USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 915 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 123 MET CE :methyl 180:sc= -0.124 (180deg=-0.0887) USER MOD Set 1.2: A 126 MET CE :methyl 171:sc= -0.321 (180deg=-0.562) USER MOD Set 2.1: A 112 MET CE :methyl -152:sc= -0.844 (180deg=-2.32!) USER MOD Set 2.2: A 113 MET CE :methyl 133:sc= -0.799 (180deg=-1.3) USER MOD Set 3.1: A 31 ASN : amide:sc= -5.29! C(o=-4.2!,f=-4.9!) USER MOD Set 3.2: A 106 TYR OH : rot -3:sc= 1.11 USER MOD Single : A 20 LYS NZ :NH3+ -121:sc= 0.335 (180deg=-0.436) USER MOD Single : A 22 GLN : amide:sc= 0.0225 K(o=0.022,f=-1) USER MOD Single : A 23 GLN : amide:sc= -3.24 X(o=-3.2,f=-3.6!) USER MOD Single : A 32 LYS NZ :NH3+ 167:sc= 1.27 (180deg=1.15) USER MOD Single : A 33 GLN : amide:sc= -0.315 X(o=-0.31,f=-0.24) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 TYR OH : rot 15:sc= -1.44! USER MOD Single : A 41 SER OG : rot 11:sc= 1.19 USER MOD Single : A 42 SER OG : rot -26:sc= 1.2 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -137:sc= 1.24 (180deg=0.405) USER MOD Single : A 54 LYS NZ :NH3+ -162:sc= 2.02 (180deg=1.05) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot -138:sc= 1.28 USER MOD Single : A 58 MET CE :methyl 164:sc= -1.46 (180deg=-3.08) USER MOD Single : A 63 ASN : amide:sc= 0.439 K(o=0.44,f=-4.3!) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= -0.0121 USER MOD Single : A 74 LYS NZ :NH3+ -175:sc= 1.29 (180deg=1.23) USER MOD Single : A 76 MET CE :methyl 178:sc= -1.53 (180deg=-1.62) USER MOD Single : A 79 LYS NZ :NH3+ 168:sc= 0.489 (180deg=0.25) USER MOD Single : A 84 LYS NZ :NH3+ -169:sc= 0.952 (180deg=0.853) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 HIS : no HD1:sc= -0.0343 X(o=-0.034,f=-0.4) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 SER OG : rot -80:sc= 1.62 USER MOD Single : A 98 SER OG : rot -11:sc= 1.04 USER MOD Single : A 100 SER OG : rot 2:sc= 0.47 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= -1.2 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 180:sc= -0.0322 USER MOD Single : A 122 LYS NZ :NH3+ -166:sc= -0.0572 (180deg=-0.267) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 245 N LEU A 18 13.461 1.965 -9.709 1.00 12.11 N ATOM 246 CA LEU A 18 12.702 1.332 -10.807 1.00 23.12 C ATOM 247 C LEU A 18 11.759 0.221 -10.352 1.00 3.35 C ATOM 248 O LEU A 18 11.044 -0.355 -11.167 1.00 11.25 O ATOM 249 CB LEU A 18 13.579 0.866 -11.997 1.00 44.52 C ATOM 250 CG LEU A 18 14.133 1.954 -12.952 1.00 31.23 C ATOM 251 CD1 LEU A 18 13.012 2.778 -13.564 1.00 2.43 C ATOM 252 CD2 LEU A 18 15.148 2.846 -12.279 1.00 21.20 C ATOM 0 HA LEU A 18 12.077 2.144 -11.177 1.00 23.12 H new ATOM 0 HB2 LEU A 18 14.426 0.312 -11.593 1.00 44.52 H new ATOM 0 HB3 LEU A 18 12.993 0.165 -12.591 1.00 44.52 H new ATOM 0 HG LEU A 18 14.648 1.428 -13.756 1.00 31.23 H new ATOM 0 HD11 LEU A 18 13.435 3.532 -14.228 1.00 2.43 H new ATOM 0 HD12 LEU A 18 12.349 2.125 -14.132 1.00 2.43 H new ATOM 0 HD13 LEU A 18 12.447 3.269 -12.772 1.00 2.43 H new ATOM 0 HD21 LEU A 18 15.506 3.591 -12.990 1.00 21.20 H new ATOM 0 HD22 LEU A 18 14.685 3.348 -11.429 1.00 21.20 H new ATOM 0 HD23 LEU A 18 15.988 2.244 -11.931 1.00 21.20 H new ATOM 264 N LEU A 19 11.762 -0.082 -9.063 1.00 74.04 N ATOM 265 CA LEU A 19 10.794 -1.011 -8.501 1.00 45.20 C ATOM 266 C LEU A 19 9.410 -0.438 -8.686 1.00 52.14 C ATOM 267 O LEU A 19 8.554 -1.067 -9.270 1.00 15.10 O ATOM 268 CB LEU A 19 11.059 -1.244 -7.020 1.00 20.42 C ATOM 269 CG LEU A 19 12.340 -1.983 -6.678 1.00 64.32 C ATOM 270 CD1 LEU A 19 12.522 -2.021 -5.184 1.00 42.31 C ATOM 271 CD2 LEU A 19 12.290 -3.402 -7.231 1.00 1.12 C ATOM 0 H LEU A 19 12.423 0.301 -8.387 1.00 74.04 H new ATOM 0 HA LEU A 19 10.880 -1.969 -9.014 1.00 45.20 H new ATOM 0 HB2 LEU A 19 11.077 -0.276 -6.519 1.00 20.42 H new ATOM 0 HB3 LEU A 19 10.220 -1.802 -6.605 1.00 20.42 H new ATOM 0 HG LEU A 19 13.183 -1.459 -7.129 1.00 64.32 H new ATOM 0 HD11 LEU A 19 13.443 -2.552 -4.943 1.00 42.31 H new ATOM 0 HD12 LEU A 19 12.579 -1.003 -4.798 1.00 42.31 H new ATOM 0 HD13 LEU A 19 11.676 -2.535 -4.727 1.00 42.31 H new ATOM 0 HD21 LEU A 19 13.214 -3.923 -6.980 1.00 1.12 H new ATOM 0 HD22 LEU A 19 11.444 -3.933 -6.795 1.00 1.12 H new ATOM 0 HD23 LEU A 19 12.176 -3.366 -8.314 1.00 1.12 H new ATOM 283 N LYS A 20 9.257 0.806 -8.254 1.00 71.32 N ATOM 284 CA LYS A 20 7.999 1.565 -8.328 1.00 32.42 C ATOM 285 C LYS A 20 7.396 1.464 -9.740 1.00 14.42 C ATOM 286 O LYS A 20 6.206 1.192 -9.908 1.00 21.35 O ATOM 287 CB LYS A 20 8.342 3.043 -8.040 1.00 0.30 C ATOM 288 CG LYS A 20 7.203 4.070 -8.155 1.00 11.12 C ATOM 289 CD LYS A 20 6.363 4.251 -6.886 1.00 52.51 C ATOM 290 CE LYS A 20 5.586 3.028 -6.470 1.00 21.51 C ATOM 291 NZ LYS A 20 4.738 3.330 -5.298 1.00 14.24 N ATOM 0 H LYS A 20 10.019 1.336 -7.830 1.00 71.32 H new ATOM 0 HA LYS A 20 7.278 1.170 -7.612 1.00 32.42 H new ATOM 0 HB2 LYS A 20 8.749 3.104 -7.031 1.00 0.30 H new ATOM 0 HB3 LYS A 20 9.137 3.344 -8.723 1.00 0.30 H new ATOM 0 HG2 LYS A 20 7.630 5.034 -8.430 1.00 11.12 H new ATOM 0 HG3 LYS A 20 6.544 3.769 -8.969 1.00 11.12 H new ATOM 0 HD2 LYS A 20 7.022 4.543 -6.068 1.00 52.51 H new ATOM 0 HD3 LYS A 20 5.665 5.074 -7.042 1.00 52.51 H new ATOM 0 HE2 LYS A 20 4.965 2.685 -7.298 1.00 21.51 H new ATOM 0 HE3 LYS A 20 6.273 2.217 -6.230 1.00 21.51 H new ATOM 0 HZ1 LYS A 20 4.996 2.701 -4.511 1.00 14.24 H new ATOM 0 HZ2 LYS A 20 4.881 4.319 -5.012 1.00 14.24 H new ATOM 0 HZ3 LYS A 20 3.739 3.182 -5.545 1.00 14.24 H new ATOM 305 N ALA A 21 8.243 1.650 -10.732 1.00 42.43 N ATOM 306 CA ALA A 21 7.828 1.658 -12.112 1.00 22.44 C ATOM 307 C ALA A 21 7.488 0.258 -12.643 1.00 34.31 C ATOM 308 O ALA A 21 6.497 0.092 -13.337 1.00 70.31 O ATOM 309 CB ALA A 21 8.887 2.321 -12.966 1.00 42.30 C ATOM 0 H ALA A 21 9.243 1.800 -10.598 1.00 42.43 H new ATOM 0 HA ALA A 21 6.905 2.235 -12.169 1.00 22.44 H new ATOM 0 HB1 ALA A 21 8.566 2.323 -14.008 1.00 42.30 H new ATOM 0 HB2 ALA A 21 9.035 3.347 -12.630 1.00 42.30 H new ATOM 0 HB3 ALA A 21 9.824 1.771 -12.876 1.00 42.30 H new ATOM 315 N GLN A 22 8.294 -0.744 -12.300 1.00 53.15 N ATOM 316 CA GLN A 22 8.070 -2.112 -12.812 1.00 33.32 C ATOM 317 C GLN A 22 6.871 -2.759 -12.121 1.00 45.41 C ATOM 318 O GLN A 22 6.188 -3.633 -12.690 1.00 31.03 O ATOM 319 CB GLN A 22 9.333 -2.985 -12.666 1.00 73.32 C ATOM 320 CG GLN A 22 9.722 -3.334 -11.243 1.00 50.31 C ATOM 321 CD GLN A 22 11.057 -4.036 -11.166 1.00 13.44 C ATOM 322 OE1 GLN A 22 11.145 -5.249 -11.249 1.00 41.24 O ATOM 323 NE2 GLN A 22 12.099 -3.270 -10.991 1.00 54.12 N ATOM 0 H GLN A 22 9.098 -0.647 -11.680 1.00 53.15 H new ATOM 0 HA GLN A 22 7.849 -2.036 -13.877 1.00 33.32 H new ATOM 0 HB2 GLN A 22 9.180 -3.911 -13.220 1.00 73.32 H new ATOM 0 HB3 GLN A 22 10.169 -2.467 -13.136 1.00 73.32 H new ATOM 0 HG2 GLN A 22 9.759 -2.423 -10.646 1.00 50.31 H new ATOM 0 HG3 GLN A 22 8.954 -3.971 -10.805 1.00 50.31 H new ATOM 0 HE21 GLN A 22 11.983 -2.259 -10.927 1.00 54.12 H new ATOM 0 HE22 GLN A 22 13.029 -3.683 -10.919 1.00 54.12 H new ATOM 332 N GLN A 23 6.632 -2.337 -10.885 1.00 3.34 N ATOM 333 CA GLN A 23 5.527 -2.828 -10.093 1.00 15.55 C ATOM 334 C GLN A 23 4.199 -2.401 -10.638 1.00 41.21 C ATOM 335 O GLN A 23 3.195 -3.044 -10.350 1.00 73.31 O ATOM 336 CB GLN A 23 5.626 -2.378 -8.658 1.00 43.14 C ATOM 337 CG GLN A 23 6.768 -2.966 -7.884 1.00 62.23 C ATOM 338 CD GLN A 23 6.760 -2.460 -6.491 1.00 70.42 C ATOM 339 OE1 GLN A 23 7.383 -1.457 -6.168 1.00 73.02 O ATOM 340 NE2 GLN A 23 6.019 -3.109 -5.675 1.00 75.41 N ATOM 0 H GLN A 23 7.206 -1.641 -10.408 1.00 3.34 H new ATOM 0 HA GLN A 23 5.594 -3.915 -10.140 1.00 15.55 H new ATOM 0 HB2 GLN A 23 5.716 -1.292 -8.640 1.00 43.14 H new ATOM 0 HB3 GLN A 23 4.695 -2.629 -8.150 1.00 43.14 H new ATOM 0 HG2 GLN A 23 6.694 -4.053 -7.883 1.00 62.23 H new ATOM 0 HG3 GLN A 23 7.712 -2.711 -8.365 1.00 62.23 H new ATOM 0 HE21 GLN A 23 5.519 -3.940 -5.991 1.00 75.41 H new ATOM 0 HE22 GLN A 23 5.928 -2.796 -4.709 1.00 75.41 H new ATOM 349 N GLU A 24 4.187 -1.325 -11.425 1.00 31.10 N ATOM 350 CA GLU A 24 2.953 -0.822 -11.994 1.00 72.42 C ATOM 351 C GLU A 24 2.292 -1.938 -12.793 1.00 71.21 C ATOM 352 O GLU A 24 1.137 -2.283 -12.547 1.00 44.21 O ATOM 353 CB GLU A 24 3.214 0.412 -12.873 1.00 11.12 C ATOM 354 CG GLU A 24 1.946 1.091 -13.374 1.00 21.23 C ATOM 355 CD GLU A 24 2.219 2.298 -14.235 1.00 11.40 C ATOM 356 OE1 GLU A 24 2.636 3.344 -13.703 1.00 53.43 O ATOM 357 OE2 GLU A 24 2.002 2.232 -15.458 1.00 11.53 O ATOM 0 H GLU A 24 5.019 -0.792 -11.678 1.00 31.10 H new ATOM 0 HA GLU A 24 2.284 -0.507 -11.193 1.00 72.42 H new ATOM 0 HB2 GLU A 24 3.801 1.134 -12.304 1.00 11.12 H new ATOM 0 HB3 GLU A 24 3.818 0.114 -13.730 1.00 11.12 H new ATOM 0 HG2 GLU A 24 1.357 0.372 -13.944 1.00 21.23 H new ATOM 0 HG3 GLU A 24 1.341 1.392 -12.519 1.00 21.23 H new ATOM 364 N GLU A 25 3.059 -2.543 -13.702 1.00 44.51 N ATOM 365 CA GLU A 25 2.571 -3.669 -14.479 1.00 2.54 C ATOM 366 C GLU A 25 2.220 -4.840 -13.581 1.00 35.04 C ATOM 367 O GLU A 25 1.187 -5.448 -13.754 1.00 24.25 O ATOM 368 CB GLU A 25 3.567 -4.153 -15.549 1.00 71.51 C ATOM 369 CG GLU A 25 3.922 -3.160 -16.642 1.00 11.40 C ATOM 370 CD GLU A 25 4.809 -2.045 -16.198 1.00 1.04 C ATOM 371 OE1 GLU A 25 6.038 -2.223 -16.236 1.00 72.43 O ATOM 372 OE2 GLU A 25 4.299 -0.982 -15.829 1.00 52.23 O ATOM 0 H GLU A 25 4.018 -2.268 -13.913 1.00 44.51 H new ATOM 0 HA GLU A 25 1.682 -3.301 -14.990 1.00 2.54 H new ATOM 0 HB2 GLU A 25 4.487 -4.452 -15.048 1.00 71.51 H new ATOM 0 HB3 GLU A 25 3.155 -5.046 -16.020 1.00 71.51 H new ATOM 0 HG2 GLU A 25 4.411 -3.694 -17.457 1.00 11.40 H new ATOM 0 HG3 GLU A 25 3.002 -2.737 -17.045 1.00 11.40 H new ATOM 379 N ARG A 26 3.092 -5.129 -12.600 1.00 63.53 N ATOM 380 CA ARG A 26 2.903 -6.278 -11.685 1.00 33.42 C ATOM 381 C ARG A 26 1.553 -6.244 -11.005 1.00 62.22 C ATOM 382 O ARG A 26 0.882 -7.267 -10.893 1.00 1.32 O ATOM 383 CB ARG A 26 3.980 -6.338 -10.601 1.00 3.04 C ATOM 384 CG ARG A 26 5.388 -6.577 -11.088 1.00 4.01 C ATOM 385 CD ARG A 26 6.333 -6.672 -9.906 1.00 50.23 C ATOM 386 NE ARG A 26 7.707 -6.941 -10.308 1.00 71.01 N ATOM 387 CZ ARG A 26 8.686 -7.292 -9.473 1.00 61.44 C ATOM 388 NH1 ARG A 26 8.452 -7.372 -8.171 1.00 41.24 N ATOM 389 NH2 ARG A 26 9.894 -7.549 -9.938 1.00 53.13 N ATOM 0 H ARG A 26 3.936 -4.586 -12.417 1.00 63.53 H new ATOM 0 HA ARG A 26 2.974 -7.164 -12.316 1.00 33.42 H new ATOM 0 HB2 ARG A 26 3.962 -5.401 -10.045 1.00 3.04 H new ATOM 0 HB3 ARG A 26 3.719 -7.130 -9.899 1.00 3.04 H new ATOM 0 HG2 ARG A 26 5.429 -7.496 -11.672 1.00 4.01 H new ATOM 0 HG3 ARG A 26 5.697 -5.766 -11.747 1.00 4.01 H new ATOM 0 HD2 ARG A 26 6.299 -5.740 -9.342 1.00 50.23 H new ATOM 0 HD3 ARG A 26 5.993 -7.462 -9.236 1.00 50.23 H new ATOM 0 HE ARG A 26 7.937 -6.855 -11.298 1.00 71.01 H new ATOM 0 HH11 ARG A 26 7.522 -7.165 -7.806 1.00 41.24 H new ATOM 0 HH12 ARG A 26 9.202 -7.641 -7.534 1.00 41.24 H new ATOM 0 HH21 ARG A 26 10.081 -7.479 -10.938 1.00 53.13 H new ATOM 0 HH22 ARG A 26 10.641 -7.817 -9.297 1.00 53.13 H new ATOM 403 N LEU A 27 1.161 -5.075 -10.560 1.00 74.30 N ATOM 404 CA LEU A 27 -0.089 -4.922 -9.867 1.00 51.12 C ATOM 405 C LEU A 27 -1.272 -5.173 -10.809 1.00 53.24 C ATOM 406 O LEU A 27 -2.239 -5.842 -10.437 1.00 42.21 O ATOM 407 CB LEU A 27 -0.164 -3.556 -9.177 1.00 42.13 C ATOM 408 CG LEU A 27 0.950 -3.263 -8.144 1.00 2.44 C ATOM 409 CD1 LEU A 27 0.718 -1.936 -7.479 1.00 21.52 C ATOM 410 CD2 LEU A 27 1.018 -4.358 -7.109 1.00 55.15 C ATOM 0 H LEU A 27 1.695 -4.213 -10.668 1.00 74.30 H new ATOM 0 HA LEU A 27 -0.148 -5.676 -9.082 1.00 51.12 H new ATOM 0 HB2 LEU A 27 -0.137 -2.781 -9.943 1.00 42.13 H new ATOM 0 HB3 LEU A 27 -1.129 -3.475 -8.676 1.00 42.13 H new ATOM 0 HG LEU A 27 1.902 -3.226 -8.673 1.00 2.44 H new ATOM 0 HD11 LEU A 27 1.512 -1.748 -6.756 1.00 21.52 H new ATOM 0 HD12 LEU A 27 0.718 -1.147 -8.231 1.00 21.52 H new ATOM 0 HD13 LEU A 27 -0.244 -1.949 -6.967 1.00 21.52 H new ATOM 0 HD21 LEU A 27 1.808 -4.133 -6.392 1.00 55.15 H new ATOM 0 HD22 LEU A 27 0.063 -4.426 -6.588 1.00 55.15 H new ATOM 0 HD23 LEU A 27 1.232 -5.308 -7.598 1.00 55.15 H new ATOM 422 N ASP A 28 -1.166 -4.679 -12.044 1.00 32.52 N ATOM 423 CA ASP A 28 -2.198 -4.936 -13.060 1.00 44.10 C ATOM 424 C ASP A 28 -2.241 -6.415 -13.407 1.00 0.21 C ATOM 425 O ASP A 28 -3.317 -6.989 -13.603 1.00 23.22 O ATOM 426 CB ASP A 28 -1.985 -4.107 -14.342 1.00 11.34 C ATOM 427 CG ASP A 28 -2.208 -2.619 -14.168 1.00 33.22 C ATOM 428 OD1 ASP A 28 -3.368 -2.169 -14.220 1.00 24.00 O ATOM 429 OD2 ASP A 28 -1.239 -1.872 -14.029 1.00 23.22 O ATOM 0 H ASP A 28 -0.387 -4.105 -12.366 1.00 32.52 H new ATOM 0 HA ASP A 28 -3.150 -4.630 -12.627 1.00 44.10 H new ATOM 0 HB2 ASP A 28 -0.969 -4.270 -14.701 1.00 11.34 H new ATOM 0 HB3 ASP A 28 -2.660 -4.475 -15.115 1.00 11.34 H new ATOM 434 N GLU A 29 -1.061 -7.036 -13.443 1.00 22.11 N ATOM 435 CA GLU A 29 -0.921 -8.461 -13.738 1.00 52.03 C ATOM 436 C GLU A 29 -1.694 -9.298 -12.760 1.00 62.43 C ATOM 437 O GLU A 29 -2.416 -10.191 -13.157 1.00 30.11 O ATOM 438 CB GLU A 29 0.553 -8.885 -13.717 1.00 2.11 C ATOM 439 CG GLU A 29 1.395 -8.308 -14.837 1.00 33.32 C ATOM 440 CD GLU A 29 1.032 -8.866 -16.188 1.00 65.32 C ATOM 441 OE1 GLU A 29 0.031 -8.436 -16.782 1.00 42.24 O ATOM 442 OE2 GLU A 29 1.761 -9.751 -16.680 1.00 52.31 O ATOM 0 H GLU A 29 -0.174 -6.563 -13.268 1.00 22.11 H new ATOM 0 HA GLU A 29 -1.325 -8.623 -14.737 1.00 52.03 H new ATOM 0 HB2 GLU A 29 0.989 -8.588 -12.763 1.00 2.11 H new ATOM 0 HB3 GLU A 29 0.605 -9.973 -13.766 1.00 2.11 H new ATOM 0 HG2 GLU A 29 1.277 -7.225 -14.853 1.00 33.32 H new ATOM 0 HG3 GLU A 29 2.447 -8.511 -14.636 1.00 33.32 H new ATOM 449 N ILE A 30 -1.560 -8.991 -11.485 1.00 41.55 N ATOM 450 CA ILE A 30 -2.233 -9.746 -10.443 1.00 34.35 C ATOM 451 C ILE A 30 -3.754 -9.674 -10.605 1.00 53.42 C ATOM 452 O ILE A 30 -4.446 -10.699 -10.487 1.00 41.42 O ATOM 453 CB ILE A 30 -1.808 -9.277 -9.025 1.00 63.32 C ATOM 454 CG1 ILE A 30 -0.296 -9.467 -8.852 1.00 63.22 C ATOM 455 CG2 ILE A 30 -2.556 -10.067 -7.957 1.00 2.44 C ATOM 456 CD1 ILE A 30 0.262 -8.955 -7.539 1.00 30.21 C ATOM 0 H ILE A 30 -0.988 -8.219 -11.143 1.00 41.55 H new ATOM 0 HA ILE A 30 -1.926 -10.786 -10.551 1.00 34.35 H new ATOM 0 HB ILE A 30 -2.056 -8.221 -8.913 1.00 63.32 H new ATOM 0 HG12 ILE A 30 -0.065 -10.529 -8.940 1.00 63.22 H new ATOM 0 HG13 ILE A 30 0.216 -8.961 -9.670 1.00 63.22 H new ATOM 0 HG21 ILE A 30 -2.247 -9.726 -6.969 1.00 2.44 H new ATOM 0 HG22 ILE A 30 -3.629 -9.913 -8.075 1.00 2.44 H new ATOM 0 HG23 ILE A 30 -2.328 -11.128 -8.063 1.00 2.44 H new ATOM 0 HD11 ILE A 30 1.337 -9.132 -7.507 1.00 30.21 H new ATOM 0 HD12 ILE A 30 0.068 -7.886 -7.453 1.00 30.21 H new ATOM 0 HD13 ILE A 30 -0.217 -9.478 -6.711 1.00 30.21 H new ATOM 468 N ASN A 31 -4.256 -8.483 -10.924 1.00 3.31 N ATOM 469 CA ASN A 31 -5.698 -8.268 -11.119 1.00 31.44 C ATOM 470 C ASN A 31 -6.236 -9.171 -12.191 1.00 5.12 C ATOM 471 O ASN A 31 -7.286 -9.760 -12.034 1.00 35.14 O ATOM 472 CB ASN A 31 -6.024 -6.820 -11.499 1.00 64.44 C ATOM 473 CG ASN A 31 -5.667 -5.820 -10.439 1.00 15.04 C ATOM 474 OD1 ASN A 31 -5.646 -6.131 -9.253 1.00 4.45 O ATOM 475 ND2 ASN A 31 -5.446 -4.603 -10.842 1.00 12.50 N ATOM 0 H ASN A 31 -3.688 -7.646 -11.054 1.00 3.31 H new ATOM 0 HA ASN A 31 -6.170 -8.496 -10.163 1.00 31.44 H new ATOM 0 HB2 ASN A 31 -5.494 -6.567 -12.417 1.00 64.44 H new ATOM 0 HB3 ASN A 31 -7.090 -6.742 -11.715 1.00 64.44 H new ATOM 0 HD21 ASN A 31 -5.247 -3.869 -10.162 1.00 12.50 H new ATOM 0 HD22 ASN A 31 -5.472 -4.383 -11.838 1.00 12.50 H new ATOM 482 N LYS A 32 -5.485 -9.285 -13.263 1.00 70.34 N ATOM 483 CA LYS A 32 -5.842 -10.092 -14.428 1.00 12.55 C ATOM 484 C LYS A 32 -6.163 -11.553 -14.074 1.00 71.41 C ATOM 485 O LYS A 32 -7.089 -12.138 -14.639 1.00 45.34 O ATOM 486 CB LYS A 32 -4.737 -9.980 -15.477 1.00 31.42 C ATOM 487 CG LYS A 32 -4.637 -8.572 -16.070 1.00 23.31 C ATOM 488 CD LYS A 32 -3.341 -8.342 -16.832 1.00 52.32 C ATOM 489 CE LYS A 32 -3.124 -9.336 -17.939 1.00 43.24 C ATOM 490 NZ LYS A 32 -1.819 -9.126 -18.591 1.00 44.44 N ATOM 0 H LYS A 32 -4.587 -8.812 -13.360 1.00 70.34 H new ATOM 0 HA LYS A 32 -6.768 -9.695 -14.844 1.00 12.55 H new ATOM 0 HB2 LYS A 32 -3.782 -10.250 -15.026 1.00 31.42 H new ATOM 0 HB3 LYS A 32 -4.925 -10.696 -16.277 1.00 31.42 H new ATOM 0 HG2 LYS A 32 -5.481 -8.404 -16.739 1.00 23.31 H new ATOM 0 HG3 LYS A 32 -4.716 -7.839 -15.267 1.00 23.31 H new ATOM 0 HD2 LYS A 32 -3.346 -7.336 -17.251 1.00 52.32 H new ATOM 0 HD3 LYS A 32 -2.503 -8.393 -16.136 1.00 52.32 H new ATOM 0 HE2 LYS A 32 -3.175 -10.348 -17.538 1.00 43.24 H new ATOM 0 HE3 LYS A 32 -3.922 -9.244 -18.676 1.00 43.24 H new ATOM 0 HZ1 LYS A 32 -1.596 -9.945 -19.192 1.00 44.44 H new ATOM 0 HZ2 LYS A 32 -1.857 -8.267 -19.176 1.00 44.44 H new ATOM 0 HZ3 LYS A 32 -1.082 -9.018 -17.865 1.00 44.44 H new ATOM 504 N GLN A 33 -5.429 -12.129 -13.124 1.00 3.52 N ATOM 505 CA GLN A 33 -5.712 -13.505 -12.683 1.00 35.33 C ATOM 506 C GLN A 33 -7.049 -13.590 -11.991 1.00 4.35 C ATOM 507 O GLN A 33 -7.836 -14.480 -12.276 1.00 71.02 O ATOM 508 CB GLN A 33 -4.611 -14.109 -11.776 1.00 73.10 C ATOM 509 CG GLN A 33 -3.302 -14.500 -12.465 1.00 25.13 C ATOM 510 CD GLN A 33 -2.556 -13.350 -13.073 1.00 1.22 C ATOM 511 OE1 GLN A 33 -2.763 -13.007 -14.220 1.00 61.13 O ATOM 512 NE2 GLN A 33 -1.669 -12.761 -12.322 1.00 53.21 N ATOM 0 H GLN A 33 -4.647 -11.679 -12.649 1.00 3.52 H new ATOM 0 HA GLN A 33 -5.732 -14.102 -13.594 1.00 35.33 H new ATOM 0 HB2 GLN A 33 -4.382 -13.389 -10.991 1.00 73.10 H new ATOM 0 HB3 GLN A 33 -5.018 -14.994 -11.288 1.00 73.10 H new ATOM 0 HG2 GLN A 33 -2.656 -14.993 -11.739 1.00 25.13 H new ATOM 0 HG3 GLN A 33 -3.520 -15.230 -13.245 1.00 25.13 H new ATOM 0 HE21 GLN A 33 -1.522 -13.076 -11.363 1.00 53.21 H new ATOM 0 HE22 GLN A 33 -1.121 -11.985 -12.693 1.00 53.21 H new ATOM 521 N PHE A 34 -7.298 -12.658 -11.100 1.00 21.31 N ATOM 522 CA PHE A 34 -8.544 -12.614 -10.341 1.00 44.43 C ATOM 523 C PHE A 34 -9.717 -12.199 -11.220 1.00 43.03 C ATOM 524 O PHE A 34 -10.858 -12.575 -10.972 1.00 41.01 O ATOM 525 CB PHE A 34 -8.412 -11.659 -9.143 1.00 25.00 C ATOM 526 CG PHE A 34 -7.468 -12.132 -8.074 1.00 23.35 C ATOM 527 CD1 PHE A 34 -6.112 -11.879 -8.151 1.00 72.33 C ATOM 528 CD2 PHE A 34 -7.948 -12.831 -6.987 1.00 1.43 C ATOM 529 CE1 PHE A 34 -5.253 -12.316 -7.162 1.00 41.33 C ATOM 530 CE2 PHE A 34 -7.096 -13.272 -5.995 1.00 11.30 C ATOM 531 CZ PHE A 34 -5.746 -13.015 -6.082 1.00 51.43 C ATOM 0 H PHE A 34 -6.648 -11.905 -10.875 1.00 21.31 H new ATOM 0 HA PHE A 34 -8.741 -13.620 -9.971 1.00 44.43 H new ATOM 0 HB2 PHE A 34 -8.075 -10.687 -9.504 1.00 25.00 H new ATOM 0 HB3 PHE A 34 -9.397 -11.511 -8.701 1.00 25.00 H new ATOM 0 HD1 PHE A 34 -5.719 -11.332 -8.995 1.00 72.33 H new ATOM 0 HD2 PHE A 34 -9.006 -13.036 -6.911 1.00 1.43 H new ATOM 0 HE1 PHE A 34 -4.195 -12.110 -7.235 1.00 41.33 H new ATOM 0 HE2 PHE A 34 -7.488 -13.819 -5.150 1.00 11.30 H new ATOM 0 HZ PHE A 34 -5.077 -13.360 -5.307 1.00 51.43 H new ATOM 541 N LEU A 35 -9.416 -11.441 -12.244 1.00 23.14 N ATOM 542 CA LEU A 35 -10.408 -10.898 -13.134 1.00 34.11 C ATOM 543 C LEU A 35 -11.025 -12.031 -13.969 1.00 4.10 C ATOM 544 O LEU A 35 -12.257 -12.143 -14.087 1.00 61.21 O ATOM 545 CB LEU A 35 -9.716 -9.858 -14.050 1.00 63.43 C ATOM 546 CG LEU A 35 -10.581 -8.773 -14.707 1.00 15.34 C ATOM 547 CD1 LEU A 35 -11.673 -9.339 -15.576 1.00 51.43 C ATOM 548 CD2 LEU A 35 -11.147 -7.851 -13.661 1.00 3.34 C ATOM 0 H LEU A 35 -8.460 -11.180 -12.486 1.00 23.14 H new ATOM 0 HA LEU A 35 -11.208 -10.416 -12.572 1.00 34.11 H new ATOM 0 HB2 LEU A 35 -8.946 -9.358 -13.462 1.00 63.43 H new ATOM 0 HB3 LEU A 35 -9.206 -10.403 -14.845 1.00 63.43 H new ATOM 0 HG LEU A 35 -9.929 -8.203 -15.369 1.00 15.34 H new ATOM 0 HD11 LEU A 35 -12.250 -8.524 -16.012 1.00 51.43 H new ATOM 0 HD12 LEU A 35 -11.231 -9.937 -16.372 1.00 51.43 H new ATOM 0 HD13 LEU A 35 -12.330 -9.966 -14.973 1.00 51.43 H new ATOM 0 HD21 LEU A 35 -11.758 -7.087 -14.142 1.00 3.34 H new ATOM 0 HD22 LEU A 35 -11.762 -8.423 -12.966 1.00 3.34 H new ATOM 0 HD23 LEU A 35 -10.332 -7.374 -13.117 1.00 3.34 H new ATOM 560 N ASP A 36 -10.173 -12.871 -14.524 1.00 35.25 N ATOM 561 CA ASP A 36 -10.627 -13.988 -15.356 1.00 23.13 C ATOM 562 C ASP A 36 -10.800 -15.278 -14.590 1.00 64.33 C ATOM 563 O ASP A 36 -11.127 -16.318 -15.184 1.00 31.31 O ATOM 564 CB ASP A 36 -9.728 -14.226 -16.580 1.00 53.11 C ATOM 565 CG ASP A 36 -10.081 -13.379 -17.793 1.00 13.43 C ATOM 566 OD1 ASP A 36 -11.287 -13.278 -18.129 1.00 61.31 O ATOM 567 OD2 ASP A 36 -9.162 -12.888 -18.497 1.00 44.22 O ATOM 0 H ASP A 36 -9.160 -12.808 -14.419 1.00 35.25 H new ATOM 0 HA ASP A 36 -11.611 -13.677 -15.708 1.00 23.13 H new ATOM 0 HB2 ASP A 36 -8.694 -14.025 -16.300 1.00 53.11 H new ATOM 0 HB3 ASP A 36 -9.785 -15.278 -16.858 1.00 53.11 H new ATOM 572 N ASP A 37 -10.621 -15.235 -13.285 1.00 51.53 N ATOM 573 CA ASP A 37 -10.747 -16.458 -12.478 1.00 23.24 C ATOM 574 C ASP A 37 -12.212 -16.916 -12.422 1.00 51.34 C ATOM 575 O ASP A 37 -13.113 -16.116 -12.106 1.00 40.44 O ATOM 576 CB ASP A 37 -10.155 -16.286 -11.067 1.00 21.33 C ATOM 577 CG ASP A 37 -10.201 -17.567 -10.244 1.00 62.12 C ATOM 578 OD1 ASP A 37 -9.257 -18.378 -10.351 1.00 31.13 O ATOM 579 OD2 ASP A 37 -11.173 -17.786 -9.477 1.00 53.13 O ATOM 0 H ASP A 37 -10.392 -14.392 -12.759 1.00 51.53 H new ATOM 0 HA ASP A 37 -10.162 -17.238 -12.966 1.00 23.24 H new ATOM 0 HB2 ASP A 37 -9.121 -15.951 -11.151 1.00 21.33 H new ATOM 0 HB3 ASP A 37 -10.702 -15.503 -10.542 1.00 21.33 H new ATOM 584 N PRO A 38 -12.471 -18.210 -12.760 1.00 34.13 N ATOM 585 CA PRO A 38 -13.827 -18.801 -12.844 1.00 44.45 C ATOM 586 C PRO A 38 -14.763 -18.481 -11.669 1.00 71.32 C ATOM 587 O PRO A 38 -15.971 -18.331 -11.867 1.00 54.34 O ATOM 588 CB PRO A 38 -13.546 -20.300 -12.897 1.00 53.34 C ATOM 589 CG PRO A 38 -12.241 -20.397 -13.592 1.00 60.45 C ATOM 590 CD PRO A 38 -11.437 -19.217 -13.119 1.00 20.13 C ATOM 0 HA PRO A 38 -14.361 -18.392 -13.702 1.00 44.45 H new ATOM 0 HB2 PRO A 38 -13.499 -20.733 -11.898 1.00 53.34 H new ATOM 0 HB3 PRO A 38 -14.327 -20.833 -13.439 1.00 53.34 H new ATOM 0 HG2 PRO A 38 -11.739 -21.334 -13.352 1.00 60.45 H new ATOM 0 HG3 PRO A 38 -12.371 -20.373 -14.674 1.00 60.45 H new ATOM 0 HD2 PRO A 38 -10.814 -19.474 -12.263 1.00 20.13 H new ATOM 0 HD3 PRO A 38 -10.771 -18.847 -13.899 1.00 20.13 H new ATOM 598 N LYS A 39 -14.211 -18.335 -10.468 1.00 33.25 N ATOM 599 CA LYS A 39 -15.028 -18.098 -9.272 1.00 64.21 C ATOM 600 C LYS A 39 -15.717 -16.730 -9.387 1.00 71.03 C ATOM 601 O LYS A 39 -16.828 -16.526 -8.900 1.00 72.35 O ATOM 602 CB LYS A 39 -14.115 -18.171 -8.018 1.00 32.30 C ATOM 603 CG LYS A 39 -14.815 -18.337 -6.638 1.00 11.14 C ATOM 604 CD LYS A 39 -15.611 -17.122 -6.164 1.00 2.55 C ATOM 605 CE LYS A 39 -14.720 -15.913 -5.904 1.00 23.54 C ATOM 606 NZ LYS A 39 -15.505 -14.756 -5.435 1.00 2.11 N ATOM 0 H LYS A 39 -13.207 -18.376 -10.293 1.00 33.25 H new ATOM 0 HA LYS A 39 -15.804 -18.858 -9.180 1.00 64.21 H new ATOM 0 HB2 LYS A 39 -13.426 -19.005 -8.150 1.00 32.30 H new ATOM 0 HB3 LYS A 39 -13.513 -17.263 -7.985 1.00 32.30 H new ATOM 0 HG2 LYS A 39 -15.486 -19.194 -6.690 1.00 11.14 H new ATOM 0 HG3 LYS A 39 -14.058 -18.570 -5.890 1.00 11.14 H new ATOM 0 HD2 LYS A 39 -16.359 -16.865 -6.914 1.00 2.55 H new ATOM 0 HD3 LYS A 39 -16.150 -17.377 -5.251 1.00 2.55 H new ATOM 0 HE2 LYS A 39 -13.966 -16.168 -5.160 1.00 23.54 H new ATOM 0 HE3 LYS A 39 -14.189 -15.648 -6.818 1.00 23.54 H new ATOM 0 HZ1 LYS A 39 -14.869 -13.950 -5.267 1.00 2.11 H new ATOM 0 HZ2 LYS A 39 -16.208 -14.498 -6.157 1.00 2.11 H new ATOM 0 HZ3 LYS A 39 -15.992 -15.003 -4.550 1.00 2.11 H new ATOM 620 N TYR A 40 -15.060 -15.822 -10.059 1.00 65.41 N ATOM 621 CA TYR A 40 -15.551 -14.471 -10.221 1.00 64.12 C ATOM 622 C TYR A 40 -16.375 -14.389 -11.483 1.00 14.42 C ATOM 623 O TYR A 40 -17.308 -13.589 -11.574 1.00 5.31 O ATOM 624 CB TYR A 40 -14.371 -13.500 -10.299 1.00 70.44 C ATOM 625 CG TYR A 40 -13.425 -13.646 -9.136 1.00 20.11 C ATOM 626 CD1 TYR A 40 -12.489 -14.659 -9.128 1.00 20.51 C ATOM 627 CD2 TYR A 40 -13.471 -12.796 -8.051 1.00 20.43 C ATOM 628 CE1 TYR A 40 -11.630 -14.835 -8.089 1.00 21.23 C ATOM 629 CE2 TYR A 40 -12.603 -12.964 -6.997 1.00 25.23 C ATOM 630 CZ TYR A 40 -11.684 -13.995 -7.028 1.00 22.32 C ATOM 631 OH TYR A 40 -10.827 -14.183 -5.988 1.00 13.13 O ATOM 0 H TYR A 40 -14.164 -15.996 -10.514 1.00 65.41 H new ATOM 0 HA TYR A 40 -16.173 -14.201 -9.367 1.00 64.12 H new ATOM 0 HB2 TYR A 40 -13.827 -13.668 -11.229 1.00 70.44 H new ATOM 0 HB3 TYR A 40 -14.748 -12.478 -10.331 1.00 70.44 H new ATOM 0 HD1 TYR A 40 -12.437 -15.332 -9.971 1.00 20.51 H new ATOM 0 HD2 TYR A 40 -14.193 -11.993 -8.029 1.00 20.43 H new ATOM 0 HE1 TYR A 40 -10.909 -15.639 -8.110 1.00 21.23 H new ATOM 0 HE2 TYR A 40 -12.640 -12.294 -6.151 1.00 25.23 H new ATOM 0 HH TYR A 40 -10.107 -14.788 -6.263 1.00 13.13 H new ATOM 641 N SER A 41 -15.991 -15.214 -12.468 1.00 71.54 N ATOM 642 CA SER A 41 -16.691 -15.331 -13.757 1.00 4.31 C ATOM 643 C SER A 41 -16.669 -14.003 -14.555 1.00 73.03 C ATOM 644 O SER A 41 -17.426 -13.835 -15.520 1.00 32.24 O ATOM 645 CB SER A 41 -18.136 -15.808 -13.520 1.00 2.22 C ATOM 646 OG SER A 41 -18.145 -17.063 -12.823 1.00 55.13 O ATOM 0 H SER A 41 -15.178 -15.825 -12.392 1.00 71.54 H new ATOM 0 HA SER A 41 -16.164 -16.068 -14.363 1.00 4.31 H new ATOM 0 HB2 SER A 41 -18.681 -15.061 -12.943 1.00 2.22 H new ATOM 0 HB3 SER A 41 -18.652 -15.912 -14.475 1.00 2.22 H new ATOM 0 HG SER A 41 -17.242 -17.263 -12.498 1.00 55.13 H new ATOM 652 N SER A 42 -15.748 -13.106 -14.172 1.00 62.14 N ATOM 653 CA SER A 42 -15.621 -11.769 -14.750 1.00 33.24 C ATOM 654 C SER A 42 -16.925 -10.972 -14.643 1.00 73.53 C ATOM 655 O SER A 42 -17.746 -10.968 -15.559 1.00 43.14 O ATOM 656 CB SER A 42 -15.118 -11.809 -16.199 1.00 4.43 C ATOM 657 OG SER A 42 -13.849 -12.448 -16.290 1.00 14.14 O ATOM 0 H SER A 42 -15.063 -13.296 -13.441 1.00 62.14 H new ATOM 0 HA SER A 42 -14.867 -11.250 -14.158 1.00 33.24 H new ATOM 0 HB2 SER A 42 -15.839 -12.338 -16.822 1.00 4.43 H new ATOM 0 HB3 SER A 42 -15.045 -10.794 -16.589 1.00 4.43 H new ATOM 0 HG SER A 42 -13.375 -12.358 -15.437 1.00 14.14 H new ATOM 663 N ASP A 43 -17.129 -10.352 -13.507 1.00 42.44 N ATOM 664 CA ASP A 43 -18.316 -9.544 -13.285 1.00 33.23 C ATOM 665 C ASP A 43 -17.982 -8.101 -13.601 1.00 2.11 C ATOM 666 O ASP A 43 -16.833 -7.716 -13.486 1.00 53.12 O ATOM 667 CB ASP A 43 -18.779 -9.669 -11.832 1.00 33.13 C ATOM 668 CG ASP A 43 -20.048 -8.898 -11.555 1.00 41.43 C ATOM 669 OD1 ASP A 43 -21.140 -9.443 -11.792 1.00 42.34 O ATOM 670 OD2 ASP A 43 -19.973 -7.742 -11.103 1.00 55.03 O ATOM 0 H ASP A 43 -16.488 -10.388 -12.714 1.00 42.44 H new ATOM 0 HA ASP A 43 -19.123 -9.890 -13.931 1.00 33.23 H new ATOM 0 HB2 ASP A 43 -18.939 -10.721 -11.595 1.00 33.13 H new ATOM 0 HB3 ASP A 43 -17.990 -9.310 -11.172 1.00 33.13 H new ATOM 675 N GLU A 44 -18.968 -7.317 -13.996 1.00 2.24 N ATOM 676 CA GLU A 44 -18.752 -5.913 -14.362 1.00 1.23 C ATOM 677 C GLU A 44 -18.314 -5.042 -13.174 1.00 1.13 C ATOM 678 O GLU A 44 -17.571 -4.078 -13.348 1.00 4.43 O ATOM 679 CB GLU A 44 -20.007 -5.312 -14.986 1.00 71.04 C ATOM 680 CG GLU A 44 -20.473 -5.996 -16.252 1.00 42.24 C ATOM 681 CD GLU A 44 -21.655 -5.296 -16.854 1.00 13.25 C ATOM 682 OE1 GLU A 44 -22.802 -5.532 -16.394 1.00 62.11 O ATOM 683 OE2 GLU A 44 -21.461 -4.486 -17.786 1.00 21.14 O ATOM 0 H GLU A 44 -19.937 -7.624 -14.075 1.00 2.24 H new ATOM 0 HA GLU A 44 -17.940 -5.917 -15.089 1.00 1.23 H new ATOM 0 HB2 GLU A 44 -20.813 -5.346 -14.253 1.00 71.04 H new ATOM 0 HB3 GLU A 44 -19.820 -4.261 -15.205 1.00 71.04 H new ATOM 0 HG2 GLU A 44 -19.657 -6.021 -16.974 1.00 42.24 H new ATOM 0 HG3 GLU A 44 -20.735 -7.031 -16.032 1.00 42.24 H new ATOM 690 N ASP A 45 -18.756 -5.385 -11.981 1.00 3.43 N ATOM 691 CA ASP A 45 -18.460 -4.579 -10.778 1.00 2.00 C ATOM 692 C ASP A 45 -17.173 -5.067 -10.103 1.00 14.14 C ATOM 693 O ASP A 45 -16.642 -4.451 -9.173 1.00 72.02 O ATOM 694 CB ASP A 45 -19.658 -4.652 -9.813 1.00 52.43 C ATOM 695 CG ASP A 45 -19.484 -3.874 -8.525 1.00 41.45 C ATOM 696 OD1 ASP A 45 -19.671 -2.637 -8.525 1.00 14.31 O ATOM 697 OD2 ASP A 45 -19.178 -4.496 -7.483 1.00 24.14 O ATOM 0 H ASP A 45 -19.323 -6.214 -11.802 1.00 3.43 H new ATOM 0 HA ASP A 45 -18.302 -3.540 -11.067 1.00 2.00 H new ATOM 0 HB2 ASP A 45 -20.544 -4.282 -10.328 1.00 52.43 H new ATOM 0 HB3 ASP A 45 -19.846 -5.697 -9.567 1.00 52.43 H new ATOM 702 N LEU A 46 -16.664 -6.159 -10.615 1.00 32.44 N ATOM 703 CA LEU A 46 -15.474 -6.802 -10.087 1.00 62.54 C ATOM 704 C LEU A 46 -14.159 -5.998 -10.378 1.00 51.11 C ATOM 705 O LEU A 46 -13.415 -5.707 -9.435 1.00 2.41 O ATOM 706 CB LEU A 46 -15.460 -8.305 -10.529 1.00 53.25 C ATOM 707 CG LEU A 46 -14.309 -9.256 -10.087 1.00 60.04 C ATOM 708 CD1 LEU A 46 -13.040 -9.010 -10.860 1.00 21.22 C ATOM 709 CD2 LEU A 46 -14.052 -9.162 -8.586 1.00 50.00 C ATOM 0 H LEU A 46 -17.065 -6.638 -11.421 1.00 32.44 H new ATOM 0 HA LEU A 46 -15.510 -6.797 -8.998 1.00 62.54 H new ATOM 0 HB2 LEU A 46 -16.393 -8.749 -10.183 1.00 53.25 H new ATOM 0 HB3 LEU A 46 -15.486 -8.318 -11.619 1.00 53.25 H new ATOM 0 HG LEU A 46 -14.639 -10.270 -10.314 1.00 60.04 H new ATOM 0 HD11 LEU A 46 -12.266 -9.697 -10.517 1.00 21.22 H new ATOM 0 HD12 LEU A 46 -13.224 -9.172 -11.922 1.00 21.22 H new ATOM 0 HD13 LEU A 46 -12.710 -7.983 -10.701 1.00 21.22 H new ATOM 0 HD21 LEU A 46 -13.243 -9.839 -8.312 1.00 50.00 H new ATOM 0 HD22 LEU A 46 -13.774 -8.140 -8.328 1.00 50.00 H new ATOM 0 HD23 LEU A 46 -14.956 -9.440 -8.044 1.00 50.00 H new ATOM 721 N PRO A 47 -13.862 -5.586 -11.673 1.00 44.32 N ATOM 722 CA PRO A 47 -12.637 -4.816 -12.008 1.00 72.43 C ATOM 723 C PRO A 47 -12.529 -3.519 -11.216 1.00 11.52 C ATOM 724 O PRO A 47 -11.433 -3.017 -10.988 1.00 72.00 O ATOM 725 CB PRO A 47 -12.797 -4.491 -13.506 1.00 21.02 C ATOM 726 CG PRO A 47 -14.230 -4.742 -13.803 1.00 74.30 C ATOM 727 CD PRO A 47 -14.651 -5.842 -12.885 1.00 61.13 C ATOM 0 HA PRO A 47 -11.738 -5.386 -11.771 1.00 72.43 H new ATOM 0 HB2 PRO A 47 -12.526 -3.457 -13.717 1.00 21.02 H new ATOM 0 HB3 PRO A 47 -12.151 -5.121 -14.118 1.00 21.02 H new ATOM 0 HG2 PRO A 47 -14.826 -3.845 -13.637 1.00 74.30 H new ATOM 0 HG3 PRO A 47 -14.369 -5.029 -14.845 1.00 74.30 H new ATOM 0 HD2 PRO A 47 -15.722 -5.811 -12.683 1.00 61.13 H new ATOM 0 HD3 PRO A 47 -14.435 -6.824 -13.307 1.00 61.13 H new ATOM 735 N SER A 48 -13.669 -3.018 -10.771 1.00 45.21 N ATOM 736 CA SER A 48 -13.740 -1.780 -10.028 1.00 33.25 C ATOM 737 C SER A 48 -12.951 -1.898 -8.707 1.00 52.11 C ATOM 738 O SER A 48 -12.287 -0.954 -8.274 1.00 14.44 O ATOM 739 CB SER A 48 -15.206 -1.457 -9.760 1.00 0.42 C ATOM 740 OG SER A 48 -15.941 -1.462 -10.983 1.00 52.21 O ATOM 0 H SER A 48 -14.574 -3.465 -10.918 1.00 45.21 H new ATOM 0 HA SER A 48 -13.291 -0.973 -10.607 1.00 33.25 H new ATOM 0 HB2 SER A 48 -15.627 -2.189 -9.071 1.00 0.42 H new ATOM 0 HB3 SER A 48 -15.290 -0.482 -9.280 1.00 0.42 H new ATOM 0 HG SER A 48 -16.881 -1.255 -10.800 1.00 52.21 H new ATOM 746 N LYS A 49 -13.011 -3.076 -8.099 1.00 42.31 N ATOM 747 CA LYS A 49 -12.284 -3.340 -6.869 1.00 13.12 C ATOM 748 C LYS A 49 -10.812 -3.535 -7.138 1.00 23.22 C ATOM 749 O LYS A 49 -9.980 -2.947 -6.463 1.00 23.55 O ATOM 750 CB LYS A 49 -12.871 -4.535 -6.084 1.00 21.54 C ATOM 751 CG LYS A 49 -14.161 -4.238 -5.303 1.00 43.22 C ATOM 752 CD LYS A 49 -15.297 -3.738 -6.177 1.00 50.43 C ATOM 753 CE LYS A 49 -16.502 -3.387 -5.332 1.00 24.23 C ATOM 754 NZ LYS A 49 -17.597 -2.821 -6.130 1.00 50.14 N ATOM 0 H LYS A 49 -13.559 -3.865 -8.441 1.00 42.31 H new ATOM 0 HA LYS A 49 -12.400 -2.459 -6.237 1.00 13.12 H new ATOM 0 HB2 LYS A 49 -13.069 -5.347 -6.784 1.00 21.54 H new ATOM 0 HB3 LYS A 49 -12.117 -4.894 -5.384 1.00 21.54 H new ATOM 0 HG2 LYS A 49 -14.481 -5.144 -4.788 1.00 43.22 H new ATOM 0 HG3 LYS A 49 -13.949 -3.493 -4.536 1.00 43.22 H new ATOM 0 HD2 LYS A 49 -14.973 -2.862 -6.739 1.00 50.43 H new ATOM 0 HD3 LYS A 49 -15.567 -4.503 -6.905 1.00 50.43 H new ATOM 0 HE2 LYS A 49 -16.855 -4.281 -4.817 1.00 24.23 H new ATOM 0 HE3 LYS A 49 -16.208 -2.672 -4.564 1.00 24.23 H new ATOM 0 HZ1 LYS A 49 -18.007 -2.007 -5.629 1.00 50.14 H new ATOM 0 HZ2 LYS A 49 -17.230 -2.511 -7.052 1.00 50.14 H new ATOM 0 HZ3 LYS A 49 -18.331 -3.544 -6.275 1.00 50.14 H new ATOM 768 N LEU A 50 -10.499 -4.341 -8.143 1.00 42.51 N ATOM 769 CA LEU A 50 -9.108 -4.621 -8.507 1.00 62.34 C ATOM 770 C LEU A 50 -8.365 -3.362 -8.914 1.00 2.33 C ATOM 771 O LEU A 50 -7.303 -3.084 -8.398 1.00 72.40 O ATOM 772 CB LEU A 50 -8.993 -5.689 -9.615 1.00 25.24 C ATOM 773 CG LEU A 50 -9.272 -7.166 -9.239 1.00 34.25 C ATOM 774 CD1 LEU A 50 -8.323 -7.646 -8.161 1.00 53.51 C ATOM 775 CD2 LEU A 50 -10.703 -7.387 -8.818 1.00 24.34 C ATOM 0 H LEU A 50 -11.189 -4.816 -8.725 1.00 42.51 H new ATOM 0 HA LEU A 50 -8.639 -5.021 -7.608 1.00 62.34 H new ATOM 0 HB2 LEU A 50 -9.680 -5.414 -10.416 1.00 25.24 H new ATOM 0 HB3 LEU A 50 -7.985 -5.635 -10.027 1.00 25.24 H new ATOM 0 HG LEU A 50 -9.101 -7.755 -10.140 1.00 34.25 H new ATOM 0 HD11 LEU A 50 -8.544 -8.686 -7.919 1.00 53.51 H new ATOM 0 HD12 LEU A 50 -7.296 -7.567 -8.518 1.00 53.51 H new ATOM 0 HD13 LEU A 50 -8.445 -7.032 -7.269 1.00 53.51 H new ATOM 0 HD21 LEU A 50 -10.850 -8.437 -8.564 1.00 24.34 H new ATOM 0 HD22 LEU A 50 -10.926 -6.769 -7.948 1.00 24.34 H new ATOM 0 HD23 LEU A 50 -11.369 -7.115 -9.637 1.00 24.34 H new ATOM 787 N GLU A 51 -8.945 -2.595 -9.818 1.00 73.41 N ATOM 788 CA GLU A 51 -8.322 -1.369 -10.291 1.00 1.24 C ATOM 789 C GLU A 51 -8.218 -0.318 -9.198 1.00 33.33 C ATOM 790 O GLU A 51 -7.189 0.363 -9.082 1.00 32.31 O ATOM 791 CB GLU A 51 -9.043 -0.831 -11.527 1.00 30.23 C ATOM 792 CG GLU A 51 -8.835 -1.690 -12.761 1.00 31.52 C ATOM 793 CD GLU A 51 -7.386 -1.703 -13.192 1.00 4.23 C ATOM 794 OE1 GLU A 51 -6.570 -2.438 -12.597 1.00 62.43 O ATOM 795 OE2 GLU A 51 -7.027 -0.956 -14.134 1.00 23.50 O ATOM 0 H GLU A 51 -9.850 -2.799 -10.242 1.00 73.41 H new ATOM 0 HA GLU A 51 -7.300 -1.615 -10.581 1.00 1.24 H new ATOM 0 HB2 GLU A 51 -10.110 -0.762 -11.316 1.00 30.23 H new ATOM 0 HB3 GLU A 51 -8.693 0.180 -11.733 1.00 30.23 H new ATOM 0 HG2 GLU A 51 -9.163 -2.709 -12.555 1.00 31.52 H new ATOM 0 HG3 GLU A 51 -9.454 -1.314 -13.575 1.00 31.52 H new ATOM 802 N GLY A 52 -9.263 -0.205 -8.387 1.00 64.04 N ATOM 803 CA GLY A 52 -9.250 0.735 -7.287 1.00 71.51 C ATOM 804 C GLY A 52 -8.177 0.385 -6.286 1.00 74.44 C ATOM 805 O GLY A 52 -7.409 1.246 -5.850 1.00 43.31 O ATOM 0 H GLY A 52 -10.121 -0.750 -8.474 1.00 64.04 H new ATOM 0 HA2 GLY A 52 -9.082 1.742 -7.668 1.00 71.51 H new ATOM 0 HA3 GLY A 52 -10.223 0.738 -6.796 1.00 71.51 H new ATOM 809 N PHE A 53 -8.111 -0.886 -5.945 1.00 24.33 N ATOM 810 CA PHE A 53 -7.114 -1.390 -5.036 1.00 32.32 C ATOM 811 C PHE A 53 -5.700 -1.286 -5.622 1.00 50.52 C ATOM 812 O PHE A 53 -4.773 -0.899 -4.933 1.00 35.53 O ATOM 813 CB PHE A 53 -7.446 -2.822 -4.608 1.00 22.23 C ATOM 814 CG PHE A 53 -6.325 -3.484 -3.909 1.00 34.31 C ATOM 815 CD1 PHE A 53 -5.816 -2.959 -2.743 1.00 1.51 C ATOM 816 CD2 PHE A 53 -5.744 -4.607 -4.446 1.00 32.55 C ATOM 817 CE1 PHE A 53 -4.755 -3.547 -2.129 1.00 22.02 C ATOM 818 CE2 PHE A 53 -4.680 -5.201 -3.838 1.00 22.33 C ATOM 819 CZ PHE A 53 -4.181 -4.676 -2.682 1.00 13.13 C ATOM 0 H PHE A 53 -8.752 -1.598 -6.295 1.00 24.33 H new ATOM 0 HA PHE A 53 -7.129 -0.762 -4.145 1.00 32.32 H new ATOM 0 HB2 PHE A 53 -8.318 -2.808 -3.955 1.00 22.23 H new ATOM 0 HB3 PHE A 53 -7.716 -3.406 -5.488 1.00 22.23 H new ATOM 0 HD1 PHE A 53 -6.262 -2.074 -2.313 1.00 1.51 H new ATOM 0 HD2 PHE A 53 -6.136 -5.024 -5.362 1.00 32.55 H new ATOM 0 HE1 PHE A 53 -4.362 -3.133 -1.212 1.00 22.02 H new ATOM 0 HE2 PHE A 53 -4.233 -6.084 -4.269 1.00 22.33 H new ATOM 0 HZ PHE A 53 -3.336 -5.143 -2.198 1.00 13.13 H new ATOM 829 N LYS A 54 -5.560 -1.631 -6.880 1.00 20.31 N ATOM 830 CA LYS A 54 -4.292 -1.521 -7.606 1.00 1.40 C ATOM 831 C LYS A 54 -3.734 -0.115 -7.510 1.00 2.43 C ATOM 832 O LYS A 54 -2.528 0.068 -7.317 1.00 71.41 O ATOM 833 CB LYS A 54 -4.550 -1.952 -9.056 1.00 13.54 C ATOM 834 CG LYS A 54 -3.372 -1.962 -10.064 1.00 53.35 C ATOM 835 CD LYS A 54 -2.952 -0.576 -10.556 1.00 13.54 C ATOM 836 CE LYS A 54 -4.078 0.142 -11.309 1.00 12.42 C ATOM 837 NZ LYS A 54 -4.563 -0.628 -12.485 1.00 22.35 N ATOM 0 H LYS A 54 -6.324 -2.001 -7.445 1.00 20.31 H new ATOM 0 HA LYS A 54 -3.535 -2.171 -7.167 1.00 1.40 H new ATOM 0 HB2 LYS A 54 -4.967 -2.959 -9.030 1.00 13.54 H new ATOM 0 HB3 LYS A 54 -5.322 -1.297 -9.460 1.00 13.54 H new ATOM 0 HG2 LYS A 54 -2.513 -2.444 -9.597 1.00 53.35 H new ATOM 0 HG3 LYS A 54 -3.650 -2.571 -10.924 1.00 53.35 H new ATOM 0 HD2 LYS A 54 -2.643 0.031 -9.705 1.00 13.54 H new ATOM 0 HD3 LYS A 54 -2.085 -0.673 -11.210 1.00 13.54 H new ATOM 0 HE2 LYS A 54 -4.910 0.319 -10.628 1.00 12.42 H new ATOM 0 HE3 LYS A 54 -3.724 1.118 -11.640 1.00 12.42 H new ATOM 0 HZ1 LYS A 54 -5.086 0.005 -13.123 1.00 22.35 H new ATOM 0 HZ2 LYS A 54 -3.751 -1.036 -12.991 1.00 22.35 H new ATOM 0 HZ3 LYS A 54 -5.191 -1.392 -12.164 1.00 22.35 H new ATOM 851 N GLU A 55 -4.601 0.871 -7.620 1.00 44.23 N ATOM 852 CA GLU A 55 -4.186 2.240 -7.476 1.00 63.02 C ATOM 853 C GLU A 55 -3.775 2.498 -6.028 1.00 42.21 C ATOM 854 O GLU A 55 -2.678 2.963 -5.765 1.00 54.30 O ATOM 855 CB GLU A 55 -5.292 3.201 -7.907 1.00 72.42 C ATOM 856 CG GLU A 55 -4.906 4.662 -7.780 1.00 43.44 C ATOM 857 CD GLU A 55 -5.985 5.592 -8.236 1.00 51.15 C ATOM 858 OE1 GLU A 55 -6.866 5.935 -7.434 1.00 42.35 O ATOM 859 OE2 GLU A 55 -5.953 6.020 -9.415 1.00 44.13 O ATOM 0 H GLU A 55 -5.595 0.744 -7.809 1.00 44.23 H new ATOM 0 HA GLU A 55 -3.330 2.417 -8.127 1.00 63.02 H new ATOM 0 HB2 GLU A 55 -5.560 2.993 -8.943 1.00 72.42 H new ATOM 0 HB3 GLU A 55 -6.180 3.014 -7.304 1.00 72.42 H new ATOM 0 HG2 GLU A 55 -4.662 4.879 -6.740 1.00 43.44 H new ATOM 0 HG3 GLU A 55 -4.004 4.846 -8.364 1.00 43.44 H new ATOM 866 N LYS A 56 -4.649 2.136 -5.102 1.00 24.00 N ATOM 867 CA LYS A 56 -4.395 2.335 -3.680 1.00 14.22 C ATOM 868 C LYS A 56 -3.106 1.665 -3.196 1.00 41.25 C ATOM 869 O LYS A 56 -2.315 2.299 -2.503 1.00 21.05 O ATOM 870 CB LYS A 56 -5.581 1.862 -2.825 1.00 43.12 C ATOM 871 CG LYS A 56 -6.852 2.689 -2.975 1.00 4.55 C ATOM 872 CD LYS A 56 -6.645 4.120 -2.494 1.00 3.25 C ATOM 873 CE LYS A 56 -7.925 4.938 -2.591 1.00 20.43 C ATOM 874 NZ LYS A 56 -7.736 6.316 -2.084 1.00 22.41 N ATOM 0 H LYS A 56 -5.547 1.700 -5.310 1.00 24.00 H new ATOM 0 HA LYS A 56 -4.268 3.410 -3.555 1.00 14.22 H new ATOM 0 HB2 LYS A 56 -5.806 0.827 -3.083 1.00 43.12 H new ATOM 0 HB3 LYS A 56 -5.281 1.871 -1.777 1.00 43.12 H new ATOM 0 HG2 LYS A 56 -7.162 2.696 -4.020 1.00 4.55 H new ATOM 0 HG3 LYS A 56 -7.658 2.226 -2.407 1.00 4.55 H new ATOM 0 HD2 LYS A 56 -6.297 4.110 -1.461 1.00 3.25 H new ATOM 0 HD3 LYS A 56 -5.864 4.594 -3.089 1.00 3.25 H new ATOM 0 HE2 LYS A 56 -8.255 4.975 -3.629 1.00 20.43 H new ATOM 0 HE3 LYS A 56 -8.715 4.447 -2.023 1.00 20.43 H new ATOM 0 HZ1 LYS A 56 -8.629 6.842 -2.167 1.00 22.41 H new ATOM 0 HZ2 LYS A 56 -7.445 6.282 -1.086 1.00 22.41 H new ATOM 0 HZ3 LYS A 56 -7.000 6.794 -2.643 1.00 22.41 H new ATOM 888 N TYR A 57 -2.870 0.404 -3.603 1.00 15.45 N ATOM 889 CA TYR A 57 -1.735 -0.369 -3.097 1.00 62.51 C ATOM 890 C TYR A 57 -0.420 0.329 -3.408 1.00 1.34 C ATOM 891 O TYR A 57 0.449 0.466 -2.542 1.00 2.34 O ATOM 892 CB TYR A 57 -1.752 -1.780 -3.696 1.00 24.55 C ATOM 893 CG TYR A 57 -0.688 -2.735 -3.159 1.00 43.31 C ATOM 894 CD1 TYR A 57 -0.910 -3.470 -2.003 1.00 53.11 C ATOM 895 CD2 TYR A 57 0.517 -2.918 -3.821 1.00 63.14 C ATOM 896 CE1 TYR A 57 0.037 -4.355 -1.523 1.00 51.32 C ATOM 897 CE2 TYR A 57 1.467 -3.809 -3.350 1.00 52.01 C ATOM 898 CZ TYR A 57 1.220 -4.522 -2.200 1.00 14.45 C ATOM 899 OH TYR A 57 2.163 -5.413 -1.733 1.00 35.15 O ATOM 0 H TYR A 57 -3.451 -0.094 -4.278 1.00 15.45 H new ATOM 0 HA TYR A 57 -1.825 -0.446 -2.013 1.00 62.51 H new ATOM 0 HB2 TYR A 57 -2.733 -2.220 -3.518 1.00 24.55 H new ATOM 0 HB3 TYR A 57 -1.631 -1.699 -4.776 1.00 24.55 H new ATOM 0 HD1 TYR A 57 -1.840 -3.348 -1.468 1.00 53.11 H new ATOM 0 HD2 TYR A 57 0.718 -2.355 -4.721 1.00 63.14 H new ATOM 0 HE1 TYR A 57 -0.153 -4.913 -0.618 1.00 51.32 H new ATOM 0 HE2 TYR A 57 2.397 -3.943 -3.883 1.00 52.01 H new ATOM 0 HH TYR A 57 3.056 -5.018 -1.816 1.00 35.15 H new ATOM 909 N MET A 58 -0.290 0.792 -4.627 1.00 5.33 N ATOM 910 CA MET A 58 0.917 1.475 -5.042 1.00 2.42 C ATOM 911 C MET A 58 1.069 2.851 -4.390 1.00 64.21 C ATOM 912 O MET A 58 2.182 3.352 -4.279 1.00 62.31 O ATOM 913 CB MET A 58 1.029 1.584 -6.572 1.00 4.43 C ATOM 914 CG MET A 58 -0.147 2.266 -7.219 1.00 65.00 C ATOM 915 SD MET A 58 0.048 2.572 -8.992 1.00 31.01 S ATOM 916 CE MET A 58 0.283 0.912 -9.626 1.00 73.42 C ATOM 0 H MET A 58 -1.003 0.710 -5.351 1.00 5.33 H new ATOM 0 HA MET A 58 1.741 0.854 -4.691 1.00 2.42 H new ATOM 0 HB2 MET A 58 1.938 2.131 -6.823 1.00 4.43 H new ATOM 0 HB3 MET A 58 1.133 0.584 -6.992 1.00 4.43 H new ATOM 0 HG2 MET A 58 -1.036 1.655 -7.064 1.00 65.00 H new ATOM 0 HG3 MET A 58 -0.322 3.217 -6.716 1.00 65.00 H new ATOM 0 HE1 MET A 58 0.133 0.910 -10.706 1.00 73.42 H new ATOM 0 HE2 MET A 58 1.295 0.576 -9.400 1.00 73.42 H new ATOM 0 HE3 MET A 58 -0.436 0.239 -9.158 1.00 73.42 H new ATOM 926 N GLU A 59 -0.035 3.442 -3.937 1.00 13.23 N ATOM 927 CA GLU A 59 0.013 4.791 -3.380 1.00 12.22 C ATOM 928 C GLU A 59 0.527 4.836 -1.946 1.00 72.13 C ATOM 929 O GLU A 59 0.960 5.900 -1.482 1.00 71.33 O ATOM 930 CB GLU A 59 -1.329 5.522 -3.480 1.00 54.25 C ATOM 931 CG GLU A 59 -1.818 5.729 -4.893 1.00 50.43 C ATOM 932 CD GLU A 59 -3.035 6.616 -4.968 1.00 61.11 C ATOM 933 OE1 GLU A 59 -4.116 6.229 -4.486 1.00 12.52 O ATOM 934 OE2 GLU A 59 -2.921 7.730 -5.528 1.00 74.23 O ATOM 0 H GLU A 59 -0.961 3.015 -3.944 1.00 13.23 H new ATOM 0 HA GLU A 59 0.735 5.317 -4.004 1.00 12.22 H new ATOM 0 HB2 GLU A 59 -2.080 4.957 -2.927 1.00 54.25 H new ATOM 0 HB3 GLU A 59 -1.238 6.493 -2.993 1.00 54.25 H new ATOM 0 HG2 GLU A 59 -1.017 6.168 -5.489 1.00 50.43 H new ATOM 0 HG3 GLU A 59 -2.052 4.761 -5.337 1.00 50.43 H new ATOM 941 N PHE A 60 0.468 3.720 -1.233 1.00 25.15 N ATOM 942 CA PHE A 60 0.964 3.705 0.142 1.00 34.54 C ATOM 943 C PHE A 60 2.482 3.831 0.159 1.00 1.34 C ATOM 944 O PHE A 60 3.024 4.913 0.405 1.00 55.42 O ATOM 945 CB PHE A 60 0.520 2.450 0.922 1.00 34.13 C ATOM 946 CG PHE A 60 -0.970 2.310 1.095 1.00 24.11 C ATOM 947 CD1 PHE A 60 -1.642 3.067 2.035 1.00 52.35 C ATOM 948 CD2 PHE A 60 -1.691 1.426 0.318 1.00 70.01 C ATOM 949 CE1 PHE A 60 -3.012 2.950 2.189 1.00 53.32 C ATOM 950 CE2 PHE A 60 -3.060 1.300 0.469 1.00 61.21 C ATOM 951 CZ PHE A 60 -3.719 2.061 1.406 1.00 63.22 C ATOM 0 H PHE A 60 0.093 2.833 -1.569 1.00 25.15 H new ATOM 0 HA PHE A 60 0.523 4.564 0.648 1.00 34.54 H new ATOM 0 HB2 PHE A 60 0.897 1.567 0.407 1.00 34.13 H new ATOM 0 HB3 PHE A 60 0.986 2.467 1.907 1.00 34.13 H new ATOM 0 HD1 PHE A 60 -1.092 3.758 2.657 1.00 52.35 H new ATOM 0 HD2 PHE A 60 -1.179 0.824 -0.418 1.00 70.01 H new ATOM 0 HE1 PHE A 60 -3.527 3.554 2.921 1.00 53.32 H new ATOM 0 HE2 PHE A 60 -3.611 0.605 -0.148 1.00 61.21 H new ATOM 0 HZ PHE A 60 -4.788 1.963 1.529 1.00 63.22 H new ATOM 961 N ASP A 61 3.153 2.747 -0.137 1.00 74.42 N ATOM 962 CA ASP A 61 4.605 2.705 -0.180 1.00 60.55 C ATOM 963 C ASP A 61 5.004 1.349 -0.616 1.00 14.21 C ATOM 964 O ASP A 61 4.575 0.374 -0.039 1.00 33.21 O ATOM 965 CB ASP A 61 5.218 2.977 1.196 1.00 20.34 C ATOM 966 CG ASP A 61 6.729 3.040 1.185 1.00 72.34 C ATOM 967 OD1 ASP A 61 7.283 4.131 0.915 1.00 34.23 O ATOM 968 OD2 ASP A 61 7.380 2.021 1.485 1.00 74.24 O ATOM 0 H ASP A 61 2.708 1.856 -0.358 1.00 74.42 H new ATOM 0 HA ASP A 61 4.961 3.474 -0.866 1.00 60.55 H new ATOM 0 HB2 ASP A 61 4.826 3.919 1.579 1.00 20.34 H new ATOM 0 HB3 ASP A 61 4.900 2.196 1.887 1.00 20.34 H new ATOM 973 N LEU A 62 5.769 1.273 -1.640 1.00 31.54 N ATOM 974 CA LEU A 62 6.232 0.012 -2.118 1.00 64.23 C ATOM 975 C LEU A 62 7.731 -0.077 -1.907 1.00 72.22 C ATOM 976 O LEU A 62 8.507 0.517 -2.667 1.00 41.14 O ATOM 977 CB LEU A 62 5.871 -0.174 -3.608 1.00 23.03 C ATOM 978 CG LEU A 62 4.367 -0.085 -3.968 1.00 52.14 C ATOM 979 CD1 LEU A 62 4.142 -0.231 -5.462 1.00 11.20 C ATOM 980 CD2 LEU A 62 3.590 -1.144 -3.251 1.00 54.44 C ATOM 0 H LEU A 62 6.095 2.078 -2.175 1.00 31.54 H new ATOM 0 HA LEU A 62 5.744 -0.788 -1.562 1.00 64.23 H new ATOM 0 HB2 LEU A 62 6.406 0.580 -4.186 1.00 23.03 H new ATOM 0 HB3 LEU A 62 6.243 -1.146 -3.931 1.00 23.03 H new ATOM 0 HG LEU A 62 4.020 0.900 -3.656 1.00 52.14 H new ATOM 0 HD11 LEU A 62 3.076 -0.164 -5.678 1.00 11.20 H new ATOM 0 HD12 LEU A 62 4.670 0.564 -5.989 1.00 11.20 H new ATOM 0 HD13 LEU A 62 4.519 -1.198 -5.794 1.00 11.20 H new ATOM 0 HD21 LEU A 62 2.536 -1.065 -3.517 1.00 54.44 H new ATOM 0 HD22 LEU A 62 3.964 -2.127 -3.538 1.00 54.44 H new ATOM 0 HD23 LEU A 62 3.703 -1.013 -2.175 1.00 54.44 H new ATOM 992 N ASN A 63 8.141 -0.756 -0.840 1.00 0.34 N ATOM 993 CA ASN A 63 9.574 -0.925 -0.560 1.00 33.24 C ATOM 994 C ASN A 63 10.194 -1.974 -1.476 1.00 60.30 C ATOM 995 O ASN A 63 9.551 -2.427 -2.415 1.00 73.21 O ATOM 996 CB ASN A 63 9.890 -1.254 0.929 1.00 44.22 C ATOM 997 CG ASN A 63 9.270 -2.537 1.466 1.00 41.35 C ATOM 998 OD1 ASN A 63 9.784 -3.633 1.225 1.00 23.13 O ATOM 999 ND2 ASN A 63 8.242 -2.411 2.266 1.00 3.31 N ATOM 0 H ASN A 63 7.518 -1.194 -0.162 1.00 0.34 H new ATOM 0 HA ASN A 63 10.026 0.046 -0.764 1.00 33.24 H new ATOM 0 HB2 ASN A 63 10.972 -1.318 1.047 1.00 44.22 H new ATOM 0 HB3 ASN A 63 9.551 -0.422 1.546 1.00 44.22 H new ATOM 0 HD21 ASN A 63 7.840 -3.235 2.713 1.00 3.31 H new ATOM 0 HD22 ASN A 63 7.843 -1.489 2.442 1.00 3.31 H new ATOM 1006 N GLY A 64 11.442 -2.358 -1.186 1.00 34.00 N ATOM 1007 CA GLY A 64 12.190 -3.322 -2.000 1.00 71.35 C ATOM 1008 C GLY A 64 11.452 -4.627 -2.276 1.00 75.22 C ATOM 1009 O GLY A 64 11.658 -5.258 -3.314 1.00 74.13 O ATOM 0 H GLY A 64 11.962 -2.009 -0.381 1.00 34.00 H new ATOM 0 HA2 GLY A 64 12.443 -2.855 -2.952 1.00 71.35 H new ATOM 0 HA3 GLY A 64 13.130 -3.551 -1.497 1.00 71.35 H new ATOM 1013 N ASN A 65 10.593 -5.028 -1.369 1.00 63.42 N ATOM 1014 CA ASN A 65 9.845 -6.272 -1.538 1.00 75.02 C ATOM 1015 C ASN A 65 8.474 -6.011 -2.138 1.00 72.33 C ATOM 1016 O ASN A 65 7.681 -6.932 -2.288 1.00 23.34 O ATOM 1017 CB ASN A 65 9.669 -7.005 -0.198 1.00 32.45 C ATOM 1018 CG ASN A 65 10.973 -7.402 0.456 1.00 45.14 C ATOM 1019 OD1 ASN A 65 11.980 -7.648 -0.215 1.00 3.43 O ATOM 1020 ND2 ASN A 65 10.971 -7.470 1.762 1.00 64.44 N ATOM 0 H ASN A 65 10.389 -4.521 -0.508 1.00 63.42 H new ATOM 0 HA ASN A 65 10.424 -6.898 -2.217 1.00 75.02 H new ATOM 0 HB2 ASN A 65 9.111 -6.365 0.485 1.00 32.45 H new ATOM 0 HB3 ASN A 65 9.067 -7.899 -0.360 1.00 32.45 H new ATOM 0 HD21 ASN A 65 11.821 -7.734 2.260 1.00 64.44 H new ATOM 0 HD22 ASN A 65 10.119 -7.259 2.282 1.00 64.44 H new ATOM 1027 N GLY A 66 8.209 -4.758 -2.503 1.00 65.34 N ATOM 1028 CA GLY A 66 6.885 -4.373 -2.978 1.00 21.12 C ATOM 1029 C GLY A 66 5.891 -4.534 -1.867 1.00 4.32 C ATOM 1030 O GLY A 66 4.763 -4.969 -2.061 1.00 31.04 O ATOM 0 H GLY A 66 8.889 -3.998 -2.479 1.00 65.34 H new ATOM 0 HA2 GLY A 66 6.897 -3.339 -3.323 1.00 21.12 H new ATOM 0 HA3 GLY A 66 6.598 -4.990 -3.830 1.00 21.12 H new ATOM 1034 N ASP A 67 6.332 -4.150 -0.718 1.00 43.53 N ATOM 1035 CA ASP A 67 5.652 -4.381 0.527 1.00 73.13 C ATOM 1036 C ASP A 67 5.230 -3.071 1.190 1.00 72.43 C ATOM 1037 O ASP A 67 5.813 -2.019 0.912 1.00 10.21 O ATOM 1038 CB ASP A 67 6.616 -5.187 1.399 1.00 45.13 C ATOM 1039 CG ASP A 67 6.250 -5.283 2.836 1.00 55.42 C ATOM 1040 OD1 ASP A 67 5.289 -5.979 3.171 1.00 24.43 O ATOM 1041 OD2 ASP A 67 6.966 -4.673 3.651 1.00 22.11 O ATOM 0 H ASP A 67 7.211 -3.645 -0.607 1.00 43.53 H new ATOM 0 HA ASP A 67 4.724 -4.932 0.372 1.00 73.13 H new ATOM 0 HB2 ASP A 67 6.689 -6.196 0.992 1.00 45.13 H new ATOM 0 HB3 ASP A 67 7.607 -4.740 1.323 1.00 45.13 H new ATOM 1046 N ILE A 68 4.220 -3.154 2.044 1.00 33.35 N ATOM 1047 CA ILE A 68 3.652 -2.008 2.749 1.00 12.13 C ATOM 1048 C ILE A 68 3.621 -2.313 4.241 1.00 13.20 C ATOM 1049 O ILE A 68 2.984 -3.279 4.655 1.00 70.14 O ATOM 1050 CB ILE A 68 2.187 -1.733 2.271 1.00 54.44 C ATOM 1051 CG1 ILE A 68 2.165 -1.373 0.790 1.00 3.23 C ATOM 1052 CG2 ILE A 68 1.536 -0.616 3.092 1.00 54.21 C ATOM 1053 CD1 ILE A 68 0.792 -1.215 0.207 1.00 44.13 C ATOM 0 H ILE A 68 3.762 -4.036 2.272 1.00 33.35 H new ATOM 0 HA ILE A 68 4.266 -1.132 2.542 1.00 12.13 H new ATOM 0 HB ILE A 68 1.613 -2.647 2.422 1.00 54.44 H new ATOM 0 HG12 ILE A 68 2.715 -0.443 0.647 1.00 3.23 H new ATOM 0 HG13 ILE A 68 2.695 -2.146 0.234 1.00 3.23 H new ATOM 0 HG21 ILE A 68 0.519 -0.448 2.736 1.00 54.21 H new ATOM 0 HG22 ILE A 68 1.510 -0.905 4.143 1.00 54.21 H new ATOM 0 HG23 ILE A 68 2.115 0.301 2.982 1.00 54.21 H new ATOM 0 HD11 ILE A 68 0.873 -0.959 -0.850 1.00 44.13 H new ATOM 0 HD12 ILE A 68 0.242 -2.150 0.313 1.00 44.13 H new ATOM 0 HD13 ILE A 68 0.262 -0.421 0.733 1.00 44.13 H new ATOM 1065 N ASP A 69 4.307 -1.511 5.036 1.00 40.54 N ATOM 1066 CA ASP A 69 4.319 -1.706 6.489 1.00 32.31 C ATOM 1067 C ASP A 69 3.150 -0.927 7.080 1.00 35.31 C ATOM 1068 O ASP A 69 2.442 -0.211 6.338 1.00 61.24 O ATOM 1069 CB ASP A 69 5.579 -1.130 7.122 1.00 24.14 C ATOM 1070 CG ASP A 69 6.888 -1.438 6.416 1.00 12.33 C ATOM 1071 OD1 ASP A 69 7.173 -0.803 5.365 1.00 34.10 O ATOM 1072 OD2 ASP A 69 7.679 -2.259 6.924 1.00 62.41 O ATOM 0 H ASP A 69 4.863 -0.720 4.710 1.00 40.54 H new ATOM 0 HA ASP A 69 4.265 -2.777 6.686 1.00 32.31 H new ATOM 0 HB2 ASP A 69 5.468 -0.047 7.180 1.00 24.14 H new ATOM 0 HB3 ASP A 69 5.647 -1.499 8.145 1.00 24.14 H new ATOM 1077 N ILE A 70 2.953 -0.995 8.416 1.00 22.05 N ATOM 1078 CA ILE A 70 1.872 -0.228 9.016 1.00 12.31 C ATOM 1079 C ILE A 70 2.193 1.242 8.891 1.00 31.31 C ATOM 1080 O ILE A 70 1.314 2.071 8.757 1.00 72.01 O ATOM 1081 CB ILE A 70 1.602 -0.497 10.521 1.00 45.02 C ATOM 1082 CG1 ILE A 70 2.724 -0.043 11.408 1.00 74.52 C ATOM 1083 CG2 ILE A 70 1.303 -1.936 10.770 1.00 15.00 C ATOM 1084 CD1 ILE A 70 2.314 0.010 12.827 1.00 3.22 C ATOM 0 H ILE A 70 3.510 -1.552 9.064 1.00 22.05 H new ATOM 0 HA ILE A 70 0.979 -0.540 8.474 1.00 12.31 H new ATOM 0 HB ILE A 70 0.726 0.098 10.778 1.00 45.02 H new ATOM 0 HG12 ILE A 70 3.571 -0.721 11.299 1.00 74.52 H new ATOM 0 HG13 ILE A 70 3.062 0.943 11.090 1.00 74.52 H new ATOM 0 HG21 ILE A 70 1.119 -2.091 11.833 1.00 15.00 H new ATOM 0 HG22 ILE A 70 0.419 -2.228 10.202 1.00 15.00 H new ATOM 0 HG23 ILE A 70 2.152 -2.544 10.457 1.00 15.00 H new ATOM 0 HD11 ILE A 70 3.154 0.343 13.436 1.00 3.22 H new ATOM 0 HD12 ILE A 70 1.484 0.708 12.940 1.00 3.22 H new ATOM 0 HD13 ILE A 70 2.001 -0.982 13.152 1.00 3.22 H new ATOM 1096 N MET A 71 3.493 1.539 8.953 1.00 14.23 N ATOM 1097 CA MET A 71 4.022 2.851 8.871 1.00 55.11 C ATOM 1098 C MET A 71 3.632 3.474 7.547 1.00 53.24 C ATOM 1099 O MET A 71 3.164 4.605 7.494 1.00 74.22 O ATOM 1100 CB MET A 71 5.526 2.741 8.960 1.00 30.33 C ATOM 1101 CG MET A 71 6.163 3.940 9.544 1.00 12.02 C ATOM 1102 SD MET A 71 5.517 4.206 11.196 1.00 65.44 S ATOM 1103 CE MET A 71 6.550 5.518 11.717 1.00 42.24 C ATOM 0 H MET A 71 4.213 0.825 9.066 1.00 14.23 H new ATOM 0 HA MET A 71 3.634 3.475 9.676 1.00 55.11 H new ATOM 0 HB2 MET A 71 5.785 1.870 9.562 1.00 30.33 H new ATOM 0 HB3 MET A 71 5.931 2.571 7.962 1.00 30.33 H new ATOM 0 HG2 MET A 71 7.245 3.811 9.580 1.00 12.02 H new ATOM 0 HG3 MET A 71 5.967 4.811 8.919 1.00 12.02 H new ATOM 0 HE1 MET A 71 6.283 5.810 12.732 1.00 42.24 H new ATOM 0 HE2 MET A 71 7.590 5.193 11.695 1.00 42.24 H new ATOM 0 HE3 MET A 71 6.422 6.369 11.049 1.00 42.24 H new ATOM 1113 N SER A 72 3.805 2.704 6.492 1.00 42.13 N ATOM 1114 CA SER A 72 3.480 3.116 5.151 1.00 61.11 C ATOM 1115 C SER A 72 1.981 3.393 5.016 1.00 43.14 C ATOM 1116 O SER A 72 1.570 4.353 4.364 1.00 14.32 O ATOM 1117 CB SER A 72 3.887 2.007 4.207 1.00 14.33 C ATOM 1118 OG SER A 72 5.276 1.716 4.339 1.00 44.25 O ATOM 0 H SER A 72 4.183 1.758 6.549 1.00 42.13 H new ATOM 0 HA SER A 72 4.012 4.036 4.911 1.00 61.11 H new ATOM 0 HB2 SER A 72 3.302 1.112 4.416 1.00 14.33 H new ATOM 0 HB3 SER A 72 3.668 2.298 3.180 1.00 14.33 H new ATOM 0 HG SER A 72 5.519 0.995 3.721 1.00 44.25 H new ATOM 1124 N LEU A 73 1.188 2.553 5.650 1.00 32.11 N ATOM 1125 CA LEU A 73 -0.253 2.678 5.638 1.00 14.31 C ATOM 1126 C LEU A 73 -0.644 3.944 6.422 1.00 11.44 C ATOM 1127 O LEU A 73 -1.391 4.790 5.928 1.00 14.13 O ATOM 1128 CB LEU A 73 -0.850 1.436 6.327 1.00 22.50 C ATOM 1129 CG LEU A 73 -2.367 1.267 6.285 1.00 25.15 C ATOM 1130 CD1 LEU A 73 -2.825 0.966 4.872 1.00 2.35 C ATOM 1131 CD2 LEU A 73 -2.818 0.178 7.250 1.00 4.03 C ATOM 0 H LEU A 73 1.529 1.759 6.192 1.00 32.11 H new ATOM 0 HA LEU A 73 -0.628 2.752 4.617 1.00 14.31 H new ATOM 0 HB2 LEU A 73 -0.401 0.552 5.875 1.00 22.50 H new ATOM 0 HB3 LEU A 73 -0.542 1.451 7.372 1.00 22.50 H new ATOM 0 HG LEU A 73 -2.828 2.203 6.601 1.00 25.15 H new ATOM 0 HD11 LEU A 73 -3.909 0.848 4.858 1.00 2.35 H new ATOM 0 HD12 LEU A 73 -2.541 1.788 4.215 1.00 2.35 H new ATOM 0 HD13 LEU A 73 -2.355 0.045 4.526 1.00 2.35 H new ATOM 0 HD21 LEU A 73 -3.902 0.076 7.202 1.00 4.03 H new ATOM 0 HD22 LEU A 73 -2.352 -0.768 6.975 1.00 4.03 H new ATOM 0 HD23 LEU A 73 -2.523 0.446 8.265 1.00 4.03 H new ATOM 1143 N LYS A 74 -0.091 4.065 7.637 1.00 3.20 N ATOM 1144 CA LYS A 74 -0.352 5.179 8.542 1.00 11.53 C ATOM 1145 C LYS A 74 -0.069 6.542 7.885 1.00 11.12 C ATOM 1146 O LYS A 74 -0.821 7.497 8.085 1.00 23.20 O ATOM 1147 CB LYS A 74 0.485 4.953 9.825 1.00 32.11 C ATOM 1148 CG LYS A 74 0.197 5.865 11.029 1.00 65.12 C ATOM 1149 CD LYS A 74 0.890 7.220 10.963 1.00 21.44 C ATOM 1150 CE LYS A 74 2.394 7.036 10.875 1.00 51.25 C ATOM 1151 NZ LYS A 74 3.133 8.282 11.164 1.00 3.04 N ATOM 0 H LYS A 74 0.559 3.378 8.019 1.00 3.20 H new ATOM 0 HA LYS A 74 -1.411 5.207 8.798 1.00 11.53 H new ATOM 0 HB2 LYS A 74 0.341 3.920 10.143 1.00 32.11 H new ATOM 0 HB3 LYS A 74 1.538 5.063 9.564 1.00 32.11 H new ATOM 0 HG2 LYS A 74 -0.879 6.023 11.103 1.00 65.12 H new ATOM 0 HG3 LYS A 74 0.507 5.354 11.940 1.00 65.12 H new ATOM 0 HD2 LYS A 74 0.533 7.777 10.097 1.00 21.44 H new ATOM 0 HD3 LYS A 74 0.639 7.808 11.846 1.00 21.44 H new ATOM 0 HE2 LYS A 74 2.704 6.262 11.577 1.00 51.25 H new ATOM 0 HE3 LYS A 74 2.656 6.685 9.877 1.00 51.25 H new ATOM 0 HZ1 LYS A 74 4.150 8.127 11.009 1.00 3.04 H new ATOM 0 HZ2 LYS A 74 2.798 9.038 10.534 1.00 3.04 H new ATOM 0 HZ3 LYS A 74 2.972 8.559 12.153 1.00 3.04 H new ATOM 1165 N ARG A 75 0.987 6.607 7.079 1.00 11.40 N ATOM 1166 CA ARG A 75 1.393 7.851 6.403 1.00 20.04 C ATOM 1167 C ARG A 75 0.292 8.451 5.522 1.00 24.45 C ATOM 1168 O ARG A 75 0.202 9.680 5.379 1.00 54.22 O ATOM 1169 CB ARG A 75 2.681 7.650 5.595 1.00 62.22 C ATOM 1170 CG ARG A 75 3.903 7.384 6.453 1.00 25.14 C ATOM 1171 CD ARG A 75 5.141 7.112 5.615 1.00 3.41 C ATOM 1172 NE ARG A 75 6.319 6.873 6.464 1.00 74.30 N ATOM 1173 CZ ARG A 75 7.434 6.230 6.078 1.00 15.52 C ATOM 1174 NH1 ARG A 75 7.555 5.787 4.823 1.00 42.33 N ATOM 1175 NH2 ARG A 75 8.430 6.053 6.945 1.00 73.33 N ATOM 0 H ARG A 75 1.587 5.808 6.872 1.00 11.40 H new ATOM 0 HA ARG A 75 1.584 8.573 7.197 1.00 20.04 H new ATOM 0 HB2 ARG A 75 2.542 6.816 4.908 1.00 62.22 H new ATOM 0 HB3 ARG A 75 2.861 8.537 4.987 1.00 62.22 H new ATOM 0 HG2 ARG A 75 4.085 8.242 7.100 1.00 25.14 H new ATOM 0 HG3 ARG A 75 3.711 6.530 7.103 1.00 25.14 H new ATOM 0 HD2 ARG A 75 4.968 6.245 4.977 1.00 3.41 H new ATOM 0 HD3 ARG A 75 5.331 7.960 4.956 1.00 3.41 H new ATOM 0 HE ARG A 75 6.287 7.223 7.421 1.00 74.30 H new ATOM 0 HH11 ARG A 75 6.799 5.937 4.154 1.00 42.33 H new ATOM 0 HH12 ARG A 75 8.403 5.299 4.534 1.00 42.33 H new ATOM 0 HH21 ARG A 75 8.345 6.405 7.898 1.00 73.33 H new ATOM 0 HH22 ARG A 75 9.278 5.565 6.655 1.00 73.33 H new ATOM 1189 N MET A 76 -0.546 7.610 4.948 1.00 54.32 N ATOM 1190 CA MET A 76 -1.607 8.106 4.093 1.00 60.10 C ATOM 1191 C MET A 76 -2.737 8.714 4.924 1.00 34.24 C ATOM 1192 O MET A 76 -3.232 9.803 4.615 1.00 45.20 O ATOM 1193 CB MET A 76 -2.134 7.017 3.159 1.00 11.04 C ATOM 1194 CG MET A 76 -3.198 7.525 2.202 1.00 74.31 C ATOM 1195 SD MET A 76 -3.823 6.266 1.079 1.00 12.24 S ATOM 1196 CE MET A 76 -2.319 5.826 0.219 1.00 60.44 C ATOM 0 H MET A 76 -0.515 6.596 5.055 1.00 54.32 H new ATOM 0 HA MET A 76 -1.185 8.893 3.468 1.00 60.10 H new ATOM 0 HB2 MET A 76 -1.304 6.604 2.586 1.00 11.04 H new ATOM 0 HB3 MET A 76 -2.547 6.203 3.755 1.00 11.04 H new ATOM 0 HG2 MET A 76 -4.030 7.929 2.779 1.00 74.31 H new ATOM 0 HG3 MET A 76 -2.786 8.348 1.618 1.00 74.31 H new ATOM 0 HE1 MET A 76 -2.527 5.027 -0.493 1.00 60.44 H new ATOM 0 HE2 MET A 76 -1.937 6.696 -0.314 1.00 60.44 H new ATOM 0 HE3 MET A 76 -1.574 5.486 0.939 1.00 60.44 H new ATOM 1206 N LEU A 77 -3.121 8.019 6.000 1.00 2.40 N ATOM 1207 CA LEU A 77 -4.196 8.473 6.895 1.00 13.01 C ATOM 1208 C LEU A 77 -3.889 9.816 7.517 1.00 51.50 C ATOM 1209 O LEU A 77 -4.795 10.580 7.803 1.00 51.54 O ATOM 1210 CB LEU A 77 -4.519 7.448 8.003 1.00 44.22 C ATOM 1211 CG LEU A 77 -5.240 6.153 7.590 1.00 25.50 C ATOM 1212 CD1 LEU A 77 -4.430 5.316 6.663 1.00 14.22 C ATOM 1213 CD2 LEU A 77 -5.623 5.363 8.799 1.00 43.43 C ATOM 0 H LEU A 77 -2.700 7.132 6.276 1.00 2.40 H new ATOM 0 HA LEU A 77 -5.077 8.575 6.262 1.00 13.01 H new ATOM 0 HB2 LEU A 77 -3.583 7.171 8.487 1.00 44.22 H new ATOM 0 HB3 LEU A 77 -5.131 7.948 8.754 1.00 44.22 H new ATOM 0 HG LEU A 77 -6.139 6.449 7.049 1.00 25.50 H new ATOM 0 HD11 LEU A 77 -4.987 4.416 6.405 1.00 14.22 H new ATOM 0 HD12 LEU A 77 -4.214 5.882 5.757 1.00 14.22 H new ATOM 0 HD13 LEU A 77 -3.495 5.037 7.148 1.00 14.22 H new ATOM 0 HD21 LEU A 77 -6.132 4.450 8.491 1.00 43.43 H new ATOM 0 HD22 LEU A 77 -4.727 5.106 9.364 1.00 43.43 H new ATOM 0 HD23 LEU A 77 -6.289 5.956 9.425 1.00 43.43 H new ATOM 1225 N GLU A 78 -2.604 10.096 7.715 1.00 13.43 N ATOM 1226 CA GLU A 78 -2.163 11.376 8.268 1.00 20.54 C ATOM 1227 C GLU A 78 -2.678 12.511 7.401 1.00 1.12 C ATOM 1228 O GLU A 78 -3.204 13.507 7.897 1.00 33.34 O ATOM 1229 CB GLU A 78 -0.643 11.467 8.250 1.00 42.35 C ATOM 1230 CG GLU A 78 0.081 10.357 8.954 1.00 20.33 C ATOM 1231 CD GLU A 78 1.569 10.524 8.857 1.00 41.30 C ATOM 1232 OE1 GLU A 78 2.082 10.685 7.735 1.00 4.12 O ATOM 1233 OE2 GLU A 78 2.247 10.464 9.895 1.00 44.02 O ATOM 0 H GLU A 78 -1.844 9.450 7.500 1.00 13.43 H new ATOM 0 HA GLU A 78 -2.542 11.448 9.287 1.00 20.54 H new ATOM 0 HB2 GLU A 78 -0.311 11.493 7.212 1.00 42.35 H new ATOM 0 HB3 GLU A 78 -0.348 12.414 8.703 1.00 42.35 H new ATOM 0 HG2 GLU A 78 -0.216 10.335 10.002 1.00 20.33 H new ATOM 0 HG3 GLU A 78 -0.208 9.400 8.520 1.00 20.33 H new ATOM 1240 N LYS A 79 -2.503 12.342 6.105 1.00 41.33 N ATOM 1241 CA LYS A 79 -2.850 13.354 5.132 1.00 72.41 C ATOM 1242 C LYS A 79 -4.354 13.400 4.941 1.00 64.34 C ATOM 1243 O LYS A 79 -4.949 14.460 4.779 1.00 44.43 O ATOM 1244 CB LYS A 79 -2.166 13.051 3.791 1.00 73.53 C ATOM 1245 CG LYS A 79 -0.685 12.687 3.902 1.00 35.05 C ATOM 1246 CD LYS A 79 0.114 13.715 4.688 1.00 72.34 C ATOM 1247 CE LYS A 79 1.587 13.336 4.760 1.00 44.20 C ATOM 1248 NZ LYS A 79 1.819 11.994 5.367 1.00 20.12 N ATOM 0 H LYS A 79 -2.113 11.492 5.697 1.00 41.33 H new ATOM 0 HA LYS A 79 -2.508 14.323 5.497 1.00 72.41 H new ATOM 0 HB2 LYS A 79 -2.694 12.230 3.306 1.00 73.53 H new ATOM 0 HB3 LYS A 79 -2.266 13.921 3.142 1.00 73.53 H new ATOM 0 HG2 LYS A 79 -0.589 11.713 4.383 1.00 35.05 H new ATOM 0 HG3 LYS A 79 -0.262 12.592 2.902 1.00 35.05 H new ATOM 0 HD2 LYS A 79 0.011 14.694 4.220 1.00 72.34 H new ATOM 0 HD3 LYS A 79 -0.291 13.800 5.696 1.00 72.34 H new ATOM 0 HE2 LYS A 79 2.009 13.351 3.755 1.00 44.20 H new ATOM 0 HE3 LYS A 79 2.121 14.088 5.341 1.00 44.20 H new ATOM 0 HZ1 LYS A 79 2.805 11.706 5.206 1.00 20.12 H new ATOM 0 HZ2 LYS A 79 1.634 12.039 6.389 1.00 20.12 H new ATOM 0 HZ3 LYS A 79 1.180 11.300 4.930 1.00 20.12 H new ATOM 1262 N LEU A 80 -4.958 12.239 4.978 1.00 32.21 N ATOM 1263 CA LEU A 80 -6.371 12.092 4.746 1.00 20.11 C ATOM 1264 C LEU A 80 -7.193 12.387 6.000 1.00 72.43 C ATOM 1265 O LEU A 80 -6.653 12.775 7.051 1.00 34.01 O ATOM 1266 CB LEU A 80 -6.660 10.691 4.223 1.00 22.22 C ATOM 1267 CG LEU A 80 -5.986 10.319 2.901 1.00 30.41 C ATOM 1268 CD1 LEU A 80 -6.344 8.911 2.510 1.00 21.33 C ATOM 1269 CD2 LEU A 80 -6.384 11.284 1.797 1.00 25.25 C ATOM 0 H LEU A 80 -4.477 11.361 5.172 1.00 32.21 H new ATOM 0 HA LEU A 80 -6.669 12.825 3.997 1.00 20.11 H new ATOM 0 HB2 LEU A 80 -6.352 9.971 4.981 1.00 22.22 H new ATOM 0 HB3 LEU A 80 -7.738 10.585 4.101 1.00 22.22 H new ATOM 0 HG LEU A 80 -4.907 10.385 3.041 1.00 30.41 H new ATOM 0 HD11 LEU A 80 -5.857 8.660 1.567 1.00 21.33 H new ATOM 0 HD12 LEU A 80 -6.010 8.222 3.286 1.00 21.33 H new ATOM 0 HD13 LEU A 80 -7.425 8.829 2.393 1.00 21.33 H new ATOM 0 HD21 LEU A 80 -5.891 10.997 0.868 1.00 25.25 H new ATOM 0 HD22 LEU A 80 -7.465 11.253 1.659 1.00 25.25 H new ATOM 0 HD23 LEU A 80 -6.082 12.295 2.071 1.00 25.25 H new ATOM 1281 N GLY A 81 -8.493 12.211 5.887 1.00 22.14 N ATOM 1282 CA GLY A 81 -9.377 12.482 6.992 1.00 22.33 C ATOM 1283 C GLY A 81 -9.669 11.257 7.814 1.00 50.44 C ATOM 1284 O GLY A 81 -10.275 11.352 8.873 1.00 45.21 O ATOM 0 H GLY A 81 -8.957 11.882 5.040 1.00 22.14 H new ATOM 0 HA2 GLY A 81 -8.931 13.245 7.630 1.00 22.33 H new ATOM 0 HA3 GLY A 81 -10.313 12.891 6.612 1.00 22.33 H new ATOM 1288 N VAL A 82 -9.252 10.114 7.322 1.00 12.23 N ATOM 1289 CA VAL A 82 -9.424 8.861 8.020 1.00 61.14 C ATOM 1290 C VAL A 82 -8.472 8.787 9.242 1.00 53.22 C ATOM 1291 O VAL A 82 -7.247 8.767 9.093 1.00 61.20 O ATOM 1292 CB VAL A 82 -9.203 7.662 7.042 1.00 65.54 C ATOM 1293 CG1 VAL A 82 -7.914 7.837 6.255 1.00 1.44 C ATOM 1294 CG2 VAL A 82 -9.198 6.333 7.790 1.00 71.42 C ATOM 0 H VAL A 82 -8.781 10.026 6.421 1.00 12.23 H new ATOM 0 HA VAL A 82 -10.446 8.800 8.395 1.00 61.14 H new ATOM 0 HB VAL A 82 -10.036 7.649 6.339 1.00 65.54 H new ATOM 0 HG11 VAL A 82 -7.781 6.991 5.581 1.00 1.44 H new ATOM 0 HG12 VAL A 82 -7.964 8.758 5.675 1.00 1.44 H new ATOM 0 HG13 VAL A 82 -7.071 7.888 6.944 1.00 1.44 H new ATOM 0 HG21 VAL A 82 -9.042 5.518 7.083 1.00 71.42 H new ATOM 0 HG22 VAL A 82 -8.394 6.333 8.526 1.00 71.42 H new ATOM 0 HG23 VAL A 82 -10.154 6.197 8.296 1.00 71.42 H new ATOM 1304 N PRO A 83 -9.011 8.811 10.467 1.00 15.11 N ATOM 1305 CA PRO A 83 -8.209 8.773 11.658 1.00 33.24 C ATOM 1306 C PRO A 83 -8.090 7.373 12.278 1.00 71.34 C ATOM 1307 O PRO A 83 -9.082 6.798 12.777 1.00 24.01 O ATOM 1308 CB PRO A 83 -8.984 9.697 12.597 1.00 34.33 C ATOM 1309 CG PRO A 83 -10.422 9.610 12.147 1.00 21.50 C ATOM 1310 CD PRO A 83 -10.435 8.926 10.794 1.00 51.42 C ATOM 0 HA PRO A 83 -7.178 9.066 11.461 1.00 33.24 H new ATOM 0 HB2 PRO A 83 -8.877 9.382 13.635 1.00 34.33 H new ATOM 0 HB3 PRO A 83 -8.614 10.720 12.535 1.00 34.33 H new ATOM 0 HG2 PRO A 83 -11.016 9.047 12.867 1.00 21.50 H new ATOM 0 HG3 PRO A 83 -10.863 10.604 12.078 1.00 21.50 H new ATOM 0 HD2 PRO A 83 -10.918 7.950 10.840 1.00 51.42 H new ATOM 0 HD3 PRO A 83 -10.973 9.513 10.050 1.00 51.42 H new ATOM 1318 N LYS A 84 -6.909 6.813 12.231 1.00 64.41 N ATOM 1319 CA LYS A 84 -6.639 5.577 12.910 1.00 20.32 C ATOM 1320 C LYS A 84 -5.438 5.713 13.817 1.00 41.34 C ATOM 1321 O LYS A 84 -4.383 6.186 13.392 1.00 44.11 O ATOM 1322 CB LYS A 84 -6.459 4.401 11.942 1.00 3.02 C ATOM 1323 CG LYS A 84 -7.730 3.945 11.231 1.00 30.32 C ATOM 1324 CD LYS A 84 -8.777 3.532 12.243 1.00 33.43 C ATOM 1325 CE LYS A 84 -9.984 2.899 11.604 1.00 3.14 C ATOM 1326 NZ LYS A 84 -10.976 2.529 12.630 1.00 33.31 N ATOM 0 H LYS A 84 -6.113 7.200 11.724 1.00 64.41 H new ATOM 0 HA LYS A 84 -7.515 5.354 13.519 1.00 20.32 H new ATOM 0 HB2 LYS A 84 -5.721 4.680 11.190 1.00 3.02 H new ATOM 0 HB3 LYS A 84 -6.048 3.556 12.494 1.00 3.02 H new ATOM 0 HG2 LYS A 84 -8.115 4.751 10.607 1.00 30.32 H new ATOM 0 HG3 LYS A 84 -7.505 3.109 10.569 1.00 30.32 H new ATOM 0 HD2 LYS A 84 -8.336 2.830 12.951 1.00 33.43 H new ATOM 0 HD3 LYS A 84 -9.090 4.406 12.814 1.00 33.43 H new ATOM 0 HE2 LYS A 84 -10.431 3.592 10.891 1.00 3.14 H new ATOM 0 HE3 LYS A 84 -9.684 2.014 11.043 1.00 3.14 H new ATOM 0 HZ1 LYS A 84 -11.712 1.932 12.202 1.00 33.31 H new ATOM 0 HZ2 LYS A 84 -10.505 2.004 13.395 1.00 33.31 H new ATOM 0 HZ3 LYS A 84 -11.412 3.390 13.018 1.00 33.31 H new ATOM 1340 N THR A 85 -5.617 5.339 15.071 1.00 5.32 N ATOM 1341 CA THR A 85 -4.547 5.347 16.045 1.00 14.32 C ATOM 1342 C THR A 85 -3.535 4.236 15.673 1.00 21.45 C ATOM 1343 O THR A 85 -3.907 3.292 15.001 1.00 22.41 O ATOM 1344 CB THR A 85 -5.134 5.105 17.453 1.00 11.14 C ATOM 1345 OG1 THR A 85 -6.228 6.020 17.652 1.00 74.54 O ATOM 1346 CG2 THR A 85 -4.095 5.365 18.535 1.00 2.14 C ATOM 0 H THR A 85 -6.513 5.021 15.441 1.00 5.32 H new ATOM 0 HA THR A 85 -4.037 6.310 16.047 1.00 14.32 H new ATOM 0 HB THR A 85 -5.460 4.067 17.521 1.00 11.14 H new ATOM 0 HG1 THR A 85 -6.615 5.879 18.541 1.00 74.54 H new ATOM 0 HG21 THR A 85 -4.538 5.186 19.515 1.00 2.14 H new ATOM 0 HG22 THR A 85 -3.246 4.696 18.393 1.00 2.14 H new ATOM 0 HG23 THR A 85 -3.756 6.399 18.473 1.00 2.14 H new ATOM 1354 N HIS A 86 -2.288 4.356 16.125 1.00 72.31 N ATOM 1355 CA HIS A 86 -1.176 3.456 15.735 1.00 12.12 C ATOM 1356 C HIS A 86 -1.541 1.944 15.786 1.00 24.51 C ATOM 1357 O HIS A 86 -1.174 1.191 14.880 1.00 42.03 O ATOM 1358 CB HIS A 86 0.061 3.760 16.596 1.00 23.10 C ATOM 1359 CG HIS A 86 1.322 3.063 16.176 1.00 0.02 C ATOM 1360 ND1 HIS A 86 2.074 2.289 17.024 1.00 13.45 N ATOM 1361 CD2 HIS A 86 2.005 3.100 15.005 1.00 21.33 C ATOM 1362 CE1 HIS A 86 3.160 1.885 16.396 1.00 65.12 C ATOM 1363 NE2 HIS A 86 3.139 2.362 15.174 1.00 30.14 N ATOM 0 H HIS A 86 -2.006 5.085 16.780 1.00 72.31 H new ATOM 0 HA HIS A 86 -0.956 3.660 14.687 1.00 12.12 H new ATOM 0 HB2 HIS A 86 0.238 4.835 16.582 1.00 23.10 H new ATOM 0 HB3 HIS A 86 -0.159 3.487 17.628 1.00 23.10 H new ATOM 0 HD2 HIS A 86 1.706 3.618 14.106 1.00 21.33 H new ATOM 0 HE1 HIS A 86 3.937 1.265 16.817 1.00 65.12 H new ATOM 0 HE2 HIS A 86 3.855 2.206 14.465 1.00 30.14 H new ATOM 1372 N LEU A 87 -2.276 1.522 16.817 1.00 71.23 N ATOM 1373 CA LEU A 87 -2.687 0.111 16.942 1.00 0.33 C ATOM 1374 C LEU A 87 -3.662 -0.257 15.809 1.00 4.43 C ATOM 1375 O LEU A 87 -3.547 -1.319 15.220 1.00 42.23 O ATOM 1376 CB LEU A 87 -3.303 -0.150 18.357 1.00 61.33 C ATOM 1377 CG LEU A 87 -3.633 -1.622 18.782 1.00 35.32 C ATOM 1378 CD1 LEU A 87 -3.999 -1.658 20.248 1.00 22.35 C ATOM 1379 CD2 LEU A 87 -4.784 -2.224 17.979 1.00 61.42 C ATOM 0 H LEU A 87 -2.599 2.125 17.573 1.00 71.23 H new ATOM 0 HA LEU A 87 -1.813 -0.533 16.845 1.00 0.33 H new ATOM 0 HB2 LEU A 87 -2.615 0.259 19.096 1.00 61.33 H new ATOM 0 HB3 LEU A 87 -4.225 0.427 18.426 1.00 61.33 H new ATOM 0 HG LEU A 87 -2.740 -2.215 18.585 1.00 35.32 H new ATOM 0 HD11 LEU A 87 -4.228 -2.683 20.541 1.00 22.35 H new ATOM 0 HD12 LEU A 87 -3.162 -1.290 20.841 1.00 22.35 H new ATOM 0 HD13 LEU A 87 -4.871 -1.028 20.421 1.00 22.35 H new ATOM 0 HD21 LEU A 87 -4.968 -3.244 18.316 1.00 61.42 H new ATOM 0 HD22 LEU A 87 -5.683 -1.625 18.126 1.00 61.42 H new ATOM 0 HD23 LEU A 87 -4.524 -2.233 16.921 1.00 61.42 H new ATOM 1391 N GLU A 88 -4.590 0.654 15.494 1.00 25.13 N ATOM 1392 CA GLU A 88 -5.605 0.450 14.439 1.00 13.32 C ATOM 1393 C GLU A 88 -4.962 0.090 13.101 1.00 23.11 C ATOM 1394 O GLU A 88 -5.464 -0.758 12.376 1.00 51.21 O ATOM 1395 CB GLU A 88 -6.432 1.714 14.237 1.00 64.40 C ATOM 1396 CG GLU A 88 -7.380 2.110 15.361 1.00 3.21 C ATOM 1397 CD GLU A 88 -8.540 1.156 15.525 1.00 13.11 C ATOM 1398 OE1 GLU A 88 -9.445 1.118 14.635 1.00 12.11 O ATOM 1399 OE2 GLU A 88 -8.609 0.471 16.555 1.00 3.05 O ATOM 0 H GLU A 88 -4.663 1.558 15.961 1.00 25.13 H new ATOM 0 HA GLU A 88 -6.240 -0.372 14.770 1.00 13.32 H new ATOM 0 HB2 GLU A 88 -5.746 2.543 14.065 1.00 64.40 H new ATOM 0 HB3 GLU A 88 -7.019 1.592 13.327 1.00 64.40 H new ATOM 0 HG2 GLU A 88 -6.823 2.159 16.297 1.00 3.21 H new ATOM 0 HG3 GLU A 88 -7.766 3.111 15.167 1.00 3.21 H new ATOM 1406 N LEU A 89 -3.854 0.746 12.783 1.00 12.30 N ATOM 1407 CA LEU A 89 -3.125 0.479 11.536 1.00 53.32 C ATOM 1408 C LEU A 89 -2.663 -0.955 11.487 1.00 14.33 C ATOM 1409 O LEU A 89 -2.876 -1.663 10.497 1.00 4.14 O ATOM 1410 CB LEU A 89 -1.895 1.399 11.364 1.00 4.11 C ATOM 1411 CG LEU A 89 -2.122 2.888 11.064 1.00 31.40 C ATOM 1412 CD1 LEU A 89 -2.875 3.089 9.779 1.00 51.22 C ATOM 1413 CD2 LEU A 89 -2.793 3.612 12.192 1.00 53.43 C ATOM 0 H LEU A 89 -3.435 1.469 13.368 1.00 12.30 H new ATOM 0 HA LEU A 89 -3.823 0.680 10.724 1.00 53.32 H new ATOM 0 HB2 LEU A 89 -1.303 1.333 12.277 1.00 4.11 H new ATOM 0 HB3 LEU A 89 -1.286 0.989 10.558 1.00 4.11 H new ATOM 0 HG LEU A 89 -1.130 3.325 10.949 1.00 31.40 H new ATOM 0 HD11 LEU A 89 -3.015 4.155 9.603 1.00 51.22 H new ATOM 0 HD12 LEU A 89 -2.309 2.656 8.954 1.00 51.22 H new ATOM 0 HD13 LEU A 89 -3.848 2.601 9.847 1.00 51.22 H new ATOM 0 HD21 LEU A 89 -2.927 4.660 11.923 1.00 53.43 H new ATOM 0 HD22 LEU A 89 -3.765 3.160 12.387 1.00 53.43 H new ATOM 0 HD23 LEU A 89 -2.175 3.544 13.087 1.00 53.43 H new ATOM 1425 N LYS A 90 -2.065 -1.390 12.569 1.00 15.55 N ATOM 1426 CA LYS A 90 -1.525 -2.711 12.630 1.00 30.20 C ATOM 1427 C LYS A 90 -2.659 -3.741 12.761 1.00 33.21 C ATOM 1428 O LYS A 90 -2.537 -4.884 12.324 1.00 71.31 O ATOM 1429 CB LYS A 90 -0.504 -2.846 13.748 1.00 33.12 C ATOM 1430 CG LYS A 90 0.394 -4.052 13.547 1.00 43.45 C ATOM 1431 CD LYS A 90 1.435 -4.215 14.649 1.00 13.11 C ATOM 1432 CE LYS A 90 2.398 -3.041 14.696 1.00 32.44 C ATOM 1433 NZ LYS A 90 3.425 -3.203 15.737 1.00 74.20 N ATOM 0 H LYS A 90 -1.943 -0.840 13.419 1.00 15.55 H new ATOM 0 HA LYS A 90 -0.994 -2.910 11.699 1.00 30.20 H new ATOM 0 HB2 LYS A 90 0.105 -1.943 13.795 1.00 33.12 H new ATOM 0 HB3 LYS A 90 -1.021 -2.933 14.704 1.00 33.12 H new ATOM 0 HG2 LYS A 90 -0.221 -4.951 13.501 1.00 43.45 H new ATOM 0 HG3 LYS A 90 0.902 -3.963 12.587 1.00 43.45 H new ATOM 0 HD2 LYS A 90 0.933 -4.311 15.612 1.00 13.11 H new ATOM 0 HD3 LYS A 90 1.994 -5.137 14.487 1.00 13.11 H new ATOM 0 HE2 LYS A 90 2.882 -2.932 13.725 1.00 32.44 H new ATOM 0 HE3 LYS A 90 1.840 -2.123 14.879 1.00 32.44 H new ATOM 0 HZ1 LYS A 90 4.058 -2.378 15.731 1.00 74.20 H new ATOM 0 HZ2 LYS A 90 2.967 -3.281 16.667 1.00 74.20 H new ATOM 0 HZ3 LYS A 90 3.977 -4.064 15.549 1.00 74.20 H new ATOM 1447 N LYS A 91 -3.778 -3.295 13.345 1.00 75.34 N ATOM 1448 CA LYS A 91 -4.990 -4.104 13.499 1.00 1.35 C ATOM 1449 C LYS A 91 -5.477 -4.525 12.129 1.00 51.23 C ATOM 1450 O LYS A 91 -5.849 -5.684 11.908 1.00 5.23 O ATOM 1451 CB LYS A 91 -6.100 -3.245 14.166 1.00 42.20 C ATOM 1452 CG LYS A 91 -7.500 -3.890 14.210 1.00 10.04 C ATOM 1453 CD LYS A 91 -7.591 -5.065 15.167 1.00 35.43 C ATOM 1454 CE LYS A 91 -7.522 -4.609 16.611 1.00 1.02 C ATOM 1455 NZ LYS A 91 -7.577 -5.746 17.546 1.00 41.51 N ATOM 0 H LYS A 91 -3.867 -2.353 13.727 1.00 75.34 H new ATOM 0 HA LYS A 91 -4.769 -4.977 14.113 1.00 1.35 H new ATOM 0 HB2 LYS A 91 -5.793 -3.014 15.186 1.00 42.20 H new ATOM 0 HB3 LYS A 91 -6.172 -2.297 13.632 1.00 42.20 H new ATOM 0 HG2 LYS A 91 -8.231 -3.136 14.502 1.00 10.04 H new ATOM 0 HG3 LYS A 91 -7.770 -4.225 13.208 1.00 10.04 H new ATOM 0 HD2 LYS A 91 -8.524 -5.603 14.998 1.00 35.43 H new ATOM 0 HD3 LYS A 91 -6.779 -5.764 14.965 1.00 35.43 H new ATOM 0 HE2 LYS A 91 -6.600 -4.050 16.772 1.00 1.02 H new ATOM 0 HE3 LYS A 91 -8.348 -3.928 16.817 1.00 1.02 H new ATOM 0 HZ1 LYS A 91 -7.527 -5.394 18.523 1.00 41.51 H new ATOM 0 HZ2 LYS A 91 -8.468 -6.265 17.410 1.00 41.51 H new ATOM 0 HZ3 LYS A 91 -6.775 -6.383 17.366 1.00 41.51 H new ATOM 1469 N LEU A 92 -5.444 -3.587 11.208 1.00 44.40 N ATOM 1470 CA LEU A 92 -5.894 -3.828 9.869 1.00 10.32 C ATOM 1471 C LEU A 92 -5.007 -4.841 9.172 1.00 25.20 C ATOM 1472 O LEU A 92 -5.500 -5.737 8.479 1.00 40.52 O ATOM 1473 CB LEU A 92 -5.939 -2.533 9.070 1.00 73.11 C ATOM 1474 CG LEU A 92 -6.801 -1.403 9.647 1.00 60.01 C ATOM 1475 CD1 LEU A 92 -6.833 -0.233 8.707 1.00 63.13 C ATOM 1476 CD2 LEU A 92 -8.208 -1.873 9.950 1.00 55.32 C ATOM 0 H LEU A 92 -5.104 -2.640 11.373 1.00 44.40 H new ATOM 0 HA LEU A 92 -6.903 -4.235 9.927 1.00 10.32 H new ATOM 0 HB2 LEU A 92 -4.919 -2.163 8.962 1.00 73.11 H new ATOM 0 HB3 LEU A 92 -6.303 -2.762 8.068 1.00 73.11 H new ATOM 0 HG LEU A 92 -6.346 -1.089 10.586 1.00 60.01 H new ATOM 0 HD11 LEU A 92 -7.449 0.559 9.133 1.00 63.13 H new ATOM 0 HD12 LEU A 92 -5.820 0.138 8.554 1.00 63.13 H new ATOM 0 HD13 LEU A 92 -7.253 -0.546 7.751 1.00 63.13 H new ATOM 0 HD21 LEU A 92 -8.788 -1.045 10.357 1.00 55.32 H new ATOM 0 HD22 LEU A 92 -8.678 -2.229 9.033 1.00 55.32 H new ATOM 0 HD23 LEU A 92 -8.172 -2.683 10.678 1.00 55.32 H new ATOM 1488 N ILE A 93 -3.703 -4.727 9.373 1.00 23.02 N ATOM 1489 CA ILE A 93 -2.778 -5.635 8.730 1.00 22.41 C ATOM 1490 C ILE A 93 -2.850 -7.007 9.371 1.00 14.41 C ATOM 1491 O ILE A 93 -2.705 -8.023 8.697 1.00 23.14 O ATOM 1492 CB ILE A 93 -1.314 -5.139 8.741 1.00 10.53 C ATOM 1493 CG1 ILE A 93 -1.236 -3.717 8.201 1.00 60.35 C ATOM 1494 CG2 ILE A 93 -0.445 -6.067 7.898 1.00 3.55 C ATOM 1495 CD1 ILE A 93 0.161 -3.228 7.913 1.00 14.34 C ATOM 0 H ILE A 93 -3.269 -4.022 9.970 1.00 23.02 H new ATOM 0 HA ILE A 93 -3.089 -5.687 7.687 1.00 22.41 H new ATOM 0 HB ILE A 93 -0.948 -5.144 9.768 1.00 10.53 H new ATOM 0 HG12 ILE A 93 -1.823 -3.658 7.284 1.00 60.35 H new ATOM 0 HG13 ILE A 93 -1.701 -3.043 8.921 1.00 60.35 H new ATOM 0 HG21 ILE A 93 0.585 -5.711 7.910 1.00 3.55 H new ATOM 0 HG22 ILE A 93 -0.486 -7.076 8.308 1.00 3.55 H new ATOM 0 HG23 ILE A 93 -0.813 -6.078 6.872 1.00 3.55 H new ATOM 0 HD11 ILE A 93 0.118 -2.207 7.533 1.00 14.34 H new ATOM 0 HD12 ILE A 93 0.750 -3.249 8.830 1.00 14.34 H new ATOM 0 HD13 ILE A 93 0.626 -3.873 7.168 1.00 14.34 H new ATOM 1507 N GLY A 94 -3.089 -7.036 10.663 1.00 72.35 N ATOM 1508 CA GLY A 94 -3.206 -8.290 11.372 1.00 1.11 C ATOM 1509 C GLY A 94 -4.346 -9.118 10.853 1.00 11.42 C ATOM 1510 O GLY A 94 -4.217 -10.328 10.679 1.00 41.50 O ATOM 0 H GLY A 94 -3.206 -6.206 11.244 1.00 72.35 H new ATOM 0 HA2 GLY A 94 -2.276 -8.850 11.276 1.00 1.11 H new ATOM 0 HA3 GLY A 94 -3.352 -8.095 12.434 1.00 1.11 H new ATOM 1514 N GLU A 95 -5.443 -8.456 10.576 1.00 54.22 N ATOM 1515 CA GLU A 95 -6.627 -9.097 10.057 1.00 22.24 C ATOM 1516 C GLU A 95 -6.351 -9.624 8.635 1.00 3.23 C ATOM 1517 O GLU A 95 -6.730 -10.746 8.286 1.00 53.32 O ATOM 1518 CB GLU A 95 -7.759 -8.077 10.017 1.00 50.43 C ATOM 1519 CG GLU A 95 -9.125 -8.660 9.739 1.00 31.22 C ATOM 1520 CD GLU A 95 -9.616 -9.565 10.858 1.00 1.24 C ATOM 1521 OE1 GLU A 95 -10.209 -9.055 11.848 1.00 12.41 O ATOM 1522 OE2 GLU A 95 -9.425 -10.795 10.773 1.00 31.15 O ATOM 0 H GLU A 95 -5.540 -7.449 10.705 1.00 54.22 H new ATOM 0 HA GLU A 95 -6.906 -9.934 10.696 1.00 22.24 H new ATOM 0 HB2 GLU A 95 -7.791 -7.552 10.972 1.00 50.43 H new ATOM 0 HB3 GLU A 95 -7.533 -7.334 9.252 1.00 50.43 H new ATOM 0 HG2 GLU A 95 -9.839 -7.849 9.594 1.00 31.22 H new ATOM 0 HG3 GLU A 95 -9.091 -9.226 8.808 1.00 31.22 H new ATOM 1529 N VAL A 96 -5.679 -8.805 7.833 1.00 41.21 N ATOM 1530 CA VAL A 96 -5.342 -9.160 6.456 1.00 62.25 C ATOM 1531 C VAL A 96 -4.318 -10.297 6.370 1.00 63.21 C ATOM 1532 O VAL A 96 -4.518 -11.247 5.618 1.00 31.15 O ATOM 1533 CB VAL A 96 -4.825 -7.928 5.647 1.00 34.43 C ATOM 1534 CG1 VAL A 96 -4.321 -8.342 4.287 1.00 54.21 C ATOM 1535 CG2 VAL A 96 -5.924 -6.933 5.456 1.00 0.11 C ATOM 0 H VAL A 96 -5.353 -7.881 8.116 1.00 41.21 H new ATOM 0 HA VAL A 96 -6.273 -9.511 6.010 1.00 62.25 H new ATOM 0 HB VAL A 96 -4.009 -7.485 6.217 1.00 34.43 H new ATOM 0 HG11 VAL A 96 -3.968 -7.464 3.747 1.00 54.21 H new ATOM 0 HG12 VAL A 96 -3.501 -9.051 4.403 1.00 54.21 H new ATOM 0 HG13 VAL A 96 -5.130 -8.811 3.727 1.00 54.21 H new ATOM 0 HG21 VAL A 96 -5.548 -6.080 4.891 1.00 0.11 H new ATOM 0 HG22 VAL A 96 -6.745 -7.398 4.909 1.00 0.11 H new ATOM 0 HG23 VAL A 96 -6.281 -6.595 6.429 1.00 0.11 H new ATOM 1545 N SER A 97 -3.255 -10.193 7.143 1.00 10.24 N ATOM 1546 CA SER A 97 -2.155 -11.144 7.093 1.00 62.53 C ATOM 1547 C SER A 97 -2.569 -12.574 7.523 1.00 52.10 C ATOM 1548 O SER A 97 -2.971 -13.394 6.693 1.00 32.32 O ATOM 1549 CB SER A 97 -0.955 -10.613 7.915 1.00 43.14 C ATOM 1550 OG SER A 97 -1.359 -10.325 9.254 1.00 11.43 O ATOM 0 H SER A 97 -3.127 -9.446 7.826 1.00 10.24 H new ATOM 0 HA SER A 97 -1.848 -11.235 6.051 1.00 62.53 H new ATOM 0 HB2 SER A 97 -0.154 -11.352 7.921 1.00 43.14 H new ATOM 0 HB3 SER A 97 -0.555 -9.713 7.447 1.00 43.14 H new ATOM 0 HG SER A 97 -1.810 -9.455 9.280 1.00 11.43 H new ATOM 1556 N SER A 98 -2.478 -12.849 8.811 1.00 54.53 N ATOM 1557 CA SER A 98 -2.831 -14.153 9.394 1.00 42.41 C ATOM 1558 C SER A 98 -2.932 -14.010 10.912 1.00 3.45 C ATOM 1559 O SER A 98 -2.893 -14.993 11.648 1.00 41.25 O ATOM 1560 CB SER A 98 -1.750 -15.223 9.056 1.00 75.41 C ATOM 1561 OG SER A 98 -1.630 -15.443 7.645 1.00 24.05 O ATOM 0 H SER A 98 -2.153 -12.171 9.500 1.00 54.53 H new ATOM 0 HA SER A 98 -3.785 -14.475 8.976 1.00 42.41 H new ATOM 0 HB2 SER A 98 -0.787 -14.904 9.456 1.00 75.41 H new ATOM 0 HB3 SER A 98 -2.004 -16.162 9.548 1.00 75.41 H new ATOM 0 HG SER A 98 -2.372 -15.002 7.181 1.00 24.05 H new ATOM 1567 N GLY A 99 -3.111 -12.786 11.362 1.00 1.11 N ATOM 1568 CA GLY A 99 -3.104 -12.510 12.764 1.00 35.53 C ATOM 1569 C GLY A 99 -1.822 -11.825 13.145 1.00 5.32 C ATOM 1570 O GLY A 99 -0.757 -12.421 13.060 1.00 44.32 O ATOM 0 H GLY A 99 -3.263 -11.971 10.767 1.00 1.11 H new ATOM 0 HA2 GLY A 99 -3.954 -11.879 13.023 1.00 35.53 H new ATOM 0 HA3 GLY A 99 -3.212 -13.437 13.326 1.00 35.53 H new ATOM 1574 N SER A 100 -1.928 -10.576 13.550 1.00 24.42 N ATOM 1575 CA SER A 100 -0.796 -9.724 13.922 1.00 2.41 C ATOM 1576 C SER A 100 0.290 -9.623 12.829 1.00 44.21 C ATOM 1577 O SER A 100 1.267 -10.371 12.824 1.00 72.22 O ATOM 1578 CB SER A 100 -0.212 -10.075 15.321 1.00 44.51 C ATOM 1579 OG SER A 100 0.190 -11.442 15.409 1.00 21.24 O ATOM 0 H SER A 100 -2.828 -10.103 13.635 1.00 24.42 H new ATOM 0 HA SER A 100 -1.210 -8.719 14.007 1.00 2.41 H new ATOM 0 HB2 SER A 100 0.644 -9.432 15.527 1.00 44.51 H new ATOM 0 HB3 SER A 100 -0.959 -9.867 16.087 1.00 44.51 H new ATOM 0 HG SER A 100 0.046 -11.882 14.545 1.00 21.24 H new ATOM 1585 N GLY A 101 0.066 -8.742 11.882 1.00 62.11 N ATOM 1586 CA GLY A 101 1.016 -8.495 10.847 1.00 40.12 C ATOM 1587 C GLY A 101 1.306 -7.033 10.798 1.00 31.34 C ATOM 1588 O GLY A 101 0.457 -6.233 11.181 1.00 13.42 O ATOM 0 H GLY A 101 -0.783 -8.181 11.816 1.00 62.11 H new ATOM 0 HA2 GLY A 101 1.932 -9.055 11.034 1.00 40.12 H new ATOM 0 HA3 GLY A 101 0.625 -8.834 9.888 1.00 40.12 H new ATOM 1592 N GLU A 102 2.463 -6.673 10.350 1.00 4.12 N ATOM 1593 CA GLU A 102 2.856 -5.281 10.317 1.00 51.21 C ATOM 1594 C GLU A 102 3.209 -4.885 8.868 1.00 23.43 C ATOM 1595 O GLU A 102 3.390 -3.742 8.557 1.00 32.21 O ATOM 1596 CB GLU A 102 4.002 -5.084 11.360 1.00 32.34 C ATOM 1597 CG GLU A 102 4.477 -3.657 11.699 1.00 2.03 C ATOM 1598 CD GLU A 102 5.377 -3.015 10.679 1.00 40.40 C ATOM 1599 OE1 GLU A 102 6.496 -3.532 10.467 1.00 11.03 O ATOM 1600 OE2 GLU A 102 5.029 -1.942 10.152 1.00 53.32 O ATOM 0 H GLU A 102 3.167 -7.321 9.996 1.00 4.12 H new ATOM 0 HA GLU A 102 2.051 -4.606 10.607 1.00 51.21 H new ATOM 0 HB2 GLU A 102 3.682 -5.552 12.291 1.00 32.34 H new ATOM 0 HB3 GLU A 102 4.868 -5.642 11.004 1.00 32.34 H new ATOM 0 HG2 GLU A 102 3.600 -3.024 11.834 1.00 2.03 H new ATOM 0 HG3 GLU A 102 5.001 -3.685 12.654 1.00 2.03 H new ATOM 1607 N THR A 103 3.261 -5.872 8.003 1.00 62.20 N ATOM 1608 CA THR A 103 3.485 -5.681 6.586 1.00 42.42 C ATOM 1609 C THR A 103 2.392 -6.404 5.753 1.00 40.43 C ATOM 1610 O THR A 103 1.842 -7.430 6.186 1.00 71.21 O ATOM 1611 CB THR A 103 4.891 -6.167 6.184 1.00 62.22 C ATOM 1612 OG1 THR A 103 5.117 -7.530 6.645 1.00 54.32 O ATOM 1613 CG2 THR A 103 5.951 -5.254 6.758 1.00 13.31 C ATOM 0 H THR A 103 3.147 -6.850 8.269 1.00 62.20 H new ATOM 0 HA THR A 103 3.422 -4.614 6.373 1.00 42.42 H new ATOM 0 HB THR A 103 4.955 -6.148 5.096 1.00 62.22 H new ATOM 0 HG1 THR A 103 6.014 -7.821 6.379 1.00 54.32 H new ATOM 0 HG21 THR A 103 6.938 -5.612 6.464 1.00 13.31 H new ATOM 0 HG22 THR A 103 5.804 -4.243 6.379 1.00 13.31 H new ATOM 0 HG23 THR A 103 5.876 -5.248 7.845 1.00 13.31 H new ATOM 1621 N PHE A 104 2.102 -5.889 4.568 1.00 31.11 N ATOM 1622 CA PHE A 104 1.035 -6.421 3.713 1.00 64.12 C ATOM 1623 C PHE A 104 1.539 -7.165 2.507 1.00 53.03 C ATOM 1624 O PHE A 104 2.719 -7.130 2.164 1.00 12.31 O ATOM 1625 CB PHE A 104 0.187 -5.307 3.122 1.00 35.31 C ATOM 1626 CG PHE A 104 -0.843 -4.674 3.972 1.00 64.11 C ATOM 1627 CD1 PHE A 104 -1.963 -5.392 4.334 1.00 33.34 C ATOM 1628 CD2 PHE A 104 -0.744 -3.351 4.345 1.00 60.40 C ATOM 1629 CE1 PHE A 104 -2.965 -4.812 5.059 1.00 3.52 C ATOM 1630 CE2 PHE A 104 -1.751 -2.753 5.062 1.00 2.41 C ATOM 1631 CZ PHE A 104 -2.868 -3.486 5.425 1.00 24.12 C ATOM 0 H PHE A 104 2.595 -5.092 4.166 1.00 31.11 H new ATOM 0 HA PHE A 104 0.481 -7.081 4.381 1.00 64.12 H new ATOM 0 HB2 PHE A 104 0.862 -4.522 2.781 1.00 35.31 H new ATOM 0 HB3 PHE A 104 -0.312 -5.704 2.238 1.00 35.31 H new ATOM 0 HD1 PHE A 104 -2.049 -6.428 4.040 1.00 33.34 H new ATOM 0 HD2 PHE A 104 0.131 -2.781 4.072 1.00 60.40 H new ATOM 0 HE1 PHE A 104 -3.831 -5.391 5.345 1.00 3.52 H new ATOM 0 HE2 PHE A 104 -1.672 -1.713 5.342 1.00 2.41 H new ATOM 0 HZ PHE A 104 -3.660 -3.021 5.993 1.00 24.12 H new ATOM 1641 N SER A 105 0.603 -7.833 1.860 1.00 30.14 N ATOM 1642 CA SER A 105 0.829 -8.446 0.598 1.00 10.50 C ATOM 1643 C SER A 105 -0.393 -8.149 -0.272 1.00 22.32 C ATOM 1644 O SER A 105 -1.529 -8.091 0.241 1.00 75.11 O ATOM 1645 CB SER A 105 1.068 -9.945 0.760 1.00 72.40 C ATOM 1646 OG SER A 105 1.355 -10.584 -0.476 1.00 31.53 O ATOM 0 H SER A 105 -0.345 -7.958 2.216 1.00 30.14 H new ATOM 0 HA SER A 105 1.725 -8.048 0.123 1.00 10.50 H new ATOM 0 HB2 SER A 105 1.896 -10.106 1.450 1.00 72.40 H new ATOM 0 HB3 SER A 105 0.187 -10.404 1.208 1.00 72.40 H new ATOM 0 HG SER A 105 1.502 -11.541 -0.323 1.00 31.53 H new ATOM 1652 N TYR A 106 -0.163 -7.941 -1.561 1.00 73.54 N ATOM 1653 CA TYR A 106 -1.216 -7.567 -2.514 1.00 23.22 C ATOM 1654 C TYR A 106 -2.374 -8.609 -2.549 1.00 65.02 C ATOM 1655 O TYR A 106 -3.543 -8.227 -2.408 1.00 1.55 O ATOM 1656 CB TYR A 106 -0.604 -7.333 -3.915 1.00 30.13 C ATOM 1657 CG TYR A 106 -1.507 -6.663 -4.940 1.00 31.10 C ATOM 1658 CD1 TYR A 106 -2.375 -7.381 -5.734 1.00 23.40 C ATOM 1659 CD2 TYR A 106 -1.443 -5.303 -5.127 1.00 33.42 C ATOM 1660 CE1 TYR A 106 -3.163 -6.750 -6.686 1.00 12.50 C ATOM 1661 CE2 TYR A 106 -2.208 -4.657 -6.069 1.00 1.44 C ATOM 1662 CZ TYR A 106 -3.073 -5.385 -6.849 1.00 1.34 C ATOM 1663 OH TYR A 106 -3.827 -4.756 -7.800 1.00 1.35 O ATOM 0 H TYR A 106 0.761 -8.026 -1.984 1.00 73.54 H new ATOM 0 HA TYR A 106 -1.663 -6.632 -2.176 1.00 23.22 H new ATOM 0 HB2 TYR A 106 0.293 -6.725 -3.800 1.00 30.13 H new ATOM 0 HB3 TYR A 106 -0.287 -8.296 -4.315 1.00 30.13 H new ATOM 0 HD1 TYR A 106 -2.443 -8.452 -5.613 1.00 23.40 H new ATOM 0 HD2 TYR A 106 -0.770 -4.723 -4.514 1.00 33.42 H new ATOM 0 HE1 TYR A 106 -3.843 -7.326 -7.296 1.00 12.50 H new ATOM 0 HE2 TYR A 106 -2.130 -3.587 -6.195 1.00 1.44 H new ATOM 0 HH TYR A 106 -4.334 -5.422 -8.309 1.00 1.35 H new ATOM 1673 N PRO A 107 -2.087 -9.954 -2.714 1.00 43.14 N ATOM 1674 CA PRO A 107 -3.142 -10.968 -2.717 1.00 71.52 C ATOM 1675 C PRO A 107 -3.859 -11.053 -1.371 1.00 32.22 C ATOM 1676 O PRO A 107 -5.028 -11.432 -1.315 1.00 31.10 O ATOM 1677 CB PRO A 107 -2.400 -12.287 -3.006 1.00 72.41 C ATOM 1678 CG PRO A 107 -1.106 -11.870 -3.598 1.00 33.13 C ATOM 1679 CD PRO A 107 -0.760 -10.579 -2.930 1.00 70.34 C ATOM 0 HA PRO A 107 -3.915 -10.737 -3.450 1.00 71.52 H new ATOM 0 HB2 PRO A 107 -2.250 -12.865 -2.094 1.00 72.41 H new ATOM 0 HB3 PRO A 107 -2.965 -12.917 -3.693 1.00 72.41 H new ATOM 0 HG2 PRO A 107 -0.335 -12.621 -3.425 1.00 33.13 H new ATOM 0 HG3 PRO A 107 -1.191 -11.743 -4.677 1.00 33.13 H new ATOM 0 HD2 PRO A 107 -0.231 -10.739 -1.991 1.00 70.34 H new ATOM 0 HD3 PRO A 107 -0.118 -9.959 -3.556 1.00 70.34 H new ATOM 1687 N ASP A 108 -3.167 -10.665 -0.295 1.00 12.11 N ATOM 1688 CA ASP A 108 -3.752 -10.719 1.042 1.00 74.33 C ATOM 1689 C ASP A 108 -4.867 -9.716 1.219 1.00 21.23 C ATOM 1690 O ASP A 108 -5.901 -10.040 1.807 1.00 74.44 O ATOM 1691 CB ASP A 108 -2.716 -10.678 2.178 1.00 73.13 C ATOM 1692 CG ASP A 108 -1.841 -11.929 2.228 1.00 73.35 C ATOM 1693 OD1 ASP A 108 -2.387 -13.062 2.286 1.00 75.04 O ATOM 1694 OD2 ASP A 108 -0.614 -11.808 2.262 1.00 43.11 O ATOM 0 H ASP A 108 -2.210 -10.314 -0.326 1.00 12.11 H new ATOM 0 HA ASP A 108 -4.207 -11.706 1.123 1.00 74.33 H new ATOM 0 HB2 ASP A 108 -2.081 -9.801 2.053 1.00 73.13 H new ATOM 0 HB3 ASP A 108 -3.233 -10.564 3.131 1.00 73.13 H new ATOM 1699 N PHE A 109 -4.679 -8.488 0.717 1.00 62.44 N ATOM 1700 CA PHE A 109 -5.792 -7.531 0.677 1.00 72.05 C ATOM 1701 C PHE A 109 -6.955 -8.130 -0.075 1.00 20.10 C ATOM 1702 O PHE A 109 -8.084 -8.091 0.377 1.00 11.30 O ATOM 1703 CB PHE A 109 -5.449 -6.252 -0.046 1.00 10.33 C ATOM 1704 CG PHE A 109 -4.595 -5.245 0.645 1.00 0.32 C ATOM 1705 CD1 PHE A 109 -3.225 -5.250 0.501 1.00 3.43 C ATOM 1706 CD2 PHE A 109 -5.188 -4.232 1.379 1.00 72.12 C ATOM 1707 CE1 PHE A 109 -2.465 -4.262 1.076 1.00 70.11 C ATOM 1708 CE2 PHE A 109 -4.432 -3.251 1.965 1.00 52.32 C ATOM 1709 CZ PHE A 109 -3.069 -3.262 1.810 1.00 1.23 C ATOM 0 H PHE A 109 -3.795 -8.141 0.344 1.00 62.44 H new ATOM 0 HA PHE A 109 -6.027 -7.311 1.718 1.00 72.05 H new ATOM 0 HB2 PHE A 109 -4.952 -6.522 -0.978 1.00 10.33 H new ATOM 0 HB3 PHE A 109 -6.385 -5.763 -0.314 1.00 10.33 H new ATOM 0 HD1 PHE A 109 -2.747 -6.035 -0.067 1.00 3.43 H new ATOM 0 HD2 PHE A 109 -6.262 -4.215 1.491 1.00 72.12 H new ATOM 0 HE1 PHE A 109 -1.392 -4.267 0.954 1.00 70.11 H new ATOM 0 HE2 PHE A 109 -4.906 -2.474 2.546 1.00 52.32 H new ATOM 0 HZ PHE A 109 -2.468 -2.487 2.263 1.00 1.23 H new ATOM 1719 N LEU A 110 -6.669 -8.689 -1.232 1.00 32.04 N ATOM 1720 CA LEU A 110 -7.684 -9.269 -2.043 1.00 40.54 C ATOM 1721 C LEU A 110 -8.414 -10.393 -1.325 1.00 70.30 C ATOM 1722 O LEU A 110 -9.603 -10.533 -1.481 1.00 13.15 O ATOM 1723 CB LEU A 110 -7.138 -9.643 -3.424 1.00 10.22 C ATOM 1724 CG LEU A 110 -6.702 -8.426 -4.272 1.00 42.15 C ATOM 1725 CD1 LEU A 110 -6.087 -8.836 -5.603 1.00 61.21 C ATOM 1726 CD2 LEU A 110 -7.892 -7.494 -4.503 1.00 72.22 C ATOM 0 H LEU A 110 -5.729 -8.747 -1.623 1.00 32.04 H new ATOM 0 HA LEU A 110 -8.453 -8.518 -2.226 1.00 40.54 H new ATOM 0 HB2 LEU A 110 -6.286 -10.311 -3.299 1.00 10.22 H new ATOM 0 HB3 LEU A 110 -7.902 -10.199 -3.968 1.00 10.22 H new ATOM 0 HG LEU A 110 -5.930 -7.900 -3.711 1.00 42.15 H new ATOM 0 HD11 LEU A 110 -5.798 -7.945 -6.160 1.00 61.21 H new ATOM 0 HD12 LEU A 110 -5.207 -9.453 -5.422 1.00 61.21 H new ATOM 0 HD13 LEU A 110 -6.816 -9.404 -6.181 1.00 61.21 H new ATOM 0 HD21 LEU A 110 -7.574 -6.640 -5.101 1.00 72.22 H new ATOM 0 HD22 LEU A 110 -8.680 -8.033 -5.029 1.00 72.22 H new ATOM 0 HD23 LEU A 110 -8.271 -7.144 -3.543 1.00 72.22 H new ATOM 1738 N ARG A 111 -7.703 -11.149 -0.486 1.00 22.53 N ATOM 1739 CA ARG A 111 -8.334 -12.198 0.324 1.00 51.21 C ATOM 1740 C ARG A 111 -9.471 -11.608 1.173 1.00 30.31 C ATOM 1741 O ARG A 111 -10.564 -12.168 1.223 1.00 40.14 O ATOM 1742 CB ARG A 111 -7.319 -12.898 1.247 1.00 23.22 C ATOM 1743 CG ARG A 111 -6.153 -13.640 0.564 1.00 12.51 C ATOM 1744 CD ARG A 111 -6.597 -14.836 -0.297 1.00 30.12 C ATOM 1745 NE ARG A 111 -7.340 -14.456 -1.517 1.00 32.14 N ATOM 1746 CZ ARG A 111 -7.911 -15.347 -2.363 1.00 71.54 C ATOM 1747 NH1 ARG A 111 -7.857 -16.643 -2.102 1.00 2.22 N ATOM 1748 NH2 ARG A 111 -8.524 -14.933 -3.465 1.00 42.03 N ATOM 0 H ARG A 111 -6.696 -11.057 -0.349 1.00 22.53 H new ATOM 0 HA ARG A 111 -8.736 -12.939 -0.367 1.00 51.21 H new ATOM 0 HB2 ARG A 111 -6.898 -12.149 1.918 1.00 23.22 H new ATOM 0 HB3 ARG A 111 -7.860 -13.613 1.866 1.00 23.22 H new ATOM 0 HG2 ARG A 111 -5.605 -12.937 -0.063 1.00 12.51 H new ATOM 0 HG3 ARG A 111 -5.461 -13.992 1.329 1.00 12.51 H new ATOM 0 HD2 ARG A 111 -5.716 -15.410 -0.585 1.00 30.12 H new ATOM 0 HD3 ARG A 111 -7.223 -15.493 0.307 1.00 30.12 H new ATOM 0 HE ARG A 111 -7.428 -13.463 -1.735 1.00 32.14 H new ATOM 0 HH11 ARG A 111 -7.384 -16.975 -1.261 1.00 2.22 H new ATOM 0 HH12 ARG A 111 -8.288 -17.310 -2.742 1.00 2.22 H new ATOM 0 HH21 ARG A 111 -8.568 -13.937 -3.681 1.00 42.03 H new ATOM 0 HH22 ARG A 111 -8.951 -15.611 -4.096 1.00 42.03 H new ATOM 1762 N MET A 112 -9.211 -10.465 1.825 1.00 24.52 N ATOM 1763 CA MET A 112 -10.239 -9.822 2.648 1.00 42.04 C ATOM 1764 C MET A 112 -11.311 -9.123 1.795 1.00 44.02 C ATOM 1765 O MET A 112 -12.490 -9.081 2.158 1.00 23.23 O ATOM 1766 CB MET A 112 -9.640 -8.897 3.755 1.00 21.34 C ATOM 1767 CG MET A 112 -8.955 -7.659 3.255 1.00 4.12 C ATOM 1768 SD MET A 112 -10.102 -6.403 2.683 1.00 12.31 S ATOM 1769 CE MET A 112 -8.991 -5.446 1.728 1.00 72.11 C ATOM 0 H MET A 112 -8.316 -9.977 1.799 1.00 24.52 H new ATOM 0 HA MET A 112 -10.750 -10.622 3.184 1.00 42.04 H new ATOM 0 HB2 MET A 112 -10.442 -8.601 4.431 1.00 21.34 H new ATOM 0 HB3 MET A 112 -8.926 -9.475 4.342 1.00 21.34 H new ATOM 0 HG2 MET A 112 -8.339 -7.244 4.053 1.00 4.12 H new ATOM 0 HG3 MET A 112 -8.283 -7.927 2.440 1.00 4.12 H new ATOM 0 HE1 MET A 112 -9.333 -4.411 1.700 1.00 72.11 H new ATOM 0 HE2 MET A 112 -7.998 -5.488 2.175 1.00 72.11 H new ATOM 0 HE3 MET A 112 -8.949 -5.842 0.713 1.00 72.11 H new ATOM 1779 N MET A 113 -10.886 -8.605 0.649 1.00 60.41 N ATOM 1780 CA MET A 113 -11.749 -7.839 -0.257 1.00 63.04 C ATOM 1781 C MET A 113 -12.777 -8.714 -0.959 1.00 40.31 C ATOM 1782 O MET A 113 -13.984 -8.496 -0.857 1.00 73.34 O ATOM 1783 CB MET A 113 -10.885 -7.114 -1.309 1.00 61.52 C ATOM 1784 CG MET A 113 -11.670 -6.323 -2.361 1.00 72.35 C ATOM 1785 SD MET A 113 -12.652 -4.976 -1.672 1.00 43.12 S ATOM 1786 CE MET A 113 -11.370 -3.936 -0.980 1.00 60.31 C ATOM 0 H MET A 113 -9.927 -8.702 0.315 1.00 60.41 H new ATOM 0 HA MET A 113 -12.294 -7.116 0.349 1.00 63.04 H new ATOM 0 HB2 MET A 113 -10.209 -6.432 -0.794 1.00 61.52 H new ATOM 0 HB3 MET A 113 -10.266 -7.852 -1.819 1.00 61.52 H new ATOM 0 HG2 MET A 113 -10.972 -5.915 -3.092 1.00 72.35 H new ATOM 0 HG3 MET A 113 -12.330 -7.005 -2.897 1.00 72.35 H new ATOM 0 HE1 MET A 113 -11.545 -2.900 -1.271 1.00 60.31 H new ATOM 0 HE2 MET A 113 -11.385 -4.015 0.107 1.00 60.31 H new ATOM 0 HE3 MET A 113 -10.398 -4.259 -1.354 1.00 60.31 H new ATOM 1796 N LEU A 114 -12.309 -9.696 -1.648 1.00 33.23 N ATOM 1797 CA LEU A 114 -13.167 -10.518 -2.467 1.00 53.43 C ATOM 1798 C LEU A 114 -13.498 -11.848 -1.796 1.00 50.14 C ATOM 1799 O LEU A 114 -14.123 -12.727 -2.395 1.00 42.42 O ATOM 1800 CB LEU A 114 -12.528 -10.673 -3.865 1.00 22.31 C ATOM 1801 CG LEU A 114 -11.050 -11.101 -3.891 1.00 54.21 C ATOM 1802 CD1 LEU A 114 -10.842 -12.542 -3.472 1.00 13.42 C ATOM 1803 CD2 LEU A 114 -10.374 -10.777 -5.211 1.00 4.22 C ATOM 0 H LEU A 114 -11.324 -9.961 -1.668 1.00 33.23 H new ATOM 0 HA LEU A 114 -14.132 -10.027 -2.592 1.00 53.43 H new ATOM 0 HB2 LEU A 114 -13.107 -11.405 -4.427 1.00 22.31 H new ATOM 0 HB3 LEU A 114 -12.619 -9.723 -4.391 1.00 22.31 H new ATOM 0 HG LEU A 114 -10.553 -10.496 -3.133 1.00 54.21 H new ATOM 0 HD11 LEU A 114 -9.780 -12.783 -3.511 1.00 13.42 H new ATOM 0 HD12 LEU A 114 -11.208 -12.682 -2.455 1.00 13.42 H new ATOM 0 HD13 LEU A 114 -11.388 -13.200 -4.148 1.00 13.42 H new ATOM 0 HD21 LEU A 114 -9.333 -11.100 -5.176 1.00 4.22 H new ATOM 0 HD22 LEU A 114 -10.888 -11.296 -6.020 1.00 4.22 H new ATOM 0 HD23 LEU A 114 -10.415 -9.702 -5.386 1.00 4.22 H new ATOM 1815 N GLY A 115 -13.099 -11.973 -0.548 1.00 52.00 N ATOM 1816 CA GLY A 115 -13.327 -13.185 0.183 1.00 42.20 C ATOM 1817 C GLY A 115 -14.614 -13.168 0.973 1.00 35.34 C ATOM 1818 O GLY A 115 -15.646 -13.645 0.501 1.00 74.04 O ATOM 0 H GLY A 115 -12.615 -11.244 -0.024 1.00 52.00 H new ATOM 0 HA2 GLY A 115 -13.346 -14.024 -0.513 1.00 42.20 H new ATOM 0 HA3 GLY A 115 -12.492 -13.354 0.863 1.00 42.20 H new ATOM 1822 N LYS A 116 -14.567 -12.623 2.159 1.00 45.51 N ATOM 1823 CA LYS A 116 -15.717 -12.623 3.048 1.00 53.44 C ATOM 1824 C LYS A 116 -15.848 -11.295 3.807 1.00 22.45 C ATOM 1825 O LYS A 116 -16.904 -11.012 4.370 1.00 53.52 O ATOM 1826 CB LYS A 116 -15.573 -13.797 4.036 1.00 32.14 C ATOM 1827 CG LYS A 116 -16.735 -13.997 4.997 1.00 24.33 C ATOM 1828 CD LYS A 116 -16.477 -15.191 5.888 1.00 3.43 C ATOM 1829 CE LYS A 116 -17.643 -15.473 6.816 1.00 44.43 C ATOM 1830 NZ LYS A 116 -17.414 -16.698 7.609 1.00 51.12 N ATOM 0 H LYS A 116 -13.739 -12.167 2.542 1.00 45.51 H new ATOM 0 HA LYS A 116 -16.623 -12.740 2.454 1.00 53.44 H new ATOM 0 HB2 LYS A 116 -15.437 -14.715 3.464 1.00 32.14 H new ATOM 0 HB3 LYS A 116 -14.665 -13.647 4.620 1.00 32.14 H new ATOM 0 HG2 LYS A 116 -16.871 -13.103 5.605 1.00 24.33 H new ATOM 0 HG3 LYS A 116 -17.658 -14.145 4.437 1.00 24.33 H new ATOM 0 HD2 LYS A 116 -16.285 -16.069 5.271 1.00 3.43 H new ATOM 0 HD3 LYS A 116 -15.578 -15.014 6.479 1.00 3.43 H new ATOM 0 HE2 LYS A 116 -17.790 -14.626 7.486 1.00 44.43 H new ATOM 0 HE3 LYS A 116 -18.557 -15.581 6.232 1.00 44.43 H new ATOM 0 HZ1 LYS A 116 -18.229 -16.864 8.234 1.00 51.12 H new ATOM 0 HZ2 LYS A 116 -17.297 -17.509 6.969 1.00 51.12 H new ATOM 0 HZ3 LYS A 116 -16.555 -16.584 8.183 1.00 51.12 H new ATOM 1844 N ARG A 117 -14.773 -10.488 3.795 1.00 42.23 N ATOM 1845 CA ARG A 117 -14.697 -9.202 4.516 1.00 24.42 C ATOM 1846 C ARG A 117 -14.375 -9.425 5.981 1.00 54.35 C ATOM 1847 O ARG A 117 -15.139 -10.045 6.723 1.00 32.12 O ATOM 1848 CB ARG A 117 -15.969 -8.293 4.290 1.00 62.33 C ATOM 1849 CG ARG A 117 -15.987 -6.895 4.979 1.00 34.21 C ATOM 1850 CD ARG A 117 -16.187 -6.944 6.491 1.00 11.43 C ATOM 1851 NE ARG A 117 -17.459 -7.571 6.856 1.00 3.31 N ATOM 1852 CZ ARG A 117 -17.828 -7.891 8.102 1.00 35.24 C ATOM 1853 NH1 ARG A 117 -17.031 -7.617 9.130 1.00 32.43 N ATOM 1854 NH2 ARG A 117 -19.000 -8.483 8.316 1.00 24.34 N ATOM 0 H ARG A 117 -13.922 -10.711 3.279 1.00 42.23 H new ATOM 0 HA ARG A 117 -13.871 -8.635 4.087 1.00 24.42 H new ATOM 0 HB2 ARG A 117 -16.087 -8.141 3.217 1.00 62.33 H new ATOM 0 HB3 ARG A 117 -16.843 -8.847 4.631 1.00 62.33 H new ATOM 0 HG2 ARG A 117 -15.048 -6.385 4.765 1.00 34.21 H new ATOM 0 HG3 ARG A 117 -16.783 -6.295 4.538 1.00 34.21 H new ATOM 0 HD2 ARG A 117 -15.366 -7.497 6.948 1.00 11.43 H new ATOM 0 HD3 ARG A 117 -16.153 -5.932 6.894 1.00 11.43 H new ATOM 0 HE ARG A 117 -18.114 -7.780 6.103 1.00 3.31 H new ATOM 0 HH11 ARG A 117 -16.133 -7.160 8.971 1.00 32.43 H new ATOM 0 HH12 ARG A 117 -17.318 -7.863 10.077 1.00 32.43 H new ATOM 0 HH21 ARG A 117 -19.616 -8.693 7.531 1.00 24.34 H new ATOM 0 HH22 ARG A 117 -19.282 -8.727 9.265 1.00 24.34 H new ATOM 1868 N SER A 118 -13.242 -8.937 6.377 1.00 3.45 N ATOM 1869 CA SER A 118 -12.810 -9.014 7.737 1.00 72.12 C ATOM 1870 C SER A 118 -12.165 -7.688 8.143 1.00 25.04 C ATOM 1871 O SER A 118 -12.624 -7.014 9.069 1.00 33.11 O ATOM 1872 CB SER A 118 -11.840 -10.194 7.891 1.00 24.53 C ATOM 1873 OG SER A 118 -10.770 -10.101 6.947 1.00 72.22 O ATOM 0 H SER A 118 -12.582 -8.468 5.757 1.00 3.45 H new ATOM 0 HA SER A 118 -13.659 -9.186 8.399 1.00 72.12 H new ATOM 0 HB2 SER A 118 -11.437 -10.209 8.904 1.00 24.53 H new ATOM 0 HB3 SER A 118 -12.376 -11.132 7.748 1.00 24.53 H new ATOM 0 HG SER A 118 -10.163 -10.862 7.064 1.00 72.22 H new ATOM 1879 N ALA A 119 -11.120 -7.320 7.420 1.00 61.53 N ATOM 1880 CA ALA A 119 -10.396 -6.079 7.636 1.00 4.05 C ATOM 1881 C ALA A 119 -11.285 -4.865 7.451 1.00 73.41 C ATOM 1882 O ALA A 119 -11.978 -4.727 6.428 1.00 0.31 O ATOM 1883 CB ALA A 119 -9.210 -6.017 6.708 1.00 12.42 C ATOM 0 H ALA A 119 -10.746 -7.883 6.656 1.00 61.53 H new ATOM 0 HA ALA A 119 -10.049 -6.065 8.669 1.00 4.05 H new ATOM 0 HB1 ALA A 119 -8.668 -5.085 6.872 1.00 12.42 H new ATOM 0 HB2 ALA A 119 -8.549 -6.861 6.906 1.00 12.42 H new ATOM 0 HB3 ALA A 119 -9.554 -6.060 5.675 1.00 12.42 H new ATOM 1889 N ILE A 120 -11.250 -3.989 8.444 1.00 45.20 N ATOM 1890 CA ILE A 120 -12.047 -2.761 8.478 1.00 4.24 C ATOM 1891 C ILE A 120 -11.726 -1.866 7.273 1.00 24.31 C ATOM 1892 O ILE A 120 -12.575 -1.124 6.792 1.00 1.22 O ATOM 1893 CB ILE A 120 -11.787 -1.985 9.803 1.00 60.13 C ATOM 1894 CG1 ILE A 120 -12.097 -2.889 11.002 1.00 45.42 C ATOM 1895 CG2 ILE A 120 -12.629 -0.704 9.871 1.00 75.52 C ATOM 1896 CD1 ILE A 120 -11.752 -2.281 12.340 1.00 65.15 C ATOM 0 H ILE A 120 -10.658 -4.109 9.266 1.00 45.20 H new ATOM 0 HA ILE A 120 -13.100 -3.039 8.429 1.00 4.24 H new ATOM 0 HB ILE A 120 -10.737 -1.695 9.831 1.00 60.13 H new ATOM 0 HG12 ILE A 120 -13.158 -3.137 10.991 1.00 45.42 H new ATOM 0 HG13 ILE A 120 -11.550 -3.825 10.889 1.00 45.42 H new ATOM 0 HG21 ILE A 120 -12.426 -0.184 10.807 1.00 75.52 H new ATOM 0 HG22 ILE A 120 -12.373 -0.056 9.033 1.00 75.52 H new ATOM 0 HG23 ILE A 120 -13.687 -0.961 9.821 1.00 75.52 H new ATOM 0 HD11 ILE A 120 -12.002 -2.984 13.134 1.00 65.15 H new ATOM 0 HD12 ILE A 120 -10.685 -2.059 12.374 1.00 65.15 H new ATOM 0 HD13 ILE A 120 -12.319 -1.361 12.478 1.00 65.15 H new ATOM 1908 N LEU A 121 -10.504 -1.965 6.776 1.00 34.41 N ATOM 1909 CA LEU A 121 -10.090 -1.200 5.614 1.00 70.12 C ATOM 1910 C LEU A 121 -10.918 -1.477 4.349 1.00 62.13 C ATOM 1911 O LEU A 121 -11.005 -0.620 3.474 1.00 51.25 O ATOM 1912 CB LEU A 121 -8.556 -1.216 5.380 1.00 65.22 C ATOM 1913 CG LEU A 121 -7.818 -2.563 5.474 1.00 64.40 C ATOM 1914 CD1 LEU A 121 -8.323 -3.550 4.461 1.00 0.34 C ATOM 1915 CD2 LEU A 121 -6.325 -2.358 5.310 1.00 10.23 C ATOM 0 H LEU A 121 -9.780 -2.571 7.162 1.00 34.41 H new ATOM 0 HA LEU A 121 -10.327 -0.166 5.864 1.00 70.12 H new ATOM 0 HB2 LEU A 121 -8.366 -0.801 4.390 1.00 65.22 H new ATOM 0 HB3 LEU A 121 -8.102 -0.537 6.102 1.00 65.22 H new ATOM 0 HG LEU A 121 -8.016 -2.977 6.463 1.00 64.40 H new ATOM 0 HD11 LEU A 121 -7.775 -4.487 4.562 1.00 0.34 H new ATOM 0 HD12 LEU A 121 -9.385 -3.731 4.627 1.00 0.34 H new ATOM 0 HD13 LEU A 121 -8.176 -3.150 3.458 1.00 0.34 H new ATOM 0 HD21 LEU A 121 -5.816 -3.319 5.379 1.00 10.23 H new ATOM 0 HD22 LEU A 121 -6.124 -1.910 4.337 1.00 10.23 H new ATOM 0 HD23 LEU A 121 -5.960 -1.697 6.096 1.00 10.23 H new ATOM 1927 N LYS A 122 -11.550 -2.666 4.260 1.00 44.02 N ATOM 1928 CA LYS A 122 -12.407 -2.961 3.114 1.00 70.22 C ATOM 1929 C LYS A 122 -13.590 -2.019 3.111 1.00 1.55 C ATOM 1930 O LYS A 122 -14.091 -1.663 2.070 1.00 72.22 O ATOM 1931 CB LYS A 122 -12.933 -4.406 3.107 1.00 72.53 C ATOM 1932 CG LYS A 122 -13.837 -4.699 1.893 1.00 31.14 C ATOM 1933 CD LYS A 122 -14.437 -6.083 1.930 1.00 42.14 C ATOM 1934 CE LYS A 122 -15.348 -6.328 0.728 1.00 34.13 C ATOM 1935 NZ LYS A 122 -16.483 -5.375 0.661 1.00 32.12 N ATOM 0 H LYS A 122 -11.481 -3.413 4.952 1.00 44.02 H new ATOM 0 HA LYS A 122 -11.792 -2.830 2.224 1.00 70.22 H new ATOM 0 HB2 LYS A 122 -12.089 -5.096 3.103 1.00 72.53 H new ATOM 0 HB3 LYS A 122 -13.491 -4.590 4.025 1.00 72.53 H new ATOM 0 HG2 LYS A 122 -14.639 -3.961 1.857 1.00 31.14 H new ATOM 0 HG3 LYS A 122 -13.256 -4.584 0.978 1.00 31.14 H new ATOM 0 HD2 LYS A 122 -13.640 -6.827 1.942 1.00 42.14 H new ATOM 0 HD3 LYS A 122 -15.005 -6.210 2.851 1.00 42.14 H new ATOM 0 HE2 LYS A 122 -14.762 -6.252 -0.188 1.00 34.13 H new ATOM 0 HE3 LYS A 122 -15.736 -7.345 0.774 1.00 34.13 H new ATOM 0 HZ1 LYS A 122 -17.189 -5.723 -0.018 1.00 32.12 H new ATOM 0 HZ2 LYS A 122 -16.920 -5.289 1.601 1.00 32.12 H new ATOM 0 HZ3 LYS A 122 -16.137 -4.444 0.354 1.00 32.12 H new ATOM 1949 N MET A 123 -14.008 -1.592 4.297 1.00 42.10 N ATOM 1950 CA MET A 123 -15.157 -0.720 4.416 1.00 50.11 C ATOM 1951 C MET A 123 -14.855 0.599 3.730 1.00 75.14 C ATOM 1952 O MET A 123 -15.702 1.159 3.061 1.00 20.20 O ATOM 1953 CB MET A 123 -15.549 -0.494 5.887 1.00 54.42 C ATOM 1954 CG MET A 123 -15.738 -1.786 6.693 1.00 41.25 C ATOM 1955 SD MET A 123 -16.896 -2.961 5.933 1.00 12.35 S ATOM 1956 CE MET A 123 -18.418 -2.018 5.927 1.00 30.11 C ATOM 0 H MET A 123 -13.567 -1.837 5.183 1.00 42.10 H new ATOM 0 HA MET A 123 -16.008 -1.197 3.930 1.00 50.11 H new ATOM 0 HB2 MET A 123 -14.780 0.111 6.367 1.00 54.42 H new ATOM 0 HB3 MET A 123 -16.475 0.081 5.921 1.00 54.42 H new ATOM 0 HG2 MET A 123 -14.770 -2.272 6.815 1.00 41.25 H new ATOM 0 HG3 MET A 123 -16.095 -1.532 7.691 1.00 41.25 H new ATOM 0 HE1 MET A 123 -19.215 -2.617 5.487 1.00 30.11 H new ATOM 0 HE2 MET A 123 -18.685 -1.752 6.950 1.00 30.11 H new ATOM 0 HE3 MET A 123 -18.281 -1.110 5.340 1.00 30.11 H new ATOM 1966 N ILE A 124 -13.616 1.047 3.856 1.00 40.11 N ATOM 1967 CA ILE A 124 -13.170 2.266 3.209 1.00 62.45 C ATOM 1968 C ILE A 124 -13.219 2.115 1.691 1.00 71.32 C ATOM 1969 O ILE A 124 -13.832 2.927 1.009 1.00 75.01 O ATOM 1970 CB ILE A 124 -11.735 2.728 3.673 1.00 53.54 C ATOM 1971 CG1 ILE A 124 -11.732 3.288 5.128 1.00 54.53 C ATOM 1972 CG2 ILE A 124 -11.139 3.749 2.708 1.00 34.02 C ATOM 1973 CD1 ILE A 124 -12.089 2.300 6.220 1.00 71.10 C ATOM 0 H ILE A 124 -12.897 0.578 4.406 1.00 40.11 H new ATOM 0 HA ILE A 124 -13.861 3.050 3.517 1.00 62.45 H new ATOM 0 HB ILE A 124 -11.108 1.837 3.665 1.00 53.54 H new ATOM 0 HG12 ILE A 124 -10.741 3.691 5.339 1.00 54.53 H new ATOM 0 HG13 ILE A 124 -12.432 4.122 5.177 1.00 54.53 H new ATOM 0 HG21 ILE A 124 -10.150 4.046 3.058 1.00 34.02 H new ATOM 0 HG22 ILE A 124 -11.055 3.306 1.716 1.00 34.02 H new ATOM 0 HG23 ILE A 124 -11.785 4.625 2.661 1.00 34.02 H new ATOM 0 HD11 ILE A 124 -12.055 2.800 7.188 1.00 71.10 H new ATOM 0 HD12 ILE A 124 -13.093 1.913 6.047 1.00 71.10 H new ATOM 0 HD13 ILE A 124 -11.376 1.475 6.212 1.00 71.10 H new ATOM 1985 N LEU A 125 -12.620 1.053 1.171 1.00 55.44 N ATOM 1986 CA LEU A 125 -12.598 0.830 -0.280 1.00 74.23 C ATOM 1987 C LEU A 125 -13.967 0.425 -0.831 1.00 32.43 C ATOM 1988 O LEU A 125 -14.203 0.500 -2.031 1.00 51.30 O ATOM 1989 CB LEU A 125 -11.507 -0.175 -0.722 1.00 33.33 C ATOM 1990 CG LEU A 125 -10.020 0.276 -0.630 1.00 51.30 C ATOM 1991 CD1 LEU A 125 -9.575 0.542 0.799 1.00 5.03 C ATOM 1992 CD2 LEU A 125 -9.108 -0.748 -1.292 1.00 12.23 C ATOM 0 H LEU A 125 -12.146 0.336 1.719 1.00 55.44 H new ATOM 0 HA LEU A 125 -12.339 1.796 -0.714 1.00 74.23 H new ATOM 0 HB2 LEU A 125 -11.620 -1.077 -0.121 1.00 33.33 H new ATOM 0 HB3 LEU A 125 -11.708 -0.454 -1.756 1.00 33.33 H new ATOM 0 HG LEU A 125 -9.944 1.222 -1.166 1.00 51.30 H new ATOM 0 HD11 LEU A 125 -8.530 0.853 0.803 1.00 5.03 H new ATOM 0 HD12 LEU A 125 -10.190 1.331 1.231 1.00 5.03 H new ATOM 0 HD13 LEU A 125 -9.685 -0.368 1.390 1.00 5.03 H new ATOM 0 HD21 LEU A 125 -8.073 -0.415 -1.218 1.00 12.23 H new ATOM 0 HD22 LEU A 125 -9.217 -1.710 -0.791 1.00 12.23 H new ATOM 0 HD23 LEU A 125 -9.381 -0.853 -2.342 1.00 12.23 H new ATOM 2004 N MET A 126 -14.859 -0.009 0.048 1.00 61.05 N ATOM 2005 CA MET A 126 -16.213 -0.363 -0.352 1.00 22.44 C ATOM 2006 C MET A 126 -16.988 0.918 -0.622 1.00 72.12 C ATOM 2007 O MET A 126 -17.855 0.972 -1.497 1.00 72.42 O ATOM 2008 CB MET A 126 -16.922 -1.166 0.747 1.00 73.30 C ATOM 2009 CG MET A 126 -18.260 -1.742 0.313 1.00 21.23 C ATOM 2010 SD MET A 126 -19.178 -2.524 1.656 1.00 21.44 S ATOM 2011 CE MET A 126 -19.547 -1.099 2.674 1.00 1.33 C ATOM 0 H MET A 126 -14.669 -0.124 1.043 1.00 61.05 H new ATOM 0 HA MET A 126 -16.168 -0.982 -1.248 1.00 22.44 H new ATOM 0 HB2 MET A 126 -16.272 -1.980 1.067 1.00 73.30 H new ATOM 0 HB3 MET A 126 -17.077 -0.523 1.613 1.00 73.30 H new ATOM 0 HG2 MET A 126 -18.868 -0.945 -0.116 1.00 21.23 H new ATOM 0 HG3 MET A 126 -18.092 -2.475 -0.476 1.00 21.23 H new ATOM 0 HE1 MET A 126 -20.245 -1.385 3.461 1.00 1.33 H new ATOM 0 HE2 MET A 126 -18.627 -0.725 3.124 1.00 1.33 H new ATOM 0 HE3 MET A 126 -19.994 -0.318 2.059 1.00 1.33 H new ATOM 2021 N TYR A 127 -16.680 1.944 0.154 1.00 74.43 N ATOM 2022 CA TYR A 127 -17.268 3.253 -0.034 1.00 52.52 C ATOM 2023 C TYR A 127 -16.547 4.012 -1.111 1.00 35.14 C ATOM 2024 O TYR A 127 -17.173 4.541 -2.033 1.00 1.45 O ATOM 2025 CB TYR A 127 -17.286 4.071 1.263 1.00 4.41 C ATOM 2026 CG TYR A 127 -18.368 3.691 2.244 1.00 45.34 C ATOM 2027 CD1 TYR A 127 -18.196 2.670 3.154 1.00 20.05 C ATOM 2028 CD2 TYR A 127 -19.569 4.383 2.258 1.00 24.10 C ATOM 2029 CE1 TYR A 127 -19.184 2.337 4.051 1.00 62.05 C ATOM 2030 CE2 TYR A 127 -20.564 4.058 3.149 1.00 52.14 C ATOM 2031 CZ TYR A 127 -20.364 3.034 4.042 1.00 33.34 C ATOM 2032 OH TYR A 127 -21.355 2.709 4.935 1.00 23.31 O ATOM 0 H TYR A 127 -16.018 1.890 0.928 1.00 74.43 H new ATOM 0 HA TYR A 127 -18.302 3.094 -0.340 1.00 52.52 H new ATOM 0 HB2 TYR A 127 -16.319 3.966 1.754 1.00 4.41 H new ATOM 0 HB3 TYR A 127 -17.402 5.125 1.008 1.00 4.41 H new ATOM 0 HD1 TYR A 127 -17.266 2.120 3.163 1.00 20.05 H new ATOM 0 HD2 TYR A 127 -19.725 5.190 1.558 1.00 24.10 H new ATOM 0 HE1 TYR A 127 -19.031 1.533 4.756 1.00 62.05 H new ATOM 0 HE2 TYR A 127 -21.496 4.604 3.147 1.00 52.14 H new ATOM 0 HH TYR A 127 -22.125 3.299 4.798 1.00 23.31 H new ATOM 2042 N GLU A 128 -15.242 4.059 -1.017 1.00 62.13 N ATOM 2043 CA GLU A 128 -14.461 4.774 -1.975 1.00 33.24 C ATOM 2044 C GLU A 128 -13.895 3.867 -3.044 1.00 12.43 C ATOM 2045 O GLU A 128 -12.670 3.688 -3.143 1.00 11.41 O ATOM 2046 CB GLU A 128 -13.334 5.585 -1.333 1.00 43.11 C ATOM 2047 CG GLU A 128 -13.780 6.640 -0.348 1.00 44.43 C ATOM 2048 CD GLU A 128 -12.626 7.495 0.092 1.00 1.01 C ATOM 2049 OE1 GLU A 128 -12.292 8.458 -0.634 1.00 3.52 O ATOM 2050 OE2 GLU A 128 -12.023 7.226 1.149 1.00 4.42 O ATOM 0 H GLU A 128 -14.702 3.605 -0.280 1.00 62.13 H new ATOM 0 HA GLU A 128 -15.152 5.473 -2.445 1.00 33.24 H new ATOM 0 HB2 GLU A 128 -12.658 4.898 -0.824 1.00 43.11 H new ATOM 0 HB3 GLU A 128 -12.760 6.069 -2.124 1.00 43.11 H new ATOM 0 HG2 GLU A 128 -14.547 7.266 -0.804 1.00 44.43 H new ATOM 0 HG3 GLU A 128 -14.234 6.162 0.520 1.00 44.43 H new