USER MOD reduce.3.24.130724 H: found=0, std=0, add=727, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 726 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 72 ASN : amide:sc= 1.54 K(o=2.5,f=0.56) USER MOD Set 1.2: A 74 ASN : amide:sc= 0.97 K(o=2.5,f=0.56) USER MOD Set 2.1: A 27 THR OG1 : rot -154:sc= 1.09 USER MOD Set 2.2: A 29 HIS : no HE2:sc= 1.27 K(o=4.6,f=-1.1!) USER MOD Set 2.3: A 31 THR OG1 : rot -154:sc= 2.2 USER MOD Set 3.1: A 19 SER OG : rot -56:sc= 1.8 USER MOD Set 3.2: A 37 LYS NZ :NH3+ 168:sc= 2.39 (180deg=0.783) USER MOD Single : A 13 MET CE :methyl -159:sc= -0.08 (180deg=-0.336) USER MOD Single : A 15 SER OG : rot 180:sc= 0.007 USER MOD Single : A 17 LYS NZ :NH3+ -167:sc= 1.35 (180deg=0.898) USER MOD Single : A 22 LYS NZ :NH3+ 147:sc= 2.08 (180deg=0.671) USER MOD Single : A 24 MET CE :methyl -156:sc= -0.181 (180deg=-1.27) USER MOD Single : A 28 GLN : amide:sc= 0.386 K(o=0.39,f=-5.8!) USER MOD Single : A 32 THR OG1 : rot 136:sc= 0.614 USER MOD Single : A 35 LYS NZ :NH3+ 146:sc= 2.47 (180deg=0.168) USER MOD Single : A 38 TYR OH : rot 130:sc=-0.00552 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= 1.24 K(o=1.2,f=-0.72) USER MOD Single : A 56 LYS NZ :NH3+ -177:sc= 0.983 (180deg=0.98) USER MOD Single : A 58 LYS NZ :NH3+ -163:sc= 2.16 (180deg=1.41) USER MOD Single : A 65 SER OG : rot 180:sc= -0.159 USER MOD Single : A 66 SER OG : rot 16:sc= 1.21 USER MOD Single : A 67 THR OG1 : rot 33:sc= 1.12 USER MOD Single : A 73 THR OG1 : rot -142:sc= 1.39 USER MOD Single : A 75 SER OG : rot -8:sc= 1.06 USER MOD Single : A 77 THR OG1 : rot -146:sc= 1.31 USER MOD Single : A 78 ASN : amide:sc= 0.101 K(o=0.1,f=-1.1) USER MOD Single : A 88 SER OG : rot -54:sc= 1.23 USER MOD Single : A 89 TYR OH : rot -63:sc= 1.02 USER MOD Single : A 96 ASN : amide:sc= -0.0103 K(o=-0.01,f=-0.67) USER MOD Single : A 97 SER OG : rot 146:sc= 1.21 USER MOD Single : A 100 THR OG1 : rot 66:sc= 0.808 USER MOD Single : A 102 HIS : no HE2:sc= 0.127 K(o=0.13,f=-2.2!) USER MOD Single : A 106 LYS NZ :NH3+ -177:sc= 1.25 (180deg=1.16) USER MOD ----------------------------------------------------------------- ATOM 211 N MET A 13 -68.295 36.581 95.433 1.00 0.00 N ATOM 212 CA MET A 13 -67.385 37.233 96.387 1.00 0.00 C ATOM 213 C MET A 13 -65.950 36.683 96.433 1.00 0.00 C ATOM 214 O MET A 13 -65.044 37.334 95.922 1.00 0.00 O ATOM 215 CB MET A 13 -68.045 37.260 97.781 1.00 0.00 C ATOM 216 CG MET A 13 -68.859 38.534 98.040 1.00 0.00 C ATOM 217 SD MET A 13 -67.940 40.102 97.984 1.00 0.00 S ATOM 218 CE MET A 13 -66.550 39.760 99.100 1.00 0.00 C ATOM 0 HA MET A 13 -67.238 38.248 96.018 1.00 0.00 H new ATOM 0 HB2 MET A 13 -68.697 36.393 97.884 1.00 0.00 H new ATOM 0 HB3 MET A 13 -67.272 37.169 98.544 1.00 0.00 H new ATOM 0 HG2 MET A 13 -69.663 38.582 97.305 1.00 0.00 H new ATOM 0 HG3 MET A 13 -69.328 38.447 99.020 1.00 0.00 H new ATOM 0 HE1 MET A 13 -66.128 40.700 99.454 1.00 0.00 H new ATOM 0 HE2 MET A 13 -66.902 39.177 99.951 1.00 0.00 H new ATOM 0 HE3 MET A 13 -65.785 39.197 98.566 1.00 0.00 H new ATOM 228 N CYS A 14 -65.699 35.580 97.152 1.00 0.00 N ATOM 229 CA CYS A 14 -64.384 35.393 97.773 1.00 0.00 C ATOM 230 C CYS A 14 -63.248 34.962 96.830 1.00 0.00 C ATOM 231 O CYS A 14 -63.097 33.784 96.509 1.00 0.00 O ATOM 232 CB CYS A 14 -64.488 34.463 98.983 1.00 0.00 C ATOM 233 SG CYS A 14 -63.963 35.258 100.522 1.00 0.00 S ATOM 0 H CYS A 14 -66.367 34.826 97.314 1.00 0.00 H new ATOM 0 HA CYS A 14 -64.087 36.391 98.095 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -65.518 34.123 99.087 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -63.876 33.578 98.809 1.00 0.00 H new ATOM 238 N SER A 15 -62.388 35.918 96.463 1.00 0.00 N ATOM 239 CA SER A 15 -61.088 35.673 95.832 1.00 0.00 C ATOM 240 C SER A 15 -59.989 35.194 96.803 1.00 0.00 C ATOM 241 O SER A 15 -58.960 34.683 96.355 1.00 0.00 O ATOM 242 CB SER A 15 -60.634 36.950 95.119 1.00 0.00 C ATOM 243 OG SER A 15 -60.609 38.034 96.029 1.00 0.00 O ATOM 0 H SER A 15 -62.583 36.910 96.601 1.00 0.00 H new ATOM 0 HA SER A 15 -61.232 34.854 95.127 1.00 0.00 H new ATOM 0 HB2 SER A 15 -59.643 36.803 94.690 1.00 0.00 H new ATOM 0 HB3 SER A 15 -61.309 37.174 94.293 1.00 0.00 H new ATOM 0 HG SER A 15 -60.316 38.845 95.564 1.00 0.00 H new ATOM 249 N GLY A 16 -60.188 35.339 98.122 1.00 0.00 N ATOM 250 CA GLY A 16 -59.176 35.082 99.154 1.00 0.00 C ATOM 251 C GLY A 16 -59.183 33.663 99.741 1.00 0.00 C ATOM 252 O GLY A 16 -60.059 32.849 99.454 1.00 0.00 O ATOM 0 H GLY A 16 -61.081 35.646 98.509 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -58.191 35.277 98.730 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -59.320 35.794 99.966 1.00 0.00 H new ATOM 256 N LYS A 17 -58.176 33.383 100.580 1.00 0.00 N ATOM 257 CA LYS A 17 -57.856 32.075 101.184 1.00 0.00 C ATOM 258 C LYS A 17 -58.750 31.742 102.398 1.00 0.00 C ATOM 259 O LYS A 17 -59.231 32.642 103.090 1.00 0.00 O ATOM 260 CB LYS A 17 -56.355 32.105 101.566 1.00 0.00 C ATOM 261 CG LYS A 17 -55.526 30.873 101.140 1.00 0.00 C ATOM 262 CD LYS A 17 -55.561 29.664 102.087 1.00 0.00 C ATOM 263 CE LYS A 17 -54.943 30.016 103.446 1.00 0.00 C ATOM 264 NZ LYS A 17 -55.216 29.001 104.486 1.00 0.00 N ATOM 0 H LYS A 17 -57.520 34.106 100.876 1.00 0.00 H new ATOM 0 HA LYS A 17 -58.055 31.280 100.465 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -55.905 32.993 101.122 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -56.277 32.215 102.648 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -55.875 30.549 100.160 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -54.488 31.184 101.022 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -56.591 29.335 102.225 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -55.018 28.831 101.641 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -53.865 30.129 103.330 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -55.331 30.980 103.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -54.971 29.387 105.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -56.225 28.749 104.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -54.644 28.152 104.301 1.00 0.00 H new ATOM 278 N PHE A 18 -58.903 30.446 102.695 1.00 0.00 N ATOM 279 CA PHE A 18 -59.729 29.864 103.769 1.00 0.00 C ATOM 280 C PHE A 18 -58.937 28.849 104.623 1.00 0.00 C ATOM 281 O PHE A 18 -57.867 28.404 104.205 1.00 0.00 O ATOM 282 CB PHE A 18 -60.934 29.162 103.113 1.00 0.00 C ATOM 283 CG PHE A 18 -61.956 30.079 102.478 1.00 0.00 C ATOM 284 CD1 PHE A 18 -61.754 30.575 101.176 1.00 0.00 C ATOM 285 CD2 PHE A 18 -63.115 30.433 103.191 1.00 0.00 C ATOM 286 CE1 PHE A 18 -62.681 31.466 100.613 1.00 0.00 C ATOM 287 CE2 PHE A 18 -64.033 31.337 102.639 1.00 0.00 C ATOM 288 CZ PHE A 18 -63.808 31.859 101.354 1.00 0.00 C ATOM 0 H PHE A 18 -58.422 29.725 102.158 1.00 0.00 H new ATOM 0 HA PHE A 18 -60.052 30.662 104.437 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -60.562 28.477 102.350 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -61.435 28.556 103.868 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -60.886 30.270 100.610 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -63.298 30.007 104.166 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -62.529 31.848 99.614 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -64.909 31.631 103.198 1.00 0.00 H new ATOM 0 HZ PHE A 18 -64.506 32.567 100.933 1.00 0.00 H new ATOM 298 N SER A 19 -59.484 28.420 105.771 1.00 0.00 N ATOM 299 CA SER A 19 -59.049 27.234 106.529 1.00 0.00 C ATOM 300 C SER A 19 -60.027 26.076 106.327 1.00 0.00 C ATOM 301 O SER A 19 -61.244 26.274 106.400 1.00 0.00 O ATOM 302 CB SER A 19 -59.000 27.453 108.050 1.00 0.00 C ATOM 303 OG SER A 19 -58.488 28.703 108.459 1.00 0.00 O ATOM 0 H SER A 19 -60.266 28.904 106.212 1.00 0.00 H new ATOM 0 HA SER A 19 -58.049 27.023 106.150 1.00 0.00 H new ATOM 0 HB2 SER A 19 -60.008 27.342 108.450 1.00 0.00 H new ATOM 0 HB3 SER A 19 -58.392 26.666 108.495 1.00 0.00 H new ATOM 0 HG SER A 19 -57.591 28.828 108.084 1.00 0.00 H new ATOM 309 N ILE A 20 -59.496 24.858 106.158 1.00 0.00 N ATOM 310 CA ILE A 20 -60.247 23.618 106.367 1.00 0.00 C ATOM 311 C ILE A 20 -60.376 23.395 107.881 1.00 0.00 C ATOM 312 O ILE A 20 -59.579 22.719 108.523 1.00 0.00 O ATOM 313 CB ILE A 20 -59.644 22.438 105.563 1.00 0.00 C ATOM 314 CG1 ILE A 20 -60.410 21.118 105.800 1.00 0.00 C ATOM 315 CG2 ILE A 20 -58.137 22.206 105.784 1.00 0.00 C ATOM 316 CD1 ILE A 20 -61.870 21.176 105.340 1.00 0.00 C ATOM 0 H ILE A 20 -58.529 24.707 105.871 1.00 0.00 H new ATOM 0 HA ILE A 20 -61.258 23.692 105.966 1.00 0.00 H new ATOM 0 HB ILE A 20 -59.763 22.748 104.525 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -59.902 20.311 105.273 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -60.380 20.874 106.862 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -57.807 21.361 105.180 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -57.585 23.099 105.491 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -57.952 21.994 106.837 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -62.351 20.218 105.535 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -62.392 21.962 105.886 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -61.907 21.390 104.272 1.00 0.00 H new ATOM 328 N ASP A 21 -61.363 24.071 108.467 1.00 0.00 N ATOM 329 CA ASP A 21 -61.565 24.191 109.909 1.00 0.00 C ATOM 330 C ASP A 21 -62.184 22.924 110.534 1.00 0.00 C ATOM 331 O ASP A 21 -62.141 22.746 111.751 1.00 0.00 O ATOM 332 CB ASP A 21 -62.418 25.444 110.145 1.00 0.00 C ATOM 333 CG ASP A 21 -62.153 26.084 111.508 1.00 0.00 C ATOM 334 OD1 ASP A 21 -61.211 26.908 111.563 1.00 0.00 O ATOM 335 OD2 ASP A 21 -62.895 25.766 112.466 1.00 0.00 O ATOM 0 H ASP A 21 -62.071 24.570 107.928 1.00 0.00 H new ATOM 0 HA ASP A 21 -60.603 24.293 110.412 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -62.214 26.172 109.360 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -63.473 25.181 110.070 1.00 0.00 H new ATOM 340 N LYS A 22 -62.731 22.018 109.711 1.00 0.00 N ATOM 341 CA LYS A 22 -62.873 20.591 110.024 1.00 0.00 C ATOM 342 C LYS A 22 -62.889 19.765 108.737 1.00 0.00 C ATOM 343 O LYS A 22 -63.580 20.130 107.784 1.00 0.00 O ATOM 344 CB LYS A 22 -64.147 20.309 110.847 1.00 0.00 C ATOM 345 CG LYS A 22 -63.997 18.981 111.608 1.00 0.00 C ATOM 346 CD LYS A 22 -65.268 18.491 112.318 1.00 0.00 C ATOM 347 CE LYS A 22 -66.411 18.041 111.392 1.00 0.00 C ATOM 348 NZ LYS A 22 -65.996 16.977 110.450 1.00 0.00 N ATOM 0 H LYS A 22 -63.094 22.263 108.790 1.00 0.00 H new ATOM 0 HA LYS A 22 -62.014 20.301 110.629 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -64.323 21.123 111.550 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -65.014 20.264 110.187 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -63.672 18.213 110.907 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -63.205 19.092 112.349 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -65.002 17.658 112.969 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -65.637 19.292 112.959 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -67.243 17.681 111.997 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -66.775 18.899 110.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -66.799 16.342 110.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -65.684 17.407 109.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -65.212 16.433 110.864 1.00 0.00 H new ATOM 362 N GLU A 23 -62.177 18.635 108.776 1.00 0.00 N ATOM 363 CA GLU A 23 -62.231 17.501 107.841 1.00 0.00 C ATOM 364 C GLU A 23 -63.660 17.012 107.549 1.00 0.00 C ATOM 365 O GLU A 23 -64.617 17.414 108.213 1.00 0.00 O ATOM 366 CB GLU A 23 -61.327 16.368 108.383 1.00 0.00 C ATOM 367 CG GLU A 23 -61.476 15.983 109.874 1.00 0.00 C ATOM 368 CD GLU A 23 -62.722 15.145 110.197 1.00 0.00 C ATOM 369 OE1 GLU A 23 -62.672 13.923 109.937 1.00 0.00 O ATOM 370 OE2 GLU A 23 -63.713 15.709 110.714 1.00 0.00 O ATOM 0 H GLU A 23 -61.495 18.474 109.517 1.00 0.00 H new ATOM 0 HA GLU A 23 -61.857 17.840 106.875 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -61.513 15.475 107.786 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -60.290 16.656 108.212 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -60.591 15.427 110.182 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -61.503 16.895 110.470 1.00 0.00 H new ATOM 377 N MET A 24 -63.831 16.151 106.542 1.00 0.00 N ATOM 378 CA MET A 24 -65.167 15.711 106.129 1.00 0.00 C ATOM 379 C MET A 24 -65.725 14.564 106.982 1.00 0.00 C ATOM 380 O MET A 24 -65.051 13.563 107.233 1.00 0.00 O ATOM 381 CB MET A 24 -65.124 15.341 104.646 1.00 0.00 C ATOM 382 CG MET A 24 -65.560 16.535 103.813 1.00 0.00 C ATOM 383 SD MET A 24 -65.175 16.452 102.055 1.00 0.00 S ATOM 384 CE MET A 24 -63.370 16.594 102.157 1.00 0.00 C ATOM 0 H MET A 24 -63.067 15.747 106.001 1.00 0.00 H new ATOM 0 HA MET A 24 -65.858 16.539 106.288 1.00 0.00 H new ATOM 0 HB2 MET A 24 -64.116 15.037 104.365 1.00 0.00 H new ATOM 0 HB3 MET A 24 -65.779 14.491 104.453 1.00 0.00 H new ATOM 0 HG2 MET A 24 -66.638 16.656 103.924 1.00 0.00 H new ATOM 0 HG3 MET A 24 -65.094 17.430 104.225 1.00 0.00 H new ATOM 0 HE1 MET A 24 -62.982 16.983 101.216 1.00 0.00 H new ATOM 0 HE2 MET A 24 -63.104 17.272 102.968 1.00 0.00 H new ATOM 0 HE3 MET A 24 -62.938 15.612 102.349 1.00 0.00 H new ATOM 394 N ALA A 25 -66.995 14.690 107.382 1.00 0.00 N ATOM 395 CA ALA A 25 -67.745 13.673 108.121 1.00 0.00 C ATOM 396 C ALA A 25 -69.062 13.346 107.402 1.00 0.00 C ATOM 397 O ALA A 25 -69.872 14.242 107.163 1.00 0.00 O ATOM 398 CB ALA A 25 -67.972 14.166 109.554 1.00 0.00 C ATOM 0 H ALA A 25 -67.544 15.529 107.194 1.00 0.00 H new ATOM 0 HA ALA A 25 -67.175 12.745 108.165 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -68.530 13.415 110.113 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -67.010 14.337 110.037 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -68.538 15.097 109.533 1.00 0.00 H new ATOM 404 N GLU A 26 -69.254 12.073 107.026 1.00 0.00 N ATOM 405 CA GLU A 26 -70.414 11.636 106.241 1.00 0.00 C ATOM 406 C GLU A 26 -71.670 11.363 107.080 1.00 0.00 C ATOM 407 O GLU A 26 -71.603 11.102 108.281 1.00 0.00 O ATOM 408 CB GLU A 26 -70.059 10.406 105.381 1.00 0.00 C ATOM 409 CG GLU A 26 -70.604 10.598 103.955 1.00 0.00 C ATOM 410 CD GLU A 26 -70.111 9.551 102.970 1.00 0.00 C ATOM 411 OE1 GLU A 26 -70.617 8.414 103.053 1.00 0.00 O ATOM 412 OE2 GLU A 26 -69.256 9.872 102.111 1.00 0.00 O ATOM 0 H GLU A 26 -68.608 11.319 107.259 1.00 0.00 H new ATOM 0 HA GLU A 26 -70.665 12.475 105.592 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -68.978 10.269 105.353 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -70.483 9.505 105.825 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -71.693 10.573 103.985 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -70.318 11.586 103.596 1.00 0.00 H new ATOM 419 N THR A 27 -72.824 11.379 106.409 1.00 0.00 N ATOM 420 CA THR A 27 -74.158 11.197 106.983 1.00 0.00 C ATOM 421 C THR A 27 -74.796 9.869 106.540 1.00 0.00 C ATOM 422 O THR A 27 -74.343 9.207 105.599 1.00 0.00 O ATOM 423 CB THR A 27 -75.060 12.379 106.571 1.00 0.00 C ATOM 424 OG1 THR A 27 -75.283 12.311 105.184 1.00 0.00 O ATOM 425 CG2 THR A 27 -74.490 13.760 106.909 1.00 0.00 C ATOM 0 H THR A 27 -72.854 11.527 105.400 1.00 0.00 H new ATOM 0 HA THR A 27 -74.057 11.166 108.068 1.00 0.00 H new ATOM 0 HB THR A 27 -75.981 12.279 107.146 1.00 0.00 H new ATOM 0 HG1 THR A 27 -75.468 13.209 104.838 1.00 0.00 H new ATOM 0 HG21 THR A 27 -75.189 14.531 106.585 1.00 0.00 H new ATOM 0 HG22 THR A 27 -74.338 13.837 107.986 1.00 0.00 H new ATOM 0 HG23 THR A 27 -73.537 13.895 106.398 1.00 0.00 H new ATOM 433 N GLN A 28 -75.915 9.500 107.179 1.00 0.00 N ATOM 434 CA GLN A 28 -76.831 8.457 106.693 1.00 0.00 C ATOM 435 C GLN A 28 -77.592 8.892 105.423 1.00 0.00 C ATOM 436 O GLN A 28 -77.908 8.049 104.589 1.00 0.00 O ATOM 437 CB GLN A 28 -77.795 7.980 107.804 1.00 0.00 C ATOM 438 CG GLN A 28 -78.256 9.008 108.857 1.00 0.00 C ATOM 439 CD GLN A 28 -78.840 10.283 108.262 1.00 0.00 C ATOM 440 OE1 GLN A 28 -78.113 11.194 107.893 1.00 0.00 O ATOM 441 NE2 GLN A 28 -80.146 10.392 108.123 1.00 0.00 N ATOM 0 H GLN A 28 -76.214 9.922 108.058 1.00 0.00 H new ATOM 0 HA GLN A 28 -76.214 7.604 106.411 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -78.685 7.575 107.322 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -77.314 7.156 108.331 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -79.003 8.544 109.501 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -77.408 9.270 109.490 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -80.756 9.634 108.429 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -80.546 11.234 107.709 1.00 0.00 H new ATOM 450 N HIS A 29 -77.795 10.201 105.226 1.00 0.00 N ATOM 451 CA HIS A 29 -78.203 10.825 103.962 1.00 0.00 C ATOM 452 C HIS A 29 -77.141 10.646 102.850 1.00 0.00 C ATOM 453 O HIS A 29 -77.424 10.877 101.677 1.00 0.00 O ATOM 454 CB HIS A 29 -78.535 12.304 104.268 1.00 0.00 C ATOM 455 CG HIS A 29 -79.006 13.171 103.124 1.00 0.00 C ATOM 456 ND1 HIS A 29 -78.779 14.527 102.999 1.00 0.00 N ATOM 457 CD2 HIS A 29 -79.798 12.789 102.073 1.00 0.00 C ATOM 458 CE1 HIS A 29 -79.417 14.944 101.893 1.00 0.00 C ATOM 459 NE2 HIS A 29 -80.050 13.922 101.296 1.00 0.00 N ATOM 0 H HIS A 29 -77.674 10.882 105.975 1.00 0.00 H new ATOM 0 HA HIS A 29 -79.089 10.334 103.559 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -79.304 12.322 105.040 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -77.644 12.766 104.694 1.00 0.00 H new ATOM 0 HD1 HIS A 29 -78.227 15.107 103.631 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -80.162 11.791 101.880 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -79.420 15.962 101.533 1.00 0.00 H new ATOM 467 N GLY A 30 -75.922 10.193 103.186 1.00 0.00 N ATOM 468 CA GLY A 30 -74.831 9.933 102.249 1.00 0.00 C ATOM 469 C GLY A 30 -74.125 11.197 101.756 1.00 0.00 C ATOM 470 O GLY A 30 -73.255 11.102 100.893 1.00 0.00 O ATOM 0 H GLY A 30 -75.666 9.993 104.153 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -74.099 9.284 102.729 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -75.224 9.389 101.390 1.00 0.00 H new ATOM 474 N THR A 31 -74.517 12.368 102.253 1.00 0.00 N ATOM 475 CA THR A 31 -73.805 13.643 102.152 1.00 0.00 C ATOM 476 C THR A 31 -72.626 13.680 103.122 1.00 0.00 C ATOM 477 O THR A 31 -72.560 12.889 104.059 1.00 0.00 O ATOM 478 CB THR A 31 -74.760 14.789 102.520 1.00 0.00 C ATOM 479 OG1 THR A 31 -75.433 14.492 103.734 1.00 0.00 O ATOM 480 CG2 THR A 31 -75.778 15.033 101.408 1.00 0.00 C ATOM 0 H THR A 31 -75.393 12.459 102.768 1.00 0.00 H new ATOM 0 HA THR A 31 -73.441 13.752 101.130 1.00 0.00 H new ATOM 0 HB THR A 31 -74.168 15.695 102.648 1.00 0.00 H new ATOM 0 HG1 THR A 31 -76.289 14.969 103.759 1.00 0.00 H new ATOM 0 HG21 THR A 31 -76.441 15.849 101.695 1.00 0.00 H new ATOM 0 HG22 THR A 31 -75.256 15.296 100.488 1.00 0.00 H new ATOM 0 HG23 THR A 31 -76.364 14.128 101.247 1.00 0.00 H new ATOM 488 N THR A 32 -71.713 14.636 102.950 1.00 0.00 N ATOM 489 CA THR A 32 -70.606 14.886 103.874 1.00 0.00 C ATOM 490 C THR A 32 -70.597 16.338 104.333 1.00 0.00 C ATOM 491 O THR A 32 -71.014 17.232 103.595 1.00 0.00 O ATOM 492 CB THR A 32 -69.278 14.423 103.261 1.00 0.00 C ATOM 493 OG1 THR A 32 -68.312 14.336 104.277 1.00 0.00 O ATOM 494 CG2 THR A 32 -68.744 15.313 102.137 1.00 0.00 C ATOM 0 H THR A 32 -71.722 15.270 102.151 1.00 0.00 H new ATOM 0 HA THR A 32 -70.748 14.291 104.776 1.00 0.00 H new ATOM 0 HB THR A 32 -69.480 13.455 102.803 1.00 0.00 H new ATOM 0 HG1 THR A 32 -67.805 13.503 104.176 1.00 0.00 H new ATOM 0 HG21 THR A 32 -67.803 14.906 101.767 1.00 0.00 H new ATOM 0 HG22 THR A 32 -69.469 15.347 101.324 1.00 0.00 H new ATOM 0 HG23 THR A 32 -68.579 16.321 102.518 1.00 0.00 H new ATOM 502 N VAL A 33 -70.160 16.570 105.574 1.00 0.00 N ATOM 503 CA VAL A 33 -70.237 17.868 106.249 1.00 0.00 C ATOM 504 C VAL A 33 -68.825 18.398 106.490 1.00 0.00 C ATOM 505 O VAL A 33 -68.011 17.742 107.145 1.00 0.00 O ATOM 506 CB VAL A 33 -71.071 17.790 107.545 1.00 0.00 C ATOM 507 CG1 VAL A 33 -71.313 19.199 108.111 1.00 0.00 C ATOM 508 CG2 VAL A 33 -72.445 17.143 107.306 1.00 0.00 C ATOM 0 H VAL A 33 -69.733 15.844 106.150 1.00 0.00 H new ATOM 0 HA VAL A 33 -70.760 18.575 105.605 1.00 0.00 H new ATOM 0 HB VAL A 33 -70.501 17.180 108.246 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -71.903 19.128 109.025 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -70.356 19.671 108.332 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -71.852 19.798 107.377 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -72.999 17.108 108.244 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -73.002 17.731 106.577 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -72.309 16.130 106.927 1.00 0.00 H new ATOM 518 N VAL A 34 -68.549 19.582 105.932 1.00 0.00 N ATOM 519 CA VAL A 34 -67.233 20.241 105.904 1.00 0.00 C ATOM 520 C VAL A 34 -67.319 21.560 106.665 1.00 0.00 C ATOM 521 O VAL A 34 -68.256 22.316 106.414 1.00 0.00 O ATOM 522 CB VAL A 34 -66.782 20.547 104.451 1.00 0.00 C ATOM 523 CG1 VAL A 34 -65.249 20.564 104.391 1.00 0.00 C ATOM 524 CG2 VAL A 34 -67.341 19.583 103.396 1.00 0.00 C ATOM 0 H VAL A 34 -69.268 20.135 105.465 1.00 0.00 H new ATOM 0 HA VAL A 34 -66.509 19.567 106.363 1.00 0.00 H new ATOM 0 HB VAL A 34 -67.195 21.524 104.199 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -64.927 20.779 103.372 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -64.867 21.334 105.062 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -64.862 19.592 104.697 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -66.975 19.871 102.410 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -67.015 18.568 103.622 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -68.430 19.625 103.405 1.00 0.00 H new ATOM 534 N LYS A 35 -66.364 21.874 107.557 1.00 0.00 N ATOM 535 CA LYS A 35 -66.333 23.179 108.243 1.00 0.00 C ATOM 536 C LYS A 35 -65.258 24.071 107.623 1.00 0.00 C ATOM 537 O LYS A 35 -64.073 23.745 107.694 1.00 0.00 O ATOM 538 CB LYS A 35 -66.158 23.026 109.765 1.00 0.00 C ATOM 539 CG LYS A 35 -66.787 24.195 110.548 1.00 0.00 C ATOM 540 CD LYS A 35 -65.988 24.628 111.787 1.00 0.00 C ATOM 541 CE LYS A 35 -65.622 23.512 112.776 1.00 0.00 C ATOM 542 NZ LYS A 35 -64.226 23.649 113.265 1.00 0.00 N ATOM 0 H LYS A 35 -65.605 21.245 107.820 1.00 0.00 H new ATOM 0 HA LYS A 35 -67.298 23.665 108.100 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -66.612 22.089 110.088 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -65.096 22.963 110.002 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -66.891 25.050 109.880 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -67.792 23.910 110.859 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -65.067 25.106 111.452 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -66.564 25.384 112.320 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -66.308 23.536 113.622 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -65.745 22.543 112.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -64.171 23.326 114.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -63.593 23.071 112.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -63.935 24.646 113.210 1.00 0.00 H new ATOM 556 N VAL A 36 -65.666 25.186 107.013 1.00 0.00 N ATOM 557 CA VAL A 36 -64.744 26.232 106.546 1.00 0.00 C ATOM 558 C VAL A 36 -64.492 27.251 107.665 1.00 0.00 C ATOM 559 O VAL A 36 -65.323 27.408 108.561 1.00 0.00 O ATOM 560 CB VAL A 36 -65.251 26.944 105.262 1.00 0.00 C ATOM 561 CG1 VAL A 36 -65.977 25.984 104.311 1.00 0.00 C ATOM 562 CG2 VAL A 36 -66.174 28.145 105.517 1.00 0.00 C ATOM 0 H VAL A 36 -66.647 25.393 106.827 1.00 0.00 H new ATOM 0 HA VAL A 36 -63.806 25.743 106.284 1.00 0.00 H new ATOM 0 HB VAL A 36 -64.334 27.315 104.805 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -66.312 26.530 103.429 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -65.297 25.188 104.008 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -66.839 25.551 104.819 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -66.478 28.579 104.564 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -67.057 27.815 106.064 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -65.642 28.894 106.104 1.00 0.00 H new ATOM 572 N LYS A 37 -63.410 28.022 107.528 1.00 0.00 N ATOM 573 CA LYS A 37 -63.218 29.360 108.107 1.00 0.00 C ATOM 574 C LYS A 37 -62.646 30.252 107.006 1.00 0.00 C ATOM 575 O LYS A 37 -61.831 29.760 106.228 1.00 0.00 O ATOM 576 CB LYS A 37 -62.230 29.266 109.280 1.00 0.00 C ATOM 577 CG LYS A 37 -62.130 30.549 110.124 1.00 0.00 C ATOM 578 CD LYS A 37 -60.687 31.008 110.395 1.00 0.00 C ATOM 579 CE LYS A 37 -59.937 30.239 111.488 1.00 0.00 C ATOM 580 NZ LYS A 37 -59.524 28.882 111.066 1.00 0.00 N ATOM 0 H LYS A 37 -62.603 27.718 106.984 1.00 0.00 H new ATOM 0 HA LYS A 37 -64.157 29.770 108.479 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -62.529 28.441 109.927 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -61.242 29.023 108.890 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -62.666 31.350 109.614 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -62.633 30.385 111.077 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -60.120 30.929 109.467 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -60.706 32.063 110.668 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -59.054 30.806 111.781 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -60.573 30.161 112.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -58.854 28.492 111.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -60.361 28.267 111.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -59.066 28.933 110.133 1.00 0.00 H new ATOM 594 N TYR A 38 -63.025 31.529 106.904 1.00 0.00 N ATOM 595 CA TYR A 38 -62.301 32.432 105.998 1.00 0.00 C ATOM 596 C TYR A 38 -60.979 32.893 106.634 1.00 0.00 C ATOM 597 O TYR A 38 -60.850 32.910 107.854 1.00 0.00 O ATOM 598 CB TYR A 38 -63.204 33.596 105.563 1.00 0.00 C ATOM 599 CG TYR A 38 -62.581 34.541 104.548 1.00 0.00 C ATOM 600 CD1 TYR A 38 -61.962 34.023 103.393 1.00 0.00 C ATOM 601 CD2 TYR A 38 -62.620 35.936 104.744 1.00 0.00 C ATOM 602 CE1 TYR A 38 -61.373 34.884 102.458 1.00 0.00 C ATOM 603 CE2 TYR A 38 -62.058 36.808 103.792 1.00 0.00 C ATOM 604 CZ TYR A 38 -61.431 36.277 102.643 1.00 0.00 C ATOM 605 OH TYR A 38 -60.889 37.094 101.701 1.00 0.00 O ATOM 0 H TYR A 38 -63.799 31.952 107.416 1.00 0.00 H new ATOM 0 HA TYR A 38 -62.032 31.893 105.090 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -64.122 33.187 105.142 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -63.486 34.169 106.447 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -61.942 32.956 103.228 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -63.085 36.339 105.632 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -60.873 34.477 101.592 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -62.106 37.877 103.939 1.00 0.00 H new ATOM 0 HH TYR A 38 -61.539 37.784 101.453 1.00 0.00 H new ATOM 615 N GLU A 39 -59.991 33.273 105.818 1.00 0.00 N ATOM 616 CA GLU A 39 -58.719 33.838 106.282 1.00 0.00 C ATOM 617 C GLU A 39 -58.440 35.168 105.579 1.00 0.00 C ATOM 618 O GLU A 39 -58.382 36.201 106.249 1.00 0.00 O ATOM 619 CB GLU A 39 -57.558 32.846 106.084 1.00 0.00 C ATOM 620 CG GLU A 39 -57.628 31.647 107.039 1.00 0.00 C ATOM 621 CD GLU A 39 -56.519 30.619 106.774 1.00 0.00 C ATOM 622 OE1 GLU A 39 -55.437 30.978 106.264 1.00 0.00 O ATOM 623 OE2 GLU A 39 -56.766 29.412 107.009 1.00 0.00 O ATOM 0 H GLU A 39 -60.053 33.196 104.803 1.00 0.00 H new ATOM 0 HA GLU A 39 -58.801 34.027 107.352 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -57.566 32.486 105.055 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -56.612 33.367 106.232 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -57.553 32.001 108.067 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -58.599 31.163 106.939 1.00 0.00 H new ATOM 630 N GLY A 40 -58.297 35.117 104.247 1.00 0.00 N ATOM 631 CA GLY A 40 -57.663 36.087 103.351 1.00 0.00 C ATOM 632 C GLY A 40 -57.675 37.564 103.753 1.00 0.00 C ATOM 633 O GLY A 40 -56.611 38.175 103.820 1.00 0.00 O ATOM 0 H GLY A 40 -58.657 34.319 103.723 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -56.623 35.787 103.219 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -58.145 36.004 102.377 1.00 0.00 H new ATOM 637 N ALA A 41 -58.862 38.159 103.926 1.00 0.00 N ATOM 638 CA ALA A 41 -59.041 39.617 103.908 1.00 0.00 C ATOM 639 C ALA A 41 -59.957 40.176 105.015 1.00 0.00 C ATOM 640 O ALA A 41 -60.440 41.302 104.898 1.00 0.00 O ATOM 641 CB ALA A 41 -59.524 40.024 102.508 1.00 0.00 C ATOM 0 H ALA A 41 -59.727 37.642 104.083 1.00 0.00 H new ATOM 0 HA ALA A 41 -58.073 40.066 104.131 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -59.664 41.104 102.471 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -58.781 39.729 101.767 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -60.470 39.528 102.291 1.00 0.00 H new ATOM 647 N GLY A 42 -60.259 39.408 106.069 1.00 0.00 N ATOM 648 CA GLY A 42 -61.076 39.859 107.206 1.00 0.00 C ATOM 649 C GLY A 42 -62.588 39.835 106.939 1.00 0.00 C ATOM 650 O GLY A 42 -63.362 39.384 107.783 1.00 0.00 O ATOM 0 H GLY A 42 -59.940 38.443 106.159 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -60.860 39.228 108.068 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -60.781 40.874 107.472 1.00 0.00 H new ATOM 654 N ALA A 43 -62.982 40.346 105.770 1.00 0.00 N ATOM 655 CA ALA A 43 -64.344 40.625 105.323 1.00 0.00 C ATOM 656 C ALA A 43 -65.294 39.401 105.270 1.00 0.00 C ATOM 657 O ALA A 43 -64.836 38.257 105.237 1.00 0.00 O ATOM 658 CB ALA A 43 -64.210 41.261 103.932 1.00 0.00 C ATOM 0 H ALA A 43 -62.298 40.595 105.055 1.00 0.00 H new ATOM 0 HA ALA A 43 -64.815 41.280 106.056 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -65.201 41.494 103.542 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -63.624 42.177 104.006 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -63.710 40.564 103.260 1.00 0.00 H new ATOM 664 N PRO A 44 -66.626 39.628 105.208 1.00 0.00 N ATOM 665 CA PRO A 44 -67.591 38.607 104.800 1.00 0.00 C ATOM 666 C PRO A 44 -67.436 38.211 103.323 1.00 0.00 C ATOM 667 O PRO A 44 -66.919 38.981 102.515 1.00 0.00 O ATOM 668 CB PRO A 44 -68.987 39.214 105.010 1.00 0.00 C ATOM 669 CG PRO A 44 -68.758 40.596 105.620 1.00 0.00 C ATOM 670 CD PRO A 44 -67.289 40.909 105.383 1.00 0.00 C ATOM 0 HA PRO A 44 -67.431 37.704 105.389 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -69.526 39.289 104.066 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -69.588 38.590 105.672 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -69.399 41.343 105.151 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -68.993 40.598 106.684 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -67.162 41.537 104.501 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -66.866 41.455 106.227 1.00 0.00 H new ATOM 678 N CYS A 45 -67.984 37.048 102.959 1.00 0.00 N ATOM 679 CA CYS A 45 -68.069 36.536 101.590 1.00 0.00 C ATOM 680 C CYS A 45 -69.219 35.527 101.445 1.00 0.00 C ATOM 681 O CYS A 45 -69.499 34.804 102.398 1.00 0.00 O ATOM 682 CB CYS A 45 -66.770 35.775 101.287 1.00 0.00 C ATOM 683 SG CYS A 45 -65.323 36.738 100.809 1.00 0.00 S ATOM 0 H CYS A 45 -68.398 36.411 103.640 1.00 0.00 H new ATOM 0 HA CYS A 45 -68.232 37.377 100.916 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -66.508 35.194 102.171 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -66.977 35.063 100.488 1.00 0.00 H new ATOM 688 N LYS A 46 -69.764 35.331 100.229 1.00 0.00 N ATOM 689 CA LYS A 46 -70.184 33.978 99.818 1.00 0.00 C ATOM 690 C LYS A 46 -68.942 33.183 99.411 1.00 0.00 C ATOM 691 O LYS A 46 -68.050 33.749 98.766 1.00 0.00 O ATOM 692 CB LYS A 46 -71.305 33.972 98.767 1.00 0.00 C ATOM 693 CG LYS A 46 -70.910 34.061 97.277 1.00 0.00 C ATOM 694 CD LYS A 46 -71.139 32.755 96.493 1.00 0.00 C ATOM 695 CE LYS A 46 -72.621 32.349 96.418 1.00 0.00 C ATOM 696 NZ LYS A 46 -73.435 33.241 95.555 1.00 0.00 N ATOM 0 H LYS A 46 -69.920 36.063 99.536 1.00 0.00 H new ATOM 0 HA LYS A 46 -70.649 33.479 100.668 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -71.884 33.059 98.904 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -71.970 34.807 98.985 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -71.482 34.861 96.807 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -69.858 34.337 97.206 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -70.749 32.872 95.482 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -70.572 31.952 96.963 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -72.692 31.329 96.042 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -73.041 32.347 97.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -74.422 32.912 95.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -73.396 34.212 95.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -73.058 33.225 94.586 1.00 0.00 H new ATOM 710 N VAL A 47 -68.853 31.913 99.818 1.00 0.00 N ATOM 711 CA VAL A 47 -67.610 31.137 99.680 1.00 0.00 C ATOM 712 C VAL A 47 -67.675 30.220 98.453 1.00 0.00 C ATOM 713 O VAL A 47 -68.709 29.588 98.222 1.00 0.00 O ATOM 714 CB VAL A 47 -67.100 30.460 100.980 1.00 0.00 C ATOM 715 CG1 VAL A 47 -67.784 30.929 102.266 1.00 0.00 C ATOM 716 CG2 VAL A 47 -67.049 28.934 100.997 1.00 0.00 C ATOM 0 H VAL A 47 -69.623 31.399 100.245 1.00 0.00 H new ATOM 0 HA VAL A 47 -66.815 31.859 99.493 1.00 0.00 H new ATOM 0 HB VAL A 47 -66.070 30.816 100.961 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -67.359 30.399 103.118 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -67.628 32.001 102.391 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -68.853 30.722 102.206 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -66.675 28.593 101.962 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -68.050 28.535 100.834 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -66.385 28.583 100.207 1.00 0.00 H new ATOM 726 N PRO A 48 -66.615 30.165 97.624 1.00 0.00 N ATOM 727 CA PRO A 48 -66.632 29.450 96.354 1.00 0.00 C ATOM 728 C PRO A 48 -66.383 27.958 96.610 1.00 0.00 C ATOM 729 O PRO A 48 -65.244 27.568 96.852 1.00 0.00 O ATOM 730 CB PRO A 48 -65.533 30.102 95.490 1.00 0.00 C ATOM 731 CG PRO A 48 -64.900 31.168 96.388 1.00 0.00 C ATOM 732 CD PRO A 48 -65.298 30.758 97.793 1.00 0.00 C ATOM 0 HA PRO A 48 -67.590 29.514 95.837 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -64.795 29.367 95.170 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -65.953 30.546 94.587 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -63.816 31.193 96.273 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -65.270 32.164 96.144 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -64.590 30.045 98.217 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -65.329 31.615 98.466 1.00 0.00 H new ATOM 740 N ILE A 49 -67.444 27.140 96.610 1.00 0.00 N ATOM 741 CA ILE A 49 -67.359 25.690 96.849 1.00 0.00 C ATOM 742 C ILE A 49 -67.704 24.904 95.586 1.00 0.00 C ATOM 743 O ILE A 49 -68.804 25.024 95.048 1.00 0.00 O ATOM 744 CB ILE A 49 -68.209 25.245 98.064 1.00 0.00 C ATOM 745 CG1 ILE A 49 -67.640 25.942 99.320 1.00 0.00 C ATOM 746 CG2 ILE A 49 -68.232 23.708 98.208 1.00 0.00 C ATOM 747 CD1 ILE A 49 -67.950 25.320 100.691 1.00 0.00 C ATOM 0 H ILE A 49 -68.395 27.468 96.443 1.00 0.00 H new ATOM 0 HA ILE A 49 -66.324 25.463 97.103 1.00 0.00 H new ATOM 0 HB ILE A 49 -69.249 25.541 97.924 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -66.556 25.992 99.213 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -68.007 26.968 99.328 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -68.838 23.432 99.071 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -68.659 23.265 97.308 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -67.215 23.340 98.346 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -67.485 25.918 101.475 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -69.029 25.296 100.844 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -67.556 24.304 100.727 1.00 0.00 H new ATOM 759 N GLU A 50 -66.775 24.038 95.180 1.00 0.00 N ATOM 760 CA GLU A 50 -66.998 22.969 94.208 1.00 0.00 C ATOM 761 C GLU A 50 -66.620 21.610 94.817 1.00 0.00 C ATOM 762 O GLU A 50 -65.812 21.536 95.745 1.00 0.00 O ATOM 763 CB GLU A 50 -66.124 23.180 92.959 1.00 0.00 C ATOM 764 CG GLU A 50 -66.281 24.519 92.226 1.00 0.00 C ATOM 765 CD GLU A 50 -65.212 24.624 91.133 1.00 0.00 C ATOM 766 OE1 GLU A 50 -65.186 23.751 90.238 1.00 0.00 O ATOM 767 OE2 GLU A 50 -64.328 25.507 91.213 1.00 0.00 O ATOM 0 H GLU A 50 -65.817 24.063 95.530 1.00 0.00 H new ATOM 0 HA GLU A 50 -68.053 22.987 93.935 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -65.080 23.073 93.253 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -66.340 22.378 92.253 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -67.276 24.592 91.787 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -66.182 25.346 92.929 1.00 0.00 H new ATOM 774 N ILE A 51 -67.091 20.527 94.188 1.00 0.00 N ATOM 775 CA ILE A 51 -66.343 19.268 94.126 1.00 0.00 C ATOM 776 C ILE A 51 -66.077 18.981 92.662 1.00 0.00 C ATOM 777 O ILE A 51 -67.023 18.931 91.871 1.00 0.00 O ATOM 778 CB ILE A 51 -67.069 18.063 94.757 1.00 0.00 C ATOM 779 CG1 ILE A 51 -67.594 18.410 96.160 1.00 0.00 C ATOM 780 CG2 ILE A 51 -66.104 16.864 94.763 1.00 0.00 C ATOM 781 CD1 ILE A 51 -67.936 17.208 97.054 1.00 0.00 C ATOM 0 H ILE A 51 -67.993 20.499 93.712 1.00 0.00 H new ATOM 0 HA ILE A 51 -65.431 19.395 94.709 1.00 0.00 H new ATOM 0 HB ILE A 51 -67.947 17.798 94.168 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -66.846 19.018 96.669 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -68.486 19.027 96.053 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -66.600 16.000 95.206 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -65.810 16.628 93.740 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -65.218 17.113 95.347 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -68.297 17.563 98.019 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -68.710 16.608 96.576 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -67.044 16.599 97.202 1.00 0.00 H new ATOM 793 N ARG A 52 -64.807 18.756 92.327 1.00 0.00 N ATOM 794 CA ARG A 52 -64.364 18.318 91.011 1.00 0.00 C ATOM 795 C ARG A 52 -63.919 16.857 91.015 1.00 0.00 C ATOM 796 O ARG A 52 -63.695 16.235 92.058 1.00 0.00 O ATOM 797 CB ARG A 52 -63.238 19.225 90.513 1.00 0.00 C ATOM 798 CG ARG A 52 -63.662 20.696 90.405 1.00 0.00 C ATOM 799 CD ARG A 52 -62.473 21.457 89.836 1.00 0.00 C ATOM 800 NE ARG A 52 -62.641 22.905 89.933 1.00 0.00 N ATOM 801 CZ ARG A 52 -61.665 23.795 89.891 1.00 0.00 C ATOM 802 NH1 ARG A 52 -60.428 23.449 89.593 1.00 0.00 N ATOM 803 NH2 ARG A 52 -61.924 25.050 90.164 1.00 0.00 N ATOM 0 H ARG A 52 -64.038 18.878 92.986 1.00 0.00 H new ATOM 0 HA ARG A 52 -65.212 18.391 90.330 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -62.388 19.146 91.190 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -62.902 18.876 89.537 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -64.533 20.801 89.758 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -63.941 21.090 91.382 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -61.568 21.162 90.368 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -62.333 21.179 88.791 1.00 0.00 H new ATOM 0 HE ARG A 52 -63.591 23.259 90.042 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -60.206 22.475 89.388 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -59.693 24.156 89.567 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -62.873 25.334 90.407 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -61.176 25.743 90.134 1.00 0.00 H new ATOM 817 N ASP A 53 -63.832 16.325 89.805 1.00 0.00 N ATOM 818 CA ASP A 53 -63.315 15.013 89.454 1.00 0.00 C ATOM 819 C ASP A 53 -61.873 14.767 89.928 1.00 0.00 C ATOM 820 O ASP A 53 -61.167 15.676 90.363 1.00 0.00 O ATOM 821 CB ASP A 53 -63.443 14.849 87.931 1.00 0.00 C ATOM 822 CG ASP A 53 -62.688 15.869 87.058 1.00 0.00 C ATOM 823 OD1 ASP A 53 -62.146 16.888 87.552 1.00 0.00 O ATOM 824 OD2 ASP A 53 -62.673 15.619 85.836 1.00 0.00 O ATOM 0 H ASP A 53 -64.145 16.839 88.982 1.00 0.00 H new ATOM 0 HA ASP A 53 -63.905 14.260 89.976 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -63.094 13.851 87.666 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -64.501 14.896 87.672 1.00 0.00 H new ATOM 829 N VAL A 54 -61.405 13.518 89.801 1.00 0.00 N ATOM 830 CA VAL A 54 -60.026 13.136 90.150 1.00 0.00 C ATOM 831 C VAL A 54 -58.971 13.922 89.358 1.00 0.00 C ATOM 832 O VAL A 54 -57.878 14.164 89.875 1.00 0.00 O ATOM 833 CB VAL A 54 -59.800 11.613 90.064 1.00 0.00 C ATOM 834 CG1 VAL A 54 -60.778 10.855 90.976 1.00 0.00 C ATOM 835 CG2 VAL A 54 -59.918 11.060 88.638 1.00 0.00 C ATOM 0 H VAL A 54 -61.970 12.743 89.454 1.00 0.00 H new ATOM 0 HA VAL A 54 -59.893 13.416 91.195 1.00 0.00 H new ATOM 0 HB VAL A 54 -58.775 11.453 90.398 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -60.595 9.784 90.895 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -60.631 11.171 92.009 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -61.802 11.073 90.672 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -59.748 9.983 88.650 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -60.915 11.265 88.249 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -59.175 11.538 88.000 1.00 0.00 H new ATOM 845 N ASN A 55 -59.326 14.395 88.156 1.00 0.00 N ATOM 846 CA ASN A 55 -58.524 15.289 87.322 1.00 0.00 C ATOM 847 C ASN A 55 -58.464 16.738 87.855 1.00 0.00 C ATOM 848 O ASN A 55 -57.571 17.479 87.450 1.00 0.00 O ATOM 849 CB ASN A 55 -59.102 15.329 85.897 1.00 0.00 C ATOM 850 CG ASN A 55 -59.212 14.026 85.129 1.00 0.00 C ATOM 851 OD1 ASN A 55 -58.908 12.939 85.597 1.00 0.00 O ATOM 852 ND2 ASN A 55 -59.659 14.129 83.894 1.00 0.00 N ATOM 0 H ASN A 55 -60.218 14.153 87.724 1.00 0.00 H new ATOM 0 HA ASN A 55 -57.511 14.886 87.335 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -60.099 15.766 85.955 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -58.488 16.011 85.308 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -59.755 13.295 83.315 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -59.909 15.043 83.517 1.00 0.00 H new ATOM 859 N LYS A 56 -59.378 17.135 88.761 1.00 0.00 N ATOM 860 CA LYS A 56 -59.453 18.436 89.461 1.00 0.00 C ATOM 861 C LYS A 56 -59.889 19.599 88.547 1.00 0.00 C ATOM 862 O LYS A 56 -59.654 20.775 88.854 1.00 0.00 O ATOM 863 CB LYS A 56 -58.153 18.694 90.260 1.00 0.00 C ATOM 864 CG LYS A 56 -57.860 17.551 91.253 1.00 0.00 C ATOM 865 CD LYS A 56 -56.410 17.528 91.745 1.00 0.00 C ATOM 866 CE LYS A 56 -56.157 16.277 92.600 1.00 0.00 C ATOM 867 NZ LYS A 56 -56.128 15.025 91.800 1.00 0.00 N ATOM 0 H LYS A 56 -60.136 16.514 89.044 1.00 0.00 H new ATOM 0 HA LYS A 56 -60.261 18.381 90.191 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -57.316 18.800 89.570 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -58.240 19.635 90.803 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -58.525 17.646 92.111 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -58.089 16.598 90.776 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -55.730 17.539 90.893 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -56.203 18.424 92.330 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -55.209 16.388 93.126 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -56.935 16.199 93.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -56.005 14.210 92.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -57.022 14.926 91.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -55.337 15.062 91.126 1.00 0.00 H new ATOM 881 N GLU A 57 -60.590 19.276 87.456 1.00 0.00 N ATOM 882 CA GLU A 57 -60.998 20.197 86.381 1.00 0.00 C ATOM 883 C GLU A 57 -62.518 20.308 86.197 1.00 0.00 C ATOM 884 O GLU A 57 -62.983 21.382 85.822 1.00 0.00 O ATOM 885 CB GLU A 57 -60.347 19.819 85.030 1.00 0.00 C ATOM 886 CG GLU A 57 -60.319 18.303 84.769 1.00 0.00 C ATOM 887 CD GLU A 57 -60.329 17.843 83.302 1.00 0.00 C ATOM 888 OE1 GLU A 57 -60.284 18.693 82.390 1.00 0.00 O ATOM 889 OE2 GLU A 57 -60.465 16.608 83.097 1.00 0.00 O ATOM 0 H GLU A 57 -60.905 18.321 87.287 1.00 0.00 H new ATOM 0 HA GLU A 57 -60.640 21.174 86.704 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -60.891 20.309 84.223 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -59.327 20.203 85.006 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -59.428 17.895 85.245 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -61.180 17.858 85.269 1.00 0.00 H new ATOM 896 N LYS A 58 -63.299 19.247 86.457 1.00 0.00 N ATOM 897 CA LYS A 58 -64.722 19.189 86.075 1.00 0.00 C ATOM 898 C LYS A 58 -65.598 18.864 87.283 1.00 0.00 C ATOM 899 O LYS A 58 -65.316 17.914 88.011 1.00 0.00 O ATOM 900 CB LYS A 58 -64.937 18.184 84.926 1.00 0.00 C ATOM 901 CG LYS A 58 -64.045 18.500 83.711 1.00 0.00 C ATOM 902 CD LYS A 58 -64.316 17.647 82.464 1.00 0.00 C ATOM 903 CE LYS A 58 -64.228 16.126 82.657 1.00 0.00 C ATOM 904 NZ LYS A 58 -62.935 15.672 83.223 1.00 0.00 N ATOM 0 H LYS A 58 -62.966 18.410 86.935 1.00 0.00 H new ATOM 0 HA LYS A 58 -65.022 20.172 85.712 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -64.723 17.176 85.281 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -65.984 18.199 84.622 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -64.174 19.550 83.449 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -63.003 18.370 84.002 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -65.311 17.889 82.092 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -63.607 17.937 81.689 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -65.036 15.805 83.315 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -64.386 15.637 81.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -62.825 14.650 83.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -62.155 16.181 82.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -62.916 15.866 84.245 1.00 0.00 H new ATOM 918 N VAL A 59 -66.643 19.670 87.503 1.00 0.00 N ATOM 919 CA VAL A 59 -67.561 19.581 88.651 1.00 0.00 C ATOM 920 C VAL A 59 -68.320 18.243 88.666 1.00 0.00 C ATOM 921 O VAL A 59 -68.866 17.820 87.649 1.00 0.00 O ATOM 922 CB VAL A 59 -68.546 20.772 88.663 1.00 0.00 C ATOM 923 CG1 VAL A 59 -69.521 20.708 89.851 1.00 0.00 C ATOM 924 CG2 VAL A 59 -67.796 22.108 88.766 1.00 0.00 C ATOM 0 H VAL A 59 -66.884 20.430 86.866 1.00 0.00 H new ATOM 0 HA VAL A 59 -66.958 19.627 89.558 1.00 0.00 H new ATOM 0 HB VAL A 59 -69.100 20.707 87.726 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -70.193 21.565 89.817 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -70.103 19.788 89.795 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -68.959 20.725 90.785 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -68.514 22.929 88.772 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -67.213 22.128 89.687 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -67.128 22.217 87.912 1.00 0.00 H new ATOM 934 N VAL A 60 -68.377 17.603 89.841 1.00 0.00 N ATOM 935 CA VAL A 60 -69.018 16.297 90.091 1.00 0.00 C ATOM 936 C VAL A 60 -69.913 16.262 91.339 1.00 0.00 C ATOM 937 O VAL A 60 -70.664 15.295 91.508 1.00 0.00 O ATOM 938 CB VAL A 60 -67.969 15.168 90.195 1.00 0.00 C ATOM 939 CG1 VAL A 60 -67.240 14.939 88.867 1.00 0.00 C ATOM 940 CG2 VAL A 60 -66.942 15.446 91.298 1.00 0.00 C ATOM 0 H VAL A 60 -67.960 17.996 90.685 1.00 0.00 H new ATOM 0 HA VAL A 60 -69.663 16.138 89.227 1.00 0.00 H new ATOM 0 HB VAL A 60 -68.522 14.264 90.449 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -66.512 14.137 88.985 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -67.962 14.663 88.098 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -66.727 15.854 88.571 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -66.222 14.629 91.339 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -66.421 16.379 91.083 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -67.452 15.528 92.258 1.00 0.00 H new ATOM 950 N GLY A 61 -69.883 17.291 92.198 1.00 0.00 N ATOM 951 CA GLY A 61 -70.664 17.356 93.443 1.00 0.00 C ATOM 952 C GLY A 61 -71.728 18.456 93.471 1.00 0.00 C ATOM 953 O GLY A 61 -71.763 19.319 92.594 1.00 0.00 O ATOM 0 H GLY A 61 -69.305 18.117 92.045 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -71.151 16.394 93.602 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -69.980 17.509 94.278 1.00 0.00 H new ATOM 957 N ARG A 62 -72.584 18.430 94.504 1.00 0.00 N ATOM 958 CA ARG A 62 -73.660 19.408 94.759 1.00 0.00 C ATOM 959 C ARG A 62 -73.615 19.886 96.215 1.00 0.00 C ATOM 960 O ARG A 62 -73.431 19.074 97.116 1.00 0.00 O ATOM 961 CB ARG A 62 -75.035 18.771 94.475 1.00 0.00 C ATOM 962 CG ARG A 62 -75.263 18.344 93.012 1.00 0.00 C ATOM 963 CD ARG A 62 -75.798 16.906 92.881 1.00 0.00 C ATOM 964 NE ARG A 62 -74.821 15.883 93.302 1.00 0.00 N ATOM 965 CZ ARG A 62 -73.711 15.496 92.695 1.00 0.00 C ATOM 966 NH1 ARG A 62 -73.295 16.007 91.565 1.00 0.00 N ATOM 967 NH2 ARG A 62 -72.970 14.578 93.249 1.00 0.00 N ATOM 0 H ARG A 62 -72.546 17.699 95.214 1.00 0.00 H new ATOM 0 HA ARG A 62 -73.511 20.261 94.097 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -75.154 17.897 95.116 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -75.813 19.481 94.756 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -75.967 19.032 92.544 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -74.324 18.428 92.464 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -76.702 16.805 93.482 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -76.082 16.724 91.845 1.00 0.00 H new ATOM 0 HE ARG A 62 -75.030 15.410 94.181 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -73.835 16.742 91.108 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -72.431 15.671 91.141 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -73.248 14.167 94.140 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -72.112 14.271 92.791 1.00 0.00 H new ATOM 981 N ILE A 63 -73.807 21.185 96.463 1.00 0.00 N ATOM 982 CA ILE A 63 -73.821 21.762 97.817 1.00 0.00 C ATOM 983 C ILE A 63 -75.262 21.807 98.343 1.00 0.00 C ATOM 984 O ILE A 63 -76.149 22.274 97.631 1.00 0.00 O ATOM 985 CB ILE A 63 -73.139 23.155 97.882 1.00 0.00 C ATOM 986 CG1 ILE A 63 -72.089 23.473 96.786 1.00 0.00 C ATOM 987 CG2 ILE A 63 -72.438 23.246 99.245 1.00 0.00 C ATOM 988 CD1 ILE A 63 -72.709 24.080 95.519 1.00 0.00 C ATOM 0 H ILE A 63 -73.959 21.874 95.726 1.00 0.00 H new ATOM 0 HA ILE A 63 -73.228 21.116 98.464 1.00 0.00 H new ATOM 0 HB ILE A 63 -73.936 23.881 97.722 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -71.349 24.165 97.189 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -71.559 22.558 96.522 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -71.943 24.213 99.336 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -73.175 23.140 100.041 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -71.698 22.450 99.327 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -71.924 24.280 94.790 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -73.428 23.380 95.095 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -73.215 25.011 95.772 1.00 0.00 H new ATOM 1000 N ILE A 64 -75.504 21.283 99.555 1.00 0.00 N ATOM 1001 CA ILE A 64 -76.851 20.915 100.024 1.00 0.00 C ATOM 1002 C ILE A 64 -77.365 21.849 101.120 1.00 0.00 C ATOM 1003 O ILE A 64 -78.453 22.400 100.971 1.00 0.00 O ATOM 1004 CB ILE A 64 -76.883 19.435 100.472 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -76.436 18.463 99.359 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -78.265 19.022 101.007 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -77.243 18.513 98.051 1.00 0.00 C ATOM 0 H ILE A 64 -74.770 21.102 100.240 1.00 0.00 H new ATOM 0 HA ILE A 64 -77.533 21.033 99.182 1.00 0.00 H new ATOM 0 HB ILE A 64 -76.161 19.363 101.286 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -75.391 18.667 99.125 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -76.482 17.447 99.752 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -78.240 17.975 101.310 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -78.523 19.642 101.866 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -79.013 19.156 100.225 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -76.838 17.788 97.345 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -78.286 18.274 98.258 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -77.178 19.513 97.621 1.00 0.00 H new ATOM 1019 N SER A 65 -76.615 22.033 102.217 1.00 0.00 N ATOM 1020 CA SER A 65 -77.102 22.809 103.375 1.00 0.00 C ATOM 1021 C SER A 65 -77.441 24.267 103.041 1.00 0.00 C ATOM 1022 O SER A 65 -78.346 24.837 103.650 1.00 0.00 O ATOM 1023 CB SER A 65 -76.076 22.795 104.512 1.00 0.00 C ATOM 1024 OG SER A 65 -76.338 21.755 105.431 1.00 0.00 O ATOM 0 H SER A 65 -75.673 21.658 102.330 1.00 0.00 H new ATOM 0 HA SER A 65 -78.024 22.316 103.683 1.00 0.00 H new ATOM 0 HB2 SER A 65 -75.075 22.674 104.099 1.00 0.00 H new ATOM 0 HB3 SER A 65 -76.093 23.754 105.031 1.00 0.00 H new ATOM 0 HG SER A 65 -75.666 21.771 106.144 1.00 0.00 H new ATOM 1030 N SER A 66 -76.715 24.891 102.107 1.00 0.00 N ATOM 1031 CA SER A 66 -76.964 26.231 101.555 1.00 0.00 C ATOM 1032 C SER A 66 -75.966 26.533 100.434 1.00 0.00 C ATOM 1033 O SER A 66 -74.957 25.842 100.297 1.00 0.00 O ATOM 1034 CB SER A 66 -76.811 27.309 102.643 1.00 0.00 C ATOM 1035 OG SER A 66 -77.950 27.318 103.472 1.00 0.00 O ATOM 0 H SER A 66 -75.893 24.452 101.692 1.00 0.00 H new ATOM 0 HA SER A 66 -77.983 26.246 101.168 1.00 0.00 H new ATOM 0 HB2 SER A 66 -75.919 27.114 103.238 1.00 0.00 H new ATOM 0 HB3 SER A 66 -76.678 28.288 102.182 1.00 0.00 H new ATOM 0 HG SER A 66 -78.458 26.491 103.338 1.00 0.00 H new ATOM 1041 N THR A 67 -76.206 27.620 99.689 1.00 0.00 N ATOM 1042 CA THR A 67 -75.188 28.340 98.910 1.00 0.00 C ATOM 1043 C THR A 67 -74.189 28.983 99.894 1.00 0.00 C ATOM 1044 O THR A 67 -74.583 29.943 100.566 1.00 0.00 O ATOM 1045 CB THR A 67 -75.835 29.430 98.038 1.00 0.00 C ATOM 1046 OG1 THR A 67 -76.564 30.307 98.865 1.00 0.00 O ATOM 1047 CG2 THR A 67 -76.768 28.854 96.974 1.00 0.00 C ATOM 0 H THR A 67 -77.135 28.033 99.609 1.00 0.00 H new ATOM 0 HA THR A 67 -74.676 27.641 98.249 1.00 0.00 H new ATOM 0 HB THR A 67 -75.033 29.955 97.519 1.00 0.00 H new ATOM 0 HG1 THR A 67 -76.116 30.387 99.733 1.00 0.00 H new ATOM 0 HG21 THR A 67 -77.197 29.667 96.388 1.00 0.00 H new ATOM 0 HG22 THR A 67 -76.205 28.191 96.317 1.00 0.00 H new ATOM 0 HG23 THR A 67 -77.568 28.293 97.457 1.00 0.00 H new ATOM 1055 N PRO A 68 -72.961 28.452 100.060 1.00 0.00 N ATOM 1056 CA PRO A 68 -72.090 28.765 101.198 1.00 0.00 C ATOM 1057 C PRO A 68 -71.731 30.243 101.376 1.00 0.00 C ATOM 1058 O PRO A 68 -71.473 30.957 100.404 1.00 0.00 O ATOM 1059 CB PRO A 68 -70.815 27.956 100.959 1.00 0.00 C ATOM 1060 CG PRO A 68 -71.329 26.752 100.189 1.00 0.00 C ATOM 1061 CD PRO A 68 -72.363 27.382 99.271 1.00 0.00 C ATOM 0 HA PRO A 68 -72.623 28.515 102.115 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -70.078 28.519 100.386 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -70.337 27.666 101.895 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -70.535 26.256 99.630 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -71.770 26.004 100.848 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -71.901 27.771 98.363 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -73.112 26.654 98.961 1.00 0.00 H new ATOM 1069 N LEU A 69 -71.598 30.673 102.635 1.00 0.00 N ATOM 1070 CA LEU A 69 -71.064 31.983 103.002 1.00 0.00 C ATOM 1071 C LEU A 69 -70.240 31.949 104.296 1.00 0.00 C ATOM 1072 O LEU A 69 -70.263 30.966 105.036 1.00 0.00 O ATOM 1073 CB LEU A 69 -72.191 33.040 103.029 1.00 0.00 C ATOM 1074 CG LEU A 69 -73.208 32.916 104.182 1.00 0.00 C ATOM 1075 CD1 LEU A 69 -73.725 34.309 104.547 1.00 0.00 C ATOM 1076 CD2 LEU A 69 -74.412 32.048 103.803 1.00 0.00 C ATOM 0 H LEU A 69 -71.864 30.107 103.441 1.00 0.00 H new ATOM 0 HA LEU A 69 -70.356 32.281 102.228 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -71.734 34.028 103.079 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -72.734 32.987 102.085 1.00 0.00 H new ATOM 0 HG LEU A 69 -72.693 32.446 105.020 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -74.445 34.228 105.362 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -72.891 34.936 104.861 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -74.209 34.757 103.679 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -75.099 31.991 104.647 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -74.924 32.489 102.948 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -74.071 31.046 103.544 1.00 0.00 H new ATOM 1088 N ALA A 70 -69.518 33.042 104.549 1.00 0.00 N ATOM 1089 CA ALA A 70 -68.740 33.330 105.745 1.00 0.00 C ATOM 1090 C ALA A 70 -68.987 34.791 106.141 1.00 0.00 C ATOM 1091 O ALA A 70 -68.879 35.694 105.311 1.00 0.00 O ATOM 1092 CB ALA A 70 -67.253 33.069 105.463 1.00 0.00 C ATOM 0 H ALA A 70 -69.461 33.802 103.871 1.00 0.00 H new ATOM 0 HA ALA A 70 -69.041 32.684 106.570 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -66.670 33.284 106.358 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -67.114 32.025 105.182 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -66.919 33.712 104.649 1.00 0.00 H new ATOM 1098 N GLU A 71 -69.340 35.031 107.406 1.00 0.00 N ATOM 1099 CA GLU A 71 -69.664 36.371 107.913 1.00 0.00 C ATOM 1100 C GLU A 71 -68.427 37.265 108.128 1.00 0.00 C ATOM 1101 O GLU A 71 -68.569 38.488 108.271 1.00 0.00 O ATOM 1102 CB GLU A 71 -70.434 36.229 109.238 1.00 0.00 C ATOM 1103 CG GLU A 71 -71.792 35.521 109.090 1.00 0.00 C ATOM 1104 CD GLU A 71 -72.762 36.265 108.160 1.00 0.00 C ATOM 1105 OE1 GLU A 71 -72.693 37.514 108.098 1.00 0.00 O ATOM 1106 OE2 GLU A 71 -73.590 35.601 107.500 1.00 0.00 O ATOM 0 H GLU A 71 -69.410 34.299 108.113 1.00 0.00 H new ATOM 0 HA GLU A 71 -70.271 36.863 107.153 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -69.820 35.674 109.947 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -70.595 37.220 109.663 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -71.630 34.514 108.705 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -72.250 35.417 110.074 1.00 0.00 H new ATOM 1113 N ASN A 72 -67.238 36.649 108.171 1.00 0.00 N ATOM 1114 CA ASN A 72 -65.946 37.229 108.528 1.00 0.00 C ATOM 1115 C ASN A 72 -64.819 36.191 108.340 1.00 0.00 C ATOM 1116 O ASN A 72 -65.100 34.995 108.270 1.00 0.00 O ATOM 1117 CB ASN A 72 -66.024 37.646 110.018 1.00 0.00 C ATOM 1118 CG ASN A 72 -65.631 39.089 110.225 1.00 0.00 C ATOM 1119 OD1 ASN A 72 -64.649 39.391 110.891 1.00 0.00 O ATOM 1120 ND2 ASN A 72 -66.415 39.988 109.666 1.00 0.00 N ATOM 0 H ASN A 72 -67.153 35.659 107.939 1.00 0.00 H new ATOM 0 HA ASN A 72 -65.727 38.086 107.891 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -67.039 37.491 110.385 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -65.370 37.004 110.608 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -66.214 40.981 109.780 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -67.223 39.691 109.119 1.00 0.00 H new ATOM 1127 N THR A 73 -63.551 36.626 108.395 1.00 0.00 N ATOM 1128 CA THR A 73 -62.404 35.757 108.743 1.00 0.00 C ATOM 1129 C THR A 73 -62.611 35.145 110.129 1.00 0.00 C ATOM 1130 O THR A 73 -62.464 33.943 110.324 1.00 0.00 O ATOM 1131 CB THR A 73 -61.077 36.538 108.672 1.00 0.00 C ATOM 1132 OG1 THR A 73 -60.749 36.728 107.313 1.00 0.00 O ATOM 1133 CG2 THR A 73 -59.883 35.885 109.372 1.00 0.00 C ATOM 0 H THR A 73 -63.286 37.591 108.200 1.00 0.00 H new ATOM 0 HA THR A 73 -62.347 34.949 108.014 1.00 0.00 H new ATOM 0 HB THR A 73 -61.254 37.470 109.209 1.00 0.00 H new ATOM 0 HG1 THR A 73 -59.781 36.634 107.194 1.00 0.00 H new ATOM 0 HG21 THR A 73 -59.004 36.519 109.259 1.00 0.00 H new ATOM 0 HG22 THR A 73 -60.106 35.760 110.431 1.00 0.00 H new ATOM 0 HG23 THR A 73 -59.687 34.911 108.925 1.00 0.00 H new ATOM 1141 N ASN A 74 -63.041 35.964 111.091 1.00 0.00 N ATOM 1142 CA ASN A 74 -63.456 35.578 112.441 1.00 0.00 C ATOM 1143 C ASN A 74 -64.794 34.794 112.454 1.00 0.00 C ATOM 1144 O ASN A 74 -65.678 35.067 113.269 1.00 0.00 O ATOM 1145 CB ASN A 74 -63.541 36.859 113.294 1.00 0.00 C ATOM 1146 CG ASN A 74 -62.308 37.740 113.166 1.00 0.00 C ATOM 1147 OD1 ASN A 74 -61.259 37.457 113.720 1.00 0.00 O ATOM 1148 ND2 ASN A 74 -62.390 38.812 112.402 1.00 0.00 N ATOM 0 H ASN A 74 -63.113 36.970 110.940 1.00 0.00 H new ATOM 0 HA ASN A 74 -62.719 34.893 112.860 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -64.421 37.429 112.997 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -63.678 36.584 114.340 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -61.573 39.409 112.272 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -63.270 39.044 111.941 1.00 0.00 H new ATOM 1155 N SER A 75 -65.029 33.883 111.503 1.00 0.00 N ATOM 1156 CA SER A 75 -66.258 33.086 111.425 1.00 0.00 C ATOM 1157 C SER A 75 -66.045 31.780 110.659 1.00 0.00 C ATOM 1158 O SER A 75 -65.251 31.709 109.720 1.00 0.00 O ATOM 1159 CB SER A 75 -67.376 33.900 110.763 1.00 0.00 C ATOM 1160 OG SER A 75 -67.742 34.978 111.601 1.00 0.00 O ATOM 0 H SER A 75 -64.364 33.676 110.758 1.00 0.00 H new ATOM 0 HA SER A 75 -66.546 32.831 112.445 1.00 0.00 H new ATOM 0 HB2 SER A 75 -67.041 34.276 109.796 1.00 0.00 H new ATOM 0 HB3 SER A 75 -68.240 33.263 110.576 1.00 0.00 H new ATOM 0 HG SER A 75 -67.291 34.887 112.466 1.00 0.00 H new ATOM 1166 N VAL A 76 -66.806 30.758 111.060 1.00 0.00 N ATOM 1167 CA VAL A 76 -66.783 29.403 110.503 1.00 0.00 C ATOM 1168 C VAL A 76 -68.130 29.042 109.881 1.00 0.00 C ATOM 1169 O VAL A 76 -69.163 29.570 110.295 1.00 0.00 O ATOM 1170 CB VAL A 76 -66.413 28.357 111.578 1.00 0.00 C ATOM 1171 CG1 VAL A 76 -64.969 28.518 112.056 1.00 0.00 C ATOM 1172 CG2 VAL A 76 -67.341 28.377 112.804 1.00 0.00 C ATOM 0 H VAL A 76 -67.485 30.857 111.815 1.00 0.00 H new ATOM 0 HA VAL A 76 -66.018 29.390 109.726 1.00 0.00 H new ATOM 0 HB VAL A 76 -66.535 27.396 111.078 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -64.749 27.763 112.811 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -64.290 28.395 111.212 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -64.837 29.511 112.486 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -67.020 27.616 113.516 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -67.298 29.358 113.277 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -68.364 28.171 112.489 1.00 0.00 H new ATOM 1182 N THR A 77 -68.124 28.091 108.941 1.00 0.00 N ATOM 1183 CA THR A 77 -69.347 27.600 108.287 1.00 0.00 C ATOM 1184 C THR A 77 -69.253 26.097 108.030 1.00 0.00 C ATOM 1185 O THR A 77 -68.499 25.661 107.159 1.00 0.00 O ATOM 1186 CB THR A 77 -69.667 28.345 106.970 1.00 0.00 C ATOM 1187 OG1 THR A 77 -69.378 29.722 107.057 1.00 0.00 O ATOM 1188 CG2 THR A 77 -71.152 28.213 106.631 1.00 0.00 C ATOM 0 H THR A 77 -67.272 27.638 108.610 1.00 0.00 H new ATOM 0 HA THR A 77 -70.168 27.801 108.975 1.00 0.00 H new ATOM 0 HB THR A 77 -69.044 27.890 106.200 1.00 0.00 H new ATOM 0 HG1 THR A 77 -70.028 30.227 106.526 1.00 0.00 H new ATOM 0 HG21 THR A 77 -71.362 28.743 105.702 1.00 0.00 H new ATOM 0 HG22 THR A 77 -71.406 27.160 106.514 1.00 0.00 H new ATOM 0 HG23 THR A 77 -71.749 28.643 107.436 1.00 0.00 H new ATOM 1196 N ASN A 78 -70.007 25.297 108.792 1.00 0.00 N ATOM 1197 CA ASN A 78 -70.284 23.897 108.469 1.00 0.00 C ATOM 1198 C ASN A 78 -71.297 23.791 107.314 1.00 0.00 C ATOM 1199 O ASN A 78 -72.391 24.345 107.390 1.00 0.00 O ATOM 1200 CB ASN A 78 -70.750 23.139 109.723 1.00 0.00 C ATOM 1201 CG ASN A 78 -71.912 23.812 110.433 1.00 0.00 C ATOM 1202 OD1 ASN A 78 -71.722 24.758 111.182 1.00 0.00 O ATOM 1203 ND2 ASN A 78 -73.131 23.365 110.216 1.00 0.00 N ATOM 0 H ASN A 78 -70.446 25.609 109.659 1.00 0.00 H new ATOM 0 HA ASN A 78 -69.363 23.425 108.127 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -71.042 22.128 109.440 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -69.914 23.047 110.416 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -73.926 23.809 110.675 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -73.280 22.574 109.589 1.00 0.00 H new ATOM 1210 N ILE A 79 -70.935 23.063 106.254 1.00 0.00 N ATOM 1211 CA ILE A 79 -71.728 22.882 105.035 1.00 0.00 C ATOM 1212 C ILE A 79 -71.856 21.390 104.709 1.00 0.00 C ATOM 1213 O ILE A 79 -70.852 20.710 104.494 1.00 0.00 O ATOM 1214 CB ILE A 79 -71.084 23.671 103.868 1.00 0.00 C ATOM 1215 CG1 ILE A 79 -71.112 25.204 104.073 1.00 0.00 C ATOM 1216 CG2 ILE A 79 -71.719 23.315 102.514 1.00 0.00 C ATOM 1217 CD1 ILE A 79 -72.507 25.850 104.104 1.00 0.00 C ATOM 0 H ILE A 79 -70.046 22.564 106.220 1.00 0.00 H new ATOM 0 HA ILE A 79 -72.733 23.274 105.190 1.00 0.00 H new ATOM 0 HB ILE A 79 -70.039 23.362 103.862 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -70.604 25.436 105.009 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -70.535 25.669 103.274 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -71.238 23.891 101.724 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -71.587 22.251 102.319 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -72.783 23.551 102.538 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -72.407 26.925 104.253 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -73.017 25.660 103.160 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -73.087 25.423 104.922 1.00 0.00 H new ATOM 1229 N GLU A 80 -73.099 20.897 104.656 1.00 0.00 N ATOM 1230 CA GLU A 80 -73.459 19.627 104.022 1.00 0.00 C ATOM 1231 C GLU A 80 -73.356 19.719 102.490 1.00 0.00 C ATOM 1232 O GLU A 80 -73.900 20.634 101.858 1.00 0.00 O ATOM 1233 CB GLU A 80 -74.889 19.244 104.416 1.00 0.00 C ATOM 1234 CG GLU A 80 -75.256 17.822 103.988 1.00 0.00 C ATOM 1235 CD GLU A 80 -76.724 17.464 104.255 1.00 0.00 C ATOM 1236 OE1 GLU A 80 -77.533 18.390 104.476 1.00 0.00 O ATOM 1237 OE2 GLU A 80 -77.017 16.241 104.180 1.00 0.00 O ATOM 0 H GLU A 80 -73.899 21.382 105.062 1.00 0.00 H new ATOM 0 HA GLU A 80 -72.760 18.865 104.366 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -75.001 19.335 105.496 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -75.588 19.948 103.963 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -75.049 17.706 102.924 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -74.616 17.115 104.516 1.00 0.00 H new ATOM 1244 N LEU A 81 -72.672 18.734 101.907 1.00 0.00 N ATOM 1245 CA LEU A 81 -72.215 18.674 100.525 1.00 0.00 C ATOM 1246 C LEU A 81 -72.309 17.221 100.007 1.00 0.00 C ATOM 1247 O LEU A 81 -72.235 16.266 100.779 1.00 0.00 O ATOM 1248 CB LEU A 81 -70.789 19.259 100.586 1.00 0.00 C ATOM 1249 CG LEU A 81 -69.886 19.131 99.356 1.00 0.00 C ATOM 1250 CD1 LEU A 81 -70.460 19.758 98.083 1.00 0.00 C ATOM 1251 CD2 LEU A 81 -68.542 19.795 99.685 1.00 0.00 C ATOM 0 H LEU A 81 -72.406 17.899 102.429 1.00 0.00 H new ATOM 0 HA LEU A 81 -72.815 19.241 99.813 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -70.877 20.320 100.822 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -70.275 18.788 101.424 1.00 0.00 H new ATOM 0 HG LEU A 81 -69.784 18.067 99.142 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -69.757 19.622 97.261 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -71.406 19.276 97.835 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -70.627 20.823 98.245 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -67.878 19.718 98.824 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -68.704 20.846 99.925 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -68.088 19.293 100.540 1.00 0.00 H new ATOM 1263 N GLU A 82 -72.503 17.041 98.698 1.00 0.00 N ATOM 1264 CA GLU A 82 -72.913 15.786 98.052 1.00 0.00 C ATOM 1265 C GLU A 82 -71.904 15.420 96.940 1.00 0.00 C ATOM 1266 O GLU A 82 -71.991 15.967 95.837 1.00 0.00 O ATOM 1267 CB GLU A 82 -74.367 15.954 97.560 1.00 0.00 C ATOM 1268 CG GLU A 82 -75.254 14.699 97.587 1.00 0.00 C ATOM 1269 CD GLU A 82 -75.143 13.775 96.374 1.00 0.00 C ATOM 1270 OE1 GLU A 82 -74.506 14.151 95.365 1.00 0.00 O ATOM 1271 OE2 GLU A 82 -75.665 12.639 96.473 1.00 0.00 O ATOM 0 H GLU A 82 -72.373 17.798 98.027 1.00 0.00 H new ATOM 0 HA GLU A 82 -72.902 14.945 98.746 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -74.845 16.722 98.168 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -74.339 16.329 96.537 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -75.010 14.124 98.480 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -76.293 15.014 97.685 1.00 0.00 H new ATOM 1278 N PRO A 83 -70.886 14.581 97.230 1.00 0.00 N ATOM 1279 CA PRO A 83 -69.888 14.112 96.258 1.00 0.00 C ATOM 1280 C PRO A 83 -70.428 13.023 95.307 1.00 0.00 C ATOM 1281 O PRO A 83 -71.511 12.486 95.535 1.00 0.00 O ATOM 1282 CB PRO A 83 -68.722 13.560 97.099 1.00 0.00 C ATOM 1283 CG PRO A 83 -69.188 13.550 98.555 1.00 0.00 C ATOM 1284 CD PRO A 83 -70.635 14.011 98.543 1.00 0.00 C ATOM 0 HA PRO A 83 -69.589 14.933 95.607 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -68.453 12.555 96.773 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -67.834 14.181 96.982 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -69.102 12.552 98.984 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -68.574 14.213 99.164 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -71.308 13.176 98.736 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -70.811 14.750 99.325 1.00 0.00 H new ATOM 1292 N PRO A 84 -69.677 12.606 94.271 1.00 0.00 N ATOM 1293 CA PRO A 84 -69.948 11.353 93.560 1.00 0.00 C ATOM 1294 C PRO A 84 -69.634 10.141 94.455 1.00 0.00 C ATOM 1295 O PRO A 84 -68.862 10.246 95.407 1.00 0.00 O ATOM 1296 CB PRO A 84 -69.024 11.392 92.338 1.00 0.00 C ATOM 1297 CG PRO A 84 -67.816 12.171 92.855 1.00 0.00 C ATOM 1298 CD PRO A 84 -68.451 13.213 93.777 1.00 0.00 C ATOM 0 HA PRO A 84 -70.996 11.255 93.276 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -68.749 10.391 92.007 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -69.495 11.890 91.490 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -67.120 11.527 93.392 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -67.258 12.637 92.043 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -67.782 13.468 94.599 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -68.661 14.137 93.238 1.00 0.00 H new ATOM 1306 N PHE A 85 -70.184 8.963 94.134 1.00 0.00 N ATOM 1307 CA PHE A 85 -69.833 7.701 94.800 1.00 0.00 C ATOM 1308 C PHE A 85 -68.458 7.189 94.329 1.00 0.00 C ATOM 1309 O PHE A 85 -68.357 6.228 93.569 1.00 0.00 O ATOM 1310 CB PHE A 85 -70.964 6.674 94.635 1.00 0.00 C ATOM 1311 CG PHE A 85 -72.233 7.048 95.385 1.00 0.00 C ATOM 1312 CD1 PHE A 85 -72.330 6.806 96.771 1.00 0.00 C ATOM 1313 CD2 PHE A 85 -73.310 7.652 94.708 1.00 0.00 C ATOM 1314 CE1 PHE A 85 -73.496 7.164 97.471 1.00 0.00 C ATOM 1315 CE2 PHE A 85 -74.477 8.006 95.409 1.00 0.00 C ATOM 1316 CZ PHE A 85 -74.570 7.762 96.790 1.00 0.00 C ATOM 0 H PHE A 85 -70.887 8.857 93.403 1.00 0.00 H new ATOM 0 HA PHE A 85 -69.731 7.876 95.871 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -71.195 6.566 93.575 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -70.616 5.702 94.986 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -71.507 6.345 97.296 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -73.240 7.844 93.648 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -73.566 6.979 98.533 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -75.302 8.466 94.886 1.00 0.00 H new ATOM 0 HZ PHE A 85 -75.466 8.034 97.328 1.00 0.00 H new ATOM 1326 N GLY A 86 -67.395 7.865 94.777 1.00 0.00 N ATOM 1327 CA GLY A 86 -65.998 7.620 94.418 1.00 0.00 C ATOM 1328 C GLY A 86 -65.064 8.627 95.099 1.00 0.00 C ATOM 1329 O GLY A 86 -65.504 9.368 95.983 1.00 0.00 O ATOM 0 H GLY A 86 -67.493 8.638 95.435 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -65.718 6.607 94.708 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -65.881 7.686 93.336 1.00 0.00 H new ATOM 1333 N ASP A 87 -63.782 8.641 94.701 1.00 0.00 N ATOM 1334 CA ASP A 87 -62.837 9.695 95.097 1.00 0.00 C ATOM 1335 C ASP A 87 -63.095 10.991 94.312 1.00 0.00 C ATOM 1336 O ASP A 87 -63.537 10.966 93.161 1.00 0.00 O ATOM 1337 CB ASP A 87 -61.372 9.250 94.931 1.00 0.00 C ATOM 1338 CG ASP A 87 -60.409 10.251 95.590 1.00 0.00 C ATOM 1339 OD1 ASP A 87 -60.726 10.693 96.717 1.00 0.00 O ATOM 1340 OD2 ASP A 87 -59.389 10.612 94.953 1.00 0.00 O ATOM 0 H ASP A 87 -63.374 7.926 94.099 1.00 0.00 H new ATOM 0 HA ASP A 87 -63.005 9.889 96.156 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -61.236 8.264 95.375 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -61.135 9.157 93.871 1.00 0.00 H new ATOM 1345 N SER A 88 -62.831 12.132 94.950 1.00 0.00 N ATOM 1346 CA SER A 88 -63.257 13.448 94.478 1.00 0.00 C ATOM 1347 C SER A 88 -62.495 14.580 95.176 1.00 0.00 C ATOM 1348 O SER A 88 -61.909 14.363 96.237 1.00 0.00 O ATOM 1349 CB SER A 88 -64.762 13.571 94.733 1.00 0.00 C ATOM 1350 OG SER A 88 -65.075 13.534 96.115 1.00 0.00 O ATOM 0 H SER A 88 -62.306 12.167 95.824 1.00 0.00 H new ATOM 0 HA SER A 88 -63.038 13.540 93.414 1.00 0.00 H new ATOM 0 HB2 SER A 88 -65.126 14.505 94.304 1.00 0.00 H new ATOM 0 HB3 SER A 88 -65.283 12.761 94.222 1.00 0.00 H new ATOM 0 HG SER A 88 -64.687 12.729 96.517 1.00 0.00 H new ATOM 1356 N TYR A 89 -62.501 15.785 94.585 1.00 0.00 N ATOM 1357 CA TYR A 89 -61.651 16.905 95.009 1.00 0.00 C ATOM 1358 C TYR A 89 -62.467 18.171 95.240 1.00 0.00 C ATOM 1359 O TYR A 89 -62.872 18.872 94.313 1.00 0.00 O ATOM 1360 CB TYR A 89 -60.467 17.089 94.051 1.00 0.00 C ATOM 1361 CG TYR A 89 -59.530 15.905 94.169 1.00 0.00 C ATOM 1362 CD1 TYR A 89 -59.821 14.735 93.447 1.00 0.00 C ATOM 1363 CD2 TYR A 89 -58.514 15.895 95.148 1.00 0.00 C ATOM 1364 CE1 TYR A 89 -59.177 13.530 93.769 1.00 0.00 C ATOM 1365 CE2 TYR A 89 -57.828 14.699 95.433 1.00 0.00 C ATOM 1366 CZ TYR A 89 -58.202 13.501 94.785 1.00 0.00 C ATOM 1367 OH TYR A 89 -57.664 12.311 95.155 1.00 0.00 O ATOM 0 H TYR A 89 -63.102 16.010 93.792 1.00 0.00 H new ATOM 0 HA TYR A 89 -61.215 16.665 95.979 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -60.826 17.181 93.026 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -59.936 18.011 94.286 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -60.541 14.763 92.643 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -58.263 16.802 95.677 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -59.429 12.624 93.237 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -57.017 14.698 96.146 1.00 0.00 H new ATOM 0 HH TYR A 89 -58.366 11.736 95.526 1.00 0.00 H new ATOM 1377 N ILE A 90 -62.733 18.422 96.519 1.00 0.00 N ATOM 1378 CA ILE A 90 -63.439 19.565 97.071 1.00 0.00 C ATOM 1379 C ILE A 90 -62.519 20.779 96.934 1.00 0.00 C ATOM 1380 O ILE A 90 -61.380 20.730 97.402 1.00 0.00 O ATOM 1381 CB ILE A 90 -63.787 19.291 98.555 1.00 0.00 C ATOM 1382 CG1 ILE A 90 -64.782 18.136 98.784 1.00 0.00 C ATOM 1383 CG2 ILE A 90 -64.427 20.538 99.184 1.00 0.00 C ATOM 1384 CD1 ILE A 90 -64.307 16.719 98.457 1.00 0.00 C ATOM 0 H ILE A 90 -62.435 17.777 97.251 1.00 0.00 H new ATOM 0 HA ILE A 90 -64.374 19.749 96.542 1.00 0.00 H new ATOM 0 HB ILE A 90 -62.835 19.019 99.010 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -65.085 18.156 99.831 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -65.673 18.337 98.190 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -64.668 20.336 100.228 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -63.729 21.373 99.128 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -65.339 20.791 98.643 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -65.108 16.010 98.666 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -64.036 16.660 97.403 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -63.438 16.476 99.069 1.00 0.00 H new ATOM 1396 N VAL A 91 -63.010 21.863 96.322 1.00 0.00 N ATOM 1397 CA VAL A 91 -62.279 23.137 96.231 1.00 0.00 C ATOM 1398 C VAL A 91 -63.093 24.226 96.933 1.00 0.00 C ATOM 1399 O VAL A 91 -64.255 24.440 96.588 1.00 0.00 O ATOM 1400 CB VAL A 91 -61.759 23.489 94.807 1.00 0.00 C ATOM 1401 CG1 VAL A 91 -61.713 22.296 93.837 1.00 0.00 C ATOM 1402 CG2 VAL A 91 -62.458 24.663 94.110 1.00 0.00 C ATOM 0 H VAL A 91 -63.926 21.884 95.875 1.00 0.00 H new ATOM 0 HA VAL A 91 -61.335 23.039 96.767 1.00 0.00 H new ATOM 0 HB VAL A 91 -60.741 23.806 95.035 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -61.339 22.629 92.869 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -61.051 21.527 94.237 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -62.716 21.885 93.717 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -62.015 24.818 93.126 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -63.519 24.441 93.999 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -62.337 25.566 94.709 1.00 0.00 H new ATOM 1412 N ILE A 92 -62.502 24.860 97.958 1.00 0.00 N ATOM 1413 CA ILE A 92 -63.120 25.913 98.784 1.00 0.00 C ATOM 1414 C ILE A 92 -62.252 27.177 98.698 1.00 0.00 C ATOM 1415 O ILE A 92 -61.222 27.289 99.367 1.00 0.00 O ATOM 1416 CB ILE A 92 -63.384 25.446 100.236 1.00 0.00 C ATOM 1417 CG1 ILE A 92 -64.178 24.123 100.250 1.00 0.00 C ATOM 1418 CG2 ILE A 92 -64.068 26.549 101.063 1.00 0.00 C ATOM 1419 CD1 ILE A 92 -64.509 23.569 101.639 1.00 0.00 C ATOM 0 H ILE A 92 -61.547 24.647 98.246 1.00 0.00 H new ATOM 0 HA ILE A 92 -64.110 26.148 98.393 1.00 0.00 H new ATOM 0 HB ILE A 92 -62.424 25.250 100.713 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -65.110 24.273 99.706 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -63.608 23.371 99.704 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -64.240 26.190 102.078 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -63.428 27.431 101.094 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -65.022 26.809 100.604 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -65.068 22.639 101.536 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -63.585 23.379 102.185 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -65.111 24.295 102.186 1.00 0.00 H new ATOM 1431 N GLY A 93 -62.651 28.092 97.812 1.00 0.00 N ATOM 1432 CA GLY A 93 -61.885 29.240 97.314 1.00 0.00 C ATOM 1433 C GLY A 93 -61.774 29.189 95.782 1.00 0.00 C ATOM 1434 O GLY A 93 -62.276 28.257 95.155 1.00 0.00 O ATOM 0 H GLY A 93 -63.581 28.049 97.394 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -62.369 30.168 97.619 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -60.889 29.240 97.757 1.00 0.00 H new ATOM 1438 N VAL A 94 -61.105 30.173 95.166 1.00 0.00 N ATOM 1439 CA VAL A 94 -60.856 30.203 93.711 1.00 0.00 C ATOM 1440 C VAL A 94 -59.364 30.066 93.403 1.00 0.00 C ATOM 1441 O VAL A 94 -58.529 30.601 94.130 1.00 0.00 O ATOM 1442 CB VAL A 94 -61.432 31.466 93.034 1.00 0.00 C ATOM 1443 CG1 VAL A 94 -62.953 31.559 93.201 1.00 0.00 C ATOM 1444 CG2 VAL A 94 -60.801 32.765 93.547 1.00 0.00 C ATOM 0 H VAL A 94 -60.718 30.976 95.662 1.00 0.00 H new ATOM 0 HA VAL A 94 -61.382 29.345 93.292 1.00 0.00 H new ATOM 0 HB VAL A 94 -61.184 31.358 91.978 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -63.318 32.461 92.711 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -63.423 30.685 92.750 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -63.201 31.597 94.262 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -61.249 33.615 93.032 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -60.977 32.856 94.619 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -59.728 32.749 93.355 1.00 0.00 H new ATOM 1454 N GLY A 95 -59.035 29.374 92.305 1.00 0.00 N ATOM 1455 CA GLY A 95 -57.668 29.110 91.841 1.00 0.00 C ATOM 1456 C GLY A 95 -56.671 28.830 92.974 1.00 0.00 C ATOM 1457 O GLY A 95 -56.847 27.892 93.749 1.00 0.00 O ATOM 0 H GLY A 95 -59.741 28.967 91.692 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -57.683 28.256 91.164 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -57.318 29.967 91.266 1.00 0.00 H new ATOM 1461 N ASN A 96 -55.634 29.665 93.091 1.00 0.00 N ATOM 1462 CA ASN A 96 -54.583 29.541 94.107 1.00 0.00 C ATOM 1463 C ASN A 96 -55.055 29.793 95.555 1.00 0.00 C ATOM 1464 O ASN A 96 -54.315 29.476 96.484 1.00 0.00 O ATOM 1465 CB ASN A 96 -53.446 30.508 93.737 1.00 0.00 C ATOM 1466 CG ASN A 96 -53.905 31.955 93.814 1.00 0.00 C ATOM 1467 OD1 ASN A 96 -54.484 32.479 92.876 1.00 0.00 O ATOM 1468 ND2 ASN A 96 -53.716 32.608 94.943 1.00 0.00 N ATOM 0 H ASN A 96 -55.498 30.462 92.470 1.00 0.00 H new ATOM 0 HA ASN A 96 -54.248 28.504 94.101 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -52.602 30.355 94.410 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -53.093 30.289 92.729 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -54.055 33.565 95.042 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -53.230 32.157 95.718 1.00 0.00 H new ATOM 1475 N SER A 97 -56.246 30.365 95.765 1.00 0.00 N ATOM 1476 CA SER A 97 -56.839 30.574 97.091 1.00 0.00 C ATOM 1477 C SER A 97 -57.639 29.357 97.581 1.00 0.00 C ATOM 1478 O SER A 97 -58.049 29.329 98.742 1.00 0.00 O ATOM 1479 CB SER A 97 -57.778 31.787 97.067 1.00 0.00 C ATOM 1480 OG SER A 97 -57.103 32.982 96.726 1.00 0.00 O ATOM 0 H SER A 97 -56.836 30.702 95.004 1.00 0.00 H new ATOM 0 HA SER A 97 -56.007 30.738 97.776 1.00 0.00 H new ATOM 0 HB2 SER A 97 -58.580 31.609 96.351 1.00 0.00 H new ATOM 0 HB3 SER A 97 -58.244 31.902 98.046 1.00 0.00 H new ATOM 0 HG SER A 97 -57.702 33.560 96.208 1.00 0.00 H new ATOM 1486 N ALA A 98 -57.896 28.373 96.707 1.00 0.00 N ATOM 1487 CA ALA A 98 -58.766 27.235 96.978 1.00 0.00 C ATOM 1488 C ALA A 98 -58.119 26.171 97.876 1.00 0.00 C ATOM 1489 O ALA A 98 -57.191 25.471 97.454 1.00 0.00 O ATOM 1490 CB ALA A 98 -59.216 26.620 95.649 1.00 0.00 C ATOM 0 H ALA A 98 -57.491 28.352 95.771 1.00 0.00 H new ATOM 0 HA ALA A 98 -59.626 27.608 97.534 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -59.867 25.768 95.844 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -59.759 27.366 95.068 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -58.343 26.288 95.088 1.00 0.00 H new ATOM 1496 N LEU A 99 -58.697 25.962 99.069 1.00 0.00 N ATOM 1497 CA LEU A 99 -58.537 24.716 99.824 1.00 0.00 C ATOM 1498 C LEU A 99 -58.968 23.558 98.923 1.00 0.00 C ATOM 1499 O LEU A 99 -60.164 23.341 98.734 1.00 0.00 O ATOM 1500 CB LEU A 99 -59.431 24.695 101.066 1.00 0.00 C ATOM 1501 CG LEU A 99 -59.138 25.710 102.169 1.00 0.00 C ATOM 1502 CD1 LEU A 99 -60.381 25.779 103.056 1.00 0.00 C ATOM 1503 CD2 LEU A 99 -57.927 25.270 102.996 1.00 0.00 C ATOM 0 H LEU A 99 -59.287 26.652 99.534 1.00 0.00 H new ATOM 0 HA LEU A 99 -57.496 24.632 100.136 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -60.461 24.842 100.740 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -59.374 23.698 101.504 1.00 0.00 H new ATOM 0 HG LEU A 99 -58.908 26.685 101.741 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -60.215 26.495 103.860 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -61.237 26.096 102.459 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -60.579 24.795 103.481 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -57.733 26.005 103.777 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -58.131 24.301 103.452 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -57.054 25.190 102.348 1.00 0.00 H new ATOM 1515 N THR A 100 -57.998 22.863 98.335 1.00 0.00 N ATOM 1516 CA THR A 100 -58.219 21.806 97.351 1.00 0.00 C ATOM 1517 C THR A 100 -57.916 20.470 98.021 1.00 0.00 C ATOM 1518 O THR A 100 -56.750 20.091 98.124 1.00 0.00 O ATOM 1519 CB THR A 100 -57.366 22.063 96.098 1.00 0.00 C ATOM 1520 OG1 THR A 100 -57.650 23.353 95.589 1.00 0.00 O ATOM 1521 CG2 THR A 100 -57.669 21.044 94.995 1.00 0.00 C ATOM 0 H THR A 100 -57.011 23.023 98.535 1.00 0.00 H new ATOM 0 HA THR A 100 -59.254 21.789 97.010 1.00 0.00 H new ATOM 0 HB THR A 100 -56.319 21.976 96.389 1.00 0.00 H new ATOM 0 HG1 THR A 100 -57.353 24.031 96.231 1.00 0.00 H new ATOM 0 HG21 THR A 100 -57.049 21.255 94.124 1.00 0.00 H new ATOM 0 HG22 THR A 100 -57.454 20.039 95.359 1.00 0.00 H new ATOM 0 HG23 THR A 100 -58.721 21.111 94.716 1.00 0.00 H new ATOM 1529 N LEU A 101 -58.950 19.791 98.535 1.00 0.00 N ATOM 1530 CA LEU A 101 -58.809 18.579 99.349 1.00 0.00 C ATOM 1531 C LEU A 101 -59.701 17.419 98.876 1.00 0.00 C ATOM 1532 O LEU A 101 -60.671 17.597 98.147 1.00 0.00 O ATOM 1533 CB LEU A 101 -58.984 18.898 100.849 1.00 0.00 C ATOM 1534 CG LEU A 101 -60.396 19.341 101.294 1.00 0.00 C ATOM 1535 CD1 LEU A 101 -60.690 18.791 102.690 1.00 0.00 C ATOM 1536 CD2 LEU A 101 -60.537 20.866 101.359 1.00 0.00 C ATOM 0 H LEU A 101 -59.920 20.073 98.395 1.00 0.00 H new ATOM 0 HA LEU A 101 -57.790 18.219 99.208 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -58.707 18.013 101.422 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -58.278 19.685 101.116 1.00 0.00 H new ATOM 0 HG LEU A 101 -61.095 18.954 100.553 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -61.686 19.104 103.002 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -60.642 17.702 102.670 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -59.952 19.174 103.395 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -61.547 21.125 101.677 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -59.818 21.268 102.073 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -60.346 21.291 100.374 1.00 0.00 H new ATOM 1548 N HIS A 102 -59.330 16.212 99.292 1.00 0.00 N ATOM 1549 CA HIS A 102 -59.861 14.925 98.841 1.00 0.00 C ATOM 1550 C HIS A 102 -61.099 14.441 99.611 1.00 0.00 C ATOM 1551 O HIS A 102 -61.207 14.657 100.814 1.00 0.00 O ATOM 1552 CB HIS A 102 -58.732 13.894 99.012 1.00 0.00 C ATOM 1553 CG HIS A 102 -57.934 13.978 100.305 1.00 0.00 C ATOM 1554 ND1 HIS A 102 -58.312 14.533 101.519 1.00 0.00 N ATOM 1555 CD2 HIS A 102 -56.623 13.600 100.428 1.00 0.00 C ATOM 1556 CE1 HIS A 102 -57.245 14.489 102.334 1.00 0.00 C ATOM 1557 NE2 HIS A 102 -56.195 13.936 101.714 1.00 0.00 N ATOM 0 H HIS A 102 -58.604 16.097 99.999 1.00 0.00 H new ATOM 0 HA HIS A 102 -60.187 15.044 97.808 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -59.166 12.896 98.942 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -58.041 14.001 98.176 1.00 0.00 H new ATOM 0 HD1 HIS A 102 -59.232 14.906 101.751 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -56.025 13.125 99.664 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -57.235 14.851 103.352 1.00 0.00 H new ATOM 1565 N TRP A 103 -61.973 13.669 98.951 1.00 0.00 N ATOM 1566 CA TRP A 103 -62.990 12.837 99.604 1.00 0.00 C ATOM 1567 C TRP A 103 -63.369 11.603 98.790 1.00 0.00 C ATOM 1568 O TRP A 103 -63.752 11.729 97.622 1.00 0.00 O ATOM 1569 CB TRP A 103 -64.271 13.628 99.839 1.00 0.00 C ATOM 1570 CG TRP A 103 -65.314 12.902 100.632 1.00 0.00 C ATOM 1571 CD1 TRP A 103 -66.479 12.407 100.154 1.00 0.00 C ATOM 1572 CD2 TRP A 103 -65.271 12.531 102.038 1.00 0.00 C ATOM 1573 NE1 TRP A 103 -67.198 11.829 101.190 1.00 0.00 N ATOM 1574 CE2 TRP A 103 -66.497 11.891 102.367 1.00 0.00 C ATOM 1575 CE3 TRP A 103 -64.320 12.658 103.069 1.00 0.00 C ATOM 1576 CZ2 TRP A 103 -66.793 11.454 103.659 1.00 0.00 C ATOM 1577 CZ3 TRP A 103 -64.606 12.205 104.371 1.00 0.00 C ATOM 1578 CH2 TRP A 103 -65.849 11.628 104.679 1.00 0.00 C ATOM 0 H TRP A 103 -61.993 13.605 97.933 1.00 0.00 H new ATOM 0 HA TRP A 103 -62.538 12.520 100.544 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -64.021 14.555 100.355 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -64.694 13.905 98.873 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -66.800 12.455 99.124 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -68.124 11.413 101.090 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -63.361 13.108 102.859 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -67.743 10.985 103.871 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -63.859 12.303 105.144 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -66.074 11.322 105.690 1.00 0.00 H new ATOM 1589 N PHE A 104 -63.389 10.449 99.469 1.00 0.00 N ATOM 1590 CA PHE A 104 -63.965 9.201 98.981 1.00 0.00 C ATOM 1591 C PHE A 104 -65.318 8.939 99.656 1.00 0.00 C ATOM 1592 O PHE A 104 -65.384 8.642 100.855 1.00 0.00 O ATOM 1593 CB PHE A 104 -62.990 8.037 99.185 1.00 0.00 C ATOM 1594 CG PHE A 104 -63.545 6.735 98.639 1.00 0.00 C ATOM 1595 CD1 PHE A 104 -63.371 6.406 97.284 1.00 0.00 C ATOM 1596 CD2 PHE A 104 -64.322 5.900 99.462 1.00 0.00 C ATOM 1597 CE1 PHE A 104 -63.990 5.263 96.749 1.00 0.00 C ATOM 1598 CE2 PHE A 104 -64.947 4.759 98.930 1.00 0.00 C ATOM 1599 CZ PHE A 104 -64.787 4.445 97.570 1.00 0.00 C ATOM 0 H PHE A 104 -62.990 10.361 100.404 1.00 0.00 H new ATOM 0 HA PHE A 104 -64.142 9.289 97.909 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -62.045 8.264 98.692 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -62.776 7.924 100.248 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -62.760 7.033 96.652 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -64.439 6.137 100.509 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -63.854 5.013 95.707 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -65.549 4.125 99.565 1.00 0.00 H new ATOM 0 HZ PHE A 104 -65.276 3.576 97.155 1.00 0.00 H new ATOM 1609 N ARG A 105 -66.407 9.064 98.891 1.00 0.00 N ATOM 1610 CA ARG A 105 -67.770 8.904 99.414 1.00 0.00 C ATOM 1611 C ARG A 105 -68.061 7.470 99.877 1.00 0.00 C ATOM 1612 O ARG A 105 -67.647 6.512 99.231 1.00 0.00 O ATOM 1613 CB ARG A 105 -68.758 9.391 98.353 1.00 0.00 C ATOM 1614 CG ARG A 105 -70.194 9.538 98.870 1.00 0.00 C ATOM 1615 CD ARG A 105 -71.096 10.152 97.799 1.00 0.00 C ATOM 1616 NE ARG A 105 -72.412 10.479 98.360 1.00 0.00 N ATOM 1617 CZ ARG A 105 -73.502 10.854 97.713 1.00 0.00 C ATOM 1618 NH1 ARG A 105 -73.557 11.048 96.425 1.00 0.00 N ATOM 1619 NH2 ARG A 105 -74.586 11.138 98.378 1.00 0.00 N ATOM 0 H ARG A 105 -66.370 9.278 97.894 1.00 0.00 H new ATOM 0 HA ARG A 105 -67.881 9.512 100.312 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -68.419 10.353 97.968 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -68.752 8.693 97.516 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -70.582 8.562 99.163 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -70.202 10.165 99.762 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -70.632 11.053 97.397 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -71.211 9.455 96.969 1.00 0.00 H new ATOM 0 HE ARG A 105 -72.496 10.408 99.374 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -72.724 10.910 95.852 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -74.433 11.338 95.990 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -74.592 11.071 99.396 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -75.428 11.428 97.881 1.00 0.00 H new ATOM 1633 N LYS A 106 -68.796 7.327 100.991 1.00 0.00 N ATOM 1634 CA LYS A 106 -69.143 6.055 101.662 1.00 0.00 C ATOM 1635 C LYS A 106 -67.928 5.202 102.074 1.00 0.00 C ATOM 1636 O LYS A 106 -68.061 3.993 102.248 1.00 0.00 O ATOM 1637 CB LYS A 106 -70.214 5.286 100.850 1.00 0.00 C ATOM 1638 CG LYS A 106 -71.613 5.938 100.865 1.00 0.00 C ATOM 1639 CD LYS A 106 -72.616 5.282 101.835 1.00 0.00 C ATOM 1640 CE LYS A 106 -72.316 5.433 103.335 1.00 0.00 C ATOM 1641 NZ LYS A 106 -72.559 6.809 103.833 1.00 0.00 N ATOM 0 H LYS A 106 -69.187 8.135 101.477 1.00 0.00 H new ATOM 0 HA LYS A 106 -69.591 6.312 102.622 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -69.877 5.200 99.817 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -70.294 4.273 101.244 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -71.506 6.990 101.130 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -72.027 5.903 99.857 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -73.603 5.701 101.640 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -72.670 4.218 101.603 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -72.935 4.733 103.897 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -71.277 5.162 103.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -72.293 6.867 104.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -71.988 7.483 103.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -73.567 7.043 103.728 1.00 0.00 H new