USER MOD reduce.3.24.130724 H: found=0, std=0, add=1119, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1121 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 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 155 GLN : amide:sc= 0 X(o=0,f=-0.094) USER MOD Set 2.1: A 87 SER OG : rot -116:sc= 1.27 USER MOD Set 2.2: A 143 HIS : no HE2:sc= 2.14 K(o=3.4,f=-5.4!) USER MOD Set 3.1: A 98 ASN : amide:sc= -1.15! K(o=-0.58!,f=-2.2) USER MOD Set 3.2: A 114 SER OG : rot -45:sc= 0.567 USER MOD Set 4.1: A 78 ASN : amide:sc= 0.61 K(o=0.98,f=-0.73) USER MOD Set 4.2: A 103 GLN : amide:sc= 0.366 K(o=0.98,f=-0.89) USER MOD Single : A 18 SER OG : rot 90:sc= 0.574 USER MOD Single : A 23 SER OG : rot -131:sc= 1.2 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 ASN :FLIP amide:sc= 0 F(o=-0.5,f=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl -110:sc= -0.352 (180deg=-2.69) USER MOD Single : A 33 ASN :FLIP amide:sc= -0.646 F(o=-1.2,f=-0.65) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 GLN : amide:sc= -2.06 K(o=-2.1,f=-5.7!) USER MOD Single : A 39 ASN : amide:sc= 0.245 X(o=0.24,f=-0.0059) USER MOD Single : A 40 ASN : amide:sc= -0.655 X(o=-0.65,f=-0.4) USER MOD Single : A 44 THR OG1 : rot -74:sc= 0.924 USER MOD Single : A 45 THR OG1 : rot -98:sc= 0.368 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 59 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 31:sc= 0.0791 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 HIS : no HE2:sc= 0.493 K(o=0.49,f=-1.7!) USER MOD Single : A 76 ASN : amide:sc= -0.491 X(o=-0.49,f=0) USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= -2.43! C(o=-2.4!,f=-2.1!) USER MOD Single : A 100 GLN : amide:sc= -0.0838 X(o=-0.084,f=0) USER MOD Single : A 101 GLN : amide:sc=-0.00256 X(o=-0.0026,f=0) USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=-0.032) USER MOD Single : A 107 ASN : amide:sc= 0.247 K(o=0.25,f=-2.5!) USER MOD Single : A 110 SER OG : rot 90:sc= -0.207 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.00046 USER MOD Single : A 119 THR OG1 : rot 180:sc= -0.0102 USER MOD Single : A 122 LYS NZ :NH3+ 162:sc= -0.0318 (180deg=-0.254) USER MOD Single : A 124 ASN : amide:sc= 0.847 K(o=0.85,f=-0.67) USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 MET CE :methyl -132:sc= -0.0106 (180deg=-0.246) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0.0211 USER MOD Single : A 136 GLN :FLIP amide:sc= -0.129 F(o=-1.8!,f=-0.13) USER MOD Single : A 140 THR OG1 : rot 40:sc= 0.945 USER MOD Single : A 145 ASN : amide:sc= 1.2 K(o=1.2,f=-8!) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 149 THR OG1 : rot -4:sc= 0.691 USER MOD Single : A 151 THR OG1 : rot -56:sc= 1.21 USER MOD Single : A 154 TYR OH : rot -49:sc= 0.0806 USER MOD Single : A 168 SER OG : rot 180:sc= 0.066 USER MOD Single : A 169 THR OG1 : rot -72:sc= -0.239 USER MOD Single : A 171 THR OG1 : rot 108:sc= -0.0144 USER MOD Single : A 175 TYR OH : rot 180:sc= 0 USER MOD Single : A 179 ASN :FLIP amide:sc= -0.366 F(o=-2.8!,f=-0.37) USER MOD ----------------------------------------------------------------- ATOM 235 N GLY A 16 -10.155 18.362 -0.890 1.00 0.00 N ATOM 236 CA GLY A 16 -8.978 17.595 -0.494 1.00 0.00 C ATOM 237 C GLY A 16 -9.060 17.241 0.985 1.00 0.00 C ATOM 238 O GLY A 16 -9.087 18.131 1.833 1.00 0.00 O ATOM 0 HA2 GLY A 16 -8.909 16.685 -1.091 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -8.075 18.173 -0.688 1.00 0.00 H new ATOM 242 N CYS A 17 -9.153 15.941 1.258 1.00 0.00 N ATOM 243 CA CYS A 17 -9.496 15.361 2.550 1.00 0.00 C ATOM 244 C CYS A 17 -8.299 15.316 3.491 1.00 0.00 C ATOM 245 O CYS A 17 -7.160 15.287 3.024 1.00 0.00 O ATOM 246 CB CYS A 17 -10.023 13.944 2.283 1.00 0.00 C ATOM 247 SG CYS A 17 -11.241 13.866 0.933 1.00 0.00 S ATOM 0 H CYS A 17 -8.982 15.230 0.547 1.00 0.00 H new ATOM 0 HA CYS A 17 -10.249 15.977 3.042 1.00 0.00 H new ATOM 0 HB2 CYS A 17 -9.183 13.292 2.043 1.00 0.00 H new ATOM 0 HB3 CYS A 17 -10.477 13.556 3.195 1.00 0.00 H new ATOM 252 N SER A 18 -8.546 15.180 4.795 1.00 0.00 N ATOM 253 CA SER A 18 -7.519 14.803 5.760 1.00 0.00 C ATOM 254 C SER A 18 -7.136 13.324 5.573 1.00 0.00 C ATOM 255 O SER A 18 -7.625 12.630 4.675 1.00 0.00 O ATOM 256 CB SER A 18 -8.024 15.123 7.179 1.00 0.00 C ATOM 257 OG SER A 18 -9.377 14.761 7.351 1.00 0.00 O ATOM 0 H SER A 18 -9.466 15.329 5.209 1.00 0.00 H new ATOM 0 HA SER A 18 -6.608 15.379 5.599 1.00 0.00 H new ATOM 0 HB2 SER A 18 -7.411 14.595 7.910 1.00 0.00 H new ATOM 0 HB3 SER A 18 -7.906 16.189 7.374 1.00 0.00 H new ATOM 0 HG SER A 18 -9.430 13.837 7.673 1.00 0.00 H new ATOM 263 N VAL A 19 -6.255 12.824 6.429 1.00 0.00 N ATOM 264 CA VAL A 19 -5.886 11.425 6.552 1.00 0.00 C ATOM 265 C VAL A 19 -6.162 11.089 8.006 1.00 0.00 C ATOM 266 O VAL A 19 -5.917 11.913 8.887 1.00 0.00 O ATOM 267 CB VAL A 19 -4.431 11.219 6.074 1.00 0.00 C ATOM 268 CG1 VAL A 19 -3.422 12.208 6.671 1.00 0.00 C ATOM 269 CG2 VAL A 19 -3.936 9.791 6.326 1.00 0.00 C ATOM 0 H VAL A 19 -5.753 13.417 7.090 1.00 0.00 H new ATOM 0 HA VAL A 19 -6.453 10.742 5.919 1.00 0.00 H new ATOM 0 HB VAL A 19 -4.480 11.410 5.002 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -2.427 11.992 6.282 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.705 13.225 6.399 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.416 12.111 7.757 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.909 9.694 5.974 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.975 9.575 7.394 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -4.571 9.086 5.790 1.00 0.00 H new ATOM 279 N ALA A 20 -6.774 9.929 8.243 1.00 0.00 N ATOM 280 CA ALA A 20 -7.263 9.611 9.570 1.00 0.00 C ATOM 281 C ALA A 20 -6.097 9.423 10.547 1.00 0.00 C ATOM 282 O ALA A 20 -5.037 8.917 10.173 1.00 0.00 O ATOM 283 CB ALA A 20 -8.137 8.369 9.478 1.00 0.00 C ATOM 0 H ALA A 20 -6.938 9.208 7.540 1.00 0.00 H new ATOM 0 HA ALA A 20 -7.862 10.435 9.958 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -8.514 8.115 10.469 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -8.976 8.563 8.809 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -7.548 7.538 9.090 1.00 0.00 H new ATOM 289 N ALA A 21 -6.325 9.742 11.825 1.00 0.00 N ATOM 290 CA ALA A 21 -5.346 9.584 12.900 1.00 0.00 C ATOM 291 C ALA A 21 -4.989 8.113 13.179 1.00 0.00 C ATOM 292 O ALA A 21 -4.044 7.837 13.914 1.00 0.00 O ATOM 293 CB ALA A 21 -5.888 10.255 14.165 1.00 0.00 C ATOM 0 H ALA A 21 -7.214 10.125 12.145 1.00 0.00 H new ATOM 0 HA ALA A 21 -4.420 10.063 12.581 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -5.166 10.143 14.974 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -6.055 11.315 13.972 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -6.829 9.785 14.451 1.00 0.00 H new ATOM 299 N GLU A 22 -5.729 7.166 12.603 1.00 0.00 N ATOM 300 CA GLU A 22 -5.415 5.740 12.629 1.00 0.00 C ATOM 301 C GLU A 22 -4.464 5.327 11.500 1.00 0.00 C ATOM 302 O GLU A 22 -4.006 4.184 11.481 1.00 0.00 O ATOM 303 CB GLU A 22 -6.727 4.946 12.558 1.00 0.00 C ATOM 304 CG GLU A 22 -7.456 5.040 11.210 1.00 0.00 C ATOM 305 CD GLU A 22 -8.887 4.529 11.348 1.00 0.00 C ATOM 306 OE1 GLU A 22 -9.748 5.341 11.758 1.00 0.00 O ATOM 307 OE2 GLU A 22 -9.119 3.316 11.128 1.00 0.00 O ATOM 0 H GLU A 22 -6.586 7.377 12.092 1.00 0.00 H new ATOM 0 HA GLU A 22 -4.893 5.519 13.560 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.515 3.898 12.770 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -7.395 5.301 13.343 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.463 6.073 10.863 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.924 4.456 10.459 1.00 0.00 H new ATOM 314 N SER A 23 -4.188 6.230 10.561 1.00 0.00 N ATOM 315 CA SER A 23 -3.424 5.996 9.348 1.00 0.00 C ATOM 316 C SER A 23 -2.120 6.779 9.403 1.00 0.00 C ATOM 317 O SER A 23 -1.055 6.221 9.176 1.00 0.00 O ATOM 318 CB SER A 23 -4.255 6.430 8.141 1.00 0.00 C ATOM 319 OG SER A 23 -5.548 5.859 8.170 1.00 0.00 O ATOM 0 H SER A 23 -4.511 7.195 10.635 1.00 0.00 H new ATOM 0 HA SER A 23 -3.189 4.936 9.258 1.00 0.00 H new ATOM 0 HB2 SER A 23 -4.336 7.517 8.126 1.00 0.00 H new ATOM 0 HB3 SER A 23 -3.747 6.135 7.223 1.00 0.00 H new ATOM 0 HG SER A 23 -5.748 5.458 7.299 1.00 0.00 H new ATOM 325 N THR A 24 -2.155 8.077 9.702 1.00 0.00 N ATOM 326 CA THR A 24 -0.932 8.799 9.972 1.00 0.00 C ATOM 327 C THR A 24 -0.360 8.232 11.272 1.00 0.00 C ATOM 328 O THR A 24 -1.051 8.239 12.288 1.00 0.00 O ATOM 329 CB THR A 24 -1.190 10.313 9.909 1.00 0.00 C ATOM 330 OG1 THR A 24 0.032 11.007 10.029 1.00 0.00 O ATOM 331 CG2 THR A 24 -2.198 10.926 10.875 1.00 0.00 C ATOM 0 H THR A 24 -3.007 8.635 9.761 1.00 0.00 H new ATOM 0 HA THR A 24 -0.157 8.660 9.218 1.00 0.00 H new ATOM 0 HB THR A 24 -1.668 10.429 8.936 1.00 0.00 H new ATOM 0 HG1 THR A 24 -0.134 11.972 9.987 1.00 0.00 H new ATOM 0 HG21 THR A 24 -2.263 12.000 10.700 1.00 0.00 H new ATOM 0 HG22 THR A 24 -3.177 10.473 10.716 1.00 0.00 H new ATOM 0 HG23 THR A 24 -1.876 10.744 11.900 1.00 0.00 H new ATOM 339 N ASN A 25 0.877 7.717 11.212 1.00 0.00 N ATOM 340 CA ASN A 25 1.483 6.829 12.207 1.00 0.00 C ATOM 341 C ASN A 25 0.617 5.580 12.366 1.00 0.00 C ATOM 342 O ASN A 25 -0.225 5.484 13.264 1.00 0.00 O ATOM 343 CB ASN A 25 1.750 7.504 13.562 1.00 0.00 C ATOM 344 CG ASN A 25 2.903 8.492 13.641 1.00 0.00 C ATOM 345 OD1 ASN A 25 3.090 9.320 12.631 1.00 0.00 O flip ATOM 346 ND2 ASN A 25 3.601 8.566 14.647 1.00 0.00 N flip ATOM 0 H ASN A 25 1.506 7.918 10.435 1.00 0.00 H new ATOM 0 HA ASN A 25 2.468 6.551 11.833 1.00 0.00 H new ATOM 0 HB2 ASN A 25 0.841 8.024 13.863 1.00 0.00 H new ATOM 0 HB3 ASN A 25 1.928 6.720 14.298 1.00 0.00 H new ATOM 0 HD21 ASN A 25 3.448 7.921 15.422 1.00 0.00 H new ATOM 0 HD22 ASN A 25 4.334 9.273 14.708 1.00 0.00 H new ATOM 353 N PHE A 26 0.839 4.602 11.493 1.00 0.00 N ATOM 354 CA PHE A 26 0.274 3.267 11.608 1.00 0.00 C ATOM 355 C PHE A 26 1.331 2.232 11.227 1.00 0.00 C ATOM 356 O PHE A 26 2.401 2.581 10.712 1.00 0.00 O ATOM 357 CB PHE A 26 -0.975 3.149 10.727 1.00 0.00 C ATOM 358 CG PHE A 26 -0.723 2.739 9.290 1.00 0.00 C ATOM 359 CD1 PHE A 26 0.015 3.562 8.421 1.00 0.00 C ATOM 360 CD2 PHE A 26 -1.191 1.494 8.839 1.00 0.00 C ATOM 361 CE1 PHE A 26 0.210 3.177 7.085 1.00 0.00 C ATOM 362 CE2 PHE A 26 -0.952 1.086 7.519 1.00 0.00 C ATOM 363 CZ PHE A 26 -0.260 1.933 6.636 1.00 0.00 C ATOM 0 H PHE A 26 1.429 4.721 10.670 1.00 0.00 H new ATOM 0 HA PHE A 26 -0.029 3.080 12.638 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -1.651 2.424 11.180 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -1.491 4.109 10.728 1.00 0.00 H new ATOM 0 HD1 PHE A 26 0.432 4.491 8.781 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -1.737 0.849 9.511 1.00 0.00 H new ATOM 0 HE1 PHE A 26 0.722 3.839 6.402 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -1.300 0.121 7.181 1.00 0.00 H new ATOM 0 HZ PHE A 26 -0.090 1.627 5.614 1.00 0.00 H new ATOM 373 N THR A 27 1.007 0.952 11.387 1.00 0.00 N ATOM 374 CA THR A 27 1.857 -0.154 10.984 1.00 0.00 C ATOM 375 C THR A 27 1.075 -1.100 10.063 1.00 0.00 C ATOM 376 O THR A 27 -0.116 -1.363 10.259 1.00 0.00 O ATOM 377 CB THR A 27 2.404 -0.823 12.252 1.00 0.00 C ATOM 378 OG1 THR A 27 3.322 0.032 12.902 1.00 0.00 O ATOM 379 CG2 THR A 27 3.168 -2.101 11.935 1.00 0.00 C ATOM 0 H THR A 27 0.128 0.653 11.809 1.00 0.00 H new ATOM 0 HA THR A 27 2.713 0.183 10.400 1.00 0.00 H new ATOM 0 HB THR A 27 1.539 -1.042 12.877 1.00 0.00 H new ATOM 0 HG1 THR A 27 3.662 -0.406 13.710 1.00 0.00 H new ATOM 0 HG21 THR A 27 3.538 -2.543 12.860 1.00 0.00 H new ATOM 0 HG22 THR A 27 2.505 -2.807 11.436 1.00 0.00 H new ATOM 0 HG23 THR A 27 4.009 -1.869 11.282 1.00 0.00 H new ATOM 387 N VAL A 28 1.766 -1.637 9.057 1.00 0.00 N ATOM 388 CA VAL A 28 1.297 -2.713 8.206 1.00 0.00 C ATOM 389 C VAL A 28 1.872 -4.007 8.762 1.00 0.00 C ATOM 390 O VAL A 28 3.090 -4.221 8.772 1.00 0.00 O ATOM 391 CB VAL A 28 1.716 -2.500 6.745 1.00 0.00 C ATOM 392 CG1 VAL A 28 1.180 -3.602 5.820 1.00 0.00 C ATOM 393 CG2 VAL A 28 1.266 -1.155 6.183 1.00 0.00 C ATOM 0 H VAL A 28 2.702 -1.317 8.809 1.00 0.00 H new ATOM 0 HA VAL A 28 0.208 -2.747 8.205 1.00 0.00 H new ATOM 0 HB VAL A 28 2.805 -2.530 6.767 1.00 0.00 H new ATOM 0 HG11 VAL A 28 1.503 -3.407 4.797 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.565 -4.569 6.144 1.00 0.00 H new ATOM 0 HG13 VAL A 28 0.091 -3.613 5.861 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.593 -1.066 5.147 1.00 0.00 H new ATOM 0 HG22 VAL A 28 0.179 -1.087 6.227 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.704 -0.349 6.772 1.00 0.00 H new ATOM 403 N ASP A 29 0.955 -4.890 9.148 1.00 0.00 N ATOM 404 CA ASP A 29 1.238 -6.261 9.525 1.00 0.00 C ATOM 405 C ASP A 29 1.432 -7.041 8.226 1.00 0.00 C ATOM 406 O ASP A 29 0.573 -7.042 7.332 1.00 0.00 O ATOM 407 CB ASP A 29 0.099 -6.821 10.401 1.00 0.00 C ATOM 408 CG ASP A 29 -0.425 -8.195 9.954 1.00 0.00 C ATOM 409 OD1 ASP A 29 0.335 -9.185 10.047 1.00 0.00 O ATOM 410 OD2 ASP A 29 -1.578 -8.243 9.456 1.00 0.00 O ATOM 0 H ASP A 29 -0.036 -4.658 9.207 1.00 0.00 H new ATOM 0 HA ASP A 29 2.140 -6.341 10.131 1.00 0.00 H new ATOM 0 HB2 ASP A 29 0.451 -6.897 11.430 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -0.728 -6.111 10.398 1.00 0.00 H new ATOM 415 N LEU A 30 2.606 -7.655 8.095 1.00 0.00 N ATOM 416 CA LEU A 30 2.941 -8.543 7.005 1.00 0.00 C ATOM 417 C LEU A 30 3.166 -9.934 7.573 1.00 0.00 C ATOM 418 O LEU A 30 4.300 -10.322 7.843 1.00 0.00 O ATOM 419 CB LEU A 30 4.102 -7.985 6.164 1.00 0.00 C ATOM 420 CG LEU A 30 3.737 -8.011 4.679 1.00 0.00 C ATOM 421 CD1 LEU A 30 3.056 -6.701 4.272 1.00 0.00 C ATOM 422 CD2 LEU A 30 4.988 -8.291 3.848 1.00 0.00 C ATOM 0 H LEU A 30 3.365 -7.540 8.767 1.00 0.00 H new ATOM 0 HA LEU A 30 2.119 -8.618 6.293 1.00 0.00 H new ATOM 0 HB2 LEU A 30 4.327 -6.964 6.473 1.00 0.00 H new ATOM 0 HB3 LEU A 30 5.002 -8.576 6.335 1.00 0.00 H new ATOM 0 HG LEU A 30 3.023 -8.813 4.491 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.803 -6.736 3.212 1.00 0.00 H new ATOM 0 HD12 LEU A 30 2.147 -6.566 4.858 1.00 0.00 H new ATOM 0 HD13 LEU A 30 3.733 -5.867 4.456 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.726 -8.309 2.790 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.725 -7.508 4.026 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.407 -9.256 4.134 1.00 0.00 H new ATOM 434 N MET A 31 2.048 -10.653 7.702 1.00 0.00 N ATOM 435 CA MET A 31 1.829 -11.933 8.373 1.00 0.00 C ATOM 436 C MET A 31 3.114 -12.780 8.469 1.00 0.00 C ATOM 437 O MET A 31 3.575 -13.086 9.573 1.00 0.00 O ATOM 438 CB MET A 31 0.642 -12.635 7.691 1.00 0.00 C ATOM 439 CG MET A 31 0.990 -13.245 6.320 1.00 0.00 C ATOM 440 SD MET A 31 -0.386 -13.677 5.232 1.00 0.00 S ATOM 441 CE MET A 31 -0.814 -12.024 4.625 1.00 0.00 C ATOM 0 H MET A 31 1.178 -10.312 7.292 1.00 0.00 H new ATOM 0 HA MET A 31 1.566 -11.771 9.418 1.00 0.00 H new ATOM 0 HB2 MET A 31 0.272 -13.423 8.346 1.00 0.00 H new ATOM 0 HB3 MET A 31 -0.169 -11.918 7.565 1.00 0.00 H new ATOM 0 HG2 MET A 31 1.631 -12.540 5.790 1.00 0.00 H new ATOM 0 HG3 MET A 31 1.580 -14.145 6.491 1.00 0.00 H new ATOM 0 HE1 MET A 31 -1.773 -11.720 5.043 1.00 0.00 H new ATOM 0 HE2 MET A 31 -0.044 -11.314 4.929 1.00 0.00 H new ATOM 0 HE3 MET A 31 -0.882 -12.042 3.537 1.00 0.00 H new ATOM 451 N GLU A 32 3.719 -13.081 7.322 1.00 0.00 N ATOM 452 CA GLU A 32 5.068 -13.541 7.100 1.00 0.00 C ATOM 453 C GLU A 32 5.279 -13.485 5.585 1.00 0.00 C ATOM 454 O GLU A 32 4.391 -13.115 4.812 1.00 0.00 O ATOM 455 CB GLU A 32 5.267 -14.953 7.690 1.00 0.00 C ATOM 456 CG GLU A 32 6.097 -14.936 8.985 1.00 0.00 C ATOM 457 CD GLU A 32 5.574 -15.876 10.072 1.00 0.00 C ATOM 458 OE1 GLU A 32 4.936 -16.913 9.769 1.00 0.00 O ATOM 459 OE2 GLU A 32 5.919 -15.663 11.256 1.00 0.00 O ATOM 0 H GLU A 32 3.214 -12.996 6.440 1.00 0.00 H new ATOM 0 HA GLU A 32 5.809 -12.920 7.603 1.00 0.00 H new ATOM 0 HB2 GLU A 32 4.294 -15.400 7.891 1.00 0.00 H new ATOM 0 HB3 GLU A 32 5.762 -15.585 6.953 1.00 0.00 H new ATOM 0 HG2 GLU A 32 7.126 -15.208 8.748 1.00 0.00 H new ATOM 0 HG3 GLU A 32 6.118 -13.919 9.378 1.00 0.00 H new ATOM 466 N ASN A 33 6.473 -13.835 5.133 1.00 0.00 N ATOM 467 CA ASN A 33 6.882 -13.971 3.739 1.00 0.00 C ATOM 468 C ASN A 33 7.474 -15.372 3.593 1.00 0.00 C ATOM 469 O ASN A 33 7.369 -16.186 4.505 1.00 0.00 O ATOM 470 CB ASN A 33 7.887 -12.862 3.372 1.00 0.00 C ATOM 471 CG ASN A 33 7.326 -11.468 3.583 1.00 0.00 C ATOM 472 OD1 ASN A 33 6.666 -10.916 2.580 1.00 0.00 O flip ATOM 473 ND2 ASN A 33 7.493 -10.868 4.636 1.00 0.00 N flip ATOM 0 H ASN A 33 7.238 -14.047 5.774 1.00 0.00 H new ATOM 0 HA ASN A 33 6.043 -13.856 3.052 1.00 0.00 H new ATOM 0 HB2 ASN A 33 8.788 -12.981 3.973 1.00 0.00 H new ATOM 0 HB3 ASN A 33 8.182 -12.976 2.329 1.00 0.00 H new ATOM 0 HD21 ASN A 33 8.005 -11.310 5.399 1.00 0.00 H new ATOM 0 HD22 ASN A 33 7.120 -9.926 4.751 1.00 0.00 H new ATOM 480 N ALA A 34 8.049 -15.714 2.450 1.00 0.00 N ATOM 481 CA ALA A 34 8.519 -17.061 2.157 1.00 0.00 C ATOM 482 C ALA A 34 9.570 -16.946 1.066 1.00 0.00 C ATOM 483 O ALA A 34 9.400 -16.116 0.172 1.00 0.00 O ATOM 484 CB ALA A 34 7.332 -17.929 1.710 1.00 0.00 C ATOM 0 H ALA A 34 8.205 -15.054 1.688 1.00 0.00 H new ATOM 0 HA ALA A 34 8.957 -17.535 3.035 1.00 0.00 H new ATOM 0 HB1 ALA A 34 7.681 -18.938 1.490 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.589 -17.968 2.507 1.00 0.00 H new ATOM 0 HB3 ALA A 34 6.882 -17.498 0.816 1.00 0.00 H new ATOM 490 N ALA A 35 10.638 -17.727 1.178 1.00 0.00 N ATOM 491 CA ALA A 35 11.763 -17.787 0.251 1.00 0.00 C ATOM 492 C ALA A 35 11.363 -18.215 -1.167 1.00 0.00 C ATOM 493 O ALA A 35 11.765 -17.556 -2.125 1.00 0.00 O ATOM 494 CB ALA A 35 12.820 -18.761 0.775 1.00 0.00 C ATOM 0 H ALA A 35 10.749 -18.371 1.961 1.00 0.00 H new ATOM 0 HA ALA A 35 12.158 -16.773 0.189 1.00 0.00 H new ATOM 0 HB1 ALA A 35 13.657 -18.800 0.077 1.00 0.00 H new ATOM 0 HB2 ALA A 35 13.175 -18.423 1.749 1.00 0.00 H new ATOM 0 HB3 ALA A 35 12.383 -19.755 0.873 1.00 0.00 H new ATOM 500 N LYS A 36 10.669 -19.351 -1.343 1.00 0.00 N ATOM 501 CA LYS A 36 10.609 -20.005 -2.669 1.00 0.00 C ATOM 502 C LYS A 36 9.839 -19.213 -3.723 1.00 0.00 C ATOM 503 O LYS A 36 10.046 -19.431 -4.911 1.00 0.00 O ATOM 504 CB LYS A 36 10.011 -21.415 -2.585 1.00 0.00 C ATOM 505 CG LYS A 36 11.003 -22.451 -2.050 1.00 0.00 C ATOM 506 CD LYS A 36 10.347 -23.836 -2.119 1.00 0.00 C ATOM 507 CE LYS A 36 11.121 -24.881 -1.319 1.00 0.00 C ATOM 508 NZ LYS A 36 12.415 -25.261 -1.913 1.00 0.00 N ATOM 0 H LYS A 36 10.152 -19.830 -0.606 1.00 0.00 H new ATOM 0 HA LYS A 36 11.650 -20.056 -2.987 1.00 0.00 H new ATOM 0 HB2 LYS A 36 9.132 -21.394 -1.940 1.00 0.00 H new ATOM 0 HB3 LYS A 36 9.673 -21.720 -3.575 1.00 0.00 H new ATOM 0 HG2 LYS A 36 11.920 -22.437 -2.639 1.00 0.00 H new ATOM 0 HG3 LYS A 36 11.280 -22.214 -1.023 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.327 -23.772 -1.740 1.00 0.00 H new ATOM 0 HD3 LYS A 36 10.281 -24.153 -3.160 1.00 0.00 H new ATOM 0 HE2 LYS A 36 11.294 -24.497 -0.314 1.00 0.00 H new ATOM 0 HE3 LYS A 36 10.504 -25.774 -1.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 12.877 -25.973 -1.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 12.258 -25.658 -2.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 13.024 -24.421 -1.986 1.00 0.00 H new ATOM 522 N GLN A 37 8.981 -18.288 -3.310 1.00 0.00 N ATOM 523 CA GLN A 37 8.251 -17.377 -4.188 1.00 0.00 C ATOM 524 C GLN A 37 9.156 -16.294 -4.796 1.00 0.00 C ATOM 525 O GLN A 37 8.677 -15.415 -5.516 1.00 0.00 O ATOM 526 CB GLN A 37 7.039 -16.797 -3.436 1.00 0.00 C ATOM 527 CG GLN A 37 7.385 -16.303 -2.031 1.00 0.00 C ATOM 528 CD GLN A 37 6.199 -15.755 -1.259 1.00 0.00 C ATOM 529 OE1 GLN A 37 5.037 -15.966 -1.585 1.00 0.00 O ATOM 530 NE2 GLN A 37 6.482 -15.057 -0.176 1.00 0.00 N ATOM 0 H GLN A 37 8.766 -18.145 -2.323 1.00 0.00 H new ATOM 0 HA GLN A 37 7.879 -17.941 -5.043 1.00 0.00 H new ATOM 0 HB2 GLN A 37 6.622 -15.971 -4.013 1.00 0.00 H new ATOM 0 HB3 GLN A 37 6.264 -17.560 -3.366 1.00 0.00 H new ATOM 0 HG2 GLN A 37 7.824 -17.125 -1.466 1.00 0.00 H new ATOM 0 HG3 GLN A 37 8.146 -15.526 -2.107 1.00 0.00 H new ATOM 0 HE21 GLN A 37 7.454 -14.889 0.083 1.00 0.00 H new ATOM 0 HE22 GLN A 37 5.729 -14.685 0.402 1.00 0.00 H new ATOM 539 N PHE A 38 10.458 -16.328 -4.499 1.00 0.00 N ATOM 540 CA PHE A 38 11.450 -15.420 -5.037 1.00 0.00 C ATOM 541 C PHE A 38 12.215 -16.134 -6.164 1.00 0.00 C ATOM 542 O PHE A 38 11.571 -16.833 -6.945 1.00 0.00 O ATOM 543 CB PHE A 38 12.254 -14.830 -3.873 1.00 0.00 C ATOM 544 CG PHE A 38 11.409 -14.221 -2.752 1.00 0.00 C ATOM 545 CD1 PHE A 38 10.228 -13.488 -3.020 1.00 0.00 C ATOM 546 CD2 PHE A 38 11.831 -14.351 -1.412 1.00 0.00 C ATOM 547 CE1 PHE A 38 9.538 -12.851 -1.989 1.00 0.00 C ATOM 548 CE2 PHE A 38 11.107 -13.738 -0.371 1.00 0.00 C ATOM 549 CZ PHE A 38 9.953 -12.990 -0.662 1.00 0.00 C ATOM 0 H PHE A 38 10.854 -17.014 -3.856 1.00 0.00 H new ATOM 0 HA PHE A 38 11.031 -14.543 -5.531 1.00 0.00 H new ATOM 0 HB2 PHE A 38 12.883 -15.614 -3.450 1.00 0.00 H new ATOM 0 HB3 PHE A 38 12.922 -14.062 -4.264 1.00 0.00 H new ATOM 0 HD1 PHE A 38 9.858 -13.421 -4.032 1.00 0.00 H new ATOM 0 HD2 PHE A 38 12.716 -14.925 -1.183 1.00 0.00 H new ATOM 0 HE1 PHE A 38 8.674 -12.244 -2.218 1.00 0.00 H new ATOM 0 HE2 PHE A 38 11.439 -13.843 0.651 1.00 0.00 H new ATOM 0 HZ PHE A 38 9.391 -12.526 0.135 1.00 0.00 H new ATOM 559 N ASN A 39 13.538 -15.937 -6.291 1.00 0.00 N ATOM 560 CA ASN A 39 14.485 -16.578 -7.238 1.00 0.00 C ATOM 561 C ASN A 39 14.632 -15.831 -8.574 1.00 0.00 C ATOM 562 O ASN A 39 15.171 -16.372 -9.540 1.00 0.00 O ATOM 563 CB ASN A 39 14.177 -18.049 -7.588 1.00 0.00 C ATOM 564 CG ASN A 39 14.004 -18.988 -6.419 1.00 0.00 C ATOM 565 OD1 ASN A 39 14.981 -19.475 -5.849 1.00 0.00 O ATOM 566 ND2 ASN A 39 12.763 -19.262 -6.081 1.00 0.00 N ATOM 0 H ASN A 39 14.019 -15.271 -5.687 1.00 0.00 H new ATOM 0 HA ASN A 39 15.412 -16.533 -6.666 1.00 0.00 H new ATOM 0 HB2 ASN A 39 13.267 -18.076 -8.187 1.00 0.00 H new ATOM 0 HB3 ASN A 39 14.983 -18.428 -8.216 1.00 0.00 H new ATOM 0 HD21 ASN A 39 12.574 -19.906 -5.313 1.00 0.00 H new ATOM 0 HD22 ASN A 39 11.990 -18.831 -6.587 1.00 0.00 H new ATOM 573 N ASN A 40 14.098 -14.618 -8.688 1.00 0.00 N ATOM 574 CA ASN A 40 13.788 -13.951 -9.955 1.00 0.00 C ATOM 575 C ASN A 40 13.147 -12.610 -9.647 1.00 0.00 C ATOM 576 O ASN A 40 12.815 -12.356 -8.500 1.00 0.00 O ATOM 577 CB ASN A 40 12.848 -14.817 -10.833 1.00 0.00 C ATOM 578 CG ASN A 40 11.893 -15.753 -10.086 1.00 0.00 C ATOM 579 OD1 ASN A 40 11.986 -16.971 -10.224 1.00 0.00 O ATOM 580 ND2 ASN A 40 11.011 -15.254 -9.241 1.00 0.00 N ATOM 0 H ASN A 40 13.860 -14.051 -7.874 1.00 0.00 H new ATOM 0 HA ASN A 40 14.708 -13.804 -10.520 1.00 0.00 H new ATOM 0 HB2 ASN A 40 12.254 -14.151 -11.459 1.00 0.00 H new ATOM 0 HB3 ASN A 40 13.463 -15.419 -11.502 1.00 0.00 H new ATOM 0 HD21 ASN A 40 10.409 -15.878 -8.705 1.00 0.00 H new ATOM 0 HD22 ASN A 40 10.931 -14.244 -9.124 1.00 0.00 H new ATOM 587 N ILE A 41 12.968 -11.747 -10.643 1.00 0.00 N ATOM 588 CA ILE A 41 12.551 -10.353 -10.483 1.00 0.00 C ATOM 589 C ILE A 41 11.046 -10.175 -10.785 1.00 0.00 C ATOM 590 O ILE A 41 10.492 -9.091 -10.608 1.00 0.00 O ATOM 591 CB ILE A 41 13.541 -9.474 -11.295 1.00 0.00 C ATOM 592 CG1 ILE A 41 14.947 -9.493 -10.631 1.00 0.00 C ATOM 593 CG2 ILE A 41 13.105 -8.008 -11.442 1.00 0.00 C ATOM 594 CD1 ILE A 41 15.909 -10.561 -11.172 1.00 0.00 C ATOM 0 H ILE A 41 13.114 -12.006 -11.619 1.00 0.00 H new ATOM 0 HA ILE A 41 12.615 -10.014 -9.449 1.00 0.00 H new ATOM 0 HB ILE A 41 13.561 -9.913 -12.292 1.00 0.00 H new ATOM 0 HG12 ILE A 41 15.406 -8.513 -10.761 1.00 0.00 H new ATOM 0 HG13 ILE A 41 14.823 -9.647 -9.559 1.00 0.00 H new ATOM 0 HG21 ILE A 41 13.850 -7.463 -12.021 1.00 0.00 H new ATOM 0 HG22 ILE A 41 12.144 -7.964 -11.954 1.00 0.00 H new ATOM 0 HG23 ILE A 41 13.011 -7.556 -10.455 1.00 0.00 H new ATOM 0 HD11 ILE A 41 16.861 -10.493 -10.646 1.00 0.00 H new ATOM 0 HD12 ILE A 41 15.479 -11.550 -11.017 1.00 0.00 H new ATOM 0 HD13 ILE A 41 16.071 -10.399 -12.238 1.00 0.00 H new ATOM 606 N GLY A 42 10.348 -11.252 -11.156 1.00 0.00 N ATOM 607 CA GLY A 42 8.882 -11.339 -11.200 1.00 0.00 C ATOM 608 C GLY A 42 8.302 -11.909 -9.905 1.00 0.00 C ATOM 609 O GLY A 42 7.092 -12.113 -9.786 1.00 0.00 O ATOM 0 H GLY A 42 10.802 -12.119 -11.444 1.00 0.00 H new ATOM 0 HA2 GLY A 42 8.465 -10.348 -11.378 1.00 0.00 H new ATOM 0 HA3 GLY A 42 8.581 -11.967 -12.039 1.00 0.00 H new ATOM 613 N ALA A 43 9.191 -12.175 -8.950 1.00 0.00 N ATOM 614 CA ALA A 43 8.971 -12.736 -7.638 1.00 0.00 C ATOM 615 C ALA A 43 7.904 -11.975 -6.868 1.00 0.00 C ATOM 616 O ALA A 43 8.153 -10.851 -6.428 1.00 0.00 O ATOM 617 CB ALA A 43 10.296 -12.602 -6.912 1.00 0.00 C ATOM 0 H ALA A 43 10.181 -11.979 -9.102 1.00 0.00 H new ATOM 0 HA ALA A 43 8.629 -13.768 -7.719 1.00 0.00 H new ATOM 0 HB1 ALA A 43 10.202 -13.009 -5.905 1.00 0.00 H new ATOM 0 HB2 ALA A 43 11.066 -13.150 -7.455 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.574 -11.550 -6.853 1.00 0.00 H new ATOM 623 N THR A 44 6.752 -12.602 -6.666 1.00 0.00 N ATOM 624 CA THR A 44 5.584 -11.959 -6.087 1.00 0.00 C ATOM 625 C THR A 44 4.972 -12.856 -5.002 1.00 0.00 C ATOM 626 O THR A 44 4.899 -14.082 -5.127 1.00 0.00 O ATOM 627 CB THR A 44 4.608 -11.579 -7.217 1.00 0.00 C ATOM 628 OG1 THR A 44 4.693 -12.486 -8.305 1.00 0.00 O ATOM 629 CG2 THR A 44 4.913 -10.183 -7.777 1.00 0.00 C ATOM 0 H THR A 44 6.603 -13.583 -6.903 1.00 0.00 H new ATOM 0 HA THR A 44 5.856 -11.032 -5.582 1.00 0.00 H new ATOM 0 HB THR A 44 3.613 -11.606 -6.773 1.00 0.00 H new ATOM 0 HG1 THR A 44 5.520 -12.321 -8.805 1.00 0.00 H new ATOM 0 HG21 THR A 44 4.206 -9.947 -8.572 1.00 0.00 H new ATOM 0 HG22 THR A 44 4.823 -9.444 -6.981 1.00 0.00 H new ATOM 0 HG23 THR A 44 5.927 -10.165 -8.176 1.00 0.00 H new ATOM 637 N THR A 45 4.620 -12.223 -3.891 1.00 0.00 N ATOM 638 CA THR A 45 4.090 -12.774 -2.651 1.00 0.00 C ATOM 639 C THR A 45 2.540 -12.755 -2.592 1.00 0.00 C ATOM 640 O THR A 45 1.908 -12.202 -3.496 1.00 0.00 O ATOM 641 CB THR A 45 4.743 -11.967 -1.515 1.00 0.00 C ATOM 642 OG1 THR A 45 4.407 -10.597 -1.543 1.00 0.00 O ATOM 643 CG2 THR A 45 6.267 -12.021 -1.567 1.00 0.00 C ATOM 0 H THR A 45 4.708 -11.209 -3.830 1.00 0.00 H new ATOM 0 HA THR A 45 4.334 -13.833 -2.564 1.00 0.00 H new ATOM 0 HB THR A 45 4.359 -12.437 -0.610 1.00 0.00 H new ATOM 0 HG1 THR A 45 5.126 -10.093 -1.977 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.680 -11.436 -0.745 1.00 0.00 H new ATOM 0 HG22 THR A 45 6.598 -13.056 -1.478 1.00 0.00 H new ATOM 0 HG23 THR A 45 6.614 -11.609 -2.515 1.00 0.00 H new ATOM 651 N PRO A 46 1.885 -13.347 -1.563 1.00 0.00 N ATOM 652 CA PRO A 46 0.432 -13.335 -1.400 1.00 0.00 C ATOM 653 C PRO A 46 -0.032 -11.981 -0.871 1.00 0.00 C ATOM 654 O PRO A 46 -0.156 -11.811 0.341 1.00 0.00 O ATOM 655 CB PRO A 46 0.065 -14.477 -0.439 1.00 0.00 C ATOM 656 CG PRO A 46 1.399 -15.032 0.050 1.00 0.00 C ATOM 657 CD PRO A 46 2.461 -14.049 -0.434 1.00 0.00 C ATOM 0 HA PRO A 46 -0.069 -13.486 -2.356 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -0.539 -14.113 0.392 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -0.519 -15.245 -0.945 1.00 0.00 H new ATOM 0 HG2 PRO A 46 1.412 -15.118 1.137 1.00 0.00 H new ATOM 0 HG3 PRO A 46 1.578 -16.030 -0.351 1.00 0.00 H new ATOM 0 HD2 PRO A 46 2.735 -13.352 0.358 1.00 0.00 H new ATOM 0 HD3 PRO A 46 3.371 -14.573 -0.726 1.00 0.00 H new ATOM 665 N VAL A 47 -0.226 -11.001 -1.747 1.00 0.00 N ATOM 666 CA VAL A 47 -0.519 -9.619 -1.373 1.00 0.00 C ATOM 667 C VAL A 47 -1.753 -9.498 -0.473 1.00 0.00 C ATOM 668 O VAL A 47 -2.651 -10.341 -0.521 1.00 0.00 O ATOM 669 CB VAL A 47 -0.621 -8.746 -2.632 1.00 0.00 C ATOM 670 CG1 VAL A 47 0.667 -8.803 -3.458 1.00 0.00 C ATOM 671 CG2 VAL A 47 -1.802 -9.152 -3.519 1.00 0.00 C ATOM 0 H VAL A 47 -0.184 -11.146 -2.756 1.00 0.00 H new ATOM 0 HA VAL A 47 0.311 -9.251 -0.769 1.00 0.00 H new ATOM 0 HB VAL A 47 -0.781 -7.726 -2.282 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.561 -8.174 -4.342 1.00 0.00 H new ATOM 0 HG12 VAL A 47 1.502 -8.444 -2.856 1.00 0.00 H new ATOM 0 HG13 VAL A 47 0.857 -9.831 -3.765 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -1.835 -8.508 -4.398 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -1.681 -10.189 -3.833 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -2.731 -9.049 -2.958 1.00 0.00 H new ATOM 681 N VAL A 48 -1.800 -8.440 0.338 1.00 0.00 N ATOM 682 CA VAL A 48 -2.829 -8.232 1.346 1.00 0.00 C ATOM 683 C VAL A 48 -3.558 -6.939 1.029 1.00 0.00 C ATOM 684 O VAL A 48 -2.888 -5.985 0.632 1.00 0.00 O ATOM 685 CB VAL A 48 -2.163 -8.220 2.740 1.00 0.00 C ATOM 686 CG1 VAL A 48 -2.469 -7.019 3.649 1.00 0.00 C ATOM 687 CG2 VAL A 48 -2.582 -9.502 3.444 1.00 0.00 C ATOM 0 H VAL A 48 -1.108 -7.691 0.308 1.00 0.00 H new ATOM 0 HA VAL A 48 -3.566 -9.035 1.345 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.091 -8.138 2.560 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.940 -7.135 4.595 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -2.143 -6.101 3.161 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -3.542 -6.969 3.837 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.133 -9.536 4.436 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.668 -9.528 3.536 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.246 -10.362 2.864 1.00 0.00 H new ATOM 697 N PRO A 49 -4.884 -6.872 1.227 1.00 0.00 N ATOM 698 CA PRO A 49 -5.625 -5.647 1.023 1.00 0.00 C ATOM 699 C PRO A 49 -5.232 -4.618 2.081 1.00 0.00 C ATOM 700 O PRO A 49 -5.009 -4.930 3.253 1.00 0.00 O ATOM 701 CB PRO A 49 -7.095 -6.039 1.105 1.00 0.00 C ATOM 702 CG PRO A 49 -7.090 -7.231 2.060 1.00 0.00 C ATOM 703 CD PRO A 49 -5.764 -7.918 1.729 1.00 0.00 C ATOM 0 HA PRO A 49 -5.414 -5.180 0.061 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -7.708 -5.222 1.485 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -7.494 -6.309 0.127 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -7.134 -6.915 3.102 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -7.941 -7.890 1.890 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -5.340 -8.394 2.613 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -5.905 -8.700 0.983 1.00 0.00 H new ATOM 711 N PHE A 50 -5.165 -3.369 1.654 1.00 0.00 N ATOM 712 CA PHE A 50 -4.776 -2.196 2.407 1.00 0.00 C ATOM 713 C PHE A 50 -5.673 -1.036 1.946 1.00 0.00 C ATOM 714 O PHE A 50 -6.469 -1.194 1.019 1.00 0.00 O ATOM 715 CB PHE A 50 -3.275 -1.968 2.153 1.00 0.00 C ATOM 716 CG PHE A 50 -2.741 -0.659 2.683 1.00 0.00 C ATOM 717 CD1 PHE A 50 -2.882 -0.341 4.046 1.00 0.00 C ATOM 718 CD2 PHE A 50 -2.190 0.285 1.796 1.00 0.00 C ATOM 719 CE1 PHE A 50 -2.524 0.938 4.499 1.00 0.00 C ATOM 720 CE2 PHE A 50 -1.802 1.551 2.262 1.00 0.00 C ATOM 721 CZ PHE A 50 -1.985 1.886 3.614 1.00 0.00 C ATOM 0 H PHE A 50 -5.402 -3.133 0.690 1.00 0.00 H new ATOM 0 HA PHE A 50 -4.910 -2.297 3.484 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -2.715 -2.785 2.608 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -3.090 -2.013 1.080 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -3.263 -1.076 4.739 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -2.065 0.034 0.753 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -2.664 1.196 5.538 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -1.363 2.266 1.582 1.00 0.00 H new ATOM 0 HZ PHE A 50 -1.712 2.868 3.971 1.00 0.00 H new ATOM 731 N ARG A 51 -5.580 0.113 2.612 1.00 0.00 N ATOM 732 CA ARG A 51 -6.251 1.379 2.343 1.00 0.00 C ATOM 733 C ARG A 51 -5.535 2.417 3.169 1.00 0.00 C ATOM 734 O ARG A 51 -5.168 2.143 4.305 1.00 0.00 O ATOM 735 CB ARG A 51 -7.714 1.362 2.815 1.00 0.00 C ATOM 736 CG ARG A 51 -7.955 0.569 4.116 1.00 0.00 C ATOM 737 CD ARG A 51 -8.981 1.211 5.044 1.00 0.00 C ATOM 738 NE ARG A 51 -9.456 0.222 6.021 1.00 0.00 N ATOM 739 CZ ARG A 51 -9.016 0.073 7.278 1.00 0.00 C ATOM 740 NH1 ARG A 51 -8.150 0.923 7.812 1.00 0.00 N ATOM 741 NH2 ARG A 51 -9.435 -0.954 8.008 1.00 0.00 N ATOM 0 H ARG A 51 -4.975 0.186 3.430 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.234 1.576 1.271 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -8.047 2.389 2.963 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -8.333 0.937 2.025 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -8.288 -0.437 3.861 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -7.010 0.467 4.649 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -8.536 2.061 5.561 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -9.820 1.594 4.464 1.00 0.00 H new ATOM 0 HE ARG A 51 -10.192 -0.413 5.713 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -7.804 1.711 7.264 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -7.829 0.789 8.771 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -10.090 -1.628 7.612 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -9.101 -1.069 8.965 1.00 0.00 H new ATOM 755 N ILE A 52 -5.407 3.623 2.633 1.00 0.00 N ATOM 756 CA ILE A 52 -4.862 4.707 3.434 1.00 0.00 C ATOM 757 C ILE A 52 -5.931 5.220 4.407 1.00 0.00 C ATOM 758 O ILE A 52 -5.584 5.533 5.538 1.00 0.00 O ATOM 759 CB ILE A 52 -4.224 5.757 2.507 1.00 0.00 C ATOM 760 CG1 ILE A 52 -2.924 5.161 1.910 1.00 0.00 C ATOM 761 CG2 ILE A 52 -3.885 7.029 3.284 1.00 0.00 C ATOM 762 CD1 ILE A 52 -2.747 5.458 0.426 1.00 0.00 C ATOM 0 H ILE A 52 -5.664 3.870 1.677 1.00 0.00 H new ATOM 0 HA ILE A 52 -4.048 4.371 4.077 1.00 0.00 H new ATOM 0 HB ILE A 52 -4.929 6.013 1.716 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -2.068 5.556 2.457 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -2.926 4.081 2.059 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -3.435 7.758 2.610 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -4.796 7.446 3.714 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -3.182 6.791 4.083 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.817 5.011 0.074 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.585 5.039 -0.131 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.712 6.537 0.272 1.00 0.00 H new ATOM 774 N LEU A 53 -7.216 5.220 4.026 1.00 0.00 N ATOM 775 CA LEU A 53 -8.344 5.757 4.796 1.00 0.00 C ATOM 776 C LEU A 53 -8.214 7.280 4.943 1.00 0.00 C ATOM 777 O LEU A 53 -7.443 7.788 5.763 1.00 0.00 O ATOM 778 CB LEU A 53 -8.541 5.026 6.137 1.00 0.00 C ATOM 779 CG LEU A 53 -9.978 5.090 6.683 1.00 0.00 C ATOM 780 CD1 LEU A 53 -10.222 3.946 7.672 1.00 0.00 C ATOM 781 CD2 LEU A 53 -10.280 6.417 7.381 1.00 0.00 C ATOM 0 H LEU A 53 -7.510 4.827 3.132 1.00 0.00 H new ATOM 0 HA LEU A 53 -9.260 5.566 4.238 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.257 3.981 6.014 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -7.864 5.455 6.875 1.00 0.00 H new ATOM 0 HG LEU A 53 -10.642 4.999 5.823 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -11.243 4.004 8.050 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -10.076 2.991 7.167 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -9.522 4.028 8.503 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -11.306 6.410 7.748 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -9.596 6.551 8.219 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -10.153 7.237 6.674 1.00 0.00 H new ATOM 793 N LEU A 54 -8.953 8.023 4.118 1.00 0.00 N ATOM 794 CA LEU A 54 -8.859 9.483 4.058 1.00 0.00 C ATOM 795 C LEU A 54 -10.190 10.056 4.501 1.00 0.00 C ATOM 796 O LEU A 54 -11.172 9.923 3.774 1.00 0.00 O ATOM 797 CB LEU A 54 -8.490 9.999 2.652 1.00 0.00 C ATOM 798 CG LEU A 54 -7.092 9.656 2.114 1.00 0.00 C ATOM 799 CD1 LEU A 54 -5.997 9.907 3.146 1.00 0.00 C ATOM 800 CD2 LEU A 54 -6.991 8.232 1.557 1.00 0.00 C ATOM 0 H LEU A 54 -9.636 7.629 3.471 1.00 0.00 H new ATOM 0 HA LEU A 54 -8.055 9.808 4.719 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -9.226 9.611 1.948 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -8.592 11.084 2.655 1.00 0.00 H new ATOM 0 HG LEU A 54 -6.933 10.338 1.279 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.028 9.650 2.718 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.000 10.959 3.431 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.180 9.292 4.027 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -5.979 8.054 1.194 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -7.225 7.516 2.345 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -7.698 8.112 0.736 1.00 0.00 H new ATOM 812 N SER A 55 -10.249 10.655 5.689 1.00 0.00 N ATOM 813 CA SER A 55 -11.482 11.210 6.221 1.00 0.00 C ATOM 814 C SER A 55 -11.201 12.180 7.369 1.00 0.00 C ATOM 815 O SER A 55 -10.108 12.113 7.943 1.00 0.00 O ATOM 816 CB SER A 55 -12.391 10.061 6.686 1.00 0.00 C ATOM 817 OG SER A 55 -11.774 9.217 7.645 1.00 0.00 O ATOM 0 H SER A 55 -9.443 10.767 6.305 1.00 0.00 H new ATOM 0 HA SER A 55 -11.985 11.775 5.437 1.00 0.00 H new ATOM 0 HB2 SER A 55 -13.304 10.477 7.111 1.00 0.00 H new ATOM 0 HB3 SER A 55 -12.685 9.465 5.822 1.00 0.00 H new ATOM 0 HG SER A 55 -12.397 8.507 7.905 1.00 0.00 H new ATOM 823 N PRO A 56 -12.179 13.003 7.784 1.00 0.00 N ATOM 824 CA PRO A 56 -13.372 13.357 7.020 1.00 0.00 C ATOM 825 C PRO A 56 -13.018 14.250 5.820 1.00 0.00 C ATOM 826 O PRO A 56 -11.847 14.531 5.548 1.00 0.00 O ATOM 827 CB PRO A 56 -14.311 14.018 8.032 1.00 0.00 C ATOM 828 CG PRO A 56 -13.372 14.627 9.064 1.00 0.00 C ATOM 829 CD PRO A 56 -12.146 13.717 9.051 1.00 0.00 C ATOM 0 HA PRO A 56 -13.859 12.493 6.567 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -14.934 14.779 7.561 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -14.985 13.291 8.485 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -13.108 15.652 8.804 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -13.833 14.657 10.051 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -11.229 14.299 9.145 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -12.170 13.021 9.890 1.00 0.00 H new ATOM 837 N CYS A 57 -14.034 14.661 5.059 1.00 0.00 N ATOM 838 CA CYS A 57 -13.878 15.494 3.879 1.00 0.00 C ATOM 839 C CYS A 57 -15.186 16.253 3.647 1.00 0.00 C ATOM 840 O CYS A 57 -16.209 15.898 4.242 1.00 0.00 O ATOM 841 CB CYS A 57 -13.461 14.627 2.697 1.00 0.00 C ATOM 842 SG CYS A 57 -12.515 15.402 1.369 1.00 0.00 S ATOM 0 H CYS A 57 -15.005 14.416 5.255 1.00 0.00 H new ATOM 0 HA CYS A 57 -13.089 16.234 4.011 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -12.873 13.795 3.084 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -14.364 14.202 2.259 1.00 0.00 H new ATOM 847 N GLY A 58 -15.169 17.266 2.778 1.00 0.00 N ATOM 848 CA GLY A 58 -16.382 17.986 2.380 1.00 0.00 C ATOM 849 C GLY A 58 -17.076 17.269 1.217 1.00 0.00 C ATOM 850 O GLY A 58 -17.041 16.042 1.132 1.00 0.00 O ATOM 0 H GLY A 58 -14.319 17.610 2.332 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -17.063 18.059 3.228 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -16.127 19.005 2.087 1.00 0.00 H new ATOM 854 N ASN A 59 -17.767 17.988 0.338 1.00 0.00 N ATOM 855 CA ASN A 59 -18.748 17.399 -0.577 1.00 0.00 C ATOM 856 C ASN A 59 -18.387 17.627 -2.053 1.00 0.00 C ATOM 857 O ASN A 59 -19.115 17.127 -2.906 1.00 0.00 O ATOM 858 CB ASN A 59 -20.160 17.987 -0.300 1.00 0.00 C ATOM 859 CG ASN A 59 -20.830 17.550 1.008 1.00 0.00 C ATOM 860 OD1 ASN A 59 -20.212 16.746 1.861 1.00 0.00 O flip ATOM 861 ND2 ASN A 59 -21.968 17.933 1.272 1.00 0.00 N flip ATOM 0 H ASN A 59 -17.665 18.998 0.237 1.00 0.00 H new ATOM 0 HA ASN A 59 -18.744 16.324 -0.394 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -20.084 19.074 -0.300 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -20.814 17.713 -1.128 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -22.460 18.552 0.628 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -22.420 17.632 2.135 1.00 0.00 H new ATOM 868 N ALA A 60 -17.319 18.370 -2.380 1.00 0.00 N ATOM 869 CA ALA A 60 -17.010 18.789 -3.753 1.00 0.00 C ATOM 870 C ALA A 60 -15.580 18.393 -4.156 1.00 0.00 C ATOM 871 O ALA A 60 -14.643 19.192 -4.028 1.00 0.00 O ATOM 872 CB ALA A 60 -17.247 20.300 -3.873 1.00 0.00 C ATOM 0 H ALA A 60 -16.641 18.699 -1.693 1.00 0.00 H new ATOM 0 HA ALA A 60 -17.671 18.272 -4.449 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -17.021 20.624 -4.889 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -18.289 20.524 -3.644 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -16.600 20.827 -3.172 1.00 0.00 H new ATOM 878 N VAL A 61 -15.395 17.155 -4.616 1.00 0.00 N ATOM 879 CA VAL A 61 -14.102 16.549 -4.921 1.00 0.00 C ATOM 880 C VAL A 61 -14.317 15.576 -6.088 1.00 0.00 C ATOM 881 O VAL A 61 -15.326 14.869 -6.083 1.00 0.00 O ATOM 882 CB VAL A 61 -13.494 15.904 -3.639 1.00 0.00 C ATOM 883 CG1 VAL A 61 -14.452 15.659 -2.460 1.00 0.00 C ATOM 884 CG2 VAL A 61 -12.799 14.563 -3.841 1.00 0.00 C ATOM 0 H VAL A 61 -16.175 16.522 -4.793 1.00 0.00 H new ATOM 0 HA VAL A 61 -13.363 17.285 -5.236 1.00 0.00 H new ATOM 0 HB VAL A 61 -12.787 16.698 -3.399 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -13.904 15.207 -1.633 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -14.880 16.608 -2.136 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -15.252 14.988 -2.774 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.414 14.206 -2.886 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -13.512 13.840 -4.238 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -11.974 14.683 -4.543 1.00 0.00 H new ATOM 894 N SER A 62 -13.374 15.514 -7.041 1.00 0.00 N ATOM 895 CA SER A 62 -13.425 14.612 -8.200 1.00 0.00 C ATOM 896 C SER A 62 -12.365 13.501 -8.167 1.00 0.00 C ATOM 897 O SER A 62 -12.550 12.446 -8.781 1.00 0.00 O ATOM 898 CB SER A 62 -13.222 15.433 -9.479 1.00 0.00 C ATOM 899 OG SER A 62 -14.153 16.494 -9.588 1.00 0.00 O ATOM 0 H SER A 62 -12.540 16.101 -7.026 1.00 0.00 H new ATOM 0 HA SER A 62 -14.401 14.127 -8.173 1.00 0.00 H new ATOM 0 HB2 SER A 62 -12.210 15.837 -9.492 1.00 0.00 H new ATOM 0 HB3 SER A 62 -13.315 14.780 -10.347 1.00 0.00 H new ATOM 0 HG SER A 62 -13.987 16.992 -10.416 1.00 0.00 H new ATOM 905 N ALA A 63 -11.211 13.741 -7.529 1.00 0.00 N ATOM 906 CA ALA A 63 -10.089 12.807 -7.503 1.00 0.00 C ATOM 907 C ALA A 63 -8.994 13.304 -6.564 1.00 0.00 C ATOM 908 O ALA A 63 -9.140 14.341 -5.911 1.00 0.00 O ATOM 909 CB ALA A 63 -9.466 12.664 -8.897 1.00 0.00 C ATOM 0 H ALA A 63 -11.034 14.602 -7.011 1.00 0.00 H new ATOM 0 HA ALA A 63 -10.480 11.849 -7.161 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -8.632 11.963 -8.853 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -10.216 12.292 -9.594 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -9.106 13.635 -9.236 1.00 0.00 H new ATOM 915 N VAL A 64 -7.882 12.573 -6.551 1.00 0.00 N ATOM 916 CA VAL A 64 -6.619 12.909 -5.925 1.00 0.00 C ATOM 917 C VAL A 64 -5.498 12.336 -6.808 1.00 0.00 C ATOM 918 O VAL A 64 -5.736 11.479 -7.671 1.00 0.00 O ATOM 919 CB VAL A 64 -6.668 12.360 -4.476 1.00 0.00 C ATOM 920 CG1 VAL A 64 -5.423 11.654 -3.942 1.00 0.00 C ATOM 921 CG2 VAL A 64 -6.985 13.498 -3.512 1.00 0.00 C ATOM 0 H VAL A 64 -7.844 11.665 -7.014 1.00 0.00 H new ATOM 0 HA VAL A 64 -6.425 13.979 -5.845 1.00 0.00 H new ATOM 0 HB VAL A 64 -7.438 11.591 -4.533 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -5.603 11.324 -2.919 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -5.198 10.790 -4.568 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -4.579 12.343 -3.958 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -7.020 13.113 -2.493 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -6.212 14.263 -3.585 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -7.951 13.933 -3.768 1.00 0.00 H new ATOM 931 N LYS A 65 -4.270 12.793 -6.570 1.00 0.00 N ATOM 932 CA LYS A 65 -3.034 12.220 -7.095 1.00 0.00 C ATOM 933 C LYS A 65 -2.191 11.795 -5.887 1.00 0.00 C ATOM 934 O LYS A 65 -2.422 12.281 -4.779 1.00 0.00 O ATOM 935 CB LYS A 65 -2.330 13.265 -7.985 1.00 0.00 C ATOM 936 CG LYS A 65 -3.179 13.830 -9.145 1.00 0.00 C ATOM 937 CD LYS A 65 -3.476 12.812 -10.261 1.00 0.00 C ATOM 938 CE LYS A 65 -4.798 13.080 -10.994 1.00 0.00 C ATOM 939 NZ LYS A 65 -4.898 14.400 -11.656 1.00 0.00 N ATOM 0 H LYS A 65 -4.103 13.608 -5.980 1.00 0.00 H new ATOM 0 HA LYS A 65 -3.210 11.347 -7.723 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -2.008 14.095 -7.356 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -1.430 12.814 -8.403 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -4.123 14.199 -8.744 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -2.660 14.686 -9.577 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -2.659 12.827 -10.983 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -3.504 11.811 -9.831 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -4.942 12.303 -11.745 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -5.616 12.987 -10.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -5.824 14.486 -12.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -4.797 15.153 -10.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -4.144 14.490 -12.366 1.00 0.00 H new ATOM 953 N VAL A 66 -1.247 10.871 -6.044 1.00 0.00 N ATOM 954 CA VAL A 66 -0.637 10.170 -4.904 1.00 0.00 C ATOM 955 C VAL A 66 0.878 10.307 -4.992 1.00 0.00 C ATOM 956 O VAL A 66 1.427 10.331 -6.093 1.00 0.00 O ATOM 957 CB VAL A 66 -1.079 8.682 -4.826 1.00 0.00 C ATOM 958 CG1 VAL A 66 -1.552 8.340 -3.414 1.00 0.00 C ATOM 959 CG2 VAL A 66 -2.154 8.254 -5.839 1.00 0.00 C ATOM 0 H VAL A 66 -0.882 10.585 -6.953 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.985 10.631 -3.980 1.00 0.00 H new ATOM 0 HB VAL A 66 -0.184 8.119 -5.092 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.858 7.295 -3.376 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.739 8.506 -2.708 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.397 8.975 -3.150 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -2.388 7.199 -5.697 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -3.054 8.849 -5.687 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.782 8.410 -6.852 1.00 0.00 H new ATOM 969 N GLY A 67 1.559 10.409 -3.852 1.00 0.00 N ATOM 970 CA GLY A 67 3.007 10.523 -3.802 1.00 0.00 C ATOM 971 C GLY A 67 3.568 9.646 -2.698 1.00 0.00 C ATOM 972 O GLY A 67 3.818 10.131 -1.595 1.00 0.00 O ATOM 0 H GLY A 67 1.115 10.414 -2.934 1.00 0.00 H new ATOM 0 HA2 GLY A 67 3.435 10.230 -4.761 1.00 0.00 H new ATOM 0 HA3 GLY A 67 3.291 11.561 -3.630 1.00 0.00 H new ATOM 976 N PHE A 68 3.832 8.375 -3.011 1.00 0.00 N ATOM 977 CA PHE A 68 4.557 7.464 -2.132 1.00 0.00 C ATOM 978 C PHE A 68 6.017 7.844 -2.295 1.00 0.00 C ATOM 979 O PHE A 68 6.559 7.832 -3.399 1.00 0.00 O ATOM 980 CB PHE A 68 4.352 6.003 -2.554 1.00 0.00 C ATOM 981 CG PHE A 68 3.189 5.326 -1.858 1.00 0.00 C ATOM 982 CD1 PHE A 68 1.922 5.938 -1.803 1.00 0.00 C ATOM 983 CD2 PHE A 68 3.388 4.079 -1.236 1.00 0.00 C ATOM 984 CE1 PHE A 68 0.868 5.320 -1.114 1.00 0.00 C ATOM 985 CE2 PHE A 68 2.339 3.473 -0.528 1.00 0.00 C ATOM 986 CZ PHE A 68 1.082 4.098 -0.453 1.00 0.00 C ATOM 0 H PHE A 68 3.544 7.948 -3.892 1.00 0.00 H new ATOM 0 HA PHE A 68 4.210 7.545 -1.102 1.00 0.00 H new ATOM 0 HB2 PHE A 68 4.192 5.964 -3.631 1.00 0.00 H new ATOM 0 HB3 PHE A 68 5.264 5.443 -2.347 1.00 0.00 H new ATOM 0 HD1 PHE A 68 1.761 6.887 -2.293 1.00 0.00 H new ATOM 0 HD2 PHE A 68 4.348 3.589 -1.304 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.108 5.783 -1.091 1.00 0.00 H new ATOM 0 HE2 PHE A 68 2.498 2.523 -0.039 1.00 0.00 H new ATOM 0 HZ PHE A 68 0.283 3.640 0.111 1.00 0.00 H new ATOM 996 N THR A 69 6.628 8.275 -1.194 1.00 0.00 N ATOM 997 CA THR A 69 7.956 8.852 -1.195 1.00 0.00 C ATOM 998 C THR A 69 8.685 8.386 0.054 1.00 0.00 C ATOM 999 O THR A 69 8.193 8.533 1.172 1.00 0.00 O ATOM 1000 CB THR A 69 7.859 10.382 -1.298 1.00 0.00 C ATOM 1001 OG1 THR A 69 6.792 10.929 -0.544 1.00 0.00 O ATOM 1002 CG2 THR A 69 7.690 10.804 -2.753 1.00 0.00 C ATOM 0 H THR A 69 6.203 8.230 -0.268 1.00 0.00 H new ATOM 0 HA THR A 69 8.529 8.519 -2.060 1.00 0.00 H new ATOM 0 HB THR A 69 8.791 10.769 -0.885 1.00 0.00 H new ATOM 0 HG1 THR A 69 6.630 10.372 0.246 1.00 0.00 H new ATOM 0 HG21 THR A 69 7.623 11.890 -2.811 1.00 0.00 H new ATOM 0 HG22 THR A 69 8.547 10.462 -3.333 1.00 0.00 H new ATOM 0 HG23 THR A 69 6.779 10.362 -3.157 1.00 0.00 H new ATOM 1010 N GLY A 70 9.848 7.787 -0.150 1.00 0.00 N ATOM 1011 CA GLY A 70 10.735 7.308 0.884 1.00 0.00 C ATOM 1012 C GLY A 70 12.089 7.078 0.235 1.00 0.00 C ATOM 1013 O GLY A 70 12.372 7.667 -0.816 1.00 0.00 O ATOM 0 H GLY A 70 10.211 7.616 -1.088 1.00 0.00 H new ATOM 0 HA2 GLY A 70 10.813 8.035 1.692 1.00 0.00 H new ATOM 0 HA3 GLY A 70 10.355 6.385 1.321 1.00 0.00 H new ATOM 1017 N VAL A 71 12.907 6.231 0.846 1.00 0.00 N ATOM 1018 CA VAL A 71 14.132 5.734 0.247 1.00 0.00 C ATOM 1019 C VAL A 71 13.794 4.911 -1.010 1.00 0.00 C ATOM 1020 O VAL A 71 13.109 3.880 -0.951 1.00 0.00 O ATOM 1021 CB VAL A 71 14.969 4.986 1.310 1.00 0.00 C ATOM 1022 CG1 VAL A 71 14.192 3.942 2.137 1.00 0.00 C ATOM 1023 CG2 VAL A 71 16.220 4.361 0.682 1.00 0.00 C ATOM 0 H VAL A 71 12.733 5.867 1.783 1.00 0.00 H new ATOM 0 HA VAL A 71 14.764 6.552 -0.097 1.00 0.00 H new ATOM 0 HB VAL A 71 15.262 5.754 2.026 1.00 0.00 H new ATOM 0 HG11 VAL A 71 14.865 3.472 2.854 1.00 0.00 H new ATOM 0 HG12 VAL A 71 13.378 4.433 2.671 1.00 0.00 H new ATOM 0 HG13 VAL A 71 13.783 3.182 1.471 1.00 0.00 H new ATOM 0 HG21 VAL A 71 16.792 3.841 1.450 1.00 0.00 H new ATOM 0 HG22 VAL A 71 15.924 3.653 -0.092 1.00 0.00 H new ATOM 0 HG23 VAL A 71 16.835 5.145 0.240 1.00 0.00 H new ATOM 1033 N ALA A 72 14.294 5.371 -2.158 1.00 0.00 N ATOM 1034 CA ALA A 72 14.276 4.607 -3.395 1.00 0.00 C ATOM 1035 C ALA A 72 15.407 3.571 -3.371 1.00 0.00 C ATOM 1036 O ALA A 72 16.440 3.756 -2.714 1.00 0.00 O ATOM 1037 CB ALA A 72 14.488 5.552 -4.570 1.00 0.00 C ATOM 0 H ALA A 72 14.725 6.291 -2.251 1.00 0.00 H new ATOM 0 HA ALA A 72 13.317 4.099 -3.497 1.00 0.00 H new ATOM 0 HB1 ALA A 72 14.475 4.984 -5.500 1.00 0.00 H new ATOM 0 HB2 ALA A 72 13.691 6.295 -4.588 1.00 0.00 H new ATOM 0 HB3 ALA A 72 15.450 6.054 -4.464 1.00 0.00 H new ATOM 1043 N ASP A 73 15.218 2.474 -4.094 1.00 0.00 N ATOM 1044 CA ASP A 73 16.117 1.332 -4.102 1.00 0.00 C ATOM 1045 C ASP A 73 17.279 1.579 -5.057 1.00 0.00 C ATOM 1046 O ASP A 73 17.197 2.389 -5.982 1.00 0.00 O ATOM 1047 CB ASP A 73 15.362 0.047 -4.483 1.00 0.00 C ATOM 1048 CG ASP A 73 16.266 -1.186 -4.392 1.00 0.00 C ATOM 1049 OD1 ASP A 73 17.023 -1.327 -3.407 1.00 0.00 O ATOM 1050 OD2 ASP A 73 16.322 -2.001 -5.335 1.00 0.00 O ATOM 0 H ASP A 73 14.412 2.353 -4.707 1.00 0.00 H new ATOM 0 HA ASP A 73 16.518 1.202 -3.097 1.00 0.00 H new ATOM 0 HB2 ASP A 73 14.504 -0.081 -3.823 1.00 0.00 H new ATOM 0 HB3 ASP A 73 14.973 0.140 -5.497 1.00 0.00 H new ATOM 1055 N SER A 74 18.352 0.828 -4.844 1.00 0.00 N ATOM 1056 CA SER A 74 19.493 0.717 -5.738 1.00 0.00 C ATOM 1057 C SER A 74 19.044 0.136 -7.083 1.00 0.00 C ATOM 1058 O SER A 74 19.394 0.662 -8.138 1.00 0.00 O ATOM 1059 CB SER A 74 20.544 -0.168 -5.043 1.00 0.00 C ATOM 1060 OG SER A 74 21.680 -0.438 -5.842 1.00 0.00 O ATOM 0 H SER A 74 18.453 0.255 -4.006 1.00 0.00 H new ATOM 0 HA SER A 74 19.932 1.692 -5.948 1.00 0.00 H new ATOM 0 HB2 SER A 74 20.866 0.320 -4.123 1.00 0.00 H new ATOM 0 HB3 SER A 74 20.079 -1.112 -4.757 1.00 0.00 H new ATOM 0 HG SER A 74 22.306 -1.002 -5.341 1.00 0.00 H new ATOM 1066 N HIS A 75 18.298 -0.971 -7.053 1.00 0.00 N ATOM 1067 CA HIS A 75 18.134 -1.845 -8.200 1.00 0.00 C ATOM 1068 C HIS A 75 16.956 -1.394 -9.033 1.00 0.00 C ATOM 1069 O HIS A 75 17.132 -1.007 -10.186 1.00 0.00 O ATOM 1070 CB HIS A 75 17.995 -3.312 -7.766 1.00 0.00 C ATOM 1071 CG HIS A 75 18.955 -3.703 -6.677 1.00 0.00 C ATOM 1072 ND1 HIS A 75 18.714 -3.578 -5.321 1.00 0.00 N ATOM 1073 CD2 HIS A 75 20.220 -4.181 -6.852 1.00 0.00 C ATOM 1074 CE1 HIS A 75 19.820 -3.998 -4.678 1.00 0.00 C ATOM 1075 NE2 HIS A 75 20.748 -4.359 -5.589 1.00 0.00 N ATOM 0 H HIS A 75 17.791 -1.281 -6.224 1.00 0.00 H new ATOM 0 HA HIS A 75 19.030 -1.781 -8.818 1.00 0.00 H new ATOM 0 HB2 HIS A 75 16.976 -3.487 -7.422 1.00 0.00 H new ATOM 0 HB3 HIS A 75 18.155 -3.956 -8.631 1.00 0.00 H new ATOM 0 HD1 HIS A 75 17.858 -3.232 -4.888 1.00 0.00 H new ATOM 0 HD2 HIS A 75 20.712 -4.381 -7.793 1.00 0.00 H new ATOM 0 HE1 HIS A 75 19.944 -4.039 -3.606 1.00 0.00 H new ATOM 1084 N ASN A 76 15.751 -1.459 -8.463 1.00 0.00 N ATOM 1085 CA ASN A 76 14.536 -1.067 -9.146 1.00 0.00 C ATOM 1086 C ASN A 76 13.926 -0.047 -8.219 1.00 0.00 C ATOM 1087 O ASN A 76 13.224 -0.409 -7.278 1.00 0.00 O ATOM 1088 CB ASN A 76 13.634 -2.274 -9.459 1.00 0.00 C ATOM 1089 CG ASN A 76 14.184 -3.241 -10.506 1.00 0.00 C ATOM 1090 OD1 ASN A 76 13.783 -4.401 -10.556 1.00 0.00 O ATOM 1091 ND2 ASN A 76 15.116 -2.847 -11.354 1.00 0.00 N ATOM 0 H ASN A 76 15.600 -1.788 -7.509 1.00 0.00 H new ATOM 0 HA ASN A 76 14.706 -0.643 -10.136 1.00 0.00 H new ATOM 0 HB2 ASN A 76 13.458 -2.825 -8.535 1.00 0.00 H new ATOM 0 HB3 ASN A 76 12.666 -1.906 -9.800 1.00 0.00 H new ATOM 0 HD21 ASN A 76 15.493 -3.503 -12.038 1.00 0.00 H new ATOM 0 HD22 ASN A 76 15.459 -1.887 -11.325 1.00 0.00 H new ATOM 1098 N ALA A 77 14.243 1.227 -8.458 1.00 0.00 N ATOM 1099 CA ALA A 77 13.784 2.348 -7.643 1.00 0.00 C ATOM 1100 C ALA A 77 12.244 2.427 -7.596 1.00 0.00 C ATOM 1101 O ALA A 77 11.689 3.144 -6.769 1.00 0.00 O ATOM 1102 CB ALA A 77 14.372 3.647 -8.211 1.00 0.00 C ATOM 0 H ALA A 77 14.836 1.511 -9.237 1.00 0.00 H new ATOM 0 HA ALA A 77 14.127 2.200 -6.619 1.00 0.00 H new ATOM 0 HB1 ALA A 77 14.036 4.492 -7.610 1.00 0.00 H new ATOM 0 HB2 ALA A 77 15.460 3.595 -8.187 1.00 0.00 H new ATOM 0 HB3 ALA A 77 14.038 3.778 -9.240 1.00 0.00 H new ATOM 1108 N ASN A 78 11.554 1.665 -8.455 1.00 0.00 N ATOM 1109 CA ASN A 78 10.105 1.480 -8.490 1.00 0.00 C ATOM 1110 C ASN A 78 9.546 0.713 -7.276 1.00 0.00 C ATOM 1111 O ASN A 78 8.366 0.360 -7.264 1.00 0.00 O ATOM 1112 CB ASN A 78 9.674 0.706 -9.750 1.00 0.00 C ATOM 1113 CG ASN A 78 10.085 1.285 -11.090 1.00 0.00 C ATOM 1114 OD1 ASN A 78 10.628 2.378 -11.182 1.00 0.00 O ATOM 1115 ND2 ASN A 78 9.815 0.571 -12.168 1.00 0.00 N ATOM 0 H ASN A 78 12.025 1.131 -9.186 1.00 0.00 H new ATOM 0 HA ASN A 78 9.701 2.492 -8.483 1.00 0.00 H new ATOM 0 HB2 ASN A 78 10.076 -0.305 -9.680 1.00 0.00 H new ATOM 0 HB3 ASN A 78 8.588 0.618 -9.738 1.00 0.00 H new ATOM 0 HD21 ASN A 78 10.059 0.929 -13.091 1.00 0.00 H new ATOM 0 HD22 ASN A 78 9.362 -0.338 -12.077 1.00 0.00 H new ATOM 1122 N LEU A 79 10.376 0.359 -6.300 1.00 0.00 N ATOM 1123 CA LEU A 79 9.973 -0.303 -5.064 1.00 0.00 C ATOM 1124 C LEU A 79 10.167 0.684 -3.902 1.00 0.00 C ATOM 1125 O LEU A 79 10.468 1.859 -4.114 1.00 0.00 O ATOM 1126 CB LEU A 79 10.742 -1.643 -4.936 1.00 0.00 C ATOM 1127 CG LEU A 79 10.218 -2.819 -5.804 1.00 0.00 C ATOM 1128 CD1 LEU A 79 8.692 -3.007 -5.856 1.00 0.00 C ATOM 1129 CD2 LEU A 79 10.719 -2.746 -7.245 1.00 0.00 C ATOM 0 H LEU A 79 11.380 0.531 -6.349 1.00 0.00 H new ATOM 0 HA LEU A 79 8.918 -0.575 -5.054 1.00 0.00 H new ATOM 0 HB2 LEU A 79 11.786 -1.465 -5.194 1.00 0.00 H new ATOM 0 HB3 LEU A 79 10.720 -1.952 -3.891 1.00 0.00 H new ATOM 0 HG LEU A 79 10.629 -3.680 -5.277 1.00 0.00 H new ATOM 0 HD11 LEU A 79 8.452 -3.858 -6.493 1.00 0.00 H new ATOM 0 HD12 LEU A 79 8.313 -3.188 -4.850 1.00 0.00 H new ATOM 0 HD13 LEU A 79 8.228 -2.108 -6.262 1.00 0.00 H new ATOM 0 HD21 LEU A 79 10.325 -3.590 -7.810 1.00 0.00 H new ATOM 0 HD22 LEU A 79 10.382 -1.815 -7.701 1.00 0.00 H new ATOM 0 HD23 LEU A 79 11.808 -2.781 -7.254 1.00 0.00 H new ATOM 1141 N LEU A 80 9.987 0.238 -2.663 1.00 0.00 N ATOM 1142 CA LEU A 80 10.278 0.949 -1.417 1.00 0.00 C ATOM 1143 C LEU A 80 11.326 0.075 -0.717 1.00 0.00 C ATOM 1144 O LEU A 80 11.138 -1.140 -0.620 1.00 0.00 O ATOM 1145 CB LEU A 80 8.962 1.168 -0.646 1.00 0.00 C ATOM 1146 CG LEU A 80 8.991 1.966 0.672 1.00 0.00 C ATOM 1147 CD1 LEU A 80 7.650 1.799 1.399 1.00 0.00 C ATOM 1148 CD2 LEU A 80 10.076 1.588 1.667 1.00 0.00 C ATOM 0 H LEU A 80 9.608 -0.693 -2.488 1.00 0.00 H new ATOM 0 HA LEU A 80 10.684 1.954 -1.533 1.00 0.00 H new ATOM 0 HB2 LEU A 80 8.266 1.669 -1.319 1.00 0.00 H new ATOM 0 HB3 LEU A 80 8.542 0.186 -0.427 1.00 0.00 H new ATOM 0 HG LEU A 80 9.200 2.987 0.353 1.00 0.00 H new ATOM 0 HD11 LEU A 80 7.669 2.363 2.332 1.00 0.00 H new ATOM 0 HD12 LEU A 80 6.844 2.171 0.766 1.00 0.00 H new ATOM 0 HD13 LEU A 80 7.483 0.744 1.616 1.00 0.00 H new ATOM 0 HD21 LEU A 80 9.993 2.218 2.552 1.00 0.00 H new ATOM 0 HD22 LEU A 80 9.959 0.543 1.953 1.00 0.00 H new ATOM 0 HD23 LEU A 80 11.055 1.731 1.210 1.00 0.00 H new ATOM 1160 N ALA A 81 12.470 0.651 -0.344 1.00 0.00 N ATOM 1161 CA ALA A 81 13.619 -0.094 0.143 1.00 0.00 C ATOM 1162 C ALA A 81 13.487 -0.407 1.639 1.00 0.00 C ATOM 1163 O ALA A 81 12.579 0.055 2.328 1.00 0.00 O ATOM 1164 CB ALA A 81 14.899 0.681 -0.178 1.00 0.00 C ATOM 0 H ALA A 81 12.621 1.659 -0.374 1.00 0.00 H new ATOM 0 HA ALA A 81 13.667 -1.057 -0.365 1.00 0.00 H new ATOM 0 HB1 ALA A 81 15.762 0.124 0.186 1.00 0.00 H new ATOM 0 HB2 ALA A 81 14.982 0.815 -1.257 1.00 0.00 H new ATOM 0 HB3 ALA A 81 14.865 1.656 0.307 1.00 0.00 H new ATOM 1170 N LEU A 82 14.395 -1.232 2.155 1.00 0.00 N ATOM 1171 CA LEU A 82 14.273 -1.814 3.489 1.00 0.00 C ATOM 1172 C LEU A 82 15.051 -0.975 4.508 1.00 0.00 C ATOM 1173 O LEU A 82 15.706 0.004 4.149 1.00 0.00 O ATOM 1174 CB LEU A 82 14.758 -3.277 3.474 1.00 0.00 C ATOM 1175 CG LEU A 82 14.265 -4.132 2.278 1.00 0.00 C ATOM 1176 CD1 LEU A 82 15.397 -4.302 1.255 1.00 0.00 C ATOM 1177 CD2 LEU A 82 13.742 -5.501 2.729 1.00 0.00 C ATOM 0 H LEU A 82 15.239 -1.517 1.658 1.00 0.00 H new ATOM 0 HA LEU A 82 13.225 -1.810 3.788 1.00 0.00 H new ATOM 0 HB2 LEU A 82 15.848 -3.280 3.475 1.00 0.00 H new ATOM 0 HB3 LEU A 82 14.437 -3.757 4.398 1.00 0.00 H new ATOM 0 HG LEU A 82 13.432 -3.605 1.813 1.00 0.00 H new ATOM 0 HD11 LEU A 82 15.043 -4.904 0.418 1.00 0.00 H new ATOM 0 HD12 LEU A 82 15.709 -3.323 0.892 1.00 0.00 H new ATOM 0 HD13 LEU A 82 16.243 -4.800 1.728 1.00 0.00 H new ATOM 0 HD21 LEU A 82 13.407 -6.067 1.860 1.00 0.00 H new ATOM 0 HD22 LEU A 82 14.540 -6.047 3.232 1.00 0.00 H new ATOM 0 HD23 LEU A 82 12.907 -5.363 3.416 1.00 0.00 H new ATOM 1189 N GLU A 83 15.093 -1.438 5.761 1.00 0.00 N ATOM 1190 CA GLU A 83 16.003 -1.033 6.842 1.00 0.00 C ATOM 1191 C GLU A 83 17.500 -1.076 6.450 1.00 0.00 C ATOM 1192 O GLU A 83 18.359 -0.579 7.181 1.00 0.00 O ATOM 1193 CB GLU A 83 15.736 -1.938 8.070 1.00 0.00 C ATOM 1194 CG GLU A 83 16.047 -3.416 7.761 1.00 0.00 C ATOM 1195 CD GLU A 83 15.604 -4.403 8.841 1.00 0.00 C ATOM 1196 OE1 GLU A 83 16.176 -4.383 9.955 1.00 0.00 O ATOM 1197 OE2 GLU A 83 14.742 -5.259 8.547 1.00 0.00 O ATOM 0 H GLU A 83 14.443 -2.160 6.072 1.00 0.00 H new ATOM 0 HA GLU A 83 15.796 0.012 7.072 1.00 0.00 H new ATOM 0 HB2 GLU A 83 16.347 -1.604 8.909 1.00 0.00 H new ATOM 0 HB3 GLU A 83 14.694 -1.840 8.376 1.00 0.00 H new ATOM 0 HG2 GLU A 83 15.564 -3.686 6.822 1.00 0.00 H new ATOM 0 HG3 GLU A 83 17.121 -3.523 7.609 1.00 0.00 H new ATOM 1204 N ASN A 84 17.817 -1.685 5.302 1.00 0.00 N ATOM 1205 CA ASN A 84 19.121 -1.799 4.645 1.00 0.00 C ATOM 1206 C ASN A 84 20.138 -2.663 5.394 1.00 0.00 C ATOM 1207 O ASN A 84 21.259 -2.838 4.927 1.00 0.00 O ATOM 1208 CB ASN A 84 19.677 -0.407 4.284 1.00 0.00 C ATOM 1209 CG ASN A 84 20.481 -0.408 2.987 1.00 0.00 C ATOM 1210 OD1 ASN A 84 21.708 -0.442 2.978 1.00 0.00 O ATOM 1211 ND2 ASN A 84 19.811 -0.309 1.851 1.00 0.00 N ATOM 0 H ASN A 84 17.095 -2.156 4.757 1.00 0.00 H new ATOM 0 HA ASN A 84 18.944 -2.346 3.719 1.00 0.00 H new ATOM 0 HB2 ASN A 84 18.850 0.297 4.192 1.00 0.00 H new ATOM 0 HB3 ASN A 84 20.309 -0.051 5.098 1.00 0.00 H new ATOM 0 HD21 ASN A 84 20.314 -0.261 0.965 1.00 0.00 H new ATOM 0 HD22 ASN A 84 18.791 -0.281 1.861 1.00 0.00 H new ATOM 1218 N THR A 85 19.754 -3.231 6.535 1.00 0.00 N ATOM 1219 CA THR A 85 20.630 -3.983 7.426 1.00 0.00 C ATOM 1220 C THR A 85 20.840 -5.416 6.902 1.00 0.00 C ATOM 1221 O THR A 85 20.069 -5.901 6.070 1.00 0.00 O ATOM 1222 CB THR A 85 20.043 -3.899 8.855 1.00 0.00 C ATOM 1223 OG1 THR A 85 21.077 -3.736 9.794 1.00 0.00 O ATOM 1224 CG2 THR A 85 19.241 -5.107 9.339 1.00 0.00 C ATOM 0 H THR A 85 18.794 -3.178 6.874 1.00 0.00 H new ATOM 0 HA THR A 85 21.632 -3.555 7.459 1.00 0.00 H new ATOM 0 HB THR A 85 19.358 -3.054 8.785 1.00 0.00 H new ATOM 0 HG1 THR A 85 20.695 -3.682 10.695 1.00 0.00 H new ATOM 0 HG21 THR A 85 18.885 -4.925 10.353 1.00 0.00 H new ATOM 0 HG22 THR A 85 18.389 -5.267 8.678 1.00 0.00 H new ATOM 0 HG23 THR A 85 19.877 -5.992 9.332 1.00 0.00 H new ATOM 1232 N VAL A 86 21.843 -6.125 7.432 1.00 0.00 N ATOM 1233 CA VAL A 86 22.158 -7.519 7.089 1.00 0.00 C ATOM 1234 C VAL A 86 20.989 -8.467 7.375 1.00 0.00 C ATOM 1235 O VAL A 86 20.678 -9.330 6.562 1.00 0.00 O ATOM 1236 CB VAL A 86 23.435 -7.978 7.831 1.00 0.00 C ATOM 1237 CG1 VAL A 86 24.659 -7.282 7.227 1.00 0.00 C ATOM 1238 CG2 VAL A 86 23.389 -7.706 9.350 1.00 0.00 C ATOM 0 H VAL A 86 22.476 -5.736 8.131 1.00 0.00 H new ATOM 0 HA VAL A 86 22.339 -7.558 6.015 1.00 0.00 H new ATOM 0 HB VAL A 86 23.501 -9.058 7.703 1.00 0.00 H new ATOM 0 HG11 VAL A 86 25.558 -7.607 7.751 1.00 0.00 H new ATOM 0 HG12 VAL A 86 24.741 -7.541 6.171 1.00 0.00 H new ATOM 0 HG13 VAL A 86 24.550 -6.202 7.328 1.00 0.00 H new ATOM 0 HG21 VAL A 86 24.315 -8.052 9.810 1.00 0.00 H new ATOM 0 HG22 VAL A 86 23.274 -6.636 9.525 1.00 0.00 H new ATOM 0 HG23 VAL A 86 22.545 -8.238 9.789 1.00 0.00 H new ATOM 1248 N SER A 87 20.328 -8.289 8.517 1.00 0.00 N ATOM 1249 CA SER A 87 19.199 -9.070 9.009 1.00 0.00 C ATOM 1250 C SER A 87 17.898 -8.725 8.266 1.00 0.00 C ATOM 1251 O SER A 87 16.847 -9.288 8.577 1.00 0.00 O ATOM 1252 CB SER A 87 19.112 -8.768 10.513 1.00 0.00 C ATOM 1253 OG SER A 87 18.367 -9.673 11.307 1.00 0.00 O ATOM 0 H SER A 87 20.586 -7.545 9.165 1.00 0.00 H new ATOM 0 HA SER A 87 19.342 -10.136 8.833 1.00 0.00 H new ATOM 0 HB2 SER A 87 20.126 -8.725 10.909 1.00 0.00 H new ATOM 0 HB3 SER A 87 18.680 -7.775 10.635 1.00 0.00 H new ATOM 0 HG SER A 87 17.591 -9.212 11.688 1.00 0.00 H new ATOM 1259 N ALA A 88 17.928 -7.769 7.329 1.00 0.00 N ATOM 1260 CA ALA A 88 16.791 -7.485 6.474 1.00 0.00 C ATOM 1261 C ALA A 88 16.654 -8.612 5.456 1.00 0.00 C ATOM 1262 O ALA A 88 17.629 -9.289 5.124 1.00 0.00 O ATOM 1263 CB ALA A 88 17.015 -6.168 5.725 1.00 0.00 C ATOM 0 H ALA A 88 18.741 -7.179 7.150 1.00 0.00 H new ATOM 0 HA ALA A 88 15.890 -7.405 7.082 1.00 0.00 H new ATOM 0 HB1 ALA A 88 16.157 -5.963 5.085 1.00 0.00 H new ATOM 0 HB2 ALA A 88 17.135 -5.357 6.443 1.00 0.00 H new ATOM 0 HB3 ALA A 88 17.913 -6.246 5.113 1.00 0.00 H new ATOM 1269 N ALA A 89 15.470 -8.750 4.882 1.00 0.00 N ATOM 1270 CA ALA A 89 15.275 -9.446 3.625 1.00 0.00 C ATOM 1271 C ALA A 89 16.155 -8.774 2.556 1.00 0.00 C ATOM 1272 O ALA A 89 15.926 -7.616 2.210 1.00 0.00 O ATOM 1273 CB ALA A 89 13.783 -9.366 3.308 1.00 0.00 C ATOM 0 H ALA A 89 14.609 -8.377 5.282 1.00 0.00 H new ATOM 0 HA ALA A 89 15.568 -10.495 3.663 1.00 0.00 H new ATOM 0 HB1 ALA A 89 13.583 -9.878 2.367 1.00 0.00 H new ATOM 0 HB2 ALA A 89 13.215 -9.842 4.107 1.00 0.00 H new ATOM 0 HB3 ALA A 89 13.485 -8.321 3.223 1.00 0.00 H new ATOM 1279 N SER A 90 17.203 -9.443 2.072 1.00 0.00 N ATOM 1280 CA SER A 90 18.078 -8.851 1.059 1.00 0.00 C ATOM 1281 C SER A 90 17.395 -8.929 -0.295 1.00 0.00 C ATOM 1282 O SER A 90 16.623 -9.851 -0.524 1.00 0.00 O ATOM 1283 CB SER A 90 19.404 -9.605 0.994 1.00 0.00 C ATOM 1284 OG SER A 90 20.470 -8.790 1.435 1.00 0.00 O ATOM 0 H SER A 90 17.465 -10.385 2.361 1.00 0.00 H new ATOM 0 HA SER A 90 18.274 -7.812 1.324 1.00 0.00 H new ATOM 0 HB2 SER A 90 19.347 -10.502 1.611 1.00 0.00 H new ATOM 0 HB3 SER A 90 19.591 -9.933 -0.029 1.00 0.00 H new ATOM 0 HG SER A 90 21.309 -9.294 1.386 1.00 0.00 H new ATOM 1290 N GLY A 91 17.751 -8.030 -1.216 1.00 0.00 N ATOM 1291 CA GLY A 91 17.279 -7.931 -2.594 1.00 0.00 C ATOM 1292 C GLY A 91 15.788 -8.120 -2.787 1.00 0.00 C ATOM 1293 O GLY A 91 15.344 -8.622 -3.820 1.00 0.00 O ATOM 0 H GLY A 91 18.428 -7.299 -0.999 1.00 0.00 H new ATOM 0 HA2 GLY A 91 17.557 -6.953 -2.986 1.00 0.00 H new ATOM 0 HA3 GLY A 91 17.803 -8.675 -3.194 1.00 0.00 H new ATOM 1297 N LEU A 92 15.046 -7.710 -1.773 1.00 0.00 N ATOM 1298 CA LEU A 92 13.614 -7.911 -1.621 1.00 0.00 C ATOM 1299 C LEU A 92 12.937 -6.565 -1.370 1.00 0.00 C ATOM 1300 O LEU A 92 12.730 -6.175 -0.228 1.00 0.00 O ATOM 1301 CB LEU A 92 13.326 -8.954 -0.520 1.00 0.00 C ATOM 1302 CG LEU A 92 13.646 -10.408 -0.947 1.00 0.00 C ATOM 1303 CD1 LEU A 92 13.817 -11.365 0.237 1.00 0.00 C ATOM 1304 CD2 LEU A 92 12.556 -10.998 -1.823 1.00 0.00 C ATOM 0 H LEU A 92 15.449 -7.198 -0.988 1.00 0.00 H new ATOM 0 HA LEU A 92 13.192 -8.319 -2.539 1.00 0.00 H new ATOM 0 HB2 LEU A 92 13.911 -8.707 0.366 1.00 0.00 H new ATOM 0 HB3 LEU A 92 12.276 -8.890 -0.236 1.00 0.00 H new ATOM 0 HG LEU A 92 14.586 -10.322 -1.492 1.00 0.00 H new ATOM 0 HD11 LEU A 92 14.039 -12.366 -0.133 1.00 0.00 H new ATOM 0 HD12 LEU A 92 14.637 -11.021 0.867 1.00 0.00 H new ATOM 0 HD13 LEU A 92 12.897 -11.390 0.820 1.00 0.00 H new ATOM 0 HD21 LEU A 92 12.823 -12.018 -2.098 1.00 0.00 H new ATOM 0 HD22 LEU A 92 11.613 -11.005 -1.276 1.00 0.00 H new ATOM 0 HD23 LEU A 92 12.448 -10.395 -2.725 1.00 0.00 H new ATOM 1316 N GLY A 93 12.638 -5.811 -2.429 1.00 0.00 N ATOM 1317 CA GLY A 93 11.982 -4.517 -2.288 1.00 0.00 C ATOM 1318 C GLY A 93 10.537 -4.687 -1.817 1.00 0.00 C ATOM 1319 O GLY A 93 9.858 -5.641 -2.194 1.00 0.00 O ATOM 0 H GLY A 93 12.841 -6.077 -3.392 1.00 0.00 H new ATOM 0 HA2 GLY A 93 12.531 -3.902 -1.575 1.00 0.00 H new ATOM 0 HA3 GLY A 93 11.998 -3.990 -3.242 1.00 0.00 H new ATOM 1323 N ILE A 94 10.039 -3.743 -1.026 1.00 0.00 N ATOM 1324 CA ILE A 94 8.640 -3.651 -0.627 1.00 0.00 C ATOM 1325 C ILE A 94 7.849 -3.186 -1.864 1.00 0.00 C ATOM 1326 O ILE A 94 8.308 -2.283 -2.569 1.00 0.00 O ATOM 1327 CB ILE A 94 8.525 -2.628 0.524 1.00 0.00 C ATOM 1328 CG1 ILE A 94 9.548 -2.737 1.676 1.00 0.00 C ATOM 1329 CG2 ILE A 94 7.097 -2.544 1.076 1.00 0.00 C ATOM 1330 CD1 ILE A 94 9.285 -3.844 2.686 1.00 0.00 C ATOM 0 H ILE A 94 10.615 -2.999 -0.633 1.00 0.00 H new ATOM 0 HA ILE A 94 8.247 -4.605 -0.276 1.00 0.00 H new ATOM 0 HB ILE A 94 8.793 -1.695 0.028 1.00 0.00 H new ATOM 0 HG12 ILE A 94 10.538 -2.890 1.246 1.00 0.00 H new ATOM 0 HG13 ILE A 94 9.574 -1.785 2.206 1.00 0.00 H new ATOM 0 HG21 ILE A 94 7.062 -1.813 1.884 1.00 0.00 H new ATOM 0 HG22 ILE A 94 6.417 -2.239 0.281 1.00 0.00 H new ATOM 0 HG23 ILE A 94 6.796 -3.520 1.457 1.00 0.00 H new ATOM 0 HD11 ILE A 94 10.062 -3.831 3.451 1.00 0.00 H new ATOM 0 HD12 ILE A 94 8.313 -3.687 3.154 1.00 0.00 H new ATOM 0 HD13 ILE A 94 9.292 -4.809 2.179 1.00 0.00 H new ATOM 1342 N GLN A 95 6.669 -3.763 -2.115 1.00 0.00 N ATOM 1343 CA GLN A 95 5.826 -3.519 -3.290 1.00 0.00 C ATOM 1344 C GLN A 95 4.441 -3.081 -2.789 1.00 0.00 C ATOM 1345 O GLN A 95 3.796 -3.843 -2.061 1.00 0.00 O ATOM 1346 CB GLN A 95 5.779 -4.810 -4.141 1.00 0.00 C ATOM 1347 CG GLN A 95 4.745 -4.772 -5.275 1.00 0.00 C ATOM 1348 CD GLN A 95 4.562 -6.138 -5.936 1.00 0.00 C ATOM 1349 OE1 GLN A 95 4.238 -7.115 -5.267 1.00 0.00 O ATOM 1350 NE2 GLN A 95 4.769 -6.248 -7.240 1.00 0.00 N ATOM 0 H GLN A 95 6.257 -4.443 -1.476 1.00 0.00 H new ATOM 0 HA GLN A 95 6.220 -2.728 -3.928 1.00 0.00 H new ATOM 0 HB2 GLN A 95 6.766 -4.987 -4.569 1.00 0.00 H new ATOM 0 HB3 GLN A 95 5.557 -5.655 -3.489 1.00 0.00 H new ATOM 0 HG2 GLN A 95 3.788 -4.430 -4.880 1.00 0.00 H new ATOM 0 HG3 GLN A 95 5.058 -4.046 -6.026 1.00 0.00 H new ATOM 0 HE21 GLN A 95 5.038 -5.429 -7.785 1.00 0.00 H new ATOM 0 HE22 GLN A 95 4.659 -7.152 -7.699 1.00 0.00 H new ATOM 1359 N LEU A 96 4.011 -1.855 -3.121 1.00 0.00 N ATOM 1360 CA LEU A 96 2.819 -1.206 -2.556 1.00 0.00 C ATOM 1361 C LEU A 96 1.848 -0.852 -3.679 1.00 0.00 C ATOM 1362 O LEU A 96 1.733 0.313 -4.057 1.00 0.00 O ATOM 1363 CB LEU A 96 3.161 0.065 -1.739 1.00 0.00 C ATOM 1364 CG LEU A 96 4.073 -0.076 -0.503 1.00 0.00 C ATOM 1365 CD1 LEU A 96 3.882 -1.372 0.253 1.00 0.00 C ATOM 1366 CD2 LEU A 96 5.531 0.158 -0.889 1.00 0.00 C ATOM 0 H LEU A 96 4.494 -1.274 -3.806 1.00 0.00 H new ATOM 0 HA LEU A 96 2.360 -1.916 -1.868 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.630 0.778 -2.417 1.00 0.00 H new ATOM 0 HB3 LEU A 96 2.222 0.509 -1.409 1.00 0.00 H new ATOM 0 HG LEU A 96 3.771 0.700 0.200 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.558 -1.397 1.108 1.00 0.00 H new ATOM 0 HD12 LEU A 96 2.852 -1.441 0.602 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.099 -2.213 -0.406 1.00 0.00 H new ATOM 0 HD21 LEU A 96 6.162 0.055 -0.006 1.00 0.00 H new ATOM 0 HD22 LEU A 96 5.831 -0.575 -1.637 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.642 1.162 -1.299 1.00 0.00 H new ATOM 1378 N LEU A 97 1.141 -1.838 -4.220 1.00 0.00 N ATOM 1379 CA LEU A 97 0.350 -1.663 -5.433 1.00 0.00 C ATOM 1380 C LEU A 97 -0.970 -0.972 -5.084 1.00 0.00 C ATOM 1381 O LEU A 97 -1.520 -1.157 -3.999 1.00 0.00 O ATOM 1382 CB LEU A 97 0.056 -3.013 -6.124 1.00 0.00 C ATOM 1383 CG LEU A 97 1.235 -4.014 -6.146 1.00 0.00 C ATOM 1384 CD1 LEU A 97 0.938 -5.180 -5.201 1.00 0.00 C ATOM 1385 CD2 LEU A 97 1.549 -4.611 -7.514 1.00 0.00 C ATOM 0 H LEU A 97 1.100 -2.780 -3.831 1.00 0.00 H new ATOM 0 HA LEU A 97 0.927 -1.050 -6.125 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.789 -3.483 -5.621 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.252 -2.817 -7.151 1.00 0.00 H new ATOM 0 HG LEU A 97 2.102 -3.429 -5.840 1.00 0.00 H new ATOM 0 HD11 LEU A 97 1.770 -5.884 -5.219 1.00 0.00 H new ATOM 0 HD12 LEU A 97 0.804 -4.802 -4.188 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.028 -5.686 -5.523 1.00 0.00 H new ATOM 0 HD21 LEU A 97 2.389 -5.299 -7.426 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.677 -5.149 -7.885 1.00 0.00 H new ATOM 0 HD23 LEU A 97 1.806 -3.812 -8.209 1.00 0.00 H new ATOM 1397 N ASN A 98 -1.520 -0.232 -6.041 1.00 0.00 N ATOM 1398 CA ASN A 98 -2.916 0.216 -6.037 1.00 0.00 C ATOM 1399 C ASN A 98 -3.825 -0.918 -6.506 1.00 0.00 C ATOM 1400 O ASN A 98 -3.315 -1.959 -6.924 1.00 0.00 O ATOM 1401 CB ASN A 98 -3.107 1.467 -6.918 1.00 0.00 C ATOM 1402 CG ASN A 98 -2.525 1.397 -8.318 1.00 0.00 C ATOM 1403 OD1 ASN A 98 -2.197 2.421 -8.908 1.00 0.00 O ATOM 1404 ND2 ASN A 98 -2.406 0.221 -8.903 1.00 0.00 N ATOM 0 H ASN A 98 -1.000 0.082 -6.860 1.00 0.00 H new ATOM 0 HA ASN A 98 -3.186 0.490 -5.017 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -4.175 1.668 -7.001 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -2.662 2.319 -6.404 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -2.039 0.159 -9.853 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -2.681 -0.626 -8.406 1.00 0.00 H new ATOM 1411 N GLU A 99 -5.145 -0.692 -6.549 1.00 0.00 N ATOM 1412 CA GLU A 99 -6.154 -1.688 -6.939 1.00 0.00 C ATOM 1413 C GLU A 99 -5.812 -2.423 -8.238 1.00 0.00 C ATOM 1414 O GLU A 99 -6.056 -3.622 -8.346 1.00 0.00 O ATOM 1415 CB GLU A 99 -7.565 -1.074 -7.047 1.00 0.00 C ATOM 1416 CG GLU A 99 -7.638 0.188 -7.916 1.00 0.00 C ATOM 1417 CD GLU A 99 -9.077 0.601 -8.211 1.00 0.00 C ATOM 1418 OE1 GLU A 99 -9.643 0.140 -9.221 1.00 0.00 O ATOM 1419 OE2 GLU A 99 -9.653 1.431 -7.466 1.00 0.00 O ATOM 0 H GLU A 99 -5.552 0.212 -6.307 1.00 0.00 H new ATOM 0 HA GLU A 99 -6.148 -2.422 -6.133 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -8.244 -1.822 -7.455 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -7.921 -0.833 -6.046 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -7.123 1.005 -7.411 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -7.112 0.012 -8.855 1.00 0.00 H new ATOM 1426 N GLN A 100 -5.191 -1.730 -9.196 1.00 0.00 N ATOM 1427 CA GLN A 100 -4.819 -2.257 -10.505 1.00 0.00 C ATOM 1428 C GLN A 100 -3.652 -3.249 -10.448 1.00 0.00 C ATOM 1429 O GLN A 100 -3.205 -3.710 -11.494 1.00 0.00 O ATOM 1430 CB GLN A 100 -4.506 -1.090 -11.460 1.00 0.00 C ATOM 1431 CG GLN A 100 -5.720 -0.177 -11.647 1.00 0.00 C ATOM 1432 CD GLN A 100 -5.539 0.970 -12.651 1.00 0.00 C ATOM 1433 OE1 GLN A 100 -6.506 1.438 -13.247 1.00 0.00 O ATOM 1434 NE2 GLN A 100 -4.349 1.514 -12.840 1.00 0.00 N ATOM 0 H GLN A 100 -4.926 -0.753 -9.074 1.00 0.00 H new ATOM 0 HA GLN A 100 -5.671 -2.823 -10.882 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -3.671 -0.511 -11.067 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -4.193 -1.484 -12.427 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -6.565 -0.787 -11.968 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -5.984 0.249 -10.679 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -3.534 1.140 -12.354 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -4.246 2.308 -13.472 1.00 0.00 H new ATOM 1443 N GLN A 101 -3.165 -3.586 -9.250 1.00 0.00 N ATOM 1444 CA GLN A 101 -2.121 -4.571 -8.987 1.00 0.00 C ATOM 1445 C GLN A 101 -0.861 -4.255 -9.802 1.00 0.00 C ATOM 1446 O GLN A 101 -0.207 -5.139 -10.359 1.00 0.00 O ATOM 1447 CB GLN A 101 -2.640 -6.009 -9.167 1.00 0.00 C ATOM 1448 CG GLN A 101 -4.136 -6.204 -8.851 1.00 0.00 C ATOM 1449 CD GLN A 101 -4.542 -7.673 -8.930 1.00 0.00 C ATOM 1450 OE1 GLN A 101 -5.378 -8.076 -9.737 1.00 0.00 O ATOM 1451 NE2 GLN A 101 -3.983 -8.514 -8.078 1.00 0.00 N ATOM 0 H GLN A 101 -3.510 -3.153 -8.393 1.00 0.00 H new ATOM 0 HA GLN A 101 -1.829 -4.504 -7.939 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -2.458 -6.319 -10.196 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -2.059 -6.672 -8.526 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -4.350 -5.820 -7.854 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -4.735 -5.623 -9.552 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -3.290 -8.177 -7.410 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -4.245 -9.500 -8.089 1.00 0.00 H new ATOM 1460 N ASN A 102 -0.554 -2.960 -9.860 1.00 0.00 N ATOM 1461 CA ASN A 102 0.423 -2.326 -10.729 1.00 0.00 C ATOM 1462 C ASN A 102 1.550 -1.813 -9.836 1.00 0.00 C ATOM 1463 O ASN A 102 1.261 -1.292 -8.753 1.00 0.00 O ATOM 1464 CB ASN A 102 -0.285 -1.180 -11.473 1.00 0.00 C ATOM 1465 CG ASN A 102 -0.121 -1.257 -12.983 1.00 0.00 C ATOM 1466 OD1 ASN A 102 0.987 -1.381 -13.495 1.00 0.00 O ATOM 1467 ND2 ASN A 102 -1.216 -1.217 -13.721 1.00 0.00 N ATOM 0 H ASN A 102 -1.018 -2.282 -9.255 1.00 0.00 H new ATOM 0 HA ASN A 102 0.840 -3.008 -11.470 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -1.347 -1.197 -11.228 1.00 0.00 H new ATOM 0 HB3 ASN A 102 0.109 -0.227 -11.119 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -1.150 -1.290 -14.736 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -2.128 -1.113 -13.276 1.00 0.00 H new ATOM 1474 N GLN A 103 2.816 -2.028 -10.212 1.00 0.00 N ATOM 1475 CA GLN A 103 3.975 -1.642 -9.404 1.00 0.00 C ATOM 1476 C GLN A 103 3.984 -0.120 -9.259 1.00 0.00 C ATOM 1477 O GLN A 103 4.273 0.574 -10.228 1.00 0.00 O ATOM 1478 CB GLN A 103 5.274 -2.162 -10.059 1.00 0.00 C ATOM 1479 CG GLN A 103 6.571 -1.743 -9.347 1.00 0.00 C ATOM 1480 CD GLN A 103 7.820 -2.176 -10.124 1.00 0.00 C ATOM 1481 OE1 GLN A 103 8.181 -1.610 -11.150 1.00 0.00 O ATOM 1482 NE2 GLN A 103 8.565 -3.165 -9.647 1.00 0.00 N ATOM 0 H GLN A 103 3.065 -2.478 -11.093 1.00 0.00 H new ATOM 0 HA GLN A 103 3.913 -2.088 -8.411 1.00 0.00 H new ATOM 0 HB2 GLN A 103 5.233 -3.251 -10.098 1.00 0.00 H new ATOM 0 HB3 GLN A 103 5.311 -1.807 -11.089 1.00 0.00 H new ATOM 0 HG2 GLN A 103 6.581 -0.661 -9.219 1.00 0.00 H new ATOM 0 HG3 GLN A 103 6.595 -2.182 -8.349 1.00 0.00 H new ATOM 0 HE21 GLN A 103 8.284 -3.650 -8.795 1.00 0.00 H new ATOM 0 HE22 GLN A 103 9.419 -3.440 -10.132 1.00 0.00 H new ATOM 1491 N ILE A 104 3.679 0.389 -8.063 1.00 0.00 N ATOM 1492 CA ILE A 104 3.712 1.814 -7.757 1.00 0.00 C ATOM 1493 C ILE A 104 5.171 2.203 -7.471 1.00 0.00 C ATOM 1494 O ILE A 104 5.725 1.725 -6.477 1.00 0.00 O ATOM 1495 CB ILE A 104 2.702 2.125 -6.615 1.00 0.00 C ATOM 1496 CG1 ILE A 104 1.548 3.015 -7.123 1.00 0.00 C ATOM 1497 CG2 ILE A 104 3.271 2.766 -5.327 1.00 0.00 C ATOM 1498 CD1 ILE A 104 0.202 2.587 -6.554 1.00 0.00 C ATOM 0 H ILE A 104 3.398 -0.189 -7.271 1.00 0.00 H new ATOM 0 HA ILE A 104 3.385 2.432 -8.593 1.00 0.00 H new ATOM 0 HB ILE A 104 2.364 1.130 -6.325 1.00 0.00 H new ATOM 0 HG12 ILE A 104 1.743 4.052 -6.850 1.00 0.00 H new ATOM 0 HG13 ILE A 104 1.511 2.973 -8.212 1.00 0.00 H new ATOM 0 HG21 ILE A 104 2.463 2.930 -4.614 1.00 0.00 H new ATOM 0 HG22 ILE A 104 4.014 2.100 -4.887 1.00 0.00 H new ATOM 0 HG23 ILE A 104 3.738 3.720 -5.571 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -0.580 3.241 -6.939 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -0.007 1.559 -6.849 1.00 0.00 H new ATOM 0 HD13 ILE A 104 0.229 2.654 -5.466 1.00 0.00 H new ATOM 1510 N PRO A 105 5.825 3.013 -8.318 1.00 0.00 N ATOM 1511 CA PRO A 105 7.136 3.555 -8.006 1.00 0.00 C ATOM 1512 C PRO A 105 7.080 4.602 -6.889 1.00 0.00 C ATOM 1513 O PRO A 105 6.064 5.270 -6.671 1.00 0.00 O ATOM 1514 CB PRO A 105 7.654 4.141 -9.322 1.00 0.00 C ATOM 1515 CG PRO A 105 6.374 4.500 -10.068 1.00 0.00 C ATOM 1516 CD PRO A 105 5.419 3.400 -9.659 1.00 0.00 C ATOM 0 HA PRO A 105 7.804 2.784 -7.622 1.00 0.00 H new ATOM 0 HB2 PRO A 105 8.282 5.016 -9.154 1.00 0.00 H new ATOM 0 HB3 PRO A 105 8.255 3.419 -9.876 1.00 0.00 H new ATOM 0 HG2 PRO A 105 6.003 5.484 -9.781 1.00 0.00 H new ATOM 0 HG3 PRO A 105 6.528 4.520 -11.147 1.00 0.00 H new ATOM 0 HD2 PRO A 105 4.387 3.751 -9.671 1.00 0.00 H new ATOM 0 HD3 PRO A 105 5.476 2.555 -10.346 1.00 0.00 H new ATOM 1524 N LEU A 106 8.208 4.773 -6.200 1.00 0.00 N ATOM 1525 CA LEU A 106 8.445 5.863 -5.264 1.00 0.00 C ATOM 1526 C LEU A 106 8.909 7.097 -6.029 1.00 0.00 C ATOM 1527 O LEU A 106 9.485 6.991 -7.109 1.00 0.00 O ATOM 1528 CB LEU A 106 9.507 5.429 -4.235 1.00 0.00 C ATOM 1529 CG LEU A 106 8.934 5.214 -2.826 1.00 0.00 C ATOM 1530 CD1 LEU A 106 7.890 4.092 -2.775 1.00 0.00 C ATOM 1531 CD2 LEU A 106 10.086 4.910 -1.868 1.00 0.00 C ATOM 0 H LEU A 106 9.002 4.138 -6.282 1.00 0.00 H new ATOM 0 HA LEU A 106 7.524 6.108 -4.735 1.00 0.00 H new ATOM 0 HB2 LEU A 106 9.976 4.505 -4.574 1.00 0.00 H new ATOM 0 HB3 LEU A 106 10.290 6.186 -4.190 1.00 0.00 H new ATOM 0 HG LEU A 106 8.419 6.127 -2.529 1.00 0.00 H new ATOM 0 HD11 LEU A 106 7.520 3.985 -1.755 1.00 0.00 H new ATOM 0 HD12 LEU A 106 7.060 4.337 -3.438 1.00 0.00 H new ATOM 0 HD13 LEU A 106 8.346 3.155 -3.095 1.00 0.00 H new ATOM 0 HD21 LEU A 106 9.693 4.755 -0.863 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.605 4.010 -2.197 1.00 0.00 H new ATOM 0 HD23 LEU A 106 10.783 5.748 -1.860 1.00 0.00 H new ATOM 1543 N ASN A 107 8.708 8.262 -5.404 1.00 0.00 N ATOM 1544 CA ASN A 107 9.151 9.578 -5.866 1.00 0.00 C ATOM 1545 C ASN A 107 8.813 9.847 -7.341 1.00 0.00 C ATOM 1546 O ASN A 107 9.556 10.559 -8.024 1.00 0.00 O ATOM 1547 CB ASN A 107 10.632 9.874 -5.495 1.00 0.00 C ATOM 1548 CG ASN A 107 11.324 8.904 -4.541 1.00 0.00 C ATOM 1549 OD1 ASN A 107 11.928 7.943 -4.983 1.00 0.00 O ATOM 1550 ND2 ASN A 107 11.340 9.116 -3.236 1.00 0.00 N ATOM 0 H ASN A 107 8.206 8.313 -4.517 1.00 0.00 H new ATOM 0 HA ASN A 107 8.563 10.309 -5.311 1.00 0.00 H new ATOM 0 HB2 ASN A 107 11.210 9.909 -6.418 1.00 0.00 H new ATOM 0 HB3 ASN A 107 10.676 10.870 -5.054 1.00 0.00 H new ATOM 0 HD21 ASN A 107 11.851 8.481 -2.622 1.00 0.00 H new ATOM 0 HD22 ASN A 107 10.841 9.914 -2.843 1.00 0.00 H new ATOM 1557 N ALA A 108 7.668 9.350 -7.809 1.00 0.00 N ATOM 1558 CA ALA A 108 7.270 9.277 -9.209 1.00 0.00 C ATOM 1559 C ALA A 108 6.034 10.143 -9.490 1.00 0.00 C ATOM 1560 O ALA A 108 5.363 10.555 -8.536 1.00 0.00 O ATOM 1561 CB ALA A 108 6.961 7.808 -9.476 1.00 0.00 C ATOM 0 H ALA A 108 6.957 8.968 -7.185 1.00 0.00 H new ATOM 0 HA ALA A 108 8.061 9.653 -9.858 1.00 0.00 H new ATOM 0 HB1 ALA A 108 6.654 7.684 -10.515 1.00 0.00 H new ATOM 0 HB2 ALA A 108 7.851 7.209 -9.286 1.00 0.00 H new ATOM 0 HB3 ALA A 108 6.156 7.480 -8.818 1.00 0.00 H new ATOM 1567 N PRO A 109 5.696 10.422 -10.767 1.00 0.00 N ATOM 1568 CA PRO A 109 4.495 11.166 -11.140 1.00 0.00 C ATOM 1569 C PRO A 109 3.277 10.235 -11.255 1.00 0.00 C ATOM 1570 O PRO A 109 3.418 9.029 -11.467 1.00 0.00 O ATOM 1571 CB PRO A 109 4.843 11.783 -12.493 1.00 0.00 C ATOM 1572 CG PRO A 109 5.707 10.709 -13.147 1.00 0.00 C ATOM 1573 CD PRO A 109 6.441 10.062 -11.971 1.00 0.00 C ATOM 0 HA PRO A 109 4.224 11.915 -10.396 1.00 0.00 H new ATOM 0 HB2 PRO A 109 3.950 11.996 -13.081 1.00 0.00 H new ATOM 0 HB3 PRO A 109 5.383 12.723 -12.381 1.00 0.00 H new ATOM 0 HG2 PRO A 109 5.100 9.983 -13.688 1.00 0.00 H new ATOM 0 HG3 PRO A 109 6.405 11.140 -13.865 1.00 0.00 H new ATOM 0 HD2 PRO A 109 6.486 8.979 -12.090 1.00 0.00 H new ATOM 0 HD3 PRO A 109 7.469 10.419 -11.912 1.00 0.00 H new ATOM 1581 N SER A 110 2.063 10.789 -11.164 1.00 0.00 N ATOM 1582 CA SER A 110 0.866 9.966 -11.007 1.00 0.00 C ATOM 1583 C SER A 110 0.415 9.221 -12.267 1.00 0.00 C ATOM 1584 O SER A 110 -0.418 8.324 -12.141 1.00 0.00 O ATOM 1585 CB SER A 110 -0.268 10.757 -10.363 1.00 0.00 C ATOM 1586 OG SER A 110 0.068 11.029 -9.010 1.00 0.00 O ATOM 0 H SER A 110 1.887 11.793 -11.196 1.00 0.00 H new ATOM 0 HA SER A 110 1.159 9.167 -10.326 1.00 0.00 H new ATOM 0 HB2 SER A 110 -0.432 11.689 -10.905 1.00 0.00 H new ATOM 0 HB3 SER A 110 -1.198 10.191 -10.413 1.00 0.00 H new ATOM 0 HG SER A 110 0.550 11.880 -8.958 1.00 0.00 H new ATOM 1592 N SER A 111 1.016 9.487 -13.432 1.00 0.00 N ATOM 1593 CA SER A 111 0.851 8.649 -14.619 1.00 0.00 C ATOM 1594 C SER A 111 1.187 7.181 -14.320 1.00 0.00 C ATOM 1595 O SER A 111 0.622 6.289 -14.952 1.00 0.00 O ATOM 1596 CB SER A 111 1.750 9.182 -15.746 1.00 0.00 C ATOM 1597 OG SER A 111 0.993 9.577 -16.871 1.00 0.00 O ATOM 0 H SER A 111 1.629 10.289 -13.576 1.00 0.00 H new ATOM 0 HA SER A 111 -0.193 8.690 -14.930 1.00 0.00 H new ATOM 0 HB2 SER A 111 2.329 10.030 -15.380 1.00 0.00 H new ATOM 0 HB3 SER A 111 2.463 8.411 -16.039 1.00 0.00 H new ATOM 0 HG SER A 111 1.594 9.912 -17.568 1.00 0.00 H new ATOM 1603 N ALA A 112 2.082 6.934 -13.357 1.00 0.00 N ATOM 1604 CA ALA A 112 2.538 5.616 -12.948 1.00 0.00 C ATOM 1605 C ALA A 112 1.556 4.871 -12.028 1.00 0.00 C ATOM 1606 O ALA A 112 1.891 3.794 -11.535 1.00 0.00 O ATOM 1607 CB ALA A 112 3.863 5.815 -12.204 1.00 0.00 C ATOM 0 H ALA A 112 2.522 7.684 -12.824 1.00 0.00 H new ATOM 0 HA ALA A 112 2.636 5.000 -13.842 1.00 0.00 H new ATOM 0 HB1 ALA A 112 4.245 4.848 -11.876 1.00 0.00 H new ATOM 0 HB2 ALA A 112 4.587 6.285 -12.870 1.00 0.00 H new ATOM 0 HB3 ALA A 112 3.700 6.454 -11.336 1.00 0.00 H new ATOM 1613 N LEU A 113 0.416 5.473 -11.676 1.00 0.00 N ATOM 1614 CA LEU A 113 -0.421 5.054 -10.555 1.00 0.00 C ATOM 1615 C LEU A 113 -1.902 5.235 -10.932 1.00 0.00 C ATOM 1616 O LEU A 113 -2.245 5.443 -12.098 1.00 0.00 O ATOM 1617 CB LEU A 113 -0.048 5.793 -9.236 1.00 0.00 C ATOM 1618 CG LEU A 113 1.204 6.691 -9.158 1.00 0.00 C ATOM 1619 CD1 LEU A 113 0.979 7.752 -8.074 1.00 0.00 C ATOM 1620 CD2 LEU A 113 2.505 5.963 -8.812 1.00 0.00 C ATOM 0 H LEU A 113 0.044 6.282 -12.175 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.241 3.998 -10.356 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -0.903 6.412 -8.963 1.00 0.00 H new ATOM 0 HB3 LEU A 113 0.055 5.033 -8.462 1.00 0.00 H new ATOM 0 HG LEU A 113 1.327 7.106 -10.158 1.00 0.00 H new ATOM 0 HD11 LEU A 113 1.856 8.395 -8.007 1.00 0.00 H new ATOM 0 HD12 LEU A 113 0.107 8.354 -8.329 1.00 0.00 H new ATOM 0 HD13 LEU A 113 0.814 7.262 -7.114 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.326 6.680 -8.781 1.00 0.00 H new ATOM 0 HD22 LEU A 113 2.406 5.483 -7.838 1.00 0.00 H new ATOM 0 HD23 LEU A 113 2.712 5.207 -9.570 1.00 0.00 H new ATOM 1632 N SER A 114 -2.811 5.141 -9.959 1.00 0.00 N ATOM 1633 CA SER A 114 -4.212 5.503 -10.114 1.00 0.00 C ATOM 1634 C SER A 114 -4.711 6.250 -8.874 1.00 0.00 C ATOM 1635 O SER A 114 -3.948 6.474 -7.936 1.00 0.00 O ATOM 1636 CB SER A 114 -5.018 4.245 -10.486 1.00 0.00 C ATOM 1637 OG SER A 114 -4.746 3.137 -9.648 1.00 0.00 O ATOM 0 H SER A 114 -2.584 4.803 -9.024 1.00 0.00 H new ATOM 0 HA SER A 114 -4.350 6.206 -10.935 1.00 0.00 H new ATOM 0 HB2 SER A 114 -6.082 4.476 -10.437 1.00 0.00 H new ATOM 0 HB3 SER A 114 -4.798 3.973 -11.518 1.00 0.00 H new ATOM 0 HG SER A 114 -3.778 3.050 -9.525 1.00 0.00 H new ATOM 1643 N TRP A 115 -5.963 6.706 -8.898 1.00 0.00 N ATOM 1644 CA TRP A 115 -6.755 6.993 -7.712 1.00 0.00 C ATOM 1645 C TRP A 115 -8.222 6.800 -8.076 1.00 0.00 C ATOM 1646 O TRP A 115 -8.558 6.614 -9.250 1.00 0.00 O ATOM 1647 CB TRP A 115 -6.518 8.403 -7.167 1.00 0.00 C ATOM 1648 CG TRP A 115 -6.855 8.538 -5.716 1.00 0.00 C ATOM 1649 CD1 TRP A 115 -7.918 9.186 -5.193 1.00 0.00 C ATOM 1650 CD2 TRP A 115 -6.135 7.974 -4.582 1.00 0.00 C ATOM 1651 NE1 TRP A 115 -7.854 9.125 -3.815 1.00 0.00 N ATOM 1652 CE2 TRP A 115 -6.756 8.416 -3.381 1.00 0.00 C ATOM 1653 CE3 TRP A 115 -5.021 7.126 -4.447 1.00 0.00 C ATOM 1654 CZ2 TRP A 115 -6.247 8.105 -2.111 1.00 0.00 C ATOM 1655 CZ3 TRP A 115 -4.506 6.805 -3.180 1.00 0.00 C ATOM 1656 CH2 TRP A 115 -5.097 7.303 -2.014 1.00 0.00 C ATOM 0 H TRP A 115 -6.464 6.889 -9.768 1.00 0.00 H new ATOM 0 HA TRP A 115 -6.455 6.312 -6.916 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -5.473 8.673 -7.317 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -7.116 9.112 -7.740 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -8.695 9.675 -5.762 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -8.539 9.554 -3.192 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -4.555 6.716 -5.330 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 -6.732 8.477 -1.221 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -3.640 6.164 -3.105 1.00 0.00 H new ATOM 0 HH2 TRP A 115 -4.673 7.073 -1.048 1.00 0.00 H new ATOM 1667 N THR A 116 -9.104 6.891 -7.088 1.00 0.00 N ATOM 1668 CA THR A 116 -10.502 6.516 -7.221 1.00 0.00 C ATOM 1669 C THR A 116 -11.378 7.764 -7.183 1.00 0.00 C ATOM 1670 O THR A 116 -10.918 8.846 -6.798 1.00 0.00 O ATOM 1671 CB THR A 116 -10.833 5.464 -6.143 1.00 0.00 C ATOM 1672 OG1 THR A 116 -12.002 4.734 -6.446 1.00 0.00 O ATOM 1673 CG2 THR A 116 -11.001 6.072 -4.752 1.00 0.00 C ATOM 0 H THR A 116 -8.862 7.233 -6.158 1.00 0.00 H new ATOM 0 HA THR A 116 -10.706 6.050 -8.185 1.00 0.00 H new ATOM 0 HB THR A 116 -9.973 4.795 -6.139 1.00 0.00 H new ATOM 0 HG1 THR A 116 -12.171 4.079 -5.737 1.00 0.00 H new ATOM 0 HG21 THR A 116 -11.233 5.284 -4.036 1.00 0.00 H new ATOM 0 HG22 THR A 116 -10.076 6.569 -4.458 1.00 0.00 H new ATOM 0 HG23 THR A 116 -11.814 6.798 -4.768 1.00 0.00 H new ATOM 1681 N THR A 117 -12.651 7.589 -7.531 1.00 0.00 N ATOM 1682 CA THR A 117 -13.691 8.584 -7.341 1.00 0.00 C ATOM 1683 C THR A 117 -13.874 8.705 -5.819 1.00 0.00 C ATOM 1684 O THR A 117 -14.497 7.852 -5.178 1.00 0.00 O ATOM 1685 CB THR A 117 -14.960 8.142 -8.099 1.00 0.00 C ATOM 1686 OG1 THR A 117 -14.637 7.591 -9.371 1.00 0.00 O ATOM 1687 CG2 THR A 117 -15.952 9.281 -8.298 1.00 0.00 C ATOM 0 H THR A 117 -12.991 6.729 -7.963 1.00 0.00 H new ATOM 0 HA THR A 117 -13.444 9.566 -7.745 1.00 0.00 H new ATOM 0 HB THR A 117 -15.428 7.382 -7.473 1.00 0.00 H new ATOM 0 HG1 THR A 117 -15.460 7.318 -9.828 1.00 0.00 H new ATOM 0 HG21 THR A 117 -16.825 8.913 -8.837 1.00 0.00 H new ATOM 0 HG22 THR A 117 -16.261 9.668 -7.327 1.00 0.00 H new ATOM 0 HG23 THR A 117 -15.480 10.078 -8.873 1.00 0.00 H new ATOM 1695 N LEU A 118 -13.235 9.719 -5.235 1.00 0.00 N ATOM 1696 CA LEU A 118 -13.282 10.101 -3.836 1.00 0.00 C ATOM 1697 C LEU A 118 -14.735 10.425 -3.483 1.00 0.00 C ATOM 1698 O LEU A 118 -15.261 11.488 -3.826 1.00 0.00 O ATOM 1699 CB LEU A 118 -12.342 11.307 -3.594 1.00 0.00 C ATOM 1700 CG LEU A 118 -10.869 10.971 -3.318 1.00 0.00 C ATOM 1701 CD1 LEU A 118 -10.122 12.268 -3.017 1.00 0.00 C ATOM 1702 CD2 LEU A 118 -10.661 10.058 -2.108 1.00 0.00 C ATOM 0 H LEU A 118 -12.628 10.337 -5.774 1.00 0.00 H new ATOM 0 HA LEU A 118 -12.937 9.291 -3.193 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -12.388 11.958 -4.467 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -12.728 11.878 -2.750 1.00 0.00 H new ATOM 0 HG LEU A 118 -10.503 10.454 -4.205 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -9.073 12.046 -2.819 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -10.195 12.937 -3.874 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -10.563 12.748 -2.143 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -9.596 9.865 -1.976 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -11.055 10.542 -1.215 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -11.183 9.115 -2.270 1.00 0.00 H new ATOM 1714 N THR A 119 -15.394 9.462 -2.837 1.00 0.00 N ATOM 1715 CA THR A 119 -16.749 9.595 -2.325 1.00 0.00 C ATOM 1716 C THR A 119 -16.837 10.823 -1.414 1.00 0.00 C ATOM 1717 O THR A 119 -15.887 11.070 -0.671 1.00 0.00 O ATOM 1718 CB THR A 119 -17.132 8.303 -1.573 1.00 0.00 C ATOM 1719 OG1 THR A 119 -18.291 8.461 -0.781 1.00 0.00 O ATOM 1720 CG2 THR A 119 -16.046 7.678 -0.705 1.00 0.00 C ATOM 0 H THR A 119 -14.985 8.546 -2.653 1.00 0.00 H new ATOM 0 HA THR A 119 -17.452 9.738 -3.145 1.00 0.00 H new ATOM 0 HB THR A 119 -17.312 7.612 -2.397 1.00 0.00 H new ATOM 0 HG1 THR A 119 -18.494 7.617 -0.326 1.00 0.00 H new ATOM 0 HG21 THR A 119 -16.434 6.778 -0.229 1.00 0.00 H new ATOM 0 HG22 THR A 119 -15.188 7.419 -1.326 1.00 0.00 H new ATOM 0 HG23 THR A 119 -15.738 8.390 0.061 1.00 0.00 H new ATOM 1728 N PRO A 120 -17.951 11.569 -1.390 1.00 0.00 N ATOM 1729 CA PRO A 120 -18.056 12.752 -0.557 1.00 0.00 C ATOM 1730 C PRO A 120 -18.101 12.325 0.918 1.00 0.00 C ATOM 1731 O PRO A 120 -18.807 11.386 1.278 1.00 0.00 O ATOM 1732 CB PRO A 120 -19.296 13.487 -1.061 1.00 0.00 C ATOM 1733 CG PRO A 120 -20.184 12.380 -1.637 1.00 0.00 C ATOM 1734 CD PRO A 120 -19.187 11.329 -2.126 1.00 0.00 C ATOM 0 HA PRO A 120 -17.205 13.430 -0.619 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -19.798 14.020 -0.254 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -19.039 14.226 -1.820 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -20.856 11.973 -0.882 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -20.807 12.750 -2.451 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -19.561 10.322 -1.942 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -19.024 11.417 -3.200 1.00 0.00 H new ATOM 1742 N GLY A 121 -17.299 12.978 1.752 1.00 0.00 N ATOM 1743 CA GLY A 121 -17.238 12.854 3.199 1.00 0.00 C ATOM 1744 C GLY A 121 -17.191 11.429 3.760 1.00 0.00 C ATOM 1745 O GLY A 121 -17.896 11.168 4.737 1.00 0.00 O ATOM 0 H GLY A 121 -16.624 13.659 1.404 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -16.356 13.389 3.551 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -18.106 13.359 3.622 1.00 0.00 H new ATOM 1749 N LYS A 122 -16.384 10.523 3.189 1.00 0.00 N ATOM 1750 CA LYS A 122 -16.409 9.077 3.525 1.00 0.00 C ATOM 1751 C LYS A 122 -15.037 8.538 3.941 1.00 0.00 C ATOM 1752 O LYS A 122 -14.081 9.294 3.837 1.00 0.00 O ATOM 1753 CB LYS A 122 -16.988 8.302 2.332 1.00 0.00 C ATOM 1754 CG LYS A 122 -18.304 7.593 2.668 1.00 0.00 C ATOM 1755 CD LYS A 122 -19.458 8.584 2.641 1.00 0.00 C ATOM 1756 CE LYS A 122 -20.683 8.056 3.383 1.00 0.00 C ATOM 1757 NZ LYS A 122 -20.456 7.948 4.844 1.00 0.00 N ATOM 0 H LYS A 122 -15.692 10.764 2.480 1.00 0.00 H new ATOM 0 HA LYS A 122 -17.048 8.937 4.397 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -17.153 8.990 1.503 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -16.259 7.565 1.995 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -18.487 6.792 1.952 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -18.235 7.131 3.653 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -19.139 9.524 3.091 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -19.726 8.800 1.607 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -21.530 8.717 3.198 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -20.950 7.077 2.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -21.371 7.885 5.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -19.896 7.095 5.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -19.941 8.788 5.178 1.00 0.00 H new ATOM 1771 N PRO A 123 -14.866 7.270 4.374 1.00 0.00 N ATOM 1772 CA PRO A 123 -13.566 6.779 4.826 1.00 0.00 C ATOM 1773 C PRO A 123 -12.556 6.666 3.686 1.00 0.00 C ATOM 1774 O PRO A 123 -11.363 6.574 3.950 1.00 0.00 O ATOM 1775 CB PRO A 123 -13.810 5.414 5.477 1.00 0.00 C ATOM 1776 CG PRO A 123 -15.074 4.915 4.796 1.00 0.00 C ATOM 1777 CD PRO A 123 -15.842 6.195 4.473 1.00 0.00 C ATOM 0 HA PRO A 123 -13.131 7.485 5.534 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -12.972 4.736 5.314 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -13.943 5.502 6.555 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -14.845 4.347 3.894 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -15.648 4.258 5.449 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -16.392 6.088 3.538 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -16.574 6.411 5.251 1.00 0.00 H new ATOM 1785 N ASN A 124 -12.996 6.686 2.421 1.00 0.00 N ATOM 1786 CA ASN A 124 -12.133 6.534 1.248 1.00 0.00 C ATOM 1787 C ASN A 124 -11.169 5.357 1.399 1.00 0.00 C ATOM 1788 O ASN A 124 -9.947 5.479 1.293 1.00 0.00 O ATOM 1789 CB ASN A 124 -11.402 7.842 0.927 1.00 0.00 C ATOM 1790 CG ASN A 124 -12.366 8.940 0.530 1.00 0.00 C ATOM 1791 OD1 ASN A 124 -13.032 8.835 -0.497 1.00 0.00 O ATOM 1792 ND2 ASN A 124 -12.446 10.001 1.300 1.00 0.00 N ATOM 0 H ASN A 124 -13.980 6.811 2.183 1.00 0.00 H new ATOM 0 HA ASN A 124 -12.772 6.303 0.396 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -10.826 8.160 1.796 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -10.691 7.672 0.119 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -13.073 10.766 1.051 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -11.881 10.060 2.147 1.00 0.00 H new ATOM 1799 N THR A 125 -11.740 4.194 1.672 1.00 0.00 N ATOM 1800 CA THR A 125 -11.091 2.908 1.526 1.00 0.00 C ATOM 1801 C THR A 125 -10.785 2.660 0.045 1.00 0.00 C ATOM 1802 O THR A 125 -11.606 2.145 -0.718 1.00 0.00 O ATOM 1803 CB THR A 125 -11.987 1.826 2.163 1.00 0.00 C ATOM 1804 OG1 THR A 125 -12.250 2.189 3.507 1.00 0.00 O ATOM 1805 CG2 THR A 125 -11.369 0.430 2.116 1.00 0.00 C ATOM 0 H THR A 125 -12.699 4.121 2.012 1.00 0.00 H new ATOM 0 HA THR A 125 -10.135 2.879 2.048 1.00 0.00 H new ATOM 0 HB THR A 125 -12.908 1.776 1.582 1.00 0.00 H new ATOM 0 HG1 THR A 125 -12.821 1.510 3.924 1.00 0.00 H new ATOM 0 HG21 THR A 125 -12.049 -0.285 2.580 1.00 0.00 H new ATOM 0 HG22 THR A 125 -11.194 0.144 1.079 1.00 0.00 H new ATOM 0 HG23 THR A 125 -10.422 0.433 2.656 1.00 0.00 H new ATOM 1813 N LEU A 126 -9.559 3.011 -0.331 1.00 0.00 N ATOM 1814 CA LEU A 126 -8.916 2.655 -1.587 1.00 0.00 C ATOM 1815 C LEU A 126 -8.443 1.223 -1.411 1.00 0.00 C ATOM 1816 O LEU A 126 -7.818 0.932 -0.398 1.00 0.00 O ATOM 1817 CB LEU A 126 -7.657 3.520 -1.741 1.00 0.00 C ATOM 1818 CG LEU A 126 -7.840 4.906 -2.364 1.00 0.00 C ATOM 1819 CD1 LEU A 126 -7.871 4.803 -3.888 1.00 0.00 C ATOM 1820 CD2 LEU A 126 -9.021 5.735 -1.854 1.00 0.00 C ATOM 0 H LEU A 126 -8.958 3.581 0.264 1.00 0.00 H new ATOM 0 HA LEU A 126 -9.584 2.786 -2.438 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -7.211 3.648 -0.755 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.938 2.968 -2.347 1.00 0.00 H new ATOM 0 HG LEU A 126 -6.967 5.466 -2.030 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -8.002 5.796 -4.317 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -6.934 4.375 -4.243 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -8.700 4.164 -4.193 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -9.043 6.694 -2.371 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -9.951 5.199 -2.044 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -8.912 5.903 -0.783 1.00 0.00 H new ATOM 1832 N ASN A 127 -8.754 0.330 -2.350 1.00 0.00 N ATOM 1833 CA ASN A 127 -8.339 -1.063 -2.254 1.00 0.00 C ATOM 1834 C ASN A 127 -6.893 -1.118 -2.742 1.00 0.00 C ATOM 1835 O ASN A 127 -6.669 -1.250 -3.941 1.00 0.00 O ATOM 1836 CB ASN A 127 -9.280 -1.978 -3.065 1.00 0.00 C ATOM 1837 CG ASN A 127 -10.749 -1.747 -2.729 1.00 0.00 C ATOM 1838 OD1 ASN A 127 -11.257 -2.179 -1.698 1.00 0.00 O ATOM 1839 ND2 ASN A 127 -11.452 -0.983 -3.546 1.00 0.00 N ATOM 0 H ASN A 127 -9.294 0.551 -3.187 1.00 0.00 H new ATOM 0 HA ASN A 127 -8.398 -1.431 -1.230 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -9.122 -1.804 -4.129 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -9.025 -3.020 -2.871 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -12.419 -0.751 -3.321 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -11.027 -0.626 -4.402 1.00 0.00 H new ATOM 1846 N PHE A 128 -5.914 -0.897 -1.864 1.00 0.00 N ATOM 1847 CA PHE A 128 -4.487 -1.011 -2.189 1.00 0.00 C ATOM 1848 C PHE A 128 -3.988 -2.378 -1.733 1.00 0.00 C ATOM 1849 O PHE A 128 -4.710 -3.099 -1.045 1.00 0.00 O ATOM 1850 CB PHE A 128 -3.692 0.139 -1.535 1.00 0.00 C ATOM 1851 CG PHE A 128 -3.585 1.430 -2.332 1.00 0.00 C ATOM 1852 CD1 PHE A 128 -4.507 1.742 -3.346 1.00 0.00 C ATOM 1853 CD2 PHE A 128 -2.510 2.310 -2.099 1.00 0.00 C ATOM 1854 CE1 PHE A 128 -4.355 2.895 -4.126 1.00 0.00 C ATOM 1855 CE2 PHE A 128 -2.355 3.468 -2.883 1.00 0.00 C ATOM 1856 CZ PHE A 128 -3.262 3.745 -3.918 1.00 0.00 C ATOM 0 H PHE A 128 -6.089 -0.631 -0.895 1.00 0.00 H new ATOM 0 HA PHE A 128 -4.339 -0.927 -3.266 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -4.153 0.369 -0.574 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -2.683 -0.218 -1.328 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -5.344 1.084 -3.526 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -1.800 2.095 -1.314 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -5.082 3.129 -4.889 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -1.537 4.145 -2.688 1.00 0.00 H new ATOM 0 HZ PHE A 128 -3.118 4.609 -4.550 1.00 0.00 H new ATOM 1866 N TYR A 129 -2.747 -2.727 -2.073 1.00 0.00 N ATOM 1867 CA TYR A 129 -2.136 -3.998 -1.740 1.00 0.00 C ATOM 1868 C TYR A 129 -0.670 -3.790 -1.338 1.00 0.00 C ATOM 1869 O TYR A 129 0.158 -3.507 -2.200 1.00 0.00 O ATOM 1870 CB TYR A 129 -2.304 -4.984 -2.911 1.00 0.00 C ATOM 1871 CG TYR A 129 -3.734 -5.200 -3.385 1.00 0.00 C ATOM 1872 CD1 TYR A 129 -4.600 -5.974 -2.592 1.00 0.00 C ATOM 1873 CD2 TYR A 129 -4.200 -4.661 -4.606 1.00 0.00 C ATOM 1874 CE1 TYR A 129 -5.927 -6.204 -2.990 1.00 0.00 C ATOM 1875 CE2 TYR A 129 -5.513 -4.934 -5.031 1.00 0.00 C ATOM 1876 CZ TYR A 129 -6.387 -5.694 -4.223 1.00 0.00 C ATOM 1877 OH TYR A 129 -7.656 -5.948 -4.651 1.00 0.00 O ATOM 0 H TYR A 129 -2.129 -2.111 -2.602 1.00 0.00 H new ATOM 0 HA TYR A 129 -2.638 -4.439 -0.879 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -1.711 -4.626 -3.753 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -1.888 -5.947 -2.615 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -4.240 -6.397 -1.666 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -3.552 -4.043 -5.209 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -6.593 -6.769 -2.355 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -5.856 -4.559 -5.984 1.00 0.00 H new ATOM 0 HH TYR A 129 -7.801 -5.518 -5.520 1.00 0.00 H new ATOM 1887 N ALA A 130 -0.323 -3.898 -0.048 1.00 0.00 N ATOM 1888 CA ALA A 130 1.077 -3.846 0.398 1.00 0.00 C ATOM 1889 C ALA A 130 1.602 -5.264 0.563 1.00 0.00 C ATOM 1890 O ALA A 130 0.939 -6.090 1.193 1.00 0.00 O ATOM 1891 CB ALA A 130 1.228 -3.080 1.724 1.00 0.00 C ATOM 0 H ALA A 130 -0.996 -4.022 0.708 1.00 0.00 H new ATOM 0 HA ALA A 130 1.654 -3.313 -0.358 1.00 0.00 H new ATOM 0 HB1 ALA A 130 2.277 -3.065 2.018 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.872 -2.058 1.596 1.00 0.00 H new ATOM 0 HB3 ALA A 130 0.641 -3.574 2.498 1.00 0.00 H new ATOM 1897 N ARG A 131 2.796 -5.549 0.035 1.00 0.00 N ATOM 1898 CA ARG A 131 3.515 -6.797 0.280 1.00 0.00 C ATOM 1899 C ARG A 131 4.991 -6.629 -0.100 1.00 0.00 C ATOM 1900 O ARG A 131 5.528 -5.522 0.023 1.00 0.00 O ATOM 1901 CB ARG A 131 2.796 -7.960 -0.431 1.00 0.00 C ATOM 1902 CG ARG A 131 2.721 -9.235 0.427 1.00 0.00 C ATOM 1903 CD ARG A 131 1.795 -9.153 1.648 1.00 0.00 C ATOM 1904 NE ARG A 131 1.379 -10.489 2.068 1.00 0.00 N ATOM 1905 CZ ARG A 131 2.080 -11.444 2.676 1.00 0.00 C ATOM 1906 NH1 ARG A 131 3.245 -11.171 3.248 1.00 0.00 N ATOM 1907 NH2 ARG A 131 1.595 -12.676 2.683 1.00 0.00 N ATOM 0 H ARG A 131 3.295 -4.909 -0.583 1.00 0.00 H new ATOM 0 HA ARG A 131 3.510 -7.050 1.340 1.00 0.00 H new ATOM 0 HB2 ARG A 131 1.786 -7.647 -0.696 1.00 0.00 H new ATOM 0 HB3 ARG A 131 3.315 -8.186 -1.363 1.00 0.00 H new ATOM 0 HG2 ARG A 131 2.389 -10.059 -0.205 1.00 0.00 H new ATOM 0 HG3 ARG A 131 3.726 -9.481 0.770 1.00 0.00 H new ATOM 0 HD2 ARG A 131 2.309 -8.652 2.468 1.00 0.00 H new ATOM 0 HD3 ARG A 131 0.918 -8.552 1.407 1.00 0.00 H new ATOM 0 HE ARG A 131 0.408 -10.725 1.865 1.00 0.00 H new ATOM 0 HH11 ARG A 131 3.614 -10.220 3.225 1.00 0.00 H new ATOM 0 HH12 ARG A 131 3.772 -11.912 3.711 1.00 0.00 H new ATOM 0 HH21 ARG A 131 0.704 -12.876 2.229 1.00 0.00 H new ATOM 0 HH22 ARG A 131 2.113 -13.425 3.142 1.00 0.00 H new ATOM 1921 N LEU A 132 5.692 -7.710 -0.449 1.00 0.00 N ATOM 1922 CA LEU A 132 7.120 -7.717 -0.761 1.00 0.00 C ATOM 1923 C LEU A 132 7.283 -8.217 -2.194 1.00 0.00 C ATOM 1924 O LEU A 132 6.390 -8.859 -2.743 1.00 0.00 O ATOM 1925 CB LEU A 132 7.851 -8.641 0.236 1.00 0.00 C ATOM 1926 CG LEU A 132 9.378 -8.475 0.336 1.00 0.00 C ATOM 1927 CD1 LEU A 132 9.746 -7.176 1.048 1.00 0.00 C ATOM 1928 CD2 LEU A 132 9.946 -9.650 1.137 1.00 0.00 C ATOM 0 H LEU A 132 5.266 -8.634 -0.524 1.00 0.00 H new ATOM 0 HA LEU A 132 7.550 -6.719 -0.675 1.00 0.00 H new ATOM 0 HB2 LEU A 132 7.425 -8.479 1.226 1.00 0.00 H new ATOM 0 HB3 LEU A 132 7.638 -9.674 -0.038 1.00 0.00 H new ATOM 0 HG LEU A 132 9.792 -8.449 -0.672 1.00 0.00 H new ATOM 0 HD11 LEU A 132 10.831 -7.086 1.104 1.00 0.00 H new ATOM 0 HD12 LEU A 132 9.340 -6.330 0.494 1.00 0.00 H new ATOM 0 HD13 LEU A 132 9.330 -7.183 2.056 1.00 0.00 H new ATOM 0 HD21 LEU A 132 11.028 -9.547 1.217 1.00 0.00 H new ATOM 0 HD22 LEU A 132 9.508 -9.656 2.135 1.00 0.00 H new ATOM 0 HD23 LEU A 132 9.707 -10.585 0.630 1.00 0.00 H new ATOM 1940 N MET A 133 8.443 -7.978 -2.777 1.00 0.00 N ATOM 1941 CA MET A 133 8.861 -8.429 -4.086 1.00 0.00 C ATOM 1942 C MET A 133 10.314 -8.848 -3.992 1.00 0.00 C ATOM 1943 O MET A 133 10.963 -8.533 -2.997 1.00 0.00 O ATOM 1944 CB MET A 133 8.767 -7.248 -5.065 1.00 0.00 C ATOM 1945 CG MET A 133 7.689 -7.451 -6.114 1.00 0.00 C ATOM 1946 SD MET A 133 7.915 -6.355 -7.535 1.00 0.00 S ATOM 1947 CE MET A 133 9.180 -7.353 -8.339 1.00 0.00 C ATOM 0 H MET A 133 9.165 -7.426 -2.315 1.00 0.00 H new ATOM 0 HA MET A 133 8.236 -9.255 -4.425 1.00 0.00 H new ATOM 0 HB2 MET A 133 8.561 -6.334 -4.508 1.00 0.00 H new ATOM 0 HB3 MET A 133 9.729 -7.111 -5.558 1.00 0.00 H new ATOM 0 HG2 MET A 133 7.700 -8.488 -6.450 1.00 0.00 H new ATOM 0 HG3 MET A 133 6.711 -7.271 -5.669 1.00 0.00 H new ATOM 0 HE1 MET A 133 10.014 -6.716 -8.633 1.00 0.00 H new ATOM 0 HE2 MET A 133 9.534 -8.118 -7.648 1.00 0.00 H new ATOM 0 HE3 MET A 133 8.759 -7.830 -9.224 1.00 0.00 H new ATOM 1957 N ALA A 134 10.857 -9.454 -5.052 1.00 0.00 N ATOM 1958 CA ALA A 134 12.299 -9.554 -5.215 1.00 0.00 C ATOM 1959 C ALA A 134 12.771 -8.667 -6.348 1.00 0.00 C ATOM 1960 O ALA A 134 12.244 -8.716 -7.455 1.00 0.00 O ATOM 1961 CB ALA A 134 12.755 -11.002 -5.379 1.00 0.00 C ATOM 0 H ALA A 134 10.316 -9.880 -5.805 1.00 0.00 H new ATOM 0 HA ALA A 134 12.768 -9.192 -4.300 1.00 0.00 H new ATOM 0 HB1 ALA A 134 13.838 -11.031 -5.498 1.00 0.00 H new ATOM 0 HB2 ALA A 134 12.471 -11.575 -4.496 1.00 0.00 H new ATOM 0 HB3 ALA A 134 12.282 -11.435 -6.260 1.00 0.00 H new ATOM 1967 N THR A 135 13.777 -7.858 -6.046 1.00 0.00 N ATOM 1968 CA THR A 135 14.516 -7.062 -6.999 1.00 0.00 C ATOM 1969 C THR A 135 15.798 -7.807 -7.420 1.00 0.00 C ATOM 1970 O THR A 135 16.422 -7.416 -8.406 1.00 0.00 O ATOM 1971 CB THR A 135 14.754 -5.664 -6.380 1.00 0.00 C ATOM 1972 OG1 THR A 135 15.203 -5.723 -5.034 1.00 0.00 O ATOM 1973 CG2 THR A 135 13.453 -4.852 -6.348 1.00 0.00 C ATOM 0 H THR A 135 14.109 -7.738 -5.089 1.00 0.00 H new ATOM 0 HA THR A 135 13.959 -6.908 -7.923 1.00 0.00 H new ATOM 0 HB THR A 135 15.514 -5.203 -7.010 1.00 0.00 H new ATOM 0 HG1 THR A 135 15.338 -4.814 -4.694 1.00 0.00 H new ATOM 0 HG21 THR A 135 13.646 -3.873 -5.909 1.00 0.00 H new ATOM 0 HG22 THR A 135 13.077 -4.726 -7.364 1.00 0.00 H new ATOM 0 HG23 THR A 135 12.710 -5.379 -5.749 1.00 0.00 H new ATOM 1981 N GLN A 136 16.199 -8.890 -6.730 1.00 0.00 N ATOM 1982 CA GLN A 136 17.302 -9.789 -7.088 1.00 0.00 C ATOM 1983 C GLN A 136 16.967 -11.230 -6.693 1.00 0.00 C ATOM 1984 O GLN A 136 15.850 -11.536 -6.284 1.00 0.00 O ATOM 1985 CB GLN A 136 18.619 -9.327 -6.406 1.00 0.00 C ATOM 1986 CG GLN A 136 19.278 -8.099 -7.035 1.00 0.00 C ATOM 1987 CD GLN A 136 20.049 -8.434 -8.315 1.00 0.00 C ATOM 1988 OE1 GLN A 136 19.387 -8.884 -9.376 1.00 0.00 O flip ATOM 1989 NE2 GLN A 136 21.269 -8.319 -8.333 1.00 0.00 N flip ATOM 0 H GLN A 136 15.737 -9.173 -5.865 1.00 0.00 H new ATOM 0 HA GLN A 136 17.443 -9.753 -8.168 1.00 0.00 H new ATOM 0 HB2 GLN A 136 18.411 -9.112 -5.358 1.00 0.00 H new ATOM 0 HB3 GLN A 136 19.330 -10.153 -6.427 1.00 0.00 H new ATOM 0 HG2 GLN A 136 18.513 -7.356 -7.260 1.00 0.00 H new ATOM 0 HG3 GLN A 136 19.958 -7.647 -6.313 1.00 0.00 H new ATOM 0 HE21 GLN A 136 21.761 -7.972 -7.510 1.00 0.00 H new ATOM 0 HE22 GLN A 136 21.793 -8.570 -9.171 1.00 0.00 H new ATOM 1998 N VAL A 137 17.950 -12.124 -6.780 1.00 0.00 N ATOM 1999 CA VAL A 137 17.852 -13.522 -6.394 1.00 0.00 C ATOM 2000 C VAL A 137 18.860 -13.781 -5.246 1.00 0.00 C ATOM 2001 O VAL A 137 19.702 -14.669 -5.373 1.00 0.00 O ATOM 2002 CB VAL A 137 18.101 -14.360 -7.677 1.00 0.00 C ATOM 2003 CG1 VAL A 137 17.957 -15.876 -7.445 1.00 0.00 C ATOM 2004 CG2 VAL A 137 17.290 -13.843 -8.879 1.00 0.00 C ATOM 0 H VAL A 137 18.874 -11.879 -7.137 1.00 0.00 H new ATOM 0 HA VAL A 137 16.875 -13.806 -6.003 1.00 0.00 H new ATOM 0 HB VAL A 137 19.149 -14.214 -7.940 1.00 0.00 H new ATOM 0 HG11 VAL A 137 18.143 -16.406 -8.379 1.00 0.00 H new ATOM 0 HG12 VAL A 137 18.678 -16.199 -6.694 1.00 0.00 H new ATOM 0 HG13 VAL A 137 16.948 -16.097 -7.097 1.00 0.00 H new ATOM 0 HG21 VAL A 137 17.498 -14.462 -9.752 1.00 0.00 H new ATOM 0 HG22 VAL A 137 16.226 -13.889 -8.647 1.00 0.00 H new ATOM 0 HG23 VAL A 137 17.571 -12.811 -9.090 1.00 0.00 H new ATOM 2014 N PRO A 138 18.841 -13.033 -4.117 1.00 0.00 N ATOM 2015 CA PRO A 138 19.766 -13.290 -3.018 1.00 0.00 C ATOM 2016 C PRO A 138 19.218 -14.359 -2.055 1.00 0.00 C ATOM 2017 O PRO A 138 19.949 -14.853 -1.205 1.00 0.00 O ATOM 2018 CB PRO A 138 19.897 -11.962 -2.283 1.00 0.00 C ATOM 2019 CG PRO A 138 18.476 -11.434 -2.380 1.00 0.00 C ATOM 2020 CD PRO A 138 18.014 -11.885 -3.764 1.00 0.00 C ATOM 0 HA PRO A 138 20.719 -13.663 -3.392 1.00 0.00 H new ATOM 0 HB2 PRO A 138 20.218 -12.093 -1.250 1.00 0.00 H new ATOM 0 HB3 PRO A 138 20.617 -11.297 -2.759 1.00 0.00 H new ATOM 0 HG2 PRO A 138 17.842 -11.844 -1.593 1.00 0.00 H new ATOM 0 HG3 PRO A 138 18.445 -10.349 -2.282 1.00 0.00 H new ATOM 0 HD2 PRO A 138 16.958 -12.155 -3.753 1.00 0.00 H new ATOM 0 HD3 PRO A 138 18.130 -11.083 -4.493 1.00 0.00 H new ATOM 2028 N VAL A 139 17.907 -14.637 -2.129 1.00 0.00 N ATOM 2029 CA VAL A 139 17.113 -15.551 -1.308 1.00 0.00 C ATOM 2030 C VAL A 139 17.628 -15.692 0.128 1.00 0.00 C ATOM 2031 O VAL A 139 17.872 -16.788 0.636 1.00 0.00 O ATOM 2032 CB VAL A 139 16.902 -16.882 -2.067 1.00 0.00 C ATOM 2033 CG1 VAL A 139 16.002 -16.668 -3.296 1.00 0.00 C ATOM 2034 CG2 VAL A 139 18.215 -17.526 -2.535 1.00 0.00 C ATOM 0 H VAL A 139 17.326 -14.182 -2.833 1.00 0.00 H new ATOM 0 HA VAL A 139 16.126 -15.115 -1.156 1.00 0.00 H new ATOM 0 HB VAL A 139 16.429 -17.557 -1.354 1.00 0.00 H new ATOM 0 HG11 VAL A 139 15.866 -17.616 -3.817 1.00 0.00 H new ATOM 0 HG12 VAL A 139 15.032 -16.287 -2.975 1.00 0.00 H new ATOM 0 HG13 VAL A 139 16.469 -15.949 -3.969 1.00 0.00 H new ATOM 0 HG21 VAL A 139 17.997 -18.456 -3.060 1.00 0.00 H new ATOM 0 HG22 VAL A 139 18.736 -16.843 -3.206 1.00 0.00 H new ATOM 0 HG23 VAL A 139 18.845 -17.736 -1.671 1.00 0.00 H new ATOM 2044 N THR A 140 17.726 -14.551 0.799 1.00 0.00 N ATOM 2045 CA THR A 140 18.245 -14.406 2.142 1.00 0.00 C ATOM 2046 C THR A 140 17.051 -14.113 3.058 1.00 0.00 C ATOM 2047 O THR A 140 16.485 -13.016 2.996 1.00 0.00 O ATOM 2048 CB THR A 140 19.269 -13.266 2.080 1.00 0.00 C ATOM 2049 OG1 THR A 140 20.345 -13.578 1.207 1.00 0.00 O ATOM 2050 CG2 THR A 140 19.846 -12.872 3.435 1.00 0.00 C ATOM 0 H THR A 140 17.430 -13.662 0.397 1.00 0.00 H new ATOM 0 HA THR A 140 18.744 -15.292 2.536 1.00 0.00 H new ATOM 0 HB THR A 140 18.703 -12.415 1.700 1.00 0.00 H new ATOM 0 HG1 THR A 140 20.000 -14.043 0.416 1.00 0.00 H new ATOM 0 HG21 THR A 140 20.561 -12.060 3.304 1.00 0.00 H new ATOM 0 HG22 THR A 140 19.041 -12.543 4.092 1.00 0.00 H new ATOM 0 HG23 THR A 140 20.349 -13.731 3.880 1.00 0.00 H new ATOM 2058 N ALA A 141 16.631 -15.107 3.845 1.00 0.00 N ATOM 2059 CA ALA A 141 15.706 -14.971 4.950 1.00 0.00 C ATOM 2060 C ALA A 141 16.175 -13.893 5.945 1.00 0.00 C ATOM 2061 O ALA A 141 17.144 -14.097 6.682 1.00 0.00 O ATOM 2062 CB ALA A 141 15.562 -16.344 5.615 1.00 0.00 C ATOM 0 H ALA A 141 16.947 -16.068 3.715 1.00 0.00 H new ATOM 0 HA ALA A 141 14.733 -14.639 4.587 1.00 0.00 H new ATOM 0 HB1 ALA A 141 14.869 -16.271 6.453 1.00 0.00 H new ATOM 0 HB2 ALA A 141 15.180 -17.062 4.889 1.00 0.00 H new ATOM 0 HB3 ALA A 141 16.535 -16.677 5.976 1.00 0.00 H new ATOM 2068 N GLY A 142 15.475 -12.760 5.984 1.00 0.00 N ATOM 2069 CA GLY A 142 15.586 -11.713 6.991 1.00 0.00 C ATOM 2070 C GLY A 142 14.208 -11.091 7.206 1.00 0.00 C ATOM 2071 O GLY A 142 13.263 -11.335 6.445 1.00 0.00 O ATOM 0 H GLY A 142 14.778 -12.539 5.273 1.00 0.00 H new ATOM 0 HA2 GLY A 142 15.964 -12.127 7.926 1.00 0.00 H new ATOM 0 HA3 GLY A 142 16.297 -10.953 6.669 1.00 0.00 H new ATOM 2075 N HIS A 143 14.069 -10.283 8.253 1.00 0.00 N ATOM 2076 CA HIS A 143 12.812 -9.607 8.550 1.00 0.00 C ATOM 2077 C HIS A 143 12.559 -8.484 7.567 1.00 0.00 C ATOM 2078 O HIS A 143 13.457 -7.983 6.892 1.00 0.00 O ATOM 2079 CB HIS A 143 12.726 -9.127 10.007 1.00 0.00 C ATOM 2080 CG HIS A 143 13.996 -8.562 10.571 1.00 0.00 C ATOM 2081 ND1 HIS A 143 14.686 -7.449 10.121 1.00 0.00 N ATOM 2082 CD2 HIS A 143 14.714 -9.154 11.571 1.00 0.00 C ATOM 2083 CE1 HIS A 143 15.826 -7.401 10.825 1.00 0.00 C ATOM 2084 NE2 HIS A 143 15.864 -8.411 11.719 1.00 0.00 N ATOM 0 H HIS A 143 14.819 -10.080 8.914 1.00 0.00 H new ATOM 0 HA HIS A 143 12.016 -10.342 8.431 1.00 0.00 H new ATOM 0 HB2 HIS A 143 11.947 -8.368 10.077 1.00 0.00 H new ATOM 0 HB3 HIS A 143 12.412 -9.964 10.630 1.00 0.00 H new ATOM 0 HD1 HIS A 143 14.386 -6.795 9.398 1.00 0.00 H new ATOM 0 HD2 HIS A 143 14.435 -10.032 12.135 1.00 0.00 H new ATOM 0 HE1 HIS A 143 16.602 -6.661 10.695 1.00 0.00 H new ATOM 2093 N ILE A 144 11.294 -8.085 7.533 1.00 0.00 N ATOM 2094 CA ILE A 144 10.835 -6.880 6.889 1.00 0.00 C ATOM 2095 C ILE A 144 10.708 -5.864 8.016 1.00 0.00 C ATOM 2096 O ILE A 144 10.105 -6.163 9.053 1.00 0.00 O ATOM 2097 CB ILE A 144 9.498 -7.131 6.158 1.00 0.00 C ATOM 2098 CG1 ILE A 144 9.410 -8.445 5.354 1.00 0.00 C ATOM 2099 CG2 ILE A 144 9.128 -5.958 5.246 1.00 0.00 C ATOM 2100 CD1 ILE A 144 10.593 -8.735 4.438 1.00 0.00 C ATOM 0 H ILE A 144 10.541 -8.616 7.970 1.00 0.00 H new ATOM 0 HA ILE A 144 11.517 -6.522 6.118 1.00 0.00 H new ATOM 0 HB ILE A 144 8.780 -7.228 6.972 1.00 0.00 H new ATOM 0 HG12 ILE A 144 9.304 -9.273 6.055 1.00 0.00 H new ATOM 0 HG13 ILE A 144 8.503 -8.421 4.750 1.00 0.00 H new ATOM 0 HG21 ILE A 144 8.182 -6.169 4.748 1.00 0.00 H new ATOM 0 HG22 ILE A 144 9.030 -5.051 5.842 1.00 0.00 H new ATOM 0 HG23 ILE A 144 9.909 -5.818 4.498 1.00 0.00 H new ATOM 0 HD11 ILE A 144 10.430 -9.681 3.921 1.00 0.00 H new ATOM 0 HD12 ILE A 144 10.691 -7.933 3.706 1.00 0.00 H new ATOM 0 HD13 ILE A 144 11.505 -8.799 5.031 1.00 0.00 H new ATOM 2112 N ASN A 145 11.316 -4.707 7.807 1.00 0.00 N ATOM 2113 CA ASN A 145 11.160 -3.428 8.479 1.00 0.00 C ATOM 2114 C ASN A 145 11.561 -2.416 7.408 1.00 0.00 C ATOM 2115 O ASN A 145 12.670 -2.496 6.867 1.00 0.00 O ATOM 2116 CB ASN A 145 12.065 -3.321 9.717 1.00 0.00 C ATOM 2117 CG ASN A 145 11.285 -3.543 11.000 1.00 0.00 C ATOM 2118 OD1 ASN A 145 10.608 -2.648 11.497 1.00 0.00 O ATOM 2119 ND2 ASN A 145 11.322 -4.736 11.559 1.00 0.00 N ATOM 0 H ASN A 145 12.018 -4.635 7.070 1.00 0.00 H new ATOM 0 HA ASN A 145 10.150 -3.272 8.857 1.00 0.00 H new ATOM 0 HB2 ASN A 145 12.867 -4.056 9.647 1.00 0.00 H new ATOM 0 HB3 ASN A 145 12.534 -2.338 9.741 1.00 0.00 H new ATOM 0 HD21 ASN A 145 10.787 -4.918 12.408 1.00 0.00 H new ATOM 0 HD22 ASN A 145 11.886 -5.477 11.143 1.00 0.00 H new ATOM 2126 N ALA A 146 10.658 -1.528 7.007 1.00 0.00 N ATOM 2127 CA ALA A 146 10.894 -0.514 5.984 1.00 0.00 C ATOM 2128 C ALA A 146 10.100 0.738 6.348 1.00 0.00 C ATOM 2129 O ALA A 146 9.176 0.656 7.163 1.00 0.00 O ATOM 2130 CB ALA A 146 10.413 -1.020 4.626 1.00 0.00 C ATOM 0 H ALA A 146 9.715 -1.492 7.395 1.00 0.00 H new ATOM 0 HA ALA A 146 11.960 -0.294 5.931 1.00 0.00 H new ATOM 0 HB1 ALA A 146 10.593 -0.257 3.869 1.00 0.00 H new ATOM 0 HB2 ALA A 146 10.956 -1.928 4.363 1.00 0.00 H new ATOM 0 HB3 ALA A 146 9.346 -1.237 4.676 1.00 0.00 H new ATOM 2136 N THR A 147 10.416 1.866 5.711 1.00 0.00 N ATOM 2137 CA THR A 147 9.925 3.180 6.095 1.00 0.00 C ATOM 2138 C THR A 147 9.816 4.052 4.841 1.00 0.00 C ATOM 2139 O THR A 147 10.752 4.124 4.045 1.00 0.00 O ATOM 2140 CB THR A 147 10.849 3.766 7.203 1.00 0.00 C ATOM 2141 OG1 THR A 147 10.867 5.184 7.251 1.00 0.00 O ATOM 2142 CG2 THR A 147 12.330 3.357 7.094 1.00 0.00 C ATOM 0 H THR A 147 11.033 1.887 4.899 1.00 0.00 H new ATOM 0 HA THR A 147 8.925 3.131 6.527 1.00 0.00 H new ATOM 0 HB THR A 147 10.394 3.339 8.097 1.00 0.00 H new ATOM 0 HG1 THR A 147 11.465 5.479 7.969 1.00 0.00 H new ATOM 0 HG21 THR A 147 12.894 3.813 7.908 1.00 0.00 H new ATOM 0 HG22 THR A 147 12.413 2.272 7.158 1.00 0.00 H new ATOM 0 HG23 THR A 147 12.732 3.696 6.139 1.00 0.00 H new ATOM 2150 N ALA A 148 8.660 4.693 4.656 1.00 0.00 N ATOM 2151 CA ALA A 148 8.400 5.738 3.672 1.00 0.00 C ATOM 2152 C ALA A 148 7.211 6.575 4.154 1.00 0.00 C ATOM 2153 O ALA A 148 6.703 6.361 5.263 1.00 0.00 O ATOM 2154 CB ALA A 148 8.111 5.122 2.301 1.00 0.00 C ATOM 0 H ALA A 148 7.837 4.483 5.221 1.00 0.00 H new ATOM 0 HA ALA A 148 9.277 6.376 3.568 1.00 0.00 H new ATOM 0 HB1 ALA A 148 7.919 5.915 1.579 1.00 0.00 H new ATOM 0 HB2 ALA A 148 8.971 4.536 1.977 1.00 0.00 H new ATOM 0 HB3 ALA A 148 7.237 4.475 2.370 1.00 0.00 H new ATOM 2160 N THR A 149 6.767 7.520 3.333 1.00 0.00 N ATOM 2161 CA THR A 149 5.737 8.486 3.651 1.00 0.00 C ATOM 2162 C THR A 149 4.812 8.650 2.433 1.00 0.00 C ATOM 2163 O THR A 149 5.259 8.946 1.321 1.00 0.00 O ATOM 2164 CB THR A 149 6.403 9.775 4.169 1.00 0.00 C ATOM 2165 OG1 THR A 149 7.401 10.294 3.305 1.00 0.00 O ATOM 2166 CG2 THR A 149 7.065 9.557 5.540 1.00 0.00 C ATOM 0 H THR A 149 7.135 7.634 2.388 1.00 0.00 H new ATOM 0 HA THR A 149 5.087 8.155 4.461 1.00 0.00 H new ATOM 0 HB THR A 149 5.583 10.491 4.232 1.00 0.00 H new ATOM 0 HG1 THR A 149 7.531 9.682 2.550 1.00 0.00 H new ATOM 0 HG21 THR A 149 7.525 10.487 5.874 1.00 0.00 H new ATOM 0 HG22 THR A 149 6.311 9.245 6.263 1.00 0.00 H new ATOM 0 HG23 THR A 149 7.829 8.784 5.456 1.00 0.00 H new ATOM 2174 N PHE A 150 3.525 8.366 2.631 1.00 0.00 N ATOM 2175 CA PHE A 150 2.471 8.281 1.631 1.00 0.00 C ATOM 2176 C PHE A 150 1.734 9.624 1.550 1.00 0.00 C ATOM 2177 O PHE A 150 0.666 9.837 2.121 1.00 0.00 O ATOM 2178 CB PHE A 150 1.576 7.078 1.973 1.00 0.00 C ATOM 2179 CG PHE A 150 0.977 7.072 3.367 1.00 0.00 C ATOM 2180 CD1 PHE A 150 1.715 6.570 4.452 1.00 0.00 C ATOM 2181 CD2 PHE A 150 -0.313 7.577 3.598 1.00 0.00 C ATOM 2182 CE1 PHE A 150 1.140 6.499 5.731 1.00 0.00 C ATOM 2183 CE2 PHE A 150 -0.857 7.561 4.891 1.00 0.00 C ATOM 2184 CZ PHE A 150 -0.156 6.982 5.953 1.00 0.00 C ATOM 0 H PHE A 150 3.169 8.175 3.568 1.00 0.00 H new ATOM 0 HA PHE A 150 2.866 8.104 0.631 1.00 0.00 H new ATOM 0 HB2 PHE A 150 0.762 7.038 1.249 1.00 0.00 H new ATOM 0 HB3 PHE A 150 2.161 6.167 1.846 1.00 0.00 H new ATOM 0 HD1 PHE A 150 2.731 6.237 4.301 1.00 0.00 H new ATOM 0 HD2 PHE A 150 -0.888 7.979 2.777 1.00 0.00 H new ATOM 0 HE1 PHE A 150 1.700 6.069 6.548 1.00 0.00 H new ATOM 0 HE2 PHE A 150 -1.828 8.001 5.068 1.00 0.00 H new ATOM 0 HZ PHE A 150 -0.608 6.908 6.931 1.00 0.00 H new ATOM 2194 N THR A 151 2.294 10.561 0.808 1.00 0.00 N ATOM 2195 CA THR A 151 1.719 11.886 0.640 1.00 0.00 C ATOM 2196 C THR A 151 0.590 11.785 -0.396 1.00 0.00 C ATOM 2197 O THR A 151 0.471 10.809 -1.147 1.00 0.00 O ATOM 2198 CB THR A 151 2.862 12.845 0.224 1.00 0.00 C ATOM 2199 OG1 THR A 151 3.190 12.786 -1.150 1.00 0.00 O ATOM 2200 CG2 THR A 151 4.189 12.563 0.948 1.00 0.00 C ATOM 0 H THR A 151 3.168 10.425 0.300 1.00 0.00 H new ATOM 0 HA THR A 151 1.279 12.282 1.555 1.00 0.00 H new ATOM 0 HB THR A 151 2.450 13.818 0.492 1.00 0.00 H new ATOM 0 HG1 THR A 151 3.413 11.863 -1.394 1.00 0.00 H new ATOM 0 HG21 THR A 151 4.946 13.271 0.610 1.00 0.00 H new ATOM 0 HG22 THR A 151 4.047 12.670 2.023 1.00 0.00 H new ATOM 0 HG23 THR A 151 4.516 11.548 0.725 1.00 0.00 H new ATOM 2208 N LEU A 152 -0.245 12.812 -0.445 1.00 0.00 N ATOM 2209 CA LEU A 152 -1.322 13.014 -1.394 1.00 0.00 C ATOM 2210 C LEU A 152 -1.051 14.356 -2.046 1.00 0.00 C ATOM 2211 O LEU A 152 -0.502 15.274 -1.425 1.00 0.00 O ATOM 2212 CB LEU A 152 -2.707 13.064 -0.702 1.00 0.00 C ATOM 2213 CG LEU A 152 -3.318 11.737 -0.214 1.00 0.00 C ATOM 2214 CD1 LEU A 152 -3.180 10.639 -1.272 1.00 0.00 C ATOM 2215 CD2 LEU A 152 -2.740 11.273 1.130 1.00 0.00 C ATOM 0 H LEU A 152 -0.181 13.578 0.226 1.00 0.00 H new ATOM 0 HA LEU A 152 -1.351 12.189 -2.106 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -2.628 13.731 0.156 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -3.412 13.521 -1.397 1.00 0.00 H new ATOM 0 HG LEU A 152 -4.378 11.931 -0.052 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -3.621 9.715 -0.897 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -3.696 10.944 -2.182 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -2.125 10.475 -1.491 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -3.208 10.333 1.423 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -1.664 11.127 1.033 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -2.936 12.029 1.891 1.00 0.00 H new ATOM 2227 N GLU A 153 -1.491 14.489 -3.284 1.00 0.00 N ATOM 2228 CA GLU A 153 -1.462 15.718 -4.035 1.00 0.00 C ATOM 2229 C GLU A 153 -2.856 15.905 -4.634 1.00 0.00 C ATOM 2230 O GLU A 153 -3.222 15.300 -5.636 1.00 0.00 O ATOM 2231 CB GLU A 153 -0.264 15.697 -4.999 1.00 0.00 C ATOM 2232 CG GLU A 153 0.155 17.133 -5.332 1.00 0.00 C ATOM 2233 CD GLU A 153 1.571 17.280 -5.892 1.00 0.00 C ATOM 2234 OE1 GLU A 153 2.511 16.556 -5.485 1.00 0.00 O ATOM 2235 OE2 GLU A 153 1.784 18.243 -6.669 1.00 0.00 O ATOM 0 H GLU A 153 -1.892 13.711 -3.808 1.00 0.00 H new ATOM 0 HA GLU A 153 -1.278 16.611 -3.438 1.00 0.00 H new ATOM 0 HB2 GLU A 153 0.570 15.160 -4.547 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -0.529 15.164 -5.912 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -0.550 17.543 -6.055 1.00 0.00 H new ATOM 0 HG3 GLU A 153 0.073 17.738 -4.429 1.00 0.00 H new ATOM 2242 N TYR A 154 -3.700 16.647 -3.922 1.00 0.00 N ATOM 2243 CA TYR A 154 -5.068 16.930 -4.326 1.00 0.00 C ATOM 2244 C TYR A 154 -5.049 17.830 -5.557 1.00 0.00 C ATOM 2245 O TYR A 154 -4.127 18.645 -5.682 1.00 0.00 O ATOM 2246 CB TYR A 154 -5.809 17.632 -3.180 1.00 0.00 C ATOM 2247 CG TYR A 154 -5.445 17.131 -1.796 1.00 0.00 C ATOM 2248 CD1 TYR A 154 -6.061 15.979 -1.282 1.00 0.00 C ATOM 2249 CD2 TYR A 154 -4.435 17.773 -1.053 1.00 0.00 C ATOM 2250 CE1 TYR A 154 -5.666 15.455 -0.040 1.00 0.00 C ATOM 2251 CE2 TYR A 154 -4.033 17.257 0.188 1.00 0.00 C ATOM 2252 CZ TYR A 154 -4.642 16.092 0.701 1.00 0.00 C ATOM 2253 OH TYR A 154 -4.213 15.599 1.893 1.00 0.00 O ATOM 0 H TYR A 154 -3.444 17.075 -3.032 1.00 0.00 H new ATOM 0 HA TYR A 154 -5.582 15.998 -4.563 1.00 0.00 H new ATOM 0 HB2 TYR A 154 -5.602 18.701 -3.232 1.00 0.00 H new ATOM 0 HB3 TYR A 154 -6.882 17.507 -3.327 1.00 0.00 H new ATOM 0 HD1 TYR A 154 -6.844 15.492 -1.845 1.00 0.00 H new ATOM 0 HD2 TYR A 154 -3.968 18.666 -1.440 1.00 0.00 H new ATOM 0 HE1 TYR A 154 -6.143 14.567 0.349 1.00 0.00 H new ATOM 0 HE2 TYR A 154 -3.256 17.752 0.752 1.00 0.00 H new ATOM 0 HH TYR A 154 -4.985 15.409 2.465 1.00 0.00 H new ATOM 2263 N GLN A 155 -6.114 17.734 -6.366 1.00 0.00 N ATOM 2264 CA GLN A 155 -6.329 18.433 -7.632 1.00 0.00 C ATOM 2265 C GLN A 155 -5.802 19.867 -7.553 1.00 0.00 C ATOM 2266 O GLN A 155 -4.878 20.245 -8.275 1.00 0.00 O ATOM 2267 CB GLN A 155 -7.829 18.423 -7.990 1.00 0.00 C ATOM 2268 CG GLN A 155 -8.463 17.035 -8.170 1.00 0.00 C ATOM 2269 CD GLN A 155 -7.905 16.252 -9.352 1.00 0.00 C ATOM 2270 OE1 GLN A 155 -7.112 15.330 -9.179 1.00 0.00 O ATOM 2271 NE2 GLN A 155 -8.324 16.565 -10.565 1.00 0.00 N ATOM 0 H GLN A 155 -6.898 17.124 -6.134 1.00 0.00 H new ATOM 0 HA GLN A 155 -5.778 17.915 -8.417 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -8.374 18.952 -7.208 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -7.967 18.987 -8.912 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -8.312 16.456 -7.259 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -9.539 17.151 -8.299 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -8.983 17.333 -10.695 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -7.989 16.039 -11.372 1.00 0.00 H new ATOM 2463 N ASP A 167 3.735 13.812 7.577 1.00 0.00 N ATOM 2464 CA ASP A 167 4.850 12.950 7.980 1.00 0.00 C ATOM 2465 C ASP A 167 4.426 11.479 8.095 1.00 0.00 C ATOM 2466 O ASP A 167 5.281 10.637 8.350 1.00 0.00 O ATOM 2467 CB ASP A 167 5.472 13.405 9.328 1.00 0.00 C ATOM 2468 CG ASP A 167 5.299 14.873 9.769 1.00 0.00 C ATOM 2469 OD1 ASP A 167 6.015 15.783 9.277 1.00 0.00 O ATOM 2470 OD2 ASP A 167 4.509 15.142 10.711 1.00 0.00 O ATOM 0 HA ASP A 167 5.599 13.041 7.193 1.00 0.00 H new ATOM 0 HB2 ASP A 167 5.056 12.774 10.113 1.00 0.00 H new ATOM 0 HB3 ASP A 167 6.541 13.197 9.285 1.00 0.00 H new ATOM 2475 N SER A 168 3.147 11.160 7.874 1.00 0.00 N ATOM 2476 CA SER A 168 2.474 9.857 7.969 1.00 0.00 C ATOM 2477 C SER A 168 3.397 8.651 7.699 1.00 0.00 C ATOM 2478 O SER A 168 3.716 8.346 6.546 1.00 0.00 O ATOM 2479 CB SER A 168 1.247 9.833 7.028 1.00 0.00 C ATOM 2480 OG SER A 168 1.093 11.015 6.257 1.00 0.00 O ATOM 0 H SER A 168 2.486 11.885 7.594 1.00 0.00 H new ATOM 0 HA SER A 168 2.153 9.748 9.005 1.00 0.00 H new ATOM 0 HB2 SER A 168 1.334 8.980 6.355 1.00 0.00 H new ATOM 0 HB3 SER A 168 0.347 9.679 7.623 1.00 0.00 H new ATOM 0 HG SER A 168 0.302 10.932 5.685 1.00 0.00 H new ATOM 2486 N THR A 169 3.842 7.970 8.747 1.00 0.00 N ATOM 2487 CA THR A 169 4.751 6.839 8.660 1.00 0.00 C ATOM 2488 C THR A 169 4.066 5.629 8.006 1.00 0.00 C ATOM 2489 O THR A 169 3.107 5.092 8.561 1.00 0.00 O ATOM 2490 CB THR A 169 5.269 6.495 10.078 1.00 0.00 C ATOM 2491 OG1 THR A 169 4.609 7.233 11.096 1.00 0.00 O ATOM 2492 CG2 THR A 169 6.756 6.813 10.170 1.00 0.00 C ATOM 0 H THR A 169 3.573 8.196 9.704 1.00 0.00 H new ATOM 0 HA THR A 169 5.598 7.105 8.028 1.00 0.00 H new ATOM 0 HB THR A 169 5.072 5.434 10.233 1.00 0.00 H new ATOM 0 HG1 THR A 169 4.904 8.167 11.066 1.00 0.00 H new ATOM 0 HG21 THR A 169 7.119 6.570 11.169 1.00 0.00 H new ATOM 0 HG22 THR A 169 7.301 6.223 9.433 1.00 0.00 H new ATOM 0 HG23 THR A 169 6.914 7.874 9.974 1.00 0.00 H new ATOM 2500 N ILE A 170 4.544 5.197 6.835 1.00 0.00 N ATOM 2501 CA ILE A 170 4.380 3.830 6.357 1.00 0.00 C ATOM 2502 C ILE A 170 5.492 3.023 7.037 1.00 0.00 C ATOM 2503 O ILE A 170 6.651 3.450 7.036 1.00 0.00 O ATOM 2504 CB ILE A 170 4.388 3.797 4.797 1.00 0.00 C ATOM 2505 CG1 ILE A 170 2.982 3.469 4.243 1.00 0.00 C ATOM 2506 CG2 ILE A 170 5.435 2.875 4.145 1.00 0.00 C ATOM 2507 CD1 ILE A 170 2.593 1.988 4.262 1.00 0.00 C ATOM 0 H ILE A 170 5.060 5.796 6.190 1.00 0.00 H new ATOM 0 HA ILE A 170 3.419 3.385 6.617 1.00 0.00 H new ATOM 0 HB ILE A 170 4.688 4.807 4.518 1.00 0.00 H new ATOM 0 HG12 ILE A 170 2.244 4.027 4.819 1.00 0.00 H new ATOM 0 HG13 ILE A 170 2.923 3.829 3.216 1.00 0.00 H new ATOM 0 HG21 ILE A 170 5.346 2.934 3.060 1.00 0.00 H new ATOM 0 HG22 ILE A 170 6.434 3.190 4.445 1.00 0.00 H new ATOM 0 HG23 ILE A 170 5.266 1.848 4.468 1.00 0.00 H new ATOM 0 HD11 ILE A 170 1.590 1.870 3.852 1.00 0.00 H new ATOM 0 HD12 ILE A 170 3.300 1.418 3.659 1.00 0.00 H new ATOM 0 HD13 ILE A 170 2.612 1.620 5.288 1.00 0.00 H new ATOM 2519 N THR A 171 5.133 1.889 7.635 1.00 0.00 N ATOM 2520 CA THR A 171 5.942 1.095 8.547 1.00 0.00 C ATOM 2521 C THR A 171 5.535 -0.366 8.347 1.00 0.00 C ATOM 2522 O THR A 171 4.494 -0.785 8.849 1.00 0.00 O ATOM 2523 CB THR A 171 5.681 1.551 10.002 1.00 0.00 C ATOM 2524 OG1 THR A 171 5.592 2.958 10.124 1.00 0.00 O ATOM 2525 CG2 THR A 171 6.813 1.069 10.905 1.00 0.00 C ATOM 0 H THR A 171 4.212 1.478 7.484 1.00 0.00 H new ATOM 0 HA THR A 171 7.007 1.218 8.350 1.00 0.00 H new ATOM 0 HB THR A 171 4.725 1.118 10.298 1.00 0.00 H new ATOM 0 HG1 THR A 171 4.660 3.214 10.288 1.00 0.00 H new ATOM 0 HG21 THR A 171 6.625 1.393 11.929 1.00 0.00 H new ATOM 0 HG22 THR A 171 6.866 -0.019 10.872 1.00 0.00 H new ATOM 0 HG23 THR A 171 7.758 1.489 10.560 1.00 0.00 H new ATOM 2533 N ILE A 172 6.292 -1.154 7.577 1.00 0.00 N ATOM 2534 CA ILE A 172 5.841 -2.487 7.152 1.00 0.00 C ATOM 2535 C ILE A 172 6.731 -3.550 7.801 1.00 0.00 C ATOM 2536 O ILE A 172 7.956 -3.448 7.702 1.00 0.00 O ATOM 2537 CB ILE A 172 5.725 -2.560 5.608 1.00 0.00 C ATOM 2538 CG1 ILE A 172 4.954 -1.328 5.059 1.00 0.00 C ATOM 2539 CG2 ILE A 172 5.122 -3.923 5.224 1.00 0.00 C ATOM 2540 CD1 ILE A 172 4.267 -1.568 3.734 1.00 0.00 C ATOM 0 H ILE A 172 7.217 -0.895 7.235 1.00 0.00 H new ATOM 0 HA ILE A 172 4.830 -2.692 7.504 1.00 0.00 H new ATOM 0 HB ILE A 172 6.705 -2.505 5.134 1.00 0.00 H new ATOM 0 HG12 ILE A 172 4.208 -1.024 5.793 1.00 0.00 H new ATOM 0 HG13 ILE A 172 5.650 -0.497 4.949 1.00 0.00 H new ATOM 0 HG21 ILE A 172 5.034 -3.989 4.140 1.00 0.00 H new ATOM 0 HG22 ILE A 172 5.769 -4.722 5.585 1.00 0.00 H new ATOM 0 HG23 ILE A 172 4.135 -4.024 5.675 1.00 0.00 H new ATOM 0 HD11 ILE A 172 3.752 -0.660 3.421 1.00 0.00 H new ATOM 0 HD12 ILE A 172 5.009 -1.841 2.984 1.00 0.00 H new ATOM 0 HD13 ILE A 172 3.544 -2.376 3.840 1.00 0.00 H new ATOM 2552 N ARG A 173 6.135 -4.523 8.514 1.00 0.00 N ATOM 2553 CA ARG A 173 6.854 -5.479 9.370 1.00 0.00 C ATOM 2554 C ARG A 173 6.417 -6.914 9.073 1.00 0.00 C ATOM 2555 O ARG A 173 5.222 -7.200 9.081 1.00 0.00 O ATOM 2556 CB ARG A 173 6.675 -5.203 10.883 1.00 0.00 C ATOM 2557 CG ARG A 173 5.912 -3.951 11.323 1.00 0.00 C ATOM 2558 CD ARG A 173 6.672 -2.629 11.171 1.00 0.00 C ATOM 2559 NE ARG A 173 7.862 -2.536 12.029 1.00 0.00 N ATOM 2560 CZ ARG A 173 7.890 -2.345 13.350 1.00 0.00 C ATOM 2561 NH1 ARG A 173 6.764 -2.254 14.052 1.00 0.00 N ATOM 2562 NH2 ARG A 173 9.063 -2.219 13.956 1.00 0.00 N ATOM 0 H ARG A 173 5.125 -4.668 8.510 1.00 0.00 H new ATOM 0 HA ARG A 173 7.910 -5.348 9.132 1.00 0.00 H new ATOM 0 HB2 ARG A 173 6.170 -6.066 11.318 1.00 0.00 H new ATOM 0 HB3 ARG A 173 7.668 -5.157 11.329 1.00 0.00 H new ATOM 0 HG2 ARG A 173 4.989 -3.888 10.747 1.00 0.00 H new ATOM 0 HG3 ARG A 173 5.628 -4.069 12.369 1.00 0.00 H new ATOM 0 HD2 ARG A 173 6.974 -2.510 10.130 1.00 0.00 H new ATOM 0 HD3 ARG A 173 6.000 -1.803 11.405 1.00 0.00 H new ATOM 0 HE ARG A 173 8.765 -2.627 11.564 1.00 0.00 H new ATOM 0 HH11 ARG A 173 5.862 -2.330 13.582 1.00 0.00 H new ATOM 0 HH12 ARG A 173 6.802 -2.108 15.061 1.00 0.00 H new ATOM 0 HH21 ARG A 173 9.925 -2.269 13.413 1.00 0.00 H new ATOM 0 HH22 ARG A 173 9.103 -2.073 14.965 1.00 0.00 H new ATOM 2576 N GLY A 174 7.376 -7.816 8.869 1.00 0.00 N ATOM 2577 CA GLY A 174 7.176 -9.202 8.449 1.00 0.00 C ATOM 2578 C GLY A 174 8.466 -10.007 8.594 1.00 0.00 C ATOM 2579 O GLY A 174 9.440 -9.500 9.163 1.00 0.00 O ATOM 0 H GLY A 174 8.362 -7.589 8.999 1.00 0.00 H new ATOM 0 HA2 GLY A 174 6.389 -9.658 9.049 1.00 0.00 H new ATOM 0 HA3 GLY A 174 6.841 -9.227 7.412 1.00 0.00 H new ATOM 2583 N TYR A 175 8.505 -11.239 8.074 1.00 0.00 N ATOM 2584 CA TYR A 175 9.623 -12.172 8.247 1.00 0.00 C ATOM 2585 C TYR A 175 9.717 -13.090 7.031 1.00 0.00 C ATOM 2586 O TYR A 175 8.737 -13.747 6.692 1.00 0.00 O ATOM 2587 CB TYR A 175 9.409 -12.997 9.525 1.00 0.00 C ATOM 2588 CG TYR A 175 10.543 -13.939 9.890 1.00 0.00 C ATOM 2589 CD1 TYR A 175 10.651 -15.193 9.261 1.00 0.00 C ATOM 2590 CD2 TYR A 175 11.441 -13.595 10.918 1.00 0.00 C ATOM 2591 CE1 TYR A 175 11.656 -16.097 9.645 1.00 0.00 C ATOM 2592 CE2 TYR A 175 12.429 -14.506 11.332 1.00 0.00 C ATOM 2593 CZ TYR A 175 12.546 -15.755 10.686 1.00 0.00 C ATOM 2594 OH TYR A 175 13.532 -16.612 11.057 1.00 0.00 O ATOM 0 H TYR A 175 7.746 -11.622 7.511 1.00 0.00 H new ATOM 0 HA TYR A 175 10.555 -11.615 8.339 1.00 0.00 H new ATOM 0 HB2 TYR A 175 9.247 -12.311 10.357 1.00 0.00 H new ATOM 0 HB3 TYR A 175 8.496 -13.582 9.411 1.00 0.00 H new ATOM 0 HD1 TYR A 175 9.957 -15.462 8.478 1.00 0.00 H new ATOM 0 HD2 TYR A 175 11.371 -12.627 11.391 1.00 0.00 H new ATOM 0 HE1 TYR A 175 11.747 -17.050 9.145 1.00 0.00 H new ATOM 0 HE2 TYR A 175 13.096 -14.250 12.142 1.00 0.00 H new ATOM 0 HH TYR A 175 14.052 -16.216 11.787 1.00 0.00 H new ATOM 2604 N VAL A 176 10.879 -13.169 6.370 1.00 0.00 N ATOM 2605 CA VAL A 176 11.074 -14.139 5.294 1.00 0.00 C ATOM 2606 C VAL A 176 11.369 -15.491 5.921 1.00 0.00 C ATOM 2607 O VAL A 176 12.386 -15.678 6.580 1.00 0.00 O ATOM 2608 CB VAL A 176 12.160 -13.676 4.308 1.00 0.00 C ATOM 2609 CG1 VAL A 176 12.437 -14.725 3.217 1.00 0.00 C ATOM 2610 CG2 VAL A 176 11.747 -12.378 3.604 1.00 0.00 C ATOM 0 H VAL A 176 11.688 -12.578 6.561 1.00 0.00 H new ATOM 0 HA VAL A 176 10.168 -14.227 4.694 1.00 0.00 H new ATOM 0 HB VAL A 176 13.059 -13.522 4.904 1.00 0.00 H new ATOM 0 HG11 VAL A 176 13.210 -14.355 2.544 1.00 0.00 H new ATOM 0 HG12 VAL A 176 12.773 -15.652 3.681 1.00 0.00 H new ATOM 0 HG13 VAL A 176 11.524 -14.912 2.652 1.00 0.00 H new ATOM 0 HG21 VAL A 176 12.533 -12.073 2.913 1.00 0.00 H new ATOM 0 HG22 VAL A 176 10.822 -12.542 3.052 1.00 0.00 H new ATOM 0 HG23 VAL A 176 11.593 -11.595 4.346 1.00 0.00 H new ATOM 2620 N ARG A 177 10.454 -16.432 5.685 1.00 0.00 N ATOM 2621 CA ARG A 177 10.626 -17.836 6.021 1.00 0.00 C ATOM 2622 C ARG A 177 11.506 -18.428 4.933 1.00 0.00 C ATOM 2623 O ARG A 177 11.471 -17.970 3.799 1.00 0.00 O ATOM 2624 CB ARG A 177 9.264 -18.549 5.972 1.00 0.00 C ATOM 2625 CG ARG A 177 8.178 -17.897 6.831 1.00 0.00 C ATOM 2626 CD ARG A 177 8.278 -18.182 8.333 1.00 0.00 C ATOM 2627 NE ARG A 177 6.972 -18.587 8.864 1.00 0.00 N ATOM 2628 CZ ARG A 177 6.308 -19.720 8.634 1.00 0.00 C ATOM 2629 NH1 ARG A 177 6.892 -20.746 8.007 1.00 0.00 N ATOM 2630 NH2 ARG A 177 5.045 -19.781 9.030 1.00 0.00 N ATOM 0 H ARG A 177 9.556 -16.230 5.246 1.00 0.00 H new ATOM 0 HA ARG A 177 11.057 -17.950 7.015 1.00 0.00 H new ATOM 0 HB2 ARG A 177 8.921 -18.581 4.938 1.00 0.00 H new ATOM 0 HB3 ARG A 177 9.396 -19.581 6.296 1.00 0.00 H new ATOM 0 HG2 ARG A 177 8.215 -16.818 6.679 1.00 0.00 H new ATOM 0 HG3 ARG A 177 7.204 -18.236 6.477 1.00 0.00 H new ATOM 0 HD2 ARG A 177 9.011 -18.969 8.512 1.00 0.00 H new ATOM 0 HD3 ARG A 177 8.631 -17.293 8.856 1.00 0.00 H new ATOM 0 HE ARG A 177 6.516 -17.920 9.486 1.00 0.00 H new ATOM 0 HH11 ARG A 177 7.861 -20.669 7.696 1.00 0.00 H new ATOM 0 HH12 ARG A 177 6.369 -21.606 7.839 1.00 0.00 H new ATOM 0 HH21 ARG A 177 4.616 -18.979 9.492 1.00 0.00 H new ATOM 0 HH22 ARG A 177 4.502 -20.630 8.873 1.00 0.00 H new ATOM 2644 N ASP A 178 12.244 -19.482 5.251 1.00 0.00 N ATOM 2645 CA ASP A 178 13.185 -20.125 4.331 1.00 0.00 C ATOM 2646 C ASP A 178 12.519 -21.053 3.294 1.00 0.00 C ATOM 2647 O ASP A 178 13.214 -21.689 2.496 1.00 0.00 O ATOM 2648 CB ASP A 178 14.340 -20.779 5.126 1.00 0.00 C ATOM 2649 CG ASP A 178 14.408 -22.309 5.027 1.00 0.00 C ATOM 2650 OD1 ASP A 178 13.455 -23.000 5.451 1.00 0.00 O ATOM 2651 OD2 ASP A 178 15.405 -22.821 4.465 1.00 0.00 O ATOM 0 H ASP A 178 12.209 -19.925 6.169 1.00 0.00 H new ATOM 0 HA ASP A 178 13.621 -19.346 3.706 1.00 0.00 H new ATOM 0 HB2 ASP A 178 15.284 -20.364 4.774 1.00 0.00 H new ATOM 0 HB3 ASP A 178 14.242 -20.501 6.175 1.00 0.00 H new ATOM 2656 N ASN A 179 11.186 -21.127 3.262 1.00 0.00 N ATOM 2657 CA ASN A 179 10.418 -22.128 2.518 1.00 0.00 C ATOM 2658 C ASN A 179 9.658 -21.572 1.336 1.00 0.00 C ATOM 2659 O ASN A 179 9.115 -22.378 0.557 1.00 0.00 O ATOM 2660 CB ASN A 179 9.497 -22.878 3.492 1.00 0.00 C ATOM 2661 CG ASN A 179 8.347 -22.086 4.117 1.00 0.00 C ATOM 2662 OD1 ASN A 179 7.926 -20.957 3.571 1.00 0.00 O flip ATOM 2663 ND2 ASN A 179 7.809 -22.491 5.140 1.00 0.00 N flip ATOM 0 H ASN A 179 10.593 -20.471 3.770 1.00 0.00 H new ATOM 0 HA ASN A 179 11.131 -22.823 2.074 1.00 0.00 H new ATOM 0 HB2 ASN A 179 9.072 -23.732 2.965 1.00 0.00 H new ATOM 0 HB3 ASN A 179 10.112 -23.276 4.300 1.00 0.00 H new ATOM 0 HD21 ASN A 179 8.123 -23.360 5.572 1.00 0.00 H new ATOM 0 HD22 ASN A 179 7.047 -21.959 5.560 1.00 0.00 H new