544 6.180 1.00 63.52 H new ATOM 0 HA LEU A 105 41.379 -17.344 4.878 1.00 51.54 H new ATOM 0 HB2 LEU A 105 42.980 -15.318 4.874 1.00 32.44 H new ATOM 0 HB3 LEU A 105 42.236 -15.793 6.388 1.00 32.44 H new ATOM 0 HG LEU A 105 44.361 -17.025 6.961 1.00 44.32 H new ATOM 0 HD11 LEU A 105 46.398 -16.399 5.722 1.00 33.02 H new ATOM 0 HD12 LEU A 105 45.245 -17.280 4.693 1.00 33.02 H new ATOM 0 HD13 LEU A 105 45.403 -15.514 4.541 1.00 33.02 H new ATOM 0 HD21 LEU A 105 45.589 -14.977 7.569 1.00 55.34 H new ATOM 0 HD22 LEU A 105 44.563 -14.037 6.460 1.00 55.34 H new ATOM 0 HD23 LEU A 105 43.845 -14.820 7.888 1.00 55.34 H new ATOM 1535 N GLN A 106 42.421 -16.966 2.596 1.00 60.41 N ATOM 1536 CA GLN A 106 42.904 -17.037 1.223 1.00 73.55 C ATOM 1537 C GLN A 106 43.576 -15.731 0.813 1.00 73.51 C ATOM 1538 O GLN A 106 43.098 -14.646 1.142 1.00 1.54 O ATOM 1539 CB GLN A 106 41.750 -17.353 0.269 1.00 14.33 C ATOM 1540 CG GLN A 106 42.131 -18.302 -0.855 1.00 45.03 C ATOM 1541 CD GLN A 106 42.118 -19.755 -0.422 1.00 51.04 C ATOM 1542 OE1 GLN A 106 42.923 -20.173 0.410 1.00 31.21 O ATOM 1543 NE2 GLN A 106 41.201 -20.533 -0.987 1.00 13.52 N ATOM 0 H GLN A 106 41.553 -16.443 2.711 1.00 60.41 H new ATOM 0 HA GLN A 106 43.642 -17.837 1.166 1.00 73.55 H new ATOM 0 HB2 GLN A 106 40.929 -17.788 0.838 1.00 14.33 H new ATOM 0 HB3 GLN A 106 41.381 -16.422 -0.162 1.00 14.33 H new ATOM 0 HG2 GLN A 106 41.440 -18.169 -1.688 1.00 45.03 H new ATOM 0 HG3 GLN A 106 43.125 -18.045 -1.221 1.00 45.03 H new ATOM 0 HE21 GLN A 106 40.554 -20.143 -1.672 1.00 13.52 H new ATOM 0 HE22 GLN A 106 41.144 -21.520 -0.735 1.00 13.52 H new ATOM 1552 N TYR A 107 44.687 -15.844 0.093 1.00 2.14 N ATOM 1553 CA TYR A 107 45.426 -14.671 -0.359 1.00 31.02 C ATOM 1554 C TYR A 107 45.584 -14.679 -1.877 1.00 32.03 C ATOM 1555 O TYR A 107 46.482 -15.327 -2.416 1.00 73.02 O ATOM 1556 CB TYR A 107 46.802 -14.622 0.308 1.00 52.33 C ATOM 1557 CG TYR A 107 46.814 -13.863 1.615 1.00 11.14 C ATOM 1558 CD1 TYR A 107 45.956 -14.213 2.651 1.00 3.42 C ATOM 1559 CD2 TYR A 107 47.681 -12.797 1.816 1.00 50.41 C ATOM 1560 CE1 TYR A 107 45.963 -13.523 3.848 1.00 14.42 C ATOM 1561 CE2 TYR A 107 47.695 -12.102 3.010 1.00 44.44 C ATOM 1562 CZ TYR A 107 46.835 -12.468 4.023 1.00 72.04 C ATOM 1563 OH TYR A 107 46.845 -11.777 5.212 1.00 1.25 O ATOM 0 H TYR A 107 45.095 -16.735 -0.190 1.00 2.14 H new ATOM 0 HA TYR A 107 44.860 -13.784 -0.075 1.00 31.02 H new ATOM 0 HB2 TYR A 107 47.147 -15.641 0.486 1.00 52.33 H new ATOM 0 HB3 TYR A 107 47.513 -14.160 -0.377 1.00 52.33 H new ATOM 0 HD1 TYR A 107 45.272 -15.038 2.518 1.00 3.42 H new ATOM 0 HD2 TYR A 107 48.356 -12.506 1.025 1.00 50.41 H new ATOM 0 HE1 TYR A 107 45.289 -13.808 4.643 1.00 14.42 H new ATOM 0 HE2 TYR A 107 48.377 -11.276 3.149 1.00 44.44 H new ATOM 0 HH TYR A 107 47.518 -11.065 5.171 1.00 1.25 H new ATOM 1712 N TYR A 116 43.941 -16.180 -11.623 1.00 75.15 N ATOM 1713 CA TYR A 116 45.238 -15.977 -10.988 1.00 53.43 C ATOM 1714 C TYR A 116 45.427 -16.935 -9.817 1.00 61.31 C ATOM 1715 O TYR A 116 44.472 -17.488 -9.273 1.00 34.11 O ATOM 1716 CB TYR A 116 45.371 -14.531 -10.506 1.00 64.01 C ATOM 1717 CG TYR A 116 45.924 -13.592 -11.555 1.00 30.45 C ATOM 1718 CD1 TYR A 116 45.262 -12.414 -11.878 1.00 3.30 C ATOM 1719 CD2 TYR A 116 47.108 -13.882 -12.221 1.00 62.23 C ATOM 1720 CE1 TYR A 116 45.764 -11.554 -12.836 1.00 10.23 C ATOM 1721 CE2 TYR A 116 47.617 -13.027 -13.179 1.00 44.21 C ATOM 1722 CZ TYR A 116 46.942 -11.865 -13.484 1.00 15.35 C ATOM 1723 OH TYR A 116 47.444 -11.009 -14.436 1.00 62.41 O ATOM 0 HA TYR A 116 46.013 -16.180 -11.727 1.00 53.43 H new ATOM 0 HB2 TYR A 116 44.392 -14.171 -10.188 1.00 64.01 H new ATOM 0 HB3 TYR A 116 46.020 -14.507 -9.630 1.00 64.01 H new ATOM 0 HD1 TYR A 116 44.340 -12.167 -11.372 1.00 3.30 H new ATOM 0 HD2 TYR A 116 47.640 -14.792 -11.986 1.00 62.23 H new ATOM 0 HE1 TYR A 116 45.237 -10.643 -13.077 1.00 10.23 H new ATOM 0 HE2 TYR A 116 48.539 -13.268 -13.686 1.00 44.21 H new ATOM 0 HH TYR A 116 48.280 -11.373 -14.796 1.00 62.41 H new ATOM 1733 N PRO A 117 46.692 -17.137 -9.417 1.00 50.35 N ATOM 1734 CA PRO A 117 47.038 -18.027 -8.306 1.00 21.13 C ATOM 1735 C PRO A 117 46.598 -17.469 -6.957 1.00 42.13 C ATOM 1736 O PRO A 117 46.188 -16.312 -6.857 1.00 11.12 O ATOM 1737 CB PRO A 117 48.565 -18.107 -8.378 1.00 71.52 C ATOM 1738 CG PRO A 117 48.980 -16.844 -9.049 1.00 51.54 C ATOM 1739 CD PRO A 117 47.881 -16.510 -10.020 1.00 30.42 C ATOM 0 HA PRO A 117 46.542 -18.994 -8.389 1.00 21.13 H new ATOM 0 HB2 PRO A 117 49.004 -18.190 -7.384 1.00 71.52 H new ATOM 0 HB3 PRO A 117 48.889 -18.981 -8.943 1.00 71.52 H new ATOM 0 HG2 PRO A 117 49.116 -16.043 -8.323 1.00 51.54 H new ATOM 0 HG3 PRO A 117 49.932 -16.971 -9.565 1.00 51.54 H new ATOM 0 HD2 PRO A 117 47.755 -15.433 -10.130 1.00 30.42 H new ATOM 0 HD3 PRO A 117 48.087 -16.910 -11.013 1.00 30.42 H new ATOM 1747 N TYR A 118 46.686 -18.296 -5.921 1.00 63.44 N ATOM 1748 CA TYR A 118 46.295 -17.886 -4.579 1.00 23.11 C ATOM 1749 C TYR A 118 46.939 -18.782 -3.526 1.00 30.02 C ATOM 1750 O TYR A 118 47.168 -19.969 -3.759 1.00 40.41 O ATOM 1751 CB TYR A 118 44.773 -17.923 -4.435 1.00 32.20 C ATOM 1752 CG TYR A 118 44.218 -19.315 -4.235 1.00 72.11 C ATOM 1753 CD1 TYR A 118 44.100 -19.862 -2.963 1.00 60.20 C ATOM 1754 CD2 TYR A 118 43.809 -20.083 -5.319 1.00 35.21 C ATOM 1755 CE1 TYR A 118 43.595 -21.134 -2.777 1.00 30.23 C ATOM 1756 CE2 TYR A 118 43.300 -21.356 -5.141 1.00 52.53 C ATOM 1757 CZ TYR A 118 43.195 -21.877 -3.869 1.00 4.14 C ATOM 1758 OH TYR A 118 42.689 -23.143 -3.686 1.00 65.23 O ATOM 0 H TYR A 118 47.025 -19.256 -5.986 1.00 63.44 H new ATOM 0 HA TYR A 118 46.643 -16.865 -4.423 1.00 23.11 H new ATOM 0 HB2 TYR A 118 44.481 -17.300 -3.590 1.00 32.20 H new ATOM 0 HB3 TYR A 118 44.321 -17.485 -5.325 1.00 32.20 H new ATOM 0 HD1 TYR A 118 44.408 -19.283 -2.105 1.00 60.20 H new ATOM 0 HD2 TYR A 118 43.890 -19.678 -6.317 1.00 35.21 H new ATOM 0 HE1 TYR A 118 43.514 -21.545 -1.782 1.00 30.23 H new ATOM 0 HE2 TYR A 118 42.986 -21.939 -5.994 1.00 52.53 H new ATOM 0 HH TYR A 118 43.036 -23.738 -4.384 1.00 65.23 H new ATOM 1768 N VAL A 119 47.228 -18.204 -2.364 1.00 21.42 N ATOM 1769 CA VAL A 119 47.844 -18.950 -1.272 1.00 3.10 C ATOM 1770 C VAL A 119 46.975 -18.911 -0.020 1.00 52.44 C ATOM 1771 O VAL A 119 46.510 -17.849 0.393 1.00 61.03 O ATOM 1772 CB VAL A 119 49.240 -18.395 -0.932 1.00 5.53 C ATOM 1773 CG1 VAL A 119 50.186 -18.568 -2.110 1.00 13.15 C ATOM 1774 CG2 VAL A 119 49.147 -16.932 -0.523 1.00 74.04 C ATOM 0 H VAL A 119 47.046 -17.223 -2.155 1.00 21.42 H new ATOM 0 HA VAL A 119 47.943 -19.982 -1.609 1.00 3.10 H new ATOM 0 HB VAL A 119 49.640 -18.960 -0.090 1.00 5.53 H new ATOM 0 HG11 VAL A 119 51.167 -18.170 -1.850 1.00 13.15 H new ATOM 0 HG12 VAL A 119 50.276 -19.627 -2.352 1.00 13.15 H new ATOM 0 HG13 VAL A 119 49.794 -18.031 -2.974 1.00 13.15 H new ATOM 0 HG21 VAL A 119 50.142 -16.556 -0.286 1.00 74.04 H new ATOM 0 HG22 VAL A 119 48.725 -16.351 -1.343 1.00 74.04 H new ATOM 0 HG23 VAL A 119 48.506 -16.839 0.354 1.00 74.04 H new ATOM 1784 N GLY A 120 46.758 -20.077 0.580 1.00 75.25 N ATOM 1785 CA GLY A 120 45.945 -20.154 1.779 1.00 21.13 C ATOM 1786 C GLY A 120 46.758 -20.500 3.010 1.00 31.41 C ATOM 1787 O GLY A 120 47.619 -21.379 2.968 1.00 31.10 O ATOM 0 H GLY A 120 47.131 -20.970 0.257 1.00 75.25 H new ATOM 0 HA2 GLY A 120 45.443 -19.199 1.936 1.00 21.13 H new ATOM 0 HA3 GLY A 120 45.167 -20.904 1.639 1.00 21.13 H new ATOM 1791 N VAL A 121 46.488 -19.806 4.112 1.00 73.33 N ATOM 1792 CA VAL A 121 47.202 -20.043 5.360 1.00 33.34 C ATOM 1793 C VAL A 121 46.254 -19.990 6.553 1.00 21.14 C ATOM 1794 O VAL A 121 45.344 -19.164 6.600 1.00 74.13 O ATOM 1795 CB VAL A 121 48.329 -19.015 5.567 1.00 53.22 C ATOM 1796 CG1 VAL A 121 49.214 -19.421 6.735 1.00 3.42 C ATOM 1797 CG2 VAL A 121 49.148 -18.860 4.295 1.00 61.43 C ATOM 0 H VAL A 121 45.779 -19.075 4.165 1.00 73.33 H new ATOM 0 HA VAL A 121 47.639 -21.039 5.290 1.00 33.34 H new ATOM 0 HB VAL A 121 47.879 -18.050 5.802 1.00 53.22 H new ATOM 0 HG11 VAL A 121 50.005 -18.683 6.866 1.00 3.42 H new ATOM 0 HG12 VAL A 121 48.615 -19.476 7.644 1.00 3.42 H new ATOM 0 HG13 VAL A 121 49.658 -20.396 6.534 1.00 3.42 H new ATOM 0 HG21 VAL A 121 49.940 -18.130 4.459 1.00 61.43 H new ATOM 0 HG22 VAL A 121 49.589 -19.820 4.027 1.00 61.43 H new ATOM 0 HG23 VAL A 121 48.502 -18.519 3.486 1.00 61.43 H new ATOM 1807 N GLY A 122 46.475 -20.878 7.518 1.00 10.40 N ATOM 1808 CA GLY A 122 45.633 -20.914 8.700 1.00 61.30 C ATOM 1809 C GLY A 122 45.906 -22.127 9.568 1.00 1.42 C ATOM 1810 O GLY A 122 47.015 -22.660 9.571 1.00 63.33 O ATOM 0 H GLY A 122 47.222 -21.573 7.502 1.00 10.40 H new ATOM 0 HA2 GLY A 122 45.794 -20.008 9.285 1.00 61.30 H new ATOM 0 HA3 GLY A 122 44.586 -20.916 8.397 1.00 61.30 H new ATOM 1814 N VAL A 123 44.892 -22.561 10.310 1.00 74.22 N ATOM 1815 CA VAL A 123 45.027 -23.718 11.188 1.00 50.52 C ATOM 1816 C VAL A 123 43.786 -24.600 11.129 1.00 30.22 C ATOM 1817 O VAL A 123 42.683 -24.121 10.865 1.00 24.42 O ATOM 1818 CB VAL A 123 45.272 -23.290 12.647 1.00 50.42 C ATOM 1819 CG1 VAL A 123 46.636 -22.631 12.789 1.00 51.25 C ATOM 1820 CG2 VAL A 123 44.167 -22.355 13.119 1.00 24.01 C ATOM 0 H VAL A 123 43.968 -22.129 10.321 1.00 74.22 H new ATOM 0 HA VAL A 123 45.888 -24.285 10.835 1.00 50.52 H new ATOM 0 HB VAL A 123 45.259 -24.180 13.276 1.00 50.42 H new ATOM 0 HG11 VAL A 123 46.791 -22.335 13.827 1.00 51.25 H new ATOM 0 HG12 VAL A 123 47.413 -23.335 12.492 1.00 51.25 H new ATOM 0 HG13 VAL A 123 46.682 -21.749 12.150 1.00 51.25 H new ATOM 0 HG21 VAL A 123 44.355 -22.062 14.152 1.00 24.01 H new ATOM 0 HG22 VAL A 123 44.147 -21.467 12.487 1.00 24.01 H new ATOM 0 HG23 VAL A 123 43.206 -22.866 13.056 1.00 24.01 H new ATOM 1830 N GLY A 124 43.973 -25.893 11.380 1.00 74.04 N ATOM 1831 CA GLY A 124 42.858 -26.822 11.351 1.00 2.31 C ATOM 1832 C GLY A 124 42.934 -27.853 12.460 1.00 44.24 C ATOM 1833 O GLY A 124 43.901 -27.883 13.222 1.00 31.23 O ATOM 0 H GLY A 124 44.876 -26.313 11.603 1.00 74.04 H new ATOM 0 HA2 GLY A 124 41.924 -26.267 11.438 1.00 2.31 H new ATOM 0 HA3 GLY A 124 42.838 -27.330 10.387 1.00 2.31 H new ATOM 1837 N ARG A 125 41.913 -28.698 12.551 1.00 63.43 N ATOM 1838 CA ARG A 125 41.868 -29.733 13.577 1.00 33.42 C ATOM 1839 C ARG A 125 40.738 -30.722 13.302 1.00 61.23 C ATOM 1840 O ARG A 125 40.043 -30.620 12.292 1.00 61.12 O ATOM 1841 CB ARG A 125 41.684 -29.104 14.959 1.00 10.23 C ATOM 1842 CG ARG A 125 40.363 -28.370 15.123 1.00 34.12 C ATOM 1843 CD ARG A 125 40.482 -26.909 14.716 1.00 33.33 C ATOM 1844 NE ARG A 125 40.657 -26.033 15.871 1.00 13.31 N ATOM 1845 CZ ARG A 125 39.707 -25.807 16.773 1.00 42.32 C ATOM 1846 NH1 ARG A 125 38.523 -26.392 16.654 1.00 42.02 N ATOM 1847 NH2 ARG A 125 39.942 -24.996 17.797 1.00 53.13 N ATOM 0 H ARG A 125 41.106 -28.687 11.927 1.00 63.43 H new ATOM 0 HA ARG A 125 42.815 -30.273 13.554 1.00 33.42 H new ATOM 0 HB2 ARG A 125 41.753 -29.885 15.716 1.00 10.23 H new ATOM 0 HB3 ARG A 125 42.502 -28.408 15.144 1.00 10.23 H new ATOM 0 HG2 ARG A 125 39.598 -28.856 14.518 1.00 34.12 H new ATOM 0 HG3 ARG A 125 40.036 -28.434 16.161 1.00 34.12 H new ATOM 0 HD2 ARG A 125 41.327 -26.789 14.038 1.00 33.33 H new ATOM 0 HD3 ARG A 125 39.589 -26.611 14.167 1.00 33.33 H new ATOM 0 HE ARG A 125 41.557 -25.569 15.992 1.00 13.31 H new ATOM 0 HH11 ARG A 125 38.340 -27.017 15.869 1.00 42.02 H new ATOM 0 HH12 ARG A 125 37.796 -26.217 17.347 1.00 42.02 H new ATOM 0 HH21 ARG A 125 40.852 -24.546 17.892 1.00 53.13 H new ATOM 0 HH22 ARG A 125 39.212 -24.823 18.489 1.00 53.13 H new ATOM 2185 N ALA A 146 46.071 -27.496 15.135 1.00 33.14 N ATOM 2186 CA ALA A 146 47.379 -27.567 14.496 1.00 30.21 C ATOM 2187 C ALA A 146 47.475 -26.586 13.333 1.00 42.21 C ATOM 2188 O ALA A 146 46.470 -26.127 12.791 1.00 42.30 O ATOM 2189 CB ALA A 146 47.656 -28.984 14.017 1.00 23.43 C ATOM 0 HA ALA A 146 48.132 -27.291 15.234 1.00 30.21 H new ATOM 0 HB1 ALA A 146 48.636 -29.022 13.542 1.00 23.43 H new ATOM 0 HB2 ALA A 146 47.638 -29.666 14.867 1.00 23.43 H new ATOM 0 HB3 ALA A 146 46.892 -29.281 13.298 1.00 23.43 H new ATOM 2195 N PRO A 147 48.714 -26.255 12.939 1.00 14.42 N ATOM 2196 CA PRO A 147 48.971 -25.323 11.836 1.00 31.24 C ATOM 2197 C PRO A 147 48.592 -25.911 10.481 1.00 63.31 C ATOM 2198 O PRO A 147 48.523 -27.129 10.320 1.00 73.10 O ATOM 2199 CB PRO A 147 50.482 -25.090 11.914 1.00 53.11 C ATOM 2200 CG PRO A 147 51.021 -26.311 12.575 1.00 31.51 C ATOM 2201 CD PRO A 147 49.959 -26.763 13.540 1.00 40.32 C ATOM 0 HA PRO A 147 48.380 -24.412 11.926 1.00 31.24 H new ATOM 0 HB2 PRO A 147 50.913 -24.954 10.922 1.00 53.11 H new ATOM 0 HB3 PRO A 147 50.715 -24.193 12.488 1.00 53.11 H new ATOM 0 HG2 PRO A 147 51.238 -27.088 11.842 1.00 31.51 H new ATOM 0 HG3 PRO A 147 51.954 -26.094 13.095 1.00 31.51 H new ATOM 0 HD2 PRO A 147 49.943 -27.848 13.641 1.00 40.32 H new ATOM 0 HD3 PRO A 147 50.121 -26.353 14.537 1.00 40.32 H new ATOM 2209 N ALA A 148 48.348 -25.038 9.510 1.00 54.32 N ATOM 2210 CA ALA A 148 47.978 -25.470 8.167 1.00 24.34 C ATOM 2211 C ALA A 148 48.373 -24.429 7.127 1.00 41.31 C ATOM 2212 O ALA A 148 48.040 -23.251 7.255 1.00 1.33 O ATOM 2213 CB ALA A 148 46.485 -25.751 8.096 1.00 11.03 C ATOM 0 H ALA A 148 48.400 -24.026 9.628 1.00 54.32 H new ATOM 0 HA ALA A 148 48.520 -26.389 7.945 1.00 24.34 H new ATOM 0 HB1 ALA A 148 46.223 -26.072 7.088 1.00 11.03 H new ATOM 0 HB2 ALA A 148 46.229 -26.537 8.806 1.00 11.03 H new ATOM 0 HB3 ALA A 148 45.932 -24.845 8.343 1.00 11.03 H new ATOM 2219 N PHE A 149 49.086 -24.871 6.096 1.00 51.44 N ATOM 2220 CA PHE A 149 49.528 -23.975 5.033 1.00 73.53 C ATOM 2221 C PHE A 149 49.521 -24.688 3.684 1.00 55.14 C ATOM 2222 O PHE A 149 50.073 -25.779 3.544 1.00 24.31 O ATOM 2223 CB PHE A 149 50.931 -23.445 5.334 1.00 11.30 C ATOM 2224 CG PHE A 149 51.552 -22.705 4.184 1.00 52.42 C ATOM 2225 CD1 PHE A 149 52.876 -22.922 3.836 1.00 32.34 C ATOM 2226 CD2 PHE A 149 50.812 -21.791 3.450 1.00 12.54 C ATOM 2227 CE1 PHE A 149 53.450 -22.243 2.778 1.00 14.24 C ATOM 2228 CE2 PHE A 149 51.381 -21.109 2.391 1.00 52.12 C ATOM 2229 CZ PHE A 149 52.701 -21.335 2.056 1.00 41.31 C ATOM 0 H PHE A 149 49.370 -25.843 5.974 1.00 51.44 H new ATOM 0 HA PHE A 149 48.833 -23.137 4.986 1.00 73.53 H new ATOM 0 HB2 PHE A 149 50.883 -22.783 6.198 1.00 11.30 H new ATOM 0 HB3 PHE A 149 51.575 -24.280 5.608 1.00 11.30 H new ATOM 0 HD1 PHE A 149 53.466 -23.630 4.398 1.00 32.34 H new ATOM 0 HD2 PHE A 149 49.779 -21.610 3.709 1.00 12.54 H new ATOM 0 HE1 PHE A 149 54.482 -22.422 2.516 1.00 14.24 H new ATOM 0 HE2 PHE A 149 50.794 -20.400 1.826 1.00 52.12 H new ATOM 0 HZ PHE A 149 53.148 -20.802 1.230 1.00 41.31 H new ATOM 2239 N GLN A 150 48.890 -24.063 2.694 1.00 42.21 N ATOM 2240 CA GLN A 150 48.810 -24.638 1.356 1.00 34.01 C ATOM 2241 C GLN A 150 48.527 -23.559 0.316 1.00 61.32 C ATOM 2242 O GLN A 150 48.109 -22.452 0.653 1.00 13.04 O ATOM 2243 CB GLN A 150 47.721 -25.711 1.304 1.00 43.02 C ATOM 2244 CG GLN A 150 46.313 -25.157 1.445 1.00 43.45 C ATOM 2245 CD GLN A 150 46.014 -24.675 2.851 1.00 14.23 C ATOM 2246 OE1 GLN A 150 45.877 -23.475 3.093 1.00 63.44 O ATOM 2247 NE2 GLN A 150 45.909 -25.610 3.788 1.00 74.44 N ATOM 0 H GLN A 150 48.427 -23.159 2.793 1.00 42.21 H new ATOM 0 HA GLN A 150 49.772 -25.095 1.126 1.00 34.01 H new ATOM 0 HB2 GLN A 150 47.798 -26.249 0.359 1.00 43.02 H new ATOM 0 HB3 GLN A 150 47.899 -26.436 2.099 1.00 43.02 H new ATOM 0 HG2 GLN A 150 46.180 -24.331 0.746 1.00 43.45 H new ATOM 0 HG3 GLN A 150 45.594 -25.928 1.169 1.00 43.45 H new ATOM 0 HE21 GLN A 150 46.030 -26.593 3.544 1.00 74.44 H new ATOM 0 HE22 GLN A 150 45.707 -25.345 4.752 1.00 74.44 H new ATOM 2256 N VAL A 151 48.759 -23.890 -0.950 1.00 72.20 N ATOM 2257 CA VAL A 151 48.528 -22.950 -2.041 1.00 5.31 C ATOM 2258 C VAL A 151 47.496 -23.490 -3.023 1.00 40.12 C ATOM 2259 O VAL A 151 46.958 -24.580 -2.837 1.00 34.44 O ATOM 2260 CB VAL A 151 49.833 -22.641 -2.801 1.00 12.25 C ATOM 2261 CG1 VAL A 151 50.869 -22.041 -1.863 1.00 14.31 C ATOM 2262 CG2 VAL A 151 50.370 -23.898 -3.468 1.00 1.21 C ATOM 0 H VAL A 151 49.107 -24.802 -1.246 1.00 72.20 H new ATOM 0 HA VAL A 151 48.151 -22.031 -1.593 1.00 5.31 H new ATOM 0 HB VAL A 151 49.616 -21.909 -3.578 1.00 12.25 H new ATOM 0 HG11 VAL A 151 51.783 -21.830 -2.418 1.00 14.31 H new ATOM 0 HG12 VAL A 151 50.481 -21.116 -1.437 1.00 14.31 H new ATOM 0 HG13 VAL A 151 51.086 -22.747 -1.061 1.00 14.31 H new ATOM 0 HG21 VAL A 151 51.292 -23.662 -4.000 1.00 1.21 H new ATOM 0 HG22 VAL A 151 50.572 -24.654 -2.710 1.00 1.21 H new ATOM 0 HG23 VAL A 151 49.631 -24.280 -4.173 1.00 1.21 H new ATOM 2272 N GLY A 152 47.224 -22.719 -4.072 1.00 64.22 N ATOM 2273 CA GLY A 152 46.257 -23.137 -5.070 1.00 44.41 C ATOM 2274 C GLY A 152 46.177 -22.175 -6.238 1.00 50.43 C ATOM 2275 O GLY A 152 46.917 -21.192 -6.295 1.00 72.13 O ATOM 0 H GLY A 152 47.656 -21.812 -4.248 1.00 64.22 H new ATOM 0 HA2 GLY A 152 46.524 -24.128 -5.437 1.00 44.41 H new ATOM 0 HA3 GLY A 152 45.274 -23.223 -4.606 1.00 44.41 H new ATOM 2279 N LEU A 153 45.278 -22.458 -7.174 1.00 53.24 N ATOM 2280 CA LEU A 153 45.104 -21.610 -8.349 1.00 10.32 C ATOM 2281 C LEU A 153 43.626 -21.337 -8.610 1.00 12.43 C ATOM 2282 O LEU A 153 42.788 -22.230 -8.484 1.00 50.31 O ATOM 2283 CB LEU A 153 45.736 -22.269 -9.576 1.00 51.33 C ATOM 2284 CG LEU A 153 47.060 -22.997 -9.339 1.00 61.34 C ATOM 2285 CD1 LEU A 153 47.433 -23.836 -10.552 1.00 41.31 C ATOM 2286 CD2 LEU A 153 48.165 -22.002 -9.016 1.00 23.13 C ATOM 0 H LEU A 153 44.658 -23.268 -7.143 1.00 53.24 H new ATOM 0 HA LEU A 153 45.602 -20.660 -8.157 1.00 10.32 H new ATOM 0 HB2 LEU A 153 45.022 -22.981 -9.990 1.00 51.33 H new ATOM 0 HB3 LEU A 153 45.897 -21.502 -10.334 1.00 51.33 H new ATOM 0 HG LEU A 153 46.938 -23.664 -8.486 1.00 61.34 H new ATOM 0 HD11 LEU A 153 48.378 -24.346 -10.365 1.00 41.31 H new ATOM 0 HD12 LEU A 153 46.653 -24.574 -10.738 1.00 41.31 H new ATOM 0 HD13 LEU A 153 47.536 -23.190 -11.424 1.00 41.31 H new ATOM 0 HD21 LEU A 153 49.100 -22.538 -8.850 1.00 23.13 H new ATOM 0 HD22 LEU A 153 48.286 -21.310 -9.849 1.00 23.13 H new ATOM 0 HD23 LEU A 153 47.902 -21.445 -8.117 1.00 23.13 H new ATOM 2298 N ARG A 154 43.314 -20.098 -8.975 1.00 51.50 N ATOM 2299 CA ARG A 154 41.937 -19.708 -9.255 1.00 13.41 C ATOM 2300 C ARG A 154 41.750 -19.399 -10.738 1.00 23.12 C ATOM 2301 O ARG A 154 42.237 -18.386 -11.238 1.00 41.32 O ATOM 2302 CB ARG A 154 41.550 -18.488 -8.417 1.00 3.13 C ATOM 2303 CG ARG A 154 41.374 -18.795 -6.939 1.00 21.55 C ATOM 2304 CD ARG A 154 40.064 -18.236 -6.406 1.00 0.20 C ATOM 2305 NE ARG A 154 38.907 -18.954 -6.933 1.00 3.40 N ATOM 2306 CZ ARG A 154 38.502 -20.133 -6.474 1.00 23.23 C ATOM 2307 NH1 ARG A 154 39.158 -20.723 -5.483 1.00 11.33 N ATOM 2308 NH2 ARG A 154 37.440 -20.724 -7.005 1.00 20.50 N ATOM 0 H ARG A 154 43.996 -19.347 -9.084 1.00 51.50 H new ATOM 0 HA ARG A 154 41.288 -20.543 -8.991 1.00 13.41 H new ATOM 0 HB2 ARG A 154 42.316 -17.721 -8.531 1.00 3.13 H new ATOM 0 HB3 ARG A 154 40.621 -18.071 -8.806 1.00 3.13 H new ATOM 0 HG2 ARG A 154 41.400 -19.874 -6.785 1.00 21.55 H new ATOM 0 HG3 ARG A 154 42.207 -18.372 -6.377 1.00 21.55 H new ATOM 0 HD2 ARG A 154 40.061 -18.294 -5.318 1.00 0.20 H new ATOM 0 HD3 ARG A 154 39.986 -17.181 -6.669 1.00 0.20 H new ATOM 0 HE ARG A 154 38.381 -18.527 -7.695 1.00 3.40 H new ATOM 0 HH11 ARG A 154 39.975 -20.271 -5.072 1.00 11.33 H new ATOM 0 HH12 ARG A 154 38.845 -21.628 -5.132 1.00 11.33 H new ATOM 0 HH21 ARG A 154 36.933 -20.273 -7.767 1.00 20.50 H new ATOM 0 HH22 ARG A 154 37.130 -21.629 -6.652 1.00 20.50 H new ATOM 2322 N TYR A 155 41.041 -20.280 -11.434 1.00 74.53 N ATOM 2323 CA TYR A 155 40.792 -20.105 -12.860 1.00 20.13 C ATOM 2324 C TYR A 155 39.301 -20.201 -13.168 1.00 51.23 C ATOM 2325 O TYR A 155 38.484 -20.427 -12.275 1.00 14.13 O ATOM 2326 CB TYR A 155 41.559 -21.154 -13.667 1.00 0.14 C ATOM 2327 CG TYR A 155 43.030 -20.840 -13.824 1.00 73.14 C ATOM 2328 CD1 TYR A 155 43.866 -20.759 -12.717 1.00 54.22 C ATOM 2329 CD2 TYR A 155 43.584 -20.626 -15.080 1.00 54.35 C ATOM 2330 CE1 TYR A 155 45.209 -20.471 -12.857 1.00 2.52 C ATOM 2331 CE2 TYR A 155 44.926 -20.339 -15.229 1.00 64.14 C ATOM 2332 CZ TYR A 155 45.736 -20.262 -14.115 1.00 12.35 C ATOM 2333 OH TYR A 155 47.074 -19.976 -14.258 1.00 32.30 O ATOM 0 H TYR A 155 40.628 -21.123 -11.034 1.00 74.53 H new ATOM 0 HA TYR A 155 41.141 -19.112 -13.144 1.00 20.13 H new ATOM 0 HB2 TYR A 155 41.453 -22.124 -13.181 1.00 0.14 H new ATOM 0 HB3 TYR A 155 41.107 -21.242 -14.655 1.00 0.14 H new ATOM 0 HD1 TYR A 155 43.458 -20.924 -11.731 1.00 54.22 H new ATOM 0 HD2 TYR A 155 42.954 -20.685 -15.955 1.00 54.35 H new ATOM 0 HE1 TYR A 155 45.844 -20.410 -11.986 1.00 2.52 H new ATOM 0 HE2 TYR A 155 45.340 -20.176 -16.213 1.00 64.14 H new ATOM 0 HH TYR A 155 47.284 -19.858 -15.208 1.00 32.30 H new ATOM 2406 N TRP A 161 30.060 -20.501 -13.044 1.00 33.53 N ATOM 2407 CA TRP A 161 30.970 -21.175 -12.124 1.00 73.34 C ATOM 2408 C TRP A 161 32.423 -20.933 -12.522 1.00 14.22 C ATOM 2409 O TRP A 161 32.699 -20.243 -13.503 1.00 3.52 O ATOM 2410 CB TRP A 161 30.681 -22.677 -12.095 1.00 13.22 C ATOM 2411 CG TRP A 161 30.746 -23.320 -13.447 1.00 33.23 C ATOM 2412 CD1 TRP A 161 31.863 -23.790 -14.079 1.00 12.45 C ATOM 2413 CD2 TRP A 161 29.649 -23.564 -14.335 1.00 11.33 C ATOM 2414 NE1 TRP A 161 31.526 -24.310 -15.305 1.00 10.12 N ATOM 2415 CE2 TRP A 161 30.173 -24.185 -15.485 1.00 4.35 C ATOM 2416 CE3 TRP A 161 28.275 -23.320 -14.268 1.00 32.13 C ATOM 2417 CZ2 TRP A 161 29.371 -24.562 -16.558 1.00 50.43 C ATOM 2418 CZ3 TRP A 161 27.479 -23.694 -15.335 1.00 24.44 C ATOM 2419 CH2 TRP A 161 28.028 -24.311 -16.467 1.00 5.23 C ATOM 0 HA TRP A 161 30.811 -20.762 -11.128 1.00 73.34 H new ATOM 0 HB2 TRP A 161 31.397 -23.165 -11.434 1.00 13.22 H new ATOM 0 HB3 TRP A 161 29.691 -22.841 -11.670 1.00 13.22 H new ATOM 0 HD1 TRP A 161 32.864 -23.757 -13.674 1.00 12.45 H new ATOM 0 HE1 TRP A 161 32.177 -24.722 -15.973 1.00 10.12 H new ATOM 0 HE3 TRP A 161 27.842 -22.848 -13.398 1.00 32.13 H new ATOM 0 HZ2 TRP A 161 29.793 -25.036 -17.432 1.00 50.43 H new ATOM 0 HZ3 TRP A 161 26.416 -23.507 -15.295 1.00 24.44 H new ATOM 0 HH2 TRP A 161 27.380 -24.594 -17.283 1.00 5.23 H new ATOM 2430 N MET A 162 33.345 -21.503 -11.754 1.00 73.30 N ATOM 2431 CA MET A 162 34.769 -21.349 -12.029 1.00 31.11 C ATOM 2432 C MET A 162 35.544 -22.586 -11.587 1.00 72.43 C ATOM 2433 O MET A 162 34.976 -23.516 -11.012 1.00 53.34 O ATOM 2434 CB MET A 162 35.315 -20.110 -11.318 1.00 11.20 C ATOM 2435 CG MET A 162 34.945 -20.040 -9.845 1.00 50.12 C ATOM 2436 SD MET A 162 33.540 -18.955 -9.533 1.00 32.23 S ATOM 2437 CE MET A 162 34.241 -17.831 -8.328 1.00 1.52 C ATOM 0 H MET A 162 33.132 -22.075 -10.937 1.00 73.30 H new ATOM 0 HA MET A 162 34.896 -21.228 -13.105 1.00 31.11 H new ATOM 0 HB2 MET A 162 36.401 -20.097 -11.412 1.00 11.20 H new ATOM 0 HB3 MET A 162 34.940 -19.218 -11.821 1.00 11.20 H new ATOM 0 HG2 MET A 162 34.712 -21.042 -9.485 1.00 50.12 H new ATOM 0 HG3 MET A 162 35.805 -19.688 -9.275 1.00 50.12 H new ATOM 0 HE1 MET A 162 33.668 -17.887 -7.402 1.00 1.52 H new ATOM 0 HE2 MET A 162 35.277 -18.108 -8.131 1.00 1.52 H new ATOM 0 HE3 MET A 162 34.205 -16.813 -8.716 1.00 1.52 H new ATOM 2447 N LEU A 163 36.844 -22.592 -11.858 1.00 42.33 N ATOM 2448 CA LEU A 163 37.699 -23.716 -11.489 1.00 40.31 C ATOM 2449 C LEU A 163 38.670 -23.320 -10.381 1.00 33.25 C ATOM 2450 O LEU A 163 39.150 -22.188 -10.337 1.00 71.45 O ATOM 2451 CB LEU A 163 38.475 -24.214 -12.709 1.00 2.34 C ATOM 2452 CG LEU A 163 39.423 -25.389 -12.467 1.00 73.10 C ATOM 2453 CD1 LEU A 163 39.525 -26.258 -13.711 1.00 2.41 C ATOM 2454 CD2 LEU A 163 40.798 -24.888 -12.049 1.00 70.15 C ATOM 0 H LEU A 163 37.330 -21.831 -12.332 1.00 42.33 H new ATOM 0 HA LEU A 163 37.062 -24.519 -11.119 1.00 40.31 H new ATOM 0 HB2 LEU A 163 37.758 -24.504 -13.477 1.00 2.34 H new ATOM 0 HB3 LEU A 163 39.054 -23.382 -13.111 1.00 2.34 H new ATOM 0 HG LEU A 163 39.018 -25.996 -11.657 1.00 73.10 H new ATOM 0 HD11 LEU A 163 40.204 -27.089 -13.520 1.00 2.41 H new ATOM 0 HD12 LEU A 163 38.539 -26.646 -13.965 1.00 2.41 H new ATOM 0 HD13 LEU A 163 39.905 -25.662 -14.541 1.00 2.41 H new ATOM 0 HD21 LEU A 163 41.459 -25.738 -11.881 1.00 70.15 H new ATOM 0 HD22 LEU A 163 41.210 -24.257 -12.837 1.00 70.15 H new ATOM 0 HD23 LEU A 163 40.710 -24.309 -11.129 1.00 70.15 H new ATOM 2466 N ASN A 164 38.955 -24.262 -9.487 1.00 73.01 N ATOM 2467 CA ASN A 164 39.869 -24.012 -8.379 1.00 23.34 C ATOM 2468 C ASN A 164 40.766 -25.222 -8.131 1.00 72.24 C ATOM 2469 O ASN A 164 40.325 -26.366 -8.237 1.00 24.22 O ATOM 2470 CB ASN A 164 39.086 -23.676 -7.109 1.00 54.23 C ATOM 2471 CG ASN A 164 38.609 -24.917 -6.377 1.00 50.24 C ATOM 2472 OD1 ASN A 164 39.037 -25.192 -5.257 1.00 23.11 O ATOM 2473 ND2 ASN A 164 37.719 -25.671 -7.010 1.00 73.24 N ATOM 0 H ASN A 164 38.566 -25.205 -9.509 1.00 73.01 H new ATOM 0 HA ASN A 164 40.498 -23.162 -8.645 1.00 23.34 H new ATOM 0 HB2 ASN A 164 39.715 -23.085 -6.444 1.00 54.23 H new ATOM 0 HB3 ASN A 164 38.227 -23.058 -7.368 1.00 54.23 H new ATOM 0 HD21 ASN A 164 37.362 -26.518 -6.568 1.00 73.24 H new ATOM 0 HD22 ASN A 164 37.392 -25.404 -7.939 1.00 73.24 H new ATOM 2480 N SER A 165 42.026 -24.959 -7.800 1.00 32.41 N ATOM 2481 CA SER A 165 42.987 -26.026 -7.541 1.00 13.03 C ATOM 2482 C SER A 165 43.803 -25.728 -6.287 1.00 52.42 C ATOM 2483 O SER A 165 43.875 -24.584 -5.837 1.00 14.14 O ATOM 2484 CB SER A 165 43.918 -26.205 -8.740 1.00 41.44 C ATOM 2485 OG SER A 165 44.797 -25.101 -8.873 1.00 3.43 O ATOM 0 H SER A 165 42.406 -24.017 -7.705 1.00 32.41 H new ATOM 0 HA SER A 165 42.433 -26.951 -7.381 1.00 13.03 H new ATOM 0 HB2 SER A 165 44.496 -27.122 -8.622 1.00 41.44 H new ATOM 0 HB3 SER A 165 43.328 -26.315 -9.650 1.00 41.44 H new ATOM 0 HG SER A 165 45.717 -25.425 -8.965 1.00 3.43 H new ATOM 2491 N ASP A 166 44.417 -26.764 -5.728 1.00 64.40 N ATOM 2492 CA ASP A 166 45.231 -26.614 -4.527 1.00 72.54 C ATOM 2493 C ASP A 166 46.513 -27.435 -4.634 1.00 33.43 C ATOM 2494 O ASP A 166 46.590 -28.389 -5.408 1.00 72.33 O ATOM 2495 CB ASP A 166 44.438 -27.042 -3.292 1.00 21.21 C ATOM 2496 CG ASP A 166 43.109 -26.320 -3.178 1.00 64.03 C ATOM 2497 OD1 ASP A 166 42.934 -25.552 -2.210 1.00 12.51 O ATOM 2498 OD2 ASP A 166 42.246 -26.524 -4.057 1.00 45.12 O ATOM 0 H ASP A 166 44.367 -27.717 -6.087 1.00 64.40 H new ATOM 0 HA ASP A 166 45.501 -25.563 -4.429 1.00 72.54 H new ATOM 0 HB2 ASP A 166 44.262 -28.117 -3.331 1.00 21.21 H new ATOM 0 HB3 ASP A 166 45.031 -26.849 -2.398 1.00 21.21 H new ATOM 2503 N VAL A 167 47.518 -27.059 -3.849 1.00 54.13 N ATOM 2504 CA VAL A 167 48.796 -27.760 -3.855 1.00 51.21 C ATOM 2505 C VAL A 167 49.473 -27.679 -2.491 1.00 21.11 C ATOM 2506 O VAL A 167 49.484 -26.626 -1.854 1.00 3.15 O ATOM 2507 CB VAL A 167 49.747 -27.185 -4.922 1.00 52.12 C ATOM 2508 CG1 VAL A 167 51.087 -27.904 -4.886 1.00 34.11 C ATOM 2509 CG2 VAL A 167 49.117 -27.281 -6.304 1.00 22.33 C ATOM 0 H VAL A 167 47.471 -26.273 -3.201 1.00 54.13 H new ATOM 0 HA VAL A 167 48.584 -28.803 -4.092 1.00 51.21 H new ATOM 0 HB VAL A 167 49.921 -26.132 -4.700 1.00 52.12 H new ATOM 0 HG11 VAL A 167 51.746 -27.484 -5.646 1.00 34.11 H new ATOM 0 HG12 VAL A 167 51.541 -27.778 -3.903 1.00 34.11 H new ATOM 0 HG13 VAL A 167 50.936 -28.965 -5.083 1.00 34.11 H new ATOM 0 HG21 VAL A 167 49.802 -26.870 -7.046 1.00 22.33 H new ATOM 0 HG22 VAL A 167 48.912 -28.325 -6.539 1.00 22.33 H new ATOM 0 HG23 VAL A 167 48.185 -26.716 -6.319 1.00 22.33 H new ATOM 2519 N ARG A 168 50.037 -28.799 -2.049 1.00 54.44 N ATOM 2520 CA ARG A 168 50.715 -28.856 -0.761 1.00 10.01 C ATOM 2521 C ARG A 168 52.035 -29.614 -0.873 1.00 54.14 C ATOM 2522 O ARG A 168 52.056 -30.795 -1.221 1.00 73.44 O ATOM 2523 CB ARG A 168 49.818 -29.524 0.283 1.00 63.34 C ATOM 2524 CG ARG A 168 48.573 -28.720 0.620 1.00 73.44 C ATOM 2525 CD ARG A 168 47.402 -29.627 0.970 1.00 24.02 C ATOM 2526 NE ARG A 168 47.407 -30.005 2.380 1.00 33.14 N ATOM 2527 CZ ARG A 168 46.361 -30.542 3.001 1.00 43.22 C ATOM 2528 NH1 ARG A 168 45.235 -30.763 2.338 1.00 42.33 N ATOM 2529 NH2 ARG A 168 46.443 -30.859 4.286 1.00 34.14 N ATOM 0 H ARG A 168 50.037 -29.679 -2.565 1.00 54.44 H new ATOM 0 HA ARG A 168 50.929 -27.834 -0.447 1.00 10.01 H new ATOM 0 HB2 ARG A 168 49.518 -30.506 -0.083 1.00 63.34 H new ATOM 0 HB3 ARG A 168 50.394 -29.686 1.194 1.00 63.34 H new ATOM 0 HG2 ARG A 168 48.783 -28.056 1.458 1.00 73.44 H new ATOM 0 HG3 ARG A 168 48.305 -28.089 -0.228 1.00 73.44 H new ATOM 0 HD2 ARG A 168 46.467 -29.119 0.734 1.00 24.02 H new ATOM 0 HD3 ARG A 168 47.442 -30.525 0.354 1.00 24.02 H new ATOM 0 HE ARG A 168 48.259 -29.849 2.918 1.00 33.14 H new ATOM 0 HH11 ARG A 168 45.169 -30.521 1.349 1.00 42.33 H new ATOM 0 HH12 ARG A 168 44.434 -31.175 2.816 1.00 42.33 H new ATOM 0 HH21 ARG A 168 47.309 -30.691 4.799 1.00 34.14 H new ATOM 0 HH22 ARG A 168 45.640 -31.271 4.762 1.00 34.14 H new ATOM 2925 N PHE A 194 53.898 -34.994 -2.952 1.00 24.22 N ATOM 2926 CA PHE A 194 53.085 -33.854 -2.544 1.00 23.11 C ATOM 2927 C PHE A 194 51.607 -34.117 -2.813 1.00 34.52 C ATOM 2928 O PHE A 194 51.247 -35.116 -3.435 1.00 74.45 O ATOM 2929 CB PHE A 194 53.533 -32.592 -3.282 1.00 64.21 C ATOM 2930 CG PHE A 194 53.722 -32.795 -4.758 1.00 72.35 C ATOM 2931 CD1 PHE A 194 52.641 -33.095 -5.573 1.00 32.14 C ATOM 2932 CD2 PHE A 194 54.978 -32.687 -5.333 1.00 13.24 C ATOM 2933 CE1 PHE A 194 52.811 -33.284 -6.931 1.00 63.23 C ATOM 2934 CE2 PHE A 194 55.154 -32.874 -6.691 1.00 2.02 C ATOM 2935 CZ PHE A 194 54.069 -33.172 -7.491 1.00 61.30 C ATOM 0 HA PHE A 194 53.220 -33.707 -1.472 1.00 23.11 H new ATOM 0 HB2 PHE A 194 52.794 -31.807 -3.123 1.00 64.21 H new ATOM 0 HB3 PHE A 194 54.470 -32.241 -2.849 1.00 64.21 H new ATOM 0 HD1 PHE A 194 51.655 -33.182 -5.141 1.00 32.14 H new ATOM 0 HD2 PHE A 194 55.830 -32.454 -4.712 1.00 13.24 H new ATOM 0 HE1 PHE A 194 51.961 -33.519 -7.554 1.00 63.23 H new ATOM 0 HE2 PHE A 194 56.139 -32.787 -7.126 1.00 2.02 H new ATOM 0 HZ PHE A 194 54.203 -33.317 -8.553 1.00 61.30 H new ATOM 2945 N ILE A 195 50.756 -33.214 -2.339 1.00 50.41 N ATOM 2946 CA ILE A 195 49.317 -33.346 -2.528 1.00 72.45 C ATOM 2947 C ILE A 195 48.775 -32.236 -3.423 1.00 70.32 C ATOM 2948 O ILE A 195 49.198 -31.084 -3.325 1.00 51.23 O ATOM 2949 CB ILE A 195 48.567 -33.319 -1.184 1.00 63.01 C ATOM 2950 CG1 ILE A 195 49.141 -34.371 -0.233 1.00 2.33 C ATOM 2951 CG2 ILE A 195 47.079 -33.550 -1.402 1.00 32.12 C ATOM 2952 CD1 ILE A 195 50.284 -33.859 0.615 1.00 25.01 C ATOM 0 H ILE A 195 51.038 -32.382 -1.821 1.00 50.41 H new ATOM 0 HA ILE A 195 49.150 -34.310 -3.008 1.00 72.45 H new ATOM 0 HB ILE A 195 48.700 -32.336 -0.731 1.00 63.01 H new ATOM 0 HG12 ILE A 195 48.346 -34.730 0.421 1.00 2.33 H new ATOM 0 HG13 ILE A 195 49.485 -35.226 -0.815 1.00 2.33 H new ATOM 0 HG21 ILE A 195 46.563 -33.528 -0.442 1.00 32.12 H new ATOM 0 HG22 ILE A 195 46.680 -32.767 -2.047 1.00 32.12 H new ATOM 0 HG23 ILE A 195 46.927 -34.521 -1.874 1.00 32.12 H new ATOM 0 HD11 ILE A 195 50.641 -34.658 1.265 1.00 25.01 H new ATOM 0 HD12 ILE A 195 51.096 -33.527 -0.031 1.00 25.01 H new ATOM 0 HD13 ILE A 195 49.939 -33.023 1.224 1.00 25.01 H new ATOM 2964 N LEU A 196 47.836 -32.590 -4.293 1.00 71.31 N ATOM 2965 CA LEU A 196 47.234 -31.624 -5.205 1.00 72.31 C ATOM 2966 C LEU A 196 45.734 -31.865 -5.342 1.00 3.22 C ATOM 2967 O LEU A 196 45.295 -32.994 -5.562 1.00 14.23 O ATOM 2968 CB LEU A 196 47.902 -31.703 -6.579 1.00 32.13 C ATOM 2969 CG LEU A 196 47.637 -32.978 -7.381 1.00 35.22 C ATOM 2970 CD1 LEU A 196 46.424 -32.799 -8.281 1.00 71.34 C ATOM 2971 CD2 LEU A 196 48.861 -33.356 -8.201 1.00 43.30 C ATOM 0 H LEU A 196 47.475 -33.539 -4.386 1.00 71.31 H new ATOM 0 HA LEU A 196 47.387 -30.628 -4.791 1.00 72.31 H new ATOM 0 HB2 LEU A 196 47.572 -30.850 -7.171 1.00 32.13 H new ATOM 0 HB3 LEU A 196 48.979 -31.600 -6.444 1.00 32.13 H new ATOM 0 HG LEU A 196 47.429 -33.788 -6.682 1.00 35.22 H new ATOM 0 HD11 LEU A 196 46.250 -33.716 -8.844 1.00 71.34 H new ATOM 0 HD12 LEU A 196 45.548 -32.576 -7.671 1.00 71.34 H new ATOM 0 HD13 LEU A 196 46.603 -31.976 -8.973 1.00 71.34 H new ATOM 0 HD21 LEU A 196 48.654 -34.265 -8.765 1.00 43.30 H new ATOM 0 HD22 LEU A 196 49.100 -32.547 -8.891 1.00 43.30 H new ATOM 0 HD23 LEU A 196 49.707 -33.527 -7.535 1.00 43.30 H new ATOM 2983 N SER A 197 44.953 -30.797 -5.211 1.00 62.12 N ATOM 2984 CA SER A 197 43.502 -30.893 -5.318 1.00 65.42 C ATOM 2985 C SER A 197 42.993 -30.108 -6.523 1.00 23.12 C ATOM 2986 O SER A 197 43.615 -29.134 -6.951 1.00 52.22 O ATOM 2987 CB SER A 197 42.840 -30.376 -4.040 1.00 41.45 C ATOM 2988 OG SER A 197 42.153 -29.159 -4.279 1.00 72.04 O ATOM 0 H SER A 197 45.301 -29.855 -5.031 1.00 62.12 H new ATOM 0 HA SER A 197 43.241 -31.942 -5.454 1.00 65.42 H new ATOM 0 HB2 SER A 197 42.143 -31.123 -3.660 1.00 41.45 H new ATOM 0 HB3 SER A 197 43.597 -30.225 -3.270 1.00 41.45 H new ATOM 0 HG SER A 197 42.071 -28.659 -3.440 1.00 72.04 H new ATOM 2994 N LEU A 198 41.860 -30.538 -7.065 1.00 51.52 N ATOM 2995 CA LEU A 198 41.265 -29.875 -8.222 1.00 25.01 C ATOM 2996 C LEU A 198 39.744 -29.967 -8.179 1.00 11.23 C ATOM 2997 O LEU A 198 39.184 -30.989 -7.783 1.00 14.13 O ATOM 2998 CB LEU A 198 41.789 -30.499 -9.516 1.00 65.31 C ATOM 2999 CG LEU A 198 41.395 -29.788 -10.812 1.00 2.45 C ATOM 3000 CD1 LEU A 198 42.134 -28.465 -10.940 1.00 45.03 C ATOM 3001 CD2 LEU A 198 41.674 -30.677 -12.014 1.00 43.40 C ATOM 0 H LEU A 198 41.334 -31.342 -6.723 1.00 51.52 H new ATOM 0 HA LEU A 198 41.548 -28.823 -8.193 1.00 25.01 H new ATOM 0 HB2 LEU A 198 42.877 -30.538 -9.463 1.00 65.31 H new ATOM 0 HB3 LEU A 198 41.436 -31.529 -9.568 1.00 65.31 H new ATOM 0 HG LEU A 198 40.325 -29.581 -10.780 1.00 2.45 H new ATOM 0 HD11 LEU A 198 41.841 -27.973 -11.868 1.00 45.03 H new ATOM 0 HD12 LEU A 198 41.883 -27.824 -10.095 1.00 45.03 H new ATOM 0 HD13 LEU A 198 43.209 -28.648 -10.950 1.00 45.03 H new ATOM 0 HD21 LEU A 198 41.388 -30.155 -12.927 1.00 43.40 H new ATOM 0 HD22 LEU A 198 42.737 -30.916 -12.051 1.00 43.40 H new ATOM 0 HD23 LEU A 198 41.098 -31.598 -11.927 1.00 43.40 H new ATOM 3013 N GLY A 199 39.079 -28.892 -8.592 1.00 12.10 N ATOM 3014 CA GLY A 199 37.628 -28.872 -8.595 1.00 23.13 C ATOM 3015 C GLY A 199 37.067 -27.584 -9.162 1.00 12.02 C ATOM 3016 O GLY A 199 37.712 -26.921 -9.973 1.00 24.12 O ATOM 0 H GLY A 199 39.520 -28.034 -8.925 1.00 12.10 H new ATOM 0 HA2 GLY A 199 37.257 -29.714 -9.179 1.00 23.13 H new ATOM 0 HA3 GLY A 199 37.264 -29.006 -7.576 1.00 23.13 H new ATOM 3020 N ALA A 200 35.859 -27.228 -8.736 1.00 1.43 N ATOM 3021 CA ALA A 200 35.211 -26.010 -9.206 1.00 23.10 C ATOM 3022 C ALA A 200 34.687 -25.180 -8.038 1.00 62.11 C ATOM 3023 O ALA A 200 34.840 -25.560 -6.877 1.00 34.21 O ATOM 3024 CB ALA A 200 34.078 -26.350 -10.163 1.00 62.51 C ATOM 0 H ALA A 200 35.310 -27.766 -8.066 1.00 1.43 H new ATOM 0 HA ALA A 200 35.954 -25.415 -9.736 1.00 23.10 H new ATOM 0 HB1 ALA A 200 33.603 -25.431 -10.506 1.00 62.51 H new ATOM 0 HB2 ALA A 200 34.476 -26.894 -11.019 1.00 62.51 H new ATOM 0 HB3 ALA A 200 33.342 -26.969 -9.650 1.00 62.51 H new ATOM 3030 N SER A 201 34.071 -24.047 -8.353 1.00 52.53 N ATOM 3031 CA SER A 201 33.528 -23.160 -7.330 1.00 61.12 C ATOM 3032 C SER A 201 32.554 -22.157 -7.940 1.00 61.33 C ATOM 3033 O SER A 201 32.595 -21.886 -9.140 1.00 31.23 O ATOM 3034 CB SER A 201 34.660 -22.419 -6.615 1.00 60.43 C ATOM 3035 OG SER A 201 34.148 -21.504 -5.663 1.00 24.55 O ATOM 0 H SER A 201 33.935 -23.720 -9.310 1.00 52.53 H new ATOM 0 HA SER A 201 32.987 -23.770 -6.606 1.00 61.12 H new ATOM 0 HB2 SER A 201 35.313 -23.137 -6.119 1.00 60.43 H new ATOM 0 HB3 SER A 201 35.269 -21.886 -7.346 1.00 60.43 H new ATOM 0 HG SER A 201 33.295 -21.837 -5.315 1.00 24.55 H new ATOM 3041 N TYR A 202 31.677 -21.611 -7.105 1.00 30.42 N ATOM 3042 CA TYR A 202 30.690 -20.640 -7.561 1.00 13.04 C ATOM 3043 C TYR A 202 30.467 -19.556 -6.511 1.00 1.33 C ATOM 3044 O TYR A 202 30.167 -19.848 -5.352 1.00 61.55 O ATOM 3045 CB TYR A 202 29.366 -21.338 -7.878 1.00 32.10 C ATOM 3046 CG TYR A 202 28.927 -22.317 -6.812 1.00 73.22 C ATOM 3047 CD1 TYR A 202 29.414 -23.619 -6.794 1.00 34.21 C ATOM 3048 CD2 TYR A 202 28.026 -21.941 -5.824 1.00 33.34 C ATOM 3049 CE1 TYR A 202 29.015 -24.517 -5.823 1.00 54.34 C ATOM 3050 CE2 TYR A 202 27.622 -22.832 -4.848 1.00 43.44 C ATOM 3051 CZ TYR A 202 28.119 -24.119 -4.852 1.00 1.30 C ATOM 3052 OH TYR A 202 27.720 -25.009 -3.882 1.00 72.24 O ATOM 0 H TYR A 202 31.630 -21.824 -6.109 1.00 30.42 H new ATOM 0 HA TYR A 202 31.072 -20.170 -8.467 1.00 13.04 H new ATOM 0 HB2 TYR A 202 28.590 -20.584 -8.009 1.00 32.10 H new ATOM 0 HB3 TYR A 202 29.461 -21.866 -8.827 1.00 32.10 H new ATOM 0 HD1 TYR A 202 30.116 -23.934 -7.552 1.00 34.21 H new ATOM 0 HD2 TYR A 202 27.634 -20.935 -5.818 1.00 33.34 H new ATOM 0 HE1 TYR A 202 29.402 -25.525 -5.824 1.00 54.34 H new ATOM 0 HE2 TYR A 202 26.921 -22.523 -4.087 1.00 43.44 H new ATOM 0 HH TYR A 202 27.088 -24.570 -3.275 1.00 72.24 H new ATOM 3062 N VAL A 203 30.614 -18.302 -6.924 1.00 44.54 N ATOM 3063 CA VAL A 203 30.428 -17.172 -6.022 1.00 61.20 C ATOM 3064 C VAL A 203 28.962 -16.763 -5.949 1.00 52.22 C ATOM 3065 O VAL A 203 28.252 -16.778 -6.955 1.00 15.11 O ATOM 3066 CB VAL A 203 31.268 -15.957 -6.462 1.00 72.21 C ATOM 3067 CG1 VAL A 203 30.808 -15.455 -7.822 1.00 74.12 C ATOM 3068 CG2 VAL A 203 31.189 -14.851 -5.422 1.00 12.35 C ATOM 0 H VAL A 203 30.862 -18.042 -7.879 1.00 44.54 H new ATOM 0 HA VAL A 203 30.761 -17.496 -5.036 1.00 61.20 H new ATOM 0 HB VAL A 203 32.309 -16.269 -6.549 1.00 72.21 H new ATOM 0 HG11 VAL A 203 31.412 -14.597 -8.117 1.00 74.12 H new ATOM 0 HG12 VAL A 203 30.921 -16.249 -8.560 1.00 74.12 H new ATOM 0 HG13 VAL A 203 29.761 -15.159 -7.765 1.00 74.12 H new ATOM 0 HG21 VAL A 203 31.788 -14.001 -5.749 1.00 12.35 H new ATOM 0 HG22 VAL A 203 30.152 -14.539 -5.301 1.00 12.35 H new ATOM 0 HG23 VAL A 203 31.571 -15.219 -4.470 1.00 12.35 H new ATOM 3078 N PHE A 204 28.514 -16.396 -4.753 1.00 61.53 N ATOM 3079 CA PHE A 204 27.130 -15.983 -4.549 1.00 25.03 C ATOM 3080 C PHE A 204 27.053 -14.799 -3.589 1.00 51.23 C ATOM 3081 O PHE A 204 27.895 -14.644 -2.705 1.00 25.30 O ATOM 3082 CB PHE A 204 26.302 -17.149 -4.005 1.00 21.32 C ATOM 3083 CG PHE A 204 24.825 -16.989 -4.224 1.00 22.31 C ATOM 3084 CD1 PHE A 204 24.246 -17.358 -5.427 1.00 21.21 C ATOM 3085 CD2 PHE A 204 24.015 -16.471 -3.226 1.00 5.34 C ATOM 3086 CE1 PHE A 204 22.887 -17.211 -5.632 1.00 21.22 C ATOM 3087 CE2 PHE A 204 22.656 -16.321 -3.425 1.00 23.44 C ATOM 3088 CZ PHE A 204 22.091 -16.693 -4.629 1.00 23.31 C ATOM 0 H PHE A 204 29.089 -16.376 -3.911 1.00 61.53 H new ATOM 0 HA PHE A 204 26.723 -15.676 -5.512 1.00 25.03 H new ATOM 0 HB2 PHE A 204 26.634 -18.072 -4.480 1.00 21.32 H new ATOM 0 HB3 PHE A 204 26.494 -17.253 -2.937 1.00 21.32 H new ATOM 0 HD1 PHE A 204 24.864 -17.765 -6.214 1.00 21.21 H new ATOM 0 HD2 PHE A 204 24.451 -16.181 -2.281 1.00 5.34 H new ATOM 0 HE1 PHE A 204 22.448 -17.501 -6.575 1.00 21.22 H new ATOM 0 HE2 PHE A 204 22.036 -15.913 -2.640 1.00 23.44 H new ATOM 0 HZ PHE A 204 21.029 -16.579 -4.786 1.00 23.31 H new ATOM 3098 N LYS A 205 26.036 -13.964 -3.771 1.00 13.31 N ATOM 3099 CA LYS A 205 25.846 -12.793 -2.923 1.00 32.21 C ATOM 3100 C LYS A 205 24.495 -12.847 -2.216 1.00 42.25 C ATOM 3101 O LYS A 205 23.459 -12.542 -2.810 1.00 1.41 O ATOM 3102 CB LYS A 205 25.947 -11.513 -3.755 1.00 52.55 C ATOM 3103 CG LYS A 205 25.170 -11.572 -5.059 1.00 72.55 C ATOM 3104 CD LYS A 205 25.395 -10.327 -5.900 1.00 4.31 C ATOM 3105 CE LYS A 205 24.472 -10.296 -7.109 1.00 41.32 C ATOM 3106 NZ LYS A 205 24.748 -11.419 -8.046 1.00 54.22 N ATOM 0 H LYS A 205 25.330 -14.076 -4.499 1.00 13.31 H new ATOM 0 HA LYS A 205 26.632 -12.791 -2.168 1.00 32.21 H new ATOM 0 HB2 LYS A 205 25.582 -10.674 -3.162 1.00 52.55 H new ATOM 0 HB3 LYS A 205 26.996 -11.315 -3.975 1.00 52.55 H new ATOM 0 HG2 LYS A 205 25.473 -12.453 -5.624 1.00 72.55 H new ATOM 0 HG3 LYS A 205 24.107 -11.680 -4.845 1.00 72.55 H new ATOM 0 HD2 LYS A 205 25.227 -9.439 -5.290 1.00 4.31 H new ATOM 0 HD3 LYS A 205 26.433 -10.294 -6.232 1.00 4.31 H new ATOM 0 HE2 LYS A 205 23.435 -10.347 -6.776 1.00 41.32 H new ATOM 0 HE3 LYS A 205 24.592 -9.348 -7.633 1.00 41.32 H new ATOM 0 HZ1 LYS A 205 24.145 -11.324 -8.888 1.00 54.22 H new ATOM 0 HZ2 LYS A 205 25.748 -11.396 -8.331 1.00 54.22 H new ATOM 0 HZ3 LYS A 205 24.544 -12.323 -7.574 1.00 54.22 H new