USER MOD reduce.3.24.130724 H: found=0, std=0, add=1163, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1167 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 127 MET CE :methyl 173:sc= -1.44 (180deg=-1.21) USER MOD Set 1.2: A 168 MET CE :methyl 137:sc= -1.01 (180deg=-1.74) USER MOD Set 2.1: A 156 THR OG1 : rot -92:sc= 0.499 USER MOD Set 2.2: A 157 THR OG1 : rot 180:sc= -1.91! USER MOD Set 3.1: A 82 MET CE :methyl -169:sc= -0.444 (180deg=-0.659) USER MOD Set 3.2: A 95 LYS NZ :NH3+ 150:sc= -0.0115 (180deg=0) USER MOD Set 4.1: A 80 HIS : no HE2:sc= -0.73 K(o=-1.9,f=-4) USER MOD Set 4.2: A 81 ASN : amide:sc= -1.13 K(o=-1.9,f=-3.9) USER MOD Set 5.1: A 39 TYR OH : rot 76:sc= 0.0333 USER MOD Set 5.2: A 94 MET CE :methyl -169:sc= -1.22 (180deg=-1.6) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 22 GLN : amide:sc= -2.52! K(o=-2.5!,f=-0.046) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -163:sc= -0.118 (180deg=-0.441) USER MOD Single : A 38 GLN : amide:sc= -0.497 X(o=-0.5,f=0) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -1.3 K(o=-1.3,f=-7.5!) USER MOD Single : A 59 LYS NZ :NH3+ -150:sc= 0.413 (180deg=-2.24!) USER MOD Single : A 61 CYS SG : rot 180:sc= -1.43 USER MOD Single : A 62 CYS SG : rot 130:sc= -0.33 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.351 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -0.118 X(o=-0.12,f=-0.029) USER MOD Single : A 77 ASN : amide:sc= -1.9! K(o=-1.9!,f=-0.055) USER MOD Single : A 83 LYS NZ :NH3+ 131:sc= -0.162 (180deg=-1.04) USER MOD Single : A 88 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 89 HIS : no HD1:sc=-0.00728 X(o=-0.0073,f=-0.0073) USER MOD Single : A 90 HIS : no HD1:sc= -0.73 X(o=-0.73,f=-0.52) USER MOD Single : A 93 GLN : amide:sc=-0.00197 K(o=-0.002,f=-0.63) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 139:sc= -0.0839 (180deg=-0.515) USER MOD Single : A 114 MET CE :methyl 166:sc= -6.45! (180deg=-7.04!) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 CYS SG : rot 105:sc= 0.359 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc= -0.159 X(o=-0.16,f=0) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= -0.225 X(o=-0.23,f=-0.59) USER MOD Single : A 137 CYS SG : rot 97:sc= 1.06 USER MOD Single : A 147 SER OG : rot 180:sc= -0.271 USER MOD Single : A 150 CYS SG : rot 180:sc= -0.885 USER MOD Single : A 154 THR OG1 : rot -61:sc= 0.513 USER MOD Single : A 160 MET CE :methyl -174:sc=-0.00768 (180deg=-0.0466) USER MOD Single : A 162 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 163 THR OG1 : rot 180:sc= 0 USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 169 HIS : no HD1:sc= -1.54 K(o=-1.5,f=-0.26) USER MOD Single : A 184 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0717) USER MOD ----------------------------------------------------------------- ATOM 214 N ILE A 16 29.826 -6.339 -7.526 1.00 4.74 N ATOM 215 CA ILE A 16 28.741 -5.847 -6.690 1.00 4.26 C ATOM 216 C ILE A 16 29.247 -5.579 -5.272 1.00 3.73 C ATOM 217 O ILE A 16 30.181 -6.235 -4.809 1.00 3.57 O ATOM 218 CB ILE A 16 27.570 -6.860 -6.667 1.00 4.00 C ATOM 219 CG1 ILE A 16 26.219 -6.138 -6.783 1.00 4.44 C ATOM 220 CG2 ILE A 16 27.616 -7.730 -5.419 1.00 3.10 C ATOM 221 CD1 ILE A 16 25.926 -5.180 -5.647 1.00 4.12 C ATOM 0 HA ILE A 16 28.374 -4.911 -7.111 1.00 4.26 H new ATOM 0 HB ILE A 16 27.680 -7.515 -7.531 1.00 4.00 H new ATOM 0 HG12 ILE A 16 26.194 -5.587 -7.723 1.00 4.44 H new ATOM 0 HG13 ILE A 16 25.425 -6.883 -6.829 1.00 4.44 H new ATOM 0 HG21 ILE A 16 26.781 -8.430 -5.433 1.00 3.10 H new ATOM 0 HG22 ILE A 16 28.554 -8.284 -5.396 1.00 3.10 H new ATOM 0 HG23 ILE A 16 27.546 -7.099 -4.533 1.00 3.10 H new ATOM 0 HD11 ILE A 16 24.954 -4.713 -5.806 1.00 4.12 H new ATOM 0 HD12 ILE A 16 25.916 -5.726 -4.704 1.00 4.12 H new ATOM 0 HD13 ILE A 16 26.697 -4.410 -5.612 1.00 4.12 H new ATOM 233 N LYS A 17 28.630 -4.620 -4.590 1.00 3.63 N ATOM 234 CA LYS A 17 29.031 -4.267 -3.233 1.00 3.33 C ATOM 235 C LYS A 17 27.864 -4.374 -2.253 1.00 2.84 C ATOM 236 O LYS A 17 26.747 -3.944 -2.546 1.00 3.10 O ATOM 237 CB LYS A 17 29.596 -2.849 -3.207 1.00 3.97 C ATOM 238 CG LYS A 17 31.098 -2.787 -3.430 1.00 4.67 C ATOM 239 CD LYS A 17 31.614 -1.357 -3.376 1.00 5.07 C ATOM 240 CE LYS A 17 33.125 -1.305 -3.533 1.00 5.85 C ATOM 241 NZ LYS A 17 33.639 0.093 -3.516 1.00 6.09 N ATOM 0 H LYS A 17 27.850 -4.073 -4.955 1.00 3.63 H new ATOM 0 HA LYS A 17 29.799 -4.975 -2.921 1.00 3.33 H new ATOM 0 HB2 LYS A 17 29.099 -2.255 -3.974 1.00 3.97 H new ATOM 0 HB3 LYS A 17 29.361 -2.391 -2.246 1.00 3.97 H new ATOM 0 HG2 LYS A 17 31.604 -3.386 -2.672 1.00 4.67 H new ATOM 0 HG3 LYS A 17 31.341 -3.226 -4.398 1.00 4.67 H new ATOM 0 HD2 LYS A 17 31.145 -0.769 -4.165 1.00 5.07 H new ATOM 0 HD3 LYS A 17 31.330 -0.902 -2.427 1.00 5.07 H new ATOM 0 HE2 LYS A 17 33.593 -1.873 -2.729 1.00 5.85 H new ATOM 0 HE3 LYS A 17 33.409 -1.785 -4.470 1.00 5.85 H new ATOM 0 HZ1 LYS A 17 34.673 0.084 -3.626 1.00 6.09 H new ATOM 0 HZ2 LYS A 17 33.212 0.629 -4.298 1.00 6.09 H new ATOM 0 HZ3 LYS A 17 33.391 0.543 -2.612 1.00 6.09 H new ATOM 255 N MET A 18 28.143 -4.953 -1.088 1.00 2.38 N ATOM 256 CA MET A 18 27.139 -5.125 -0.044 1.00 2.12 C ATOM 257 C MET A 18 27.648 -4.583 1.289 1.00 2.26 C ATOM 258 O MET A 18 28.837 -4.663 1.591 1.00 2.37 O ATOM 259 CB MET A 18 26.768 -6.602 0.097 1.00 1.82 C ATOM 260 CG MET A 18 26.061 -7.169 -1.122 1.00 2.03 C ATOM 261 SD MET A 18 25.689 -8.925 -0.957 1.00 2.43 S ATOM 262 CE MET A 18 24.930 -9.261 -2.545 1.00 3.14 C ATOM 0 H MET A 18 29.065 -5.314 -0.843 1.00 2.38 H new ATOM 0 HA MET A 18 26.250 -4.563 -0.329 1.00 2.12 H new ATOM 0 HB2 MET A 18 27.673 -7.180 0.283 1.00 1.82 H new ATOM 0 HB3 MET A 18 26.126 -6.725 0.969 1.00 1.82 H new ATOM 0 HG2 MET A 18 25.134 -6.620 -1.288 1.00 2.03 H new ATOM 0 HG3 MET A 18 26.684 -7.015 -2.003 1.00 2.03 H new ATOM 0 HE1 MET A 18 24.644 -10.311 -2.596 1.00 3.14 H new ATOM 0 HE2 MET A 18 24.044 -8.637 -2.664 1.00 3.14 H new ATOM 0 HE3 MET A 18 25.640 -9.039 -3.342 1.00 3.14 H new ATOM 272 N PHE A 19 26.739 -4.024 2.076 1.00 2.46 N ATOM 273 CA PHE A 19 27.079 -3.462 3.380 1.00 2.77 C ATOM 274 C PHE A 19 26.195 -4.065 4.475 1.00 2.74 C ATOM 275 O PHE A 19 24.986 -4.189 4.306 1.00 2.74 O ATOM 276 CB PHE A 19 26.898 -1.944 3.343 1.00 3.31 C ATOM 277 CG PHE A 19 27.791 -1.203 4.293 1.00 3.72 C ATOM 278 CD1 PHE A 19 27.468 -1.099 5.636 1.00 3.78 C ATOM 279 CD2 PHE A 19 28.957 -0.608 3.838 1.00 4.18 C ATOM 280 CE1 PHE A 19 28.291 -0.414 6.509 1.00 4.26 C ATOM 281 CE2 PHE A 19 29.783 0.080 4.706 1.00 4.66 C ATOM 282 CZ PHE A 19 29.450 0.176 6.044 1.00 4.68 C ATOM 0 H PHE A 19 25.751 -3.946 1.833 1.00 2.46 H new ATOM 0 HA PHE A 19 28.118 -3.701 3.606 1.00 2.77 H new ATOM 0 HB2 PHE A 19 27.088 -1.590 2.330 1.00 3.31 H new ATOM 0 HB3 PHE A 19 25.860 -1.706 3.575 1.00 3.31 H new ATOM 0 HD1 PHE A 19 26.563 -1.558 6.005 1.00 3.78 H new ATOM 0 HD2 PHE A 19 29.223 -0.683 2.794 1.00 4.18 H new ATOM 0 HE1 PHE A 19 28.028 -0.340 7.554 1.00 4.26 H new ATOM 0 HE2 PHE A 19 30.688 0.542 4.339 1.00 4.66 H new ATOM 0 HZ PHE A 19 30.095 0.712 6.725 1.00 4.68 H new ATOM 292 N VAL A 20 26.797 -4.431 5.603 1.00 2.86 N ATOM 293 CA VAL A 20 26.040 -5.016 6.708 1.00 3.00 C ATOM 294 C VAL A 20 26.250 -4.217 7.991 1.00 3.64 C ATOM 295 O VAL A 20 27.334 -3.676 8.225 1.00 3.85 O ATOM 296 CB VAL A 20 26.406 -6.495 6.946 1.00 2.66 C ATOM 297 CG1 VAL A 20 26.688 -7.195 5.628 1.00 2.37 C ATOM 298 CG2 VAL A 20 27.588 -6.618 7.893 1.00 2.99 C ATOM 0 H VAL A 20 27.797 -4.335 5.777 1.00 2.86 H new ATOM 0 HA VAL A 20 24.988 -4.974 6.426 1.00 3.00 H new ATOM 0 HB VAL A 20 25.553 -6.985 7.415 1.00 2.66 H new ATOM 0 HG11 VAL A 20 26.944 -8.237 5.817 1.00 2.37 H new ATOM 0 HG12 VAL A 20 25.802 -7.148 4.994 1.00 2.37 H new ATOM 0 HG13 VAL A 20 27.520 -6.702 5.125 1.00 2.37 H new ATOM 0 HG21 VAL A 20 27.825 -7.671 8.044 1.00 2.99 H new ATOM 0 HG22 VAL A 20 28.452 -6.109 7.465 1.00 2.99 H new ATOM 0 HG23 VAL A 20 27.336 -6.162 8.851 1.00 2.99 H new ATOM 308 N GLY A 21 25.206 -4.153 8.815 1.00 3.97 N ATOM 309 CA GLY A 21 25.276 -3.392 10.047 1.00 4.60 C ATOM 310 C GLY A 21 24.771 -4.135 11.269 1.00 4.93 C ATOM 311 O GLY A 21 23.774 -4.855 11.202 1.00 4.85 O ATOM 0 H GLY A 21 24.313 -4.616 8.649 1.00 3.97 H new ATOM 0 HA2 GLY A 21 26.311 -3.095 10.219 1.00 4.60 H new ATOM 0 HA3 GLY A 21 24.697 -2.476 9.928 1.00 4.60 H new ATOM 315 N GLN A 22 25.473 -3.956 12.389 1.00 5.36 N ATOM 316 CA GLN A 22 25.090 -4.568 13.659 1.00 5.79 C ATOM 317 C GLN A 22 25.141 -6.090 13.600 1.00 5.48 C ATOM 318 O GLN A 22 24.123 -6.761 13.757 1.00 5.53 O ATOM 319 CB GLN A 22 23.688 -4.106 14.071 1.00 6.13 C ATOM 320 CG GLN A 22 23.313 -4.487 15.496 1.00 6.35 C ATOM 321 CD GLN A 22 23.793 -3.478 16.525 1.00 7.21 C ATOM 322 OE1 GLN A 22 23.178 -3.314 17.579 1.00 7.79 O ATOM 323 NE2 GLN A 22 24.893 -2.795 16.228 1.00 7.55 N ATOM 0 H GLN A 22 26.317 -3.386 12.440 1.00 5.36 H new ATOM 0 HA GLN A 22 25.814 -4.243 14.406 1.00 5.79 H new ATOM 0 HB2 GLN A 22 23.626 -3.023 13.966 1.00 6.13 H new ATOM 0 HB3 GLN A 22 22.957 -4.535 13.385 1.00 6.13 H new ATOM 0 HG2 GLN A 22 22.230 -4.583 15.567 1.00 6.35 H new ATOM 0 HG3 GLN A 22 23.736 -5.464 15.728 1.00 6.35 H new ATOM 0 HE21 GLN A 22 25.373 -2.961 15.344 1.00 7.55 H new ATOM 0 HE22 GLN A 22 25.257 -2.105 16.884 1.00 7.55 H new ATOM 332 N VAL A 23 26.332 -6.632 13.375 1.00 5.25 N ATOM 333 CA VAL A 23 26.503 -8.080 13.317 1.00 5.09 C ATOM 334 C VAL A 23 27.511 -8.549 14.368 1.00 5.64 C ATOM 335 O VAL A 23 28.534 -7.898 14.579 1.00 5.87 O ATOM 336 CB VAL A 23 26.976 -8.525 11.922 1.00 4.52 C ATOM 337 CG1 VAL A 23 28.361 -7.989 11.631 1.00 4.57 C ATOM 338 CG2 VAL A 23 26.948 -10.040 11.793 1.00 4.51 C ATOM 0 H VAL A 23 27.188 -6.096 13.231 1.00 5.25 H new ATOM 0 HA VAL A 23 25.533 -8.533 13.522 1.00 5.09 H new ATOM 0 HB VAL A 23 26.286 -8.112 11.186 1.00 4.52 H new ATOM 0 HG11 VAL A 23 28.677 -8.315 10.640 1.00 4.57 H new ATOM 0 HG12 VAL A 23 28.344 -6.900 11.666 1.00 4.57 H new ATOM 0 HG13 VAL A 23 29.061 -8.366 12.377 1.00 4.57 H new ATOM 0 HG21 VAL A 23 27.287 -10.327 10.798 1.00 4.51 H new ATOM 0 HG22 VAL A 23 27.606 -10.481 12.542 1.00 4.51 H new ATOM 0 HG23 VAL A 23 25.931 -10.400 11.947 1.00 4.51 H new ATOM 348 N PRO A 24 27.233 -9.673 15.062 1.00 5.91 N ATOM 349 CA PRO A 24 28.141 -10.210 16.079 1.00 6.48 C ATOM 350 C PRO A 24 29.547 -10.432 15.530 1.00 6.48 C ATOM 351 O PRO A 24 29.858 -11.499 14.996 1.00 7.01 O ATOM 352 CB PRO A 24 27.497 -11.541 16.470 1.00 6.70 C ATOM 353 CG PRO A 24 26.061 -11.381 16.137 1.00 6.51 C ATOM 354 CD PRO A 24 26.018 -10.497 14.926 1.00 5.77 C ATOM 0 HA PRO A 24 28.266 -9.527 16.919 1.00 6.48 H new ATOM 0 HB2 PRO A 24 27.940 -12.371 15.920 1.00 6.70 H new ATOM 0 HB3 PRO A 24 27.636 -11.751 17.531 1.00 6.70 H new ATOM 0 HG2 PRO A 24 25.597 -12.346 15.933 1.00 6.51 H new ATOM 0 HG3 PRO A 24 25.515 -10.934 16.967 1.00 6.51 H new ATOM 0 HD2 PRO A 24 26.028 -11.078 14.004 1.00 5.77 H new ATOM 0 HD3 PRO A 24 25.117 -9.884 14.907 1.00 5.77 H new ATOM 362 N ARG A 25 30.391 -9.416 15.669 1.00 6.06 N ATOM 363 CA ARG A 25 31.765 -9.482 15.188 1.00 6.01 C ATOM 364 C ARG A 25 32.638 -10.298 16.137 1.00 6.40 C ATOM 365 O ARG A 25 33.864 -10.309 16.013 1.00 6.39 O ATOM 366 CB ARG A 25 32.335 -8.069 15.047 1.00 5.95 C ATOM 367 CG ARG A 25 31.563 -7.187 14.077 1.00 5.62 C ATOM 368 CD ARG A 25 32.020 -7.397 12.645 1.00 5.99 C ATOM 369 NE ARG A 25 31.183 -6.661 11.707 1.00 6.24 N ATOM 370 CZ ARG A 25 30.959 -7.045 10.459 1.00 6.85 C ATOM 371 NH1 ARG A 25 31.560 -8.120 9.968 1.00 7.30 N ATOM 372 NH2 ARG A 25 30.125 -6.349 9.699 1.00 7.24 N ATOM 0 H ARG A 25 30.145 -8.532 16.114 1.00 6.06 H new ATOM 0 HA ARG A 25 31.763 -9.973 14.215 1.00 6.01 H new ATOM 0 HB2 ARG A 25 32.345 -7.592 16.027 1.00 5.95 H new ATOM 0 HB3 ARG A 25 33.371 -8.137 14.715 1.00 5.95 H new ATOM 0 HG2 ARG A 25 30.498 -7.405 14.155 1.00 5.62 H new ATOM 0 HG3 ARG A 25 31.695 -6.141 14.352 1.00 5.62 H new ATOM 0 HD2 ARG A 25 33.056 -7.075 12.541 1.00 5.99 H new ATOM 0 HD3 ARG A 25 31.991 -8.460 12.404 1.00 5.99 H new ATOM 0 HE ARG A 25 30.743 -5.799 12.030 1.00 6.24 H new ATOM 0 HH11 ARG A 25 32.200 -8.658 10.552 1.00 7.30 H new ATOM 0 HH12 ARG A 25 31.382 -8.409 9.006 1.00 7.30 H new ATOM 0 HH21 ARG A 25 29.660 -5.523 10.076 1.00 7.24 H new ATOM 0 HH22 ARG A 25 29.948 -6.639 8.737 1.00 7.24 H new ATOM 386 N THR A 26 32.000 -10.977 17.084 1.00 6.80 N ATOM 387 CA THR A 26 32.716 -11.792 18.060 1.00 7.23 C ATOM 388 C THR A 26 33.431 -12.958 17.389 1.00 7.16 C ATOM 389 O THR A 26 34.445 -13.447 17.886 1.00 7.49 O ATOM 390 CB THR A 26 31.761 -12.348 19.133 1.00 7.59 C ATOM 391 OG1 THR A 26 32.493 -13.139 20.077 1.00 8.00 O ATOM 392 CG2 THR A 26 30.668 -13.194 18.496 1.00 7.42 C ATOM 0 H THR A 26 30.986 -10.979 17.197 1.00 6.80 H new ATOM 0 HA THR A 26 33.451 -11.141 18.533 1.00 7.23 H new ATOM 0 HB THR A 26 31.296 -11.507 19.647 1.00 7.59 H new ATOM 0 HG1 THR A 26 31.879 -13.488 20.757 1.00 8.00 H new ATOM 0 HG21 THR A 26 30.005 -13.576 19.272 1.00 7.42 H new ATOM 0 HG22 THR A 26 30.095 -12.583 17.798 1.00 7.42 H new ATOM 0 HG23 THR A 26 31.120 -14.029 17.961 1.00 7.42 H new ATOM 400 N TRP A 27 32.894 -13.399 16.256 1.00 6.78 N ATOM 401 CA TRP A 27 33.473 -14.514 15.519 1.00 6.78 C ATOM 402 C TRP A 27 34.684 -14.062 14.707 1.00 6.52 C ATOM 403 O TRP A 27 35.123 -12.917 14.818 1.00 6.48 O ATOM 404 CB TRP A 27 32.419 -15.142 14.606 1.00 6.61 C ATOM 405 CG TRP A 27 31.270 -15.738 15.359 1.00 6.78 C ATOM 406 CD1 TRP A 27 29.996 -15.253 15.436 1.00 7.11 C ATOM 407 CD2 TRP A 27 31.293 -16.933 16.150 1.00 6.87 C ATOM 408 NE1 TRP A 27 29.226 -16.076 16.222 1.00 7.30 N ATOM 409 CE2 TRP A 27 30.000 -17.112 16.672 1.00 7.14 C ATOM 410 CE3 TRP A 27 32.284 -17.868 16.465 1.00 7.00 C ATOM 411 CZ2 TRP A 27 29.670 -18.191 17.492 1.00 7.39 C ATOM 412 CZ3 TRP A 27 31.957 -18.936 17.277 1.00 7.36 C ATOM 413 CH2 TRP A 27 30.660 -19.089 17.783 1.00 7.49 C ATOM 0 H TRP A 27 32.058 -13.000 15.829 1.00 6.78 H new ATOM 0 HA TRP A 27 33.810 -15.263 16.236 1.00 6.78 H new ATOM 0 HB2 TRP A 27 32.042 -14.383 13.921 1.00 6.61 H new ATOM 0 HB3 TRP A 27 32.888 -15.916 13.998 1.00 6.61 H new ATOM 0 HD1 TRP A 27 29.645 -14.354 14.950 1.00 7.11 H new ATOM 0 HE1 TRP A 27 28.238 -15.938 16.436 1.00 7.30 H new ATOM 0 HE3 TRP A 27 33.287 -17.757 16.080 1.00 7.00 H new ATOM 0 HZ2 TRP A 27 28.670 -18.313 17.882 1.00 7.39 H new ATOM 0 HZ3 TRP A 27 32.714 -19.665 17.526 1.00 7.36 H new ATOM 0 HH2 TRP A 27 30.437 -19.934 18.417 1.00 7.49 H new ATOM 424 N SER A 28 35.220 -14.966 13.891 1.00 6.41 N ATOM 425 CA SER A 28 36.381 -14.657 13.066 1.00 6.22 C ATOM 426 C SER A 28 35.959 -14.173 11.684 1.00 5.65 C ATOM 427 O SER A 28 34.770 -14.121 11.368 1.00 5.37 O ATOM 428 CB SER A 28 37.288 -15.883 12.939 1.00 6.54 C ATOM 429 OG SER A 28 37.763 -16.299 14.208 1.00 6.97 O ATOM 0 H SER A 28 34.868 -15.917 13.785 1.00 6.41 H new ATOM 0 HA SER A 28 36.935 -13.855 13.554 1.00 6.22 H new ATOM 0 HB2 SER A 28 36.739 -16.698 12.467 1.00 6.54 H new ATOM 0 HB3 SER A 28 38.132 -15.649 12.290 1.00 6.54 H new ATOM 0 HG SER A 28 38.339 -17.085 14.100 1.00 6.97 H new ATOM 435 N GLU A 29 36.941 -13.818 10.863 1.00 5.49 N ATOM 436 CA GLU A 29 36.676 -13.322 9.519 1.00 4.97 C ATOM 437 C GLU A 29 36.282 -14.449 8.567 1.00 4.84 C ATOM 438 O GLU A 29 35.329 -14.318 7.799 1.00 4.48 O ATOM 439 CB GLU A 29 37.911 -12.602 8.973 1.00 4.89 C ATOM 440 CG GLU A 29 37.615 -11.690 7.795 1.00 4.40 C ATOM 441 CD GLU A 29 38.848 -10.962 7.297 1.00 4.54 C ATOM 442 OE1 GLU A 29 39.174 -9.895 7.858 1.00 4.76 O ATOM 443 OE2 GLU A 29 39.489 -11.460 6.348 1.00 4.58 O ATOM 0 H GLU A 29 37.930 -13.865 11.106 1.00 5.49 H new ATOM 0 HA GLU A 29 35.840 -12.626 9.585 1.00 4.97 H new ATOM 0 HB2 GLU A 29 38.361 -12.014 9.773 1.00 4.89 H new ATOM 0 HB3 GLU A 29 38.649 -13.345 8.670 1.00 4.89 H new ATOM 0 HG2 GLU A 29 37.192 -12.279 6.981 1.00 4.40 H new ATOM 0 HG3 GLU A 29 36.860 -10.960 8.086 1.00 4.40 H new ATOM 450 N LYS A 30 37.016 -15.553 8.624 1.00 5.20 N ATOM 451 CA LYS A 30 36.756 -16.685 7.744 1.00 5.23 C ATOM 452 C LYS A 30 35.316 -17.185 7.858 1.00 5.19 C ATOM 453 O LYS A 30 34.631 -17.351 6.853 1.00 4.95 O ATOM 454 CB LYS A 30 37.730 -17.818 8.060 1.00 5.76 C ATOM 455 CG LYS A 30 37.397 -19.123 7.358 1.00 6.10 C ATOM 456 CD LYS A 30 38.560 -20.094 7.419 1.00 6.00 C ATOM 457 CE LYS A 30 38.199 -21.436 6.803 1.00 6.45 C ATOM 458 NZ LYS A 30 37.020 -22.054 7.470 1.00 7.08 N ATOM 0 H LYS A 30 37.795 -15.689 9.269 1.00 5.20 H new ATOM 0 HA LYS A 30 36.902 -16.347 6.718 1.00 5.23 H new ATOM 0 HB2 LYS A 30 38.736 -17.510 7.777 1.00 5.76 H new ATOM 0 HB3 LYS A 30 37.740 -17.987 9.137 1.00 5.76 H new ATOM 0 HG2 LYS A 30 36.519 -19.574 7.821 1.00 6.10 H new ATOM 0 HG3 LYS A 30 37.141 -18.924 6.317 1.00 6.10 H new ATOM 0 HD2 LYS A 30 39.417 -19.671 6.895 1.00 6.00 H new ATOM 0 HD3 LYS A 30 38.861 -20.238 8.457 1.00 6.00 H new ATOM 0 HE2 LYS A 30 37.988 -21.303 5.742 1.00 6.45 H new ATOM 0 HE3 LYS A 30 39.052 -22.110 6.876 1.00 6.45 H new ATOM 0 HZ1 LYS A 30 36.978 -23.066 7.233 1.00 7.08 H new ATOM 0 HZ2 LYS A 30 37.107 -21.943 8.500 1.00 7.08 H new ATOM 0 HZ3 LYS A 30 36.151 -21.585 7.143 1.00 7.08 H new ATOM 472 N ASP A 31 34.837 -17.389 9.076 1.00 5.49 N ATOM 473 CA ASP A 31 33.474 -17.872 9.266 1.00 5.55 C ATOM 474 C ASP A 31 32.467 -16.842 8.775 1.00 5.01 C ATOM 475 O ASP A 31 31.369 -17.186 8.336 1.00 4.91 O ATOM 476 CB ASP A 31 33.217 -18.202 10.737 1.00 6.02 C ATOM 477 CG ASP A 31 33.532 -17.040 11.656 1.00 6.57 C ATOM 478 OD1 ASP A 31 32.781 -16.043 11.634 1.00 6.86 O ATOM 479 OD2 ASP A 31 34.528 -17.131 12.403 1.00 6.91 O ATOM 0 H ASP A 31 35.361 -17.231 9.937 1.00 5.49 H new ATOM 0 HA ASP A 31 33.353 -18.783 8.680 1.00 5.55 H new ATOM 0 HB2 ASP A 31 32.173 -18.489 10.865 1.00 6.02 H new ATOM 0 HB3 ASP A 31 33.822 -19.062 11.024 1.00 6.02 H new ATOM 484 N LEU A 32 32.863 -15.577 8.830 1.00 4.72 N ATOM 485 CA LEU A 32 31.997 -14.483 8.413 1.00 4.23 C ATOM 486 C LEU A 32 31.593 -14.596 6.945 1.00 3.82 C ATOM 487 O LEU A 32 30.435 -14.355 6.600 1.00 3.55 O ATOM 488 CB LEU A 32 32.689 -13.143 8.653 1.00 4.13 C ATOM 489 CG LEU A 32 31.841 -11.912 8.340 1.00 3.86 C ATOM 490 CD1 LEU A 32 31.136 -11.414 9.593 1.00 4.25 C ATOM 491 CD2 LEU A 32 32.706 -10.819 7.733 1.00 3.73 C ATOM 0 H LEU A 32 33.782 -15.283 9.161 1.00 4.72 H new ATOM 0 HA LEU A 32 31.089 -14.544 9.013 1.00 4.23 H new ATOM 0 HB2 LEU A 32 33.001 -13.094 9.696 1.00 4.13 H new ATOM 0 HB3 LEU A 32 33.594 -13.105 8.047 1.00 4.13 H new ATOM 0 HG LEU A 32 31.078 -12.189 7.613 1.00 3.86 H new ATOM 0 HD11 LEU A 32 30.537 -10.537 9.349 1.00 4.25 H new ATOM 0 HD12 LEU A 32 30.488 -12.199 9.982 1.00 4.25 H new ATOM 0 HD13 LEU A 32 31.877 -11.149 10.347 1.00 4.25 H new ATOM 0 HD21 LEU A 32 32.090 -9.947 7.514 1.00 3.73 H new ATOM 0 HD22 LEU A 32 33.490 -10.542 8.438 1.00 3.73 H new ATOM 0 HD23 LEU A 32 33.159 -11.183 6.811 1.00 3.73 H new ATOM 503 N ARG A 33 32.531 -14.982 6.079 1.00 3.89 N ATOM 504 CA ARG A 33 32.224 -15.079 4.654 1.00 3.67 C ATOM 505 C ARG A 33 31.211 -16.182 4.391 1.00 3.83 C ATOM 506 O ARG A 33 30.453 -16.114 3.424 1.00 3.57 O ATOM 507 CB ARG A 33 33.484 -15.292 3.809 1.00 3.95 C ATOM 508 CG ARG A 33 34.386 -16.401 4.303 1.00 4.34 C ATOM 509 CD ARG A 33 35.411 -16.794 3.253 1.00 4.72 C ATOM 510 NE ARG A 33 34.785 -17.362 2.063 1.00 5.30 N ATOM 511 CZ ARG A 33 35.349 -17.361 0.860 1.00 5.77 C ATOM 512 NH1 ARG A 33 36.549 -16.820 0.686 1.00 5.63 N ATOM 513 NH2 ARG A 33 34.716 -17.903 -0.173 1.00 6.56 N ATOM 0 H ARG A 33 33.488 -15.227 6.332 1.00 3.89 H new ATOM 0 HA ARG A 33 31.787 -14.127 4.355 1.00 3.67 H new ATOM 0 HB2 ARG A 33 33.187 -15.511 2.784 1.00 3.95 H new ATOM 0 HB3 ARG A 33 34.052 -14.362 3.784 1.00 3.95 H new ATOM 0 HG2 ARG A 33 34.898 -16.079 5.210 1.00 4.34 H new ATOM 0 HG3 ARG A 33 33.784 -17.270 4.569 1.00 4.34 H new ATOM 0 HD2 ARG A 33 35.996 -15.918 2.972 1.00 4.72 H new ATOM 0 HD3 ARG A 33 36.106 -17.518 3.678 1.00 4.72 H new ATOM 0 HE ARG A 33 33.862 -17.784 2.161 1.00 5.30 H new ATOM 0 HH11 ARG A 33 37.040 -16.404 1.477 1.00 5.63 H new ATOM 0 HH12 ARG A 33 36.980 -16.821 -0.239 1.00 5.63 H new ATOM 0 HH21 ARG A 33 33.795 -18.321 -0.044 1.00 6.56 H new ATOM 0 HH22 ARG A 33 35.151 -17.901 -1.096 1.00 6.56 H new ATOM 527 N GLU A 34 31.197 -17.196 5.252 1.00 4.29 N ATOM 528 CA GLU A 34 30.260 -18.299 5.094 1.00 4.54 C ATOM 529 C GLU A 34 28.836 -17.762 5.026 1.00 4.17 C ATOM 530 O GLU A 34 28.016 -18.237 4.240 1.00 4.17 O ATOM 531 CB GLU A 34 30.392 -19.289 6.252 1.00 5.12 C ATOM 532 CG GLU A 34 31.778 -19.899 6.378 1.00 5.67 C ATOM 533 CD GLU A 34 31.849 -20.966 7.452 1.00 6.50 C ATOM 534 OE1 GLU A 34 31.957 -20.604 8.642 1.00 6.86 O ATOM 535 OE2 GLU A 34 31.798 -22.164 7.104 1.00 6.88 O ATOM 0 H GLU A 34 31.818 -17.275 6.058 1.00 4.29 H new ATOM 0 HA GLU A 34 30.491 -18.822 4.166 1.00 4.54 H new ATOM 0 HB2 GLU A 34 30.142 -18.781 7.183 1.00 5.12 H new ATOM 0 HB3 GLU A 34 29.663 -20.089 6.120 1.00 5.12 H new ATOM 0 HG2 GLU A 34 32.069 -20.332 5.421 1.00 5.67 H new ATOM 0 HG3 GLU A 34 32.498 -19.113 6.604 1.00 5.67 H new ATOM 542 N LEU A 35 28.564 -16.749 5.841 1.00 3.97 N ATOM 543 CA LEU A 35 27.246 -16.132 5.886 1.00 3.73 C ATOM 544 C LEU A 35 26.867 -15.587 4.513 1.00 3.22 C ATOM 545 O LEU A 35 25.736 -15.751 4.057 1.00 3.17 O ATOM 546 CB LEU A 35 27.229 -14.998 6.916 1.00 3.73 C ATOM 547 CG LEU A 35 27.882 -15.327 8.263 1.00 4.04 C ATOM 548 CD1 LEU A 35 27.927 -14.094 9.154 1.00 4.24 C ATOM 549 CD2 LEU A 35 27.138 -16.460 8.955 1.00 4.42 C ATOM 0 H LEU A 35 29.243 -16.337 6.482 1.00 3.97 H new ATOM 0 HA LEU A 35 26.519 -16.890 6.177 1.00 3.73 H new ATOM 0 HB2 LEU A 35 27.735 -14.133 6.488 1.00 3.73 H new ATOM 0 HB3 LEU A 35 26.194 -14.707 7.094 1.00 3.73 H new ATOM 0 HG LEU A 35 28.906 -15.651 8.076 1.00 4.04 H new ATOM 0 HD11 LEU A 35 28.394 -14.349 10.105 1.00 4.24 H new ATOM 0 HD12 LEU A 35 28.506 -13.312 8.664 1.00 4.24 H new ATOM 0 HD13 LEU A 35 26.913 -13.737 9.332 1.00 4.24 H new ATOM 0 HD21 LEU A 35 27.616 -16.680 9.910 1.00 4.42 H new ATOM 0 HD22 LEU A 35 26.103 -16.164 9.127 1.00 4.42 H new ATOM 0 HD23 LEU A 35 27.161 -17.349 8.325 1.00 4.42 H new ATOM 561 N PHE A 36 27.829 -14.940 3.865 1.00 2.92 N ATOM 562 CA PHE A 36 27.616 -14.357 2.547 1.00 2.53 C ATOM 563 C PHE A 36 27.611 -15.421 1.453 1.00 2.79 C ATOM 564 O PHE A 36 27.039 -15.215 0.383 1.00 2.71 O ATOM 565 CB PHE A 36 28.689 -13.307 2.261 1.00 2.33 C ATOM 566 CG PHE A 36 28.704 -12.192 3.265 1.00 2.64 C ATOM 567 CD1 PHE A 36 27.770 -11.170 3.201 1.00 3.18 C ATOM 568 CD2 PHE A 36 29.658 -12.162 4.268 1.00 2.74 C ATOM 569 CE1 PHE A 36 27.787 -10.138 4.120 1.00 3.84 C ATOM 570 CE2 PHE A 36 29.680 -11.134 5.191 1.00 3.25 C ATOM 571 CZ PHE A 36 28.720 -10.133 5.132 1.00 3.84 C ATOM 0 H PHE A 36 28.770 -14.806 4.235 1.00 2.92 H new ATOM 0 HA PHE A 36 26.635 -13.881 2.546 1.00 2.53 H new ATOM 0 HB2 PHE A 36 29.666 -13.789 2.248 1.00 2.33 H new ATOM 0 HB3 PHE A 36 28.526 -12.891 1.267 1.00 2.33 H new ATOM 0 HD1 PHE A 36 27.020 -11.180 2.424 1.00 3.18 H new ATOM 0 HD2 PHE A 36 30.393 -12.951 4.330 1.00 2.74 H new ATOM 0 HE1 PHE A 36 27.068 -9.335 4.044 1.00 3.84 H new ATOM 0 HE2 PHE A 36 30.442 -11.109 5.956 1.00 3.25 H new ATOM 0 HZ PHE A 36 28.705 -9.352 5.878 1.00 3.84 H new ATOM 581 N GLU A 37 28.256 -16.554 1.718 1.00 3.23 N ATOM 582 CA GLU A 37 28.330 -17.634 0.738 1.00 3.62 C ATOM 583 C GLU A 37 26.945 -18.198 0.439 1.00 3.69 C ATOM 584 O GLU A 37 26.705 -18.735 -0.643 1.00 3.94 O ATOM 585 CB GLU A 37 29.256 -18.746 1.236 1.00 4.13 C ATOM 586 CG GLU A 37 30.731 -18.383 1.155 1.00 4.40 C ATOM 587 CD GLU A 37 31.637 -19.510 1.613 1.00 5.13 C ATOM 588 OE1 GLU A 37 31.871 -20.443 0.817 1.00 5.27 O ATOM 589 OE2 GLU A 37 32.111 -19.459 2.768 1.00 5.70 O ATOM 0 H GLU A 37 28.733 -16.748 2.599 1.00 3.23 H new ATOM 0 HA GLU A 37 28.738 -17.222 -0.185 1.00 3.62 H new ATOM 0 HB2 GLU A 37 29.004 -18.984 2.269 1.00 4.13 H new ATOM 0 HB3 GLU A 37 29.078 -19.647 0.649 1.00 4.13 H new ATOM 0 HG2 GLU A 37 30.980 -18.117 0.128 1.00 4.40 H new ATOM 0 HG3 GLU A 37 30.918 -17.500 1.767 1.00 4.40 H new ATOM 596 N GLN A 38 26.034 -18.064 1.398 1.00 3.55 N ATOM 597 CA GLN A 38 24.672 -18.560 1.238 1.00 3.66 C ATOM 598 C GLN A 38 23.909 -17.750 0.192 1.00 3.45 C ATOM 599 O GLN A 38 22.756 -18.051 -0.117 1.00 3.63 O ATOM 600 CB GLN A 38 23.929 -18.514 2.574 1.00 3.66 C ATOM 601 CG GLN A 38 24.604 -19.320 3.672 1.00 4.03 C ATOM 602 CD GLN A 38 23.831 -19.289 4.975 1.00 4.19 C ATOM 603 OE1 GLN A 38 22.968 -20.132 5.218 1.00 4.53 O ATOM 604 NE2 GLN A 38 24.135 -18.313 5.822 1.00 4.12 N ATOM 0 H GLN A 38 26.215 -17.615 2.296 1.00 3.55 H new ATOM 0 HA GLN A 38 24.731 -19.593 0.896 1.00 3.66 H new ATOM 0 HB2 GLN A 38 23.842 -17.477 2.897 1.00 3.66 H new ATOM 0 HB3 GLN A 38 22.916 -18.889 2.430 1.00 3.66 H new ATOM 0 HG2 GLN A 38 24.715 -20.353 3.344 1.00 4.03 H new ATOM 0 HG3 GLN A 38 25.608 -18.930 3.840 1.00 4.03 H new ATOM 0 HE21 GLN A 38 24.858 -17.635 5.581 1.00 4.12 H new ATOM 0 HE22 GLN A 38 23.646 -18.241 6.714 1.00 4.12 H new ATOM 613 N TYR A 39 24.559 -16.722 -0.348 1.00 3.16 N ATOM 614 CA TYR A 39 23.936 -15.867 -1.353 1.00 3.09 C ATOM 615 C TYR A 39 24.559 -16.092 -2.729 1.00 3.43 C ATOM 616 O TYR A 39 23.946 -15.788 -3.754 1.00 3.70 O ATOM 617 CB TYR A 39 24.074 -14.395 -0.957 1.00 2.67 C ATOM 618 CG TYR A 39 23.456 -14.069 0.384 1.00 2.49 C ATOM 619 CD1 TYR A 39 24.192 -14.183 1.557 1.00 2.40 C ATOM 620 CD2 TYR A 39 22.138 -13.642 0.477 1.00 2.65 C ATOM 621 CE1 TYR A 39 23.632 -13.884 2.784 1.00 2.52 C ATOM 622 CE2 TYR A 39 21.570 -13.340 1.702 1.00 2.74 C ATOM 623 CZ TYR A 39 22.321 -13.463 2.850 1.00 2.70 C ATOM 624 OH TYR A 39 21.759 -13.165 4.070 1.00 3.03 O ATOM 0 H TYR A 39 25.515 -16.462 -0.107 1.00 3.16 H new ATOM 0 HA TYR A 39 22.879 -16.128 -1.406 1.00 3.09 H new ATOM 0 HB2 TYR A 39 25.131 -14.131 -0.934 1.00 2.67 H new ATOM 0 HB3 TYR A 39 23.607 -13.776 -1.723 1.00 2.67 H new ATOM 0 HD1 TYR A 39 25.220 -14.511 1.509 1.00 2.40 H new ATOM 0 HD2 TYR A 39 21.547 -13.544 -0.421 1.00 2.65 H new ATOM 0 HE1 TYR A 39 24.218 -13.980 3.686 1.00 2.52 H new ATOM 0 HE2 TYR A 39 20.543 -13.010 1.758 1.00 2.74 H new ATOM 0 HH TYR A 39 22.087 -12.294 4.377 1.00 3.03 H new ATOM 634 N GLY A 40 25.777 -16.625 -2.747 1.00 3.54 N ATOM 635 CA GLY A 40 26.455 -16.877 -4.008 1.00 3.95 C ATOM 636 C GLY A 40 27.958 -17.000 -3.851 1.00 4.02 C ATOM 637 O GLY A 40 28.447 -17.448 -2.814 1.00 3.95 O ATOM 0 H GLY A 40 26.306 -16.886 -1.915 1.00 3.54 H new ATOM 0 HA2 GLY A 40 26.064 -17.794 -4.449 1.00 3.95 H new ATOM 0 HA3 GLY A 40 26.232 -16.068 -4.704 1.00 3.95 H new ATOM 641 N ALA A 41 28.692 -16.599 -4.886 1.00 4.22 N ATOM 642 CA ALA A 41 30.150 -16.671 -4.865 1.00 4.36 C ATOM 643 C ALA A 41 30.767 -15.338 -4.452 1.00 3.96 C ATOM 644 O ALA A 41 30.697 -14.352 -5.188 1.00 3.97 O ATOM 645 CB ALA A 41 30.674 -17.097 -6.229 1.00 4.90 C ATOM 0 H ALA A 41 28.301 -16.221 -5.749 1.00 4.22 H new ATOM 0 HA ALA A 41 30.440 -17.416 -4.124 1.00 4.36 H new ATOM 0 HB1 ALA A 41 31.762 -17.147 -6.201 1.00 4.90 H new ATOM 0 HB2 ALA A 41 30.272 -18.078 -6.483 1.00 4.90 H new ATOM 0 HB3 ALA A 41 30.363 -16.372 -6.981 1.00 4.90 H new ATOM 651 N VAL A 42 31.376 -15.321 -3.269 1.00 3.69 N ATOM 652 CA VAL A 42 32.012 -14.114 -2.750 1.00 3.34 C ATOM 653 C VAL A 42 33.418 -13.965 -3.321 1.00 3.70 C ATOM 654 O VAL A 42 33.931 -14.878 -3.969 1.00 4.23 O ATOM 655 CB VAL A 42 32.083 -14.130 -1.209 1.00 3.12 C ATOM 656 CG1 VAL A 42 32.015 -12.717 -0.665 1.00 2.79 C ATOM 657 CG2 VAL A 42 30.967 -14.983 -0.623 1.00 3.91 C ATOM 0 H VAL A 42 31.442 -16.130 -2.652 1.00 3.69 H new ATOM 0 HA VAL A 42 31.401 -13.266 -3.058 1.00 3.34 H new ATOM 0 HB VAL A 42 33.035 -14.572 -0.914 1.00 3.12 H new ATOM 0 HG11 VAL A 42 32.066 -12.743 0.423 1.00 2.79 H new ATOM 0 HG12 VAL A 42 32.852 -12.137 -1.054 1.00 2.79 H new ATOM 0 HG13 VAL A 42 31.078 -12.253 -0.973 1.00 2.79 H new ATOM 0 HG21 VAL A 42 31.038 -14.979 0.465 1.00 3.91 H new ATOM 0 HG22 VAL A 42 30.002 -14.577 -0.925 1.00 3.91 H new ATOM 0 HG23 VAL A 42 31.061 -16.006 -0.988 1.00 3.91 H new ATOM 667 N TYR A 43 34.042 -12.813 -3.083 1.00 3.46 N ATOM 668 CA TYR A 43 35.384 -12.560 -3.593 1.00 3.81 C ATOM 669 C TYR A 43 36.246 -11.825 -2.572 1.00 3.64 C ATOM 670 O TYR A 43 37.242 -12.362 -2.088 1.00 3.92 O ATOM 671 CB TYR A 43 35.310 -11.752 -4.892 1.00 4.02 C ATOM 672 CG TYR A 43 36.660 -11.480 -5.518 1.00 4.43 C ATOM 673 CD1 TYR A 43 37.308 -12.454 -6.267 1.00 4.86 C ATOM 674 CD2 TYR A 43 37.284 -10.249 -5.362 1.00 4.46 C ATOM 675 CE1 TYR A 43 38.541 -12.210 -6.842 1.00 5.24 C ATOM 676 CE2 TYR A 43 38.516 -9.996 -5.934 1.00 4.87 C ATOM 677 CZ TYR A 43 39.141 -10.980 -6.673 1.00 5.22 C ATOM 678 OH TYR A 43 40.368 -10.733 -7.245 1.00 5.63 O ATOM 0 H TYR A 43 33.641 -12.046 -2.544 1.00 3.46 H new ATOM 0 HA TYR A 43 35.850 -13.525 -3.791 1.00 3.81 H new ATOM 0 HB2 TYR A 43 34.689 -12.289 -5.609 1.00 4.02 H new ATOM 0 HB3 TYR A 43 34.815 -10.802 -4.691 1.00 4.02 H new ATOM 0 HD1 TYR A 43 36.841 -13.418 -6.402 1.00 4.86 H new ATOM 0 HD2 TYR A 43 36.798 -9.477 -4.784 1.00 4.46 H new ATOM 0 HE1 TYR A 43 39.032 -12.979 -7.421 1.00 5.24 H new ATOM 0 HE2 TYR A 43 38.988 -9.033 -5.804 1.00 4.87 H new ATOM 0 HH TYR A 43 40.650 -9.819 -7.031 1.00 5.63 H new ATOM 688 N GLU A 44 35.860 -10.595 -2.244 1.00 3.26 N ATOM 689 CA GLU A 44 36.621 -9.794 -1.289 1.00 3.20 C ATOM 690 C GLU A 44 35.738 -9.292 -0.152 1.00 2.81 C ATOM 691 O GLU A 44 34.676 -8.716 -0.382 1.00 2.54 O ATOM 692 CB GLU A 44 37.278 -8.609 -1.998 1.00 3.40 C ATOM 693 CG GLU A 44 38.111 -7.732 -1.078 1.00 3.50 C ATOM 694 CD GLU A 44 38.782 -6.588 -1.811 1.00 4.22 C ATOM 695 OE1 GLU A 44 39.875 -6.804 -2.375 1.00 4.91 O ATOM 696 OE2 GLU A 44 38.213 -5.476 -1.823 1.00 4.36 O ATOM 0 H GLU A 44 35.032 -10.134 -2.621 1.00 3.26 H new ATOM 0 HA GLU A 44 37.393 -10.434 -0.861 1.00 3.20 H new ATOM 0 HB2 GLU A 44 37.913 -8.984 -2.801 1.00 3.40 H new ATOM 0 HB3 GLU A 44 36.503 -8.000 -2.463 1.00 3.40 H new ATOM 0 HG2 GLU A 44 37.473 -7.330 -0.291 1.00 3.50 H new ATOM 0 HG3 GLU A 44 38.872 -8.342 -0.591 1.00 3.50 H new ATOM 703 N ILE A 45 36.194 -9.513 1.078 1.00 2.90 N ATOM 704 CA ILE A 45 35.461 -9.082 2.259 1.00 2.73 C ATOM 705 C ILE A 45 36.386 -8.390 3.254 1.00 3.01 C ATOM 706 O ILE A 45 37.484 -8.872 3.535 1.00 3.32 O ATOM 707 CB ILE A 45 34.777 -10.271 2.955 1.00 2.75 C ATOM 708 CG1 ILE A 45 33.622 -10.788 2.102 1.00 2.52 C ATOM 709 CG2 ILE A 45 34.283 -9.861 4.338 1.00 2.81 C ATOM 710 CD1 ILE A 45 33.278 -12.240 2.360 1.00 2.72 C ATOM 0 H ILE A 45 37.072 -9.991 1.280 1.00 2.90 H new ATOM 0 HA ILE A 45 34.699 -8.378 1.923 1.00 2.73 H new ATOM 0 HB ILE A 45 35.504 -11.074 3.074 1.00 2.75 H new ATOM 0 HG12 ILE A 45 32.740 -10.176 2.291 1.00 2.52 H new ATOM 0 HG13 ILE A 45 33.876 -10.665 1.049 1.00 2.52 H new ATOM 0 HG21 ILE A 45 33.801 -10.712 4.819 1.00 2.81 H new ATOM 0 HG22 ILE A 45 35.128 -9.532 4.943 1.00 2.81 H new ATOM 0 HG23 ILE A 45 33.567 -9.045 4.241 1.00 2.81 H new ATOM 0 HD11 ILE A 45 32.449 -12.537 1.718 1.00 2.72 H new ATOM 0 HD12 ILE A 45 34.146 -12.863 2.144 1.00 2.72 H new ATOM 0 HD13 ILE A 45 32.992 -12.366 3.404 1.00 2.72 H new ATOM 722 N ASN A 46 35.934 -7.258 3.783 1.00 2.98 N ATOM 723 CA ASN A 46 36.721 -6.498 4.747 1.00 3.34 C ATOM 724 C ASN A 46 35.874 -6.083 5.946 1.00 3.49 C ATOM 725 O ASN A 46 34.716 -5.684 5.796 1.00 3.30 O ATOM 726 CB ASN A 46 37.309 -5.253 4.087 1.00 3.44 C ATOM 727 CG ASN A 46 38.381 -5.575 3.063 1.00 3.89 C ATOM 728 OD1 ASN A 46 38.338 -6.612 2.402 1.00 4.29 O ATOM 729 ND2 ASN A 46 39.351 -4.680 2.925 1.00 4.16 N ATOM 0 H ASN A 46 35.027 -6.847 3.561 1.00 2.98 H new ATOM 0 HA ASN A 46 37.528 -7.142 5.097 1.00 3.34 H new ATOM 0 HB2 ASN A 46 36.509 -4.693 3.603 1.00 3.44 H new ATOM 0 HB3 ASN A 46 37.731 -4.606 4.856 1.00 3.44 H new ATOM 0 HD21 ASN A 46 40.099 -4.839 2.250 1.00 4.16 H new ATOM 0 HD22 ASN A 46 39.348 -3.833 3.494 1.00 4.16 H new ATOM 736 N VAL A 47 36.467 -6.177 7.134 1.00 3.90 N ATOM 737 CA VAL A 47 35.784 -5.802 8.366 1.00 4.21 C ATOM 738 C VAL A 47 36.549 -4.695 9.081 1.00 4.58 C ATOM 739 O VAL A 47 37.766 -4.779 9.253 1.00 4.76 O ATOM 740 CB VAL A 47 35.628 -7.003 9.320 1.00 4.49 C ATOM 741 CG1 VAL A 47 34.742 -6.636 10.501 1.00 4.76 C ATOM 742 CG2 VAL A 47 35.066 -8.204 8.575 1.00 4.27 C ATOM 0 H VAL A 47 37.422 -6.511 7.268 1.00 3.90 H new ATOM 0 HA VAL A 47 34.791 -5.448 8.089 1.00 4.21 H new ATOM 0 HB VAL A 47 36.612 -7.270 9.705 1.00 4.49 H new ATOM 0 HG11 VAL A 47 34.644 -7.496 11.163 1.00 4.76 H new ATOM 0 HG12 VAL A 47 35.190 -5.806 11.048 1.00 4.76 H new ATOM 0 HG13 VAL A 47 33.757 -6.342 10.139 1.00 4.76 H new ATOM 0 HG21 VAL A 47 34.962 -9.043 9.263 1.00 4.27 H new ATOM 0 HG22 VAL A 47 34.090 -7.951 8.161 1.00 4.27 H new ATOM 0 HG23 VAL A 47 35.743 -8.480 7.766 1.00 4.27 H new ATOM 752 N LEU A 48 35.832 -3.660 9.499 1.00 4.75 N ATOM 753 CA LEU A 48 36.446 -2.529 10.187 1.00 5.16 C ATOM 754 C LEU A 48 36.653 -2.828 11.668 1.00 5.98 C ATOM 755 O LEU A 48 36.643 -1.917 12.497 1.00 6.68 O ATOM 756 CB LEU A 48 35.582 -1.274 10.035 1.00 5.21 C ATOM 757 CG LEU A 48 35.328 -0.799 8.599 1.00 4.88 C ATOM 758 CD1 LEU A 48 36.629 -0.705 7.814 1.00 4.66 C ATOM 759 CD2 LEU A 48 34.338 -1.712 7.890 1.00 4.67 C ATOM 0 H LEU A 48 34.823 -3.579 9.374 1.00 4.75 H new ATOM 0 HA LEU A 48 37.419 -2.355 9.728 1.00 5.16 H new ATOM 0 HB2 LEU A 48 34.619 -1.461 10.510 1.00 5.21 H new ATOM 0 HB3 LEU A 48 36.057 -0.462 10.586 1.00 5.21 H new ATOM 0 HG LEU A 48 34.893 0.199 8.652 1.00 4.88 H new ATOM 0 HD11 LEU A 48 36.418 -0.366 6.800 1.00 4.66 H new ATOM 0 HD12 LEU A 48 37.298 0.004 8.302 1.00 4.66 H new ATOM 0 HD13 LEU A 48 37.104 -1.686 7.777 1.00 4.66 H new ATOM 0 HD21 LEU A 48 34.175 -1.353 6.874 1.00 4.67 H new ATOM 0 HD22 LEU A 48 34.737 -2.726 7.857 1.00 4.67 H new ATOM 0 HD23 LEU A 48 33.391 -1.712 8.431 1.00 4.67 H new ATOM 771 N ARG A 49 36.846 -4.098 11.996 1.00 6.10 N ATOM 772 CA ARG A 49 37.050 -4.497 13.381 1.00 6.94 C ATOM 773 C ARG A 49 38.465 -5.018 13.597 1.00 7.60 C ATOM 774 O ARG A 49 38.908 -5.954 12.931 1.00 7.80 O ATOM 775 CB ARG A 49 36.027 -5.558 13.786 1.00 7.01 C ATOM 776 CG ARG A 49 34.586 -5.089 13.675 1.00 6.73 C ATOM 777 CD ARG A 49 34.346 -3.819 14.473 1.00 6.74 C ATOM 778 NE ARG A 49 33.032 -3.817 15.105 1.00 6.98 N ATOM 779 CZ ARG A 49 32.805 -4.281 16.330 1.00 7.61 C ATOM 780 NH1 ARG A 49 33.803 -4.778 17.049 1.00 8.05 N ATOM 781 NH2 ARG A 49 31.580 -4.257 16.837 1.00 8.04 N ATOM 0 H ARG A 49 36.866 -4.866 11.325 1.00 6.10 H new ATOM 0 HA ARG A 49 36.912 -3.617 14.010 1.00 6.94 H new ATOM 0 HB2 ARG A 49 36.163 -6.439 13.159 1.00 7.01 H new ATOM 0 HB3 ARG A 49 36.222 -5.865 14.814 1.00 7.01 H new ATOM 0 HG2 ARG A 49 34.340 -4.913 12.628 1.00 6.73 H new ATOM 0 HG3 ARG A 49 33.919 -5.874 14.031 1.00 6.73 H new ATOM 0 HD2 ARG A 49 35.117 -3.719 15.237 1.00 6.74 H new ATOM 0 HD3 ARG A 49 34.434 -2.954 13.815 1.00 6.74 H new ATOM 0 HE ARG A 49 32.244 -3.439 14.579 1.00 6.98 H new ATOM 0 HH11 ARG A 49 34.746 -4.805 16.662 1.00 8.05 H new ATOM 0 HH12 ARG A 49 33.627 -5.134 17.989 1.00 8.05 H new ATOM 0 HH21 ARG A 49 30.808 -3.882 16.287 1.00 8.04 H new ATOM 0 HH22 ARG A 49 31.410 -4.614 17.777 1.00 8.04 H new ATOM 929 N LYS A 59 32.386 -1.102 15.653 1.00 6.67 N ATOM 930 CA LYS A 59 30.960 -0.812 15.512 1.00 6.51 C ATOM 931 C LYS A 59 30.191 -2.083 15.188 1.00 6.29 C ATOM 932 O LYS A 59 29.303 -2.493 15.937 1.00 6.35 O ATOM 933 CB LYS A 59 30.706 0.225 14.415 1.00 6.45 C ATOM 934 CG LYS A 59 31.950 0.977 13.983 1.00 6.21 C ATOM 935 CD LYS A 59 32.425 0.526 12.613 1.00 6.05 C ATOM 936 CE LYS A 59 33.226 -0.762 12.701 1.00 6.48 C ATOM 937 NZ LYS A 59 34.500 -0.567 13.446 1.00 6.59 N ATOM 0 HA LYS A 59 30.614 -0.405 16.462 1.00 6.51 H new ATOM 0 HB2 LYS A 59 30.276 -0.276 13.548 1.00 6.45 H new ATOM 0 HB3 LYS A 59 29.965 0.941 14.770 1.00 6.45 H new ATOM 0 HG2 LYS A 59 31.741 2.047 13.963 1.00 6.21 H new ATOM 0 HG3 LYS A 59 32.743 0.821 14.714 1.00 6.21 H new ATOM 0 HD2 LYS A 59 31.566 0.378 11.959 1.00 6.05 H new ATOM 0 HD3 LYS A 59 33.038 1.307 12.163 1.00 6.05 H new ATOM 0 HE2 LYS A 59 32.629 -1.529 13.195 1.00 6.48 H new ATOM 0 HE3 LYS A 59 33.443 -1.125 11.696 1.00 6.48 H new ATOM 0 HZ1 LYS A 59 35.218 -1.227 13.085 1.00 6.59 H new ATOM 0 HZ2 LYS A 59 34.832 0.410 13.317 1.00 6.59 H new ATOM 0 HZ3 LYS A 59 34.342 -0.748 14.458 1.00 6.59 H new ATOM 951 N GLY A 60 30.538 -2.701 14.064 1.00 6.22 N ATOM 952 CA GLY A 60 29.878 -3.923 13.664 1.00 6.09 C ATOM 953 C GLY A 60 29.390 -3.887 12.228 1.00 5.44 C ATOM 954 O GLY A 60 28.323 -4.429 11.920 1.00 5.15 O ATOM 0 H GLY A 60 31.264 -2.375 13.426 1.00 6.22 H new ATOM 0 HA2 GLY A 60 30.566 -4.759 13.788 1.00 6.09 H new ATOM 0 HA3 GLY A 60 29.031 -4.106 14.326 1.00 6.09 H new ATOM 958 N CYS A 61 30.175 -3.258 11.352 1.00 5.25 N ATOM 959 CA CYS A 61 29.818 -3.148 9.940 1.00 4.69 C ATOM 960 C CYS A 61 30.937 -3.672 9.039 1.00 4.28 C ATOM 961 O CYS A 61 32.120 -3.507 9.336 1.00 4.52 O ATOM 962 CB CYS A 61 29.504 -1.695 9.584 1.00 4.94 C ATOM 963 SG CYS A 61 30.935 -0.593 9.653 1.00 5.62 S ATOM 0 H CYS A 61 31.062 -2.818 11.597 1.00 5.25 H new ATOM 0 HA CYS A 61 28.932 -3.760 9.774 1.00 4.69 H new ATOM 0 HB2 CYS A 61 29.081 -1.661 8.580 1.00 4.94 H new ATOM 0 HB3 CYS A 61 28.739 -1.322 10.265 1.00 4.94 H new ATOM 0 HG CYS A 61 30.570 0.613 9.334 1.00 5.62 H new ATOM 969 N CYS A 62 30.545 -4.304 7.935 1.00 3.72 N ATOM 970 CA CYS A 62 31.501 -4.868 6.976 1.00 3.34 C ATOM 971 C CYS A 62 30.960 -4.763 5.554 1.00 2.85 C ATOM 972 O CYS A 62 29.747 -4.769 5.347 1.00 2.73 O ATOM 973 CB CYS A 62 31.825 -6.329 7.297 1.00 3.28 C ATOM 974 SG CYS A 62 30.568 -7.508 6.750 1.00 2.98 S ATOM 0 H CYS A 62 29.567 -4.440 7.679 1.00 3.72 H new ATOM 0 HA CYS A 62 32.420 -4.288 7.056 1.00 3.34 H new ATOM 0 HB2 CYS A 62 32.776 -6.588 6.832 1.00 3.28 H new ATOM 0 HB3 CYS A 62 31.958 -6.431 8.374 1.00 3.28 H new ATOM 0 HG CYS A 62 31.135 -8.467 6.080 1.00 2.98 H new ATOM 980 N PHE A 63 31.856 -4.671 4.577 1.00 2.68 N ATOM 981 CA PHE A 63 31.436 -4.566 3.185 1.00 2.38 C ATOM 982 C PHE A 63 31.987 -5.737 2.384 1.00 2.10 C ATOM 983 O PHE A 63 33.136 -6.143 2.557 1.00 2.27 O ATOM 984 CB PHE A 63 31.861 -3.227 2.571 1.00 2.72 C ATOM 985 CG PHE A 63 33.334 -2.942 2.647 1.00 3.01 C ATOM 986 CD1 PHE A 63 33.910 -2.527 3.837 1.00 3.36 C ATOM 987 CD2 PHE A 63 34.145 -3.106 1.535 1.00 3.06 C ATOM 988 CE1 PHE A 63 35.267 -2.280 3.917 1.00 3.65 C ATOM 989 CE2 PHE A 63 35.504 -2.861 1.610 1.00 3.39 C ATOM 990 CZ PHE A 63 36.053 -2.379 2.773 1.00 3.65 C ATOM 0 H PHE A 63 32.866 -4.667 4.721 1.00 2.68 H new ATOM 0 HA PHE A 63 30.347 -4.604 3.152 1.00 2.38 H new ATOM 0 HB2 PHE A 63 31.555 -3.209 1.525 1.00 2.72 H new ATOM 0 HB3 PHE A 63 31.323 -2.424 3.075 1.00 2.72 H new ATOM 0 HD1 PHE A 63 33.291 -2.395 4.712 1.00 3.36 H new ATOM 0 HD2 PHE A 63 33.711 -3.429 0.600 1.00 3.06 H new ATOM 0 HE1 PHE A 63 35.715 -2.012 4.862 1.00 3.65 H new ATOM 0 HE2 PHE A 63 36.134 -3.049 0.753 1.00 3.39 H new ATOM 0 HZ PHE A 63 37.090 -2.078 2.800 1.00 3.65 H new ATOM 1000 N VAL A 64 31.146 -6.271 1.504 1.00 1.83 N ATOM 1001 CA VAL A 64 31.491 -7.439 0.709 1.00 1.80 C ATOM 1002 C VAL A 64 31.355 -7.199 -0.790 1.00 1.98 C ATOM 1003 O VAL A 64 30.497 -6.444 -1.239 1.00 2.06 O ATOM 1004 CB VAL A 64 30.578 -8.616 1.093 1.00 1.69 C ATOM 1005 CG1 VAL A 64 30.935 -9.863 0.306 1.00 1.96 C ATOM 1006 CG2 VAL A 64 30.640 -8.877 2.590 1.00 2.19 C ATOM 0 H VAL A 64 30.211 -5.906 1.324 1.00 1.83 H new ATOM 0 HA VAL A 64 32.537 -7.661 0.922 1.00 1.80 H new ATOM 0 HB VAL A 64 29.553 -8.347 0.838 1.00 1.69 H new ATOM 0 HG11 VAL A 64 30.274 -10.679 0.598 1.00 1.96 H new ATOM 0 HG12 VAL A 64 30.820 -9.666 -0.760 1.00 1.96 H new ATOM 0 HG13 VAL A 64 31.968 -10.141 0.514 1.00 1.96 H new ATOM 0 HG21 VAL A 64 29.987 -9.713 2.841 1.00 2.19 H new ATOM 0 HG22 VAL A 64 31.664 -9.118 2.875 1.00 2.19 H new ATOM 0 HG23 VAL A 64 30.313 -7.987 3.128 1.00 2.19 H new ATOM 1016 N THR A 65 32.222 -7.855 -1.555 1.00 2.26 N ATOM 1017 CA THR A 65 32.197 -7.758 -3.006 1.00 2.63 C ATOM 1018 C THR A 65 32.063 -9.154 -3.608 1.00 2.83 C ATOM 1019 O THR A 65 32.786 -10.074 -3.222 1.00 2.93 O ATOM 1020 CB THR A 65 33.471 -7.084 -3.552 1.00 3.06 C ATOM 1021 OG1 THR A 65 33.625 -5.784 -2.970 1.00 3.07 O ATOM 1022 CG2 THR A 65 33.413 -6.960 -5.066 1.00 3.50 C ATOM 0 H THR A 65 32.954 -8.463 -1.189 1.00 2.26 H new ATOM 0 HA THR A 65 31.342 -7.143 -3.287 1.00 2.63 H new ATOM 0 HB THR A 65 34.325 -7.706 -3.286 1.00 3.06 H new ATOM 0 HG1 THR A 65 34.438 -5.363 -3.320 1.00 3.07 H new ATOM 0 HG21 THR A 65 34.323 -6.481 -5.427 1.00 3.50 H new ATOM 0 HG22 THR A 65 33.324 -7.952 -5.509 1.00 3.50 H new ATOM 0 HG23 THR A 65 32.550 -6.358 -5.349 1.00 3.50 H new ATOM 1030 N PHE A 66 31.144 -9.305 -4.559 1.00 3.01 N ATOM 1031 CA PHE A 66 30.906 -10.602 -5.189 1.00 3.31 C ATOM 1032 C PHE A 66 31.574 -10.711 -6.553 1.00 3.79 C ATOM 1033 O PHE A 66 32.209 -9.771 -7.031 1.00 3.94 O ATOM 1034 CB PHE A 66 29.405 -10.854 -5.330 1.00 3.27 C ATOM 1035 CG PHE A 66 28.769 -11.418 -4.089 1.00 3.23 C ATOM 1036 CD1 PHE A 66 28.723 -10.678 -2.920 1.00 3.49 C ATOM 1037 CD2 PHE A 66 28.220 -12.690 -4.096 1.00 3.34 C ATOM 1038 CE1 PHE A 66 28.140 -11.197 -1.779 1.00 3.79 C ATOM 1039 CE2 PHE A 66 27.636 -13.214 -2.959 1.00 3.52 C ATOM 1040 CZ PHE A 66 27.596 -12.466 -1.800 1.00 3.72 C ATOM 0 H PHE A 66 30.555 -8.550 -4.909 1.00 3.01 H new ATOM 0 HA PHE A 66 31.348 -11.359 -4.541 1.00 3.31 H new ATOM 0 HB2 PHE A 66 28.911 -9.917 -5.588 1.00 3.27 H new ATOM 0 HB3 PHE A 66 29.237 -11.542 -6.159 1.00 3.27 H new ATOM 0 HD1 PHE A 66 29.147 -9.685 -2.899 1.00 3.49 H new ATOM 0 HD2 PHE A 66 28.249 -13.279 -5.001 1.00 3.34 H new ATOM 0 HE1 PHE A 66 28.110 -10.611 -0.872 1.00 3.79 H new ATOM 0 HE2 PHE A 66 27.212 -14.207 -2.977 1.00 3.52 H new ATOM 0 HZ PHE A 66 27.139 -12.873 -0.910 1.00 3.72 H new ATOM 1050 N TYR A 67 31.417 -11.880 -7.170 1.00 4.15 N ATOM 1051 CA TYR A 67 31.996 -12.152 -8.480 1.00 4.67 C ATOM 1052 C TYR A 67 30.908 -12.546 -9.478 1.00 4.93 C ATOM 1053 O TYR A 67 31.110 -12.484 -10.692 1.00 5.34 O ATOM 1054 CB TYR A 67 33.043 -13.266 -8.366 1.00 5.09 C ATOM 1055 CG TYR A 67 33.615 -13.716 -9.693 1.00 5.42 C ATOM 1056 CD1 TYR A 67 34.594 -12.967 -10.335 1.00 5.82 C ATOM 1057 CD2 TYR A 67 33.177 -14.885 -10.304 1.00 5.58 C ATOM 1058 CE1 TYR A 67 35.120 -13.372 -11.547 1.00 6.28 C ATOM 1059 CE2 TYR A 67 33.698 -15.295 -11.516 1.00 6.07 C ATOM 1060 CZ TYR A 67 34.668 -14.551 -12.129 1.00 6.38 C ATOM 1061 OH TYR A 67 35.188 -14.940 -13.342 1.00 6.97 O ATOM 0 H TYR A 67 30.888 -12.659 -6.778 1.00 4.15 H new ATOM 0 HA TYR A 67 32.480 -11.246 -8.843 1.00 4.67 H new ATOM 0 HB2 TYR A 67 33.858 -12.920 -7.730 1.00 5.09 H new ATOM 0 HB3 TYR A 67 32.592 -14.124 -7.868 1.00 5.09 H new ATOM 0 HD1 TYR A 67 34.949 -12.054 -9.880 1.00 5.82 H new ATOM 0 HD2 TYR A 67 32.417 -15.483 -9.823 1.00 5.58 H new ATOM 0 HE1 TYR A 67 35.876 -12.777 -12.038 1.00 6.28 H new ATOM 0 HE2 TYR A 67 33.340 -16.202 -11.979 1.00 6.07 H new ATOM 0 HH TYR A 67 34.775 -15.784 -13.620 1.00 6.97 H new ATOM 1071 N THR A 68 29.753 -12.944 -8.955 1.00 4.78 N ATOM 1072 CA THR A 68 28.628 -13.345 -9.787 1.00 5.09 C ATOM 1073 C THR A 68 27.423 -12.458 -9.514 1.00 4.71 C ATOM 1074 O THR A 68 26.615 -12.741 -8.630 1.00 4.43 O ATOM 1075 CB THR A 68 28.244 -14.818 -9.544 1.00 5.46 C ATOM 1076 OG1 THR A 68 28.076 -15.058 -8.143 1.00 5.14 O ATOM 1077 CG2 THR A 68 29.306 -15.754 -10.102 1.00 6.11 C ATOM 0 H THR A 68 29.573 -12.997 -7.952 1.00 4.78 H new ATOM 0 HA THR A 68 28.935 -13.234 -10.827 1.00 5.09 H new ATOM 0 HB THR A 68 27.304 -15.014 -10.059 1.00 5.46 H new ATOM 0 HG1 THR A 68 27.831 -15.996 -7.999 1.00 5.14 H new ATOM 0 HG21 THR A 68 29.013 -16.788 -9.918 1.00 6.11 H new ATOM 0 HG22 THR A 68 29.408 -15.591 -11.175 1.00 6.11 H new ATOM 0 HG23 THR A 68 30.260 -15.555 -9.613 1.00 6.11 H new ATOM 1085 N ARG A 69 27.311 -11.378 -10.281 1.00 4.80 N ATOM 1086 CA ARG A 69 26.213 -10.434 -10.123 1.00 4.60 C ATOM 1087 C ARG A 69 24.868 -11.142 -10.212 1.00 4.68 C ATOM 1088 O ARG A 69 23.922 -10.783 -9.509 1.00 4.42 O ATOM 1089 CB ARG A 69 26.302 -9.318 -11.174 1.00 4.95 C ATOM 1090 CG ARG A 69 26.013 -9.768 -12.601 1.00 5.58 C ATOM 1091 CD ARG A 69 27.087 -10.707 -13.133 1.00 5.81 C ATOM 1092 NE ARG A 69 28.427 -10.304 -12.716 1.00 5.91 N ATOM 1093 CZ ARG A 69 29.307 -9.715 -13.522 1.00 6.49 C ATOM 1094 NH1 ARG A 69 28.989 -9.458 -14.784 1.00 7.00 N ATOM 1095 NH2 ARG A 69 30.508 -9.385 -13.066 1.00 6.63 N ATOM 0 H ARG A 69 27.970 -11.135 -11.020 1.00 4.80 H new ATOM 0 HA ARG A 69 26.296 -9.985 -9.133 1.00 4.60 H new ATOM 0 HB2 ARG A 69 25.600 -8.528 -10.907 1.00 4.95 H new ATOM 0 HB3 ARG A 69 27.301 -8.883 -11.139 1.00 4.95 H new ATOM 0 HG2 ARG A 69 25.045 -10.269 -12.634 1.00 5.58 H new ATOM 0 HG3 ARG A 69 25.942 -8.894 -13.249 1.00 5.58 H new ATOM 0 HD2 ARG A 69 26.888 -11.720 -12.782 1.00 5.81 H new ATOM 0 HD3 ARG A 69 27.039 -10.732 -14.222 1.00 5.81 H new ATOM 0 HE ARG A 69 28.705 -10.484 -11.751 1.00 5.91 H new ATOM 0 HH11 ARG A 69 28.067 -9.712 -15.140 1.00 7.00 H new ATOM 0 HH12 ARG A 69 29.666 -9.006 -15.399 1.00 7.00 H new ATOM 0 HH21 ARG A 69 30.758 -9.583 -12.097 1.00 6.63 H new ATOM 0 HH22 ARG A 69 31.182 -8.934 -13.684 1.00 6.63 H new ATOM 1109 N LYS A 70 24.789 -12.155 -11.066 1.00 5.09 N ATOM 1110 CA LYS A 70 23.553 -12.910 -11.231 1.00 5.26 C ATOM 1111 C LYS A 70 23.136 -13.508 -9.895 1.00 4.89 C ATOM 1112 O LYS A 70 21.961 -13.493 -9.530 1.00 4.81 O ATOM 1113 CB LYS A 70 23.728 -14.015 -12.278 1.00 5.77 C ATOM 1114 CG LYS A 70 22.496 -14.892 -12.445 1.00 5.89 C ATOM 1115 CD LYS A 70 22.647 -15.856 -13.612 1.00 6.19 C ATOM 1116 CE LYS A 70 22.641 -15.123 -14.944 1.00 6.65 C ATOM 1117 NZ LYS A 70 22.702 -16.064 -16.098 1.00 6.82 N ATOM 0 H LYS A 70 25.561 -12.472 -11.652 1.00 5.09 H new ATOM 0 HA LYS A 70 22.773 -12.234 -11.580 1.00 5.26 H new ATOM 0 HB2 LYS A 70 23.973 -13.560 -13.238 1.00 5.77 H new ATOM 0 HB3 LYS A 70 24.575 -14.641 -11.996 1.00 5.77 H new ATOM 0 HG2 LYS A 70 22.323 -15.455 -11.528 1.00 5.89 H new ATOM 0 HG3 LYS A 70 21.620 -14.263 -12.603 1.00 5.89 H new ATOM 0 HD2 LYS A 70 23.578 -16.414 -13.507 1.00 6.19 H new ATOM 0 HD3 LYS A 70 21.835 -16.583 -13.592 1.00 6.19 H new ATOM 0 HE2 LYS A 70 21.740 -14.515 -15.019 1.00 6.65 H new ATOM 0 HE3 LYS A 70 23.490 -14.441 -14.987 1.00 6.65 H new ATOM 0 HZ1 LYS A 70 22.696 -15.524 -16.987 1.00 6.82 H new ATOM 0 HZ2 LYS A 70 23.574 -16.627 -16.041 1.00 6.82 H new ATOM 0 HZ3 LYS A 70 21.878 -16.698 -16.073 1.00 6.82 H new ATOM 1131 N ALA A 71 24.118 -14.026 -9.168 1.00 4.71 N ATOM 1132 CA ALA A 71 23.873 -14.617 -7.863 1.00 4.41 C ATOM 1133 C ALA A 71 23.394 -13.557 -6.880 1.00 3.94 C ATOM 1134 O ALA A 71 22.551 -13.824 -6.021 1.00 3.77 O ATOM 1135 CB ALA A 71 25.139 -15.281 -7.346 1.00 4.40 C ATOM 0 H ALA A 71 25.094 -14.048 -9.463 1.00 4.71 H new ATOM 0 HA ALA A 71 23.094 -15.373 -7.962 1.00 4.41 H new ATOM 0 HB1 ALA A 71 24.946 -15.721 -6.368 1.00 4.40 H new ATOM 0 HB2 ALA A 71 25.450 -16.062 -8.040 1.00 4.40 H new ATOM 0 HB3 ALA A 71 25.931 -14.537 -7.259 1.00 4.40 H new ATOM 1141 N ALA A 72 23.926 -12.347 -7.026 1.00 3.78 N ATOM 1142 CA ALA A 72 23.563 -11.242 -6.150 1.00 3.40 C ATOM 1143 C ALA A 72 22.068 -10.961 -6.224 1.00 3.51 C ATOM 1144 O ALA A 72 21.467 -10.497 -5.254 1.00 3.28 O ATOM 1145 CB ALA A 72 24.357 -9.996 -6.509 1.00 3.39 C ATOM 0 H ALA A 72 24.610 -12.109 -7.744 1.00 3.78 H new ATOM 0 HA ALA A 72 23.806 -11.525 -5.126 1.00 3.40 H new ATOM 0 HB1 ALA A 72 24.073 -9.180 -5.845 1.00 3.39 H new ATOM 0 HB2 ALA A 72 25.422 -10.199 -6.400 1.00 3.39 H new ATOM 0 HB3 ALA A 72 24.145 -9.714 -7.541 1.00 3.39 H new ATOM 1151 N LEU A 73 21.470 -11.258 -7.376 1.00 3.95 N ATOM 1152 CA LEU A 73 20.045 -11.033 -7.574 1.00 4.16 C ATOM 1153 C LEU A 73 19.239 -11.729 -6.483 1.00 4.02 C ATOM 1154 O LEU A 73 18.324 -11.143 -5.904 1.00 3.99 O ATOM 1155 CB LEU A 73 19.612 -11.546 -8.952 1.00 4.66 C ATOM 1156 CG LEU A 73 20.396 -10.972 -10.135 1.00 4.93 C ATOM 1157 CD1 LEU A 73 20.008 -11.680 -11.425 1.00 5.43 C ATOM 1158 CD2 LEU A 73 20.160 -9.474 -10.257 1.00 4.92 C ATOM 0 H LEU A 73 21.951 -11.654 -8.183 1.00 3.95 H new ATOM 0 HA LEU A 73 19.855 -9.961 -7.520 1.00 4.16 H new ATOM 0 HB2 LEU A 73 19.708 -12.632 -8.965 1.00 4.66 H new ATOM 0 HB3 LEU A 73 18.555 -11.318 -9.092 1.00 4.66 H new ATOM 0 HG LEU A 73 21.458 -11.138 -9.956 1.00 4.93 H new ATOM 0 HD11 LEU A 73 20.575 -11.259 -12.256 1.00 5.43 H new ATOM 0 HD12 LEU A 73 20.229 -12.744 -11.337 1.00 5.43 H new ATOM 0 HD13 LEU A 73 18.942 -11.545 -11.608 1.00 5.43 H new ATOM 0 HD21 LEU A 73 20.726 -9.084 -11.103 1.00 4.92 H new ATOM 0 HD22 LEU A 73 19.098 -9.284 -10.412 1.00 4.92 H new ATOM 0 HD23 LEU A 73 20.487 -8.978 -9.343 1.00 4.92 H new ATOM 1170 N GLU A 74 19.599 -12.975 -6.199 1.00 4.00 N ATOM 1171 CA GLU A 74 18.912 -13.754 -5.176 1.00 3.94 C ATOM 1172 C GLU A 74 19.033 -13.082 -3.814 1.00 3.55 C ATOM 1173 O GLU A 74 18.081 -13.069 -3.032 1.00 3.57 O ATOM 1174 CB GLU A 74 19.489 -15.170 -5.110 1.00 4.07 C ATOM 1175 CG GLU A 74 19.987 -15.683 -6.451 1.00 4.42 C ATOM 1176 CD GLU A 74 20.048 -17.197 -6.512 1.00 4.73 C ATOM 1177 OE1 GLU A 74 21.043 -17.772 -6.021 1.00 4.77 O ATOM 1178 OE2 GLU A 74 19.102 -17.807 -7.053 1.00 4.99 O ATOM 0 H GLU A 74 20.363 -13.467 -6.663 1.00 4.00 H new ATOM 0 HA GLU A 74 17.857 -13.811 -5.444 1.00 3.94 H new ATOM 0 HB2 GLU A 74 20.312 -15.186 -4.395 1.00 4.07 H new ATOM 0 HB3 GLU A 74 18.725 -15.848 -4.731 1.00 4.07 H new ATOM 0 HG2 GLU A 74 19.331 -15.318 -7.241 1.00 4.42 H new ATOM 0 HG3 GLU A 74 20.979 -15.275 -6.646 1.00 4.42 H new ATOM 1185 N ALA A 75 20.205 -12.511 -3.543 1.00 3.24 N ATOM 1186 CA ALA A 75 20.450 -11.844 -2.276 1.00 2.89 C ATOM 1187 C ALA A 75 19.431 -10.741 -2.047 1.00 2.95 C ATOM 1188 O ALA A 75 18.993 -10.516 -0.922 1.00 2.87 O ATOM 1189 CB ALA A 75 21.862 -11.282 -2.238 1.00 2.61 C ATOM 0 H ALA A 75 20.996 -12.499 -4.186 1.00 3.24 H new ATOM 0 HA ALA A 75 20.347 -12.576 -1.475 1.00 2.89 H new ATOM 0 HB1 ALA A 75 22.030 -10.785 -1.282 1.00 2.61 H new ATOM 0 HB2 ALA A 75 22.580 -12.094 -2.357 1.00 2.61 H new ATOM 0 HB3 ALA A 75 21.990 -10.564 -3.048 1.00 2.61 H new ATOM 1195 N GLN A 76 19.041 -10.066 -3.122 1.00 3.20 N ATOM 1196 CA GLN A 76 18.072 -8.985 -3.028 1.00 3.38 C ATOM 1197 C GLN A 76 16.790 -9.474 -2.364 1.00 3.55 C ATOM 1198 O GLN A 76 16.253 -8.821 -1.474 1.00 3.58 O ATOM 1199 CB GLN A 76 17.762 -8.425 -4.418 1.00 3.75 C ATOM 1200 CG GLN A 76 19.000 -8.039 -5.209 1.00 3.74 C ATOM 1201 CD GLN A 76 19.878 -7.041 -4.476 1.00 3.45 C ATOM 1202 OE1 GLN A 76 19.707 -5.830 -4.612 1.00 3.63 O ATOM 1203 NE2 GLN A 76 20.825 -7.548 -3.695 1.00 3.07 N ATOM 0 H GLN A 76 19.381 -10.249 -4.066 1.00 3.20 H new ATOM 0 HA GLN A 76 18.501 -8.191 -2.417 1.00 3.38 H new ATOM 0 HB2 GLN A 76 17.198 -9.168 -4.982 1.00 3.75 H new ATOM 0 HB3 GLN A 76 17.121 -7.550 -4.313 1.00 3.75 H new ATOM 0 HG2 GLN A 76 19.581 -8.935 -5.427 1.00 3.74 H new ATOM 0 HG3 GLN A 76 18.697 -7.615 -6.166 1.00 3.74 H new ATOM 0 HE21 GLN A 76 20.931 -8.559 -3.612 1.00 3.07 H new ATOM 0 HE22 GLN A 76 21.447 -6.926 -3.178 1.00 3.07 H new ATOM 1212 N ASN A 77 16.322 -10.641 -2.786 1.00 3.74 N ATOM 1213 CA ASN A 77 15.102 -11.214 -2.239 1.00 3.96 C ATOM 1214 C ASN A 77 15.265 -11.541 -0.757 1.00 3.80 C ATOM 1215 O ASN A 77 14.303 -11.493 0.008 1.00 3.98 O ATOM 1216 CB ASN A 77 14.736 -12.477 -3.019 1.00 4.24 C ATOM 1217 CG ASN A 77 14.107 -12.167 -4.365 1.00 4.49 C ATOM 1218 OD1 ASN A 77 13.269 -12.923 -4.859 1.00 4.84 O ATOM 1219 ND2 ASN A 77 14.511 -11.056 -4.971 1.00 4.70 N ATOM 0 H ASN A 77 16.770 -11.209 -3.506 1.00 3.74 H new ATOM 0 HA ASN A 77 14.301 -10.481 -2.335 1.00 3.96 H new ATOM 0 HB2 ASN A 77 15.632 -13.079 -3.170 1.00 4.24 H new ATOM 0 HB3 ASN A 77 14.044 -13.077 -2.428 1.00 4.24 H new ATOM 0 HD21 ASN A 77 14.125 -10.802 -5.880 1.00 4.70 H new ATOM 0 HD22 ASN A 77 15.207 -10.457 -4.527 1.00 4.70 H new ATOM 1226 N ALA A 78 16.490 -11.873 -0.364 1.00 3.52 N ATOM 1227 CA ALA A 78 16.787 -12.222 1.019 1.00 3.42 C ATOM 1228 C ALA A 78 16.855 -11.000 1.939 1.00 3.30 C ATOM 1229 O ALA A 78 16.645 -11.123 3.142 1.00 3.41 O ATOM 1230 CB ALA A 78 18.089 -13.003 1.087 1.00 3.23 C ATOM 0 H ALA A 78 17.296 -11.908 -0.988 1.00 3.52 H new ATOM 0 HA ALA A 78 15.964 -12.840 1.377 1.00 3.42 H new ATOM 0 HB1 ALA A 78 18.305 -13.261 2.124 1.00 3.23 H new ATOM 0 HB2 ALA A 78 17.997 -13.915 0.498 1.00 3.23 H new ATOM 0 HB3 ALA A 78 18.900 -12.394 0.688 1.00 3.23 H new ATOM 1236 N LEU A 79 17.157 -9.825 1.383 1.00 3.16 N ATOM 1237 CA LEU A 79 17.262 -8.607 2.189 1.00 3.14 C ATOM 1238 C LEU A 79 16.363 -7.492 1.676 1.00 3.35 C ATOM 1239 O LEU A 79 15.562 -6.938 2.430 1.00 3.66 O ATOM 1240 CB LEU A 79 18.707 -8.109 2.213 1.00 2.85 C ATOM 1241 CG LEU A 79 19.717 -8.992 1.489 1.00 2.57 C ATOM 1242 CD1 LEU A 79 20.564 -8.154 0.545 1.00 2.41 C ATOM 1243 CD2 LEU A 79 20.592 -9.722 2.493 1.00 2.50 C ATOM 0 H LEU A 79 17.332 -9.691 0.387 1.00 3.16 H new ATOM 0 HA LEU A 79 16.936 -8.869 3.195 1.00 3.14 H new ATOM 0 HB2 LEU A 79 18.737 -7.114 1.770 1.00 2.85 H new ATOM 0 HB3 LEU A 79 19.020 -8.005 3.252 1.00 2.85 H new ATOM 0 HG LEU A 79 19.179 -9.735 0.900 1.00 2.57 H new ATOM 0 HD11 LEU A 79 21.282 -8.795 0.034 1.00 2.41 H new ATOM 0 HD12 LEU A 79 19.920 -7.672 -0.190 1.00 2.41 H new ATOM 0 HD13 LEU A 79 21.098 -7.393 1.114 1.00 2.41 H new ATOM 0 HD21 LEU A 79 21.309 -10.349 1.963 1.00 2.50 H new ATOM 0 HD22 LEU A 79 21.128 -8.996 3.104 1.00 2.50 H new ATOM 0 HD23 LEU A 79 19.968 -10.346 3.133 1.00 2.50 H new ATOM 1255 N HIS A 80 16.528 -7.159 0.398 1.00 3.27 N ATOM 1256 CA HIS A 80 15.779 -6.083 -0.248 1.00 3.53 C ATOM 1257 C HIS A 80 16.512 -4.804 0.081 1.00 3.49 C ATOM 1258 O HIS A 80 17.598 -4.572 -0.453 1.00 3.37 O ATOM 1259 CB HIS A 80 14.314 -6.031 0.209 1.00 3.94 C ATOM 1260 CG HIS A 80 13.459 -5.110 -0.607 1.00 4.25 C ATOM 1261 ND1 HIS A 80 12.530 -4.255 -0.051 1.00 4.68 N ATOM 1262 CD2 HIS A 80 13.390 -4.917 -1.948 1.00 4.44 C ATOM 1263 CE1 HIS A 80 11.925 -3.579 -1.012 1.00 4.89 C ATOM 1264 NE2 HIS A 80 12.429 -3.961 -2.169 1.00 4.71 N ATOM 0 H HIS A 80 17.188 -7.630 -0.222 1.00 3.27 H new ATOM 0 HA HIS A 80 15.730 -6.245 -1.325 1.00 3.53 H new ATOM 0 HB2 HIS A 80 13.894 -7.036 0.166 1.00 3.94 H new ATOM 0 HB3 HIS A 80 14.279 -5.716 1.252 1.00 3.94 H new ATOM 0 HD1 HIS A 80 12.340 -4.159 0.947 1.00 4.68 H new ATOM 0 HD2 HIS A 80 13.980 -5.420 -2.700 1.00 4.44 H new ATOM 0 HE1 HIS A 80 11.150 -2.840 -0.873 1.00 4.89 H new ATOM 1273 N ASN A 81 15.958 -3.958 0.937 1.00 3.77 N ATOM 1274 CA ASN A 81 16.709 -2.787 1.322 1.00 3.89 C ATOM 1275 C ASN A 81 17.712 -3.233 2.361 1.00 3.88 C ATOM 1276 O ASN A 81 18.898 -2.954 2.246 1.00 4.01 O ATOM 1277 CB ASN A 81 15.800 -1.690 1.870 1.00 4.31 C ATOM 1278 CG ASN A 81 14.405 -2.195 2.178 1.00 4.75 C ATOM 1279 OD1 ASN A 81 13.517 -2.156 1.328 1.00 4.86 O ATOM 1280 ND2 ASN A 81 14.203 -2.672 3.402 1.00 5.40 N ATOM 0 H ASN A 81 15.034 -4.056 1.358 1.00 3.77 H new ATOM 0 HA ASN A 81 17.211 -2.356 0.456 1.00 3.89 H new ATOM 0 HB2 ASN A 81 16.241 -1.275 2.776 1.00 4.31 H new ATOM 0 HB3 ASN A 81 15.738 -0.878 1.145 1.00 4.31 H new ATOM 0 HD21 ASN A 81 13.283 -3.024 3.667 1.00 5.40 H new ATOM 0 HD22 ASN A 81 14.968 -2.686 4.077 1.00 5.40 H new ATOM 1287 N MET A 82 17.219 -3.937 3.379 1.00 3.89 N ATOM 1288 CA MET A 82 18.088 -4.522 4.387 1.00 4.02 C ATOM 1289 C MET A 82 17.388 -5.674 5.115 1.00 3.90 C ATOM 1290 O MET A 82 16.438 -5.440 5.861 1.00 4.17 O ATOM 1291 CB MET A 82 18.496 -3.451 5.396 1.00 4.60 C ATOM 1292 CG MET A 82 17.310 -2.775 6.056 1.00 4.89 C ATOM 1293 SD MET A 82 17.781 -1.704 7.428 1.00 5.67 S ATOM 1294 CE MET A 82 18.537 -0.338 6.549 1.00 5.71 C ATOM 0 H MET A 82 16.225 -4.113 3.523 1.00 3.89 H new ATOM 0 HA MET A 82 18.973 -4.918 3.889 1.00 4.02 H new ATOM 0 HB2 MET A 82 19.123 -3.904 6.164 1.00 4.60 H new ATOM 0 HB3 MET A 82 19.102 -2.698 4.893 1.00 4.60 H new ATOM 0 HG2 MET A 82 16.774 -2.187 5.311 1.00 4.89 H new ATOM 0 HG3 MET A 82 16.620 -3.537 6.418 1.00 4.89 H new ATOM 0 HE1 MET A 82 19.051 0.311 7.258 1.00 5.71 H new ATOM 0 HE2 MET A 82 19.254 -0.724 5.825 1.00 5.71 H new ATOM 0 HE3 MET A 82 17.766 0.231 6.029 1.00 5.71 H new ATOM 1304 N LYS A 83 17.811 -6.912 4.911 1.00 3.68 N ATOM 1305 CA LYS A 83 17.227 -7.997 5.698 1.00 3.64 C ATOM 1306 C LYS A 83 18.079 -9.258 5.753 1.00 3.70 C ATOM 1307 O LYS A 83 18.350 -9.893 4.735 1.00 3.74 O ATOM 1308 CB LYS A 83 15.803 -8.342 5.254 1.00 3.51 C ATOM 1309 CG LYS A 83 15.102 -9.313 6.196 1.00 3.75 C ATOM 1310 CD LYS A 83 15.486 -10.756 5.914 1.00 3.35 C ATOM 1311 CE LYS A 83 14.445 -11.725 6.452 1.00 3.68 C ATOM 1312 NZ LYS A 83 13.098 -11.476 5.867 1.00 4.16 N ATOM 0 H LYS A 83 18.526 -7.188 4.238 1.00 3.68 H new ATOM 0 HA LYS A 83 17.190 -7.599 6.712 1.00 3.64 H new ATOM 0 HB2 LYS A 83 15.218 -7.425 5.186 1.00 3.51 H new ATOM 0 HB3 LYS A 83 15.835 -8.775 4.254 1.00 3.51 H new ATOM 0 HG2 LYS A 83 15.355 -9.065 7.227 1.00 3.75 H new ATOM 0 HG3 LYS A 83 14.023 -9.199 6.097 1.00 3.75 H new ATOM 0 HD2 LYS A 83 15.598 -10.900 4.839 1.00 3.35 H new ATOM 0 HD3 LYS A 83 16.454 -10.971 6.367 1.00 3.35 H new ATOM 0 HE2 LYS A 83 14.753 -12.747 6.232 1.00 3.68 H new ATOM 0 HE3 LYS A 83 14.392 -11.635 7.537 1.00 3.68 H new ATOM 0 HZ1 LYS A 83 12.696 -12.373 5.527 1.00 4.16 H new ATOM 0 HZ2 LYS A 83 12.474 -11.070 6.593 1.00 4.16 H new ATOM 0 HZ3 LYS A 83 13.182 -10.811 5.072 1.00 4.16 H new ATOM 1326 N VAL A 84 18.491 -9.603 6.955 1.00 4.00 N ATOM 1327 CA VAL A 84 19.190 -10.849 7.220 1.00 4.21 C ATOM 1328 C VAL A 84 18.946 -11.187 8.665 1.00 4.29 C ATOM 1329 O VAL A 84 19.253 -10.385 9.539 1.00 4.68 O ATOM 1330 CB VAL A 84 20.690 -10.767 6.963 1.00 4.91 C ATOM 1331 CG1 VAL A 84 21.287 -9.646 7.779 1.00 5.39 C ATOM 1332 CG2 VAL A 84 21.354 -12.100 7.290 1.00 5.32 C ATOM 0 H VAL A 84 18.351 -9.025 7.783 1.00 4.00 H new ATOM 0 HA VAL A 84 18.811 -11.613 6.541 1.00 4.21 H new ATOM 0 HB VAL A 84 20.865 -10.555 5.908 1.00 4.91 H new ATOM 0 HG11 VAL A 84 22.359 -9.591 7.592 1.00 5.39 H new ATOM 0 HG12 VAL A 84 20.821 -8.702 7.497 1.00 5.39 H new ATOM 0 HG13 VAL A 84 21.113 -9.834 8.838 1.00 5.39 H new ATOM 0 HG21 VAL A 84 22.425 -12.029 7.102 1.00 5.32 H new ATOM 0 HG22 VAL A 84 21.185 -12.343 8.339 1.00 5.32 H new ATOM 0 HG23 VAL A 84 20.927 -12.883 6.663 1.00 5.32 H new ATOM 1342 N LEU A 85 18.334 -12.309 8.948 1.00 4.15 N ATOM 1343 CA LEU A 85 18.091 -12.625 10.334 1.00 4.34 C ATOM 1344 C LEU A 85 18.851 -13.854 10.796 1.00 4.70 C ATOM 1345 O LEU A 85 18.906 -14.869 10.097 1.00 4.80 O ATOM 1346 CB LEU A 85 16.598 -12.660 10.616 1.00 4.21 C ATOM 1347 CG LEU A 85 15.956 -11.258 10.573 1.00 4.11 C ATOM 1348 CD1 LEU A 85 16.571 -10.347 11.623 1.00 3.90 C ATOM 1349 CD2 LEU A 85 16.156 -10.621 9.219 1.00 4.45 C ATOM 0 H LEU A 85 18.006 -12.995 8.269 1.00 4.15 H new ATOM 0 HA LEU A 85 18.500 -11.823 10.949 1.00 4.34 H new ATOM 0 HB2 LEU A 85 16.108 -13.303 9.885 1.00 4.21 H new ATOM 0 HB3 LEU A 85 16.427 -13.105 11.596 1.00 4.21 H new ATOM 0 HG LEU A 85 14.892 -11.383 10.772 1.00 4.11 H new ATOM 0 HD11 LEU A 85 16.102 -9.365 11.572 1.00 3.90 H new ATOM 0 HD12 LEU A 85 16.413 -10.774 12.613 1.00 3.90 H new ATOM 0 HD13 LEU A 85 17.641 -10.248 11.437 1.00 3.90 H new ATOM 0 HD21 LEU A 85 15.696 -9.633 9.210 1.00 4.45 H new ATOM 0 HD22 LEU A 85 17.223 -10.526 9.015 1.00 4.45 H new ATOM 0 HD23 LEU A 85 15.694 -11.243 8.452 1.00 4.45 H new ATOM 1361 N PRO A 86 19.450 -13.770 11.991 1.00 5.11 N ATOM 1362 CA PRO A 86 20.244 -14.847 12.561 1.00 5.57 C ATOM 1363 C PRO A 86 19.421 -15.788 13.425 1.00 5.64 C ATOM 1364 O PRO A 86 19.597 -17.006 13.390 1.00 5.96 O ATOM 1365 CB PRO A 86 21.232 -14.055 13.401 1.00 5.85 C ATOM 1366 CG PRO A 86 20.425 -12.934 13.957 1.00 5.81 C ATOM 1367 CD PRO A 86 19.393 -12.607 12.908 1.00 5.38 C ATOM 0 HA PRO A 86 20.691 -15.504 11.815 1.00 5.57 H new ATOM 0 HB2 PRO A 86 21.661 -14.668 14.194 1.00 5.85 H new ATOM 0 HB3 PRO A 86 22.062 -13.687 12.798 1.00 5.85 H new ATOM 0 HG2 PRO A 86 19.951 -13.222 14.895 1.00 5.81 H new ATOM 0 HG3 PRO A 86 21.053 -12.069 14.170 1.00 5.81 H new ATOM 0 HD2 PRO A 86 18.401 -12.488 13.344 1.00 5.38 H new ATOM 0 HD3 PRO A 86 19.627 -11.676 12.391 1.00 5.38 H new ATOM 1375 N GLY A 87 18.524 -15.205 14.202 1.00 5.51 N ATOM 1376 CA GLY A 87 17.664 -15.987 15.072 1.00 5.74 C ATOM 1377 C GLY A 87 18.127 -15.980 16.517 1.00 6.21 C ATOM 1378 O GLY A 87 17.324 -16.178 17.430 1.00 6.52 O ATOM 0 H GLY A 87 18.373 -14.197 14.248 1.00 5.51 H new ATOM 0 HA2 GLY A 87 16.648 -15.595 15.019 1.00 5.74 H new ATOM 0 HA3 GLY A 87 17.628 -17.015 14.712 1.00 5.74 H new ATOM 1382 N MET A 88 19.420 -15.748 16.726 1.00 6.40 N ATOM 1383 CA MET A 88 19.983 -15.719 18.073 1.00 6.91 C ATOM 1384 C MET A 88 19.507 -14.489 18.842 1.00 6.86 C ATOM 1385 O MET A 88 18.580 -13.800 18.416 1.00 7.07 O ATOM 1386 CB MET A 88 21.512 -15.749 18.013 1.00 7.26 C ATOM 1387 CG MET A 88 22.082 -17.097 17.595 1.00 7.46 C ATOM 1388 SD MET A 88 21.659 -17.542 15.900 1.00 7.81 S ATOM 1389 CE MET A 88 22.397 -19.170 15.784 1.00 8.29 C ATOM 0 H MET A 88 20.096 -15.578 15.982 1.00 6.40 H new ATOM 0 HA MET A 88 19.634 -16.605 18.603 1.00 6.91 H new ATOM 0 HB2 MET A 88 21.854 -14.987 17.313 1.00 7.26 H new ATOM 0 HB3 MET A 88 21.910 -15.484 18.992 1.00 7.26 H new ATOM 0 HG2 MET A 88 23.167 -17.075 17.700 1.00 7.46 H new ATOM 0 HG3 MET A 88 21.712 -17.868 18.271 1.00 7.46 H new ATOM 0 HE1 MET A 88 22.220 -19.580 14.790 1.00 8.29 H new ATOM 0 HE2 MET A 88 23.470 -19.096 15.961 1.00 8.29 H new ATOM 0 HE3 MET A 88 21.950 -19.826 16.531 1.00 8.29 H new ATOM 1399 N HIS A 89 20.144 -14.219 19.979 1.00 6.83 N ATOM 1400 CA HIS A 89 19.775 -13.075 20.807 1.00 6.90 C ATOM 1401 C HIS A 89 20.308 -11.773 20.219 1.00 6.45 C ATOM 1402 O HIS A 89 19.845 -10.688 20.570 1.00 6.58 O ATOM 1403 CB HIS A 89 20.306 -13.257 22.231 1.00 7.63 C ATOM 1404 CG HIS A 89 19.776 -12.245 23.200 1.00 8.02 C ATOM 1405 ND1 HIS A 89 20.500 -11.147 23.615 1.00 8.70 N ATOM 1406 CD2 HIS A 89 18.583 -12.169 23.840 1.00 8.06 C ATOM 1407 CE1 HIS A 89 19.777 -10.440 24.466 1.00 9.11 C ATOM 1408 NE2 HIS A 89 18.610 -11.039 24.619 1.00 8.74 N ATOM 0 H HIS A 89 20.916 -14.775 20.347 1.00 6.83 H new ATOM 0 HA HIS A 89 18.687 -13.019 20.833 1.00 6.90 H new ATOM 0 HB2 HIS A 89 20.046 -14.256 22.582 1.00 7.63 H new ATOM 0 HB3 HIS A 89 21.394 -13.198 22.215 1.00 7.63 H new ATOM 0 HD2 HIS A 89 17.764 -12.868 23.753 1.00 8.06 H new ATOM 0 HE1 HIS A 89 20.088 -9.528 24.953 1.00 9.11 H new ATOM 0 HE2 HIS A 89 17.852 -10.715 25.219 1.00 8.74 H new ATOM 1417 N HIS A 90 21.276 -11.886 19.314 1.00 6.08 N ATOM 1418 CA HIS A 90 21.872 -10.711 18.689 1.00 5.77 C ATOM 1419 C HIS A 90 21.443 -10.602 17.225 1.00 5.44 C ATOM 1420 O HIS A 90 21.874 -11.396 16.389 1.00 5.60 O ATOM 1421 CB HIS A 90 23.397 -10.782 18.780 1.00 6.09 C ATOM 1422 CG HIS A 90 24.072 -9.457 18.608 1.00 6.55 C ATOM 1423 ND1 HIS A 90 24.940 -8.928 19.540 1.00 7.04 N ATOM 1424 CD2 HIS A 90 24.008 -8.552 17.602 1.00 6.91 C ATOM 1425 CE1 HIS A 90 25.379 -7.755 19.116 1.00 7.58 C ATOM 1426 NE2 HIS A 90 24.830 -7.506 17.942 1.00 7.51 N ATOM 0 H HIS A 90 21.663 -12.776 18.999 1.00 6.08 H new ATOM 0 HA HIS A 90 21.523 -9.826 19.221 1.00 5.77 H new ATOM 0 HB2 HIS A 90 23.675 -11.199 19.748 1.00 6.09 H new ATOM 0 HB3 HIS A 90 23.766 -11.469 18.019 1.00 6.09 H new ATOM 0 HD2 HIS A 90 23.420 -8.637 16.700 1.00 6.91 H new ATOM 0 HE1 HIS A 90 26.069 -7.111 19.641 1.00 7.58 H new ATOM 0 HE2 HIS A 90 24.990 -6.671 17.378 1.00 7.51 H new ATOM 1435 N PRO A 91 20.584 -9.618 16.891 1.00 5.15 N ATOM 1436 CA PRO A 91 20.106 -9.427 15.519 1.00 4.98 C ATOM 1437 C PRO A 91 21.154 -8.788 14.617 1.00 4.84 C ATOM 1438 O PRO A 91 21.966 -7.976 15.064 1.00 5.14 O ATOM 1439 CB PRO A 91 18.913 -8.493 15.693 1.00 5.10 C ATOM 1440 CG PRO A 91 19.246 -7.691 16.902 1.00 5.17 C ATOM 1441 CD PRO A 91 20.008 -8.617 17.815 1.00 5.17 C ATOM 0 HA PRO A 91 19.862 -10.374 15.038 1.00 4.98 H new ATOM 0 HB2 PRO A 91 18.776 -7.856 14.819 1.00 5.10 H new ATOM 0 HB3 PRO A 91 17.987 -9.052 15.829 1.00 5.10 H new ATOM 0 HG2 PRO A 91 19.846 -6.820 16.640 1.00 5.17 H new ATOM 0 HG3 PRO A 91 18.342 -7.321 17.386 1.00 5.17 H new ATOM 0 HD2 PRO A 91 20.784 -8.087 18.367 1.00 5.17 H new ATOM 0 HD3 PRO A 91 19.353 -9.082 18.552 1.00 5.17 H new ATOM 1449 N ILE A 92 21.126 -9.164 13.345 1.00 4.52 N ATOM 1450 CA ILE A 92 22.063 -8.640 12.360 1.00 4.42 C ATOM 1451 C ILE A 92 21.309 -8.095 11.150 1.00 3.99 C ATOM 1452 O ILE A 92 20.216 -8.561 10.835 1.00 3.99 O ATOM 1453 CB ILE A 92 23.104 -9.699 11.921 1.00 4.77 C ATOM 1454 CG1 ILE A 92 22.711 -10.352 10.591 1.00 4.68 C ATOM 1455 CG2 ILE A 92 23.281 -10.754 13.005 1.00 5.46 C ATOM 1456 CD1 ILE A 92 21.564 -11.322 10.687 1.00 4.43 C ATOM 0 H ILE A 92 20.458 -9.836 12.969 1.00 4.52 H new ATOM 0 HA ILE A 92 22.613 -7.827 12.834 1.00 4.42 H new ATOM 0 HB ILE A 92 24.056 -9.189 11.771 1.00 4.77 H new ATOM 0 HG12 ILE A 92 22.449 -9.569 9.879 1.00 4.68 H new ATOM 0 HG13 ILE A 92 23.578 -10.873 10.186 1.00 4.68 H new ATOM 0 HG21 ILE A 92 24.016 -11.490 12.680 1.00 5.46 H new ATOM 0 HG22 ILE A 92 23.626 -10.278 13.923 1.00 5.46 H new ATOM 0 HG23 ILE A 92 22.328 -11.250 13.189 1.00 5.46 H new ATOM 0 HD11 ILE A 92 21.354 -11.736 9.701 1.00 4.43 H new ATOM 0 HD12 ILE A 92 21.826 -12.129 11.371 1.00 4.43 H new ATOM 0 HD13 ILE A 92 20.680 -10.804 11.059 1.00 4.43 H new ATOM 1468 N GLN A 93 21.876 -7.093 10.489 1.00 3.75 N ATOM 1469 CA GLN A 93 21.224 -6.483 9.333 1.00 3.44 C ATOM 1470 C GLN A 93 22.114 -6.555 8.080 1.00 3.12 C ATOM 1471 O GLN A 93 23.316 -6.296 8.154 1.00 3.04 O ATOM 1472 CB GLN A 93 20.916 -5.018 9.649 1.00 3.51 C ATOM 1473 CG GLN A 93 20.034 -4.833 10.875 1.00 3.77 C ATOM 1474 CD GLN A 93 18.650 -5.424 10.693 1.00 3.84 C ATOM 1475 OE1 GLN A 93 18.122 -5.466 9.582 1.00 4.15 O ATOM 1476 NE2 GLN A 93 18.053 -5.882 11.788 1.00 4.02 N ATOM 0 H GLN A 93 22.780 -6.687 10.730 1.00 3.75 H new ATOM 0 HA GLN A 93 20.305 -7.033 9.128 1.00 3.44 H new ATOM 0 HB2 GLN A 93 21.853 -4.483 9.802 1.00 3.51 H new ATOM 0 HB3 GLN A 93 20.426 -4.564 8.787 1.00 3.51 H new ATOM 0 HG2 GLN A 93 20.513 -5.299 11.736 1.00 3.77 H new ATOM 0 HG3 GLN A 93 19.944 -3.769 11.096 1.00 3.77 H new ATOM 0 HE21 GLN A 93 18.528 -5.827 12.689 1.00 4.02 H new ATOM 0 HE22 GLN A 93 17.120 -6.289 11.728 1.00 4.02 H new ATOM 1485 N MET A 94 21.520 -6.906 6.930 1.00 3.01 N ATOM 1486 CA MET A 94 22.271 -6.993 5.673 1.00 2.75 C ATOM 1487 C MET A 94 21.591 -6.185 4.576 1.00 2.77 C ATOM 1488 O MET A 94 20.418 -6.397 4.276 1.00 2.91 O ATOM 1489 CB MET A 94 22.426 -8.435 5.188 1.00 2.65 C ATOM 1490 CG MET A 94 23.426 -8.585 4.049 1.00 2.30 C ATOM 1491 SD MET A 94 23.774 -10.309 3.648 1.00 2.33 S ATOM 1492 CE MET A 94 24.484 -10.882 5.190 1.00 2.41 C ATOM 0 H MET A 94 20.529 -7.132 6.846 1.00 3.01 H new ATOM 0 HA MET A 94 23.260 -6.586 5.881 1.00 2.75 H new ATOM 0 HB2 MET A 94 22.742 -9.060 6.024 1.00 2.65 H new ATOM 0 HB3 MET A 94 21.455 -8.807 4.861 1.00 2.65 H new ATOM 0 HG2 MET A 94 23.039 -8.081 3.163 1.00 2.30 H new ATOM 0 HG3 MET A 94 24.356 -8.085 4.319 1.00 2.30 H new ATOM 0 HE1 MET A 94 24.927 -11.867 5.043 1.00 2.41 H new ATOM 0 HE2 MET A 94 25.253 -10.183 5.518 1.00 2.41 H new ATOM 0 HE3 MET A 94 23.704 -10.945 5.949 1.00 2.41 H new ATOM 1502 N LYS A 95 22.335 -5.272 3.973 1.00 2.73 N ATOM 1503 CA LYS A 95 21.808 -4.424 2.910 1.00 2.87 C ATOM 1504 C LYS A 95 22.849 -4.224 1.815 1.00 2.75 C ATOM 1505 O LYS A 95 24.038 -4.248 2.095 1.00 2.63 O ATOM 1506 CB LYS A 95 21.368 -3.086 3.485 1.00 3.24 C ATOM 1507 CG LYS A 95 22.513 -2.265 4.060 1.00 3.26 C ATOM 1508 CD LYS A 95 22.032 -1.277 5.109 1.00 3.68 C ATOM 1509 CE LYS A 95 21.717 -1.971 6.425 1.00 3.80 C ATOM 1510 NZ LYS A 95 21.535 -0.998 7.538 1.00 4.40 N ATOM 0 H LYS A 95 23.313 -5.097 4.202 1.00 2.73 H new ATOM 0 HA LYS A 95 20.943 -4.916 2.465 1.00 2.87 H new ATOM 0 HB2 LYS A 95 20.874 -2.509 2.703 1.00 3.24 H new ATOM 0 HB3 LYS A 95 20.629 -3.261 4.267 1.00 3.24 H new ATOM 0 HG2 LYS A 95 23.252 -2.933 4.503 1.00 3.26 H new ATOM 0 HG3 LYS A 95 23.012 -1.725 3.255 1.00 3.26 H new ATOM 0 HD2 LYS A 95 22.796 -0.516 5.271 1.00 3.68 H new ATOM 0 HD3 LYS A 95 21.142 -0.763 4.745 1.00 3.68 H new ATOM 0 HE2 LYS A 95 20.812 -2.567 6.313 1.00 3.80 H new ATOM 0 HE3 LYS A 95 22.524 -2.660 6.674 1.00 3.80 H new ATOM 0 HZ1 LYS A 95 20.866 -1.387 8.233 1.00 4.40 H new ATOM 0 HZ2 LYS A 95 22.451 -0.823 7.999 1.00 4.40 H new ATOM 0 HZ3 LYS A 95 21.161 -0.104 7.160 1.00 4.40 H new ATOM 1524 N PRO A 96 22.436 -4.033 0.550 1.00 2.85 N ATOM 1525 CA PRO A 96 23.366 -3.848 -0.548 1.00 2.87 C ATOM 1526 C PRO A 96 23.423 -2.407 -1.058 1.00 3.26 C ATOM 1527 O PRO A 96 22.411 -1.820 -1.442 1.00 3.59 O ATOM 1528 CB PRO A 96 22.730 -4.746 -1.601 1.00 2.87 C ATOM 1529 CG PRO A 96 21.247 -4.627 -1.360 1.00 2.97 C ATOM 1530 CD PRO A 96 21.062 -4.088 0.048 1.00 3.03 C ATOM 0 HA PRO A 96 24.397 -4.075 -0.277 1.00 2.87 H new ATOM 0 HB2 PRO A 96 22.995 -4.424 -2.608 1.00 2.87 H new ATOM 0 HB3 PRO A 96 23.067 -5.778 -1.497 1.00 2.87 H new ATOM 0 HG2 PRO A 96 20.791 -3.959 -2.091 1.00 2.97 H new ATOM 0 HG3 PRO A 96 20.761 -5.597 -1.468 1.00 2.97 H new ATOM 0 HD2 PRO A 96 20.591 -3.105 0.047 1.00 3.03 H new ATOM 0 HD3 PRO A 96 20.435 -4.742 0.654 1.00 3.03 H new ATOM 1538 N ALA A 97 24.638 -1.859 -1.052 1.00 3.26 N ATOM 1539 CA ALA A 97 24.905 -0.492 -1.499 1.00 3.66 C ATOM 1540 C ALA A 97 23.947 0.524 -0.894 1.00 3.56 C ATOM 1541 O ALA A 97 23.498 1.447 -1.574 1.00 3.83 O ATOM 1542 CB ALA A 97 24.867 -0.397 -3.007 1.00 3.99 C ATOM 0 H ALA A 97 25.471 -2.355 -0.734 1.00 3.26 H new ATOM 0 HA ALA A 97 25.907 -0.248 -1.146 1.00 3.66 H new ATOM 0 HB1 ALA A 97 25.069 0.630 -3.312 1.00 3.99 H new ATOM 0 HB2 ALA A 97 25.623 -1.057 -3.432 1.00 3.99 H new ATOM 0 HB3 ALA A 97 23.882 -0.695 -3.366 1.00 3.99 H new ATOM 1548 N ASP A 98 23.635 0.351 0.379 1.00 3.37 N ATOM 1549 CA ASP A 98 22.759 1.282 1.075 1.00 3.32 C ATOM 1550 C ASP A 98 23.380 2.663 1.063 1.00 3.17 C ATOM 1551 O ASP A 98 22.701 3.676 1.217 1.00 3.27 O ATOM 1552 CB ASP A 98 22.533 0.830 2.513 1.00 3.42 C ATOM 1553 CG ASP A 98 21.358 1.532 3.165 1.00 3.94 C ATOM 1554 OD1 ASP A 98 20.224 1.021 3.053 1.00 4.23 O ATOM 1555 OD2 ASP A 98 21.571 2.593 3.788 1.00 4.40 O ATOM 0 H ASP A 98 23.973 -0.423 0.951 1.00 3.37 H new ATOM 0 HA ASP A 98 21.796 1.309 0.565 1.00 3.32 H new ATOM 0 HB2 ASP A 98 22.363 -0.247 2.530 1.00 3.42 H new ATOM 0 HB3 ASP A 98 23.434 1.020 3.096 1.00 3.42 H new ATOM 1560 N SER A 99 24.689 2.684 0.891 1.00 3.17 N ATOM 1561 CA SER A 99 25.439 3.924 0.865 1.00 3.44 C ATOM 1562 C SER A 99 24.927 4.871 -0.213 1.00 3.74 C ATOM 1563 O SER A 99 25.072 6.088 -0.098 1.00 4.12 O ATOM 1564 CB SER A 99 26.926 3.642 0.651 1.00 3.73 C ATOM 1565 OG SER A 99 27.435 2.790 1.663 1.00 3.81 O ATOM 0 H SER A 99 25.258 1.847 0.766 1.00 3.17 H new ATOM 0 HA SER A 99 25.300 4.411 1.830 1.00 3.44 H new ATOM 0 HB2 SER A 99 27.075 3.181 -0.325 1.00 3.73 H new ATOM 0 HB3 SER A 99 27.481 4.580 0.649 1.00 3.73 H new ATOM 0 HG SER A 99 28.387 2.624 1.502 1.00 3.81 H new ATOM 1571 N GLU A 100 24.329 4.316 -1.263 1.00 3.82 N ATOM 1572 CA GLU A 100 23.816 5.133 -2.352 1.00 4.40 C ATOM 1573 C GLU A 100 22.561 4.533 -2.980 1.00 4.57 C ATOM 1574 O GLU A 100 22.476 4.370 -4.197 1.00 5.20 O ATOM 1575 CB GLU A 100 24.917 5.310 -3.393 1.00 4.96 C ATOM 1576 CG GLU A 100 25.312 4.023 -4.105 1.00 4.97 C ATOM 1577 CD GLU A 100 26.491 4.212 -5.038 1.00 5.69 C ATOM 1578 OE1 GLU A 100 26.268 4.575 -6.213 1.00 6.33 O ATOM 1579 OE2 GLU A 100 27.639 3.998 -4.596 1.00 5.72 O ATOM 0 H GLU A 100 24.190 3.312 -1.381 1.00 3.82 H new ATOM 0 HA GLU A 100 23.524 6.104 -1.952 1.00 4.40 H new ATOM 0 HB2 GLU A 100 24.587 6.037 -4.135 1.00 4.96 H new ATOM 0 HB3 GLU A 100 25.798 5.729 -2.907 1.00 4.96 H new ATOM 0 HG2 GLU A 100 25.558 3.263 -3.364 1.00 4.97 H new ATOM 0 HG3 GLU A 100 24.460 3.650 -4.673 1.00 4.97 H new ATOM 1689 N ARG A 108 10.438 0.912 3.618 1.00 2.89 N ATOM 1690 CA ARG A 108 9.110 0.529 4.064 1.00 3.04 C ATOM 1691 C ARG A 108 8.113 0.722 2.931 1.00 2.46 C ATOM 1692 O ARG A 108 7.674 1.843 2.662 1.00 1.90 O ATOM 1693 CB ARG A 108 8.766 1.447 5.229 1.00 3.22 C ATOM 1694 CG ARG A 108 9.566 2.748 5.176 1.00 2.91 C ATOM 1695 CD ARG A 108 9.323 3.651 6.371 1.00 3.48 C ATOM 1696 NE ARG A 108 10.124 4.872 6.292 1.00 3.38 N ATOM 1697 CZ ARG A 108 10.724 5.433 7.338 1.00 3.81 C ATOM 1698 NH1 ARG A 108 10.619 4.888 8.543 1.00 4.30 N ATOM 1699 NH2 ARG A 108 11.432 6.544 7.180 1.00 3.91 N ATOM 0 HA ARG A 108 9.075 -0.518 4.366 1.00 3.04 H new ATOM 0 HB2 ARG A 108 7.700 1.674 5.212 1.00 3.22 H new ATOM 0 HB3 ARG A 108 8.967 0.934 6.169 1.00 3.22 H new ATOM 0 HG2 ARG A 108 10.628 2.511 5.118 1.00 2.91 H new ATOM 0 HG3 ARG A 108 9.310 3.287 4.264 1.00 2.91 H new ATOM 0 HD2 ARG A 108 8.266 3.911 6.423 1.00 3.48 H new ATOM 0 HD3 ARG A 108 9.565 3.115 7.289 1.00 3.48 H new ATOM 0 HE ARG A 108 10.229 5.320 5.381 1.00 3.38 H new ATOM 0 HH11 ARG A 108 10.076 4.034 8.671 1.00 4.30 H new ATOM 0 HH12 ARG A 108 11.081 5.323 9.341 1.00 4.30 H new ATOM 0 HH21 ARG A 108 11.516 6.968 6.256 1.00 3.91 H new ATOM 0 HH22 ARG A 108 11.892 6.974 7.982 1.00 3.91 H new ATOM 1713 N LYS A 109 7.642 -0.400 2.391 1.00 2.91 N ATOM 1714 CA LYS A 109 6.713 -0.380 1.267 1.00 2.73 C ATOM 1715 C LYS A 109 5.472 -1.246 1.458 1.00 3.05 C ATOM 1716 O LYS A 109 5.537 -2.342 2.012 1.00 3.83 O ATOM 1717 CB LYS A 109 7.436 -0.812 -0.007 1.00 3.38 C ATOM 1718 CG LYS A 109 7.954 0.348 -0.840 1.00 3.27 C ATOM 1719 CD LYS A 109 6.816 1.101 -1.511 1.00 3.31 C ATOM 1720 CE LYS A 109 7.338 2.189 -2.434 1.00 3.81 C ATOM 1721 NZ LYS A 109 8.242 1.640 -3.482 1.00 4.37 N ATOM 0 H LYS A 109 7.890 -1.335 2.715 1.00 2.91 H new ATOM 0 HA LYS A 109 6.360 0.649 1.194 1.00 2.73 H new ATOM 0 HB2 LYS A 109 8.273 -1.457 0.262 1.00 3.38 H new ATOM 0 HB3 LYS A 109 6.756 -1.409 -0.615 1.00 3.38 H new ATOM 0 HG2 LYS A 109 8.519 1.030 -0.205 1.00 3.27 H new ATOM 0 HG3 LYS A 109 8.642 -0.025 -1.598 1.00 3.27 H new ATOM 0 HD2 LYS A 109 6.202 0.403 -2.080 1.00 3.31 H new ATOM 0 HD3 LYS A 109 6.173 1.545 -0.751 1.00 3.31 H new ATOM 0 HE2 LYS A 109 6.498 2.697 -2.908 1.00 3.81 H new ATOM 0 HE3 LYS A 109 7.873 2.937 -1.848 1.00 3.81 H new ATOM 0 HZ1 LYS A 109 8.042 2.104 -4.391 1.00 4.37 H new ATOM 0 HZ2 LYS A 109 9.231 1.816 -3.214 1.00 4.37 H new ATOM 0 HZ3 LYS A 109 8.085 0.616 -3.574 1.00 4.37 H new ATOM 1735 N LEU A 110 4.347 -0.728 0.986 1.00 2.58 N ATOM 1736 CA LEU A 110 3.083 -1.455 0.989 1.00 2.86 C ATOM 1737 C LEU A 110 2.454 -1.341 -0.394 1.00 3.03 C ATOM 1738 O LEU A 110 2.555 -0.296 -1.038 1.00 2.83 O ATOM 1739 CB LEU A 110 2.111 -0.941 2.056 1.00 2.44 C ATOM 1740 CG LEU A 110 2.408 -1.387 3.491 1.00 3.17 C ATOM 1741 CD1 LEU A 110 2.652 -2.889 3.558 1.00 4.14 C ATOM 1742 CD2 LEU A 110 3.599 -0.625 4.047 1.00 3.11 C ATOM 0 H LEU A 110 4.284 0.210 0.589 1.00 2.58 H new ATOM 0 HA LEU A 110 3.290 -2.497 1.234 1.00 2.86 H new ATOM 0 HB2 LEU A 110 2.110 0.149 2.026 1.00 2.44 H new ATOM 0 HB3 LEU A 110 1.105 -1.268 1.794 1.00 2.44 H new ATOM 0 HG LEU A 110 1.535 -1.162 4.104 1.00 3.17 H new ATOM 0 HD11 LEU A 110 2.860 -3.178 4.588 1.00 4.14 H new ATOM 0 HD12 LEU A 110 1.767 -3.418 3.205 1.00 4.14 H new ATOM 0 HD13 LEU A 110 3.504 -3.148 2.929 1.00 4.14 H new ATOM 0 HD21 LEU A 110 3.797 -0.954 5.067 1.00 3.11 H new ATOM 0 HD22 LEU A 110 4.475 -0.817 3.428 1.00 3.11 H new ATOM 0 HD23 LEU A 110 3.381 0.443 4.046 1.00 3.11 H new ATOM 1754 N PHE A 111 1.810 -2.404 -0.855 1.00 3.75 N ATOM 1755 CA PHE A 111 1.184 -2.385 -2.172 1.00 4.24 C ATOM 1756 C PHE A 111 -0.295 -2.727 -2.079 1.00 4.19 C ATOM 1757 O PHE A 111 -0.667 -3.783 -1.582 1.00 4.56 O ATOM 1758 CB PHE A 111 1.892 -3.370 -3.108 1.00 5.34 C ATOM 1759 CG PHE A 111 1.206 -3.547 -4.435 1.00 6.09 C ATOM 1760 CD1 PHE A 111 1.374 -2.613 -5.444 1.00 6.18 C ATOM 1761 CD2 PHE A 111 0.395 -4.644 -4.671 1.00 6.87 C ATOM 1762 CE1 PHE A 111 0.746 -2.770 -6.666 1.00 6.97 C ATOM 1763 CE2 PHE A 111 -0.236 -4.809 -5.890 1.00 7.61 C ATOM 1764 CZ PHE A 111 -0.066 -3.874 -6.886 1.00 7.63 C ATOM 0 H PHE A 111 1.707 -3.281 -0.345 1.00 3.75 H new ATOM 0 HA PHE A 111 1.277 -1.377 -2.576 1.00 4.24 H new ATOM 0 HB2 PHE A 111 2.911 -3.025 -3.280 1.00 5.34 H new ATOM 0 HB3 PHE A 111 1.963 -4.339 -2.614 1.00 5.34 H new ATOM 0 HD1 PHE A 111 2.003 -1.752 -5.274 1.00 6.18 H new ATOM 0 HD2 PHE A 111 0.254 -5.380 -3.893 1.00 6.87 H new ATOM 0 HE1 PHE A 111 0.887 -2.037 -7.446 1.00 6.97 H new ATOM 0 HE2 PHE A 111 -0.863 -5.672 -6.061 1.00 7.61 H new ATOM 0 HZ PHE A 111 -0.563 -3.999 -7.836 1.00 7.63 H new ATOM 1774 N ILE A 112 -1.128 -1.825 -2.584 1.00 3.92 N ATOM 1775 CA ILE A 112 -2.572 -2.012 -2.576 1.00 3.86 C ATOM 1776 C ILE A 112 -3.104 -1.962 -4.001 1.00 4.75 C ATOM 1777 O ILE A 112 -2.977 -0.940 -4.675 1.00 5.06 O ATOM 1778 CB ILE A 112 -3.287 -0.926 -1.743 1.00 2.95 C ATOM 1779 CG1 ILE A 112 -2.616 -0.745 -0.378 1.00 2.19 C ATOM 1780 CG2 ILE A 112 -4.755 -1.279 -1.565 1.00 2.90 C ATOM 1781 CD1 ILE A 112 -1.386 0.138 -0.412 1.00 2.02 C ATOM 0 H ILE A 112 -0.823 -0.949 -3.008 1.00 3.92 H new ATOM 0 HA ILE A 112 -2.773 -2.983 -2.124 1.00 3.86 H new ATOM 0 HB ILE A 112 -3.213 0.017 -2.284 1.00 2.95 H new ATOM 0 HG12 ILE A 112 -3.339 -0.318 0.318 1.00 2.19 H new ATOM 0 HG13 ILE A 112 -2.338 -1.724 0.012 1.00 2.19 H new ATOM 0 HG21 ILE A 112 -5.247 -0.505 -0.976 1.00 2.90 H new ATOM 0 HG22 ILE A 112 -5.233 -1.350 -2.542 1.00 2.90 H new ATOM 0 HG23 ILE A 112 -4.839 -2.236 -1.049 1.00 2.90 H new ATOM 0 HD11 ILE A 112 -0.968 0.218 0.591 1.00 2.02 H new ATOM 0 HD12 ILE A 112 -0.644 -0.297 -1.081 1.00 2.02 H new ATOM 0 HD13 ILE A 112 -1.660 1.130 -0.771 1.00 2.02 H new ATOM 1793 N GLY A 113 -3.697 -3.057 -4.465 1.00 5.33 N ATOM 1794 CA GLY A 113 -4.204 -3.076 -5.825 1.00 6.24 C ATOM 1795 C GLY A 113 -5.626 -2.554 -5.955 1.00 6.09 C ATOM 1796 O GLY A 113 -5.870 -1.353 -5.911 1.00 6.49 O ATOM 0 H GLY A 113 -3.834 -3.918 -3.935 1.00 5.33 H new ATOM 0 HA2 GLY A 113 -3.548 -2.477 -6.456 1.00 6.24 H new ATOM 0 HA3 GLY A 113 -4.165 -4.097 -6.203 1.00 6.24 H new ATOM 1800 N MET A 114 -6.548 -3.489 -6.090 1.00 5.69 N ATOM 1801 CA MET A 114 -7.972 -3.228 -6.256 1.00 5.55 C ATOM 1802 C MET A 114 -8.562 -2.272 -5.210 1.00 4.56 C ATOM 1803 O MET A 114 -8.981 -2.693 -4.134 1.00 4.05 O ATOM 1804 CB MET A 114 -8.705 -4.567 -6.183 1.00 6.00 C ATOM 1805 CG MET A 114 -8.482 -5.322 -4.872 1.00 5.90 C ATOM 1806 SD MET A 114 -6.756 -5.473 -4.392 1.00 7.01 S ATOM 1807 CE MET A 114 -6.521 -4.054 -3.323 1.00 7.54 C ATOM 0 H MET A 114 -6.323 -4.484 -6.087 1.00 5.69 H new ATOM 0 HA MET A 114 -8.101 -2.734 -7.219 1.00 5.55 H new ATOM 0 HB2 MET A 114 -9.773 -4.394 -6.314 1.00 6.00 H new ATOM 0 HB3 MET A 114 -8.380 -5.194 -7.013 1.00 6.00 H new ATOM 0 HG2 MET A 114 -9.026 -4.813 -4.076 1.00 5.90 H new ATOM 0 HG3 MET A 114 -8.911 -6.320 -4.963 1.00 5.90 H new ATOM 0 HE1 MET A 114 -5.588 -4.166 -2.770 1.00 7.54 H new ATOM 0 HE2 MET A 114 -6.479 -3.147 -3.926 1.00 7.54 H new ATOM 0 HE3 MET A 114 -7.353 -3.985 -2.622 1.00 7.54 H new ATOM 1817 N ILE A 115 -8.617 -0.986 -5.529 1.00 4.53 N ATOM 1818 CA ILE A 115 -9.207 -0.020 -4.609 1.00 3.90 C ATOM 1819 C ILE A 115 -10.309 0.784 -5.280 1.00 4.44 C ATOM 1820 O ILE A 115 -10.358 0.901 -6.505 1.00 5.25 O ATOM 1821 CB ILE A 115 -8.178 0.930 -3.980 1.00 3.67 C ATOM 1822 CG1 ILE A 115 -7.112 1.333 -5.000 1.00 4.42 C ATOM 1823 CG2 ILE A 115 -7.563 0.266 -2.757 1.00 2.85 C ATOM 1824 CD1 ILE A 115 -6.172 2.407 -4.498 1.00 4.43 C ATOM 0 H ILE A 115 -8.267 -0.591 -6.402 1.00 4.53 H new ATOM 0 HA ILE A 115 -9.634 -0.613 -3.800 1.00 3.90 H new ATOM 0 HB ILE A 115 -8.677 1.846 -3.664 1.00 3.67 H new ATOM 0 HG12 ILE A 115 -6.531 0.452 -5.274 1.00 4.42 H new ATOM 0 HG13 ILE A 115 -7.603 1.686 -5.907 1.00 4.42 H new ATOM 0 HG21 ILE A 115 -6.832 0.938 -2.307 1.00 2.85 H new ATOM 0 HG22 ILE A 115 -8.346 0.044 -2.032 1.00 2.85 H new ATOM 0 HG23 ILE A 115 -7.071 -0.660 -3.055 1.00 2.85 H new ATOM 0 HD11 ILE A 115 -5.443 2.643 -5.273 1.00 4.43 H new ATOM 0 HD12 ILE A 115 -6.742 3.303 -4.251 1.00 4.43 H new ATOM 0 HD13 ILE A 115 -5.653 2.050 -3.608 1.00 4.43 H new ATOM 1836 N SER A 116 -11.193 1.338 -4.460 1.00 4.14 N ATOM 1837 CA SER A 116 -12.321 2.110 -4.950 1.00 4.74 C ATOM 1838 C SER A 116 -11.858 3.384 -5.645 1.00 5.61 C ATOM 1839 O SER A 116 -10.915 4.044 -5.210 1.00 5.67 O ATOM 1840 CB SER A 116 -13.242 2.456 -3.784 1.00 4.50 C ATOM 1841 OG SER A 116 -13.939 1.311 -3.326 1.00 4.35 O ATOM 0 H SER A 116 -11.147 1.264 -3.444 1.00 4.14 H new ATOM 0 HA SER A 116 -12.861 1.508 -5.681 1.00 4.74 H new ATOM 0 HB2 SER A 116 -12.657 2.880 -2.968 1.00 4.50 H new ATOM 0 HB3 SER A 116 -13.955 3.219 -4.094 1.00 4.50 H new ATOM 0 HG SER A 116 -14.521 1.560 -2.578 1.00 4.35 H new ATOM 1847 N LYS A 117 -12.540 3.712 -6.738 1.00 6.37 N ATOM 1848 CA LYS A 117 -12.218 4.889 -7.531 1.00 7.35 C ATOM 1849 C LYS A 117 -12.382 6.168 -6.717 1.00 7.65 C ATOM 1850 O LYS A 117 -11.770 7.192 -7.025 1.00 8.40 O ATOM 1851 CB LYS A 117 -13.108 4.945 -8.776 1.00 8.11 C ATOM 1852 CG LYS A 117 -12.872 3.806 -9.760 1.00 8.25 C ATOM 1853 CD LYS A 117 -13.531 2.513 -9.298 1.00 7.50 C ATOM 1854 CE LYS A 117 -12.502 1.495 -8.830 1.00 7.13 C ATOM 1855 NZ LYS A 117 -13.143 0.255 -8.310 1.00 7.69 N ATOM 0 H LYS A 117 -13.327 3.171 -7.096 1.00 6.37 H new ATOM 0 HA LYS A 117 -11.174 4.813 -7.836 1.00 7.35 H new ATOM 0 HB2 LYS A 117 -14.152 4.931 -8.464 1.00 8.11 H new ATOM 0 HB3 LYS A 117 -12.941 5.893 -9.287 1.00 8.11 H new ATOM 0 HG2 LYS A 117 -13.264 4.084 -10.738 1.00 8.25 H new ATOM 0 HG3 LYS A 117 -11.801 3.645 -9.880 1.00 8.25 H new ATOM 0 HD2 LYS A 117 -14.226 2.728 -8.486 1.00 7.50 H new ATOM 0 HD3 LYS A 117 -14.116 2.090 -10.115 1.00 7.50 H new ATOM 0 HE2 LYS A 117 -11.840 1.241 -9.658 1.00 7.13 H new ATOM 0 HE3 LYS A 117 -11.882 1.938 -8.050 1.00 7.13 H new ATOM 0 HZ1 LYS A 117 -12.408 -0.413 -8.001 1.00 7.69 H new ATOM 0 HZ2 LYS A 117 -13.755 0.493 -7.504 1.00 7.69 H new ATOM 0 HZ3 LYS A 117 -13.714 -0.182 -9.061 1.00 7.69 H new ATOM 1869 N LYS A 118 -13.214 6.106 -5.684 1.00 7.20 N ATOM 1870 CA LYS A 118 -13.451 7.259 -4.825 1.00 7.69 C ATOM 1871 C LYS A 118 -12.394 7.344 -3.732 1.00 7.36 C ATOM 1872 O LYS A 118 -12.709 7.516 -2.554 1.00 7.36 O ATOM 1873 CB LYS A 118 -14.837 7.182 -4.209 1.00 7.64 C ATOM 1874 CG LYS A 118 -15.062 5.870 -3.524 1.00 7.99 C ATOM 1875 CD LYS A 118 -15.859 4.914 -4.394 1.00 7.52 C ATOM 1876 CE LYS A 118 -17.326 5.304 -4.456 1.00 7.69 C ATOM 1877 NZ LYS A 118 -18.139 4.289 -5.183 1.00 7.78 N ATOM 0 H LYS A 118 -13.735 5.270 -5.421 1.00 7.20 H new ATOM 0 HA LYS A 118 -13.387 8.159 -5.436 1.00 7.69 H new ATOM 0 HB2 LYS A 118 -14.963 7.994 -3.493 1.00 7.64 H new ATOM 0 HB3 LYS A 118 -15.589 7.322 -4.985 1.00 7.64 H new ATOM 0 HG2 LYS A 118 -14.101 5.420 -3.274 1.00 7.99 H new ATOM 0 HG3 LYS A 118 -15.591 6.035 -2.585 1.00 7.99 H new ATOM 0 HD2 LYS A 118 -15.442 4.904 -5.401 1.00 7.52 H new ATOM 0 HD3 LYS A 118 -15.768 3.901 -4.001 1.00 7.52 H new ATOM 0 HE2 LYS A 118 -17.713 5.423 -3.444 1.00 7.69 H new ATOM 0 HE3 LYS A 118 -17.424 6.270 -4.951 1.00 7.69 H new ATOM 0 HZ1 LYS A 118 -19.134 4.591 -5.204 1.00 7.78 H new ATOM 0 HZ2 LYS A 118 -17.786 4.194 -6.156 1.00 7.78 H new ATOM 0 HZ3 LYS A 118 -18.066 3.373 -4.697 1.00 7.78 H new ATOM 1891 N CYS A 119 -11.132 7.224 -4.134 1.00 7.20 N ATOM 1892 CA CYS A 119 -10.021 7.272 -3.192 1.00 6.89 C ATOM 1893 C CYS A 119 -8.972 8.293 -3.616 1.00 7.58 C ATOM 1894 O CYS A 119 -8.551 8.324 -4.773 1.00 7.88 O ATOM 1895 CB CYS A 119 -9.371 5.895 -3.075 1.00 5.83 C ATOM 1896 SG CYS A 119 -10.450 4.626 -2.375 1.00 5.00 S ATOM 0 H CYS A 119 -10.854 7.093 -5.107 1.00 7.20 H new ATOM 0 HA CYS A 119 -10.422 7.574 -2.225 1.00 6.89 H new ATOM 0 HB2 CYS A 119 -9.045 5.574 -4.064 1.00 5.83 H new ATOM 0 HB3 CYS A 119 -8.477 5.978 -2.456 1.00 5.83 H new ATOM 0 HG CYS A 119 -10.861 3.835 -3.322 1.00 5.00 H new ATOM 1902 N THR A 120 -8.553 9.123 -2.668 1.00 7.94 N ATOM 1903 CA THR A 120 -7.533 10.128 -2.929 1.00 8.60 C ATOM 1904 C THR A 120 -6.239 9.742 -2.226 1.00 8.03 C ATOM 1905 O THR A 120 -6.267 9.021 -1.229 1.00 7.32 O ATOM 1906 CB THR A 120 -7.972 11.526 -2.460 1.00 9.61 C ATOM 1907 OG1 THR A 120 -9.343 11.753 -2.807 1.00 9.96 O ATOM 1908 CG2 THR A 120 -7.103 12.601 -3.093 1.00 10.47 C ATOM 0 H THR A 120 -8.905 9.119 -1.711 1.00 7.94 H new ATOM 0 HA THR A 120 -7.378 10.168 -4.007 1.00 8.60 H new ATOM 0 HB THR A 120 -7.859 11.574 -1.377 1.00 9.61 H new ATOM 0 HG1 THR A 120 -9.614 12.644 -2.503 1.00 9.96 H new ATOM 0 HG21 THR A 120 -7.430 13.582 -2.749 1.00 10.47 H new ATOM 0 HG22 THR A 120 -6.063 12.444 -2.807 1.00 10.47 H new ATOM 0 HG23 THR A 120 -7.192 12.549 -4.178 1.00 10.47 H new ATOM 1916 N GLU A 121 -5.109 10.214 -2.736 1.00 8.38 N ATOM 1917 CA GLU A 121 -3.823 9.873 -2.142 1.00 7.86 C ATOM 1918 C GLU A 121 -3.740 10.326 -0.686 1.00 7.95 C ATOM 1919 O GLU A 121 -3.387 9.536 0.193 1.00 7.23 O ATOM 1920 CB GLU A 121 -2.690 10.488 -2.977 1.00 8.41 C ATOM 1921 CG GLU A 121 -1.405 10.738 -2.204 1.00 8.20 C ATOM 1922 CD GLU A 121 -1.310 12.155 -1.672 1.00 8.99 C ATOM 1923 OE1 GLU A 121 -1.103 13.080 -2.484 1.00 9.31 O ATOM 1924 OE2 GLU A 121 -1.443 12.338 -0.445 1.00 9.38 O ATOM 0 H GLU A 121 -5.056 10.827 -3.550 1.00 8.38 H new ATOM 0 HA GLU A 121 -3.717 8.788 -2.144 1.00 7.86 H new ATOM 0 HB2 GLU A 121 -2.472 9.826 -3.815 1.00 8.41 H new ATOM 0 HB3 GLU A 121 -3.036 11.432 -3.398 1.00 8.41 H new ATOM 0 HG2 GLU A 121 -1.344 10.037 -1.372 1.00 8.20 H new ATOM 0 HG3 GLU A 121 -0.551 10.539 -2.852 1.00 8.20 H new ATOM 1931 N ASN A 122 -4.125 11.568 -0.420 1.00 8.92 N ATOM 1932 CA ASN A 122 -4.076 12.096 0.939 1.00 9.27 C ATOM 1933 C ASN A 122 -5.000 11.304 1.849 1.00 8.93 C ATOM 1934 O ASN A 122 -4.620 10.912 2.953 1.00 8.77 O ATOM 1935 CB ASN A 122 -4.466 13.574 0.952 1.00 10.46 C ATOM 1936 CG ASN A 122 -4.470 14.161 2.351 1.00 10.98 C ATOM 1937 OD1 ASN A 122 -3.456 14.671 2.827 1.00 11.25 O ATOM 1938 ND2 ASN A 122 -5.616 14.090 3.021 1.00 11.25 N ATOM 0 H ASN A 122 -4.472 12.224 -1.120 1.00 8.92 H new ATOM 0 HA ASN A 122 -3.055 12.001 1.308 1.00 9.27 H new ATOM 0 HB2 ASN A 122 -3.771 14.135 0.328 1.00 10.46 H new ATOM 0 HB3 ASN A 122 -5.456 13.689 0.510 1.00 10.46 H new ATOM 0 HD21 ASN A 122 -5.678 14.467 3.967 1.00 11.25 H new ATOM 0 HD22 ASN A 122 -6.433 13.659 2.589 1.00 11.25 H new ATOM 1945 N ASP A 123 -6.212 11.057 1.368 1.00 8.91 N ATOM 1946 CA ASP A 123 -7.197 10.311 2.130 1.00 8.65 C ATOM 1947 C ASP A 123 -6.662 8.941 2.532 1.00 7.63 C ATOM 1948 O ASP A 123 -6.929 8.468 3.638 1.00 7.63 O ATOM 1949 CB ASP A 123 -8.488 10.152 1.325 1.00 8.67 C ATOM 1950 CG ASP A 123 -9.314 11.422 1.305 1.00 8.97 C ATOM 1951 OD1 ASP A 123 -10.133 11.613 2.228 1.00 8.72 O ATOM 1952 OD2 ASP A 123 -9.146 12.225 0.363 1.00 9.52 O ATOM 0 H ASP A 123 -6.534 11.365 0.450 1.00 8.91 H new ATOM 0 HA ASP A 123 -7.411 10.874 3.038 1.00 8.65 H new ATOM 0 HB2 ASP A 123 -8.243 9.865 0.303 1.00 8.67 H new ATOM 0 HB3 ASP A 123 -9.081 9.342 1.750 1.00 8.67 H new ATOM 1957 N ILE A 124 -5.880 8.318 1.648 1.00 6.86 N ATOM 1958 CA ILE A 124 -5.336 6.996 1.936 1.00 5.85 C ATOM 1959 C ILE A 124 -4.538 7.018 3.229 1.00 6.05 C ATOM 1960 O ILE A 124 -4.680 6.131 4.071 1.00 5.79 O ATOM 1961 CB ILE A 124 -4.444 6.476 0.785 1.00 5.17 C ATOM 1962 CG1 ILE A 124 -5.307 6.007 -0.389 1.00 4.90 C ATOM 1963 CG2 ILE A 124 -3.539 5.348 1.260 1.00 4.29 C ATOM 1964 CD1 ILE A 124 -6.272 4.892 -0.039 1.00 4.19 C ATOM 0 H ILE A 124 -5.614 8.703 0.741 1.00 6.86 H new ATOM 0 HA ILE A 124 -6.182 6.317 2.042 1.00 5.85 H new ATOM 0 HB ILE A 124 -3.812 7.299 0.450 1.00 5.17 H new ATOM 0 HG12 ILE A 124 -5.873 6.856 -0.772 1.00 4.90 H new ATOM 0 HG13 ILE A 124 -4.654 5.669 -1.194 1.00 4.90 H new ATOM 0 HG21 ILE A 124 -2.923 5.002 0.430 1.00 4.29 H new ATOM 0 HG22 ILE A 124 -2.896 5.710 2.062 1.00 4.29 H new ATOM 0 HG23 ILE A 124 -4.149 4.523 1.628 1.00 4.29 H new ATOM 0 HD11 ILE A 124 -6.846 4.617 -0.924 1.00 4.19 H new ATOM 0 HD12 ILE A 124 -5.714 4.025 0.315 1.00 4.19 H new ATOM 0 HD13 ILE A 124 -6.951 5.231 0.743 1.00 4.19 H new ATOM 1976 N ARG A 125 -3.729 8.056 3.397 1.00 6.68 N ATOM 1977 CA ARG A 125 -2.908 8.188 4.588 1.00 7.01 C ATOM 1978 C ARG A 125 -3.775 8.104 5.835 1.00 7.61 C ATOM 1979 O ARG A 125 -3.451 7.387 6.780 1.00 7.60 O ATOM 1980 CB ARG A 125 -2.154 9.518 4.566 1.00 7.78 C ATOM 1981 CG ARG A 125 -1.287 9.750 5.793 1.00 8.22 C ATOM 1982 CD ARG A 125 -0.721 11.160 5.815 1.00 8.67 C ATOM 1983 NE ARG A 125 -1.773 12.169 5.883 1.00 9.09 N ATOM 1984 CZ ARG A 125 -1.583 13.403 6.344 1.00 9.67 C ATOM 1985 NH1 ARG A 125 -0.384 13.776 6.772 1.00 9.86 N ATOM 1986 NH2 ARG A 125 -2.591 14.264 6.375 1.00 10.27 N ATOM 0 H ARG A 125 -3.626 8.816 2.724 1.00 6.68 H new ATOM 0 HA ARG A 125 -2.185 7.373 4.604 1.00 7.01 H new ATOM 0 HB2 ARG A 125 -1.526 9.554 3.676 1.00 7.78 H new ATOM 0 HB3 ARG A 125 -2.874 10.332 4.482 1.00 7.78 H new ATOM 0 HG2 ARG A 125 -1.876 9.579 6.694 1.00 8.22 H new ATOM 0 HG3 ARG A 125 -0.470 9.028 5.805 1.00 8.22 H new ATOM 0 HD2 ARG A 125 -0.056 11.271 6.672 1.00 8.67 H new ATOM 0 HD3 ARG A 125 -0.119 11.323 4.921 1.00 8.67 H new ATOM 0 HE ARG A 125 -2.706 11.914 5.559 1.00 9.09 H new ATOM 0 HH11 ARG A 125 0.394 13.117 6.748 1.00 9.86 H new ATOM 0 HH12 ARG A 125 -0.240 14.722 7.125 1.00 9.86 H new ATOM 0 HH21 ARG A 125 -3.514 13.981 6.045 1.00 10.27 H new ATOM 0 HH22 ARG A 125 -2.444 15.209 6.729 1.00 10.27 H new ATOM 2000 N VAL A 126 -4.907 8.801 5.802 1.00 8.22 N ATOM 2001 CA VAL A 126 -5.819 8.827 6.936 1.00 8.90 C ATOM 2002 C VAL A 126 -6.226 7.420 7.343 1.00 8.37 C ATOM 2003 O VAL A 126 -6.225 7.082 8.527 1.00 8.88 O ATOM 2004 CB VAL A 126 -7.088 9.643 6.614 1.00 9.46 C ATOM 2005 CG1 VAL A 126 -7.945 9.821 7.859 1.00 10.20 C ATOM 2006 CG2 VAL A 126 -6.717 10.992 6.016 1.00 10.10 C ATOM 0 H VAL A 126 -5.213 9.354 5.002 1.00 8.22 H new ATOM 0 HA VAL A 126 -5.288 9.302 7.761 1.00 8.90 H new ATOM 0 HB VAL A 126 -7.673 9.092 5.878 1.00 9.46 H new ATOM 0 HG11 VAL A 126 -8.834 10.399 7.609 1.00 10.20 H new ATOM 0 HG12 VAL A 126 -8.243 8.844 8.239 1.00 10.20 H new ATOM 0 HG13 VAL A 126 -7.373 10.348 8.622 1.00 10.20 H new ATOM 0 HG21 VAL A 126 -7.624 11.554 5.795 1.00 10.10 H new ATOM 0 HG22 VAL A 126 -6.108 11.550 6.727 1.00 10.10 H new ATOM 0 HG23 VAL A 126 -6.152 10.839 5.097 1.00 10.10 H new ATOM 2016 N MET A 127 -6.546 6.591 6.356 1.00 7.45 N ATOM 2017 CA MET A 127 -6.960 5.222 6.627 1.00 7.01 C ATOM 2018 C MET A 127 -5.843 4.456 7.320 1.00 6.90 C ATOM 2019 O MET A 127 -6.073 3.740 8.294 1.00 7.35 O ATOM 2020 CB MET A 127 -7.345 4.510 5.330 1.00 6.01 C ATOM 2021 CG MET A 127 -8.129 3.227 5.555 1.00 5.80 C ATOM 2022 SD MET A 127 -7.883 2.022 4.237 1.00 4.71 S ATOM 2023 CE MET A 127 -6.217 1.468 4.597 1.00 4.35 C ATOM 0 H MET A 127 -6.527 6.842 5.368 1.00 7.45 H new ATOM 0 HA MET A 127 -7.829 5.255 7.284 1.00 7.01 H new ATOM 0 HB2 MET A 127 -7.939 5.187 4.715 1.00 6.01 H new ATOM 0 HB3 MET A 127 -6.440 4.280 4.768 1.00 6.01 H new ATOM 0 HG2 MET A 127 -7.830 2.786 6.506 1.00 5.80 H new ATOM 0 HG3 MET A 127 -9.190 3.463 5.632 1.00 5.80 H new ATOM 0 HE1 MET A 127 -5.963 0.631 3.946 1.00 4.35 H new ATOM 0 HE2 MET A 127 -5.517 2.286 4.427 1.00 4.35 H new ATOM 0 HE3 MET A 127 -6.156 1.149 5.638 1.00 4.35 H new ATOM 2033 N PHE A 128 -4.622 4.642 6.830 1.00 6.45 N ATOM 2034 CA PHE A 128 -3.470 3.955 7.387 1.00 6.34 C ATOM 2035 C PHE A 128 -3.096 4.554 8.735 1.00 7.39 C ATOM 2036 O PHE A 128 -2.463 3.900 9.564 1.00 7.66 O ATOM 2037 CB PHE A 128 -2.286 4.021 6.423 1.00 5.52 C ATOM 2038 CG PHE A 128 -2.372 3.033 5.294 1.00 4.45 C ATOM 2039 CD1 PHE A 128 -3.114 3.320 4.159 1.00 4.02 C ATOM 2040 CD2 PHE A 128 -1.713 1.817 5.369 1.00 4.07 C ATOM 2041 CE1 PHE A 128 -3.195 2.413 3.120 1.00 3.10 C ATOM 2042 CE2 PHE A 128 -1.790 0.906 4.334 1.00 3.27 C ATOM 2043 CZ PHE A 128 -2.529 1.202 3.207 1.00 2.70 C ATOM 0 H PHE A 128 -4.408 5.263 6.049 1.00 6.45 H new ATOM 0 HA PHE A 128 -3.732 2.907 7.535 1.00 6.34 H new ATOM 0 HB2 PHE A 128 -2.221 5.027 6.009 1.00 5.52 H new ATOM 0 HB3 PHE A 128 -1.365 3.845 6.979 1.00 5.52 H new ATOM 0 HD1 PHE A 128 -3.635 4.263 4.086 1.00 4.02 H new ATOM 0 HD2 PHE A 128 -1.132 1.578 6.248 1.00 4.07 H new ATOM 0 HE1 PHE A 128 -3.777 2.648 2.241 1.00 3.10 H new ATOM 0 HE2 PHE A 128 -1.272 -0.039 4.407 1.00 3.27 H new ATOM 0 HZ PHE A 128 -2.588 0.492 2.396 1.00 2.70 H new ATOM 2053 N SER A 129 -3.491 5.806 8.945 1.00 8.07 N ATOM 2054 CA SER A 129 -3.194 6.501 10.189 1.00 9.09 C ATOM 2055 C SER A 129 -3.866 5.801 11.363 1.00 9.73 C ATOM 2056 O SER A 129 -3.422 5.922 12.504 1.00 10.48 O ATOM 2057 CB SER A 129 -3.653 7.959 10.111 1.00 9.77 C ATOM 2058 OG SER A 129 -3.352 8.652 11.310 1.00 10.65 O ATOM 0 H SER A 129 -4.018 6.359 8.268 1.00 8.07 H new ATOM 0 HA SER A 129 -2.115 6.483 10.343 1.00 9.09 H new ATOM 0 HB2 SER A 129 -3.166 8.452 9.270 1.00 9.77 H new ATOM 0 HB3 SER A 129 -4.726 7.996 9.925 1.00 9.77 H new ATOM 0 HG SER A 129 -3.653 9.581 11.235 1.00 10.65 H new ATOM 2064 N SER A 130 -4.939 5.071 11.073 1.00 9.49 N ATOM 2065 CA SER A 130 -5.667 4.348 12.108 1.00 10.16 C ATOM 2066 C SER A 130 -4.749 3.355 12.809 1.00 10.26 C ATOM 2067 O SER A 130 -4.987 2.973 13.955 1.00 11.09 O ATOM 2068 CB SER A 130 -6.866 3.614 11.505 1.00 9.81 C ATOM 2069 OG SER A 130 -7.585 2.908 12.501 1.00 10.25 O ATOM 0 H SER A 130 -5.322 4.965 10.133 1.00 9.49 H new ATOM 0 HA SER A 130 -6.029 5.070 12.840 1.00 10.16 H new ATOM 0 HB2 SER A 130 -7.526 4.330 11.015 1.00 9.81 H new ATOM 0 HB3 SER A 130 -6.523 2.919 10.738 1.00 9.81 H new ATOM 0 HG SER A 130 -8.347 2.449 12.091 1.00 10.25 H new ATOM 2075 N PHE A 131 -3.696 2.940 12.108 1.00 9.46 N ATOM 2076 CA PHE A 131 -2.740 1.988 12.652 1.00 9.57 C ATOM 2077 C PHE A 131 -1.567 2.697 13.321 1.00 9.98 C ATOM 2078 O PHE A 131 -1.412 2.639 14.540 1.00 10.80 O ATOM 2079 CB PHE A 131 -2.227 1.071 11.540 1.00 8.58 C ATOM 2080 CG PHE A 131 -3.296 0.648 10.573 1.00 8.00 C ATOM 2081 CD1 PHE A 131 -4.459 0.050 11.028 1.00 8.07 C ATOM 2082 CD2 PHE A 131 -3.136 0.844 9.210 1.00 7.49 C ATOM 2083 CE1 PHE A 131 -5.443 -0.344 10.143 1.00 7.58 C ATOM 2084 CE2 PHE A 131 -4.116 0.452 8.321 1.00 6.97 C ATOM 2085 CZ PHE A 131 -5.270 -0.126 8.779 1.00 6.97 C ATOM 0 H PHE A 131 -3.486 3.251 11.160 1.00 9.46 H new ATOM 0 HA PHE A 131 -3.251 1.394 13.409 1.00 9.57 H new ATOM 0 HB2 PHE A 131 -1.435 1.583 10.993 1.00 8.58 H new ATOM 0 HB3 PHE A 131 -1.781 0.183 11.988 1.00 8.58 H new ATOM 0 HD1 PHE A 131 -4.598 -0.110 12.087 1.00 8.07 H new ATOM 0 HD2 PHE A 131 -2.234 1.309 8.840 1.00 7.49 H new ATOM 0 HE1 PHE A 131 -6.342 -0.819 10.507 1.00 7.58 H new ATOM 0 HE2 PHE A 131 -3.973 0.601 7.261 1.00 6.97 H new ATOM 0 HZ PHE A 131 -6.045 -0.412 8.083 1.00 6.97 H new ATOM 2095 N GLY A 132 -0.747 3.369 12.516 1.00 9.45 N ATOM 2096 CA GLY A 132 0.405 4.067 13.055 1.00 9.82 C ATOM 2097 C GLY A 132 0.715 5.351 12.312 1.00 9.42 C ATOM 2098 O GLY A 132 -0.191 6.095 11.933 1.00 9.41 O ATOM 0 H GLY A 132 -0.860 3.442 11.505 1.00 9.45 H new ATOM 0 HA2 GLY A 132 0.227 4.295 14.106 1.00 9.82 H new ATOM 0 HA3 GLY A 132 1.274 3.410 13.014 1.00 9.82 H new ATOM 2102 N GLN A 133 2.002 5.611 12.106 1.00 9.20 N ATOM 2103 CA GLN A 133 2.441 6.814 11.406 1.00 8.95 C ATOM 2104 C GLN A 133 2.816 6.500 9.961 1.00 7.78 C ATOM 2105 O GLN A 133 3.529 5.534 9.689 1.00 7.16 O ATOM 2106 CB GLN A 133 3.633 7.440 12.137 1.00 9.43 C ATOM 2107 CG GLN A 133 4.289 8.580 11.375 1.00 9.26 C ATOM 2108 CD GLN A 133 3.326 9.707 11.056 1.00 9.65 C ATOM 2109 OE1 GLN A 133 2.379 9.961 11.801 1.00 10.41 O ATOM 2110 NE2 GLN A 133 3.563 10.388 9.941 1.00 9.25 N ATOM 0 H GLN A 133 2.761 5.004 12.414 1.00 9.20 H new ATOM 0 HA GLN A 133 1.614 7.524 11.395 1.00 8.95 H new ATOM 0 HB2 GLN A 133 3.300 7.808 13.107 1.00 9.43 H new ATOM 0 HB3 GLN A 133 4.377 6.667 12.328 1.00 9.43 H new ATOM 0 HG2 GLN A 133 5.119 8.973 11.962 1.00 9.26 H new ATOM 0 HG3 GLN A 133 4.710 8.195 10.446 1.00 9.26 H new ATOM 0 HE21 GLN A 133 4.360 10.143 9.353 1.00 9.25 H new ATOM 0 HE22 GLN A 133 2.948 11.156 9.672 1.00 9.25 H new ATOM 2119 N ILE A 134 2.326 7.322 9.038 1.00 7.58 N ATOM 2120 CA ILE A 134 2.606 7.138 7.618 1.00 6.58 C ATOM 2121 C ILE A 134 3.714 8.077 7.158 1.00 6.62 C ATOM 2122 O ILE A 134 3.661 9.285 7.396 1.00 7.42 O ATOM 2123 CB ILE A 134 1.340 7.368 6.761 1.00 6.45 C ATOM 2124 CG1 ILE A 134 0.425 6.147 6.834 1.00 6.02 C ATOM 2125 CG2 ILE A 134 1.701 7.676 5.311 1.00 5.90 C ATOM 2126 CD1 ILE A 134 -0.214 5.957 8.190 1.00 6.94 C ATOM 0 H ILE A 134 1.732 8.124 9.249 1.00 7.58 H new ATOM 0 HA ILE A 134 2.934 6.107 7.483 1.00 6.58 H new ATOM 0 HB ILE A 134 0.812 8.232 7.164 1.00 6.45 H new ATOM 0 HG12 ILE A 134 -0.358 6.243 6.082 1.00 6.02 H new ATOM 0 HG13 ILE A 134 1.000 5.256 6.583 1.00 6.02 H new ATOM 0 HG21 ILE A 134 0.789 7.833 4.734 1.00 5.90 H new ATOM 0 HG22 ILE A 134 2.314 8.576 5.272 1.00 5.90 H new ATOM 0 HG23 ILE A 134 2.258 6.839 4.889 1.00 5.90 H new ATOM 0 HD11 ILE A 134 -0.851 5.072 8.172 1.00 6.94 H new ATOM 0 HD12 ILE A 134 0.563 5.829 8.944 1.00 6.94 H new ATOM 0 HD13 ILE A 134 -0.816 6.832 8.434 1.00 6.94 H new ATOM 2138 N GLU A 135 4.715 7.512 6.496 1.00 5.83 N ATOM 2139 CA GLU A 135 5.838 8.294 5.998 1.00 5.88 C ATOM 2140 C GLU A 135 5.510 8.908 4.645 1.00 5.91 C ATOM 2141 O GLU A 135 5.810 10.074 4.394 1.00 6.67 O ATOM 2142 CB GLU A 135 7.085 7.423 5.890 1.00 5.10 C ATOM 2143 CG GLU A 135 7.745 7.159 7.231 1.00 5.50 C ATOM 2144 CD GLU A 135 8.260 8.425 7.888 1.00 6.06 C ATOM 2145 OE1 GLU A 135 7.482 9.072 8.620 1.00 6.66 O ATOM 2146 OE2 GLU A 135 9.440 8.768 7.670 1.00 6.00 O ATOM 0 H GLU A 135 4.772 6.514 6.291 1.00 5.83 H new ATOM 0 HA GLU A 135 6.031 9.100 6.705 1.00 5.88 H new ATOM 0 HB2 GLU A 135 6.818 6.472 5.430 1.00 5.10 H new ATOM 0 HB3 GLU A 135 7.803 7.907 5.228 1.00 5.10 H new ATOM 0 HG2 GLU A 135 7.029 6.675 7.895 1.00 5.50 H new ATOM 0 HG3 GLU A 135 8.573 6.463 7.094 1.00 5.50 H new ATOM 2153 N GLU A 136 4.895 8.115 3.774 1.00 5.21 N ATOM 2154 CA GLU A 136 4.526 8.593 2.448 1.00 5.43 C ATOM 2155 C GLU A 136 3.221 7.960 1.979 1.00 5.05 C ATOM 2156 O GLU A 136 2.980 6.773 2.197 1.00 4.20 O ATOM 2157 CB GLU A 136 5.643 8.293 1.446 1.00 5.17 C ATOM 2158 CG GLU A 136 5.466 8.998 0.112 1.00 5.90 C ATOM 2159 CD GLU A 136 6.626 8.754 -0.834 1.00 5.96 C ATOM 2160 OE1 GLU A 136 7.788 8.862 -0.387 1.00 6.14 O ATOM 2161 OE2 GLU A 136 6.373 8.454 -2.018 1.00 5.95 O ATOM 0 H GLU A 136 4.643 7.144 3.961 1.00 5.21 H new ATOM 0 HA GLU A 136 4.380 9.672 2.508 1.00 5.43 H new ATOM 0 HB2 GLU A 136 6.598 8.588 1.880 1.00 5.17 H new ATOM 0 HB3 GLU A 136 5.689 7.217 1.276 1.00 5.17 H new ATOM 0 HG2 GLU A 136 4.542 8.657 -0.356 1.00 5.90 H new ATOM 0 HG3 GLU A 136 5.360 10.069 0.282 1.00 5.90 H new ATOM 2168 N CYS A 137 2.380 8.766 1.340 1.00 5.74 N ATOM 2169 CA CYS A 137 1.103 8.290 0.824 1.00 5.52 C ATOM 2170 C CYS A 137 1.000 8.592 -0.663 1.00 5.95 C ATOM 2171 O CYS A 137 1.186 9.733 -1.086 1.00 6.88 O ATOM 2172 CB CYS A 137 -0.056 8.945 1.575 1.00 6.14 C ATOM 2173 SG CYS A 137 0.028 10.750 1.639 1.00 7.54 S ATOM 0 H CYS A 137 2.561 9.755 1.167 1.00 5.74 H new ATOM 0 HA CYS A 137 1.046 7.212 0.974 1.00 5.52 H new ATOM 0 HB2 CYS A 137 -0.993 8.653 1.101 1.00 6.14 H new ATOM 0 HB3 CYS A 137 -0.080 8.557 2.593 1.00 6.14 H new ATOM 0 HG CYS A 137 -0.716 11.253 0.699 1.00 7.54 H new ATOM 2179 N ARG A 138 0.715 7.565 -1.457 1.00 5.43 N ATOM 2180 CA ARG A 138 0.613 7.734 -2.900 1.00 6.08 C ATOM 2181 C ARG A 138 -0.572 6.967 -3.473 1.00 5.90 C ATOM 2182 O ARG A 138 -0.892 5.865 -3.029 1.00 5.02 O ATOM 2183 CB ARG A 138 1.902 7.271 -3.581 1.00 6.07 C ATOM 2184 CG ARG A 138 3.018 6.915 -2.612 1.00 5.34 C ATOM 2185 CD ARG A 138 4.222 6.336 -3.334 1.00 5.40 C ATOM 2186 NE ARG A 138 5.266 5.909 -2.405 1.00 4.64 N ATOM 2187 CZ ARG A 138 6.518 5.648 -2.770 1.00 4.78 C ATOM 2188 NH1 ARG A 138 6.881 5.761 -4.041 1.00 5.71 N ATOM 2189 NH2 ARG A 138 7.409 5.273 -1.863 1.00 4.08 N ATOM 0 H ARG A 138 0.552 6.614 -1.128 1.00 5.43 H new ATOM 0 HA ARG A 138 0.458 8.795 -3.095 1.00 6.08 H new ATOM 0 HB2 ARG A 138 1.682 6.402 -4.201 1.00 6.07 H new ATOM 0 HB3 ARG A 138 2.252 8.059 -4.249 1.00 6.07 H new ATOM 0 HG2 ARG A 138 3.318 7.805 -2.059 1.00 5.34 H new ATOM 0 HG3 ARG A 138 2.650 6.195 -1.881 1.00 5.34 H new ATOM 0 HD2 ARG A 138 3.907 5.487 -3.940 1.00 5.40 H new ATOM 0 HD3 ARG A 138 4.628 7.082 -4.017 1.00 5.40 H new ATOM 0 HE ARG A 138 5.021 5.805 -1.420 1.00 4.64 H new ATOM 0 HH11 ARG A 138 6.199 6.049 -4.743 1.00 5.71 H new ATOM 0 HH12 ARG A 138 7.842 5.560 -4.317 1.00 5.71 H new ATOM 0 HH21 ARG A 138 7.135 5.184 -0.885 1.00 4.08 H new ATOM 0 HH22 ARG A 138 8.369 5.073 -2.143 1.00 4.08 H new ATOM 2203 N ILE A 139 -1.214 7.566 -4.466 1.00 6.77 N ATOM 2204 CA ILE A 139 -2.349 6.952 -5.139 1.00 6.80 C ATOM 2205 C ILE A 139 -2.209 7.110 -6.640 1.00 7.75 C ATOM 2206 O ILE A 139 -1.661 8.101 -7.124 1.00 8.55 O ATOM 2207 CB ILE A 139 -3.714 7.528 -4.672 1.00 6.95 C ATOM 2208 CG1 ILE A 139 -4.356 6.555 -3.672 1.00 5.96 C ATOM 2209 CG2 ILE A 139 -4.645 7.799 -5.860 1.00 7.85 C ATOM 2210 CD1 ILE A 139 -5.869 6.624 -3.600 1.00 6.13 C ATOM 0 H ILE A 139 -0.964 8.487 -4.826 1.00 6.77 H new ATOM 0 HA ILE A 139 -2.341 5.895 -4.871 1.00 6.80 H new ATOM 0 HB ILE A 139 -3.544 8.486 -4.181 1.00 6.95 H new ATOM 0 HG12 ILE A 139 -4.065 5.539 -3.937 1.00 5.96 H new ATOM 0 HG13 ILE A 139 -3.950 6.754 -2.680 1.00 5.96 H new ATOM 0 HG21 ILE A 139 -5.591 8.201 -5.497 1.00 7.85 H new ATOM 0 HG22 ILE A 139 -4.178 8.520 -6.531 1.00 7.85 H new ATOM 0 HG23 ILE A 139 -4.829 6.869 -6.398 1.00 7.85 H new ATOM 0 HD11 ILE A 139 -6.232 5.902 -2.868 1.00 6.13 H new ATOM 0 HD12 ILE A 139 -6.174 7.627 -3.302 1.00 6.13 H new ATOM 0 HD13 ILE A 139 -6.291 6.393 -4.578 1.00 6.13 H new ATOM 2222 N LEU A 140 -2.706 6.131 -7.372 1.00 7.74 N ATOM 2223 CA LEU A 140 -2.645 6.171 -8.815 1.00 8.72 C ATOM 2224 C LEU A 140 -4.054 6.149 -9.377 1.00 9.04 C ATOM 2225 O LEU A 140 -4.850 5.227 -9.108 1.00 8.48 O ATOM 2226 CB LEU A 140 -1.846 4.982 -9.344 1.00 8.72 C ATOM 2227 CG LEU A 140 -0.555 4.678 -8.583 1.00 8.18 C ATOM 2228 CD1 LEU A 140 0.079 3.397 -9.099 1.00 8.31 C ATOM 2229 CD2 LEU A 140 0.421 5.841 -8.695 1.00 8.71 C ATOM 0 H LEU A 140 -3.156 5.300 -6.988 1.00 7.74 H new ATOM 0 HA LEU A 140 -2.145 7.087 -9.130 1.00 8.72 H new ATOM 0 HB2 LEU A 140 -2.482 4.097 -9.318 1.00 8.72 H new ATOM 0 HB3 LEU A 140 -1.598 5.167 -10.389 1.00 8.72 H new ATOM 0 HG LEU A 140 -0.802 4.540 -7.530 1.00 8.18 H new ATOM 0 HD11 LEU A 140 0.997 3.197 -8.546 1.00 8.31 H new ATOM 0 HD12 LEU A 140 -0.615 2.567 -8.964 1.00 8.31 H new ATOM 0 HD13 LEU A 140 0.311 3.507 -10.158 1.00 8.31 H new ATOM 0 HD21 LEU A 140 1.333 5.605 -8.147 1.00 8.71 H new ATOM 0 HD22 LEU A 140 0.662 6.014 -9.744 1.00 8.71 H new ATOM 0 HD23 LEU A 140 -0.033 6.739 -8.275 1.00 8.71 H new ATOM 2241 N ARG A 141 -4.324 7.190 -10.160 1.00 9.99 N ATOM 2242 CA ARG A 141 -5.610 7.412 -10.797 1.00 10.47 C ATOM 2243 C ARG A 141 -5.416 7.855 -12.248 1.00 11.63 C ATOM 2244 O ARG A 141 -4.426 8.514 -12.568 1.00 12.15 O ATOM 2245 CB ARG A 141 -6.406 8.468 -10.026 1.00 10.48 C ATOM 2246 CG ARG A 141 -5.605 9.712 -9.685 1.00 10.88 C ATOM 2247 CD ARG A 141 -6.508 10.925 -9.530 1.00 11.35 C ATOM 2248 NE ARG A 141 -7.687 10.634 -8.718 1.00 11.42 N ATOM 2249 CZ ARG A 141 -8.137 11.438 -7.762 1.00 11.99 C ATOM 2250 NH1 ARG A 141 -7.503 12.570 -7.489 1.00 12.56 N ATOM 2251 NH2 ARG A 141 -9.223 11.111 -7.075 1.00 12.08 N ATOM 0 H ARG A 141 -3.638 7.915 -10.371 1.00 9.99 H new ATOM 0 HA ARG A 141 -6.168 6.476 -10.790 1.00 10.47 H new ATOM 0 HB2 ARG A 141 -7.275 8.758 -10.617 1.00 10.48 H new ATOM 0 HB3 ARG A 141 -6.781 8.025 -9.104 1.00 10.48 H new ATOM 0 HG2 ARG A 141 -5.051 9.548 -8.761 1.00 10.88 H new ATOM 0 HG3 ARG A 141 -4.871 9.900 -10.468 1.00 10.88 H new ATOM 0 HD2 ARG A 141 -5.945 11.739 -9.072 1.00 11.35 H new ATOM 0 HD3 ARG A 141 -6.823 11.270 -10.515 1.00 11.35 H new ATOM 0 HE ARG A 141 -8.192 9.766 -8.895 1.00 11.42 H new ATOM 0 HH11 ARG A 141 -6.667 12.826 -8.014 1.00 12.56 H new ATOM 0 HH12 ARG A 141 -7.852 13.185 -6.754 1.00 12.56 H new ATOM 0 HH21 ARG A 141 -9.714 10.241 -7.281 1.00 12.08 H new ATOM 0 HH22 ARG A 141 -9.568 11.730 -6.341 1.00 12.08 H new ATOM 2265 N GLY A 142 -6.352 7.496 -13.121 1.00 12.05 N ATOM 2266 CA GLY A 142 -6.234 7.879 -14.519 1.00 13.16 C ATOM 2267 C GLY A 142 -7.311 8.866 -14.945 1.00 13.83 C ATOM 2268 O GLY A 142 -8.409 8.858 -14.394 1.00 13.45 O ATOM 0 H GLY A 142 -7.183 6.952 -12.890 1.00 12.05 H new ATOM 0 HA2 GLY A 142 -5.252 8.321 -14.690 1.00 13.16 H new ATOM 0 HA3 GLY A 142 -6.295 6.987 -15.143 1.00 13.16 H new ATOM 2272 N PRO A 143 -7.018 9.738 -15.930 1.00 14.87 N ATOM 2273 CA PRO A 143 -7.976 10.744 -16.407 1.00 15.64 C ATOM 2274 C PRO A 143 -9.093 10.150 -17.260 1.00 15.86 C ATOM 2275 O PRO A 143 -9.803 10.878 -17.956 1.00 16.55 O ATOM 2276 CB PRO A 143 -7.110 11.683 -17.245 1.00 16.66 C ATOM 2277 CG PRO A 143 -5.999 10.826 -17.740 1.00 16.59 C ATOM 2278 CD PRO A 143 -5.733 9.817 -16.655 1.00 15.42 C ATOM 0 HA PRO A 143 -8.491 11.230 -15.579 1.00 15.64 H new ATOM 0 HB2 PRO A 143 -7.677 12.114 -18.071 1.00 16.66 H new ATOM 0 HB3 PRO A 143 -6.734 12.514 -16.648 1.00 16.66 H new ATOM 0 HG2 PRO A 143 -6.274 10.332 -18.672 1.00 16.59 H new ATOM 0 HG3 PRO A 143 -5.109 11.421 -17.945 1.00 16.59 H new ATOM 0 HD2 PRO A 143 -5.446 8.850 -17.068 1.00 15.42 H new ATOM 0 HD3 PRO A 143 -4.922 10.137 -16.000 1.00 15.42 H new ATOM 2286 N ASP A 144 -9.249 8.833 -17.207 1.00 15.31 N ATOM 2287 CA ASP A 144 -10.290 8.157 -17.975 1.00 15.50 C ATOM 2288 C ASP A 144 -11.669 8.554 -17.460 1.00 15.23 C ATOM 2289 O ASP A 144 -12.668 8.457 -18.173 1.00 15.58 O ATOM 2290 CB ASP A 144 -10.116 6.641 -17.887 1.00 14.89 C ATOM 2291 CG ASP A 144 -8.732 6.191 -18.311 1.00 15.23 C ATOM 2292 OD1 ASP A 144 -7.820 6.187 -17.456 1.00 15.02 O ATOM 2293 OD2 ASP A 144 -8.558 5.842 -19.498 1.00 15.79 O ATOM 0 H ASP A 144 -8.670 8.212 -16.642 1.00 15.31 H new ATOM 0 HA ASP A 144 -10.202 8.461 -19.018 1.00 15.50 H new ATOM 0 HB2 ASP A 144 -10.303 6.316 -16.864 1.00 14.89 H new ATOM 0 HB3 ASP A 144 -10.861 6.156 -18.517 1.00 14.89 H new ATOM 2298 N GLY A 145 -11.706 9.005 -16.210 1.00 14.64 N ATOM 2299 CA GLY A 145 -12.951 9.417 -15.593 1.00 14.42 C ATOM 2300 C GLY A 145 -12.962 9.107 -14.111 1.00 13.31 C ATOM 2301 O GLY A 145 -13.782 9.633 -13.358 1.00 13.11 O ATOM 0 H GLY A 145 -10.886 9.092 -15.609 1.00 14.64 H new ATOM 0 HA2 GLY A 145 -13.097 10.487 -15.744 1.00 14.42 H new ATOM 0 HA3 GLY A 145 -13.785 8.910 -16.079 1.00 14.42 H new ATOM 2305 N LEU A 146 -12.036 8.247 -13.702 1.00 12.64 N ATOM 2306 CA LEU A 146 -11.913 7.846 -12.307 1.00 11.55 C ATOM 2307 C LEU A 146 -10.516 7.297 -12.033 1.00 11.12 C ATOM 2308 O LEU A 146 -9.686 7.217 -12.938 1.00 11.67 O ATOM 2309 CB LEU A 146 -12.979 6.799 -11.944 1.00 10.90 C ATOM 2310 CG LEU A 146 -13.152 5.617 -12.917 1.00 11.20 C ATOM 2311 CD1 LEU A 146 -13.881 6.051 -14.179 1.00 12.22 C ATOM 2312 CD2 LEU A 146 -11.808 4.992 -13.266 1.00 11.35 C ATOM 0 H LEU A 146 -11.354 7.811 -14.323 1.00 12.64 H new ATOM 0 HA LEU A 146 -12.072 8.726 -11.684 1.00 11.55 H new ATOM 0 HB2 LEU A 146 -12.738 6.396 -10.960 1.00 10.90 H new ATOM 0 HB3 LEU A 146 -13.939 7.308 -11.854 1.00 10.90 H new ATOM 0 HG LEU A 146 -13.758 4.863 -12.415 1.00 11.20 H new ATOM 0 HD11 LEU A 146 -13.990 5.198 -14.848 1.00 12.22 H new ATOM 0 HD12 LEU A 146 -14.867 6.434 -13.916 1.00 12.22 H new ATOM 0 HD13 LEU A 146 -13.310 6.833 -14.679 1.00 12.22 H new ATOM 0 HD21 LEU A 146 -11.961 4.161 -13.954 1.00 11.35 H new ATOM 0 HD22 LEU A 146 -11.170 5.740 -13.737 1.00 11.35 H new ATOM 0 HD23 LEU A 146 -11.329 4.627 -12.357 1.00 11.35 H new ATOM 2324 N SER A 147 -10.258 6.917 -10.789 1.00 10.17 N ATOM 2325 CA SER A 147 -8.962 6.370 -10.421 1.00 9.69 C ATOM 2326 C SER A 147 -8.801 4.946 -10.942 1.00 9.46 C ATOM 2327 O SER A 147 -9.675 4.103 -10.744 1.00 8.99 O ATOM 2328 CB SER A 147 -8.796 6.384 -8.900 1.00 8.75 C ATOM 2329 OG SER A 147 -7.542 5.846 -8.518 1.00 8.22 O ATOM 0 H SER A 147 -10.927 6.978 -10.021 1.00 10.17 H new ATOM 0 HA SER A 147 -8.192 6.994 -10.875 1.00 9.69 H new ATOM 0 HB2 SER A 147 -8.884 7.406 -8.531 1.00 8.75 H new ATOM 0 HB3 SER A 147 -9.598 5.808 -8.438 1.00 8.75 H new ATOM 0 HG SER A 147 -7.460 5.868 -7.542 1.00 8.22 H new ATOM 2335 N ARG A 148 -7.679 4.694 -11.623 1.00 9.89 N ATOM 2336 CA ARG A 148 -7.377 3.368 -12.154 1.00 9.93 C ATOM 2337 C ARG A 148 -7.674 2.316 -11.099 1.00 8.90 C ATOM 2338 O ARG A 148 -8.055 1.189 -11.410 1.00 8.92 O ATOM 2339 CB ARG A 148 -5.902 3.282 -12.556 1.00 10.37 C ATOM 2340 CG ARG A 148 -4.958 3.499 -11.385 1.00 9.67 C ATOM 2341 CD ARG A 148 -3.539 3.059 -11.697 1.00 9.77 C ATOM 2342 NE ARG A 148 -2.902 3.924 -12.687 1.00 10.74 N ATOM 2343 CZ ARG A 148 -1.726 3.662 -13.251 1.00 11.24 C ATOM 2344 NH1 ARG A 148 -1.061 2.562 -12.927 1.00 10.90 N ATOM 2345 NH2 ARG A 148 -1.215 4.501 -14.141 1.00 12.22 N ATOM 0 H ARG A 148 -6.965 5.396 -11.818 1.00 9.89 H new ATOM 0 HA ARG A 148 -7.997 3.192 -13.033 1.00 9.93 H new ATOM 0 HB2 ARG A 148 -5.707 2.305 -12.997 1.00 10.37 H new ATOM 0 HB3 ARG A 148 -5.696 4.026 -13.325 1.00 10.37 H new ATOM 0 HG2 ARG A 148 -4.957 4.555 -11.113 1.00 9.67 H new ATOM 0 HG3 ARG A 148 -5.325 2.948 -10.519 1.00 9.67 H new ATOM 0 HD2 ARG A 148 -2.949 3.062 -10.780 1.00 9.77 H new ATOM 0 HD3 ARG A 148 -3.550 2.033 -12.066 1.00 9.77 H new ATOM 0 HE ARG A 148 -3.387 4.778 -12.962 1.00 10.74 H new ATOM 0 HH11 ARG A 148 -1.451 1.913 -12.243 1.00 10.90 H new ATOM 0 HH12 ARG A 148 -0.160 2.364 -13.362 1.00 10.90 H new ATOM 0 HH21 ARG A 148 -1.724 5.348 -14.394 1.00 12.22 H new ATOM 0 HH22 ARG A 148 -0.313 4.299 -14.573 1.00 12.22 H new ATOM 2359 N GLY A 149 -7.485 2.709 -9.844 1.00 8.07 N ATOM 2360 CA GLY A 149 -7.744 1.821 -8.737 1.00 7.06 C ATOM 2361 C GLY A 149 -6.491 1.184 -8.174 1.00 6.63 C ATOM 2362 O GLY A 149 -6.522 0.018 -7.793 1.00 6.24 O ATOM 0 H GLY A 149 -7.154 3.636 -9.577 1.00 8.07 H new ATOM 0 HA2 GLY A 149 -8.248 2.376 -7.946 1.00 7.06 H new ATOM 0 HA3 GLY A 149 -8.428 1.037 -9.062 1.00 7.06 H new ATOM 2366 N CYS A 150 -5.381 1.930 -8.119 1.00 6.80 N ATOM 2367 CA CYS A 150 -4.145 1.372 -7.563 1.00 6.41 C ATOM 2368 C CYS A 150 -3.443 2.402 -6.688 1.00 5.95 C ATOM 2369 O CYS A 150 -3.474 3.587 -6.988 1.00 6.46 O ATOM 2370 CB CYS A 150 -3.217 0.889 -8.674 1.00 7.32 C ATOM 2371 SG CYS A 150 -4.075 0.128 -10.073 1.00 8.04 S ATOM 0 H CYS A 150 -5.313 2.895 -8.443 1.00 6.80 H new ATOM 0 HA CYS A 150 -4.407 0.513 -6.945 1.00 6.41 H new ATOM 0 HB2 CYS A 150 -2.631 1.734 -9.037 1.00 7.32 H new ATOM 0 HB3 CYS A 150 -2.513 0.168 -8.257 1.00 7.32 H new ATOM 0 HG CYS A 150 -3.205 -0.247 -10.963 1.00 8.04 H new ATOM 2377 N ALA A 151 -2.822 1.951 -5.597 1.00 5.10 N ATOM 2378 CA ALA A 151 -2.153 2.867 -4.675 1.00 4.66 C ATOM 2379 C ALA A 151 -0.905 2.273 -4.020 1.00 4.11 C ATOM 2380 O ALA A 151 -0.817 1.065 -3.799 1.00 3.84 O ATOM 2381 CB ALA A 151 -3.128 3.327 -3.614 1.00 4.12 C ATOM 0 H ALA A 151 -2.769 0.967 -5.333 1.00 5.10 H new ATOM 0 HA ALA A 151 -1.812 3.714 -5.270 1.00 4.66 H new ATOM 0 HB1 ALA A 151 -2.625 4.010 -2.929 1.00 4.12 H new ATOM 0 HB2 ALA A 151 -3.966 3.840 -4.087 1.00 4.12 H new ATOM 0 HB3 ALA A 151 -3.497 2.464 -3.060 1.00 4.12 H new ATOM 2387 N PHE A 152 0.056 3.147 -3.715 1.00 4.15 N ATOM 2388 CA PHE A 152 1.301 2.749 -3.061 1.00 3.65 C ATOM 2389 C PHE A 152 1.466 3.525 -1.751 1.00 3.07 C ATOM 2390 O PHE A 152 1.070 4.686 -1.657 1.00 3.60 O ATOM 2391 CB PHE A 152 2.500 3.003 -3.978 1.00 4.44 C ATOM 2392 CG PHE A 152 2.644 1.989 -5.078 1.00 5.27 C ATOM 2393 CD1 PHE A 152 1.791 2.008 -6.169 1.00 5.74 C ATOM 2394 CD2 PHE A 152 3.629 1.015 -5.019 1.00 5.76 C ATOM 2395 CE1 PHE A 152 1.918 1.078 -7.183 1.00 6.61 C ATOM 2396 CE2 PHE A 152 3.760 0.082 -6.030 1.00 6.72 C ATOM 2397 CZ PHE A 152 2.915 0.111 -7.109 1.00 7.13 C ATOM 0 H PHE A 152 -0.007 4.145 -3.914 1.00 4.15 H new ATOM 0 HA PHE A 152 1.257 1.682 -2.845 1.00 3.65 H new ATOM 0 HB2 PHE A 152 2.404 3.995 -4.420 1.00 4.44 H new ATOM 0 HB3 PHE A 152 3.410 3.008 -3.378 1.00 4.44 H new ATOM 0 HD1 PHE A 152 1.017 2.759 -6.228 1.00 5.74 H new ATOM 0 HD2 PHE A 152 4.301 0.985 -4.174 1.00 5.76 H new ATOM 0 HE1 PHE A 152 1.247 1.102 -8.029 1.00 6.61 H new ATOM 0 HE2 PHE A 152 4.531 -0.672 -5.970 1.00 6.72 H new ATOM 0 HZ PHE A 152 3.023 -0.616 -7.900 1.00 7.13 H new ATOM 2407 N VAL A 153 2.047 2.879 -0.742 1.00 2.26 N ATOM 2408 CA VAL A 153 2.226 3.500 0.571 1.00 2.07 C ATOM 2409 C VAL A 153 3.559 3.121 1.223 1.00 1.71 C ATOM 2410 O VAL A 153 4.082 2.030 1.007 1.00 1.46 O ATOM 2411 CB VAL A 153 1.073 3.133 1.537 1.00 1.96 C ATOM 2412 CG1 VAL A 153 1.383 3.581 2.959 1.00 2.68 C ATOM 2413 CG2 VAL A 153 -0.238 3.745 1.069 1.00 2.36 C ATOM 0 H VAL A 153 2.402 1.925 -0.808 1.00 2.26 H new ATOM 0 HA VAL A 153 2.222 4.575 0.391 1.00 2.07 H new ATOM 0 HB VAL A 153 0.973 2.048 1.535 1.00 1.96 H new ATOM 0 HG11 VAL A 153 0.555 3.310 3.614 1.00 2.68 H new ATOM 0 HG12 VAL A 153 2.294 3.092 3.304 1.00 2.68 H new ATOM 0 HG13 VAL A 153 1.521 4.662 2.978 1.00 2.68 H new ATOM 0 HG21 VAL A 153 -1.034 3.474 1.763 1.00 2.36 H new ATOM 0 HG22 VAL A 153 -0.141 4.830 1.034 1.00 2.36 H new ATOM 0 HG23 VAL A 153 -0.480 3.370 0.075 1.00 2.36 H new ATOM 2423 N THR A 154 4.097 4.045 2.015 1.00 2.20 N ATOM 2424 CA THR A 154 5.347 3.835 2.737 1.00 2.13 C ATOM 2425 C THR A 154 5.051 3.958 4.226 1.00 2.87 C ATOM 2426 O THR A 154 4.461 4.949 4.664 1.00 3.63 O ATOM 2427 CB THR A 154 6.414 4.872 2.330 1.00 2.53 C ATOM 2428 OG1 THR A 154 6.870 4.609 0.999 1.00 2.59 O ATOM 2429 CG2 THR A 154 7.598 4.857 3.286 1.00 2.45 C ATOM 0 H THR A 154 3.677 4.961 2.174 1.00 2.20 H new ATOM 0 HA THR A 154 5.743 2.848 2.496 1.00 2.13 H new ATOM 0 HB THR A 154 5.953 5.859 2.373 1.00 2.53 H new ATOM 0 HG1 THR A 154 7.277 3.718 0.963 1.00 2.59 H new ATOM 0 HG21 THR A 154 8.331 5.600 2.970 1.00 2.45 H new ATOM 0 HG22 THR A 154 7.255 5.092 4.294 1.00 2.45 H new ATOM 0 HG23 THR A 154 8.058 3.869 3.280 1.00 2.45 H new ATOM 2437 N PHE A 155 5.474 2.966 5.010 1.00 3.05 N ATOM 2438 CA PHE A 155 5.139 2.966 6.447 1.00 4.10 C ATOM 2439 C PHE A 155 6.347 2.882 7.378 1.00 4.59 C ATOM 2440 O PHE A 155 7.146 1.956 7.299 1.00 4.50 O ATOM 2441 CB PHE A 155 4.187 1.808 6.752 1.00 4.47 C ATOM 2442 CG PHE A 155 3.148 2.146 7.781 1.00 5.26 C ATOM 2443 CD1 PHE A 155 3.499 2.289 9.115 1.00 6.22 C ATOM 2444 CD2 PHE A 155 1.823 2.313 7.418 1.00 5.12 C ATOM 2445 CE1 PHE A 155 2.545 2.596 10.066 1.00 7.05 C ATOM 2446 CE2 PHE A 155 0.865 2.620 8.365 1.00 5.96 C ATOM 2447 CZ PHE A 155 1.225 2.777 9.684 1.00 6.93 C ATOM 0 H PHE A 155 6.032 2.173 4.695 1.00 3.05 H new ATOM 0 HA PHE A 155 4.669 3.930 6.643 1.00 4.10 H new ATOM 0 HB2 PHE A 155 3.690 1.504 5.831 1.00 4.47 H new ATOM 0 HB3 PHE A 155 4.767 0.953 7.099 1.00 4.47 H new ATOM 0 HD1 PHE A 155 4.529 2.159 9.414 1.00 6.22 H new ATOM 0 HD2 PHE A 155 1.535 2.202 6.383 1.00 5.12 H new ATOM 0 HE1 PHE A 155 2.827 2.695 11.104 1.00 7.05 H new ATOM 0 HE2 PHE A 155 -0.167 2.737 8.070 1.00 5.96 H new ATOM 0 HZ PHE A 155 0.480 3.041 10.420 1.00 6.93 H new ATOM 2457 N THR A 156 6.407 3.838 8.309 1.00 5.34 N ATOM 2458 CA THR A 156 7.488 3.946 9.294 1.00 5.91 C ATOM 2459 C THR A 156 8.132 2.604 9.652 1.00 6.07 C ATOM 2460 O THR A 156 9.214 2.281 9.164 1.00 5.70 O ATOM 2461 CB THR A 156 6.989 4.611 10.590 1.00 7.03 C ATOM 2462 OG1 THR A 156 5.819 3.937 11.070 1.00 7.51 O ATOM 2463 CG2 THR A 156 6.670 6.079 10.357 1.00 7.22 C ATOM 0 H THR A 156 5.699 4.567 8.401 1.00 5.34 H new ATOM 0 HA THR A 156 8.249 4.562 8.814 1.00 5.91 H new ATOM 0 HB THR A 156 7.782 4.539 11.335 1.00 7.03 H new ATOM 0 HG1 THR A 156 5.019 4.372 10.707 1.00 7.51 H new ATOM 0 HG21 THR A 156 6.319 6.527 11.287 1.00 7.22 H new ATOM 0 HG22 THR A 156 7.568 6.597 10.020 1.00 7.22 H new ATOM 0 HG23 THR A 156 5.894 6.166 9.597 1.00 7.22 H new ATOM 2471 N THR A 157 7.472 1.824 10.505 1.00 6.77 N ATOM 2472 CA THR A 157 8.016 0.540 10.925 1.00 7.26 C ATOM 2473 C THR A 157 7.405 -0.603 10.134 1.00 6.99 C ATOM 2474 O THR A 157 6.193 -0.656 9.925 1.00 6.85 O ATOM 2475 CB THR A 157 7.794 0.298 12.429 1.00 8.46 C ATOM 2476 OG1 THR A 157 6.424 0.531 12.766 1.00 8.78 O ATOM 2477 CG2 THR A 157 8.685 1.208 13.260 1.00 8.87 C ATOM 0 H THR A 157 6.568 2.058 10.915 1.00 6.77 H new ATOM 0 HA THR A 157 9.088 0.573 10.730 1.00 7.26 H new ATOM 0 HB THR A 157 8.051 -0.738 12.649 1.00 8.46 H new ATOM 0 HG1 THR A 157 6.291 0.373 13.724 1.00 8.78 H new ATOM 0 HG21 THR A 157 8.511 1.019 14.319 1.00 8.87 H new ATOM 0 HG22 THR A 157 9.730 1.009 13.023 1.00 8.87 H new ATOM 0 HG23 THR A 157 8.454 2.249 13.034 1.00 8.87 H new ATOM 2485 N ARG A 158 8.262 -1.518 9.697 1.00 7.05 N ATOM 2486 CA ARG A 158 7.829 -2.672 8.924 1.00 7.06 C ATOM 2487 C ARG A 158 6.766 -3.468 9.670 1.00 7.86 C ATOM 2488 O ARG A 158 5.749 -3.849 9.094 1.00 7.67 O ATOM 2489 CB ARG A 158 9.027 -3.564 8.613 1.00 7.38 C ATOM 2490 CG ARG A 158 9.939 -3.752 9.808 1.00 7.76 C ATOM 2491 CD ARG A 158 11.345 -3.249 9.525 1.00 8.64 C ATOM 2492 NE ARG A 158 11.360 -1.827 9.184 1.00 8.78 N ATOM 2493 CZ ARG A 158 12.447 -1.063 9.246 1.00 9.57 C ATOM 2494 NH1 ARG A 158 13.603 -1.581 9.638 1.00 10.24 N ATOM 2495 NH2 ARG A 158 12.378 0.220 8.917 1.00 9.80 N ATOM 0 H ARG A 158 9.267 -1.481 9.867 1.00 7.05 H new ATOM 0 HA ARG A 158 7.390 -2.314 7.993 1.00 7.06 H new ATOM 0 HB2 ARG A 158 8.672 -4.538 8.275 1.00 7.38 H new ATOM 0 HB3 ARG A 158 9.596 -3.129 7.791 1.00 7.38 H new ATOM 0 HG2 ARG A 158 9.528 -3.221 10.667 1.00 7.76 H new ATOM 0 HG3 ARG A 158 9.977 -4.808 10.075 1.00 7.76 H new ATOM 0 HD2 ARG A 158 11.974 -3.419 10.399 1.00 8.64 H new ATOM 0 HD3 ARG A 158 11.777 -3.823 8.705 1.00 8.64 H new ATOM 0 HE ARG A 158 10.486 -1.396 8.881 1.00 8.78 H new ATOM 0 HH11 ARG A 158 13.660 -2.567 9.893 1.00 10.24 H new ATOM 0 HH12 ARG A 158 14.435 -0.993 9.685 1.00 10.24 H new ATOM 0 HH21 ARG A 158 11.490 0.622 8.616 1.00 9.80 H new ATOM 0 HH22 ARG A 158 13.213 0.804 8.965 1.00 9.80 H new ATOM 2509 N ALA A 159 7.000 -3.708 10.959 1.00 8.79 N ATOM 2510 CA ALA A 159 6.053 -4.464 11.768 1.00 9.64 C ATOM 2511 C ALA A 159 4.676 -3.816 11.730 1.00 9.32 C ATOM 2512 O ALA A 159 3.670 -4.489 11.497 1.00 9.45 O ATOM 2513 CB ALA A 159 6.552 -4.574 13.200 1.00 10.64 C ATOM 0 H ALA A 159 7.830 -3.392 11.460 1.00 8.79 H new ATOM 0 HA ALA A 159 5.968 -5.468 11.352 1.00 9.64 H new ATOM 0 HB1 ALA A 159 5.834 -5.141 13.793 1.00 10.64 H new ATOM 0 HB2 ALA A 159 7.515 -5.084 13.211 1.00 10.64 H new ATOM 0 HB3 ALA A 159 6.664 -3.576 13.624 1.00 10.64 H new ATOM 2519 N MET A 160 4.642 -2.502 11.923 1.00 8.95 N ATOM 2520 CA MET A 160 3.386 -1.766 11.902 1.00 8.73 C ATOM 2521 C MET A 160 2.763 -1.852 10.520 1.00 7.79 C ATOM 2522 O MET A 160 1.541 -1.882 10.376 1.00 7.78 O ATOM 2523 CB MET A 160 3.607 -0.305 12.294 1.00 8.63 C ATOM 2524 CG MET A 160 2.423 0.316 13.014 1.00 9.38 C ATOM 2525 SD MET A 160 1.981 -0.581 14.516 1.00 10.41 S ATOM 2526 CE MET A 160 0.644 0.434 15.137 1.00 11.44 C ATOM 0 H MET A 160 5.467 -1.928 12.095 1.00 8.95 H new ATOM 0 HA MET A 160 2.708 -2.213 12.629 1.00 8.73 H new ATOM 0 HB2 MET A 160 4.487 -0.238 12.934 1.00 8.63 H new ATOM 0 HB3 MET A 160 3.821 0.275 11.396 1.00 8.63 H new ATOM 0 HG2 MET A 160 2.657 1.350 13.268 1.00 9.38 H new ATOM 0 HG3 MET A 160 1.565 0.339 12.342 1.00 9.38 H new ATOM 0 HE1 MET A 160 0.335 0.070 16.117 1.00 11.44 H new ATOM 0 HE2 MET A 160 0.981 1.467 15.224 1.00 11.44 H new ATOM 0 HE3 MET A 160 -0.200 0.384 14.449 1.00 11.44 H new ATOM 2536 N ALA A 161 3.615 -1.906 9.503 1.00 7.04 N ATOM 2537 CA ALA A 161 3.147 -2.009 8.135 1.00 6.16 C ATOM 2538 C ALA A 161 2.414 -3.325 7.946 1.00 6.64 C ATOM 2539 O ALA A 161 1.376 -3.387 7.284 1.00 6.28 O ATOM 2540 CB ALA A 161 4.314 -1.903 7.166 1.00 5.48 C ATOM 0 H ALA A 161 4.630 -1.880 9.604 1.00 7.04 H new ATOM 0 HA ALA A 161 2.460 -1.188 7.929 1.00 6.16 H new ATOM 0 HB1 ALA A 161 3.946 -1.982 6.143 1.00 5.48 H new ATOM 0 HB2 ALA A 161 4.811 -0.942 7.299 1.00 5.48 H new ATOM 0 HB3 ALA A 161 5.022 -2.708 7.360 1.00 5.48 H new ATOM 2546 N GLN A 162 2.951 -4.374 8.566 1.00 7.56 N ATOM 2547 CA GLN A 162 2.359 -5.697 8.475 1.00 8.22 C ATOM 2548 C GLN A 162 0.977 -5.692 9.104 1.00 8.56 C ATOM 2549 O GLN A 162 0.097 -6.454 8.703 1.00 8.70 O ATOM 2550 CB GLN A 162 3.257 -6.725 9.162 1.00 9.22 C ATOM 2551 CG GLN A 162 4.610 -6.884 8.489 1.00 9.05 C ATOM 2552 CD GLN A 162 5.574 -7.719 9.305 1.00 10.06 C ATOM 2553 OE1 GLN A 162 5.169 -8.615 10.046 1.00 10.94 O ATOM 2554 NE2 GLN A 162 6.862 -7.427 9.173 1.00 9.99 N ATOM 0 H GLN A 162 3.796 -4.328 9.136 1.00 7.56 H new ATOM 0 HA GLN A 162 2.262 -5.971 7.424 1.00 8.22 H new ATOM 0 HB2 GLN A 162 3.408 -6.430 10.200 1.00 9.22 H new ATOM 0 HB3 GLN A 162 2.750 -7.690 9.175 1.00 9.22 H new ATOM 0 HG2 GLN A 162 4.473 -7.346 7.511 1.00 9.05 H new ATOM 0 HG3 GLN A 162 5.044 -5.899 8.318 1.00 9.05 H new ATOM 0 HE21 GLN A 162 7.153 -6.676 8.547 1.00 9.99 H new ATOM 0 HE22 GLN A 162 7.561 -7.954 9.697 1.00 9.99 H new ATOM 2563 N THR A 163 0.788 -4.817 10.085 1.00 8.76 N ATOM 2564 CA THR A 163 -0.494 -4.705 10.759 1.00 9.19 C ATOM 2565 C THR A 163 -1.575 -4.315 9.761 1.00 8.39 C ATOM 2566 O THR A 163 -2.679 -4.864 9.778 1.00 8.67 O ATOM 2567 CB THR A 163 -0.444 -3.671 11.904 1.00 9.62 C ATOM 2568 OG1 THR A 163 0.448 -4.120 12.931 1.00 10.45 O ATOM 2569 CG2 THR A 163 -1.827 -3.442 12.495 1.00 10.08 C ATOM 0 H THR A 163 1.505 -4.178 10.428 1.00 8.76 H new ATOM 0 HA THR A 163 -0.728 -5.678 11.192 1.00 9.19 H new ATOM 0 HB THR A 163 -0.083 -2.728 11.492 1.00 9.62 H new ATOM 0 HG1 THR A 163 0.476 -3.458 13.653 1.00 10.45 H new ATOM 0 HG21 THR A 163 -1.762 -2.709 13.299 1.00 10.08 H new ATOM 0 HG22 THR A 163 -2.497 -3.071 11.719 1.00 10.08 H new ATOM 0 HG23 THR A 163 -2.214 -4.381 12.890 1.00 10.08 H new ATOM 2577 N ALA A 164 -1.239 -3.379 8.873 1.00 7.40 N ATOM 2578 CA ALA A 164 -2.179 -2.919 7.861 1.00 6.57 C ATOM 2579 C ALA A 164 -2.656 -4.083 7.012 1.00 6.51 C ATOM 2580 O ALA A 164 -3.810 -4.128 6.586 1.00 6.33 O ATOM 2581 CB ALA A 164 -1.537 -1.861 6.980 1.00 5.56 C ATOM 0 H ALA A 164 -0.325 -2.928 8.837 1.00 7.40 H new ATOM 0 HA ALA A 164 -3.038 -2.479 8.367 1.00 6.57 H new ATOM 0 HB1 ALA A 164 -2.254 -1.529 6.229 1.00 5.56 H new ATOM 0 HB2 ALA A 164 -1.234 -1.012 7.593 1.00 5.56 H new ATOM 0 HB3 ALA A 164 -0.662 -2.282 6.485 1.00 5.56 H new ATOM 2587 N ILE A 165 -1.756 -5.035 6.783 1.00 6.81 N ATOM 2588 CA ILE A 165 -2.072 -6.204 5.983 1.00 7.06 C ATOM 2589 C ILE A 165 -3.247 -6.959 6.586 1.00 7.79 C ATOM 2590 O ILE A 165 -4.182 -7.335 5.882 1.00 7.66 O ATOM 2591 CB ILE A 165 -0.848 -7.140 5.876 1.00 7.65 C ATOM 2592 CG1 ILE A 165 0.297 -6.422 5.158 1.00 6.92 C ATOM 2593 CG2 ILE A 165 -1.209 -8.431 5.156 1.00 8.25 C ATOM 2594 CD1 ILE A 165 1.593 -7.205 5.138 1.00 7.54 C ATOM 0 H ILE A 165 -0.802 -5.016 7.143 1.00 6.81 H new ATOM 0 HA ILE A 165 -2.343 -5.866 4.983 1.00 7.06 H new ATOM 0 HB ILE A 165 -0.523 -7.402 6.883 1.00 7.65 H new ATOM 0 HG12 ILE A 165 -0.005 -6.212 4.132 1.00 6.92 H new ATOM 0 HG13 ILE A 165 0.471 -5.461 5.642 1.00 6.92 H new ATOM 0 HG21 ILE A 165 -0.329 -9.072 5.095 1.00 8.25 H new ATOM 0 HG22 ILE A 165 -1.996 -8.947 5.706 1.00 8.25 H new ATOM 0 HG23 ILE A 165 -1.561 -8.201 4.150 1.00 8.25 H new ATOM 0 HD11 ILE A 165 2.356 -6.632 4.612 1.00 7.54 H new ATOM 0 HD12 ILE A 165 1.920 -7.393 6.161 1.00 7.54 H new ATOM 0 HD13 ILE A 165 1.436 -8.155 4.627 1.00 7.54 H new ATOM 2606 N LYS A 166 -3.211 -7.148 7.898 1.00 8.61 N ATOM 2607 CA LYS A 166 -4.282 -7.851 8.587 1.00 9.40 C ATOM 2608 C LYS A 166 -5.569 -7.043 8.511 1.00 8.92 C ATOM 2609 O LYS A 166 -6.670 -7.595 8.506 1.00 9.17 O ATOM 2610 CB LYS A 166 -3.895 -8.100 10.048 1.00 10.41 C ATOM 2611 CG LYS A 166 -5.021 -8.670 10.897 1.00 11.21 C ATOM 2612 CD LYS A 166 -5.453 -10.041 10.411 1.00 11.56 C ATOM 2613 CE LYS A 166 -6.424 -10.693 11.381 1.00 12.63 C ATOM 2614 NZ LYS A 166 -6.878 -12.027 10.900 1.00 13.37 N ATOM 0 H LYS A 166 -2.456 -6.826 8.503 1.00 8.61 H new ATOM 0 HA LYS A 166 -4.444 -8.813 8.101 1.00 9.40 H new ATOM 0 HB2 LYS A 166 -3.049 -8.786 10.077 1.00 10.41 H new ATOM 0 HB3 LYS A 166 -3.560 -7.161 10.490 1.00 10.41 H new ATOM 0 HG2 LYS A 166 -4.695 -8.738 11.935 1.00 11.21 H new ATOM 0 HG3 LYS A 166 -5.873 -7.991 10.874 1.00 11.21 H new ATOM 0 HD2 LYS A 166 -5.921 -9.950 9.431 1.00 11.56 H new ATOM 0 HD3 LYS A 166 -4.577 -10.678 10.288 1.00 11.56 H new ATOM 0 HE2 LYS A 166 -5.946 -10.802 12.355 1.00 12.63 H new ATOM 0 HE3 LYS A 166 -7.288 -10.044 11.521 1.00 12.63 H new ATOM 0 HZ1 LYS A 166 -7.539 -12.438 11.590 1.00 13.37 H new ATOM 0 HZ2 LYS A 166 -7.356 -11.921 9.983 1.00 13.37 H new ATOM 0 HZ3 LYS A 166 -6.056 -12.655 10.791 1.00 13.37 H new ATOM 2628 N ALA A 167 -5.412 -5.726 8.448 1.00 8.28 N ATOM 2629 CA ALA A 167 -6.541 -4.812 8.378 1.00 7.90 C ATOM 2630 C ALA A 167 -7.165 -4.777 6.985 1.00 6.96 C ATOM 2631 O ALA A 167 -8.346 -4.465 6.840 1.00 6.80 O ATOM 2632 CB ALA A 167 -6.108 -3.417 8.796 1.00 7.77 C ATOM 0 H ALA A 167 -4.502 -5.265 8.444 1.00 8.28 H new ATOM 0 HA ALA A 167 -7.303 -5.177 9.066 1.00 7.90 H new ATOM 0 HB1 ALA A 167 -6.960 -2.740 8.740 1.00 7.77 H new ATOM 0 HB2 ALA A 167 -5.732 -3.444 9.819 1.00 7.77 H new ATOM 0 HB3 ALA A 167 -5.321 -3.065 8.129 1.00 7.77 H new ATOM 2638 N MET A 168 -6.369 -5.084 5.960 1.00 6.41 N ATOM 2639 CA MET A 168 -6.861 -5.055 4.584 1.00 5.59 C ATOM 2640 C MET A 168 -6.769 -6.425 3.919 1.00 6.06 C ATOM 2641 O MET A 168 -7.789 -7.032 3.589 1.00 6.21 O ATOM 2642 CB MET A 168 -6.077 -4.028 3.769 1.00 4.61 C ATOM 2643 CG MET A 168 -6.053 -2.651 4.406 1.00 4.37 C ATOM 2644 SD MET A 168 -7.704 -1.946 4.578 1.00 4.25 S ATOM 2645 CE MET A 168 -7.605 -1.244 6.223 1.00 4.06 C ATOM 0 H MET A 168 -5.390 -5.353 6.056 1.00 6.41 H new ATOM 0 HA MET A 168 -7.913 -4.771 4.616 1.00 5.59 H new ATOM 0 HB2 MET A 168 -5.053 -4.380 3.641 1.00 4.61 H new ATOM 0 HB3 MET A 168 -6.515 -3.953 2.774 1.00 4.61 H new ATOM 0 HG2 MET A 168 -5.584 -2.716 5.388 1.00 4.37 H new ATOM 0 HG3 MET A 168 -5.437 -1.985 3.802 1.00 4.37 H new ATOM 0 HE1 MET A 168 -8.064 -0.255 6.225 1.00 4.06 H new ATOM 0 HE2 MET A 168 -8.131 -1.890 6.926 1.00 4.06 H new ATOM 0 HE3 MET A 168 -6.560 -1.159 6.520 1.00 4.06 H new ATOM 2655 N HIS A 169 -5.544 -6.899 3.715 1.00 6.40 N ATOM 2656 CA HIS A 169 -5.312 -8.193 3.080 1.00 7.11 C ATOM 2657 C HIS A 169 -6.172 -9.283 3.717 1.00 8.00 C ATOM 2658 O HIS A 169 -6.581 -10.231 3.047 1.00 8.44 O ATOM 2659 CB HIS A 169 -3.836 -8.568 3.180 1.00 7.58 C ATOM 2660 CG HIS A 169 -3.431 -9.663 2.244 1.00 8.20 C ATOM 2661 ND1 HIS A 169 -3.228 -10.966 2.651 1.00 9.21 N ATOM 2662 CD2 HIS A 169 -3.194 -9.647 0.911 1.00 8.09 C ATOM 2663 CE1 HIS A 169 -2.882 -11.702 1.610 1.00 9.66 C ATOM 2664 NE2 HIS A 169 -2.855 -10.926 0.542 1.00 9.05 N ATOM 0 H HIS A 169 -4.693 -6.404 3.981 1.00 6.40 H new ATOM 0 HA HIS A 169 -5.593 -8.110 2.030 1.00 7.11 H new ATOM 0 HB2 HIS A 169 -3.231 -7.685 2.976 1.00 7.58 H new ATOM 0 HB3 HIS A 169 -3.616 -8.876 4.202 1.00 7.58 H new ATOM 0 HD2 HIS A 169 -3.259 -8.788 0.259 1.00 8.09 H new ATOM 0 HE1 HIS A 169 -2.659 -12.759 1.629 1.00 9.66 H new ATOM 0 HE2 HIS A 169 -2.620 -11.227 -0.404 1.00 9.05 H new ATOM 2834 N VAL A 182 -6.138 -6.687 -1.699 1.00 5.55 N ATOM 2835 CA VAL A 182 -4.810 -7.211 -1.440 1.00 6.08 C ATOM 2836 C VAL A 182 -3.803 -6.114 -1.112 1.00 5.39 C ATOM 2837 O VAL A 182 -3.611 -5.165 -1.883 1.00 4.91 O ATOM 2838 CB VAL A 182 -4.286 -8.038 -2.635 1.00 6.97 C ATOM 2839 CG1 VAL A 182 -4.468 -7.299 -3.943 1.00 6.80 C ATOM 2840 CG2 VAL A 182 -2.828 -8.422 -2.439 1.00 7.45 C ATOM 0 HA VAL A 182 -4.910 -7.857 -0.567 1.00 6.08 H new ATOM 0 HB VAL A 182 -4.878 -8.952 -2.680 1.00 6.97 H new ATOM 0 HG11 VAL A 182 -4.089 -7.910 -4.762 1.00 6.80 H new ATOM 0 HG12 VAL A 182 -5.527 -7.096 -4.102 1.00 6.80 H new ATOM 0 HG13 VAL A 182 -3.920 -6.358 -3.908 1.00 6.80 H new ATOM 0 HG21 VAL A 182 -2.487 -9.003 -3.296 1.00 7.45 H new ATOM 0 HG22 VAL A 182 -2.223 -7.520 -2.348 1.00 7.45 H new ATOM 0 HG23 VAL A 182 -2.728 -9.019 -1.532 1.00 7.45 H new ATOM 2850 N VAL A 183 -3.164 -6.266 0.048 1.00 5.50 N ATOM 2851 CA VAL A 183 -2.142 -5.338 0.507 1.00 4.93 C ATOM 2852 C VAL A 183 -0.983 -6.125 1.109 1.00 5.68 C ATOM 2853 O VAL A 183 -1.172 -6.892 2.054 1.00 6.34 O ATOM 2854 CB VAL A 183 -2.692 -4.356 1.561 1.00 4.22 C ATOM 2855 CG1 VAL A 183 -1.612 -3.372 1.994 1.00 3.70 C ATOM 2856 CG2 VAL A 183 -3.909 -3.617 1.023 1.00 3.54 C ATOM 0 H VAL A 183 -3.343 -7.036 0.692 1.00 5.50 H new ATOM 0 HA VAL A 183 -1.806 -4.756 -0.351 1.00 4.93 H new ATOM 0 HB VAL A 183 -3.001 -4.930 2.435 1.00 4.22 H new ATOM 0 HG11 VAL A 183 -2.020 -2.688 2.738 1.00 3.70 H new ATOM 0 HG12 VAL A 183 -0.773 -3.919 2.425 1.00 3.70 H new ATOM 0 HG13 VAL A 183 -1.269 -2.805 1.129 1.00 3.70 H new ATOM 0 HG21 VAL A 183 -4.282 -2.929 1.782 1.00 3.54 H new ATOM 0 HG22 VAL A 183 -3.629 -3.056 0.131 1.00 3.54 H new ATOM 0 HG23 VAL A 183 -4.689 -4.336 0.770 1.00 3.54 H new ATOM 2866 N LYS A 184 0.217 -5.940 0.564 1.00 5.70 N ATOM 2867 CA LYS A 184 1.382 -6.672 1.052 1.00 6.41 C ATOM 2868 C LYS A 184 2.670 -5.869 0.931 1.00 5.98 C ATOM 2869 O LYS A 184 2.845 -5.077 0.003 1.00 5.49 O ATOM 2870 CB LYS A 184 1.525 -7.990 0.291 1.00 7.46 C ATOM 2871 CG LYS A 184 1.860 -7.802 -1.181 1.00 7.98 C ATOM 2872 CD LYS A 184 1.823 -9.117 -1.940 1.00 8.81 C ATOM 2873 CE LYS A 184 2.328 -8.947 -3.364 1.00 8.99 C ATOM 2874 NZ LYS A 184 3.803 -8.743 -3.410 1.00 9.80 N ATOM 0 H LYS A 184 0.407 -5.298 -0.206 1.00 5.70 H new ATOM 0 HA LYS A 184 1.218 -6.866 2.112 1.00 6.41 H new ATOM 0 HB2 LYS A 184 2.305 -8.590 0.760 1.00 7.46 H new ATOM 0 HB3 LYS A 184 0.596 -8.553 0.376 1.00 7.46 H new ATOM 0 HG2 LYS A 184 1.153 -7.104 -1.629 1.00 7.98 H new ATOM 0 HG3 LYS A 184 2.850 -7.356 -1.274 1.00 7.98 H new ATOM 0 HD2 LYS A 184 2.433 -9.856 -1.421 1.00 8.81 H new ATOM 0 HD3 LYS A 184 0.803 -9.501 -1.957 1.00 8.81 H new ATOM 0 HE2 LYS A 184 2.065 -9.828 -3.950 1.00 8.99 H new ATOM 0 HE3 LYS A 184 1.829 -8.095 -3.827 1.00 8.99 H new ATOM 0 HZ1 LYS A 184 4.131 -8.801 -4.395 1.00 9.80 H new ATOM 0 HZ2 LYS A 184 4.036 -7.807 -3.022 1.00 9.80 H new ATOM 0 HZ3 LYS A 184 4.273 -9.479 -2.845 1.00 9.80 H new ATOM 2888 N PHE A 185 3.567 -6.085 1.887 1.00 6.30 N ATOM 2889 CA PHE A 185 4.863 -5.422 1.903 1.00 5.99 C ATOM 2890 C PHE A 185 5.637 -5.759 0.631 1.00 6.35 C ATOM 2891 O PHE A 185 5.944 -6.923 0.376 1.00 7.24 O ATOM 2892 CB PHE A 185 5.655 -5.876 3.129 1.00 6.57 C ATOM 2893 CG PHE A 185 6.563 -4.825 3.699 1.00 6.08 C ATOM 2894 CD1 PHE A 185 7.737 -4.485 3.047 1.00 5.74 C ATOM 2895 CD2 PHE A 185 6.240 -4.171 4.878 1.00 6.14 C ATOM 2896 CE1 PHE A 185 8.573 -3.512 3.559 1.00 5.34 C ATOM 2897 CE2 PHE A 185 7.075 -3.198 5.395 1.00 5.81 C ATOM 2898 CZ PHE A 185 8.242 -2.889 4.774 1.00 5.34 C ATOM 0 H PHE A 185 3.416 -6.722 2.669 1.00 6.30 H new ATOM 0 HA PHE A 185 4.713 -4.343 1.950 1.00 5.99 H new ATOM 0 HB2 PHE A 185 4.956 -6.194 3.902 1.00 6.57 H new ATOM 0 HB3 PHE A 185 6.251 -6.748 2.860 1.00 6.57 H new ATOM 0 HD1 PHE A 185 8.002 -4.986 2.128 1.00 5.74 H new ATOM 0 HD2 PHE A 185 5.328 -4.424 5.397 1.00 6.14 H new ATOM 0 HE1 PHE A 185 9.472 -3.233 3.030 1.00 5.34 H new ATOM 0 HE2 PHE A 185 6.797 -2.679 6.300 1.00 5.81 H new ATOM 0 HZ PHE A 185 8.914 -2.166 5.213 1.00 5.34 H new ATOM 2908 N ALA A 186 5.948 -4.738 -0.164 1.00 5.78 N ATOM 2909 CA ALA A 186 6.679 -4.934 -1.414 1.00 6.30 C ATOM 2910 C ALA A 186 7.939 -5.764 -1.203 1.00 6.85 C ATOM 2911 O ALA A 186 8.747 -5.472 -0.320 1.00 6.41 O ATOM 2912 CB ALA A 186 7.029 -3.592 -2.039 1.00 5.74 C ATOM 0 H ALA A 186 5.706 -3.767 0.035 1.00 5.78 H new ATOM 0 HA ALA A 186 6.029 -5.484 -2.094 1.00 6.30 H new ATOM 0 HB1 ALA A 186 7.573 -3.755 -2.969 1.00 5.74 H new ATOM 0 HB2 ALA A 186 6.114 -3.037 -2.246 1.00 5.74 H new ATOM 0 HB3 ALA A 186 7.651 -3.021 -1.350 1.00 5.74 H new