USER MOD reduce.3.24.130724 H: found=0, std=0, add=1147, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1151 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 28 GLN : amide:sc= 0 X(o=-0.067,f=-0.067) USER MOD Set 1.2: A 137 MET CE :methyl -150:sc= -0.0671 (180deg=-0.539) USER MOD Set 2.1: A 126 CYS SG : rot -64:sc= -0.44! USER MOD Set 2.2: A 127 THR OG1 : rot -90:sc= -3.03! USER MOD Set 3.1: A 55 SER OG : rot -91:sc= 0.0536 USER MOD Set 3.2: A 56 THR OG1 : rot 180:sc= 0.00297 USER MOD Single : A 15 SER OG : rot 180:sc= -0.514 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 MET CE :methyl 170:sc= -0.38 (180deg=-0.499) USER MOD Single : A 21 LYS NZ :NH3+ 158:sc= -0.263 (180deg=-0.928) USER MOD Single : A 22 THR OG1 : rot 95:sc= 1.19 USER MOD Single : A 32 GLN : amide:sc= -2.51! C(o=-2.5!,f=-2.7!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 164:sc= -0.0151 (180deg=-0.306) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 CYS SG : rot -150:sc= -0.0935 USER MOD Single : A 64 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00836) USER MOD Single : A 72 SER OG : rot -38:sc= 1.14 USER MOD Single : A 73 ASN : amide:sc= -1.13 K(o=-1.1,f=-2) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -3.8! C(o=-3.8!,f=-4.3!) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 99 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot -44:sc= 0.876 USER MOD Single : A 119 LYS NZ :NH3+ 168:sc= -2.01 (180deg=-2.38) USER MOD Single : A 123 LYS NZ :NH3+ 152:sc= -0.193 (180deg=-0.912) USER MOD Single : A 128 LYS NZ :NH3+ 157:sc= -0.0393 (180deg=-0.504) USER MOD Single : A 135 THR OG1 : rot 79:sc= 0.754 USER MOD Single : A 140 THR OG1 : rot -33:sc= -0.835 USER MOD Single : A 153 GLN : amide:sc= -0.801 K(o=-0.8,f=-3.5!) USER MOD Single : A 155 GLN : amide:sc= 0.512 K(o=0.51,f=-0.29) USER MOD Single : A 163 SER OG : rot 102:sc= 1.01 USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 171 GLN : amide:sc= -0.373 X(o=-0.37,f=0) USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD Single : A 174 THR OG1 : rot 180:sc= -0.145 USER MOD Single : A 182 THR OG1 : rot 103:sc= 0.202 USER MOD Single : A 184 SER OG : rot 180:sc= 0 USER MOD Single : A 186 THR OG1 : rot 69:sc= 0.239 USER MOD ----------------------------------------------------------------- ATOM 176 N SER A 15 19.700 1.594 -3.405 1.00 1.07 N ATOM 177 CA SER A 15 19.852 2.866 -2.629 1.00 0.91 C ATOM 178 C SER A 15 18.477 3.404 -2.220 1.00 0.75 C ATOM 179 O SER A 15 17.531 3.366 -2.981 1.00 0.78 O ATOM 180 CB SER A 15 20.557 3.907 -3.499 1.00 0.99 C ATOM 181 OG SER A 15 19.649 4.394 -4.477 1.00 1.38 O ATOM 0 HA SER A 15 20.440 2.666 -1.733 1.00 0.91 H new ATOM 0 HB2 SER A 15 20.919 4.729 -2.881 1.00 0.99 H new ATOM 0 HB3 SER A 15 21.428 3.464 -3.983 1.00 0.99 H new ATOM 0 HG SER A 15 20.097 5.063 -5.036 1.00 1.38 H new ATOM 187 N SER A 16 18.365 3.905 -1.021 1.00 0.72 N ATOM 188 CA SER A 16 17.058 4.453 -0.548 1.00 0.82 C ATOM 189 C SER A 16 16.511 5.469 -1.562 1.00 0.81 C ATOM 190 O SER A 16 15.430 5.993 -1.395 1.00 0.92 O ATOM 191 CB SER A 16 17.256 5.143 0.802 1.00 1.06 C ATOM 192 OG SER A 16 18.142 6.243 0.642 1.00 1.64 O ATOM 0 H SER A 16 19.125 3.960 -0.343 1.00 0.72 H new ATOM 0 HA SER A 16 16.346 3.634 -0.445 1.00 0.82 H new ATOM 0 HB2 SER A 16 16.298 5.487 1.192 1.00 1.06 H new ATOM 0 HB3 SER A 16 17.661 4.438 1.528 1.00 1.06 H new ATOM 0 HG SER A 16 18.270 6.689 1.505 1.00 1.64 H new ATOM 198 N GLU A 17 17.230 5.739 -2.618 1.00 0.80 N ATOM 199 CA GLU A 17 16.740 6.705 -3.643 1.00 0.94 C ATOM 200 C GLU A 17 15.873 5.976 -4.676 1.00 0.85 C ATOM 201 O GLU A 17 14.765 6.382 -4.964 1.00 0.89 O ATOM 202 CB GLU A 17 17.945 7.365 -4.330 1.00 1.13 C ATOM 203 CG GLU A 17 17.476 8.358 -5.421 1.00 1.71 C ATOM 204 CD GLU A 17 17.491 7.683 -6.798 1.00 2.26 C ATOM 205 OE1 GLU A 17 17.248 6.489 -6.854 1.00 2.90 O ATOM 206 OE2 GLU A 17 17.747 8.373 -7.771 1.00 2.68 O ATOM 0 H GLU A 17 18.143 5.329 -2.816 1.00 0.80 H new ATOM 0 HA GLU A 17 16.134 7.473 -3.163 1.00 0.94 H new ATOM 0 HB2 GLU A 17 18.550 7.889 -3.590 1.00 1.13 H new ATOM 0 HB3 GLU A 17 18.580 6.600 -4.776 1.00 1.13 H new ATOM 0 HG2 GLU A 17 16.470 8.711 -5.193 1.00 1.71 H new ATOM 0 HG3 GLU A 17 18.127 9.233 -5.430 1.00 1.71 H new ATOM 213 N GLN A 18 16.359 4.899 -5.227 1.00 0.80 N ATOM 214 CA GLN A 18 15.551 4.147 -6.231 1.00 0.83 C ATOM 215 C GLN A 18 14.295 3.577 -5.556 1.00 0.68 C ATOM 216 O GLN A 18 13.225 3.549 -6.132 1.00 0.69 O ATOM 217 CB GLN A 18 16.389 2.999 -6.812 1.00 0.96 C ATOM 218 CG GLN A 18 17.191 2.321 -5.705 1.00 1.53 C ATOM 219 CD GLN A 18 17.884 1.080 -6.271 1.00 2.23 C ATOM 220 OE1 GLN A 18 18.730 1.186 -7.138 1.00 2.69 O ATOM 221 NE2 GLN A 18 17.560 -0.099 -5.818 1.00 3.07 N ATOM 0 H GLN A 18 17.279 4.506 -5.027 1.00 0.80 H new ATOM 0 HA GLN A 18 15.256 4.821 -7.035 1.00 0.83 H new ATOM 0 HB2 GLN A 18 15.737 2.272 -7.297 1.00 0.96 H new ATOM 0 HB3 GLN A 18 17.064 3.382 -7.578 1.00 0.96 H new ATOM 0 HG2 GLN A 18 17.931 3.012 -5.300 1.00 1.53 H new ATOM 0 HG3 GLN A 18 16.533 2.041 -4.882 1.00 1.53 H new ATOM 0 HE21 GLN A 18 16.850 -0.189 -5.091 1.00 3.07 H new ATOM 0 HE22 GLN A 18 18.016 -0.932 -6.191 1.00 3.07 H new ATOM 230 N ILE A 19 14.421 3.119 -4.334 1.00 0.59 N ATOM 231 CA ILE A 19 13.242 2.548 -3.613 1.00 0.58 C ATOM 232 C ILE A 19 12.179 3.632 -3.423 1.00 0.52 C ATOM 233 O ILE A 19 11.100 3.562 -3.976 1.00 0.59 O ATOM 234 CB ILE A 19 13.690 2.002 -2.252 1.00 0.64 C ATOM 235 CG1 ILE A 19 14.566 0.769 -2.480 1.00 0.74 C ATOM 236 CG2 ILE A 19 12.465 1.606 -1.423 1.00 0.73 C ATOM 237 CD1 ILE A 19 15.257 0.363 -1.178 1.00 0.81 C ATOM 0 H ILE A 19 15.293 3.116 -3.804 1.00 0.59 H new ATOM 0 HA ILE A 19 12.815 1.735 -4.200 1.00 0.58 H new ATOM 0 HB ILE A 19 14.251 2.768 -1.717 1.00 0.64 H new ATOM 0 HG12 ILE A 19 13.956 -0.056 -2.849 1.00 0.74 H new ATOM 0 HG13 ILE A 19 15.312 0.981 -3.245 1.00 0.74 H new ATOM 0 HG21 ILE A 19 12.789 1.219 -0.457 1.00 0.73 H new ATOM 0 HG22 ILE A 19 11.832 2.480 -1.270 1.00 0.73 H new ATOM 0 HG23 ILE A 19 11.901 0.837 -1.951 1.00 0.73 H new ATOM 0 HD11 ILE A 19 15.877 -0.516 -1.354 1.00 0.81 H new ATOM 0 HD12 ILE A 19 15.882 1.184 -0.826 1.00 0.81 H new ATOM 0 HD13 ILE A 19 14.505 0.131 -0.424 1.00 0.81 H new ATOM 249 N MET A 20 12.485 4.640 -2.657 1.00 0.51 N ATOM 250 CA MET A 20 11.525 5.751 -2.425 1.00 0.60 C ATOM 251 C MET A 20 10.845 6.211 -3.720 1.00 0.55 C ATOM 252 O MET A 20 9.646 6.403 -3.785 1.00 0.59 O ATOM 253 CB MET A 20 12.340 6.944 -1.863 1.00 0.82 C ATOM 254 CG MET A 20 11.464 7.787 -0.908 1.00 1.07 C ATOM 255 SD MET A 20 11.139 6.848 0.618 1.00 1.43 S ATOM 256 CE MET A 20 9.326 6.764 0.517 1.00 0.93 C ATOM 0 H MET A 20 13.377 4.742 -2.173 1.00 0.51 H new ATOM 0 HA MET A 20 10.747 5.407 -1.743 1.00 0.60 H new ATOM 0 HB2 MET A 20 13.218 6.576 -1.333 1.00 0.82 H new ATOM 0 HB3 MET A 20 12.700 7.566 -2.682 1.00 0.82 H new ATOM 0 HG2 MET A 20 11.967 8.724 -0.669 1.00 1.07 H new ATOM 0 HG3 MET A 20 10.523 8.045 -1.395 1.00 1.07 H new ATOM 0 HE1 MET A 20 8.951 6.074 1.273 1.00 0.93 H new ATOM 0 HE2 MET A 20 8.906 7.755 0.690 1.00 0.93 H new ATOM 0 HE3 MET A 20 9.033 6.413 -0.472 1.00 0.93 H new ATOM 266 N LYS A 21 11.636 6.408 -4.748 1.00 0.57 N ATOM 267 CA LYS A 21 11.098 6.882 -6.057 1.00 0.61 C ATOM 268 C LYS A 21 10.101 5.881 -6.639 1.00 0.53 C ATOM 269 O LYS A 21 8.967 6.218 -6.907 1.00 0.51 O ATOM 270 CB LYS A 21 12.249 7.047 -7.053 1.00 0.72 C ATOM 271 CG LYS A 21 13.133 8.226 -6.643 1.00 1.09 C ATOM 272 CD LYS A 21 14.466 8.155 -7.399 1.00 1.24 C ATOM 273 CE LYS A 21 14.221 8.257 -8.910 1.00 1.80 C ATOM 274 NZ LYS A 21 13.253 9.355 -9.191 1.00 2.40 N ATOM 0 H LYS A 21 12.645 6.258 -4.732 1.00 0.57 H new ATOM 0 HA LYS A 21 10.593 7.833 -5.887 1.00 0.61 H new ATOM 0 HB2 LYS A 21 12.842 6.133 -7.090 1.00 0.72 H new ATOM 0 HB3 LYS A 21 11.853 7.211 -8.055 1.00 0.72 H new ATOM 0 HG2 LYS A 21 12.628 9.166 -6.863 1.00 1.09 H new ATOM 0 HG3 LYS A 21 13.311 8.204 -5.568 1.00 1.09 H new ATOM 0 HD2 LYS A 21 15.121 8.963 -7.074 1.00 1.24 H new ATOM 0 HD3 LYS A 21 14.975 7.219 -7.168 1.00 1.24 H new ATOM 0 HE2 LYS A 21 15.161 8.447 -9.428 1.00 1.80 H new ATOM 0 HE3 LYS A 21 13.833 7.312 -9.290 1.00 1.80 H new ATOM 0 HZ1 LYS A 21 13.364 9.672 -10.175 1.00 2.40 H new ATOM 0 HZ2 LYS A 21 12.283 9.008 -9.046 1.00 2.40 H new ATOM 0 HZ3 LYS A 21 13.436 10.152 -8.548 1.00 2.40 H new ATOM 288 N THR A 22 10.498 4.653 -6.835 1.00 0.53 N ATOM 289 CA THR A 22 9.549 3.661 -7.409 1.00 0.52 C ATOM 290 C THR A 22 8.334 3.539 -6.490 1.00 0.45 C ATOM 291 O THR A 22 7.219 3.358 -6.936 1.00 0.48 O ATOM 292 CB THR A 22 10.257 2.302 -7.538 1.00 0.55 C ATOM 293 OG1 THR A 22 11.604 2.513 -7.937 1.00 0.64 O ATOM 294 CG2 THR A 22 9.547 1.439 -8.584 1.00 0.62 C ATOM 0 H THR A 22 11.430 4.297 -6.624 1.00 0.53 H new ATOM 0 HA THR A 22 9.218 3.985 -8.396 1.00 0.52 H new ATOM 0 HB THR A 22 10.231 1.790 -6.576 1.00 0.55 H new ATOM 0 HG1 THR A 22 12.181 2.526 -7.145 1.00 0.64 H new ATOM 0 HG21 THR A 22 10.055 0.478 -8.669 1.00 0.62 H new ATOM 0 HG22 THR A 22 8.513 1.277 -8.281 1.00 0.62 H new ATOM 0 HG23 THR A 22 9.567 1.946 -9.549 1.00 0.62 H new ATOM 302 N GLY A 23 8.547 3.630 -5.209 1.00 0.42 N ATOM 303 CA GLY A 23 7.415 3.514 -4.252 1.00 0.43 C ATOM 304 C GLY A 23 6.393 4.629 -4.498 1.00 0.41 C ATOM 305 O GLY A 23 5.205 4.381 -4.549 1.00 0.47 O ATOM 0 H GLY A 23 9.461 3.780 -4.782 1.00 0.42 H new ATOM 0 HA2 GLY A 23 6.935 2.541 -4.362 1.00 0.43 H new ATOM 0 HA3 GLY A 23 7.787 3.572 -3.229 1.00 0.43 H new ATOM 309 N ALA A 24 6.828 5.855 -4.639 1.00 0.40 N ATOM 310 CA ALA A 24 5.859 6.967 -4.865 1.00 0.41 C ATOM 311 C ALA A 24 5.293 6.911 -6.284 1.00 0.41 C ATOM 312 O ALA A 24 4.236 7.445 -6.556 1.00 0.41 O ATOM 313 CB ALA A 24 6.576 8.305 -4.678 1.00 0.42 C ATOM 0 H ALA A 24 7.809 6.133 -4.607 1.00 0.40 H new ATOM 0 HA ALA A 24 5.042 6.865 -4.150 1.00 0.41 H new ATOM 0 HB1 ALA A 24 5.872 9.121 -4.842 1.00 0.42 H new ATOM 0 HB2 ALA A 24 6.973 8.367 -3.665 1.00 0.42 H new ATOM 0 HB3 ALA A 24 7.394 8.382 -5.394 1.00 0.42 H new ATOM 319 N LEU A 25 5.974 6.264 -7.198 1.00 0.42 N ATOM 320 CA LEU A 25 5.432 6.193 -8.590 1.00 0.44 C ATOM 321 C LEU A 25 4.405 5.060 -8.623 1.00 0.44 C ATOM 322 O LEU A 25 3.296 5.220 -9.092 1.00 0.46 O ATOM 323 CB LEU A 25 6.569 5.926 -9.603 1.00 0.47 C ATOM 324 CG LEU A 25 7.173 7.250 -10.111 1.00 0.77 C ATOM 325 CD1 LEU A 25 8.071 7.858 -9.033 1.00 1.58 C ATOM 326 CD2 LEU A 25 8.013 6.978 -11.361 1.00 1.67 C ATOM 0 H LEU A 25 6.864 5.791 -7.045 1.00 0.42 H new ATOM 0 HA LEU A 25 4.966 7.139 -8.867 1.00 0.44 H new ATOM 0 HB2 LEU A 25 7.346 5.323 -9.133 1.00 0.47 H new ATOM 0 HB3 LEU A 25 6.184 5.350 -10.445 1.00 0.47 H new ATOM 0 HG LEU A 25 6.366 7.943 -10.347 1.00 0.77 H new ATOM 0 HD11 LEU A 25 8.495 8.794 -9.398 1.00 1.58 H new ATOM 0 HD12 LEU A 25 7.483 8.052 -8.136 1.00 1.58 H new ATOM 0 HD13 LEU A 25 8.876 7.163 -8.796 1.00 1.58 H new ATOM 0 HD21 LEU A 25 8.441 7.913 -11.722 1.00 1.67 H new ATOM 0 HD22 LEU A 25 8.815 6.282 -11.116 1.00 1.67 H new ATOM 0 HD23 LEU A 25 7.381 6.545 -12.137 1.00 1.67 H new ATOM 338 N LEU A 26 4.791 3.903 -8.155 1.00 0.45 N ATOM 339 CA LEU A 26 3.874 2.734 -8.179 1.00 0.47 C ATOM 340 C LEU A 26 2.513 3.089 -7.585 1.00 0.49 C ATOM 341 O LEU A 26 1.494 2.924 -8.227 1.00 0.52 O ATOM 342 CB LEU A 26 4.509 1.565 -7.392 1.00 0.51 C ATOM 343 CG LEU A 26 5.577 0.864 -8.257 1.00 0.69 C ATOM 344 CD1 LEU A 26 6.450 -0.046 -7.389 1.00 1.17 C ATOM 345 CD2 LEU A 26 4.889 0.020 -9.343 1.00 1.35 C ATOM 0 H LEU A 26 5.711 3.720 -7.754 1.00 0.45 H new ATOM 0 HA LEU A 26 3.719 2.436 -9.216 1.00 0.47 H new ATOM 0 HB2 LEU A 26 4.961 1.938 -6.473 1.00 0.51 H new ATOM 0 HB3 LEU A 26 3.739 0.851 -7.101 1.00 0.51 H new ATOM 0 HG LEU A 26 6.205 1.624 -8.722 1.00 0.69 H new ATOM 0 HD11 LEU A 26 7.199 -0.534 -8.012 1.00 1.17 H new ATOM 0 HD12 LEU A 26 6.947 0.549 -6.623 1.00 1.17 H new ATOM 0 HD13 LEU A 26 5.826 -0.802 -6.912 1.00 1.17 H new ATOM 0 HD21 LEU A 26 5.645 -0.474 -9.953 1.00 1.35 H new ATOM 0 HD22 LEU A 26 4.254 -0.731 -8.873 1.00 1.35 H new ATOM 0 HD23 LEU A 26 4.279 0.666 -9.974 1.00 1.35 H new ATOM 357 N LEU A 27 2.464 3.547 -6.368 1.00 0.50 N ATOM 358 CA LEU A 27 1.136 3.865 -5.780 1.00 0.56 C ATOM 359 C LEU A 27 0.474 4.973 -6.608 1.00 0.56 C ATOM 360 O LEU A 27 -0.659 4.846 -7.028 1.00 0.60 O ATOM 361 CB LEU A 27 1.304 4.287 -4.314 1.00 0.64 C ATOM 362 CG LEU A 27 -0.043 4.692 -3.702 1.00 0.95 C ATOM 363 CD1 LEU A 27 -1.007 3.497 -3.709 1.00 1.66 C ATOM 364 CD2 LEU A 27 0.189 5.156 -2.261 1.00 1.42 C ATOM 0 H LEU A 27 3.269 3.713 -5.764 1.00 0.50 H new ATOM 0 HA LEU A 27 0.494 2.984 -5.802 1.00 0.56 H new ATOM 0 HB2 LEU A 27 1.735 3.465 -3.742 1.00 0.64 H new ATOM 0 HB3 LEU A 27 2.003 5.121 -4.250 1.00 0.64 H new ATOM 0 HG LEU A 27 -0.482 5.499 -4.289 1.00 0.95 H new ATOM 0 HD11 LEU A 27 -1.960 3.796 -3.272 1.00 1.66 H new ATOM 0 HD12 LEU A 27 -1.166 3.164 -4.735 1.00 1.66 H new ATOM 0 HD13 LEU A 27 -0.580 2.682 -3.125 1.00 1.66 H new ATOM 0 HD21 LEU A 27 -0.762 5.447 -1.815 1.00 1.42 H new ATOM 0 HD22 LEU A 27 0.627 4.342 -1.683 1.00 1.42 H new ATOM 0 HD23 LEU A 27 0.867 6.009 -2.258 1.00 1.42 H new ATOM 376 N GLN A 28 1.161 6.056 -6.850 1.00 0.55 N ATOM 377 CA GLN A 28 0.552 7.156 -7.654 1.00 0.58 C ATOM 378 C GLN A 28 0.069 6.603 -9.001 1.00 0.54 C ATOM 379 O GLN A 28 -0.771 7.181 -9.662 1.00 0.58 O ATOM 380 CB GLN A 28 1.610 8.233 -7.904 1.00 0.60 C ATOM 381 CG GLN A 28 0.988 9.386 -8.691 1.00 1.00 C ATOM 382 CD GLN A 28 1.927 10.594 -8.654 1.00 1.40 C ATOM 383 OE1 GLN A 28 1.691 11.540 -7.929 1.00 2.09 O ATOM 384 NE2 GLN A 28 2.991 10.602 -9.410 1.00 1.91 N ATOM 0 H GLN A 28 2.114 6.227 -6.528 1.00 0.55 H new ATOM 0 HA GLN A 28 -0.293 7.580 -7.112 1.00 0.58 H new ATOM 0 HB2 GLN A 28 2.005 8.597 -6.955 1.00 0.60 H new ATOM 0 HB3 GLN A 28 2.449 7.812 -8.458 1.00 0.60 H new ATOM 0 HG2 GLN A 28 0.810 9.082 -9.722 1.00 1.00 H new ATOM 0 HG3 GLN A 28 0.020 9.651 -8.265 1.00 1.00 H new ATOM 0 HE21 GLN A 28 3.190 9.808 -10.019 1.00 1.91 H new ATOM 0 HE22 GLN A 28 3.624 11.402 -9.392 1.00 1.91 H new ATOM 393 N GLY A 29 0.625 5.500 -9.420 1.00 0.50 N ATOM 394 CA GLY A 29 0.237 4.910 -10.737 1.00 0.48 C ATOM 395 C GLY A 29 -1.113 4.194 -10.638 1.00 0.44 C ATOM 396 O GLY A 29 -2.062 4.548 -11.310 1.00 0.50 O ATOM 0 H GLY A 29 1.335 4.978 -8.906 1.00 0.50 H new ATOM 0 HA2 GLY A 29 0.182 5.696 -11.490 1.00 0.48 H new ATOM 0 HA3 GLY A 29 1.003 4.207 -11.065 1.00 0.48 H new ATOM 400 N PHE A 30 -1.205 3.179 -9.826 1.00 0.44 N ATOM 401 CA PHE A 30 -2.491 2.433 -9.711 1.00 0.43 C ATOM 402 C PHE A 30 -3.635 3.399 -9.390 1.00 0.40 C ATOM 403 O PHE A 30 -4.792 3.063 -9.557 1.00 0.43 O ATOM 404 CB PHE A 30 -2.377 1.378 -8.599 1.00 0.47 C ATOM 405 CG PHE A 30 -3.730 0.746 -8.340 1.00 0.47 C ATOM 406 CD1 PHE A 30 -4.328 -0.050 -9.324 1.00 1.20 C ATOM 407 CD2 PHE A 30 -4.382 0.950 -7.115 1.00 1.39 C ATOM 408 CE1 PHE A 30 -5.575 -0.641 -9.087 1.00 1.21 C ATOM 409 CE2 PHE A 30 -5.629 0.359 -6.879 1.00 1.42 C ATOM 410 CZ PHE A 30 -6.225 -0.436 -7.864 1.00 0.58 C ATOM 0 H PHE A 30 -0.447 2.833 -9.237 1.00 0.44 H new ATOM 0 HA PHE A 30 -2.701 1.940 -10.660 1.00 0.43 H new ATOM 0 HB2 PHE A 30 -1.658 0.611 -8.887 1.00 0.47 H new ATOM 0 HB3 PHE A 30 -2.002 1.840 -7.686 1.00 0.47 H new ATOM 0 HD1 PHE A 30 -3.827 -0.209 -10.267 1.00 1.20 H new ATOM 0 HD2 PHE A 30 -3.922 1.563 -6.354 1.00 1.39 H new ATOM 0 HE1 PHE A 30 -6.035 -1.255 -9.847 1.00 1.21 H new ATOM 0 HE2 PHE A 30 -6.131 0.517 -5.936 1.00 1.42 H new ATOM 0 HZ PHE A 30 -7.187 -0.892 -7.681 1.00 0.58 H new ATOM 420 N ILE A 31 -3.348 4.597 -8.936 1.00 0.40 N ATOM 421 CA ILE A 31 -4.454 5.549 -8.619 1.00 0.40 C ATOM 422 C ILE A 31 -4.855 6.291 -9.899 1.00 0.40 C ATOM 423 O ILE A 31 -5.976 6.196 -10.358 1.00 0.43 O ATOM 424 CB ILE A 31 -3.965 6.556 -7.568 1.00 0.41 C ATOM 425 CG1 ILE A 31 -3.737 5.844 -6.232 1.00 0.53 C ATOM 426 CG2 ILE A 31 -5.000 7.668 -7.386 1.00 0.72 C ATOM 427 CD1 ILE A 31 -2.919 6.749 -5.304 1.00 0.48 C ATOM 0 H ILE A 31 -2.405 4.951 -8.774 1.00 0.40 H new ATOM 0 HA ILE A 31 -5.315 5.007 -8.227 1.00 0.40 H new ATOM 0 HB ILE A 31 -3.026 6.993 -7.909 1.00 0.41 H new ATOM 0 HG12 ILE A 31 -4.694 5.600 -5.770 1.00 0.53 H new ATOM 0 HG13 ILE A 31 -3.213 4.902 -6.394 1.00 0.53 H new ATOM 0 HG21 ILE A 31 -4.644 8.377 -6.639 1.00 0.72 H new ATOM 0 HG22 ILE A 31 -5.150 8.184 -8.334 1.00 0.72 H new ATOM 0 HG23 ILE A 31 -5.944 7.236 -7.055 1.00 0.72 H new ATOM 0 HD11 ILE A 31 -2.756 6.243 -4.353 1.00 0.48 H new ATOM 0 HD12 ILE A 31 -1.957 6.970 -5.767 1.00 0.48 H new ATOM 0 HD13 ILE A 31 -3.461 7.679 -5.132 1.00 0.48 H new ATOM 439 N GLN A 32 -3.946 7.028 -10.476 1.00 0.42 N ATOM 440 CA GLN A 32 -4.264 7.779 -11.727 1.00 0.47 C ATOM 441 C GLN A 32 -4.997 6.858 -12.713 1.00 0.50 C ATOM 442 O GLN A 32 -5.946 7.255 -13.359 1.00 0.61 O ATOM 443 CB GLN A 32 -2.956 8.292 -12.353 1.00 0.57 C ATOM 444 CG GLN A 32 -3.237 9.518 -13.227 1.00 1.19 C ATOM 445 CD GLN A 32 -4.226 9.145 -14.331 1.00 1.59 C ATOM 446 OE1 GLN A 32 -5.328 9.657 -14.374 1.00 2.16 O ATOM 447 NE2 GLN A 32 -3.878 8.269 -15.233 1.00 2.21 N ATOM 0 H GLN A 32 -2.992 7.144 -10.134 1.00 0.42 H new ATOM 0 HA GLN A 32 -4.909 8.626 -11.494 1.00 0.47 H new ATOM 0 HB2 GLN A 32 -2.245 8.550 -11.568 1.00 0.57 H new ATOM 0 HB3 GLN A 32 -2.498 7.506 -12.952 1.00 0.57 H new ATOM 0 HG2 GLN A 32 -3.644 10.326 -12.618 1.00 1.19 H new ATOM 0 HG3 GLN A 32 -2.309 9.885 -13.665 1.00 1.19 H new ATOM 0 HE21 GLN A 32 -2.954 7.840 -15.197 1.00 2.21 H new ATOM 0 HE22 GLN A 32 -4.530 8.014 -15.974 1.00 2.21 H new ATOM 456 N ASP A 33 -4.564 5.633 -12.829 1.00 0.49 N ATOM 457 CA ASP A 33 -5.239 4.693 -13.770 1.00 0.58 C ATOM 458 C ASP A 33 -6.654 4.403 -13.260 1.00 0.61 C ATOM 459 O ASP A 33 -7.596 4.310 -14.021 1.00 0.70 O ATOM 460 CB ASP A 33 -4.446 3.387 -13.852 1.00 0.61 C ATOM 461 CG ASP A 33 -3.010 3.688 -14.287 1.00 1.10 C ATOM 462 OD1 ASP A 33 -2.812 4.688 -14.957 1.00 1.78 O ATOM 463 OD2 ASP A 33 -2.133 2.913 -13.942 1.00 1.89 O ATOM 0 H ASP A 33 -3.774 5.242 -12.315 1.00 0.49 H new ATOM 0 HA ASP A 33 -5.290 5.143 -14.762 1.00 0.58 H new ATOM 0 HB2 ASP A 33 -4.447 2.887 -12.883 1.00 0.61 H new ATOM 0 HB3 ASP A 33 -4.917 2.707 -14.562 1.00 0.61 H new ATOM 468 N ARG A 34 -6.802 4.261 -11.973 1.00 0.58 N ATOM 469 CA ARG A 34 -8.145 3.979 -11.388 1.00 0.71 C ATOM 470 C ARG A 34 -8.979 5.262 -11.311 1.00 0.65 C ATOM 471 O ARG A 34 -10.169 5.208 -11.072 1.00 0.85 O ATOM 472 CB ARG A 34 -7.972 3.401 -9.978 1.00 0.85 C ATOM 473 CG ARG A 34 -7.361 1.988 -10.053 1.00 1.25 C ATOM 474 CD ARG A 34 -8.463 0.940 -10.264 1.00 1.31 C ATOM 475 NE ARG A 34 -9.450 1.021 -9.151 1.00 1.58 N ATOM 476 CZ ARG A 34 -10.616 0.445 -9.270 1.00 2.09 C ATOM 477 NH1 ARG A 34 -10.919 -0.194 -10.367 1.00 2.58 N ATOM 478 NH2 ARG A 34 -11.478 0.509 -8.293 1.00 2.75 N ATOM 0 H ARG A 34 -6.044 4.329 -11.294 1.00 0.58 H new ATOM 0 HA ARG A 34 -8.662 3.262 -12.025 1.00 0.71 H new ATOM 0 HB2 ARG A 34 -7.329 4.052 -9.387 1.00 0.85 H new ATOM 0 HB3 ARG A 34 -8.937 3.362 -9.472 1.00 0.85 H new ATOM 0 HG2 ARG A 34 -6.642 1.939 -10.871 1.00 1.25 H new ATOM 0 HG3 ARG A 34 -6.815 1.771 -9.135 1.00 1.25 H new ATOM 0 HD2 ARG A 34 -8.962 1.109 -11.218 1.00 1.31 H new ATOM 0 HD3 ARG A 34 -8.027 -0.058 -10.305 1.00 1.31 H new ATOM 0 HE ARG A 34 -9.215 1.526 -8.296 1.00 1.58 H new ATOM 0 HH11 ARG A 34 -10.245 -0.243 -11.131 1.00 2.58 H new ATOM 0 HH12 ARG A 34 -11.830 -0.644 -10.460 1.00 2.58 H new ATOM 0 HH21 ARG A 34 -11.241 1.009 -7.436 1.00 2.75 H new ATOM 0 HH22 ARG A 34 -12.389 0.059 -8.386 1.00 2.75 H new ATOM 492 N ALA A 35 -8.396 6.415 -11.517 1.00 0.59 N ATOM 493 CA ALA A 35 -9.218 7.666 -11.453 1.00 0.66 C ATOM 494 C ALA A 35 -9.895 7.889 -12.810 1.00 0.80 C ATOM 495 O ALA A 35 -10.989 8.411 -12.894 1.00 0.88 O ATOM 496 CB ALA A 35 -8.337 8.865 -11.096 1.00 0.94 C ATOM 0 H ALA A 35 -7.406 6.547 -11.723 1.00 0.59 H new ATOM 0 HA ALA A 35 -9.978 7.561 -10.679 1.00 0.66 H new ATOM 0 HB1 ALA A 35 -8.949 9.766 -11.053 1.00 0.94 H new ATOM 0 HB2 ALA A 35 -7.870 8.697 -10.126 1.00 0.94 H new ATOM 0 HB3 ALA A 35 -7.564 8.987 -11.854 1.00 0.94 H new ATOM 751 N ALA A 54 8.994 0.702 -18.481 1.00 0.91 N ATOM 752 CA ALA A 54 8.626 -0.716 -18.754 1.00 0.84 C ATOM 753 C ALA A 54 8.672 -1.537 -17.462 1.00 0.76 C ATOM 754 O ALA A 54 7.980 -2.527 -17.326 1.00 0.75 O ATOM 755 CB ALA A 54 9.606 -1.310 -19.769 1.00 0.95 C ATOM 0 HA ALA A 54 7.613 -0.746 -19.156 1.00 0.84 H new ATOM 0 HB1 ALA A 54 9.338 -2.347 -19.970 1.00 0.95 H new ATOM 0 HB2 ALA A 54 9.561 -0.738 -20.696 1.00 0.95 H new ATOM 0 HB3 ALA A 54 10.618 -1.268 -19.365 1.00 0.95 H new ATOM 761 N SER A 55 9.471 -1.139 -16.505 1.00 0.75 N ATOM 762 CA SER A 55 9.538 -1.910 -15.229 1.00 0.71 C ATOM 763 C SER A 55 8.355 -1.520 -14.346 1.00 0.66 C ATOM 764 O SER A 55 7.614 -2.357 -13.871 1.00 0.66 O ATOM 765 CB SER A 55 10.847 -1.590 -14.498 1.00 0.76 C ATOM 766 OG SER A 55 11.155 -0.214 -14.672 1.00 1.37 O ATOM 0 H SER A 55 10.076 -0.319 -16.552 1.00 0.75 H new ATOM 0 HA SER A 55 9.501 -2.977 -15.447 1.00 0.71 H new ATOM 0 HB2 SER A 55 10.751 -1.822 -13.437 1.00 0.76 H new ATOM 0 HB3 SER A 55 11.656 -2.208 -14.888 1.00 0.76 H new ATOM 0 HG SER A 55 11.717 -0.103 -15.467 1.00 1.37 H new ATOM 772 N THR A 56 8.188 -0.249 -14.109 1.00 0.65 N ATOM 773 CA THR A 56 7.071 0.200 -13.239 1.00 0.62 C ATOM 774 C THR A 56 5.747 -0.060 -13.954 1.00 0.59 C ATOM 775 O THR A 56 4.706 -0.198 -13.340 1.00 0.57 O ATOM 776 CB THR A 56 7.232 1.696 -12.946 1.00 0.67 C ATOM 777 OG1 THR A 56 8.607 1.987 -12.730 1.00 1.09 O ATOM 778 CG2 THR A 56 6.437 2.063 -11.700 1.00 1.06 C ATOM 0 H THR A 56 8.777 0.496 -14.481 1.00 0.65 H new ATOM 0 HA THR A 56 7.082 -0.349 -12.298 1.00 0.62 H new ATOM 0 HB THR A 56 6.862 2.273 -13.794 1.00 0.67 H new ATOM 0 HG1 THR A 56 8.714 2.943 -12.544 1.00 1.09 H new ATOM 0 HG21 THR A 56 6.554 3.127 -11.494 1.00 1.06 H new ATOM 0 HG22 THR A 56 5.383 1.838 -11.862 1.00 1.06 H new ATOM 0 HG23 THR A 56 6.805 1.487 -10.851 1.00 1.06 H new ATOM 786 N LYS A 57 5.785 -0.125 -15.253 1.00 0.61 N ATOM 787 CA LYS A 57 4.542 -0.369 -16.027 1.00 0.59 C ATOM 788 C LYS A 57 4.073 -1.810 -15.808 1.00 0.54 C ATOM 789 O LYS A 57 2.892 -2.075 -15.692 1.00 0.52 O ATOM 790 CB LYS A 57 4.833 -0.123 -17.513 1.00 0.65 C ATOM 791 CG LYS A 57 3.649 -0.598 -18.396 1.00 1.20 C ATOM 792 CD LYS A 57 3.931 -1.987 -18.999 1.00 1.33 C ATOM 793 CE LYS A 57 2.936 -2.258 -20.127 1.00 1.94 C ATOM 794 NZ LYS A 57 3.027 -3.687 -20.540 1.00 2.73 N ATOM 0 H LYS A 57 6.630 -0.019 -15.815 1.00 0.61 H new ATOM 0 HA LYS A 57 3.753 0.306 -15.694 1.00 0.59 H new ATOM 0 HB2 LYS A 57 5.014 0.939 -17.681 1.00 0.65 H new ATOM 0 HB3 LYS A 57 5.742 -0.651 -17.802 1.00 0.65 H new ATOM 0 HG2 LYS A 57 2.738 -0.635 -17.799 1.00 1.20 H new ATOM 0 HG3 LYS A 57 3.476 0.121 -19.196 1.00 1.20 H new ATOM 0 HD2 LYS A 57 4.951 -2.031 -19.380 1.00 1.33 H new ATOM 0 HD3 LYS A 57 3.845 -2.755 -18.230 1.00 1.33 H new ATOM 0 HE2 LYS A 57 1.923 -2.028 -19.795 1.00 1.94 H new ATOM 0 HE3 LYS A 57 3.148 -1.609 -20.977 1.00 1.94 H new ATOM 0 HZ1 LYS A 57 2.350 -3.870 -21.308 1.00 2.73 H new ATOM 0 HZ2 LYS A 57 3.991 -3.892 -20.873 1.00 2.73 H new ATOM 0 HZ3 LYS A 57 2.804 -4.298 -19.728 1.00 2.73 H new ATOM 808 N LYS A 58 4.982 -2.747 -15.745 1.00 0.55 N ATOM 809 CA LYS A 58 4.561 -4.161 -15.530 1.00 0.53 C ATOM 810 C LYS A 58 4.087 -4.318 -14.081 1.00 0.48 C ATOM 811 O LYS A 58 3.081 -4.950 -13.824 1.00 0.46 O ATOM 812 CB LYS A 58 5.745 -5.101 -15.831 1.00 0.56 C ATOM 813 CG LYS A 58 5.422 -6.564 -15.464 1.00 0.78 C ATOM 814 CD LYS A 58 4.445 -7.165 -16.479 1.00 0.96 C ATOM 815 CE LYS A 58 4.214 -8.638 -16.143 1.00 0.85 C ATOM 816 NZ LYS A 58 3.468 -8.740 -14.857 1.00 1.75 N ATOM 0 H LYS A 58 5.987 -2.596 -15.832 1.00 0.55 H new ATOM 0 HA LYS A 58 3.742 -4.422 -16.200 1.00 0.53 H new ATOM 0 HB2 LYS A 58 5.998 -5.039 -16.889 1.00 0.56 H new ATOM 0 HB3 LYS A 58 6.622 -4.771 -15.274 1.00 0.56 H new ATOM 0 HG2 LYS A 58 6.340 -7.151 -15.441 1.00 0.78 H new ATOM 0 HG3 LYS A 58 4.991 -6.608 -14.464 1.00 0.78 H new ATOM 0 HD2 LYS A 58 3.500 -6.622 -16.457 1.00 0.96 H new ATOM 0 HD3 LYS A 58 4.845 -7.068 -17.488 1.00 0.96 H new ATOM 0 HE2 LYS A 58 3.651 -9.121 -16.942 1.00 0.85 H new ATOM 0 HE3 LYS A 58 5.168 -9.159 -16.065 1.00 0.85 H new ATOM 0 HZ1 LYS A 58 3.075 -9.698 -14.759 1.00 1.75 H new ATOM 0 HZ2 LYS A 58 4.114 -8.548 -14.065 1.00 1.75 H new ATOM 0 HZ3 LYS A 58 2.694 -8.046 -14.849 1.00 1.75 H new ATOM 830 N LEU A 59 4.796 -3.781 -13.126 1.00 0.50 N ATOM 831 CA LEU A 59 4.346 -3.959 -11.717 1.00 0.47 C ATOM 832 C LEU A 59 2.946 -3.342 -11.563 1.00 0.43 C ATOM 833 O LEU A 59 2.200 -3.683 -10.667 1.00 0.42 O ATOM 834 CB LEU A 59 5.341 -3.284 -10.744 1.00 0.53 C ATOM 835 CG LEU A 59 6.251 -4.312 -10.044 1.00 0.71 C ATOM 836 CD1 LEU A 59 7.382 -3.549 -9.347 1.00 1.07 C ATOM 837 CD2 LEU A 59 5.455 -5.078 -8.976 1.00 1.34 C ATOM 0 H LEU A 59 5.650 -3.238 -13.255 1.00 0.50 H new ATOM 0 HA LEU A 59 4.307 -5.021 -11.477 1.00 0.47 H new ATOM 0 HB2 LEU A 59 5.955 -2.569 -11.292 1.00 0.53 H new ATOM 0 HB3 LEU A 59 4.788 -2.719 -9.994 1.00 0.53 H new ATOM 0 HG LEU A 59 6.642 -5.016 -10.779 1.00 0.71 H new ATOM 0 HD11 LEU A 59 8.041 -4.256 -8.843 1.00 1.07 H new ATOM 0 HD12 LEU A 59 7.951 -2.986 -10.087 1.00 1.07 H new ATOM 0 HD13 LEU A 59 6.959 -2.861 -8.614 1.00 1.07 H new ATOM 0 HD21 LEU A 59 6.106 -5.802 -8.487 1.00 1.34 H new ATOM 0 HD22 LEU A 59 5.071 -4.376 -8.235 1.00 1.34 H new ATOM 0 HD23 LEU A 59 4.622 -5.600 -9.447 1.00 1.34 H new ATOM 849 N SER A 60 2.577 -2.462 -12.457 1.00 0.43 N ATOM 850 CA SER A 60 1.216 -1.853 -12.391 1.00 0.42 C ATOM 851 C SER A 60 0.215 -2.911 -12.860 1.00 0.39 C ATOM 852 O SER A 60 -0.869 -3.041 -12.330 1.00 0.41 O ATOM 853 CB SER A 60 1.155 -0.640 -13.318 1.00 0.47 C ATOM 854 OG SER A 60 -0.102 0.004 -13.164 1.00 1.36 O ATOM 0 H SER A 60 3.159 -2.139 -13.230 1.00 0.43 H new ATOM 0 HA SER A 60 0.985 -1.529 -11.376 1.00 0.42 H new ATOM 0 HB2 SER A 60 1.963 0.053 -13.083 1.00 0.47 H new ATOM 0 HB3 SER A 60 1.293 -0.951 -14.353 1.00 0.47 H new ATOM 0 HG SER A 60 -0.145 0.784 -13.756 1.00 1.36 H new ATOM 860 N GLU A 61 0.602 -3.694 -13.827 1.00 0.38 N ATOM 861 CA GLU A 61 -0.281 -4.789 -14.323 1.00 0.38 C ATOM 862 C GLU A 61 -0.594 -5.749 -13.171 1.00 0.38 C ATOM 863 O GLU A 61 -1.659 -6.331 -13.126 1.00 0.41 O ATOM 864 CB GLU A 61 0.428 -5.549 -15.446 1.00 0.39 C ATOM 865 CG GLU A 61 -0.546 -6.545 -16.079 1.00 1.06 C ATOM 866 CD GLU A 61 0.119 -7.221 -17.278 1.00 1.67 C ATOM 867 OE1 GLU A 61 0.419 -6.525 -18.235 1.00 2.25 O ATOM 868 OE2 GLU A 61 0.316 -8.423 -17.221 1.00 2.40 O ATOM 0 H GLU A 61 1.502 -3.622 -14.301 1.00 0.38 H new ATOM 0 HA GLU A 61 -1.209 -4.364 -14.705 1.00 0.38 H new ATOM 0 HB2 GLU A 61 0.792 -4.850 -16.199 1.00 0.39 H new ATOM 0 HB3 GLU A 61 1.298 -6.074 -15.052 1.00 0.39 H new ATOM 0 HG2 GLU A 61 -0.844 -7.294 -15.345 1.00 1.06 H new ATOM 0 HG3 GLU A 61 -1.453 -6.031 -16.396 1.00 1.06 H new ATOM 875 N CYS A 62 0.299 -5.925 -12.239 1.00 0.37 N ATOM 876 CA CYS A 62 -0.001 -6.854 -11.109 1.00 0.39 C ATOM 877 C CYS A 62 -1.003 -6.190 -10.151 1.00 0.38 C ATOM 878 O CYS A 62 -1.988 -6.784 -9.758 1.00 0.44 O ATOM 879 CB CYS A 62 1.291 -7.176 -10.357 1.00 0.41 C ATOM 880 SG CYS A 62 2.400 -8.112 -11.438 1.00 1.62 S ATOM 0 H CYS A 62 1.213 -5.474 -12.207 1.00 0.37 H new ATOM 0 HA CYS A 62 -0.431 -7.776 -11.501 1.00 0.39 H new ATOM 0 HB2 CYS A 62 1.774 -6.255 -10.032 1.00 0.41 H new ATOM 0 HB3 CYS A 62 1.068 -7.753 -9.459 1.00 0.41 H new ATOM 0 HG CYS A 62 3.142 -8.902 -10.720 1.00 1.62 H new ATOM 886 N LEU A 63 -0.762 -4.958 -9.792 1.00 0.35 N ATOM 887 CA LEU A 63 -1.689 -4.224 -8.880 1.00 0.36 C ATOM 888 C LEU A 63 -2.994 -3.907 -9.627 1.00 0.36 C ATOM 889 O LEU A 63 -4.044 -3.769 -9.032 1.00 0.41 O ATOM 890 CB LEU A 63 -0.987 -2.932 -8.431 1.00 0.38 C ATOM 891 CG LEU A 63 -1.873 -2.089 -7.493 1.00 0.69 C ATOM 892 CD1 LEU A 63 -2.487 -2.957 -6.379 1.00 1.39 C ATOM 893 CD2 LEU A 63 -1.012 -0.983 -6.851 1.00 1.11 C ATOM 0 H LEU A 63 0.050 -4.420 -10.096 1.00 0.35 H new ATOM 0 HA LEU A 63 -1.937 -4.827 -8.006 1.00 0.36 H new ATOM 0 HB2 LEU A 63 -0.057 -3.183 -7.922 1.00 0.38 H new ATOM 0 HB3 LEU A 63 -0.721 -2.341 -9.307 1.00 0.38 H new ATOM 0 HG LEU A 63 -2.683 -1.655 -8.079 1.00 0.69 H new ATOM 0 HD11 LEU A 63 -3.107 -2.335 -5.733 1.00 1.39 H new ATOM 0 HD12 LEU A 63 -3.100 -3.741 -6.824 1.00 1.39 H new ATOM 0 HD13 LEU A 63 -1.690 -3.410 -5.790 1.00 1.39 H new ATOM 0 HD21 LEU A 63 -1.630 -0.381 -6.185 1.00 1.11 H new ATOM 0 HD22 LEU A 63 -0.202 -1.438 -6.281 1.00 1.11 H new ATOM 0 HD23 LEU A 63 -0.595 -0.348 -7.632 1.00 1.11 H new ATOM 905 N LYS A 64 -2.932 -3.798 -10.922 1.00 0.35 N ATOM 906 CA LYS A 64 -4.162 -3.498 -11.718 1.00 0.37 C ATOM 907 C LYS A 64 -5.017 -4.765 -11.865 1.00 0.39 C ATOM 908 O LYS A 64 -6.210 -4.748 -11.637 1.00 0.43 O ATOM 909 CB LYS A 64 -3.758 -3.007 -13.108 1.00 0.38 C ATOM 910 CG LYS A 64 -5.015 -2.760 -13.953 1.00 0.82 C ATOM 911 CD LYS A 64 -4.660 -1.954 -15.232 1.00 1.35 C ATOM 912 CE LYS A 64 -5.052 -0.480 -15.065 1.00 1.38 C ATOM 913 NZ LYS A 64 -4.628 0.286 -16.271 1.00 2.09 N ATOM 0 H LYS A 64 -2.079 -3.904 -11.471 1.00 0.35 H new ATOM 0 HA LYS A 64 -4.739 -2.730 -11.203 1.00 0.37 H new ATOM 0 HB2 LYS A 64 -3.177 -2.089 -13.025 1.00 0.38 H new ATOM 0 HB3 LYS A 64 -3.120 -3.745 -13.594 1.00 0.38 H new ATOM 0 HG2 LYS A 64 -5.467 -3.712 -14.230 1.00 0.82 H new ATOM 0 HG3 LYS A 64 -5.754 -2.215 -13.366 1.00 0.82 H new ATOM 0 HD2 LYS A 64 -3.591 -2.032 -15.433 1.00 1.35 H new ATOM 0 HD3 LYS A 64 -5.178 -2.379 -16.092 1.00 1.35 H new ATOM 0 HE2 LYS A 64 -6.130 -0.393 -14.926 1.00 1.38 H new ATOM 0 HE3 LYS A 64 -4.581 -0.066 -14.174 1.00 1.38 H new ATOM 0 HZ1 LYS A 64 -4.953 1.271 -16.189 1.00 2.09 H new ATOM 0 HZ2 LYS A 64 -3.591 0.269 -16.346 1.00 2.09 H new ATOM 0 HZ3 LYS A 64 -5.044 -0.146 -17.121 1.00 2.09 H new ATOM 927 N ARG A 65 -4.420 -5.855 -12.261 1.00 0.43 N ATOM 928 CA ARG A 65 -5.196 -7.119 -12.444 1.00 0.47 C ATOM 929 C ARG A 65 -5.931 -7.509 -11.154 1.00 0.50 C ATOM 930 O ARG A 65 -7.009 -8.074 -11.193 1.00 0.54 O ATOM 931 CB ARG A 65 -4.233 -8.247 -12.826 1.00 0.45 C ATOM 932 CG ARG A 65 -5.034 -9.469 -13.285 1.00 0.94 C ATOM 933 CD ARG A 65 -4.079 -10.538 -13.819 1.00 1.55 C ATOM 934 NE ARG A 65 -4.867 -11.647 -14.429 1.00 1.86 N ATOM 935 CZ ARG A 65 -4.278 -12.519 -15.202 1.00 2.39 C ATOM 936 NH1 ARG A 65 -2.999 -12.421 -15.441 1.00 2.94 N ATOM 937 NH2 ARG A 65 -4.969 -13.488 -15.736 1.00 2.92 N ATOM 0 H ARG A 65 -3.424 -5.927 -12.467 1.00 0.43 H new ATOM 0 HA ARG A 65 -5.934 -6.959 -13.230 1.00 0.47 H new ATOM 0 HB2 ARG A 65 -3.566 -7.916 -13.622 1.00 0.45 H new ATOM 0 HB3 ARG A 65 -3.606 -8.509 -11.973 1.00 0.45 H new ATOM 0 HG2 ARG A 65 -5.615 -9.869 -12.454 1.00 0.94 H new ATOM 0 HG3 ARG A 65 -5.744 -9.181 -14.061 1.00 0.94 H new ATOM 0 HD2 ARG A 65 -3.408 -10.104 -14.560 1.00 1.55 H new ATOM 0 HD3 ARG A 65 -3.456 -10.922 -13.011 1.00 1.55 H new ATOM 0 HE ARG A 65 -5.867 -11.725 -14.242 1.00 1.86 H new ATOM 0 HH11 ARG A 65 -2.459 -11.663 -15.024 1.00 2.94 H new ATOM 0 HH12 ARG A 65 -2.539 -13.102 -16.045 1.00 2.94 H new ATOM 0 HH21 ARG A 65 -5.969 -13.564 -15.550 1.00 2.92 H new ATOM 0 HH22 ARG A 65 -4.509 -14.169 -16.340 1.00 2.92 H new ATOM 951 N ILE A 66 -5.364 -7.227 -10.008 1.00 0.49 N ATOM 952 CA ILE A 66 -6.037 -7.605 -8.723 1.00 0.53 C ATOM 953 C ILE A 66 -6.916 -6.452 -8.238 1.00 0.54 C ATOM 954 O ILE A 66 -7.927 -6.661 -7.599 1.00 0.60 O ATOM 955 CB ILE A 66 -4.958 -7.972 -7.699 1.00 0.52 C ATOM 956 CG1 ILE A 66 -4.121 -6.735 -7.362 1.00 1.22 C ATOM 957 CG2 ILE A 66 -4.084 -9.043 -8.356 1.00 1.29 C ATOM 958 CD1 ILE A 66 -2.946 -7.139 -6.471 1.00 1.25 C ATOM 0 H ILE A 66 -4.467 -6.753 -9.904 1.00 0.49 H new ATOM 0 HA ILE A 66 -6.687 -8.468 -8.867 1.00 0.53 H new ATOM 0 HB ILE A 66 -5.395 -8.340 -6.771 1.00 0.52 H new ATOM 0 HG12 ILE A 66 -3.754 -6.271 -8.278 1.00 1.22 H new ATOM 0 HG13 ILE A 66 -4.738 -5.993 -6.854 1.00 1.22 H new ATOM 0 HG21 ILE A 66 -3.295 -9.342 -7.666 1.00 1.29 H new ATOM 0 HG22 ILE A 66 -4.696 -9.910 -8.605 1.00 1.29 H new ATOM 0 HG23 ILE A 66 -3.638 -8.641 -9.265 1.00 1.29 H new ATOM 0 HD11 ILE A 66 -2.351 -6.258 -6.232 1.00 1.25 H new ATOM 0 HD12 ILE A 66 -3.324 -7.583 -5.550 1.00 1.25 H new ATOM 0 HD13 ILE A 66 -2.325 -7.865 -6.995 1.00 1.25 H new ATOM 970 N GLY A 67 -6.563 -5.239 -8.563 1.00 0.52 N ATOM 971 CA GLY A 67 -7.412 -4.087 -8.146 1.00 0.55 C ATOM 972 C GLY A 67 -8.802 -4.266 -8.758 1.00 0.53 C ATOM 973 O GLY A 67 -9.792 -3.815 -8.217 1.00 0.63 O ATOM 0 H GLY A 67 -5.728 -4.996 -9.096 1.00 0.52 H new ATOM 0 HA2 GLY A 67 -7.479 -4.039 -7.059 1.00 0.55 H new ATOM 0 HA3 GLY A 67 -6.969 -3.149 -8.479 1.00 0.55 H new ATOM 977 N ASP A 68 -8.885 -4.919 -9.886 1.00 0.54 N ATOM 978 CA ASP A 68 -10.211 -5.126 -10.539 1.00 0.54 C ATOM 979 C ASP A 68 -10.898 -6.353 -9.936 1.00 0.52 C ATOM 980 O ASP A 68 -12.065 -6.318 -9.599 1.00 0.56 O ATOM 981 CB ASP A 68 -10.009 -5.345 -12.040 1.00 0.60 C ATOM 982 CG ASP A 68 -11.372 -5.466 -12.726 1.00 1.43 C ATOM 983 OD1 ASP A 68 -12.257 -4.699 -12.382 1.00 2.12 O ATOM 984 OD2 ASP A 68 -11.507 -6.322 -13.585 1.00 2.20 O ATOM 0 H ASP A 68 -8.090 -5.319 -10.385 1.00 0.54 H new ATOM 0 HA ASP A 68 -10.834 -4.247 -10.376 1.00 0.54 H new ATOM 0 HB2 ASP A 68 -9.447 -4.514 -12.467 1.00 0.60 H new ATOM 0 HB3 ASP A 68 -9.422 -6.248 -12.211 1.00 0.60 H new ATOM 989 N GLU A 69 -10.189 -7.441 -9.804 1.00 0.56 N ATOM 990 CA GLU A 69 -10.811 -8.669 -9.230 1.00 0.56 C ATOM 991 C GLU A 69 -11.246 -8.405 -7.786 1.00 0.55 C ATOM 992 O GLU A 69 -12.395 -8.579 -7.431 1.00 0.73 O ATOM 993 CB GLU A 69 -9.794 -9.812 -9.255 1.00 0.61 C ATOM 994 CG GLU A 69 -10.495 -11.132 -8.929 1.00 0.84 C ATOM 995 CD GLU A 69 -11.375 -11.548 -10.109 1.00 1.65 C ATOM 996 OE1 GLU A 69 -10.840 -12.100 -11.056 1.00 2.23 O ATOM 997 OE2 GLU A 69 -12.569 -11.307 -10.046 1.00 2.48 O ATOM 0 H GLU A 69 -9.208 -7.533 -10.068 1.00 0.56 H new ATOM 0 HA GLU A 69 -11.684 -8.941 -9.823 1.00 0.56 H new ATOM 0 HB2 GLU A 69 -9.323 -9.872 -10.236 1.00 0.61 H new ATOM 0 HB3 GLU A 69 -9.001 -9.622 -8.532 1.00 0.61 H new ATOM 0 HG2 GLU A 69 -9.757 -11.907 -8.722 1.00 0.84 H new ATOM 0 HG3 GLU A 69 -11.102 -11.021 -8.030 1.00 0.84 H new ATOM 1004 N LEU A 70 -10.334 -8.001 -6.947 1.00 0.53 N ATOM 1005 CA LEU A 70 -10.689 -7.743 -5.522 1.00 0.52 C ATOM 1006 C LEU A 70 -11.803 -6.695 -5.425 1.00 0.54 C ATOM 1007 O LEU A 70 -12.741 -6.845 -4.667 1.00 0.60 O ATOM 1008 CB LEU A 70 -9.444 -7.224 -4.771 1.00 0.61 C ATOM 1009 CG LEU A 70 -8.544 -8.386 -4.305 1.00 0.70 C ATOM 1010 CD1 LEU A 70 -9.165 -9.112 -3.100 1.00 1.38 C ATOM 1011 CD2 LEU A 70 -8.332 -9.380 -5.451 1.00 1.61 C ATOM 0 H LEU A 70 -9.356 -7.838 -7.186 1.00 0.53 H new ATOM 0 HA LEU A 70 -11.038 -8.674 -5.076 1.00 0.52 H new ATOM 0 HB2 LEU A 70 -8.875 -6.560 -5.422 1.00 0.61 H new ATOM 0 HB3 LEU A 70 -9.756 -6.635 -3.909 1.00 0.61 H new ATOM 0 HG LEU A 70 -7.583 -7.970 -4.003 1.00 0.70 H new ATOM 0 HD11 LEU A 70 -8.511 -9.927 -2.790 1.00 1.38 H new ATOM 0 HD12 LEU A 70 -9.286 -8.410 -2.275 1.00 1.38 H new ATOM 0 HD13 LEU A 70 -10.139 -9.514 -3.380 1.00 1.38 H new ATOM 0 HD21 LEU A 70 -7.695 -10.197 -5.111 1.00 1.61 H new ATOM 0 HD22 LEU A 70 -9.295 -9.779 -5.769 1.00 1.61 H new ATOM 0 HD23 LEU A 70 -7.855 -8.872 -6.289 1.00 1.61 H new ATOM 1023 N ASP A 71 -11.695 -5.623 -6.159 1.00 0.67 N ATOM 1024 CA ASP A 71 -12.737 -4.563 -6.070 1.00 0.91 C ATOM 1025 C ASP A 71 -14.097 -5.096 -6.535 1.00 1.02 C ATOM 1026 O ASP A 71 -15.094 -4.423 -6.370 1.00 1.29 O ATOM 1027 CB ASP A 71 -12.329 -3.364 -6.928 1.00 1.09 C ATOM 1028 CG ASP A 71 -13.399 -2.275 -6.827 1.00 1.66 C ATOM 1029 OD1 ASP A 71 -13.869 -2.034 -5.728 1.00 2.25 O ATOM 1030 OD2 ASP A 71 -13.730 -1.701 -7.852 1.00 2.36 O ATOM 0 H ASP A 71 -10.935 -5.436 -6.813 1.00 0.67 H new ATOM 0 HA ASP A 71 -12.826 -4.252 -5.029 1.00 0.91 H new ATOM 0 HB2 ASP A 71 -11.367 -2.975 -6.594 1.00 1.09 H new ATOM 0 HB3 ASP A 71 -12.205 -3.672 -7.966 1.00 1.09 H new ATOM 1035 N SER A 72 -14.172 -6.288 -7.100 1.00 0.90 N ATOM 1036 CA SER A 72 -15.515 -6.816 -7.546 1.00 1.20 C ATOM 1037 C SER A 72 -16.024 -7.836 -6.521 1.00 0.98 C ATOM 1038 O SER A 72 -16.994 -8.533 -6.745 1.00 1.02 O ATOM 1039 CB SER A 72 -15.415 -7.445 -8.935 1.00 1.57 C ATOM 1040 OG SER A 72 -16.666 -8.023 -9.279 1.00 2.09 O ATOM 0 H SER A 72 -13.379 -6.907 -7.269 1.00 0.90 H new ATOM 0 HA SER A 72 -16.223 -5.989 -7.608 1.00 1.20 H new ATOM 0 HB2 SER A 72 -15.136 -6.690 -9.670 1.00 1.57 H new ATOM 0 HB3 SER A 72 -14.634 -8.205 -8.947 1.00 1.57 H new ATOM 0 HG SER A 72 -17.063 -8.440 -8.486 1.00 2.09 H new ATOM 1046 N ASN A 73 -15.403 -7.876 -5.376 1.00 0.92 N ATOM 1047 CA ASN A 73 -15.855 -8.781 -4.283 1.00 0.83 C ATOM 1048 C ASN A 73 -17.050 -8.122 -3.592 1.00 0.75 C ATOM 1049 O ASN A 73 -16.938 -7.058 -3.020 1.00 1.07 O ATOM 1050 CB ASN A 73 -14.712 -8.939 -3.265 1.00 0.91 C ATOM 1051 CG ASN A 73 -13.748 -10.034 -3.734 1.00 1.43 C ATOM 1052 OD1 ASN A 73 -12.546 -9.853 -3.714 1.00 2.29 O ATOM 1053 ND2 ASN A 73 -14.229 -11.173 -4.155 1.00 1.90 N ATOM 0 H ASN A 73 -14.586 -7.309 -5.147 1.00 0.92 H new ATOM 0 HA ASN A 73 -16.132 -9.758 -4.679 1.00 0.83 H new ATOM 0 HB2 ASN A 73 -14.178 -7.995 -3.154 1.00 0.91 H new ATOM 0 HB3 ASN A 73 -15.117 -9.193 -2.286 1.00 0.91 H new ATOM 0 HD21 ASN A 73 -13.596 -11.910 -4.467 1.00 1.90 H new ATOM 0 HD22 ASN A 73 -15.237 -11.326 -4.172 1.00 1.90 H new ATOM 1060 N MET A 74 -18.200 -8.746 -3.648 1.00 0.71 N ATOM 1061 CA MET A 74 -19.403 -8.146 -3.002 1.00 0.67 C ATOM 1062 C MET A 74 -19.335 -8.376 -1.493 1.00 0.67 C ATOM 1063 O MET A 74 -19.912 -7.642 -0.717 1.00 0.71 O ATOM 1064 CB MET A 74 -20.683 -8.762 -3.577 1.00 0.75 C ATOM 1065 CG MET A 74 -20.599 -8.801 -5.106 1.00 1.20 C ATOM 1066 SD MET A 74 -20.480 -7.114 -5.750 1.00 1.92 S ATOM 1067 CE MET A 74 -20.696 -7.524 -7.500 1.00 1.96 C ATOM 0 H MET A 74 -18.356 -9.641 -4.112 1.00 0.71 H new ATOM 0 HA MET A 74 -19.421 -7.075 -3.203 1.00 0.67 H new ATOM 0 HB2 MET A 74 -20.820 -9.770 -3.185 1.00 0.75 H new ATOM 0 HB3 MET A 74 -21.550 -8.179 -3.266 1.00 0.75 H new ATOM 0 HG2 MET A 74 -19.731 -9.382 -5.418 1.00 1.20 H new ATOM 0 HG3 MET A 74 -21.479 -9.297 -5.516 1.00 1.20 H new ATOM 0 HE1 MET A 74 -20.656 -6.612 -8.095 1.00 1.96 H new ATOM 0 HE2 MET A 74 -19.901 -8.199 -7.816 1.00 1.96 H new ATOM 0 HE3 MET A 74 -21.662 -8.009 -7.644 1.00 1.96 H new ATOM 1077 N GLU A 75 -18.596 -9.361 -1.069 1.00 0.70 N ATOM 1078 CA GLU A 75 -18.445 -9.610 0.387 1.00 0.75 C ATOM 1079 C GLU A 75 -17.427 -8.612 0.937 1.00 0.73 C ATOM 1080 O GLU A 75 -17.659 -7.960 1.935 1.00 0.78 O ATOM 1081 CB GLU A 75 -17.943 -11.035 0.613 1.00 0.87 C ATOM 1082 CG GLU A 75 -18.065 -11.377 2.094 1.00 1.15 C ATOM 1083 CD GLU A 75 -17.576 -12.807 2.335 1.00 1.70 C ATOM 1084 OE1 GLU A 75 -16.561 -13.168 1.762 1.00 2.29 O ATOM 1085 OE2 GLU A 75 -18.224 -13.515 3.087 1.00 2.21 O ATOM 0 H GLU A 75 -18.088 -10.007 -1.673 1.00 0.70 H new ATOM 0 HA GLU A 75 -19.403 -9.490 0.894 1.00 0.75 H new ATOM 0 HB2 GLU A 75 -18.524 -11.738 0.016 1.00 0.87 H new ATOM 0 HB3 GLU A 75 -16.906 -11.124 0.291 1.00 0.87 H new ATOM 0 HG2 GLU A 75 -17.478 -10.677 2.688 1.00 1.15 H new ATOM 0 HG3 GLU A 75 -19.102 -11.278 2.416 1.00 1.15 H new ATOM 1092 N LEU A 76 -16.313 -8.465 0.278 1.00 0.74 N ATOM 1093 CA LEU A 76 -15.293 -7.484 0.744 1.00 0.80 C ATOM 1094 C LEU A 76 -15.857 -6.067 0.554 1.00 0.75 C ATOM 1095 O LEU A 76 -15.531 -5.156 1.286 1.00 0.81 O ATOM 1096 CB LEU A 76 -13.991 -7.684 -0.053 1.00 0.92 C ATOM 1097 CG LEU A 76 -12.757 -7.251 0.763 1.00 1.00 C ATOM 1098 CD1 LEU A 76 -12.885 -5.775 1.164 1.00 1.57 C ATOM 1099 CD2 LEU A 76 -12.587 -8.148 2.009 1.00 1.51 C ATOM 0 H LEU A 76 -16.064 -8.982 -0.565 1.00 0.74 H new ATOM 0 HA LEU A 76 -15.065 -7.632 1.800 1.00 0.80 H new ATOM 0 HB2 LEU A 76 -13.893 -8.732 -0.334 1.00 0.92 H new ATOM 0 HB3 LEU A 76 -14.037 -7.109 -0.978 1.00 0.92 H new ATOM 0 HG LEU A 76 -11.867 -7.366 0.144 1.00 1.00 H new ATOM 0 HD11 LEU A 76 -12.009 -5.477 1.740 1.00 1.57 H new ATOM 0 HD12 LEU A 76 -12.956 -5.159 0.267 1.00 1.57 H new ATOM 0 HD13 LEU A 76 -13.781 -5.639 1.770 1.00 1.57 H new ATOM 0 HD21 LEU A 76 -11.711 -7.827 2.572 1.00 1.51 H new ATOM 0 HD22 LEU A 76 -13.473 -8.067 2.639 1.00 1.51 H new ATOM 0 HD23 LEU A 76 -12.457 -9.184 1.696 1.00 1.51 H new ATOM 1111 N GLN A 77 -16.751 -5.879 -0.373 1.00 0.76 N ATOM 1112 CA GLN A 77 -17.361 -4.529 -0.534 1.00 0.74 C ATOM 1113 C GLN A 77 -18.406 -4.349 0.574 1.00 0.71 C ATOM 1114 O GLN A 77 -18.710 -3.242 0.979 1.00 0.72 O ATOM 1115 CB GLN A 77 -18.017 -4.405 -1.917 1.00 0.71 C ATOM 1116 CG GLN A 77 -18.345 -2.939 -2.224 1.00 1.26 C ATOM 1117 CD GLN A 77 -19.539 -2.488 -1.382 1.00 1.59 C ATOM 1118 OE1 GLN A 77 -19.457 -1.511 -0.665 1.00 2.35 O ATOM 1119 NE2 GLN A 77 -20.655 -3.162 -1.438 1.00 2.03 N ATOM 0 H GLN A 77 -17.084 -6.592 -1.021 1.00 0.76 H new ATOM 0 HA GLN A 77 -16.597 -3.755 -0.457 1.00 0.74 H new ATOM 0 HB2 GLN A 77 -17.348 -4.802 -2.681 1.00 0.71 H new ATOM 0 HB3 GLN A 77 -18.928 -5.002 -1.949 1.00 0.71 H new ATOM 0 HG2 GLN A 77 -17.480 -2.311 -2.011 1.00 1.26 H new ATOM 0 HG3 GLN A 77 -18.571 -2.822 -3.284 1.00 1.26 H new ATOM 0 HE21 GLN A 77 -20.726 -3.983 -2.040 1.00 2.03 H new ATOM 0 HE22 GLN A 77 -21.457 -2.868 -0.880 1.00 2.03 H new ATOM 1128 N ARG A 78 -18.936 -5.425 1.097 1.00 0.72 N ATOM 1129 CA ARG A 78 -19.936 -5.294 2.199 1.00 0.73 C ATOM 1130 C ARG A 78 -19.178 -5.042 3.506 1.00 0.75 C ATOM 1131 O ARG A 78 -19.726 -4.595 4.494 1.00 0.79 O ATOM 1132 CB ARG A 78 -20.734 -6.626 2.326 1.00 0.74 C ATOM 1133 CG ARG A 78 -22.206 -6.469 1.866 1.00 0.94 C ATOM 1134 CD ARG A 78 -22.323 -6.774 0.371 1.00 1.23 C ATOM 1135 NE ARG A 78 -23.723 -6.527 -0.073 1.00 1.80 N ATOM 1136 CZ ARG A 78 -24.002 -6.459 -1.345 1.00 2.50 C ATOM 1137 NH1 ARG A 78 -23.054 -6.610 -2.229 1.00 2.83 N ATOM 1138 NH2 ARG A 78 -25.229 -6.243 -1.733 1.00 3.41 N ATOM 0 H ARG A 78 -18.722 -6.381 0.812 1.00 0.72 H new ATOM 0 HA ARG A 78 -20.623 -4.474 1.991 1.00 0.73 H new ATOM 0 HB2 ARG A 78 -20.248 -7.398 1.729 1.00 0.74 H new ATOM 0 HB3 ARG A 78 -20.712 -6.964 3.362 1.00 0.74 H new ATOM 0 HG2 ARG A 78 -22.847 -7.143 2.434 1.00 0.94 H new ATOM 0 HG3 ARG A 78 -22.552 -5.455 2.067 1.00 0.94 H new ATOM 0 HD2 ARG A 78 -21.634 -6.147 -0.195 1.00 1.23 H new ATOM 0 HD3 ARG A 78 -22.045 -7.810 0.176 1.00 1.23 H new ATOM 0 HE ARG A 78 -24.464 -6.411 0.618 1.00 1.80 H new ATOM 0 HH11 ARG A 78 -22.096 -6.781 -1.925 1.00 2.83 H new ATOM 0 HH12 ARG A 78 -23.271 -6.557 -3.224 1.00 2.83 H new ATOM 0 HH21 ARG A 78 -25.970 -6.127 -1.041 1.00 3.41 H new ATOM 0 HH22 ARG A 78 -25.447 -6.190 -2.728 1.00 3.41 H new ATOM 1152 N MET A 79 -17.912 -5.366 3.503 1.00 0.75 N ATOM 1153 CA MET A 79 -17.065 -5.207 4.714 1.00 0.77 C ATOM 1154 C MET A 79 -16.627 -3.747 4.832 1.00 0.77 C ATOM 1155 O MET A 79 -16.899 -3.080 5.810 1.00 0.78 O ATOM 1156 CB MET A 79 -15.837 -6.122 4.531 1.00 0.81 C ATOM 1157 CG MET A 79 -15.347 -6.692 5.865 1.00 1.08 C ATOM 1158 SD MET A 79 -16.487 -7.975 6.445 1.00 1.07 S ATOM 1159 CE MET A 79 -16.015 -7.919 8.193 1.00 0.81 C ATOM 0 H MET A 79 -17.422 -5.742 2.692 1.00 0.75 H new ATOM 0 HA MET A 79 -17.608 -5.477 5.620 1.00 0.77 H new ATOM 0 HB2 MET A 79 -16.091 -6.941 3.858 1.00 0.81 H new ATOM 0 HB3 MET A 79 -15.032 -5.559 4.059 1.00 0.81 H new ATOM 0 HG2 MET A 79 -14.347 -7.109 5.747 1.00 1.08 H new ATOM 0 HG3 MET A 79 -15.275 -5.896 6.606 1.00 1.08 H new ATOM 0 HE1 MET A 79 -16.605 -8.645 8.753 1.00 0.81 H new ATOM 0 HE2 MET A 79 -14.956 -8.158 8.292 1.00 0.81 H new ATOM 0 HE3 MET A 79 -16.199 -6.920 8.588 1.00 0.81 H new ATOM 1169 N ILE A 80 -15.951 -3.248 3.833 1.00 0.77 N ATOM 1170 CA ILE A 80 -15.497 -1.834 3.880 1.00 0.80 C ATOM 1171 C ILE A 80 -16.706 -0.939 4.139 1.00 0.80 C ATOM 1172 O ILE A 80 -16.599 0.109 4.745 1.00 0.83 O ATOM 1173 CB ILE A 80 -14.850 -1.460 2.546 1.00 0.82 C ATOM 1174 CG1 ILE A 80 -13.646 -2.372 2.296 1.00 0.84 C ATOM 1175 CG2 ILE A 80 -14.386 -0.003 2.595 1.00 0.89 C ATOM 1176 CD1 ILE A 80 -13.171 -2.210 0.850 1.00 1.10 C ATOM 0 H ILE A 80 -15.695 -3.760 2.989 1.00 0.77 H new ATOM 0 HA ILE A 80 -14.765 -1.703 4.677 1.00 0.80 H new ATOM 0 HB ILE A 80 -15.574 -1.582 1.741 1.00 0.82 H new ATOM 0 HG12 ILE A 80 -12.839 -2.123 2.985 1.00 0.84 H new ATOM 0 HG13 ILE A 80 -13.918 -3.410 2.486 1.00 0.84 H new ATOM 0 HG21 ILE A 80 -13.925 0.264 1.644 1.00 0.89 H new ATOM 0 HG22 ILE A 80 -15.243 0.646 2.778 1.00 0.89 H new ATOM 0 HG23 ILE A 80 -13.660 0.121 3.398 1.00 0.89 H new ATOM 0 HD11 ILE A 80 -12.314 -2.860 0.674 1.00 1.10 H new ATOM 0 HD12 ILE A 80 -13.978 -2.481 0.169 1.00 1.10 H new ATOM 0 HD13 ILE A 80 -12.882 -1.173 0.676 1.00 1.10 H new ATOM 1188 N ALA A 81 -17.864 -1.353 3.693 1.00 0.78 N ATOM 1189 CA ALA A 81 -19.082 -0.532 3.927 1.00 0.80 C ATOM 1190 C ALA A 81 -19.501 -0.670 5.391 1.00 0.81 C ATOM 1191 O ALA A 81 -20.261 0.124 5.910 1.00 0.85 O ATOM 1192 CB ALA A 81 -20.213 -1.015 3.021 1.00 0.79 C ATOM 0 H ALA A 81 -18.015 -2.221 3.179 1.00 0.78 H new ATOM 0 HA ALA A 81 -18.869 0.513 3.701 1.00 0.80 H new ATOM 0 HB1 ALA A 81 -21.103 -0.410 3.196 1.00 0.79 H new ATOM 0 HB2 ALA A 81 -19.910 -0.920 1.978 1.00 0.79 H new ATOM 0 HB3 ALA A 81 -20.435 -2.059 3.241 1.00 0.79 H new ATOM 1198 N ALA A 82 -19.010 -1.678 6.058 1.00 0.78 N ATOM 1199 CA ALA A 82 -19.374 -1.883 7.489 1.00 0.80 C ATOM 1200 C ALA A 82 -18.520 -0.983 8.374 1.00 0.79 C ATOM 1201 O ALA A 82 -18.858 -0.710 9.508 1.00 0.83 O ATOM 1202 CB ALA A 82 -19.092 -3.327 7.874 1.00 0.87 C ATOM 0 H ALA A 82 -18.370 -2.372 5.672 1.00 0.78 H new ATOM 0 HA ALA A 82 -20.430 -1.647 7.623 1.00 0.80 H new ATOM 0 HB1 ALA A 82 -19.356 -3.483 8.920 1.00 0.87 H new ATOM 0 HB2 ALA A 82 -19.684 -3.993 7.247 1.00 0.87 H new ATOM 0 HB3 ALA A 82 -18.033 -3.541 7.732 1.00 0.87 H new ATOM 1208 N VAL A 83 -17.419 -0.516 7.866 1.00 0.80 N ATOM 1209 CA VAL A 83 -16.543 0.370 8.677 1.00 0.85 C ATOM 1210 C VAL A 83 -17.080 1.799 8.604 1.00 0.99 C ATOM 1211 O VAL A 83 -18.230 2.037 8.896 1.00 1.36 O ATOM 1212 CB VAL A 83 -15.101 0.308 8.149 1.00 0.97 C ATOM 1213 CG1 VAL A 83 -14.128 0.818 9.215 1.00 1.81 C ATOM 1214 CG2 VAL A 83 -14.744 -1.138 7.793 1.00 1.40 C ATOM 0 H VAL A 83 -17.086 -0.709 6.922 1.00 0.80 H new ATOM 0 HA VAL A 83 -16.540 0.039 9.715 1.00 0.85 H new ATOM 0 HB VAL A 83 -15.025 0.936 7.261 1.00 0.97 H new ATOM 0 HG11 VAL A 83 -13.109 0.770 8.831 1.00 1.81 H new ATOM 0 HG12 VAL A 83 -14.372 1.850 9.467 1.00 1.81 H new ATOM 0 HG13 VAL A 83 -14.209 0.198 10.108 1.00 1.81 H new ATOM 0 HG21 VAL A 83 -13.721 -1.179 7.419 1.00 1.40 H new ATOM 0 HG22 VAL A 83 -14.831 -1.763 8.681 1.00 1.40 H new ATOM 0 HG23 VAL A 83 -15.426 -1.503 7.025 1.00 1.40 H new ATOM 1273 N PRO A 88 -10.172 8.784 9.856 1.00 0.77 N ATOM 1274 CA PRO A 88 -9.331 7.947 8.975 1.00 0.83 C ATOM 1275 C PRO A 88 -7.873 7.936 9.457 1.00 0.73 C ATOM 1276 O PRO A 88 -7.090 7.098 9.056 1.00 0.72 O ATOM 1277 CB PRO A 88 -9.452 8.600 7.573 1.00 1.01 C ATOM 1278 CG PRO A 88 -10.438 9.796 7.695 1.00 1.07 C ATOM 1279 CD PRO A 88 -10.810 9.941 9.186 1.00 0.83 C ATOM 0 HA PRO A 88 -9.652 6.905 8.968 1.00 0.83 H new ATOM 0 HB2 PRO A 88 -8.477 8.941 7.224 1.00 1.01 H new ATOM 0 HB3 PRO A 88 -9.816 7.876 6.844 1.00 1.01 H new ATOM 0 HG2 PRO A 88 -9.978 10.712 7.324 1.00 1.07 H new ATOM 0 HG3 PRO A 88 -11.329 9.621 7.093 1.00 1.07 H new ATOM 0 HD2 PRO A 88 -10.445 10.884 9.594 1.00 0.83 H new ATOM 0 HD3 PRO A 88 -11.891 9.931 9.326 1.00 0.83 H new ATOM 1287 N ARG A 89 -7.493 8.860 10.300 1.00 0.75 N ATOM 1288 CA ARG A 89 -6.079 8.885 10.773 1.00 0.73 C ATOM 1289 C ARG A 89 -5.868 7.794 11.826 1.00 0.67 C ATOM 1290 O ARG A 89 -4.929 7.026 11.756 1.00 0.68 O ATOM 1291 CB ARG A 89 -5.758 10.255 11.377 1.00 0.79 C ATOM 1292 CG ARG A 89 -5.866 11.334 10.296 1.00 1.63 C ATOM 1293 CD ARG A 89 -5.919 12.715 10.955 1.00 1.65 C ATOM 1294 NE ARG A 89 -4.829 12.824 11.965 1.00 2.07 N ATOM 1295 CZ ARG A 89 -4.499 13.992 12.448 1.00 2.47 C ATOM 1296 NH1 ARG A 89 -5.130 15.064 12.052 1.00 2.69 N ATOM 1297 NH2 ARG A 89 -3.540 14.087 13.328 1.00 3.10 N ATOM 0 H ARG A 89 -8.095 9.592 10.678 1.00 0.75 H new ATOM 0 HA ARG A 89 -5.415 8.702 9.928 1.00 0.73 H new ATOM 0 HB2 ARG A 89 -6.447 10.474 12.193 1.00 0.79 H new ATOM 0 HB3 ARG A 89 -4.754 10.250 11.800 1.00 0.79 H new ATOM 0 HG2 ARG A 89 -5.012 11.274 9.621 1.00 1.63 H new ATOM 0 HG3 ARG A 89 -6.760 11.172 9.694 1.00 1.63 H new ATOM 0 HD2 ARG A 89 -5.810 13.494 10.201 1.00 1.65 H new ATOM 0 HD3 ARG A 89 -6.888 12.866 11.432 1.00 1.65 H new ATOM 0 HE ARG A 89 -4.340 11.986 12.280 1.00 2.07 H new ATOM 0 HH11 ARG A 89 -5.881 14.990 11.365 1.00 2.69 H new ATOM 0 HH12 ARG A 89 -4.872 15.976 12.429 1.00 2.69 H new ATOM 0 HH21 ARG A 89 -3.048 13.249 13.639 1.00 3.10 H new ATOM 0 HH22 ARG A 89 -3.282 14.999 13.705 1.00 3.10 H new ATOM 1311 N GLU A 90 -6.735 7.715 12.800 1.00 0.65 N ATOM 1312 CA GLU A 90 -6.580 6.667 13.849 1.00 0.65 C ATOM 1313 C GLU A 90 -6.794 5.293 13.212 1.00 0.64 C ATOM 1314 O GLU A 90 -6.051 4.365 13.459 1.00 0.67 O ATOM 1315 CB GLU A 90 -7.619 6.892 14.949 1.00 0.71 C ATOM 1316 CG GLU A 90 -7.337 8.223 15.648 1.00 1.32 C ATOM 1317 CD GLU A 90 -6.047 8.109 16.462 1.00 2.02 C ATOM 1318 OE1 GLU A 90 -6.083 7.484 17.509 1.00 2.46 O ATOM 1319 OE2 GLU A 90 -5.043 8.648 16.024 1.00 2.78 O ATOM 0 H GLU A 90 -7.541 8.329 12.914 1.00 0.65 H new ATOM 0 HA GLU A 90 -5.581 6.719 14.283 1.00 0.65 H new ATOM 0 HB2 GLU A 90 -8.622 6.898 14.522 1.00 0.71 H new ATOM 0 HB3 GLU A 90 -7.585 6.075 15.670 1.00 0.71 H new ATOM 0 HG2 GLU A 90 -7.245 9.021 14.911 1.00 1.32 H new ATOM 0 HG3 GLU A 90 -8.169 8.487 16.301 1.00 1.32 H new ATOM 1326 N VAL A 91 -7.807 5.148 12.402 1.00 0.64 N ATOM 1327 CA VAL A 91 -8.068 3.827 11.763 1.00 0.67 C ATOM 1328 C VAL A 91 -6.903 3.466 10.838 1.00 0.66 C ATOM 1329 O VAL A 91 -6.423 2.351 10.838 1.00 0.67 O ATOM 1330 CB VAL A 91 -9.369 3.912 10.960 1.00 0.71 C ATOM 1331 CG1 VAL A 91 -9.700 2.549 10.354 1.00 0.80 C ATOM 1332 CG2 VAL A 91 -10.508 4.345 11.886 1.00 0.75 C ATOM 0 H VAL A 91 -8.465 5.887 12.155 1.00 0.64 H new ATOM 0 HA VAL A 91 -8.163 3.056 12.528 1.00 0.67 H new ATOM 0 HB VAL A 91 -9.247 4.640 10.158 1.00 0.71 H new ATOM 0 HG11 VAL A 91 -10.627 2.619 9.785 1.00 0.80 H new ATOM 0 HG12 VAL A 91 -8.891 2.239 9.693 1.00 0.80 H new ATOM 0 HG13 VAL A 91 -9.819 1.815 11.151 1.00 0.80 H new ATOM 0 HG21 VAL A 91 -11.436 4.407 11.317 1.00 0.75 H new ATOM 0 HG22 VAL A 91 -10.622 3.616 12.688 1.00 0.75 H new ATOM 0 HG23 VAL A 91 -10.279 5.321 12.313 1.00 0.75 H new ATOM 1342 N PHE A 92 -6.445 4.398 10.053 1.00 0.64 N ATOM 1343 CA PHE A 92 -5.311 4.108 9.132 1.00 0.65 C ATOM 1344 C PHE A 92 -4.105 3.590 9.925 1.00 0.62 C ATOM 1345 O PHE A 92 -3.449 2.652 9.520 1.00 0.67 O ATOM 1346 CB PHE A 92 -4.919 5.390 8.389 1.00 0.65 C ATOM 1347 CG PHE A 92 -3.673 5.144 7.570 1.00 0.65 C ATOM 1348 CD1 PHE A 92 -3.774 4.596 6.285 1.00 1.44 C ATOM 1349 CD2 PHE A 92 -2.415 5.460 8.099 1.00 1.31 C ATOM 1350 CE1 PHE A 92 -2.618 4.366 5.530 1.00 1.47 C ATOM 1351 CE2 PHE A 92 -1.260 5.230 7.343 1.00 1.31 C ATOM 1352 CZ PHE A 92 -1.361 4.683 6.058 1.00 0.73 C ATOM 0 H PHE A 92 -6.807 5.351 10.008 1.00 0.64 H new ATOM 0 HA PHE A 92 -5.620 3.346 8.417 1.00 0.65 H new ATOM 0 HB2 PHE A 92 -5.735 5.710 7.741 1.00 0.65 H new ATOM 0 HB3 PHE A 92 -4.744 6.196 9.102 1.00 0.65 H new ATOM 0 HD1 PHE A 92 -4.743 4.351 5.877 1.00 1.44 H new ATOM 0 HD2 PHE A 92 -2.336 5.881 9.090 1.00 1.31 H new ATOM 0 HE1 PHE A 92 -2.696 3.944 4.539 1.00 1.47 H new ATOM 0 HE2 PHE A 92 -0.290 5.475 7.751 1.00 1.31 H new ATOM 0 HZ PHE A 92 -0.470 4.506 5.475 1.00 0.73 H new ATOM 1362 N PHE A 93 -3.789 4.197 11.040 1.00 0.58 N ATOM 1363 CA PHE A 93 -2.604 3.731 11.824 1.00 0.57 C ATOM 1364 C PHE A 93 -2.978 2.501 12.658 1.00 0.59 C ATOM 1365 O PHE A 93 -2.186 1.595 12.828 1.00 0.60 O ATOM 1366 CB PHE A 93 -2.122 4.857 12.742 1.00 0.57 C ATOM 1367 CG PHE A 93 -0.827 4.459 13.406 1.00 0.56 C ATOM 1368 CD1 PHE A 93 0.394 4.724 12.774 1.00 1.47 C ATOM 1369 CD2 PHE A 93 -0.846 3.831 14.657 1.00 1.15 C ATOM 1370 CE1 PHE A 93 1.596 4.360 13.393 1.00 1.58 C ATOM 1371 CE2 PHE A 93 0.356 3.466 15.276 1.00 1.07 C ATOM 1372 CZ PHE A 93 1.577 3.731 14.644 1.00 0.70 C ATOM 0 H PHE A 93 -4.294 4.988 11.439 1.00 0.58 H new ATOM 0 HA PHE A 93 -1.803 3.460 11.136 1.00 0.57 H new ATOM 0 HB2 PHE A 93 -1.980 5.772 12.166 1.00 0.57 H new ATOM 0 HB3 PHE A 93 -2.878 5.071 13.498 1.00 0.57 H new ATOM 0 HD1 PHE A 93 0.409 5.209 11.809 1.00 1.47 H new ATOM 0 HD2 PHE A 93 -1.788 3.628 15.145 1.00 1.15 H new ATOM 0 HE1 PHE A 93 2.538 4.564 12.906 1.00 1.58 H new ATOM 0 HE2 PHE A 93 0.341 2.980 16.241 1.00 1.07 H new ATOM 0 HZ PHE A 93 2.504 3.450 15.121 1.00 0.70 H new ATOM 1382 N ARG A 94 -4.175 2.453 13.176 1.00 0.62 N ATOM 1383 CA ARG A 94 -4.584 1.272 13.990 1.00 0.67 C ATOM 1384 C ARG A 94 -4.722 0.051 13.075 1.00 0.66 C ATOM 1385 O ARG A 94 -4.082 -0.960 13.289 1.00 0.67 O ATOM 1386 CB ARG A 94 -5.917 1.564 14.693 1.00 0.72 C ATOM 1387 CG ARG A 94 -6.091 0.640 15.908 1.00 0.89 C ATOM 1388 CD ARG A 94 -6.198 -0.822 15.455 1.00 1.00 C ATOM 1389 NE ARG A 94 -6.924 -1.606 16.495 1.00 1.95 N ATOM 1390 CZ ARG A 94 -7.388 -2.793 16.215 1.00 2.64 C ATOM 1391 NH1 ARG A 94 -7.211 -3.299 15.025 1.00 2.76 N ATOM 1392 NH2 ARG A 94 -8.027 -3.476 17.125 1.00 3.65 N ATOM 0 H ARG A 94 -4.885 3.177 13.072 1.00 0.62 H new ATOM 0 HA ARG A 94 -3.827 1.067 14.747 1.00 0.67 H new ATOM 0 HB2 ARG A 94 -5.947 2.606 15.012 1.00 0.72 H new ATOM 0 HB3 ARG A 94 -6.743 1.420 13.996 1.00 0.72 H new ATOM 0 HG2 ARG A 94 -5.246 0.757 16.586 1.00 0.89 H new ATOM 0 HG3 ARG A 94 -6.986 0.922 16.463 1.00 0.89 H new ATOM 0 HD2 ARG A 94 -6.725 -0.882 14.503 1.00 1.00 H new ATOM 0 HD3 ARG A 94 -5.204 -1.240 15.296 1.00 1.00 H new ATOM 0 HE ARG A 94 -7.058 -1.214 17.427 1.00 1.95 H new ATOM 0 HH11 ARG A 94 -6.710 -2.767 14.314 1.00 2.76 H new ATOM 0 HH12 ARG A 94 -7.574 -4.227 14.806 1.00 2.76 H new ATOM 0 HH21 ARG A 94 -8.164 -3.082 18.056 1.00 3.65 H new ATOM 0 HH22 ARG A 94 -8.389 -4.404 16.905 1.00 3.65 H new ATOM 1406 N VAL A 95 -5.526 0.121 12.051 1.00 0.65 N ATOM 1407 CA VAL A 95 -5.668 -1.045 11.136 1.00 0.66 C ATOM 1408 C VAL A 95 -4.303 -1.432 10.565 1.00 0.66 C ATOM 1409 O VAL A 95 -3.963 -2.595 10.471 1.00 0.67 O ATOM 1410 CB VAL A 95 -6.594 -0.649 9.984 1.00 0.64 C ATOM 1411 CG1 VAL A 95 -6.674 -1.793 8.970 1.00 1.27 C ATOM 1412 CG2 VAL A 95 -7.991 -0.368 10.540 1.00 1.08 C ATOM 0 H VAL A 95 -6.091 0.935 11.808 1.00 0.65 H new ATOM 0 HA VAL A 95 -6.079 -1.892 11.685 1.00 0.66 H new ATOM 0 HB VAL A 95 -6.204 0.242 9.492 1.00 0.64 H new ATOM 0 HG11 VAL A 95 -7.334 -1.508 8.151 1.00 1.27 H new ATOM 0 HG12 VAL A 95 -5.679 -2.002 8.578 1.00 1.27 H new ATOM 0 HG13 VAL A 95 -7.066 -2.685 9.458 1.00 1.27 H new ATOM 0 HG21 VAL A 95 -8.657 -0.085 9.725 1.00 1.08 H new ATOM 0 HG22 VAL A 95 -8.375 -1.264 11.028 1.00 1.08 H new ATOM 0 HG23 VAL A 95 -7.938 0.445 11.264 1.00 1.08 H new ATOM 1422 N ALA A 96 -3.527 -0.462 10.158 1.00 0.65 N ATOM 1423 CA ALA A 96 -2.197 -0.771 9.564 1.00 0.68 C ATOM 1424 C ALA A 96 -1.362 -1.569 10.568 1.00 0.70 C ATOM 1425 O ALA A 96 -0.995 -2.707 10.354 1.00 0.76 O ATOM 1426 CB ALA A 96 -1.483 0.545 9.252 1.00 0.69 C ATOM 0 H ALA A 96 -3.758 0.530 10.212 1.00 0.65 H new ATOM 0 HA ALA A 96 -2.325 -1.356 8.653 1.00 0.68 H new ATOM 0 HB1 ALA A 96 -0.506 0.335 8.816 1.00 0.69 H new ATOM 0 HB2 ALA A 96 -2.079 1.124 8.546 1.00 0.69 H new ATOM 0 HB3 ALA A 96 -1.354 1.116 10.171 1.00 0.69 H new ATOM 1432 N ALA A 97 -1.084 -0.935 11.678 1.00 0.74 N ATOM 1433 CA ALA A 97 -0.285 -1.575 12.767 1.00 0.78 C ATOM 1434 C ALA A 97 -0.731 -3.027 12.950 1.00 0.79 C ATOM 1435 O ALA A 97 0.070 -3.905 13.202 1.00 0.83 O ATOM 1436 CB ALA A 97 -0.511 -0.812 14.074 1.00 0.77 C ATOM 0 H ALA A 97 -1.383 0.019 11.880 1.00 0.74 H new ATOM 0 HA ALA A 97 0.772 -1.551 12.501 1.00 0.78 H new ATOM 0 HB1 ALA A 97 0.070 -1.276 14.871 1.00 0.77 H new ATOM 0 HB2 ALA A 97 -0.195 0.224 13.950 1.00 0.77 H new ATOM 0 HB3 ALA A 97 -1.569 -0.840 14.333 1.00 0.77 H new ATOM 1442 N ASP A 98 -2.001 -3.286 12.826 1.00 0.78 N ATOM 1443 CA ASP A 98 -2.496 -4.679 12.994 1.00 0.82 C ATOM 1444 C ASP A 98 -1.915 -5.575 11.898 1.00 0.83 C ATOM 1445 O ASP A 98 -1.642 -6.737 12.127 1.00 0.88 O ATOM 1446 CB ASP A 98 -4.025 -4.695 12.920 1.00 0.82 C ATOM 1447 CG ASP A 98 -4.539 -6.090 13.279 1.00 1.47 C ATOM 1448 OD1 ASP A 98 -4.700 -6.355 14.460 1.00 2.19 O ATOM 1449 OD2 ASP A 98 -4.765 -6.870 12.369 1.00 2.13 O ATOM 0 H ASP A 98 -2.719 -2.593 12.615 1.00 0.78 H new ATOM 0 HA ASP A 98 -2.179 -5.056 13.966 1.00 0.82 H new ATOM 0 HB2 ASP A 98 -4.440 -3.956 13.605 1.00 0.82 H new ATOM 0 HB3 ASP A 98 -4.354 -4.422 11.917 1.00 0.82 H new ATOM 1454 N MET A 99 -1.744 -5.074 10.704 1.00 0.81 N ATOM 1455 CA MET A 99 -1.207 -5.948 9.622 1.00 0.85 C ATOM 1456 C MET A 99 0.237 -6.349 9.938 1.00 0.97 C ATOM 1457 O MET A 99 0.711 -7.371 9.484 1.00 1.14 O ATOM 1458 CB MET A 99 -1.241 -5.212 8.282 1.00 0.79 C ATOM 1459 CG MET A 99 -2.687 -4.984 7.846 1.00 0.81 C ATOM 1460 SD MET A 99 -2.696 -4.312 6.166 1.00 0.97 S ATOM 1461 CE MET A 99 -4.469 -3.973 6.069 1.00 0.48 C ATOM 0 H MET A 99 -1.949 -4.112 10.434 1.00 0.81 H new ATOM 0 HA MET A 99 -1.828 -6.841 9.560 1.00 0.85 H new ATOM 0 HB2 MET A 99 -0.724 -4.256 8.370 1.00 0.79 H new ATOM 0 HB3 MET A 99 -0.712 -5.792 7.526 1.00 0.79 H new ATOM 0 HG2 MET A 99 -3.243 -5.921 7.880 1.00 0.81 H new ATOM 0 HG3 MET A 99 -3.182 -4.295 8.530 1.00 0.81 H new ATOM 0 HE1 MET A 99 -4.705 -3.544 5.095 1.00 0.48 H new ATOM 0 HE2 MET A 99 -5.025 -4.901 6.201 1.00 0.48 H new ATOM 0 HE3 MET A 99 -4.748 -3.269 6.853 1.00 0.48 H new ATOM 1600 N ARG A 109 0.309 -7.971 3.791 1.00 0.86 N ATOM 1601 CA ARG A 109 0.474 -6.594 4.339 1.00 0.87 C ATOM 1602 C ARG A 109 0.705 -5.581 3.214 1.00 0.70 C ATOM 1603 O ARG A 109 -0.012 -4.609 3.082 1.00 0.81 O ATOM 1604 CB ARG A 109 1.717 -6.570 5.286 1.00 1.08 C ATOM 1605 CG ARG A 109 2.479 -7.899 5.223 1.00 1.48 C ATOM 1606 CD ARG A 109 3.825 -7.754 5.945 1.00 1.96 C ATOM 1607 NE ARG A 109 4.814 -7.115 5.033 1.00 2.74 N ATOM 1608 CZ ARG A 109 5.900 -6.579 5.520 1.00 3.19 C ATOM 1609 NH1 ARG A 109 6.094 -6.552 6.810 1.00 3.19 N ATOM 1610 NH2 ARG A 109 6.785 -6.055 4.716 1.00 4.08 N ATOM 0 HA ARG A 109 -0.434 -6.326 4.878 1.00 0.87 H new ATOM 0 HB2 ARG A 109 2.380 -5.753 5.002 1.00 1.08 H new ATOM 0 HB3 ARG A 109 1.395 -6.379 6.310 1.00 1.08 H new ATOM 0 HG2 ARG A 109 1.890 -8.690 5.686 1.00 1.48 H new ATOM 0 HG3 ARG A 109 2.641 -8.188 4.185 1.00 1.48 H new ATOM 0 HD2 ARG A 109 3.703 -7.152 6.845 1.00 1.96 H new ATOM 0 HD3 ARG A 109 4.186 -8.732 6.262 1.00 1.96 H new ATOM 0 HE ARG A 109 4.643 -7.096 4.028 1.00 2.74 H new ATOM 0 HH11 ARG A 109 5.397 -6.950 7.439 1.00 3.19 H new ATOM 0 HH12 ARG A 109 6.943 -6.133 7.189 1.00 3.19 H new ATOM 0 HH21 ARG A 109 6.628 -6.065 3.708 1.00 4.08 H new ATOM 0 HH22 ARG A 109 7.634 -5.636 5.096 1.00 4.08 H new ATOM 1624 N VAL A 110 1.743 -5.768 2.446 1.00 0.60 N ATOM 1625 CA VAL A 110 2.059 -4.775 1.387 1.00 0.68 C ATOM 1626 C VAL A 110 0.867 -4.600 0.445 1.00 0.56 C ATOM 1627 O VAL A 110 0.233 -3.563 0.421 1.00 0.60 O ATOM 1628 CB VAL A 110 3.292 -5.231 0.605 1.00 0.88 C ATOM 1629 CG1 VAL A 110 3.721 -4.131 -0.366 1.00 1.27 C ATOM 1630 CG2 VAL A 110 4.436 -5.521 1.580 1.00 1.73 C ATOM 0 H VAL A 110 2.381 -6.561 2.507 1.00 0.60 H new ATOM 0 HA VAL A 110 2.269 -3.813 1.855 1.00 0.68 H new ATOM 0 HB VAL A 110 3.050 -6.135 0.045 1.00 0.88 H new ATOM 0 HG11 VAL A 110 4.600 -4.459 -0.922 1.00 1.27 H new ATOM 0 HG12 VAL A 110 2.908 -3.923 -1.062 1.00 1.27 H new ATOM 0 HG13 VAL A 110 3.961 -3.226 0.192 1.00 1.27 H new ATOM 0 HG21 VAL A 110 5.315 -5.846 1.023 1.00 1.73 H new ATOM 0 HG22 VAL A 110 4.675 -4.617 2.140 1.00 1.73 H new ATOM 0 HG23 VAL A 110 4.134 -6.307 2.272 1.00 1.73 H new ATOM 1640 N VAL A 111 0.568 -5.592 -0.351 1.00 0.51 N ATOM 1641 CA VAL A 111 -0.565 -5.468 -1.309 1.00 0.50 C ATOM 1642 C VAL A 111 -1.808 -4.919 -0.603 1.00 0.46 C ATOM 1643 O VAL A 111 -2.438 -3.979 -1.046 1.00 0.47 O ATOM 1644 CB VAL A 111 -0.894 -6.855 -1.869 1.00 0.58 C ATOM 1645 CG1 VAL A 111 -1.934 -6.721 -2.985 1.00 1.41 C ATOM 1646 CG2 VAL A 111 0.379 -7.485 -2.439 1.00 1.36 C ATOM 0 H VAL A 111 1.062 -6.484 -0.378 1.00 0.51 H new ATOM 0 HA VAL A 111 -0.277 -4.786 -2.109 1.00 0.50 H new ATOM 0 HB VAL A 111 -1.292 -7.484 -1.073 1.00 0.58 H new ATOM 0 HG11 VAL A 111 -2.169 -7.708 -3.384 1.00 1.41 H new ATOM 0 HG12 VAL A 111 -2.840 -6.266 -2.585 1.00 1.41 H new ATOM 0 HG13 VAL A 111 -1.534 -6.093 -3.781 1.00 1.41 H new ATOM 0 HG21 VAL A 111 0.149 -8.473 -2.839 1.00 1.36 H new ATOM 0 HG22 VAL A 111 0.772 -6.854 -3.236 1.00 1.36 H new ATOM 0 HG23 VAL A 111 1.124 -7.578 -1.649 1.00 1.36 H new ATOM 1656 N ALA A 112 -2.160 -5.534 0.501 1.00 0.45 N ATOM 1657 CA ALA A 112 -3.361 -5.108 1.277 1.00 0.47 C ATOM 1658 C ALA A 112 -3.220 -3.659 1.747 1.00 0.46 C ATOM 1659 O ALA A 112 -4.187 -3.038 2.141 1.00 0.54 O ATOM 1660 CB ALA A 112 -3.533 -6.026 2.492 1.00 0.53 C ATOM 0 H ALA A 112 -1.656 -6.325 0.901 1.00 0.45 H new ATOM 0 HA ALA A 112 -4.236 -5.178 0.631 1.00 0.47 H new ATOM 0 HB1 ALA A 112 -4.410 -5.717 3.061 1.00 0.53 H new ATOM 0 HB2 ALA A 112 -3.663 -7.055 2.155 1.00 0.53 H new ATOM 0 HB3 ALA A 112 -2.648 -5.961 3.125 1.00 0.53 H new ATOM 1666 N LEU A 113 -2.041 -3.101 1.709 1.00 0.43 N ATOM 1667 CA LEU A 113 -1.882 -1.683 2.158 1.00 0.43 C ATOM 1668 C LEU A 113 -2.133 -0.748 0.968 1.00 0.42 C ATOM 1669 O LEU A 113 -2.895 0.193 1.060 1.00 0.45 O ATOM 1670 CB LEU A 113 -0.463 -1.480 2.704 1.00 0.44 C ATOM 1671 CG LEU A 113 -0.245 -0.017 3.120 1.00 0.51 C ATOM 1672 CD1 LEU A 113 -1.300 0.406 4.155 1.00 1.45 C ATOM 1673 CD2 LEU A 113 1.156 0.116 3.727 1.00 1.27 C ATOM 0 H LEU A 113 -1.187 -3.558 1.390 1.00 0.43 H new ATOM 0 HA LEU A 113 -2.600 -1.457 2.947 1.00 0.43 H new ATOM 0 HB2 LEU A 113 -0.300 -2.135 3.560 1.00 0.44 H new ATOM 0 HB3 LEU A 113 0.268 -1.760 1.945 1.00 0.44 H new ATOM 0 HG LEU A 113 -0.339 0.628 2.247 1.00 0.51 H new ATOM 0 HD11 LEU A 113 -1.133 1.445 4.441 1.00 1.45 H new ATOM 0 HD12 LEU A 113 -2.295 0.304 3.723 1.00 1.45 H new ATOM 0 HD13 LEU A 113 -1.220 -0.230 5.037 1.00 1.45 H new ATOM 0 HD21 LEU A 113 1.326 1.150 4.027 1.00 1.27 H new ATOM 0 HD22 LEU A 113 1.238 -0.533 4.599 1.00 1.27 H new ATOM 0 HD23 LEU A 113 1.902 -0.174 2.987 1.00 1.27 H new ATOM 1685 N PHE A 114 -1.498 -0.994 -0.145 1.00 0.40 N ATOM 1686 CA PHE A 114 -1.706 -0.110 -1.330 1.00 0.40 C ATOM 1687 C PHE A 114 -3.192 -0.051 -1.700 1.00 0.39 C ATOM 1688 O PHE A 114 -3.728 0.999 -1.994 1.00 0.41 O ATOM 1689 CB PHE A 114 -0.913 -0.638 -2.533 1.00 0.41 C ATOM 1690 CG PHE A 114 0.553 -0.892 -2.194 1.00 0.44 C ATOM 1691 CD1 PHE A 114 1.189 -0.275 -1.094 1.00 1.29 C ATOM 1692 CD2 PHE A 114 1.288 -1.756 -3.018 1.00 1.27 C ATOM 1693 CE1 PHE A 114 2.540 -0.531 -0.835 1.00 1.38 C ATOM 1694 CE2 PHE A 114 2.640 -2.005 -2.753 1.00 1.27 C ATOM 1695 CZ PHE A 114 3.264 -1.393 -1.663 1.00 0.68 C ATOM 0 H PHE A 114 -0.846 -1.766 -0.286 1.00 0.40 H new ATOM 0 HA PHE A 114 -1.357 0.890 -1.072 1.00 0.40 H new ATOM 0 HB2 PHE A 114 -1.367 -1.563 -2.887 1.00 0.41 H new ATOM 0 HB3 PHE A 114 -0.975 0.081 -3.350 1.00 0.41 H new ATOM 0 HD1 PHE A 114 0.633 0.394 -0.454 1.00 1.29 H new ATOM 0 HD2 PHE A 114 0.809 -2.232 -3.861 1.00 1.27 H new ATOM 0 HE1 PHE A 114 3.025 -0.061 0.008 1.00 1.38 H new ATOM 0 HE2 PHE A 114 3.201 -2.671 -3.392 1.00 1.27 H new ATOM 0 HZ PHE A 114 4.307 -1.586 -1.460 1.00 0.68 H new ATOM 1705 N TYR A 115 -3.857 -1.175 -1.704 1.00 0.40 N ATOM 1706 CA TYR A 115 -5.304 -1.188 -2.074 1.00 0.41 C ATOM 1707 C TYR A 115 -6.148 -0.563 -0.961 1.00 0.41 C ATOM 1708 O TYR A 115 -7.113 0.132 -1.219 1.00 0.44 O ATOM 1709 CB TYR A 115 -5.762 -2.632 -2.308 1.00 0.44 C ATOM 1710 CG TYR A 115 -7.235 -2.649 -2.649 1.00 0.47 C ATOM 1711 CD1 TYR A 115 -7.652 -2.370 -3.956 1.00 1.28 C ATOM 1712 CD2 TYR A 115 -8.183 -2.944 -1.661 1.00 1.24 C ATOM 1713 CE1 TYR A 115 -9.016 -2.387 -4.276 1.00 1.32 C ATOM 1714 CE2 TYR A 115 -9.547 -2.960 -1.980 1.00 1.26 C ATOM 1715 CZ TYR A 115 -9.963 -2.682 -3.288 1.00 0.61 C ATOM 1716 OH TYR A 115 -11.307 -2.698 -3.603 1.00 0.70 O ATOM 0 H TYR A 115 -3.462 -2.085 -1.467 1.00 0.40 H new ATOM 0 HA TYR A 115 -5.435 -0.606 -2.986 1.00 0.41 H new ATOM 0 HB2 TYR A 115 -5.186 -3.080 -3.118 1.00 0.44 H new ATOM 0 HB3 TYR A 115 -5.578 -3.231 -1.416 1.00 0.44 H new ATOM 0 HD1 TYR A 115 -6.922 -2.141 -4.718 1.00 1.28 H new ATOM 0 HD2 TYR A 115 -7.862 -3.159 -0.652 1.00 1.24 H new ATOM 0 HE1 TYR A 115 -9.337 -2.173 -5.285 1.00 1.32 H new ATOM 0 HE2 TYR A 115 -10.277 -3.187 -1.217 1.00 1.26 H new ATOM 0 HH TYR A 115 -11.828 -2.921 -2.803 1.00 0.70 H new ATOM 1726 N PHE A 116 -5.796 -0.793 0.271 1.00 0.38 N ATOM 1727 CA PHE A 116 -6.593 -0.198 1.377 1.00 0.38 C ATOM 1728 C PHE A 116 -6.543 1.328 1.255 1.00 0.36 C ATOM 1729 O PHE A 116 -7.542 2.016 1.371 1.00 0.35 O ATOM 1730 CB PHE A 116 -5.997 -0.615 2.726 1.00 0.40 C ATOM 1731 CG PHE A 116 -6.748 0.068 3.852 1.00 0.37 C ATOM 1732 CD1 PHE A 116 -8.044 -0.352 4.191 1.00 1.17 C ATOM 1733 CD2 PHE A 116 -6.149 1.120 4.559 1.00 1.35 C ATOM 1734 CE1 PHE A 116 -8.735 0.279 5.232 1.00 1.18 C ATOM 1735 CE2 PHE A 116 -6.843 1.750 5.601 1.00 1.37 C ATOM 1736 CZ PHE A 116 -8.135 1.329 5.936 1.00 0.45 C ATOM 0 H PHE A 116 -4.999 -1.361 0.559 1.00 0.38 H new ATOM 0 HA PHE A 116 -7.624 -0.547 1.316 1.00 0.38 H new ATOM 0 HB2 PHE A 116 -6.056 -1.697 2.841 1.00 0.40 H new ATOM 0 HB3 PHE A 116 -4.941 -0.347 2.766 1.00 0.40 H new ATOM 0 HD1 PHE A 116 -8.508 -1.162 3.648 1.00 1.17 H new ATOM 0 HD2 PHE A 116 -5.152 1.445 4.301 1.00 1.35 H new ATOM 0 HE1 PHE A 116 -9.732 -0.045 5.492 1.00 1.18 H new ATOM 0 HE2 PHE A 116 -6.381 2.560 6.145 1.00 1.37 H new ATOM 0 HZ PHE A 116 -8.670 1.815 6.739 1.00 0.45 H new ATOM 1746 N ALA A 117 -5.372 1.859 1.013 1.00 0.35 N ATOM 1747 CA ALA A 117 -5.228 3.330 0.875 1.00 0.34 C ATOM 1748 C ALA A 117 -5.842 3.799 -0.444 1.00 0.34 C ATOM 1749 O ALA A 117 -6.374 4.885 -0.532 1.00 0.34 O ATOM 1750 CB ALA A 117 -3.746 3.706 0.907 1.00 0.37 C ATOM 0 H ALA A 117 -4.507 1.329 0.905 1.00 0.35 H new ATOM 0 HA ALA A 117 -5.747 3.814 1.702 1.00 0.34 H new ATOM 0 HB1 ALA A 117 -3.642 4.786 0.806 1.00 0.37 H new ATOM 0 HB2 ALA A 117 -3.310 3.387 1.854 1.00 0.37 H new ATOM 0 HB3 ALA A 117 -3.228 3.213 0.085 1.00 0.37 H new ATOM 1756 N SER A 118 -5.782 2.996 -1.476 1.00 0.35 N ATOM 1757 CA SER A 118 -6.368 3.420 -2.776 1.00 0.37 C ATOM 1758 C SER A 118 -7.800 3.904 -2.564 1.00 0.36 C ATOM 1759 O SER A 118 -8.232 4.880 -3.142 1.00 0.36 O ATOM 1760 CB SER A 118 -6.369 2.236 -3.745 1.00 0.42 C ATOM 1761 OG SER A 118 -7.358 1.299 -3.340 1.00 1.25 O ATOM 0 H SER A 118 -5.354 2.070 -1.472 1.00 0.35 H new ATOM 0 HA SER A 118 -5.771 4.232 -3.191 1.00 0.37 H new ATOM 0 HB2 SER A 118 -6.572 2.581 -4.759 1.00 0.42 H new ATOM 0 HB3 SER A 118 -5.387 1.763 -3.760 1.00 0.42 H new ATOM 0 HG SER A 118 -7.311 1.172 -2.369 1.00 1.25 H new ATOM 1767 N LYS A 119 -8.529 3.238 -1.710 1.00 0.37 N ATOM 1768 CA LYS A 119 -9.927 3.665 -1.423 1.00 0.39 C ATOM 1769 C LYS A 119 -9.886 4.988 -0.643 1.00 0.36 C ATOM 1770 O LYS A 119 -10.510 5.953 -1.037 1.00 0.38 O ATOM 1771 CB LYS A 119 -10.643 2.574 -0.604 1.00 0.46 C ATOM 1772 CG LYS A 119 -12.162 2.613 -0.869 1.00 1.29 C ATOM 1773 CD LYS A 119 -12.502 1.831 -2.155 1.00 1.84 C ATOM 1774 CE LYS A 119 -12.717 0.347 -1.831 1.00 2.48 C ATOM 1775 NZ LYS A 119 -13.997 0.182 -1.086 1.00 3.36 N ATOM 0 H LYS A 119 -8.215 2.414 -1.197 1.00 0.37 H new ATOM 0 HA LYS A 119 -10.477 3.812 -2.353 1.00 0.39 H new ATOM 0 HB2 LYS A 119 -10.246 1.593 -0.867 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -10.449 2.721 0.458 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -12.697 2.183 -0.022 1.00 1.29 H new ATOM 0 HG3 LYS A 119 -12.495 3.647 -0.965 1.00 1.29 H new ATOM 0 HD2 LYS A 119 -13.400 2.244 -2.614 1.00 1.84 H new ATOM 0 HD3 LYS A 119 -11.695 1.939 -2.879 1.00 1.84 H new ATOM 0 HE2 LYS A 119 -12.741 -0.237 -2.751 1.00 2.48 H new ATOM 0 HE3 LYS A 119 -11.886 -0.030 -1.235 1.00 2.48 H new ATOM 0 HZ1 LYS A 119 -14.246 -0.827 -1.043 1.00 3.36 H new ATOM 0 HZ2 LYS A 119 -13.887 0.553 -0.121 1.00 3.36 H new ATOM 0 HZ3 LYS A 119 -14.752 0.705 -1.574 1.00 3.36 H new ATOM 1789 N LEU A 120 -9.145 5.065 0.434 1.00 0.36 N ATOM 1790 CA LEU A 120 -9.069 6.361 1.186 1.00 0.35 C ATOM 1791 C LEU A 120 -8.810 7.499 0.186 1.00 0.33 C ATOM 1792 O LEU A 120 -9.431 8.542 0.231 1.00 0.39 O ATOM 1793 CB LEU A 120 -7.922 6.294 2.207 1.00 0.36 C ATOM 1794 CG LEU A 120 -8.371 5.503 3.452 1.00 0.68 C ATOM 1795 CD1 LEU A 120 -7.143 5.119 4.283 1.00 1.69 C ATOM 1796 CD2 LEU A 120 -9.328 6.345 4.322 1.00 1.28 C ATOM 0 H LEU A 120 -8.595 4.299 0.823 1.00 0.36 H new ATOM 0 HA LEU A 120 -10.005 6.542 1.714 1.00 0.35 H new ATOM 0 HB2 LEU A 120 -7.051 5.817 1.757 1.00 0.36 H new ATOM 0 HB3 LEU A 120 -7.621 7.301 2.495 1.00 0.36 H new ATOM 0 HG LEU A 120 -8.896 4.607 3.121 1.00 0.68 H new ATOM 0 HD11 LEU A 120 -7.460 4.560 5.163 1.00 1.69 H new ATOM 0 HD12 LEU A 120 -6.475 4.502 3.682 1.00 1.69 H new ATOM 0 HD13 LEU A 120 -6.619 6.022 4.596 1.00 1.69 H new ATOM 0 HD21 LEU A 120 -9.631 5.766 5.194 1.00 1.28 H new ATOM 0 HD22 LEU A 120 -8.820 7.253 4.648 1.00 1.28 H new ATOM 0 HD23 LEU A 120 -10.210 6.612 3.739 1.00 1.28 H new ATOM 1808 N VAL A 121 -7.920 7.270 -0.738 1.00 0.33 N ATOM 1809 CA VAL A 121 -7.612 8.279 -1.794 1.00 0.39 C ATOM 1810 C VAL A 121 -8.825 8.469 -2.707 1.00 0.36 C ATOM 1811 O VAL A 121 -9.413 9.530 -2.771 1.00 0.39 O ATOM 1812 CB VAL A 121 -6.446 7.766 -2.640 1.00 0.54 C ATOM 1813 CG1 VAL A 121 -6.152 8.774 -3.754 1.00 0.95 C ATOM 1814 CG2 VAL A 121 -5.205 7.609 -1.756 1.00 1.18 C ATOM 0 H VAL A 121 -7.380 6.407 -0.808 1.00 0.33 H new ATOM 0 HA VAL A 121 -7.359 9.228 -1.321 1.00 0.39 H new ATOM 0 HB VAL A 121 -6.705 6.801 -3.076 1.00 0.54 H new ATOM 0 HG11 VAL A 121 -5.321 8.414 -4.361 1.00 0.95 H new ATOM 0 HG12 VAL A 121 -7.036 8.891 -4.381 1.00 0.95 H new ATOM 0 HG13 VAL A 121 -5.889 9.736 -3.314 1.00 0.95 H new ATOM 0 HG21 VAL A 121 -4.373 7.243 -2.358 1.00 1.18 H new ATOM 0 HG22 VAL A 121 -4.943 8.574 -1.323 1.00 1.18 H new ATOM 0 HG23 VAL A 121 -5.415 6.898 -0.957 1.00 1.18 H new ATOM 1824 N LEU A 122 -9.190 7.444 -3.424 1.00 0.37 N ATOM 1825 CA LEU A 122 -10.354 7.551 -4.350 1.00 0.39 C ATOM 1826 C LEU A 122 -11.583 8.051 -3.579 1.00 0.40 C ATOM 1827 O LEU A 122 -12.264 8.961 -4.010 1.00 0.40 O ATOM 1828 CB LEU A 122 -10.637 6.165 -4.990 1.00 0.42 C ATOM 1829 CG LEU A 122 -10.750 6.279 -6.524 1.00 0.72 C ATOM 1830 CD1 LEU A 122 -9.351 6.372 -7.142 1.00 1.15 C ATOM 1831 CD2 LEU A 122 -11.459 5.040 -7.081 1.00 1.24 C ATOM 0 H LEU A 122 -8.732 6.533 -3.409 1.00 0.37 H new ATOM 0 HA LEU A 122 -10.128 8.263 -5.143 1.00 0.39 H new ATOM 0 HB2 LEU A 122 -9.838 5.471 -4.731 1.00 0.42 H new ATOM 0 HB3 LEU A 122 -11.561 5.754 -4.583 1.00 0.42 H new ATOM 0 HG LEU A 122 -11.320 7.174 -6.772 1.00 0.72 H new ATOM 0 HD11 LEU A 122 -9.437 6.452 -8.226 1.00 1.15 H new ATOM 0 HD12 LEU A 122 -8.839 7.252 -6.752 1.00 1.15 H new ATOM 0 HD13 LEU A 122 -8.781 5.478 -6.888 1.00 1.15 H new ATOM 0 HD21 LEU A 122 -11.538 5.122 -8.165 1.00 1.24 H new ATOM 0 HD22 LEU A 122 -10.887 4.148 -6.826 1.00 1.24 H new ATOM 0 HD23 LEU A 122 -12.457 4.967 -6.649 1.00 1.24 H new ATOM 1843 N LYS A 123 -11.877 7.469 -2.451 1.00 0.51 N ATOM 1844 CA LYS A 123 -13.065 7.928 -1.680 1.00 0.55 C ATOM 1845 C LYS A 123 -12.974 9.440 -1.450 1.00 0.54 C ATOM 1846 O LYS A 123 -13.969 10.129 -1.465 1.00 0.55 O ATOM 1847 CB LYS A 123 -13.132 7.202 -0.324 1.00 0.59 C ATOM 1848 CG LYS A 123 -14.583 7.153 0.166 1.00 0.97 C ATOM 1849 CD LYS A 123 -14.647 6.413 1.502 1.00 1.37 C ATOM 1850 CE LYS A 123 -16.109 6.162 1.872 1.00 1.74 C ATOM 1851 NZ LYS A 123 -16.737 5.282 0.846 1.00 2.32 N ATOM 0 H LYS A 123 -11.351 6.702 -2.032 1.00 0.51 H new ATOM 0 HA LYS A 123 -13.966 7.699 -2.248 1.00 0.55 H new ATOM 0 HB2 LYS A 123 -12.737 6.191 -0.422 1.00 0.59 H new ATOM 0 HB3 LYS A 123 -12.509 7.718 0.407 1.00 0.59 H new ATOM 0 HG2 LYS A 123 -14.974 8.164 0.280 1.00 0.97 H new ATOM 0 HG3 LYS A 123 -15.210 6.650 -0.570 1.00 0.97 H new ATOM 0 HD2 LYS A 123 -14.110 5.467 1.433 1.00 1.37 H new ATOM 0 HD3 LYS A 123 -14.159 7.000 2.280 1.00 1.37 H new ATOM 0 HE2 LYS A 123 -16.171 5.695 2.855 1.00 1.74 H new ATOM 0 HE3 LYS A 123 -16.647 7.108 1.934 1.00 1.74 H new ATOM 0 HZ1 LYS A 123 -17.507 4.736 1.282 1.00 2.32 H new ATOM 0 HZ2 LYS A 123 -17.120 5.866 0.075 1.00 2.32 H new ATOM 0 HZ3 LYS A 123 -16.023 4.629 0.464 1.00 2.32 H new ATOM 1865 N ALA A 124 -11.789 9.960 -1.231 1.00 0.52 N ATOM 1866 CA ALA A 124 -11.657 11.429 -0.987 1.00 0.52 C ATOM 1867 C ALA A 124 -11.849 12.190 -2.295 1.00 0.51 C ATOM 1868 O ALA A 124 -12.279 13.327 -2.314 1.00 0.54 O ATOM 1869 CB ALA A 124 -10.289 11.748 -0.394 1.00 0.51 C ATOM 0 H ALA A 124 -10.915 9.434 -1.211 1.00 0.52 H new ATOM 0 HA ALA A 124 -12.424 11.737 -0.277 1.00 0.52 H new ATOM 0 HB1 ALA A 124 -10.208 12.821 -0.222 1.00 0.51 H new ATOM 0 HB2 ALA A 124 -10.170 11.219 0.552 1.00 0.51 H new ATOM 0 HB3 ALA A 124 -9.509 11.432 -1.087 1.00 0.51 H new ATOM 1875 N LEU A 125 -11.545 11.558 -3.394 1.00 0.47 N ATOM 1876 CA LEU A 125 -11.719 12.222 -4.711 1.00 0.47 C ATOM 1877 C LEU A 125 -13.207 12.519 -4.916 1.00 0.48 C ATOM 1878 O LEU A 125 -13.584 13.583 -5.364 1.00 0.48 O ATOM 1879 CB LEU A 125 -11.217 11.275 -5.822 1.00 0.51 C ATOM 1880 CG LEU A 125 -10.711 12.075 -7.034 1.00 0.49 C ATOM 1881 CD1 LEU A 125 -10.422 11.110 -8.187 1.00 1.10 C ATOM 1882 CD2 LEU A 125 -11.773 13.090 -7.479 1.00 1.21 C ATOM 0 H LEU A 125 -11.182 10.606 -3.434 1.00 0.47 H new ATOM 0 HA LEU A 125 -11.151 13.152 -4.747 1.00 0.47 H new ATOM 0 HB2 LEU A 125 -10.415 10.646 -5.435 1.00 0.51 H new ATOM 0 HB3 LEU A 125 -12.023 10.610 -6.131 1.00 0.51 H new ATOM 0 HG LEU A 125 -9.802 12.609 -6.756 1.00 0.49 H new ATOM 0 HD11 LEU A 125 -10.063 11.671 -9.050 1.00 1.10 H new ATOM 0 HD12 LEU A 125 -9.662 10.392 -7.879 1.00 1.10 H new ATOM 0 HD13 LEU A 125 -11.335 10.579 -8.454 1.00 1.10 H new ATOM 0 HD21 LEU A 125 -11.403 13.650 -8.338 1.00 1.21 H new ATOM 0 HD22 LEU A 125 -12.686 12.563 -7.755 1.00 1.21 H new ATOM 0 HD23 LEU A 125 -11.984 13.778 -6.660 1.00 1.21 H new ATOM 1894 N CYS A 126 -14.056 11.574 -4.612 1.00 0.52 N ATOM 1895 CA CYS A 126 -15.513 11.796 -4.818 1.00 0.57 C ATOM 1896 C CYS A 126 -16.023 12.833 -3.814 1.00 0.57 C ATOM 1897 O CYS A 126 -16.769 13.736 -4.134 1.00 0.68 O ATOM 1898 CB CYS A 126 -16.259 10.451 -4.641 1.00 0.66 C ATOM 1899 SG CYS A 126 -16.738 10.192 -2.907 1.00 1.67 S ATOM 0 H CYS A 126 -13.803 10.662 -4.232 1.00 0.52 H new ATOM 0 HA CYS A 126 -15.695 12.173 -5.824 1.00 0.57 H new ATOM 0 HB2 CYS A 126 -17.147 10.438 -5.273 1.00 0.66 H new ATOM 0 HB3 CYS A 126 -15.621 9.631 -4.972 1.00 0.66 H new ATOM 0 HG CYS A 126 -15.670 10.098 -2.171 1.00 1.67 H new ATOM 1905 N THR A 127 -15.630 12.660 -2.585 1.00 0.57 N ATOM 1906 CA THR A 127 -16.083 13.577 -1.506 1.00 0.60 C ATOM 1907 C THR A 127 -15.806 15.033 -1.892 1.00 0.62 C ATOM 1908 O THR A 127 -16.308 15.930 -1.254 1.00 0.70 O ATOM 1909 CB THR A 127 -15.367 13.218 -0.182 1.00 0.60 C ATOM 1910 OG1 THR A 127 -14.679 12.001 -0.356 1.00 1.14 O ATOM 1911 CG2 THR A 127 -16.376 13.040 0.953 1.00 1.19 C ATOM 0 H THR A 127 -15.007 11.913 -2.279 1.00 0.57 H new ATOM 0 HA THR A 127 -17.158 13.462 -1.368 1.00 0.60 H new ATOM 0 HB THR A 127 -14.682 14.026 0.074 1.00 0.60 H new ATOM 0 HG1 THR A 127 -15.268 11.255 -0.116 1.00 1.14 H new ATOM 0 HG21 THR A 127 -15.848 12.788 1.873 1.00 1.19 H new ATOM 0 HG22 THR A 127 -16.931 13.967 1.095 1.00 1.19 H new ATOM 0 HG23 THR A 127 -17.069 12.237 0.701 1.00 1.19 H new ATOM 1919 N LYS A 128 -15.020 15.275 -2.925 1.00 0.60 N ATOM 1920 CA LYS A 128 -14.746 16.691 -3.334 1.00 0.70 C ATOM 1921 C LYS A 128 -13.789 17.377 -2.365 1.00 0.61 C ATOM 1922 O LYS A 128 -13.934 18.556 -2.104 1.00 0.60 O ATOM 1923 CB LYS A 128 -16.054 17.510 -3.413 1.00 0.87 C ATOM 1924 CG LYS A 128 -17.129 16.715 -4.168 1.00 1.12 C ATOM 1925 CD LYS A 128 -18.255 17.659 -4.599 1.00 1.43 C ATOM 1926 CE LYS A 128 -19.428 16.838 -5.138 1.00 1.83 C ATOM 1927 NZ LYS A 128 -20.073 16.098 -4.016 1.00 2.47 N ATOM 0 H LYS A 128 -14.564 14.561 -3.493 1.00 0.60 H new ATOM 0 HA LYS A 128 -14.284 16.650 -4.320 1.00 0.70 H new ATOM 0 HB2 LYS A 128 -16.405 17.748 -2.409 1.00 0.87 H new ATOM 0 HB3 LYS A 128 -15.869 18.458 -3.919 1.00 0.87 H new ATOM 0 HG2 LYS A 128 -16.692 16.231 -5.041 1.00 1.12 H new ATOM 0 HG3 LYS A 128 -17.526 15.925 -3.531 1.00 1.12 H new ATOM 0 HD2 LYS A 128 -18.579 18.266 -3.754 1.00 1.43 H new ATOM 0 HD3 LYS A 128 -17.895 18.346 -5.365 1.00 1.43 H new ATOM 0 HE2 LYS A 128 -20.153 17.493 -5.620 1.00 1.83 H new ATOM 0 HE3 LYS A 128 -19.078 16.138 -5.896 1.00 1.83 H new ATOM 0 HZ1 LYS A 128 -21.054 15.867 -4.271 1.00 2.47 H new ATOM 0 HZ2 LYS A 128 -19.547 15.220 -3.831 1.00 2.47 H new ATOM 0 HZ3 LYS A 128 -20.068 16.690 -3.161 1.00 2.47 H new ATOM 1941 N VAL A 129 -12.782 16.690 -1.858 1.00 0.60 N ATOM 1942 CA VAL A 129 -11.790 17.362 -0.948 1.00 0.53 C ATOM 1943 C VAL A 129 -10.378 16.991 -1.438 1.00 0.53 C ATOM 1944 O VAL A 129 -9.724 16.170 -0.827 1.00 0.56 O ATOM 1945 CB VAL A 129 -11.978 16.852 0.480 1.00 0.57 C ATOM 1946 CG1 VAL A 129 -11.133 17.684 1.444 1.00 1.40 C ATOM 1947 CG2 VAL A 129 -13.453 16.941 0.867 1.00 1.22 C ATOM 0 H VAL A 129 -12.607 15.701 -2.034 1.00 0.60 H new ATOM 0 HA VAL A 129 -11.932 18.443 -0.960 1.00 0.53 H new ATOM 0 HB VAL A 129 -11.656 15.812 0.536 1.00 0.57 H new ATOM 0 HG11 VAL A 129 -11.272 17.315 2.460 1.00 1.40 H new ATOM 0 HG12 VAL A 129 -10.081 17.603 1.169 1.00 1.40 H new ATOM 0 HG13 VAL A 129 -11.443 18.728 1.391 1.00 1.40 H new ATOM 0 HG21 VAL A 129 -13.584 16.577 1.886 1.00 1.22 H new ATOM 0 HG22 VAL A 129 -13.783 17.978 0.807 1.00 1.22 H new ATOM 0 HG23 VAL A 129 -14.046 16.332 0.185 1.00 1.22 H new ATOM 1957 N PRO A 130 -9.955 17.568 -2.548 1.00 0.62 N ATOM 1958 CA PRO A 130 -8.637 17.247 -3.128 1.00 0.73 C ATOM 1959 C PRO A 130 -7.488 17.567 -2.156 1.00 0.65 C ATOM 1960 O PRO A 130 -6.423 16.977 -2.246 1.00 0.64 O ATOM 1961 CB PRO A 130 -8.540 18.100 -4.417 1.00 1.00 C ATOM 1962 CG PRO A 130 -9.869 18.898 -4.549 1.00 1.00 C ATOM 1963 CD PRO A 130 -10.735 18.572 -3.310 1.00 0.75 C ATOM 0 HA PRO A 130 -8.545 16.181 -3.338 1.00 0.73 H new ATOM 0 HB2 PRO A 130 -7.689 18.779 -4.365 1.00 1.00 H new ATOM 0 HB3 PRO A 130 -8.387 17.463 -5.288 1.00 1.00 H new ATOM 0 HG2 PRO A 130 -9.669 19.968 -4.606 1.00 1.00 H new ATOM 0 HG3 PRO A 130 -10.392 18.622 -5.465 1.00 1.00 H new ATOM 0 HD2 PRO A 130 -10.920 19.464 -2.712 1.00 0.75 H new ATOM 0 HD3 PRO A 130 -11.708 18.177 -3.602 1.00 0.75 H new ATOM 1971 N GLU A 131 -7.649 18.494 -1.240 1.00 0.73 N ATOM 1972 CA GLU A 131 -6.493 18.788 -0.339 1.00 0.82 C ATOM 1973 C GLU A 131 -6.263 17.569 0.554 1.00 0.72 C ATOM 1974 O GLU A 131 -5.207 17.391 1.130 1.00 0.73 O ATOM 1975 CB GLU A 131 -6.755 20.040 0.504 1.00 1.09 C ATOM 1976 CG GLU A 131 -7.136 21.209 -0.405 1.00 1.55 C ATOM 1977 CD GLU A 131 -7.661 22.366 0.449 1.00 2.17 C ATOM 1978 OE1 GLU A 131 -8.665 22.177 1.115 1.00 2.52 O ATOM 1979 OE2 GLU A 131 -7.049 23.421 0.423 1.00 2.86 O ATOM 0 H GLU A 131 -8.496 19.040 -1.081 1.00 0.73 H new ATOM 0 HA GLU A 131 -5.603 18.986 -0.935 1.00 0.82 H new ATOM 0 HB2 GLU A 131 -7.556 19.847 1.218 1.00 1.09 H new ATOM 0 HB3 GLU A 131 -5.866 20.292 1.082 1.00 1.09 H new ATOM 0 HG2 GLU A 131 -6.270 21.532 -0.983 1.00 1.55 H new ATOM 0 HG3 GLU A 131 -7.897 20.895 -1.120 1.00 1.55 H new ATOM 1986 N LEU A 132 -7.242 16.710 0.637 1.00 0.71 N ATOM 1987 CA LEU A 132 -7.101 15.474 1.445 1.00 0.69 C ATOM 1988 C LEU A 132 -6.416 14.403 0.585 1.00 0.58 C ATOM 1989 O LEU A 132 -5.693 13.568 1.091 1.00 0.59 O ATOM 1990 CB LEU A 132 -8.477 14.997 1.930 1.00 0.80 C ATOM 1991 CG LEU A 132 -8.314 13.912 3.007 1.00 0.60 C ATOM 1992 CD1 LEU A 132 -7.956 14.538 4.367 1.00 1.11 C ATOM 1993 CD2 LEU A 132 -9.626 13.133 3.151 1.00 0.77 C ATOM 0 H LEU A 132 -8.143 16.817 0.172 1.00 0.71 H new ATOM 0 HA LEU A 132 -6.491 15.670 2.327 1.00 0.69 H new ATOM 0 HB2 LEU A 132 -9.040 15.838 2.334 1.00 0.80 H new ATOM 0 HB3 LEU A 132 -9.050 14.603 1.091 1.00 0.80 H new ATOM 0 HG LEU A 132 -7.508 13.245 2.701 1.00 0.60 H new ATOM 0 HD11 LEU A 132 -7.846 13.750 5.112 1.00 1.11 H new ATOM 0 HD12 LEU A 132 -7.019 15.088 4.279 1.00 1.11 H new ATOM 0 HD13 LEU A 132 -8.749 15.220 4.674 1.00 1.11 H new ATOM 0 HD21 LEU A 132 -9.510 12.364 3.915 1.00 0.77 H new ATOM 0 HD22 LEU A 132 -10.424 13.816 3.442 1.00 0.77 H new ATOM 0 HD23 LEU A 132 -9.877 12.665 2.199 1.00 0.77 H new ATOM 2005 N ILE A 133 -6.595 14.436 -0.707 1.00 0.52 N ATOM 2006 CA ILE A 133 -5.904 13.441 -1.578 1.00 0.46 C ATOM 2007 C ILE A 133 -4.403 13.504 -1.281 1.00 0.43 C ATOM 2008 O ILE A 133 -3.757 12.506 -1.033 1.00 0.46 O ATOM 2009 CB ILE A 133 -6.149 13.805 -3.050 1.00 0.45 C ATOM 2010 CG1 ILE A 133 -7.613 13.497 -3.397 1.00 0.42 C ATOM 2011 CG2 ILE A 133 -5.220 12.978 -3.953 1.00 0.49 C ATOM 2012 CD1 ILE A 133 -7.946 13.998 -4.808 1.00 1.19 C ATOM 0 H ILE A 133 -7.188 15.106 -1.197 1.00 0.52 H new ATOM 0 HA ILE A 133 -6.284 12.437 -1.386 1.00 0.46 H new ATOM 0 HB ILE A 133 -5.943 14.864 -3.207 1.00 0.45 H new ATOM 0 HG12 ILE A 133 -7.790 12.423 -3.335 1.00 0.42 H new ATOM 0 HG13 ILE A 133 -8.273 13.972 -2.671 1.00 0.42 H new ATOM 0 HG21 ILE A 133 -5.398 13.240 -4.996 1.00 0.49 H new ATOM 0 HG22 ILE A 133 -4.182 13.190 -3.698 1.00 0.49 H new ATOM 0 HG23 ILE A 133 -5.420 11.917 -3.807 1.00 0.49 H new ATOM 0 HD11 ILE A 133 -8.987 13.772 -5.038 1.00 1.19 H new ATOM 0 HD12 ILE A 133 -7.789 15.075 -4.858 1.00 1.19 H new ATOM 0 HD13 ILE A 133 -7.299 13.503 -5.532 1.00 1.19 H new ATOM 2024 N ARG A 134 -3.858 14.691 -1.289 1.00 0.42 N ATOM 2025 CA ARG A 134 -2.405 14.873 -0.993 1.00 0.43 C ATOM 2026 C ARG A 134 -2.114 14.514 0.468 1.00 0.40 C ATOM 2027 O ARG A 134 -1.080 13.956 0.778 1.00 0.39 O ATOM 2028 CB ARG A 134 -2.018 16.334 -1.244 1.00 0.51 C ATOM 2029 CG ARG A 134 -2.317 16.699 -2.700 1.00 1.26 C ATOM 2030 CD ARG A 134 -2.021 18.184 -2.927 1.00 1.57 C ATOM 2031 NE ARG A 134 -0.572 18.444 -2.696 1.00 2.30 N ATOM 2032 CZ ARG A 134 -0.035 19.560 -3.109 1.00 2.86 C ATOM 2033 NH1 ARG A 134 -0.766 20.449 -3.726 1.00 2.98 N ATOM 2034 NH2 ARG A 134 1.234 19.788 -2.906 1.00 3.71 N ATOM 0 H ARG A 134 -4.363 15.554 -1.490 1.00 0.42 H new ATOM 0 HA ARG A 134 -1.824 14.218 -1.642 1.00 0.43 H new ATOM 0 HB2 ARG A 134 -2.573 16.989 -0.573 1.00 0.51 H new ATOM 0 HB3 ARG A 134 -0.959 16.483 -1.031 1.00 0.51 H new ATOM 0 HG2 ARG A 134 -1.710 16.090 -3.370 1.00 1.26 H new ATOM 0 HG3 ARG A 134 -3.360 16.486 -2.932 1.00 1.26 H new ATOM 0 HD2 ARG A 134 -2.295 18.469 -3.943 1.00 1.57 H new ATOM 0 HD3 ARG A 134 -2.623 18.793 -2.252 1.00 1.57 H new ATOM 0 HE ARG A 134 0.000 17.750 -2.215 1.00 2.30 H new ATOM 0 HH11 ARG A 134 -1.758 20.272 -3.886 1.00 2.98 H new ATOM 0 HH12 ARG A 134 -0.345 21.321 -4.048 1.00 2.98 H new ATOM 0 HH21 ARG A 134 1.806 19.094 -2.425 1.00 3.71 H new ATOM 0 HH22 ARG A 134 1.654 20.660 -3.229 1.00 3.71 H new ATOM 2048 N THR A 135 -2.994 14.838 1.372 1.00 0.41 N ATOM 2049 CA THR A 135 -2.719 14.514 2.802 1.00 0.41 C ATOM 2050 C THR A 135 -2.660 12.998 3.006 1.00 0.39 C ATOM 2051 O THR A 135 -1.913 12.497 3.823 1.00 0.52 O ATOM 2052 CB THR A 135 -3.790 15.123 3.705 1.00 0.42 C ATOM 2053 OG1 THR A 135 -3.805 16.530 3.511 1.00 0.89 O ATOM 2054 CG2 THR A 135 -3.456 14.825 5.167 1.00 0.88 C ATOM 0 H THR A 135 -3.881 15.307 1.189 1.00 0.41 H new ATOM 0 HA THR A 135 -1.753 14.941 3.069 1.00 0.41 H new ATOM 0 HB THR A 135 -4.763 14.698 3.460 1.00 0.42 H new ATOM 0 HG1 THR A 135 -4.294 16.742 2.688 1.00 0.89 H new ATOM 0 HG21 THR A 135 -4.221 15.260 5.811 1.00 0.88 H new ATOM 0 HG22 THR A 135 -3.423 13.746 5.320 1.00 0.88 H new ATOM 0 HG23 THR A 135 -2.486 15.256 5.414 1.00 0.88 H new ATOM 2062 N ILE A 136 -3.416 12.262 2.232 1.00 0.35 N ATOM 2063 CA ILE A 136 -3.387 10.776 2.330 1.00 0.36 C ATOM 2064 C ILE A 136 -2.045 10.291 1.785 1.00 0.35 C ATOM 2065 O ILE A 136 -1.232 9.799 2.541 1.00 0.51 O ATOM 2066 CB ILE A 136 -4.557 10.192 1.525 1.00 0.46 C ATOM 2067 CG1 ILE A 136 -5.870 10.504 2.266 1.00 0.60 C ATOM 2068 CG2 ILE A 136 -4.394 8.675 1.398 1.00 0.94 C ATOM 2069 CD1 ILE A 136 -7.060 10.381 1.312 1.00 0.64 C ATOM 0 H ILE A 136 -4.057 12.633 1.531 1.00 0.35 H new ATOM 0 HA ILE A 136 -3.493 10.449 3.364 1.00 0.36 H new ATOM 0 HB ILE A 136 -4.574 10.633 0.528 1.00 0.46 H new ATOM 0 HG12 ILE A 136 -5.994 9.818 3.104 1.00 0.60 H new ATOM 0 HG13 ILE A 136 -5.831 11.511 2.681 1.00 0.60 H new ATOM 0 HG21 ILE A 136 -5.227 8.266 0.826 1.00 0.94 H new ATOM 0 HG22 ILE A 136 -3.458 8.451 0.886 1.00 0.94 H new ATOM 0 HG23 ILE A 136 -4.381 8.226 2.391 1.00 0.94 H new ATOM 0 HD11 ILE A 136 -7.982 10.604 1.849 1.00 0.64 H new ATOM 0 HD12 ILE A 136 -6.940 11.085 0.488 1.00 0.64 H new ATOM 0 HD13 ILE A 136 -7.107 9.366 0.918 1.00 0.64 H new ATOM 2081 N MET A 137 -1.798 10.402 0.496 1.00 0.35 N ATOM 2082 CA MET A 137 -0.486 9.935 -0.068 1.00 0.33 C ATOM 2083 C MET A 137 0.652 10.270 0.909 1.00 0.31 C ATOM 2084 O MET A 137 1.677 9.621 0.960 1.00 0.34 O ATOM 2085 CB MET A 137 -0.233 10.632 -1.414 1.00 0.36 C ATOM 2086 CG MET A 137 -1.423 10.397 -2.383 1.00 0.67 C ATOM 2087 SD MET A 137 -0.903 9.336 -3.763 1.00 1.13 S ATOM 2088 CE MET A 137 0.262 10.484 -4.548 1.00 0.67 C ATOM 0 H MET A 137 -2.446 10.794 -0.187 1.00 0.35 H new ATOM 0 HA MET A 137 -0.521 8.856 -0.217 1.00 0.33 H new ATOM 0 HB2 MET A 137 -0.092 11.701 -1.255 1.00 0.36 H new ATOM 0 HB3 MET A 137 0.686 10.252 -1.859 1.00 0.36 H new ATOM 0 HG2 MET A 137 -2.251 9.932 -1.848 1.00 0.67 H new ATOM 0 HG3 MET A 137 -1.786 11.352 -2.764 1.00 0.67 H new ATOM 0 HE1 MET A 137 0.290 10.297 -5.621 1.00 0.67 H new ATOM 0 HE2 MET A 137 -0.060 11.510 -4.367 1.00 0.67 H new ATOM 0 HE3 MET A 137 1.257 10.336 -4.128 1.00 0.67 H new ATOM 2098 N GLY A 138 0.436 11.287 1.696 1.00 0.31 N ATOM 2099 CA GLY A 138 1.435 11.716 2.716 1.00 0.33 C ATOM 2100 C GLY A 138 1.544 10.636 3.798 1.00 0.33 C ATOM 2101 O GLY A 138 2.624 10.223 4.172 1.00 0.34 O ATOM 0 H GLY A 138 -0.412 11.853 1.674 1.00 0.31 H new ATOM 0 HA2 GLY A 138 2.406 11.877 2.247 1.00 0.33 H new ATOM 0 HA3 GLY A 138 1.134 12.665 3.161 1.00 0.33 H new ATOM 2105 N TRP A 139 0.430 10.168 4.296 1.00 0.34 N ATOM 2106 CA TRP A 139 0.471 9.105 5.344 1.00 0.37 C ATOM 2107 C TRP A 139 0.980 7.792 4.737 1.00 0.35 C ATOM 2108 O TRP A 139 1.486 6.934 5.434 1.00 0.39 O ATOM 2109 CB TRP A 139 -0.921 8.872 5.941 1.00 0.43 C ATOM 2110 CG TRP A 139 -1.505 10.147 6.471 1.00 0.46 C ATOM 2111 CD1 TRP A 139 -0.805 11.209 6.943 1.00 0.54 C ATOM 2112 CD2 TRP A 139 -2.913 10.499 6.602 1.00 0.53 C ATOM 2113 NE1 TRP A 139 -1.697 12.185 7.352 1.00 0.57 N ATOM 2114 CE2 TRP A 139 -3.007 11.795 7.161 1.00 0.56 C ATOM 2115 CE3 TRP A 139 -4.107 9.824 6.291 1.00 0.67 C ATOM 2116 CZ2 TRP A 139 -4.242 12.399 7.404 1.00 0.66 C ATOM 2117 CZ3 TRP A 139 -5.351 10.428 6.532 1.00 0.81 C ATOM 2118 CH2 TRP A 139 -5.418 11.713 7.088 1.00 0.78 C ATOM 0 H TRP A 139 -0.504 10.474 4.024 1.00 0.34 H new ATOM 0 HA TRP A 139 1.145 9.436 6.134 1.00 0.37 H new ATOM 0 HB2 TRP A 139 -1.581 8.456 5.180 1.00 0.43 H new ATOM 0 HB3 TRP A 139 -0.857 8.137 6.744 1.00 0.43 H new ATOM 0 HD1 TRP A 139 0.272 11.281 6.992 1.00 0.54 H new ATOM 0 HE1 TRP A 139 -1.420 13.084 7.747 1.00 0.57 H new ATOM 0 HE3 TRP A 139 -4.066 8.833 5.863 1.00 0.67 H new ATOM 0 HZ2 TRP A 139 -4.288 13.389 7.833 1.00 0.66 H new ATOM 0 HZ3 TRP A 139 -6.261 9.900 6.288 1.00 0.81 H new ATOM 0 HH2 TRP A 139 -6.378 12.173 7.272 1.00 0.78 H new ATOM 2129 N THR A 140 0.852 7.623 3.448 1.00 0.34 N ATOM 2130 CA THR A 140 1.334 6.359 2.816 1.00 0.36 C ATOM 2131 C THR A 140 2.865 6.357 2.783 1.00 0.34 C ATOM 2132 O THR A 140 3.506 5.514 3.378 1.00 0.39 O ATOM 2133 CB THR A 140 0.791 6.253 1.387 1.00 0.38 C ATOM 2134 OG1 THR A 140 1.279 7.338 0.613 1.00 1.20 O ATOM 2135 CG2 THR A 140 -0.738 6.290 1.414 1.00 1.17 C ATOM 0 H THR A 140 0.437 8.300 2.808 1.00 0.34 H new ATOM 0 HA THR A 140 0.980 5.508 3.398 1.00 0.36 H new ATOM 0 HB THR A 140 1.121 5.314 0.944 1.00 0.38 H new ATOM 0 HG1 THR A 140 1.376 8.129 1.183 1.00 1.20 H new ATOM 0 HG21 THR A 140 -1.122 6.214 0.397 1.00 1.17 H new ATOM 0 HG22 THR A 140 -1.112 5.454 2.006 1.00 1.17 H new ATOM 0 HG23 THR A 140 -1.071 7.228 1.859 1.00 1.17 H new ATOM 2143 N LEU A 141 3.455 7.295 2.094 1.00 0.33 N ATOM 2144 CA LEU A 141 4.945 7.349 2.025 1.00 0.34 C ATOM 2145 C LEU A 141 5.529 7.487 3.432 1.00 0.33 C ATOM 2146 O LEU A 141 6.642 7.073 3.691 1.00 0.33 O ATOM 2147 CB LEU A 141 5.387 8.527 1.150 1.00 0.35 C ATOM 2148 CG LEU A 141 5.049 8.244 -0.330 1.00 0.41 C ATOM 2149 CD1 LEU A 141 4.852 9.565 -1.081 1.00 0.99 C ATOM 2150 CD2 LEU A 141 6.193 7.463 -0.992 1.00 0.80 C ATOM 0 H LEU A 141 2.970 8.027 1.575 1.00 0.33 H new ATOM 0 HA LEU A 141 5.314 6.424 1.581 1.00 0.34 H new ATOM 0 HB2 LEU A 141 4.889 9.440 1.477 1.00 0.35 H new ATOM 0 HB3 LEU A 141 6.459 8.691 1.262 1.00 0.35 H new ATOM 0 HG LEU A 141 4.133 7.655 -0.371 1.00 0.41 H new ATOM 0 HD11 LEU A 141 4.614 9.358 -2.124 1.00 0.99 H new ATOM 0 HD12 LEU A 141 4.034 10.124 -0.626 1.00 0.99 H new ATOM 0 HD13 LEU A 141 5.768 10.154 -1.028 1.00 0.99 H new ATOM 0 HD21 LEU A 141 5.945 7.269 -2.035 1.00 0.80 H new ATOM 0 HD22 LEU A 141 7.111 8.049 -0.940 1.00 0.80 H new ATOM 0 HD23 LEU A 141 6.337 6.517 -0.471 1.00 0.80 H new ATOM 2162 N ASP A 142 4.791 8.044 4.351 1.00 0.36 N ATOM 2163 CA ASP A 142 5.321 8.174 5.737 1.00 0.37 C ATOM 2164 C ASP A 142 5.555 6.769 6.292 1.00 0.37 C ATOM 2165 O ASP A 142 6.610 6.454 6.806 1.00 0.42 O ATOM 2166 CB ASP A 142 4.299 8.904 6.611 1.00 0.37 C ATOM 2167 CG ASP A 142 4.278 10.388 6.241 1.00 0.78 C ATOM 2168 OD1 ASP A 142 4.737 10.715 5.159 1.00 1.32 O ATOM 2169 OD2 ASP A 142 3.803 11.172 7.045 1.00 1.59 O ATOM 0 H ASP A 142 3.851 8.412 4.205 1.00 0.36 H new ATOM 0 HA ASP A 142 6.252 8.740 5.733 1.00 0.37 H new ATOM 0 HB2 ASP A 142 3.309 8.470 6.471 1.00 0.37 H new ATOM 0 HB3 ASP A 142 4.554 8.784 7.664 1.00 0.37 H new ATOM 2174 N PHE A 143 4.571 5.922 6.174 1.00 0.41 N ATOM 2175 CA PHE A 143 4.705 4.524 6.669 1.00 0.43 C ATOM 2176 C PHE A 143 5.714 3.771 5.796 1.00 0.43 C ATOM 2177 O PHE A 143 6.452 2.934 6.276 1.00 0.45 O ATOM 2178 CB PHE A 143 3.339 3.837 6.587 1.00 0.44 C ATOM 2179 CG PHE A 143 3.362 2.537 7.358 1.00 0.47 C ATOM 2180 CD1 PHE A 143 3.856 1.375 6.755 1.00 1.16 C ATOM 2181 CD2 PHE A 143 2.879 2.493 8.672 1.00 1.29 C ATOM 2182 CE1 PHE A 143 3.869 0.168 7.465 1.00 1.22 C ATOM 2183 CE2 PHE A 143 2.893 1.286 9.383 1.00 1.35 C ATOM 2184 CZ PHE A 143 3.387 0.124 8.779 1.00 0.72 C ATOM 0 H PHE A 143 3.669 6.142 5.751 1.00 0.41 H new ATOM 0 HA PHE A 143 5.054 4.525 7.701 1.00 0.43 H new ATOM 0 HB2 PHE A 143 2.568 4.494 6.990 1.00 0.44 H new ATOM 0 HB3 PHE A 143 3.082 3.646 5.545 1.00 0.44 H new ATOM 0 HD1 PHE A 143 4.227 1.409 5.741 1.00 1.16 H new ATOM 0 HD2 PHE A 143 2.496 3.389 9.137 1.00 1.29 H new ATOM 0 HE1 PHE A 143 4.251 -0.729 6.999 1.00 1.22 H new ATOM 0 HE2 PHE A 143 2.523 1.252 10.397 1.00 1.35 H new ATOM 0 HZ PHE A 143 3.396 -0.807 9.327 1.00 0.72 H new ATOM 2194 N LEU A 144 5.753 4.048 4.518 1.00 0.45 N ATOM 2195 CA LEU A 144 6.718 3.327 3.634 1.00 0.47 C ATOM 2196 C LEU A 144 8.141 3.823 3.941 1.00 0.47 C ATOM 2197 O LEU A 144 9.015 3.046 4.271 1.00 0.49 O ATOM 2198 CB LEU A 144 6.344 3.588 2.164 1.00 0.49 C ATOM 2199 CG LEU A 144 6.870 2.481 1.248 1.00 0.64 C ATOM 2200 CD1 LEU A 144 6.240 2.636 -0.138 1.00 1.31 C ATOM 2201 CD2 LEU A 144 8.396 2.573 1.122 1.00 1.01 C ATOM 0 H LEU A 144 5.163 4.737 4.051 1.00 0.45 H new ATOM 0 HA LEU A 144 6.678 2.253 3.815 1.00 0.47 H new ATOM 0 HB2 LEU A 144 5.260 3.656 2.069 1.00 0.49 H new ATOM 0 HB3 LEU A 144 6.752 4.548 1.848 1.00 0.49 H new ATOM 0 HG LEU A 144 6.608 1.513 1.674 1.00 0.64 H new ATOM 0 HD11 LEU A 144 6.611 1.850 -0.796 1.00 1.31 H new ATOM 0 HD12 LEU A 144 5.156 2.559 -0.056 1.00 1.31 H new ATOM 0 HD13 LEU A 144 6.504 3.610 -0.551 1.00 1.31 H new ATOM 0 HD21 LEU A 144 8.756 1.779 0.467 1.00 1.01 H new ATOM 0 HD22 LEU A 144 8.669 3.541 0.702 1.00 1.01 H new ATOM 0 HD23 LEU A 144 8.850 2.464 2.107 1.00 1.01 H new ATOM 2213 N ARG A 145 8.373 5.095 3.863 1.00 0.47 N ATOM 2214 CA ARG A 145 9.728 5.639 4.179 1.00 0.48 C ATOM 2215 C ARG A 145 10.162 5.229 5.595 1.00 0.49 C ATOM 2216 O ARG A 145 11.325 4.973 5.837 1.00 0.50 O ATOM 2217 CB ARG A 145 9.678 7.167 4.097 1.00 0.49 C ATOM 2218 CG ARG A 145 11.049 7.745 4.464 1.00 0.69 C ATOM 2219 CD ARG A 145 11.090 9.239 4.124 1.00 0.68 C ATOM 2220 NE ARG A 145 12.197 9.886 4.884 1.00 1.56 N ATOM 2221 CZ ARG A 145 12.609 11.079 4.551 1.00 2.10 C ATOM 2222 NH1 ARG A 145 12.052 11.707 3.552 1.00 2.12 N ATOM 2223 NH2 ARG A 145 13.580 11.643 5.217 1.00 3.16 N ATOM 0 H ARG A 145 7.681 5.794 3.592 1.00 0.47 H new ATOM 0 HA ARG A 145 10.445 5.238 3.463 1.00 0.48 H new ATOM 0 HB2 ARG A 145 9.398 7.479 3.091 1.00 0.49 H new ATOM 0 HB3 ARG A 145 8.916 7.553 4.774 1.00 0.49 H new ATOM 0 HG2 ARG A 145 11.243 7.599 5.527 1.00 0.69 H new ATOM 0 HG3 ARG A 145 11.833 7.217 3.921 1.00 0.69 H new ATOM 0 HD2 ARG A 145 11.240 9.376 3.053 1.00 0.68 H new ATOM 0 HD3 ARG A 145 10.138 9.707 4.375 1.00 0.68 H new ATOM 0 HE ARG A 145 12.633 9.396 5.665 1.00 1.56 H new ATOM 0 HH11 ARG A 145 11.294 11.266 3.031 1.00 2.12 H new ATOM 0 HH12 ARG A 145 12.374 12.639 3.292 1.00 2.12 H new ATOM 0 HH21 ARG A 145 14.016 11.151 5.997 1.00 3.16 H new ATOM 0 HH22 ARG A 145 13.902 12.575 4.957 1.00 3.16 H new ATOM 2237 N GLU A 146 9.270 5.222 6.546 1.00 0.49 N ATOM 2238 CA GLU A 146 9.690 4.893 7.950 1.00 0.51 C ATOM 2239 C GLU A 146 9.800 3.378 8.213 1.00 0.53 C ATOM 2240 O GLU A 146 10.711 2.969 8.905 1.00 0.55 O ATOM 2241 CB GLU A 146 8.700 5.512 8.940 1.00 0.52 C ATOM 2242 CG GLU A 146 8.697 7.036 8.788 1.00 0.96 C ATOM 2243 CD GLU A 146 9.946 7.622 9.449 1.00 1.48 C ATOM 2244 OE1 GLU A 146 10.139 7.376 10.628 1.00 2.22 O ATOM 2245 OE2 GLU A 146 10.688 8.308 8.764 1.00 2.03 O ATOM 0 H GLU A 146 8.278 5.426 6.421 1.00 0.49 H new ATOM 0 HA GLU A 146 10.687 5.312 8.087 1.00 0.51 H new ATOM 0 HB2 GLU A 146 7.699 5.118 8.762 1.00 0.52 H new ATOM 0 HB3 GLU A 146 8.973 5.240 9.960 1.00 0.52 H new ATOM 0 HG2 GLU A 146 8.672 7.306 7.732 1.00 0.96 H new ATOM 0 HG3 GLU A 146 7.801 7.455 9.246 1.00 0.96 H new ATOM 2252 N ARG A 147 8.890 2.544 7.757 1.00 0.59 N ATOM 2253 CA ARG A 147 8.998 1.072 8.114 1.00 0.62 C ATOM 2254 C ARG A 147 9.421 0.182 6.934 1.00 0.58 C ATOM 2255 O ARG A 147 10.274 -0.673 7.064 1.00 0.62 O ATOM 2256 CB ARG A 147 7.637 0.608 8.626 1.00 0.63 C ATOM 2257 CG ARG A 147 7.288 1.399 9.898 1.00 0.73 C ATOM 2258 CD ARG A 147 6.018 0.828 10.576 1.00 1.11 C ATOM 2259 NE ARG A 147 6.275 0.571 12.035 1.00 1.75 N ATOM 2260 CZ ARG A 147 7.270 -0.176 12.440 1.00 2.40 C ATOM 2261 NH1 ARG A 147 8.028 -0.793 11.575 1.00 2.71 N ATOM 2262 NH2 ARG A 147 7.491 -0.325 13.717 1.00 3.30 N ATOM 0 H ARG A 147 8.096 2.800 7.170 1.00 0.59 H new ATOM 0 HA ARG A 147 9.777 0.974 8.870 1.00 0.62 H new ATOM 0 HB2 ARG A 147 6.874 0.764 7.863 1.00 0.63 H new ATOM 0 HB3 ARG A 147 7.659 -0.460 8.841 1.00 0.63 H new ATOM 0 HG2 ARG A 147 8.125 1.361 10.595 1.00 0.73 H new ATOM 0 HG3 ARG A 147 7.130 2.448 9.646 1.00 0.73 H new ATOM 0 HD2 ARG A 147 5.191 1.529 10.464 1.00 1.11 H new ATOM 0 HD3 ARG A 147 5.720 -0.098 10.084 1.00 1.11 H new ATOM 0 HE ARG A 147 5.656 0.991 12.729 1.00 1.75 H new ATOM 0 HH11 ARG A 147 7.846 -0.694 10.576 1.00 2.71 H new ATOM 0 HH12 ARG A 147 8.802 -1.374 11.898 1.00 2.71 H new ATOM 0 HH21 ARG A 147 6.889 0.140 14.396 1.00 3.30 H new ATOM 0 HH22 ARG A 147 8.266 -0.907 14.036 1.00 3.30 H new ATOM 2276 N LEU A 148 8.794 0.343 5.806 1.00 0.53 N ATOM 2277 CA LEU A 148 9.099 -0.521 4.623 1.00 0.57 C ATOM 2278 C LEU A 148 10.316 -0.036 3.829 1.00 0.67 C ATOM 2279 O LEU A 148 10.336 -0.160 2.624 1.00 1.61 O ATOM 2280 CB LEU A 148 7.891 -0.484 3.687 1.00 0.59 C ATOM 2281 CG LEU A 148 6.600 -0.691 4.489 1.00 0.70 C ATOM 2282 CD1 LEU A 148 5.405 -0.703 3.531 1.00 1.29 C ATOM 2283 CD2 LEU A 148 6.667 -2.028 5.241 1.00 1.34 C ATOM 0 H LEU A 148 8.072 1.045 5.646 1.00 0.53 H new ATOM 0 HA LEU A 148 9.317 -1.523 4.994 1.00 0.57 H new ATOM 0 HB2 LEU A 148 7.855 0.472 3.164 1.00 0.59 H new ATOM 0 HB3 LEU A 148 7.985 -1.260 2.927 1.00 0.59 H new ATOM 0 HG LEU A 148 6.485 0.120 5.208 1.00 0.70 H new ATOM 0 HD11 LEU A 148 4.486 -0.850 4.098 1.00 1.29 H new ATOM 0 HD12 LEU A 148 5.355 0.247 2.999 1.00 1.29 H new ATOM 0 HD13 LEU A 148 5.522 -1.515 2.813 1.00 1.29 H new ATOM 0 HD21 LEU A 148 5.748 -2.172 5.810 1.00 1.34 H new ATOM 0 HD22 LEU A 148 6.782 -2.842 4.526 1.00 1.34 H new ATOM 0 HD23 LEU A 148 7.518 -2.020 5.922 1.00 1.34 H new ATOM 2295 N LEU A 149 11.326 0.511 4.462 1.00 0.67 N ATOM 2296 CA LEU A 149 12.526 0.986 3.686 1.00 0.57 C ATOM 2297 C LEU A 149 13.703 0.028 3.928 1.00 0.56 C ATOM 2298 O LEU A 149 14.323 -0.456 2.998 1.00 0.58 O ATOM 2299 CB LEU A 149 12.887 2.424 4.124 1.00 0.54 C ATOM 2300 CG LEU A 149 13.372 3.244 2.917 1.00 0.59 C ATOM 2301 CD1 LEU A 149 13.646 4.686 3.348 1.00 0.83 C ATOM 2302 CD2 LEU A 149 14.656 2.624 2.361 1.00 1.21 C ATOM 0 H LEU A 149 11.376 0.650 5.471 1.00 0.67 H new ATOM 0 HA LEU A 149 12.300 0.996 2.620 1.00 0.57 H new ATOM 0 HB2 LEU A 149 12.017 2.904 4.572 1.00 0.54 H new ATOM 0 HB3 LEU A 149 13.664 2.394 4.888 1.00 0.54 H new ATOM 0 HG LEU A 149 12.602 3.239 2.146 1.00 0.59 H new ATOM 0 HD11 LEU A 149 13.989 5.263 2.490 1.00 0.83 H new ATOM 0 HD12 LEU A 149 12.730 5.129 3.740 1.00 0.83 H new ATOM 0 HD13 LEU A 149 14.414 4.695 4.122 1.00 0.83 H new ATOM 0 HD21 LEU A 149 15.000 3.205 1.505 1.00 1.21 H new ATOM 0 HD22 LEU A 149 15.425 2.626 3.133 1.00 1.21 H new ATOM 0 HD23 LEU A 149 14.459 1.599 2.048 1.00 1.21 H new ATOM 2314 N GLY A 150 14.017 -0.251 5.161 1.00 0.56 N ATOM 2315 CA GLY A 150 15.153 -1.173 5.450 1.00 0.58 C ATOM 2316 C GLY A 150 14.842 -2.575 4.915 1.00 0.62 C ATOM 2317 O GLY A 150 15.712 -3.273 4.429 1.00 0.70 O ATOM 0 H GLY A 150 13.538 0.118 5.982 1.00 0.56 H new ATOM 0 HA2 GLY A 150 16.065 -0.794 4.990 1.00 0.58 H new ATOM 0 HA3 GLY A 150 15.332 -1.217 6.524 1.00 0.58 H new ATOM 2321 N TRP A 151 13.613 -3.003 5.020 1.00 0.63 N ATOM 2322 CA TRP A 151 13.253 -4.369 4.540 1.00 0.69 C ATOM 2323 C TRP A 151 13.301 -4.432 3.008 1.00 0.70 C ATOM 2324 O TRP A 151 13.665 -5.442 2.438 1.00 0.72 O ATOM 2325 CB TRP A 151 11.840 -4.722 5.032 1.00 0.73 C ATOM 2326 CG TRP A 151 11.896 -5.161 6.464 1.00 1.25 C ATOM 2327 CD1 TRP A 151 11.838 -6.446 6.883 1.00 2.17 C ATOM 2328 CD2 TRP A 151 12.024 -4.345 7.666 1.00 1.86 C ATOM 2329 NE1 TRP A 151 11.920 -6.471 8.264 1.00 2.65 N ATOM 2330 CE2 TRP A 151 12.036 -5.201 8.793 1.00 2.43 C ATOM 2331 CE3 TRP A 151 12.129 -2.959 7.886 1.00 2.68 C ATOM 2332 CZ2 TRP A 151 12.149 -4.702 10.091 1.00 3.17 C ATOM 2333 CZ3 TRP A 151 12.243 -2.453 9.192 1.00 3.62 C ATOM 2334 CH2 TRP A 151 12.253 -3.323 10.291 1.00 3.67 C ATOM 0 H TRP A 151 12.842 -2.466 5.417 1.00 0.63 H new ATOM 0 HA TRP A 151 13.972 -5.086 4.937 1.00 0.69 H new ATOM 0 HB2 TRP A 151 11.184 -3.857 4.933 1.00 0.73 H new ATOM 0 HB3 TRP A 151 11.418 -5.515 4.415 1.00 0.73 H new ATOM 0 HD1 TRP A 151 11.743 -7.311 6.244 1.00 2.17 H new ATOM 0 HE1 TRP A 151 11.897 -7.324 8.823 1.00 2.65 H new ATOM 0 HE3 TRP A 151 12.122 -2.280 7.046 1.00 2.68 H new ATOM 0 HZ2 TRP A 151 12.156 -5.376 10.935 1.00 3.17 H new ATOM 0 HZ3 TRP A 151 12.323 -1.388 9.350 1.00 3.62 H new ATOM 0 HH2 TRP A 151 12.341 -2.928 11.292 1.00 3.67 H new ATOM 2345 N ILE A 152 12.940 -3.376 2.330 1.00 0.73 N ATOM 2346 CA ILE A 152 12.978 -3.418 0.839 1.00 0.76 C ATOM 2347 C ILE A 152 14.432 -3.495 0.373 1.00 0.79 C ATOM 2348 O ILE A 152 14.724 -3.937 -0.720 1.00 0.89 O ATOM 2349 CB ILE A 152 12.309 -2.170 0.259 1.00 0.78 C ATOM 2350 CG1 ILE A 152 10.821 -2.199 0.623 1.00 0.83 C ATOM 2351 CG2 ILE A 152 12.466 -2.165 -1.270 1.00 0.92 C ATOM 2352 CD1 ILE A 152 10.134 -0.924 0.130 1.00 0.94 C ATOM 0 H ILE A 152 12.624 -2.496 2.737 1.00 0.73 H new ATOM 0 HA ILE A 152 12.437 -4.297 0.489 1.00 0.76 H new ATOM 0 HB ILE A 152 12.775 -1.273 0.667 1.00 0.78 H new ATOM 0 HG12 ILE A 152 10.346 -3.073 0.177 1.00 0.83 H new ATOM 0 HG13 ILE A 152 10.705 -2.290 1.703 1.00 0.83 H new ATOM 0 HG21 ILE A 152 11.989 -1.276 -1.682 1.00 0.92 H new ATOM 0 HG22 ILE A 152 13.525 -2.161 -1.527 1.00 0.92 H new ATOM 0 HG23 ILE A 152 11.995 -3.055 -1.687 1.00 0.92 H new ATOM 0 HD11 ILE A 152 9.077 -0.955 0.394 1.00 0.94 H new ATOM 0 HD12 ILE A 152 10.599 -0.056 0.597 1.00 0.94 H new ATOM 0 HD13 ILE A 152 10.236 -0.851 -0.953 1.00 0.94 H new ATOM 2364 N GLN A 153 15.347 -3.078 1.202 1.00 0.77 N ATOM 2365 CA GLN A 153 16.785 -3.137 0.815 1.00 0.80 C ATOM 2366 C GLN A 153 17.291 -4.582 0.914 1.00 0.81 C ATOM 2367 O GLN A 153 18.076 -5.019 0.096 1.00 0.82 O ATOM 2368 CB GLN A 153 17.622 -2.267 1.758 1.00 0.82 C ATOM 2369 CG GLN A 153 17.405 -0.769 1.480 1.00 1.09 C ATOM 2370 CD GLN A 153 17.711 0.043 2.746 1.00 1.98 C ATOM 2371 OE1 GLN A 153 18.050 -0.510 3.773 1.00 2.66 O ATOM 2372 NE2 GLN A 153 17.615 1.344 2.710 1.00 2.77 N ATOM 0 H GLN A 153 15.162 -2.699 2.131 1.00 0.77 H new ATOM 0 HA GLN A 153 16.882 -2.773 -0.208 1.00 0.80 H new ATOM 0 HB2 GLN A 153 17.357 -2.489 2.792 1.00 0.82 H new ATOM 0 HB3 GLN A 153 18.678 -2.511 1.640 1.00 0.82 H new ATOM 0 HG2 GLN A 153 18.050 -0.444 0.663 1.00 1.09 H new ATOM 0 HG3 GLN A 153 16.377 -0.593 1.164 1.00 1.09 H new ATOM 0 HE21 GLN A 153 17.331 1.811 1.849 1.00 2.77 H new ATOM 0 HE22 GLN A 153 17.824 1.894 3.543 1.00 2.77 H new ATOM 2381 N ASP A 154 16.907 -5.317 1.925 1.00 0.83 N ATOM 2382 CA ASP A 154 17.453 -6.703 2.051 1.00 0.86 C ATOM 2383 C ASP A 154 16.994 -7.577 0.875 1.00 0.85 C ATOM 2384 O ASP A 154 17.748 -8.384 0.368 1.00 0.94 O ATOM 2385 CB ASP A 154 17.011 -7.327 3.376 1.00 0.90 C ATOM 2386 CG ASP A 154 17.484 -6.453 4.538 1.00 1.28 C ATOM 2387 OD1 ASP A 154 16.823 -5.467 4.818 1.00 1.99 O ATOM 2388 OD2 ASP A 154 18.498 -6.785 5.129 1.00 1.84 O ATOM 0 H ASP A 154 16.255 -5.028 2.654 1.00 0.83 H new ATOM 0 HA ASP A 154 18.541 -6.646 2.033 1.00 0.86 H new ATOM 0 HB2 ASP A 154 15.926 -7.424 3.399 1.00 0.90 H new ATOM 0 HB3 ASP A 154 17.423 -8.331 3.472 1.00 0.90 H new ATOM 2393 N GLN A 155 15.779 -7.421 0.424 1.00 0.79 N ATOM 2394 CA GLN A 155 15.292 -8.238 -0.728 1.00 0.79 C ATOM 2395 C GLN A 155 15.936 -7.744 -2.025 1.00 0.72 C ATOM 2396 O GLN A 155 15.573 -8.158 -3.108 1.00 1.03 O ATOM 2397 CB GLN A 155 13.773 -8.097 -0.844 1.00 0.90 C ATOM 2398 CG GLN A 155 13.399 -6.618 -0.914 1.00 1.37 C ATOM 2399 CD GLN A 155 11.878 -6.480 -1.000 1.00 2.01 C ATOM 2400 OE1 GLN A 155 11.179 -6.718 -0.034 1.00 2.72 O ATOM 2401 NE2 GLN A 155 11.331 -6.103 -2.123 1.00 2.54 N ATOM 0 H GLN A 155 15.100 -6.762 0.804 1.00 0.79 H new ATOM 0 HA GLN A 155 15.559 -9.282 -0.563 1.00 0.79 H new ATOM 0 HB2 GLN A 155 13.417 -8.615 -1.734 1.00 0.90 H new ATOM 0 HB3 GLN A 155 13.288 -8.565 0.013 1.00 0.90 H new ATOM 0 HG2 GLN A 155 13.773 -6.095 -0.034 1.00 1.37 H new ATOM 0 HG3 GLN A 155 13.867 -6.154 -1.783 1.00 1.37 H new ATOM 0 HE21 GLN A 155 11.917 -5.903 -2.934 1.00 2.54 H new ATOM 0 HE22 GLN A 155 10.318 -6.008 -2.190 1.00 2.54 H new ATOM 2410 N GLY A 156 16.886 -6.855 -1.924 1.00 0.63 N ATOM 2411 CA GLY A 156 17.554 -6.321 -3.145 1.00 0.72 C ATOM 2412 C GLY A 156 16.770 -5.112 -3.650 1.00 0.87 C ATOM 2413 O GLY A 156 17.306 -4.035 -3.827 1.00 1.38 O ATOM 0 H GLY A 156 17.230 -6.473 -1.043 1.00 0.63 H new ATOM 0 HA2 GLY A 156 18.581 -6.036 -2.918 1.00 0.72 H new ATOM 0 HA3 GLY A 156 17.599 -7.090 -3.916 1.00 0.72 H new ATOM 2417 N GLY A 157 15.501 -5.289 -3.890 1.00 0.81 N ATOM 2418 CA GLY A 157 14.664 -4.160 -4.393 1.00 1.10 C ATOM 2419 C GLY A 157 13.269 -4.680 -4.754 1.00 0.84 C ATOM 2420 O GLY A 157 12.942 -5.828 -4.531 1.00 0.88 O ATOM 0 H GLY A 157 15.004 -6.170 -3.759 1.00 0.81 H new ATOM 0 HA2 GLY A 157 14.588 -3.382 -3.633 1.00 1.10 H new ATOM 0 HA3 GLY A 157 15.132 -3.707 -5.267 1.00 1.10 H new ATOM 2424 N TRP A 158 12.440 -3.828 -5.300 1.00 0.67 N ATOM 2425 CA TRP A 158 11.055 -4.247 -5.669 1.00 0.50 C ATOM 2426 C TRP A 158 11.093 -5.453 -6.611 1.00 0.51 C ATOM 2427 O TRP A 158 10.063 -6.007 -6.941 1.00 0.53 O ATOM 2428 CB TRP A 158 10.326 -3.093 -6.361 1.00 0.51 C ATOM 2429 CG TRP A 158 10.184 -1.933 -5.429 1.00 0.46 C ATOM 2430 CD1 TRP A 158 11.045 -0.892 -5.343 1.00 0.59 C ATOM 2431 CD2 TRP A 158 9.128 -1.670 -4.463 1.00 0.46 C ATOM 2432 NE1 TRP A 158 10.581 -0.007 -4.386 1.00 0.55 N ATOM 2433 CE2 TRP A 158 9.402 -0.444 -3.814 1.00 0.47 C ATOM 2434 CE3 TRP A 158 7.969 -2.373 -4.091 1.00 0.65 C ATOM 2435 CZ2 TRP A 158 8.555 0.069 -2.831 1.00 0.58 C ATOM 2436 CZ3 TRP A 158 7.114 -1.862 -3.102 1.00 0.84 C ATOM 2437 CH2 TRP A 158 7.406 -0.643 -2.473 1.00 0.78 C ATOM 0 H TRP A 158 12.664 -2.855 -5.507 1.00 0.67 H new ATOM 0 HA TRP A 158 10.526 -4.521 -4.757 1.00 0.50 H new ATOM 0 HB2 TRP A 158 10.877 -2.788 -7.251 1.00 0.51 H new ATOM 0 HB3 TRP A 158 9.342 -3.423 -6.693 1.00 0.51 H new ATOM 0 HD1 TRP A 158 11.946 -0.772 -5.926 1.00 0.59 H new ATOM 0 HE1 TRP A 158 11.052 0.862 -4.134 1.00 0.55 H new ATOM 0 HE3 TRP A 158 7.735 -3.313 -4.569 1.00 0.65 H new ATOM 0 HZ2 TRP A 158 8.785 1.008 -2.350 1.00 0.58 H new ATOM 0 HZ3 TRP A 158 6.226 -2.411 -2.824 1.00 0.84 H new ATOM 0 HH2 TRP A 158 6.744 -0.255 -1.713 1.00 0.78 H new ATOM 2448 N ASP A 159 12.240 -5.873 -7.060 1.00 0.50 N ATOM 2449 CA ASP A 159 12.262 -7.043 -7.982 1.00 0.51 C ATOM 2450 C ASP A 159 11.707 -8.265 -7.245 1.00 0.51 C ATOM 2451 O ASP A 159 11.109 -9.142 -7.837 1.00 0.51 O ATOM 2452 CB ASP A 159 13.694 -7.314 -8.447 1.00 0.54 C ATOM 2453 CG ASP A 159 14.598 -7.505 -7.229 1.00 1.66 C ATOM 2454 OD1 ASP A 159 14.995 -6.508 -6.648 1.00 2.46 O ATOM 2455 OD2 ASP A 159 14.879 -8.645 -6.896 1.00 2.37 O ATOM 0 H ASP A 159 13.148 -5.467 -6.835 1.00 0.50 H new ATOM 0 HA ASP A 159 11.647 -6.834 -8.858 1.00 0.51 H new ATOM 0 HB2 ASP A 159 13.721 -8.204 -9.076 1.00 0.54 H new ATOM 0 HB3 ASP A 159 14.054 -6.483 -9.054 1.00 0.54 H new ATOM 2460 N GLY A 160 11.892 -8.323 -5.952 1.00 0.52 N ATOM 2461 CA GLY A 160 11.367 -9.481 -5.171 1.00 0.54 C ATOM 2462 C GLY A 160 9.836 -9.427 -5.161 1.00 0.53 C ATOM 2463 O GLY A 160 9.169 -10.443 -5.163 1.00 0.54 O ATOM 0 H GLY A 160 12.384 -7.618 -5.403 1.00 0.52 H new ATOM 0 HA2 GLY A 160 11.707 -10.418 -5.613 1.00 0.54 H new ATOM 0 HA3 GLY A 160 11.751 -9.452 -4.151 1.00 0.54 H new ATOM 2467 N LEU A 161 9.278 -8.248 -5.158 1.00 0.54 N ATOM 2468 CA LEU A 161 7.793 -8.117 -5.156 1.00 0.56 C ATOM 2469 C LEU A 161 7.219 -8.815 -6.391 1.00 0.56 C ATOM 2470 O LEU A 161 6.359 -9.669 -6.302 1.00 0.62 O ATOM 2471 CB LEU A 161 7.424 -6.627 -5.209 1.00 0.58 C ATOM 2472 CG LEU A 161 5.892 -6.447 -5.158 1.00 0.74 C ATOM 2473 CD1 LEU A 161 5.303 -7.112 -3.897 1.00 1.63 C ATOM 2474 CD2 LEU A 161 5.566 -4.950 -5.138 1.00 1.56 C ATOM 0 H LEU A 161 9.789 -7.365 -5.157 1.00 0.54 H new ATOM 0 HA LEU A 161 7.385 -8.573 -4.254 1.00 0.56 H new ATOM 0 HB2 LEU A 161 7.886 -6.102 -4.373 1.00 0.58 H new ATOM 0 HB3 LEU A 161 7.818 -6.181 -6.122 1.00 0.58 H new ATOM 0 HG LEU A 161 5.453 -6.920 -6.037 1.00 0.74 H new ATOM 0 HD11 LEU A 161 4.222 -6.972 -3.883 1.00 1.63 H new ATOM 0 HD12 LEU A 161 5.531 -8.178 -3.908 1.00 1.63 H new ATOM 0 HD13 LEU A 161 5.739 -6.657 -3.008 1.00 1.63 H new ATOM 0 HD21 LEU A 161 4.485 -4.813 -5.102 1.00 1.56 H new ATOM 0 HD22 LEU A 161 6.019 -4.491 -4.260 1.00 1.56 H new ATOM 0 HD23 LEU A 161 5.961 -4.479 -6.038 1.00 1.56 H new ATOM 2486 N LEU A 162 7.675 -8.415 -7.551 1.00 0.53 N ATOM 2487 CA LEU A 162 7.156 -8.997 -8.822 1.00 0.56 C ATOM 2488 C LEU A 162 7.677 -10.429 -9.003 1.00 0.55 C ATOM 2489 O LEU A 162 7.030 -11.248 -9.625 1.00 0.57 O ATOM 2490 CB LEU A 162 7.601 -8.091 -9.984 1.00 0.61 C ATOM 2491 CG LEU A 162 7.331 -8.746 -11.342 1.00 0.80 C ATOM 2492 CD1 LEU A 162 5.835 -9.037 -11.491 1.00 1.56 C ATOM 2493 CD2 LEU A 162 7.775 -7.788 -12.451 1.00 1.33 C ATOM 0 H LEU A 162 8.394 -7.701 -7.671 1.00 0.53 H new ATOM 0 HA LEU A 162 6.067 -9.048 -8.799 1.00 0.56 H new ATOM 0 HB2 LEU A 162 7.073 -7.139 -9.927 1.00 0.61 H new ATOM 0 HB3 LEU A 162 8.665 -7.872 -9.889 1.00 0.61 H new ATOM 0 HG LEU A 162 7.885 -9.682 -11.413 1.00 0.80 H new ATOM 0 HD11 LEU A 162 5.650 -9.503 -12.459 1.00 1.56 H new ATOM 0 HD12 LEU A 162 5.515 -9.711 -10.697 1.00 1.56 H new ATOM 0 HD13 LEU A 162 5.274 -8.105 -11.424 1.00 1.56 H new ATOM 0 HD21 LEU A 162 7.587 -8.244 -13.423 1.00 1.33 H new ATOM 0 HD22 LEU A 162 7.214 -6.857 -12.373 1.00 1.33 H new ATOM 0 HD23 LEU A 162 8.840 -7.580 -12.347 1.00 1.33 H new ATOM 2505 N SER A 163 8.817 -10.753 -8.467 1.00 0.54 N ATOM 2506 CA SER A 163 9.324 -12.147 -8.624 1.00 0.56 C ATOM 2507 C SER A 163 8.452 -13.088 -7.789 1.00 0.53 C ATOM 2508 O SER A 163 8.379 -14.274 -8.042 1.00 0.60 O ATOM 2509 CB SER A 163 10.773 -12.230 -8.145 1.00 0.63 C ATOM 2510 OG SER A 163 11.558 -11.287 -8.861 1.00 1.32 O ATOM 0 H SER A 163 9.416 -10.124 -7.932 1.00 0.54 H new ATOM 0 HA SER A 163 9.282 -12.436 -9.674 1.00 0.56 H new ATOM 0 HB2 SER A 163 10.827 -12.028 -7.075 1.00 0.63 H new ATOM 0 HB3 SER A 163 11.162 -13.236 -8.299 1.00 0.63 H new ATOM 0 HG SER A 163 11.727 -10.505 -8.295 1.00 1.32 H new ATOM 2516 N TYR A 164 7.786 -12.562 -6.799 1.00 0.59 N ATOM 2517 CA TYR A 164 6.910 -13.413 -5.944 1.00 0.64 C ATOM 2518 C TYR A 164 5.696 -13.868 -6.757 1.00 0.63 C ATOM 2519 O TYR A 164 5.342 -15.030 -6.761 1.00 0.68 O ATOM 2520 CB TYR A 164 6.440 -12.585 -4.742 1.00 0.69 C ATOM 2521 CG TYR A 164 5.424 -13.365 -3.935 1.00 0.72 C ATOM 2522 CD1 TYR A 164 5.814 -14.528 -3.261 1.00 1.50 C ATOM 2523 CD2 TYR A 164 4.095 -12.922 -3.854 1.00 1.34 C ATOM 2524 CE1 TYR A 164 4.879 -15.249 -2.508 1.00 1.57 C ATOM 2525 CE2 TYR A 164 3.160 -13.644 -3.101 1.00 1.35 C ATOM 2526 CZ TYR A 164 3.553 -14.807 -2.428 1.00 0.87 C ATOM 2527 OH TYR A 164 2.633 -15.518 -1.684 1.00 0.97 O ATOM 0 H TYR A 164 7.811 -11.575 -6.544 1.00 0.59 H new ATOM 0 HA TYR A 164 7.461 -14.288 -5.599 1.00 0.64 H new ATOM 0 HB2 TYR A 164 7.292 -12.326 -4.114 1.00 0.69 H new ATOM 0 HB3 TYR A 164 6.001 -11.648 -5.086 1.00 0.69 H new ATOM 0 HD1 TYR A 164 6.837 -14.870 -3.322 1.00 1.50 H new ATOM 0 HD2 TYR A 164 3.793 -12.024 -4.372 1.00 1.34 H new ATOM 0 HE1 TYR A 164 5.181 -16.147 -1.989 1.00 1.57 H new ATOM 0 HE2 TYR A 164 2.137 -13.304 -3.040 1.00 1.35 H new ATOM 0 HH TYR A 164 1.760 -15.075 -1.733 1.00 0.97 H new ATOM 2537 N PHE A 165 5.054 -12.967 -7.443 1.00 0.64 N ATOM 2538 CA PHE A 165 3.864 -13.358 -8.249 1.00 0.72 C ATOM 2539 C PHE A 165 4.269 -14.354 -9.345 1.00 0.82 C ATOM 2540 O PHE A 165 4.772 -15.423 -9.064 1.00 1.56 O ATOM 2541 CB PHE A 165 3.250 -12.114 -8.896 1.00 0.74 C ATOM 2542 CG PHE A 165 2.571 -11.277 -7.839 1.00 0.84 C ATOM 2543 CD1 PHE A 165 1.271 -11.592 -7.426 1.00 1.65 C ATOM 2544 CD2 PHE A 165 3.241 -10.187 -7.272 1.00 1.42 C ATOM 2545 CE1 PHE A 165 0.641 -10.817 -6.446 1.00 1.96 C ATOM 2546 CE2 PHE A 165 2.611 -9.411 -6.291 1.00 1.71 C ATOM 2547 CZ PHE A 165 1.311 -9.726 -5.879 1.00 1.66 C ATOM 0 H PHE A 165 5.300 -11.978 -7.481 1.00 0.64 H new ATOM 0 HA PHE A 165 3.133 -13.829 -7.591 1.00 0.72 H new ATOM 0 HB2 PHE A 165 4.025 -11.531 -9.394 1.00 0.74 H new ATOM 0 HB3 PHE A 165 2.530 -12.407 -9.660 1.00 0.74 H new ATOM 0 HD1 PHE A 165 0.754 -12.433 -7.864 1.00 1.65 H new ATOM 0 HD2 PHE A 165 4.244 -9.944 -7.591 1.00 1.42 H new ATOM 0 HE1 PHE A 165 -0.362 -11.060 -6.127 1.00 1.96 H new ATOM 0 HE2 PHE A 165 3.128 -8.570 -5.853 1.00 1.71 H new ATOM 0 HZ PHE A 165 0.824 -9.127 -5.123 1.00 1.66 H new ATOM 2557 N GLY A 166 4.075 -14.011 -10.587 1.00 0.94 N ATOM 2558 CA GLY A 166 4.466 -14.937 -11.690 1.00 1.01 C ATOM 2559 C GLY A 166 3.933 -16.347 -11.414 1.00 1.23 C ATOM 2560 O GLY A 166 4.307 -17.297 -12.074 1.00 1.85 O ATOM 0 H GLY A 166 3.662 -13.128 -10.888 1.00 0.94 H new ATOM 0 HA2 GLY A 166 4.072 -14.571 -12.638 1.00 1.01 H new ATOM 0 HA3 GLY A 166 5.552 -14.963 -11.785 1.00 1.01 H new ATOM 2606 N TRP A 170 -3.931 -17.829 -9.753 1.00 1.04 N ATOM 2607 CA TRP A 170 -4.096 -16.414 -9.301 1.00 1.01 C ATOM 2608 C TRP A 170 -5.134 -16.354 -8.175 1.00 0.92 C ATOM 2609 O TRP A 170 -5.395 -15.311 -7.610 1.00 0.95 O ATOM 2610 CB TRP A 170 -4.576 -15.563 -10.479 1.00 1.32 C ATOM 2611 CG TRP A 170 -3.644 -15.743 -11.634 1.00 1.70 C ATOM 2612 CD1 TRP A 170 -3.917 -16.460 -12.749 1.00 2.30 C ATOM 2613 CD2 TRP A 170 -2.298 -15.213 -11.808 1.00 2.52 C ATOM 2614 NE1 TRP A 170 -2.825 -16.403 -13.596 1.00 3.04 N ATOM 2615 CE2 TRP A 170 -1.801 -15.646 -13.060 1.00 3.15 C ATOM 2616 CE3 TRP A 170 -1.469 -14.406 -11.008 1.00 3.32 C ATOM 2617 CZ2 TRP A 170 -0.527 -15.291 -13.503 1.00 4.11 C ATOM 2618 CZ3 TRP A 170 -0.185 -14.047 -11.451 1.00 4.37 C ATOM 2619 CH2 TRP A 170 0.284 -14.489 -12.696 1.00 4.64 C ATOM 0 HA TRP A 170 -3.142 -16.033 -8.936 1.00 1.01 H new ATOM 0 HB2 TRP A 170 -5.587 -15.854 -10.764 1.00 1.32 H new ATOM 0 HB3 TRP A 170 -4.617 -14.513 -10.190 1.00 1.32 H new ATOM 0 HD1 TRP A 170 -4.837 -16.990 -12.945 1.00 2.30 H new ATOM 0 HE1 TRP A 170 -2.781 -16.863 -14.505 1.00 3.04 H new ATOM 0 HE3 TRP A 170 -1.822 -14.060 -10.048 1.00 3.32 H new ATOM 0 HZ2 TRP A 170 -0.170 -15.634 -14.463 1.00 4.11 H new ATOM 0 HZ3 TRP A 170 0.444 -13.427 -10.829 1.00 4.37 H new ATOM 0 HH2 TRP A 170 1.272 -14.210 -13.031 1.00 4.64 H new ATOM 2630 N GLN A 171 -5.743 -17.464 -7.857 1.00 0.88 N ATOM 2631 CA GLN A 171 -6.779 -17.471 -6.782 1.00 0.84 C ATOM 2632 C GLN A 171 -6.121 -17.572 -5.400 1.00 0.75 C ATOM 2633 O GLN A 171 -6.772 -17.401 -4.388 1.00 0.75 O ATOM 2634 CB GLN A 171 -7.713 -18.668 -6.987 1.00 0.88 C ATOM 2635 CG GLN A 171 -6.893 -19.959 -7.045 1.00 1.57 C ATOM 2636 CD GLN A 171 -7.828 -21.148 -7.279 1.00 1.93 C ATOM 2637 OE1 GLN A 171 -7.544 -22.009 -8.087 1.00 2.66 O ATOM 2638 NE2 GLN A 171 -8.939 -21.231 -6.600 1.00 2.34 N ATOM 0 H GLN A 171 -5.568 -18.368 -8.295 1.00 0.88 H new ATOM 0 HA GLN A 171 -7.345 -16.541 -6.834 1.00 0.84 H new ATOM 0 HB2 GLN A 171 -8.436 -18.721 -6.173 1.00 0.88 H new ATOM 0 HB3 GLN A 171 -8.281 -18.545 -7.909 1.00 0.88 H new ATOM 0 HG2 GLN A 171 -6.157 -19.899 -7.846 1.00 1.57 H new ATOM 0 HG3 GLN A 171 -6.341 -20.094 -6.115 1.00 1.57 H new ATOM 0 HE21 GLN A 171 -9.177 -20.508 -5.921 1.00 2.34 H new ATOM 0 HE22 GLN A 171 -9.569 -22.019 -6.748 1.00 2.34 H new ATOM 2647 N THR A 172 -4.843 -17.845 -5.335 1.00 0.67 N ATOM 2648 CA THR A 172 -4.172 -17.949 -3.997 1.00 0.60 C ATOM 2649 C THR A 172 -3.635 -16.579 -3.593 1.00 0.59 C ATOM 2650 O THR A 172 -3.443 -16.307 -2.426 1.00 0.74 O ATOM 2651 CB THR A 172 -3.019 -18.962 -4.049 1.00 0.59 C ATOM 2652 OG1 THR A 172 -2.264 -18.870 -2.850 1.00 0.81 O ATOM 2653 CG2 THR A 172 -2.105 -18.688 -5.246 1.00 0.92 C ATOM 0 H THR A 172 -4.237 -18.000 -6.141 1.00 0.67 H new ATOM 0 HA THR A 172 -4.901 -18.291 -3.262 1.00 0.60 H new ATOM 0 HB THR A 172 -3.438 -19.963 -4.156 1.00 0.59 H new ATOM 0 HG1 THR A 172 -1.527 -19.516 -2.877 1.00 0.81 H new ATOM 0 HG21 THR A 172 -1.296 -19.419 -5.261 1.00 0.92 H new ATOM 0 HG22 THR A 172 -2.681 -18.765 -6.168 1.00 0.92 H new ATOM 0 HG23 THR A 172 -1.686 -17.685 -5.162 1.00 0.92 H new ATOM 2661 N VAL A 173 -3.430 -15.696 -4.528 1.00 0.59 N ATOM 2662 CA VAL A 173 -2.944 -14.333 -4.168 1.00 0.58 C ATOM 2663 C VAL A 173 -4.168 -13.450 -3.903 1.00 0.57 C ATOM 2664 O VAL A 173 -4.137 -12.569 -3.064 1.00 0.60 O ATOM 2665 CB VAL A 173 -2.112 -13.758 -5.325 1.00 0.64 C ATOM 2666 CG1 VAL A 173 -0.675 -14.279 -5.240 1.00 1.13 C ATOM 2667 CG2 VAL A 173 -2.722 -14.185 -6.660 1.00 1.01 C ATOM 0 H VAL A 173 -3.577 -15.857 -5.524 1.00 0.59 H new ATOM 0 HA VAL A 173 -2.313 -14.372 -3.280 1.00 0.58 H new ATOM 0 HB VAL A 173 -2.110 -12.670 -5.254 1.00 0.64 H new ATOM 0 HG11 VAL A 173 -0.090 -13.868 -6.063 1.00 1.13 H new ATOM 0 HG12 VAL A 173 -0.233 -13.973 -4.292 1.00 1.13 H new ATOM 0 HG13 VAL A 173 -0.678 -15.367 -5.305 1.00 1.13 H new ATOM 0 HG21 VAL A 173 -2.130 -13.776 -7.478 1.00 1.01 H new ATOM 0 HG22 VAL A 173 -2.728 -15.273 -6.726 1.00 1.01 H new ATOM 0 HG23 VAL A 173 -3.744 -13.811 -6.729 1.00 1.01 H new ATOM 2677 N THR A 174 -5.254 -13.695 -4.584 1.00 0.55 N ATOM 2678 CA THR A 174 -6.480 -12.884 -4.336 1.00 0.56 C ATOM 2679 C THR A 174 -7.077 -13.301 -2.987 1.00 0.53 C ATOM 2680 O THR A 174 -7.605 -12.486 -2.255 1.00 0.55 O ATOM 2681 CB THR A 174 -7.501 -13.150 -5.446 1.00 0.59 C ATOM 2682 OG1 THR A 174 -7.784 -14.542 -5.499 1.00 1.37 O ATOM 2683 CG2 THR A 174 -6.934 -12.694 -6.792 1.00 1.27 C ATOM 0 H THR A 174 -5.346 -14.418 -5.298 1.00 0.55 H new ATOM 0 HA THR A 174 -6.230 -11.823 -4.324 1.00 0.56 H new ATOM 0 HB THR A 174 -8.416 -12.596 -5.236 1.00 0.59 H new ATOM 0 HG1 THR A 174 -8.438 -14.716 -6.208 1.00 1.37 H new ATOM 0 HG21 THR A 174 -7.664 -12.886 -7.578 1.00 1.27 H new ATOM 0 HG22 THR A 174 -6.715 -11.627 -6.752 1.00 1.27 H new ATOM 0 HG23 THR A 174 -6.018 -13.244 -7.006 1.00 1.27 H new ATOM 2691 N ILE A 175 -7.003 -14.560 -2.651 1.00 0.51 N ATOM 2692 CA ILE A 175 -7.570 -15.024 -1.350 1.00 0.50 C ATOM 2693 C ILE A 175 -6.592 -14.693 -0.214 1.00 0.49 C ATOM 2694 O ILE A 175 -6.975 -14.617 0.937 1.00 0.49 O ATOM 2695 CB ILE A 175 -7.801 -16.538 -1.420 1.00 0.52 C ATOM 2696 CG1 ILE A 175 -8.960 -16.824 -2.380 1.00 0.77 C ATOM 2697 CG2 ILE A 175 -8.139 -17.093 -0.030 1.00 0.87 C ATOM 2698 CD1 ILE A 175 -9.054 -18.328 -2.648 1.00 0.89 C ATOM 0 H ILE A 175 -6.574 -15.289 -3.221 1.00 0.51 H new ATOM 0 HA ILE A 175 -8.517 -14.520 -1.157 1.00 0.50 H new ATOM 0 HB ILE A 175 -6.892 -17.021 -1.778 1.00 0.52 H new ATOM 0 HG12 ILE A 175 -9.895 -16.463 -1.953 1.00 0.77 H new ATOM 0 HG13 ILE A 175 -8.809 -16.287 -3.317 1.00 0.77 H new ATOM 0 HG21 ILE A 175 -8.300 -18.169 -0.097 1.00 0.87 H new ATOM 0 HG22 ILE A 175 -7.314 -16.892 0.653 1.00 0.87 H new ATOM 0 HG23 ILE A 175 -9.044 -16.613 0.343 1.00 0.87 H new ATOM 0 HD11 ILE A 175 -9.880 -18.525 -3.331 1.00 0.89 H new ATOM 0 HD12 ILE A 175 -8.123 -18.677 -3.094 1.00 0.89 H new ATOM 0 HD13 ILE A 175 -9.226 -18.855 -1.709 1.00 0.89 H new ATOM 2710 N PHE A 176 -5.344 -14.465 -0.523 1.00 0.48 N ATOM 2711 CA PHE A 176 -4.369 -14.103 0.548 1.00 0.49 C ATOM 2712 C PHE A 176 -4.744 -12.719 1.097 1.00 0.49 C ATOM 2713 O PHE A 176 -5.130 -12.574 2.240 1.00 0.56 O ATOM 2714 CB PHE A 176 -2.948 -14.052 -0.068 1.00 0.51 C ATOM 2715 CG PHE A 176 -1.968 -14.795 0.822 1.00 0.51 C ATOM 2716 CD1 PHE A 176 -1.709 -14.325 2.115 1.00 1.41 C ATOM 2717 CD2 PHE A 176 -1.331 -15.954 0.359 1.00 1.23 C ATOM 2718 CE1 PHE A 176 -0.815 -15.011 2.944 1.00 1.52 C ATOM 2719 CE2 PHE A 176 -0.438 -16.641 1.188 1.00 1.22 C ATOM 2720 CZ PHE A 176 -0.179 -16.169 2.481 1.00 0.76 C ATOM 0 H PHE A 176 -4.958 -14.513 -1.466 1.00 0.48 H new ATOM 0 HA PHE A 176 -4.390 -14.838 1.353 1.00 0.49 H new ATOM 0 HB2 PHE A 176 -2.958 -14.497 -1.063 1.00 0.51 H new ATOM 0 HB3 PHE A 176 -2.631 -13.016 -0.186 1.00 0.51 H new ATOM 0 HD1 PHE A 176 -2.200 -13.432 2.473 1.00 1.41 H new ATOM 0 HD2 PHE A 176 -1.530 -16.317 -0.639 1.00 1.23 H new ATOM 0 HE1 PHE A 176 -0.615 -14.647 3.941 1.00 1.52 H new ATOM 0 HE2 PHE A 176 0.052 -17.535 0.831 1.00 1.22 H new ATOM 0 HZ PHE A 176 0.511 -16.698 3.121 1.00 0.76 H new ATOM 2730 N VAL A 177 -4.600 -11.702 0.293 1.00 0.46 N ATOM 2731 CA VAL A 177 -4.912 -10.321 0.763 1.00 0.48 C ATOM 2732 C VAL A 177 -6.352 -10.252 1.282 1.00 0.44 C ATOM 2733 O VAL A 177 -6.619 -9.639 2.296 1.00 0.57 O ATOM 2734 CB VAL A 177 -4.740 -9.336 -0.402 1.00 0.56 C ATOM 2735 CG1 VAL A 177 -3.378 -9.551 -1.067 1.00 1.20 C ATOM 2736 CG2 VAL A 177 -5.848 -9.559 -1.436 1.00 1.24 C ATOM 0 H VAL A 177 -4.279 -11.767 -0.673 1.00 0.46 H new ATOM 0 HA VAL A 177 -4.231 -10.058 1.572 1.00 0.48 H new ATOM 0 HB VAL A 177 -4.800 -8.318 -0.017 1.00 0.56 H new ATOM 0 HG11 VAL A 177 -3.262 -8.849 -1.893 1.00 1.20 H new ATOM 0 HG12 VAL A 177 -2.586 -9.386 -0.336 1.00 1.20 H new ATOM 0 HG13 VAL A 177 -3.315 -10.571 -1.446 1.00 1.20 H new ATOM 0 HG21 VAL A 177 -5.722 -8.858 -2.261 1.00 1.24 H new ATOM 0 HG22 VAL A 177 -5.792 -10.579 -1.815 1.00 1.24 H new ATOM 0 HG23 VAL A 177 -6.820 -9.399 -0.969 1.00 1.24 H new ATOM 2746 N ALA A 178 -7.280 -10.867 0.609 1.00 0.45 N ATOM 2747 CA ALA A 178 -8.690 -10.816 1.089 1.00 0.43 C ATOM 2748 C ALA A 178 -8.796 -11.507 2.451 1.00 0.40 C ATOM 2749 O ALA A 178 -9.361 -10.976 3.385 1.00 0.40 O ATOM 2750 CB ALA A 178 -9.603 -11.521 0.086 1.00 0.46 C ATOM 0 H ALA A 178 -7.127 -11.400 -0.247 1.00 0.45 H new ATOM 0 HA ALA A 178 -8.997 -9.775 1.186 1.00 0.43 H new ATOM 0 HB1 ALA A 178 -10.633 -11.481 0.441 1.00 0.46 H new ATOM 0 HB2 ALA A 178 -9.533 -11.024 -0.881 1.00 0.46 H new ATOM 0 HB3 ALA A 178 -9.295 -12.561 -0.018 1.00 0.46 H new ATOM 2756 N GLY A 179 -8.259 -12.688 2.571 1.00 0.41 N ATOM 2757 CA GLY A 179 -8.334 -13.410 3.871 1.00 0.43 C ATOM 2758 C GLY A 179 -7.612 -12.605 4.953 1.00 0.43 C ATOM 2759 O GLY A 179 -8.026 -12.571 6.096 1.00 0.48 O ATOM 0 H GLY A 179 -7.771 -13.185 1.825 1.00 0.41 H new ATOM 0 HA2 GLY A 179 -9.376 -13.563 4.153 1.00 0.43 H new ATOM 0 HA3 GLY A 179 -7.881 -14.397 3.776 1.00 0.43 H new ATOM 2763 N VAL A 180 -6.527 -11.967 4.607 1.00 0.42 N ATOM 2764 CA VAL A 180 -5.772 -11.184 5.622 1.00 0.45 C ATOM 2765 C VAL A 180 -6.414 -9.814 5.841 1.00 0.45 C ATOM 2766 O VAL A 180 -6.588 -9.359 6.955 1.00 0.43 O ATOM 2767 CB VAL A 180 -4.325 -10.993 5.153 1.00 0.49 C ATOM 2768 CG1 VAL A 180 -3.573 -10.095 6.142 1.00 1.31 C ATOM 2769 CG2 VAL A 180 -3.629 -12.354 5.077 1.00 1.41 C ATOM 0 H VAL A 180 -6.133 -11.955 3.666 1.00 0.42 H new ATOM 0 HA VAL A 180 -5.790 -11.734 6.563 1.00 0.45 H new ATOM 0 HB VAL A 180 -4.327 -10.525 4.168 1.00 0.49 H new ATOM 0 HG11 VAL A 180 -2.545 -9.962 5.804 1.00 1.31 H new ATOM 0 HG12 VAL A 180 -4.065 -9.124 6.198 1.00 1.31 H new ATOM 0 HG13 VAL A 180 -3.574 -10.559 7.128 1.00 1.31 H new ATOM 0 HG21 VAL A 180 -2.600 -12.218 4.744 1.00 1.41 H new ATOM 0 HG22 VAL A 180 -3.633 -12.820 6.062 1.00 1.41 H new ATOM 0 HG23 VAL A 180 -4.158 -12.994 4.371 1.00 1.41 H new ATOM 2779 N LEU A 181 -6.740 -9.142 4.765 1.00 0.49 N ATOM 2780 CA LEU A 181 -7.342 -7.785 4.874 1.00 0.50 C ATOM 2781 C LEU A 181 -8.679 -7.873 5.614 1.00 0.49 C ATOM 2782 O LEU A 181 -8.999 -7.067 6.465 1.00 0.51 O ATOM 2783 CB LEU A 181 -7.555 -7.240 3.449 1.00 0.56 C ATOM 2784 CG LEU A 181 -8.264 -5.867 3.457 1.00 0.64 C ATOM 2785 CD1 LEU A 181 -9.775 -6.008 3.763 1.00 1.60 C ATOM 2786 CD2 LEU A 181 -7.600 -4.945 4.490 1.00 1.20 C ATOM 0 H LEU A 181 -6.613 -9.481 3.811 1.00 0.49 H new ATOM 0 HA LEU A 181 -6.684 -7.118 5.432 1.00 0.50 H new ATOM 0 HB2 LEU A 181 -6.591 -7.148 2.948 1.00 0.56 H new ATOM 0 HB3 LEU A 181 -8.147 -7.951 2.873 1.00 0.56 H new ATOM 0 HG LEU A 181 -8.167 -5.431 2.463 1.00 0.64 H new ATOM 0 HD11 LEU A 181 -10.240 -5.022 3.760 1.00 1.60 H new ATOM 0 HD12 LEU A 181 -10.244 -6.633 3.002 1.00 1.60 H new ATOM 0 HD13 LEU A 181 -9.907 -6.469 4.742 1.00 1.60 H new ATOM 0 HD21 LEU A 181 -8.104 -3.978 4.492 1.00 1.20 H new ATOM 0 HD22 LEU A 181 -7.674 -5.395 5.480 1.00 1.20 H new ATOM 0 HD23 LEU A 181 -6.550 -4.807 4.232 1.00 1.20 H new ATOM 2798 N THR A 182 -9.461 -8.868 5.279 1.00 0.49 N ATOM 2799 CA THR A 182 -10.790 -9.042 5.930 1.00 0.51 C ATOM 2800 C THR A 182 -10.599 -9.326 7.418 1.00 0.48 C ATOM 2801 O THR A 182 -11.367 -8.882 8.248 1.00 0.51 O ATOM 2802 CB THR A 182 -11.535 -10.211 5.275 1.00 0.54 C ATOM 2803 OG1 THR A 182 -11.489 -10.067 3.862 1.00 1.16 O ATOM 2804 CG2 THR A 182 -12.993 -10.215 5.737 1.00 1.07 C ATOM 0 H THR A 182 -9.232 -9.571 4.577 1.00 0.49 H new ATOM 0 HA THR A 182 -11.373 -8.129 5.809 1.00 0.51 H new ATOM 0 HB THR A 182 -11.061 -11.149 5.564 1.00 0.54 H new ATOM 0 HG1 THR A 182 -10.827 -10.687 3.491 1.00 1.16 H new ATOM 0 HG21 THR A 182 -13.520 -11.047 5.270 1.00 1.07 H new ATOM 0 HG22 THR A 182 -13.031 -10.324 6.821 1.00 1.07 H new ATOM 0 HG23 THR A 182 -13.468 -9.277 5.450 1.00 1.07 H new ATOM 2812 N ALA A 183 -9.586 -10.072 7.764 1.00 0.45 N ATOM 2813 CA ALA A 183 -9.361 -10.388 9.200 1.00 0.44 C ATOM 2814 C ALA A 183 -9.334 -9.086 10.006 1.00 0.44 C ATOM 2815 O ALA A 183 -10.016 -8.939 11.001 1.00 0.50 O ATOM 2816 CB ALA A 183 -8.024 -11.115 9.357 1.00 0.46 C ATOM 0 H ALA A 183 -8.908 -10.474 7.117 1.00 0.45 H new ATOM 0 HA ALA A 183 -10.165 -11.026 9.566 1.00 0.44 H new ATOM 0 HB1 ALA A 183 -7.857 -11.347 10.409 1.00 0.46 H new ATOM 0 HB2 ALA A 183 -8.042 -12.039 8.780 1.00 0.46 H new ATOM 0 HB3 ALA A 183 -7.218 -10.477 8.994 1.00 0.46 H new ATOM 2822 N SER A 184 -8.544 -8.139 9.572 1.00 0.47 N ATOM 2823 CA SER A 184 -8.458 -6.836 10.295 1.00 0.51 C ATOM 2824 C SER A 184 -9.856 -6.228 10.428 1.00 0.54 C ATOM 2825 O SER A 184 -10.225 -5.710 11.463 1.00 0.56 O ATOM 2826 CB SER A 184 -7.560 -5.877 9.512 1.00 0.62 C ATOM 2827 OG SER A 184 -6.287 -6.479 9.319 1.00 1.55 O ATOM 0 H SER A 184 -7.952 -8.213 8.744 1.00 0.47 H new ATOM 0 HA SER A 184 -8.039 -7.001 11.288 1.00 0.51 H new ATOM 0 HB2 SER A 184 -8.013 -5.640 8.549 1.00 0.62 H new ATOM 0 HB3 SER A 184 -7.452 -4.937 10.053 1.00 0.62 H new ATOM 0 HG SER A 184 -5.709 -5.868 8.816 1.00 1.55 H new ATOM 2833 N LEU A 185 -10.638 -6.300 9.387 1.00 0.58 N ATOM 2834 CA LEU A 185 -12.018 -5.745 9.436 1.00 0.69 C ATOM 2835 C LEU A 185 -12.891 -6.619 10.333 1.00 0.69 C ATOM 2836 O LEU A 185 -13.821 -6.161 10.966 1.00 0.79 O ATOM 2837 CB LEU A 185 -12.612 -5.763 8.026 1.00 0.71 C ATOM 2838 CG LEU A 185 -11.739 -4.936 7.072 1.00 0.79 C ATOM 2839 CD1 LEU A 185 -12.333 -5.011 5.662 1.00 1.62 C ATOM 2840 CD2 LEU A 185 -11.672 -3.472 7.549 1.00 1.18 C ATOM 0 H LEU A 185 -10.377 -6.724 8.497 1.00 0.58 H new ATOM 0 HA LEU A 185 -11.983 -4.728 9.826 1.00 0.69 H new ATOM 0 HB2 LEU A 185 -12.684 -6.790 7.667 1.00 0.71 H new ATOM 0 HB3 LEU A 185 -13.625 -5.360 8.045 1.00 0.71 H new ATOM 0 HG LEU A 185 -10.726 -5.338 7.060 1.00 0.79 H new ATOM 0 HD11 LEU A 185 -11.719 -4.426 4.977 1.00 1.62 H new ATOM 0 HD12 LEU A 185 -12.356 -6.050 5.332 1.00 1.62 H new ATOM 0 HD13 LEU A 185 -13.347 -4.611 5.673 1.00 1.62 H new ATOM 0 HD21 LEU A 185 -11.050 -2.895 6.865 1.00 1.18 H new ATOM 0 HD22 LEU A 185 -12.677 -3.050 7.570 1.00 1.18 H new ATOM 0 HD23 LEU A 185 -11.242 -3.435 8.550 1.00 1.18 H new ATOM 2852 N THR A 186 -12.591 -7.888 10.374 1.00 0.62 N ATOM 2853 CA THR A 186 -13.381 -8.834 11.206 1.00 0.68 C ATOM 2854 C THR A 186 -13.292 -8.447 12.681 1.00 0.62 C ATOM 2855 O THR A 186 -14.281 -8.430 13.387 1.00 0.64 O ATOM 2856 CB THR A 186 -12.808 -10.243 11.034 1.00 0.73 C ATOM 2857 OG1 THR A 186 -12.616 -10.510 9.652 1.00 0.89 O ATOM 2858 CG2 THR A 186 -13.785 -11.264 11.621 1.00 1.00 C ATOM 0 H THR A 186 -11.821 -8.314 9.858 1.00 0.62 H new ATOM 0 HA THR A 186 -14.423 -8.801 10.888 1.00 0.68 H new ATOM 0 HB THR A 186 -11.852 -10.314 11.553 1.00 0.73 H new ATOM 0 HG1 THR A 186 -11.889 -9.950 9.309 1.00 0.89 H new ATOM 0 HG21 THR A 186 -13.379 -12.268 11.499 1.00 1.00 H new ATOM 0 HG22 THR A 186 -13.933 -11.058 12.681 1.00 1.00 H new ATOM 0 HG23 THR A 186 -14.740 -11.194 11.101 1.00 1.00 H new ATOM 2866 N ILE A 187 -12.115 -8.140 13.156 1.00 0.64 N ATOM 2867 CA ILE A 187 -11.964 -7.760 14.590 1.00 0.66 C ATOM 2868 C ILE A 187 -12.246 -6.263 14.764 1.00 0.66 C ATOM 2869 O ILE A 187 -12.871 -5.857 15.724 1.00 0.75 O ATOM 2870 CB ILE A 187 -10.537 -8.095 15.051 1.00 0.72 C ATOM 2871 CG1 ILE A 187 -9.508 -7.351 14.186 1.00 0.88 C ATOM 2872 CG2 ILE A 187 -10.318 -9.603 14.907 1.00 1.57 C ATOM 2873 CD1 ILE A 187 -8.093 -7.793 14.570 1.00 0.87 C ATOM 0 H ILE A 187 -11.252 -8.136 12.613 1.00 0.64 H new ATOM 0 HA ILE A 187 -12.677 -8.318 15.197 1.00 0.66 H new ATOM 0 HB ILE A 187 -10.411 -7.788 16.089 1.00 0.72 H new ATOM 0 HG12 ILE A 187 -9.689 -7.556 13.131 1.00 0.88 H new ATOM 0 HG13 ILE A 187 -9.613 -6.275 14.324 1.00 0.88 H new ATOM 0 HG21 ILE A 187 -9.309 -9.857 15.231 1.00 1.57 H new ATOM 0 HG22 ILE A 187 -11.041 -10.136 15.524 1.00 1.57 H new ATOM 0 HG23 ILE A 187 -10.448 -9.892 13.864 1.00 1.57 H new ATOM 0 HD11 ILE A 187 -7.367 -7.263 13.954 1.00 0.87 H new ATOM 0 HD12 ILE A 187 -7.913 -7.565 15.621 1.00 0.87 H new ATOM 0 HD13 ILE A 187 -7.991 -8.866 14.409 1.00 0.87 H new ATOM 2885 N TRP A 188 -11.722 -5.439 13.890 1.00 0.64 N ATOM 2886 CA TRP A 188 -11.886 -3.957 14.029 1.00 0.70 C ATOM 2887 C TRP A 188 -13.298 -3.591 14.501 1.00 0.81 C ATOM 2888 O TRP A 188 -13.535 -2.492 14.961 1.00 1.06 O ATOM 2889 CB TRP A 188 -11.625 -3.298 12.671 1.00 0.85 C ATOM 2890 CG TRP A 188 -11.736 -1.812 12.800 1.00 0.92 C ATOM 2891 CD1 TRP A 188 -10.701 -0.976 13.037 1.00 1.76 C ATOM 2892 CD2 TRP A 188 -12.925 -0.973 12.698 1.00 1.04 C ATOM 2893 NE1 TRP A 188 -11.177 0.322 13.094 1.00 2.01 N ATOM 2894 CE2 TRP A 188 -12.541 0.375 12.890 1.00 1.34 C ATOM 2895 CE3 TRP A 188 -14.284 -1.248 12.461 1.00 1.79 C ATOM 2896 CZ2 TRP A 188 -13.472 1.414 12.849 1.00 1.47 C ATOM 2897 CZ3 TRP A 188 -15.224 -0.205 12.419 1.00 2.17 C ATOM 2898 CH2 TRP A 188 -14.819 1.123 12.613 1.00 1.71 C ATOM 0 H TRP A 188 -11.181 -5.733 13.077 1.00 0.64 H new ATOM 0 HA TRP A 188 -11.175 -3.601 14.774 1.00 0.70 H new ATOM 0 HB2 TRP A 188 -10.632 -3.568 12.310 1.00 0.85 H new ATOM 0 HB3 TRP A 188 -12.342 -3.663 11.935 1.00 0.85 H new ATOM 0 HD1 TRP A 188 -9.670 -1.273 13.162 1.00 1.76 H new ATOM 0 HE1 TRP A 188 -10.592 1.139 13.266 1.00 2.01 H new ATOM 0 HE3 TRP A 188 -14.607 -2.268 12.310 1.00 1.79 H new ATOM 0 HZ2 TRP A 188 -13.154 2.435 12.998 1.00 1.47 H new ATOM 0 HZ3 TRP A 188 -16.265 -0.428 12.236 1.00 2.17 H new ATOM 0 HH2 TRP A 188 -15.547 1.920 12.580 1.00 1.71 H new