USER MOD reduce.3.24.130724 H: found=0, std=0, add=727, rem=0, adj=28 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 96 ASN : amide:sc= -0.148 X(o=1,f=0.84) USER MOD Set 1.2: A 97 SER OG : rot 167:sc= 1.16 USER MOD Set 2.1: A 27 THR OG1 : rot -141:sc= 1.19 USER MOD Set 2.2: A 29 HIS : no HE2:sc= 1.18 K(o=4.4,f=-1.2!) USER MOD Set 2.3: A 31 THR OG1 : rot -153:sc= 2.05 USER MOD Set 3.1: A 19 SER OG : rot -57:sc= 1.88 USER MOD Set 3.2: A 37 LYS NZ :NH3+ 173:sc= 2.36 (180deg=0.889) USER MOD Single : A 13 MET CE :methyl -169:sc= 0 (180deg=-0.123) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -155:sc= 0.947! (180deg=0.437) USER MOD Single : A 22 LYS NZ :NH3+ 145:sc= 2.47 (180deg=0.544) USER MOD Single : A 24 MET CE :methyl -157:sc= -0.213 (180deg=-1) USER MOD Single : A 28 GLN : amide:sc= 0.2 K(o=0.2,f=-4.3!) USER MOD Single : A 32 THR OG1 : rot 137:sc= 1.39 USER MOD Single : A 35 LYS NZ :NH3+ -139:sc= 1.45 (180deg=1.14) USER MOD Single : A 38 TYR OH : rot 130:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0137) USER MOD Single : A 55 ASN : amide:sc= 1.2 K(o=1.2,f=-0.39) USER MOD Single : A 56 LYS NZ :NH3+ -172:sc= 3.21 (180deg=3.05) USER MOD Single : A 58 LYS NZ :NH3+ -145:sc= 1.75 (180deg=-1.36) USER MOD Single : A 65 SER OG : rot -50:sc= 1.12 USER MOD Single : A 66 SER OG : rot 180:sc= 0.175 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= 1.27 K(o=1.3,f=-0.06) USER MOD Single : A 73 THR OG1 : rot -131:sc= 1.53 USER MOD Single : A 74 ASN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 75 SER OG : rot -110:sc= 0 USER MOD Single : A 77 THR OG1 : rot 163:sc= 1.28 USER MOD Single : A 78 ASN : amide:sc= 0.372 K(o=0.37,f=-2.5!) USER MOD Single : A 88 SER OG : rot 5:sc= 1.12 USER MOD Single : A 89 TYR OH : rot -13:sc= 1.1 USER MOD Single : A 100 THR OG1 : rot 64:sc= 1.2 USER MOD Single : A 102 HIS : no HE2:sc= -0.198 K(o=-0.2,f=-1.8) USER MOD Single : A 106 LYS NZ :NH3+ -179:sc= 1.23 (180deg=1.16) USER MOD ----------------------------------------------------------------- ATOM 211 N MET A 13 -68.397 36.617 95.619 1.00 0.00 N ATOM 212 CA MET A 13 -67.419 37.283 96.495 1.00 0.00 C ATOM 213 C MET A 13 -66.005 36.675 96.485 1.00 0.00 C ATOM 214 O MET A 13 -65.147 37.138 95.737 1.00 0.00 O ATOM 215 CB MET A 13 -68.006 37.391 97.918 1.00 0.00 C ATOM 216 CG MET A 13 -69.031 38.520 98.056 1.00 0.00 C ATOM 217 SD MET A 13 -68.349 40.200 98.047 1.00 0.00 S ATOM 218 CE MET A 13 -67.520 40.230 99.662 1.00 0.00 C ATOM 0 HA MET A 13 -67.257 38.280 96.084 1.00 0.00 H new ATOM 0 HB2 MET A 13 -68.477 36.445 98.184 1.00 0.00 H new ATOM 0 HB3 MET A 13 -67.196 37.554 98.628 1.00 0.00 H new ATOM 0 HG2 MET A 13 -69.751 38.435 97.242 1.00 0.00 H new ATOM 0 HG3 MET A 13 -69.582 38.375 98.985 1.00 0.00 H new ATOM 0 HE1 MET A 13 -67.218 41.251 99.897 1.00 0.00 H new ATOM 0 HE2 MET A 13 -68.205 39.868 100.429 1.00 0.00 H new ATOM 0 HE3 MET A 13 -66.639 39.589 99.631 1.00 0.00 H new ATOM 228 N CYS A 14 -65.704 35.742 97.396 1.00 0.00 N ATOM 229 CA CYS A 14 -64.362 35.699 97.981 1.00 0.00 C ATOM 230 C CYS A 14 -63.332 34.884 97.190 1.00 0.00 C ATOM 231 O CYS A 14 -63.180 33.680 97.384 1.00 0.00 O ATOM 232 CB CYS A 14 -64.461 35.273 99.442 1.00 0.00 C ATOM 233 SG CYS A 14 -65.010 36.631 100.504 1.00 0.00 S ATOM 0 H CYS A 14 -66.349 35.028 97.735 1.00 0.00 H new ATOM 0 HA CYS A 14 -63.961 36.711 97.926 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -65.157 34.439 99.531 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -63.489 34.915 99.783 1.00 0.00 H new ATOM 238 N SER A 15 -62.549 35.594 96.371 1.00 0.00 N ATOM 239 CA SER A 15 -61.293 35.133 95.767 1.00 0.00 C ATOM 240 C SER A 15 -60.145 34.908 96.770 1.00 0.00 C ATOM 241 O SER A 15 -59.119 34.326 96.404 1.00 0.00 O ATOM 242 CB SER A 15 -60.850 36.154 94.713 1.00 0.00 C ATOM 243 OG SER A 15 -60.724 37.434 95.306 1.00 0.00 O ATOM 0 H SER A 15 -62.783 36.549 96.098 1.00 0.00 H new ATOM 0 HA SER A 15 -61.502 34.157 95.329 1.00 0.00 H new ATOM 0 HB2 SER A 15 -59.898 35.850 94.277 1.00 0.00 H new ATOM 0 HB3 SER A 15 -61.576 36.190 93.901 1.00 0.00 H new ATOM 0 HG SER A 15 -60.439 38.082 94.628 1.00 0.00 H new ATOM 249 N GLY A 16 -60.299 35.345 98.027 1.00 0.00 N ATOM 250 CA GLY A 16 -59.325 35.153 99.102 1.00 0.00 C ATOM 251 C GLY A 16 -59.232 33.703 99.600 1.00 0.00 C ATOM 252 O GLY A 16 -60.040 32.845 99.251 1.00 0.00 O ATOM 0 H GLY A 16 -61.129 35.856 98.329 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -58.343 35.471 98.752 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -59.589 35.799 99.939 1.00 0.00 H new ATOM 256 N LYS A 17 -58.221 33.439 100.437 1.00 0.00 N ATOM 257 CA LYS A 17 -57.920 32.124 101.023 1.00 0.00 C ATOM 258 C LYS A 17 -58.844 31.809 102.216 1.00 0.00 C ATOM 259 O LYS A 17 -59.380 32.713 102.861 1.00 0.00 O ATOM 260 CB LYS A 17 -56.419 32.106 101.404 1.00 0.00 C ATOM 261 CG LYS A 17 -55.622 30.883 100.897 1.00 0.00 C ATOM 262 CD LYS A 17 -55.649 29.641 101.797 1.00 0.00 C ATOM 263 CE LYS A 17 -54.937 29.928 103.126 1.00 0.00 C ATOM 264 NZ LYS A 17 -55.284 28.964 104.190 1.00 0.00 N ATOM 0 H LYS A 17 -57.565 34.161 100.737 1.00 0.00 H new ATOM 0 HA LYS A 17 -58.113 31.333 100.298 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -55.952 33.010 101.014 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -56.337 32.147 102.490 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -56.007 30.605 99.916 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -54.584 31.184 100.758 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -56.680 29.344 101.986 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -55.165 28.806 101.290 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -53.859 29.910 102.965 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -55.193 30.934 103.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -55.144 29.408 105.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -56.279 28.679 104.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -54.674 28.125 104.111 1.00 0.00 H new ATOM 278 N PHE A 18 -58.982 30.518 102.528 1.00 0.00 N ATOM 279 CA PHE A 18 -59.821 29.936 103.586 1.00 0.00 C ATOM 280 C PHE A 18 -59.019 28.909 104.412 1.00 0.00 C ATOM 281 O PHE A 18 -57.961 28.463 103.963 1.00 0.00 O ATOM 282 CB PHE A 18 -61.038 29.265 102.911 1.00 0.00 C ATOM 283 CG PHE A 18 -62.056 30.231 102.333 1.00 0.00 C ATOM 284 CD1 PHE A 18 -61.855 30.810 101.064 1.00 0.00 C ATOM 285 CD2 PHE A 18 -63.201 30.571 103.077 1.00 0.00 C ATOM 286 CE1 PHE A 18 -62.755 31.775 100.576 1.00 0.00 C ATOM 287 CE2 PHE A 18 -64.089 31.550 102.601 1.00 0.00 C ATOM 288 CZ PHE A 18 -63.856 32.161 101.358 1.00 0.00 C ATOM 0 H PHE A 18 -58.475 29.798 102.013 1.00 0.00 H new ATOM 0 HA PHE A 18 -60.155 30.714 104.272 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -60.680 28.615 102.113 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -61.536 28.628 103.642 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -61.008 30.512 100.464 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -63.398 30.078 104.017 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -62.600 32.218 99.603 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -64.949 31.832 103.190 1.00 0.00 H new ATOM 0 HZ PHE A 18 -64.526 32.930 101.002 1.00 0.00 H new ATOM 298 N SER A 19 -59.542 28.463 105.563 1.00 0.00 N ATOM 299 CA SER A 19 -59.062 27.274 106.290 1.00 0.00 C ATOM 300 C SER A 19 -60.068 26.128 106.181 1.00 0.00 C ATOM 301 O SER A 19 -61.275 26.338 106.337 1.00 0.00 O ATOM 302 CB SER A 19 -58.851 27.505 107.796 1.00 0.00 C ATOM 303 OG SER A 19 -58.356 28.780 108.146 1.00 0.00 O ATOM 0 H SER A 19 -60.325 28.925 106.025 1.00 0.00 H new ATOM 0 HA SER A 19 -58.106 27.040 105.822 1.00 0.00 H new ATOM 0 HB2 SER A 19 -59.801 27.349 108.308 1.00 0.00 H new ATOM 0 HB3 SER A 19 -58.160 26.750 108.170 1.00 0.00 H new ATOM 0 HG SER A 19 -57.507 28.940 107.683 1.00 0.00 H new ATOM 309 N ILE A 20 -59.554 24.905 106.003 1.00 0.00 N ATOM 310 CA ILE A 20 -60.252 23.683 106.400 1.00 0.00 C ATOM 311 C ILE A 20 -60.239 23.632 107.932 1.00 0.00 C ATOM 312 O ILE A 20 -59.177 23.584 108.549 1.00 0.00 O ATOM 313 CB ILE A 20 -59.647 22.431 105.716 1.00 0.00 C ATOM 314 CG1 ILE A 20 -60.355 21.130 106.155 1.00 0.00 C ATOM 315 CG2 ILE A 20 -58.129 22.257 105.912 1.00 0.00 C ATOM 316 CD1 ILE A 20 -61.850 21.119 105.822 1.00 0.00 C ATOM 0 H ILE A 20 -58.641 24.738 105.579 1.00 0.00 H new ATOM 0 HA ILE A 20 -61.288 23.689 106.061 1.00 0.00 H new ATOM 0 HB ILE A 20 -59.817 22.614 104.655 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -59.874 20.280 105.670 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -60.227 20.998 107.229 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -57.797 21.355 105.398 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -57.608 23.122 105.501 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -57.907 22.171 106.976 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -62.290 20.179 106.155 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -62.342 21.950 106.328 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -61.984 21.220 104.745 1.00 0.00 H new ATOM 328 N ASP A 21 -61.417 23.751 108.546 1.00 0.00 N ATOM 329 CA ASP A 21 -61.567 24.087 109.966 1.00 0.00 C ATOM 330 C ASP A 21 -62.291 22.980 110.762 1.00 0.00 C ATOM 331 O ASP A 21 -62.208 22.930 111.991 1.00 0.00 O ATOM 332 CB ASP A 21 -62.250 25.459 110.028 1.00 0.00 C ATOM 333 CG ASP A 21 -61.951 26.201 111.325 1.00 0.00 C ATOM 334 OD1 ASP A 21 -60.922 26.917 111.350 1.00 0.00 O ATOM 335 OD2 ASP A 21 -62.766 26.073 112.263 1.00 0.00 O ATOM 0 H ASP A 21 -62.307 23.615 108.066 1.00 0.00 H new ATOM 0 HA ASP A 21 -60.597 24.149 110.458 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -61.921 26.064 109.183 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -63.328 25.330 109.927 1.00 0.00 H new ATOM 340 N LYS A 22 -62.931 22.036 110.057 1.00 0.00 N ATOM 341 CA LYS A 22 -63.037 20.620 110.426 1.00 0.00 C ATOM 342 C LYS A 22 -63.080 19.773 109.149 1.00 0.00 C ATOM 343 O LYS A 22 -63.742 20.150 108.179 1.00 0.00 O ATOM 344 CB LYS A 22 -64.276 20.337 111.299 1.00 0.00 C ATOM 345 CG LYS A 22 -64.183 18.961 111.975 1.00 0.00 C ATOM 346 CD LYS A 22 -65.485 18.505 112.652 1.00 0.00 C ATOM 347 CE LYS A 22 -66.617 18.114 111.686 1.00 0.00 C ATOM 348 NZ LYS A 22 -66.238 16.993 110.794 1.00 0.00 N ATOM 0 H LYS A 22 -63.407 22.248 109.180 1.00 0.00 H new ATOM 0 HA LYS A 22 -62.163 20.356 111.022 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -64.372 21.112 112.060 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -65.174 20.382 110.684 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -63.895 18.220 111.229 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -63.388 18.987 112.721 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -65.264 17.652 113.293 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -65.841 19.307 113.299 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -67.500 17.835 112.260 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -66.890 18.979 111.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -67.069 16.394 110.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -65.886 17.371 109.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -65.492 16.426 111.246 1.00 0.00 H new ATOM 362 N GLU A 23 -62.405 18.624 109.204 1.00 0.00 N ATOM 363 CA GLU A 23 -62.428 17.531 108.227 1.00 0.00 C ATOM 364 C GLU A 23 -63.839 17.061 107.837 1.00 0.00 C ATOM 365 O GLU A 23 -64.816 17.314 108.545 1.00 0.00 O ATOM 366 CB GLU A 23 -61.587 16.360 108.778 1.00 0.00 C ATOM 367 CG GLU A 23 -61.830 15.912 110.240 1.00 0.00 C ATOM 368 CD GLU A 23 -63.184 15.234 110.519 1.00 0.00 C ATOM 369 OE1 GLU A 23 -63.429 14.152 109.944 1.00 0.00 O ATOM 370 OE2 GLU A 23 -63.966 15.774 111.333 1.00 0.00 O ATOM 0 H GLU A 23 -61.784 18.417 109.986 1.00 0.00 H new ATOM 0 HA GLU A 23 -61.999 17.914 107.301 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -61.754 15.497 108.133 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -60.536 16.631 108.683 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -61.035 15.223 110.525 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -61.743 16.785 110.887 1.00 0.00 H new ATOM 377 N MET A 24 -63.944 16.353 106.710 1.00 0.00 N ATOM 378 CA MET A 24 -65.207 15.809 106.210 1.00 0.00 C ATOM 379 C MET A 24 -65.652 14.537 106.943 1.00 0.00 C ATOM 380 O MET A 24 -64.893 13.571 107.063 1.00 0.00 O ATOM 381 CB MET A 24 -65.071 15.532 104.713 1.00 0.00 C ATOM 382 CG MET A 24 -65.225 16.835 103.936 1.00 0.00 C ATOM 383 SD MET A 24 -64.956 16.676 102.161 1.00 0.00 S ATOM 384 CE MET A 24 -63.157 16.473 102.163 1.00 0.00 C ATOM 0 H MET A 24 -63.145 16.139 106.113 1.00 0.00 H new ATOM 0 HA MET A 24 -65.980 16.555 106.397 1.00 0.00 H new ATOM 0 HB2 MET A 24 -64.100 15.084 104.503 1.00 0.00 H new ATOM 0 HB3 MET A 24 -65.828 14.815 104.395 1.00 0.00 H new ATOM 0 HG2 MET A 24 -66.227 17.230 104.106 1.00 0.00 H new ATOM 0 HG3 MET A 24 -64.522 17.567 104.334 1.00 0.00 H new ATOM 0 HE1 MET A 24 -62.757 16.763 101.191 1.00 0.00 H new ATOM 0 HE2 MET A 24 -62.721 17.104 102.938 1.00 0.00 H new ATOM 0 HE3 MET A 24 -62.909 15.430 102.361 1.00 0.00 H new ATOM 394 N ALA A 25 -66.925 14.523 107.359 1.00 0.00 N ATOM 395 CA ALA A 25 -67.616 13.374 107.944 1.00 0.00 C ATOM 396 C ALA A 25 -68.953 13.119 107.225 1.00 0.00 C ATOM 397 O ALA A 25 -69.736 14.050 107.027 1.00 0.00 O ATOM 398 CB ALA A 25 -67.811 13.632 109.443 1.00 0.00 C ATOM 0 H ALA A 25 -67.523 15.347 107.293 1.00 0.00 H new ATOM 0 HA ALA A 25 -67.017 12.472 107.818 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -68.325 12.784 109.894 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -66.839 13.762 109.919 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -68.407 14.534 109.582 1.00 0.00 H new ATOM 404 N GLU A 26 -69.200 11.868 106.812 1.00 0.00 N ATOM 405 CA GLU A 26 -70.374 11.481 106.017 1.00 0.00 C ATOM 406 C GLU A 26 -71.634 11.242 106.874 1.00 0.00 C ATOM 407 O GLU A 26 -71.549 10.982 108.070 1.00 0.00 O ATOM 408 CB GLU A 26 -70.030 10.249 105.161 1.00 0.00 C ATOM 409 CG GLU A 26 -70.733 10.260 103.789 1.00 0.00 C ATOM 410 CD GLU A 26 -70.259 9.144 102.859 1.00 0.00 C ATOM 411 OE1 GLU A 26 -69.057 8.790 102.894 1.00 0.00 O ATOM 412 OE2 GLU A 26 -71.088 8.576 102.114 1.00 0.00 O ATOM 0 H GLU A 26 -68.581 11.085 107.024 1.00 0.00 H new ATOM 0 HA GLU A 26 -70.622 12.318 105.364 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -68.951 10.206 105.011 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -70.313 9.346 105.702 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -71.809 10.167 103.939 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -70.561 11.223 103.308 1.00 0.00 H new ATOM 419 N THR A 27 -72.810 11.299 106.237 1.00 0.00 N ATOM 420 CA THR A 27 -74.129 11.242 106.886 1.00 0.00 C ATOM 421 C THR A 27 -74.928 9.991 106.485 1.00 0.00 C ATOM 422 O THR A 27 -74.614 9.308 105.505 1.00 0.00 O ATOM 423 CB THR A 27 -74.943 12.502 106.530 1.00 0.00 C ATOM 424 OG1 THR A 27 -75.293 12.437 105.170 1.00 0.00 O ATOM 425 CG2 THR A 27 -74.214 13.822 106.794 1.00 0.00 C ATOM 0 H THR A 27 -72.874 11.389 105.223 1.00 0.00 H new ATOM 0 HA THR A 27 -73.955 11.193 107.961 1.00 0.00 H new ATOM 0 HB THR A 27 -75.816 12.503 107.182 1.00 0.00 H new ATOM 0 HG1 THR A 27 -75.228 13.330 104.772 1.00 0.00 H new ATOM 0 HG21 THR A 27 -74.859 14.656 106.516 1.00 0.00 H new ATOM 0 HG22 THR A 27 -73.964 13.894 107.852 1.00 0.00 H new ATOM 0 HG23 THR A 27 -73.299 13.857 106.202 1.00 0.00 H new ATOM 433 N GLN A 28 -76.030 9.725 107.202 1.00 0.00 N ATOM 434 CA GLN A 28 -77.058 8.754 106.792 1.00 0.00 C ATOM 435 C GLN A 28 -77.837 9.209 105.542 1.00 0.00 C ATOM 436 O GLN A 28 -78.289 8.371 104.767 1.00 0.00 O ATOM 437 CB GLN A 28 -78.006 8.406 107.964 1.00 0.00 C ATOM 438 CG GLN A 28 -78.392 9.535 108.940 1.00 0.00 C ATOM 439 CD GLN A 28 -78.896 10.799 108.254 1.00 0.00 C ATOM 440 OE1 GLN A 28 -78.117 11.676 107.910 1.00 0.00 O ATOM 441 NE2 GLN A 28 -80.181 10.922 107.992 1.00 0.00 N ATOM 0 H GLN A 28 -76.235 10.181 108.091 1.00 0.00 H new ATOM 0 HA GLN A 28 -76.533 7.841 106.510 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -78.925 8.001 107.541 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -77.542 7.607 108.543 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -79.164 9.169 109.617 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -77.525 9.786 109.551 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -80.832 10.191 108.278 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -80.525 11.748 107.503 1.00 0.00 H new ATOM 450 N HIS A 29 -77.924 10.523 105.300 1.00 0.00 N ATOM 451 CA HIS A 29 -78.377 11.145 104.053 1.00 0.00 C ATOM 452 C HIS A 29 -77.396 10.889 102.883 1.00 0.00 C ATOM 453 O HIS A 29 -77.728 11.152 101.729 1.00 0.00 O ATOM 454 CB HIS A 29 -78.595 12.644 104.356 1.00 0.00 C ATOM 455 CG HIS A 29 -79.117 13.523 103.243 1.00 0.00 C ATOM 456 ND1 HIS A 29 -78.852 14.869 103.109 1.00 0.00 N ATOM 457 CD2 HIS A 29 -79.990 13.171 102.248 1.00 0.00 C ATOM 458 CE1 HIS A 29 -79.548 15.312 102.048 1.00 0.00 C ATOM 459 NE2 HIS A 29 -80.255 14.316 101.492 1.00 0.00 N ATOM 0 H HIS A 29 -77.667 11.214 106.005 1.00 0.00 H new ATOM 0 HA HIS A 29 -79.313 10.701 103.713 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -79.289 12.718 105.194 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -77.644 13.059 104.692 1.00 0.00 H new ATOM 0 HD1 HIS A 29 -78.240 15.426 103.705 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -80.400 12.186 102.078 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -79.539 16.331 101.691 1.00 0.00 H new ATOM 467 N GLY A 30 -76.198 10.346 103.153 1.00 0.00 N ATOM 468 CA GLY A 30 -75.173 10.031 102.160 1.00 0.00 C ATOM 469 C GLY A 30 -74.386 11.248 101.670 1.00 0.00 C ATOM 470 O GLY A 30 -73.554 11.106 100.777 1.00 0.00 O ATOM 0 H GLY A 30 -75.912 10.108 104.103 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -74.477 9.309 102.588 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -75.646 9.549 101.305 1.00 0.00 H new ATOM 474 N THR A 31 -74.673 12.434 102.207 1.00 0.00 N ATOM 475 CA THR A 31 -73.890 13.668 102.094 1.00 0.00 C ATOM 476 C THR A 31 -72.658 13.609 103.002 1.00 0.00 C ATOM 477 O THR A 31 -72.533 12.714 103.835 1.00 0.00 O ATOM 478 CB THR A 31 -74.767 14.863 102.509 1.00 0.00 C ATOM 479 OG1 THR A 31 -75.361 14.614 103.773 1.00 0.00 O ATOM 480 CG2 THR A 31 -75.867 15.110 101.477 1.00 0.00 C ATOM 0 H THR A 31 -75.513 12.569 102.770 1.00 0.00 H new ATOM 0 HA THR A 31 -73.561 13.782 101.061 1.00 0.00 H new ATOM 0 HB THR A 31 -74.131 15.746 102.569 1.00 0.00 H new ATOM 0 HG1 THR A 31 -76.204 15.109 103.841 1.00 0.00 H new ATOM 0 HG21 THR A 31 -76.475 15.959 101.790 1.00 0.00 H new ATOM 0 HG22 THR A 31 -75.416 15.324 100.508 1.00 0.00 H new ATOM 0 HG23 THR A 31 -76.496 14.223 101.396 1.00 0.00 H new ATOM 488 N THR A 32 -71.755 14.585 102.886 1.00 0.00 N ATOM 489 CA THR A 32 -70.648 14.796 103.823 1.00 0.00 C ATOM 490 C THR A 32 -70.644 16.231 104.342 1.00 0.00 C ATOM 491 O THR A 32 -71.169 17.134 103.691 1.00 0.00 O ATOM 492 CB THR A 32 -69.314 14.360 103.197 1.00 0.00 C ATOM 493 OG1 THR A 32 -68.349 14.204 104.207 1.00 0.00 O ATOM 494 CG2 THR A 32 -68.755 15.324 102.148 1.00 0.00 C ATOM 0 H THR A 32 -71.772 15.264 102.125 1.00 0.00 H new ATOM 0 HA THR A 32 -70.791 14.161 104.698 1.00 0.00 H new ATOM 0 HB THR A 32 -69.528 13.423 102.683 1.00 0.00 H new ATOM 0 HG1 THR A 32 -67.829 13.390 104.040 1.00 0.00 H new ATOM 0 HG21 THR A 32 -67.813 14.935 101.762 1.00 0.00 H new ATOM 0 HG22 THR A 32 -69.468 15.425 101.330 1.00 0.00 H new ATOM 0 HG23 THR A 32 -68.585 16.299 102.604 1.00 0.00 H new ATOM 502 N VAL A 33 -70.079 16.430 105.535 1.00 0.00 N ATOM 503 CA VAL A 33 -70.110 17.699 106.270 1.00 0.00 C ATOM 504 C VAL A 33 -68.686 18.200 106.488 1.00 0.00 C ATOM 505 O VAL A 33 -67.949 17.659 107.310 1.00 0.00 O ATOM 506 CB VAL A 33 -70.892 17.581 107.595 1.00 0.00 C ATOM 507 CG1 VAL A 33 -70.997 18.950 108.284 1.00 0.00 C ATOM 508 CG2 VAL A 33 -72.319 17.063 107.365 1.00 0.00 C ATOM 0 H VAL A 33 -69.574 15.695 106.030 1.00 0.00 H new ATOM 0 HA VAL A 33 -70.647 18.434 105.670 1.00 0.00 H new ATOM 0 HB VAL A 33 -70.343 16.877 108.221 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -71.552 18.846 109.217 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -69.997 19.328 108.497 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -71.517 19.648 107.628 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -72.839 16.993 108.320 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -72.854 17.750 106.710 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -72.278 16.077 106.901 1.00 0.00 H new ATOM 518 N VAL A 34 -68.312 19.237 105.726 1.00 0.00 N ATOM 519 CA VAL A 34 -67.096 20.037 105.940 1.00 0.00 C ATOM 520 C VAL A 34 -67.359 21.074 107.046 1.00 0.00 C ATOM 521 O VAL A 34 -68.515 21.413 107.308 1.00 0.00 O ATOM 522 CB VAL A 34 -66.680 20.796 104.646 1.00 0.00 C ATOM 523 CG1 VAL A 34 -65.154 20.960 104.593 1.00 0.00 C ATOM 524 CG2 VAL A 34 -67.121 20.153 103.321 1.00 0.00 C ATOM 0 H VAL A 34 -68.859 19.551 104.924 1.00 0.00 H new ATOM 0 HA VAL A 34 -66.292 19.357 106.224 1.00 0.00 H new ATOM 0 HB VAL A 34 -67.204 21.749 104.724 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -64.877 21.492 103.683 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -64.819 21.527 105.462 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -64.682 19.977 104.597 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -66.778 20.766 102.487 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -66.690 19.155 103.240 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -68.208 20.082 103.295 1.00 0.00 H new ATOM 534 N LYS A 35 -66.310 21.683 107.616 1.00 0.00 N ATOM 535 CA LYS A 35 -66.413 22.999 108.268 1.00 0.00 C ATOM 536 C LYS A 35 -65.282 23.906 107.789 1.00 0.00 C ATOM 537 O LYS A 35 -64.116 23.506 107.816 1.00 0.00 O ATOM 538 CB LYS A 35 -66.442 22.833 109.794 1.00 0.00 C ATOM 539 CG LYS A 35 -66.951 24.057 110.588 1.00 0.00 C ATOM 540 CD LYS A 35 -65.963 24.678 111.593 1.00 0.00 C ATOM 541 CE LYS A 35 -65.288 23.656 112.515 1.00 0.00 C ATOM 542 NZ LYS A 35 -64.312 24.281 113.434 1.00 0.00 N ATOM 0 H LYS A 35 -65.372 21.282 107.639 1.00 0.00 H new ATOM 0 HA LYS A 35 -67.349 23.481 107.987 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -67.072 21.977 110.037 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -65.435 22.594 110.135 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -67.245 24.828 109.876 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -67.850 23.764 111.129 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -65.194 25.220 111.043 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -66.493 25.409 112.204 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -66.050 23.138 113.097 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -64.782 22.904 111.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -63.467 23.679 113.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -64.041 25.216 113.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -64.741 24.388 114.375 1.00 0.00 H new ATOM 556 N VAL A 36 -65.632 25.112 107.334 1.00 0.00 N ATOM 557 CA VAL A 36 -64.692 26.102 106.789 1.00 0.00 C ATOM 558 C VAL A 36 -64.483 27.257 107.768 1.00 0.00 C ATOM 559 O VAL A 36 -65.341 27.520 108.613 1.00 0.00 O ATOM 560 CB VAL A 36 -65.152 26.641 105.409 1.00 0.00 C ATOM 561 CG1 VAL A 36 -65.614 25.517 104.475 1.00 0.00 C ATOM 562 CG2 VAL A 36 -66.282 27.682 105.478 1.00 0.00 C ATOM 0 H VAL A 36 -66.599 25.437 107.333 1.00 0.00 H new ATOM 0 HA VAL A 36 -63.740 25.591 106.644 1.00 0.00 H new ATOM 0 HB VAL A 36 -64.259 27.128 105.017 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -65.927 25.942 103.521 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -64.792 24.820 104.310 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -66.452 24.988 104.929 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -66.541 28.005 104.470 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -67.157 27.238 105.953 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -65.950 28.542 106.060 1.00 0.00 H new ATOM 572 N LYS A 37 -63.392 28.003 107.568 1.00 0.00 N ATOM 573 CA LYS A 37 -63.149 29.354 108.091 1.00 0.00 C ATOM 574 C LYS A 37 -62.658 30.227 106.933 1.00 0.00 C ATOM 575 O LYS A 37 -61.937 29.717 106.076 1.00 0.00 O ATOM 576 CB LYS A 37 -62.079 29.270 109.192 1.00 0.00 C ATOM 577 CG LYS A 37 -61.903 30.565 110.005 1.00 0.00 C ATOM 578 CD LYS A 37 -60.441 31.008 110.178 1.00 0.00 C ATOM 579 CE LYS A 37 -59.639 30.247 111.241 1.00 0.00 C ATOM 580 NZ LYS A 37 -59.246 28.889 110.807 1.00 0.00 N ATOM 0 H LYS A 37 -62.611 27.663 107.006 1.00 0.00 H new ATOM 0 HA LYS A 37 -64.057 29.785 108.514 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -62.338 28.460 109.873 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -61.124 29.009 108.735 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -62.458 31.366 109.516 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -62.347 30.425 110.990 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -59.932 30.902 109.220 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -60.429 32.068 110.430 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -58.743 30.816 111.489 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -60.232 30.174 112.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -58.609 28.469 111.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -60.095 28.296 110.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -58.757 28.945 109.891 1.00 0.00 H new ATOM 594 N TYR A 38 -62.996 31.517 106.886 1.00 0.00 N ATOM 595 CA TYR A 38 -62.341 32.433 105.943 1.00 0.00 C ATOM 596 C TYR A 38 -60.990 32.910 106.499 1.00 0.00 C ATOM 597 O TYR A 38 -60.786 32.930 107.707 1.00 0.00 O ATOM 598 CB TYR A 38 -63.290 33.591 105.590 1.00 0.00 C ATOM 599 CG TYR A 38 -62.760 34.592 104.573 1.00 0.00 C ATOM 600 CD1 TYR A 38 -62.145 34.146 103.385 1.00 0.00 C ATOM 601 CD2 TYR A 38 -62.925 35.976 104.783 1.00 0.00 C ATOM 602 CE1 TYR A 38 -61.718 35.063 102.410 1.00 0.00 C ATOM 603 CE2 TYR A 38 -62.506 36.903 103.809 1.00 0.00 C ATOM 604 CZ TYR A 38 -61.913 36.442 102.612 1.00 0.00 C ATOM 605 OH TYR A 38 -61.533 37.319 101.646 1.00 0.00 O ATOM 0 H TYR A 38 -63.706 31.948 107.478 1.00 0.00 H new ATOM 0 HA TYR A 38 -62.121 31.906 105.015 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -64.220 33.171 105.208 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -63.536 34.127 106.507 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -62.001 33.088 103.223 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -63.377 36.329 105.699 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -61.241 34.710 101.507 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -62.637 37.962 103.976 1.00 0.00 H new ATOM 0 HH TYR A 38 -62.271 37.934 101.454 1.00 0.00 H new ATOM 615 N GLU A 39 -60.060 33.310 105.628 1.00 0.00 N ATOM 616 CA GLU A 39 -58.788 33.924 106.021 1.00 0.00 C ATOM 617 C GLU A 39 -58.633 35.275 105.320 1.00 0.00 C ATOM 618 O GLU A 39 -58.630 36.304 105.996 1.00 0.00 O ATOM 619 CB GLU A 39 -57.601 32.979 105.758 1.00 0.00 C ATOM 620 CG GLU A 39 -57.609 31.762 106.696 1.00 0.00 C ATOM 621 CD GLU A 39 -56.507 30.748 106.368 1.00 0.00 C ATOM 622 OE1 GLU A 39 -55.454 31.117 105.807 1.00 0.00 O ATOM 623 OE2 GLU A 39 -56.727 29.536 106.607 1.00 0.00 O ATOM 0 H GLU A 39 -60.170 33.216 104.618 1.00 0.00 H new ATOM 0 HA GLU A 39 -58.793 34.103 107.096 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -57.633 32.638 104.723 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -56.667 33.527 105.885 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -57.488 32.102 107.725 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -58.579 31.269 106.635 1.00 0.00 H new ATOM 630 N GLY A 40 -58.567 35.244 103.981 1.00 0.00 N ATOM 631 CA GLY A 40 -58.279 36.315 103.022 1.00 0.00 C ATOM 632 C GLY A 40 -58.199 37.755 103.541 1.00 0.00 C ATOM 633 O GLY A 40 -57.106 38.312 103.611 1.00 0.00 O ATOM 0 H GLY A 40 -58.734 34.365 103.490 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -57.330 36.083 102.540 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -59.046 36.283 102.248 1.00 0.00 H new ATOM 637 N ALA A 41 -59.354 38.385 103.791 1.00 0.00 N ATOM 638 CA ALA A 41 -59.482 39.849 103.821 1.00 0.00 C ATOM 639 C ALA A 41 -60.325 40.409 104.984 1.00 0.00 C ATOM 640 O ALA A 41 -60.765 41.558 104.924 1.00 0.00 O ATOM 641 CB ALA A 41 -60.028 40.301 102.458 1.00 0.00 C ATOM 0 H ALA A 41 -60.228 37.894 103.979 1.00 0.00 H new ATOM 0 HA ALA A 41 -58.490 40.261 104.007 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -60.134 41.386 102.450 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -59.338 39.998 101.671 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -61.000 39.840 102.285 1.00 0.00 H new ATOM 647 N GLY A 42 -60.612 39.621 106.027 1.00 0.00 N ATOM 648 CA GLY A 42 -61.397 40.058 107.189 1.00 0.00 C ATOM 649 C GLY A 42 -62.905 40.026 106.933 1.00 0.00 C ATOM 650 O GLY A 42 -63.648 39.407 107.692 1.00 0.00 O ATOM 0 H GLY A 42 -60.303 38.651 106.089 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -61.164 39.418 108.040 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -61.101 41.071 107.461 1.00 0.00 H new ATOM 654 N ALA A 43 -63.332 40.705 105.866 1.00 0.00 N ATOM 655 CA ALA A 43 -64.712 40.952 105.457 1.00 0.00 C ATOM 656 C ALA A 43 -65.566 39.676 105.228 1.00 0.00 C ATOM 657 O ALA A 43 -65.016 38.580 105.088 1.00 0.00 O ATOM 658 CB ALA A 43 -64.629 41.813 104.186 1.00 0.00 C ATOM 0 H ALA A 43 -62.669 41.128 105.217 1.00 0.00 H new ATOM 0 HA ALA A 43 -65.237 41.456 106.269 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -65.635 42.033 103.829 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -64.112 42.746 104.412 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -64.081 41.272 103.415 1.00 0.00 H new ATOM 664 N PRO A 44 -66.912 39.799 105.166 1.00 0.00 N ATOM 665 CA PRO A 44 -67.808 38.689 104.841 1.00 0.00 C ATOM 666 C PRO A 44 -67.609 38.119 103.428 1.00 0.00 C ATOM 667 O PRO A 44 -67.080 38.777 102.533 1.00 0.00 O ATOM 668 CB PRO A 44 -69.240 39.228 104.959 1.00 0.00 C ATOM 669 CG PRO A 44 -69.114 40.583 105.644 1.00 0.00 C ATOM 670 CD PRO A 44 -67.677 41.016 105.390 1.00 0.00 C ATOM 0 HA PRO A 44 -67.596 37.870 105.529 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -69.703 39.327 103.977 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -69.866 38.552 105.541 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -69.822 41.302 105.232 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -69.321 40.507 106.711 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -67.618 41.676 104.525 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -67.283 41.571 106.241 1.00 0.00 H new ATOM 678 N CYS A 45 -68.156 36.920 103.216 1.00 0.00 N ATOM 679 CA CYS A 45 -68.141 36.180 101.961 1.00 0.00 C ATOM 680 C CYS A 45 -69.475 35.459 101.729 1.00 0.00 C ATOM 681 O CYS A 45 -70.029 34.890 102.672 1.00 0.00 O ATOM 682 CB CYS A 45 -67.042 35.111 102.067 1.00 0.00 C ATOM 683 SG CYS A 45 -65.360 35.721 102.277 1.00 0.00 S ATOM 0 H CYS A 45 -68.646 36.417 103.956 1.00 0.00 H new ATOM 0 HA CYS A 45 -67.967 36.874 101.139 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -67.278 34.459 102.908 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -67.074 34.496 101.168 1.00 0.00 H new ATOM 688 N LYS A 46 -69.880 35.302 100.456 1.00 0.00 N ATOM 689 CA LYS A 46 -70.215 33.951 99.989 1.00 0.00 C ATOM 690 C LYS A 46 -68.924 33.281 99.511 1.00 0.00 C ATOM 691 O LYS A 46 -68.060 33.962 98.944 1.00 0.00 O ATOM 692 CB LYS A 46 -71.368 33.901 98.973 1.00 0.00 C ATOM 693 CG LYS A 46 -71.041 34.223 97.506 1.00 0.00 C ATOM 694 CD LYS A 46 -72.118 33.676 96.553 1.00 0.00 C ATOM 695 CE LYS A 46 -73.546 34.022 97.000 1.00 0.00 C ATOM 696 NZ LYS A 46 -74.501 34.010 95.869 1.00 0.00 N ATOM 0 H LYS A 46 -69.979 36.049 99.768 1.00 0.00 H new ATOM 0 HA LYS A 46 -70.624 33.379 100.822 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -71.803 32.902 99.008 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -72.139 34.597 99.305 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -70.957 35.302 97.380 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -70.073 33.795 97.246 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -71.949 34.077 95.554 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -72.017 32.593 96.483 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -73.872 33.308 97.757 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -73.551 35.007 97.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -75.463 34.182 96.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -74.245 34.755 95.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -74.467 33.084 95.396 1.00 0.00 H new ATOM 710 N VAL A 47 -68.770 31.987 99.794 1.00 0.00 N ATOM 711 CA VAL A 47 -67.498 31.274 99.613 1.00 0.00 C ATOM 712 C VAL A 47 -67.578 30.392 98.360 1.00 0.00 C ATOM 713 O VAL A 47 -68.546 29.641 98.221 1.00 0.00 O ATOM 714 CB VAL A 47 -66.992 30.543 100.886 1.00 0.00 C ATOM 715 CG1 VAL A 47 -67.614 31.047 102.198 1.00 0.00 C ATOM 716 CG2 VAL A 47 -67.046 29.016 100.892 1.00 0.00 C ATOM 0 H VAL A 47 -69.522 31.400 100.156 1.00 0.00 H new ATOM 0 HA VAL A 47 -66.716 32.015 99.446 1.00 0.00 H new ATOM 0 HB VAL A 47 -65.939 30.819 100.834 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -67.205 30.482 103.035 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -67.384 32.105 102.327 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -68.695 30.912 102.163 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -66.662 28.642 101.841 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -68.077 28.688 100.763 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -66.437 28.627 100.076 1.00 0.00 H new ATOM 726 N PRO A 48 -66.607 30.470 97.429 1.00 0.00 N ATOM 727 CA PRO A 48 -66.542 29.551 96.299 1.00 0.00 C ATOM 728 C PRO A 48 -66.338 28.121 96.810 1.00 0.00 C ATOM 729 O PRO A 48 -65.312 27.846 97.433 1.00 0.00 O ATOM 730 CB PRO A 48 -65.370 30.005 95.417 1.00 0.00 C ATOM 731 CG PRO A 48 -64.877 31.313 96.033 1.00 0.00 C ATOM 732 CD PRO A 48 -65.436 31.332 97.449 1.00 0.00 C ATOM 0 HA PRO A 48 -67.465 29.559 95.720 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -64.578 29.256 95.401 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -65.690 30.153 94.386 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -63.788 31.357 96.040 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -65.227 32.172 95.461 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -64.698 30.971 98.165 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -65.702 32.345 97.750 1.00 0.00 H new ATOM 740 N ILE A 49 -67.298 27.225 96.551 1.00 0.00 N ATOM 741 CA ILE A 49 -67.157 25.781 96.762 1.00 0.00 C ATOM 742 C ILE A 49 -67.528 25.050 95.476 1.00 0.00 C ATOM 743 O ILE A 49 -68.629 25.225 94.955 1.00 0.00 O ATOM 744 CB ILE A 49 -67.973 25.253 97.969 1.00 0.00 C ATOM 745 CG1 ILE A 49 -67.531 25.998 99.247 1.00 0.00 C ATOM 746 CG2 ILE A 49 -67.800 23.724 98.112 1.00 0.00 C ATOM 747 CD1 ILE A 49 -67.968 25.400 100.592 1.00 0.00 C ATOM 0 H ILE A 49 -68.211 27.489 96.182 1.00 0.00 H new ATOM 0 HA ILE A 49 -66.115 25.583 97.013 1.00 0.00 H new ATOM 0 HB ILE A 49 -69.034 25.444 97.807 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -66.443 26.061 99.242 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -67.910 27.019 99.192 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -68.380 23.370 98.965 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -68.151 23.232 97.205 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -66.747 23.490 98.267 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -67.591 26.020 101.405 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -69.056 25.364 100.638 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -67.567 24.391 100.689 1.00 0.00 H new ATOM 759 N GLU A 50 -66.629 24.181 95.015 1.00 0.00 N ATOM 760 CA GLU A 50 -66.942 23.124 94.052 1.00 0.00 C ATOM 761 C GLU A 50 -66.511 21.768 94.634 1.00 0.00 C ATOM 762 O GLU A 50 -65.758 21.699 95.610 1.00 0.00 O ATOM 763 CB GLU A 50 -66.240 23.349 92.695 1.00 0.00 C ATOM 764 CG GLU A 50 -66.353 24.753 92.071 1.00 0.00 C ATOM 765 CD GLU A 50 -65.377 24.885 90.904 1.00 0.00 C ATOM 766 OE1 GLU A 50 -64.151 24.947 91.155 1.00 0.00 O ATOM 767 OE2 GLU A 50 -65.792 24.828 89.719 1.00 0.00 O ATOM 0 H GLU A 50 -65.651 24.191 95.303 1.00 0.00 H new ATOM 0 HA GLU A 50 -68.017 23.140 93.873 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -65.182 23.118 92.819 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -66.642 22.629 91.983 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -67.372 24.925 91.725 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -66.139 25.513 92.823 1.00 0.00 H new ATOM 774 N ILE A 51 -66.913 20.683 93.969 1.00 0.00 N ATOM 775 CA ILE A 51 -66.189 19.412 94.017 1.00 0.00 C ATOM 776 C ILE A 51 -65.809 19.073 92.597 1.00 0.00 C ATOM 777 O ILE A 51 -66.669 19.111 91.714 1.00 0.00 O ATOM 778 CB ILE A 51 -67.003 18.253 94.612 1.00 0.00 C ATOM 779 CG1 ILE A 51 -67.587 18.672 95.968 1.00 0.00 C ATOM 780 CG2 ILE A 51 -66.110 16.999 94.701 1.00 0.00 C ATOM 781 CD1 ILE A 51 -68.127 17.493 96.772 1.00 0.00 C ATOM 0 H ILE A 51 -67.748 20.661 93.383 1.00 0.00 H new ATOM 0 HA ILE A 51 -65.327 19.536 94.672 1.00 0.00 H new ATOM 0 HB ILE A 51 -67.848 18.005 93.970 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -66.816 19.179 96.549 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -68.389 19.392 95.806 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -66.683 16.173 95.123 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -65.763 16.728 93.704 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -65.252 17.208 95.339 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -68.527 17.852 97.720 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -68.919 17.000 96.208 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -67.322 16.783 96.963 1.00 0.00 H new ATOM 793 N ARG A 52 -64.544 18.716 92.399 1.00 0.00 N ATOM 794 CA ARG A 52 -63.983 18.369 91.108 1.00 0.00 C ATOM 795 C ARG A 52 -63.539 16.903 91.078 1.00 0.00 C ATOM 796 O ARG A 52 -63.259 16.300 92.119 1.00 0.00 O ATOM 797 CB ARG A 52 -62.873 19.376 90.776 1.00 0.00 C ATOM 798 CG ARG A 52 -63.468 20.774 90.542 1.00 0.00 C ATOM 799 CD ARG A 52 -62.406 21.880 90.475 1.00 0.00 C ATOM 800 NE ARG A 52 -62.926 23.029 89.723 1.00 0.00 N ATOM 801 CZ ARG A 52 -63.145 23.066 88.418 1.00 0.00 C ATOM 802 NH1 ARG A 52 -62.525 22.247 87.600 1.00 0.00 N ATOM 803 NH2 ARG A 52 -64.032 23.898 87.933 1.00 0.00 N ATOM 0 H ARG A 52 -63.865 18.660 93.158 1.00 0.00 H new ATOM 0 HA ARG A 52 -64.735 18.443 90.322 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -62.151 19.413 91.592 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -62.332 19.051 89.887 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -64.037 20.769 89.612 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -64.170 21.002 91.344 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -62.127 22.190 91.482 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -61.503 21.500 89.997 1.00 0.00 H new ATOM 0 HE ARG A 52 -63.137 23.874 90.254 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -61.860 21.566 87.967 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -62.708 22.292 86.598 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -64.550 24.513 88.560 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -64.205 23.931 86.928 1.00 0.00 H new ATOM 817 N ASP A 53 -63.534 16.336 89.873 1.00 0.00 N ATOM 818 CA ASP A 53 -63.127 14.959 89.586 1.00 0.00 C ATOM 819 C ASP A 53 -61.650 14.694 89.922 1.00 0.00 C ATOM 820 O ASP A 53 -60.912 15.597 90.315 1.00 0.00 O ATOM 821 CB ASP A 53 -63.478 14.604 88.125 1.00 0.00 C ATOM 822 CG ASP A 53 -62.701 15.342 87.022 1.00 0.00 C ATOM 823 OD1 ASP A 53 -62.126 16.425 87.280 1.00 0.00 O ATOM 824 OD2 ASP A 53 -62.712 14.822 85.881 1.00 0.00 O ATOM 0 H ASP A 53 -63.824 16.842 89.036 1.00 0.00 H new ATOM 0 HA ASP A 53 -63.689 14.295 90.242 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -63.324 13.533 87.990 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -64.541 14.794 87.976 1.00 0.00 H new ATOM 829 N VAL A 54 -61.188 13.445 89.776 1.00 0.00 N ATOM 830 CA VAL A 54 -59.809 13.063 90.132 1.00 0.00 C ATOM 831 C VAL A 54 -58.753 13.896 89.391 1.00 0.00 C ATOM 832 O VAL A 54 -57.782 14.340 90.011 1.00 0.00 O ATOM 833 CB VAL A 54 -59.566 11.545 89.991 1.00 0.00 C ATOM 834 CG1 VAL A 54 -60.498 10.754 90.921 1.00 0.00 C ATOM 835 CG2 VAL A 54 -59.742 11.017 88.560 1.00 0.00 C ATOM 0 H VAL A 54 -61.750 12.676 89.412 1.00 0.00 H new ATOM 0 HA VAL A 54 -59.692 13.299 91.190 1.00 0.00 H new ATOM 0 HB VAL A 54 -58.523 11.397 90.270 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -60.309 9.687 90.804 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -60.312 11.044 91.955 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -61.535 10.968 90.665 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -59.555 9.943 88.543 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -60.760 11.213 88.222 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -59.037 11.519 87.898 1.00 0.00 H new ATOM 845 N ASN A 55 -58.999 14.183 88.104 1.00 0.00 N ATOM 846 CA ASN A 55 -58.200 15.055 87.239 1.00 0.00 C ATOM 847 C ASN A 55 -58.337 16.552 87.584 1.00 0.00 C ATOM 848 O ASN A 55 -57.486 17.350 87.197 1.00 0.00 O ATOM 849 CB ASN A 55 -58.655 14.857 85.784 1.00 0.00 C ATOM 850 CG ASN A 55 -58.457 13.475 85.189 1.00 0.00 C ATOM 851 OD1 ASN A 55 -57.851 12.583 85.762 1.00 0.00 O ATOM 852 ND2 ASN A 55 -58.976 13.279 83.996 1.00 0.00 N ATOM 0 H ASN A 55 -59.804 13.791 87.616 1.00 0.00 H new ATOM 0 HA ASN A 55 -57.156 14.778 87.388 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -59.715 15.105 85.722 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -58.123 15.575 85.160 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -58.875 12.373 83.538 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -59.480 14.033 83.529 1.00 0.00 H new ATOM 859 N LYS A 56 -59.397 16.924 88.318 1.00 0.00 N ATOM 860 CA LYS A 56 -59.735 18.247 88.869 1.00 0.00 C ATOM 861 C LYS A 56 -60.240 19.263 87.828 1.00 0.00 C ATOM 862 O LYS A 56 -60.533 20.414 88.156 1.00 0.00 O ATOM 863 CB LYS A 56 -58.636 18.769 89.825 1.00 0.00 C ATOM 864 CG LYS A 56 -58.052 17.626 90.682 1.00 0.00 C ATOM 865 CD LYS A 56 -57.245 18.039 91.915 1.00 0.00 C ATOM 866 CE LYS A 56 -56.298 16.905 92.354 1.00 0.00 C ATOM 867 NZ LYS A 56 -56.945 15.566 92.391 1.00 0.00 N ATOM 0 H LYS A 56 -60.110 16.238 88.565 1.00 0.00 H new ATOM 0 HA LYS A 56 -60.617 18.105 89.493 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -57.839 19.237 89.246 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -59.052 19.539 90.475 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -58.875 16.991 91.010 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -57.413 17.015 90.045 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -56.667 18.936 91.693 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -57.922 18.290 92.731 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -55.448 16.869 91.673 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -55.904 17.136 93.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -56.295 14.878 92.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -57.817 15.617 92.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -57.176 15.265 91.423 1.00 0.00 H new ATOM 881 N GLU A 57 -60.414 18.828 86.580 1.00 0.00 N ATOM 882 CA GLU A 57 -61.012 19.563 85.457 1.00 0.00 C ATOM 883 C GLU A 57 -62.537 19.724 85.586 1.00 0.00 C ATOM 884 O GLU A 57 -63.044 20.821 85.330 1.00 0.00 O ATOM 885 CB GLU A 57 -60.674 18.889 84.104 1.00 0.00 C ATOM 886 CG GLU A 57 -60.530 17.358 84.200 1.00 0.00 C ATOM 887 CD GLU A 57 -60.717 16.555 82.909 1.00 0.00 C ATOM 888 OE1 GLU A 57 -61.383 17.042 81.975 1.00 0.00 O ATOM 889 OE2 GLU A 57 -60.350 15.351 82.929 1.00 0.00 O ATOM 0 H GLU A 57 -60.122 17.890 86.305 1.00 0.00 H new ATOM 0 HA GLU A 57 -60.573 20.560 85.487 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -61.455 19.128 83.383 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -59.745 19.310 83.719 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -59.539 17.136 84.595 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -61.253 16.996 84.931 1.00 0.00 H new ATOM 896 N LYS A 58 -63.273 18.672 85.984 1.00 0.00 N ATOM 897 CA LYS A 58 -64.741 18.613 85.859 1.00 0.00 C ATOM 898 C LYS A 58 -65.410 18.714 87.225 1.00 0.00 C ATOM 899 O LYS A 58 -65.021 18.003 88.147 1.00 0.00 O ATOM 900 CB LYS A 58 -65.189 17.302 85.185 1.00 0.00 C ATOM 901 CG LYS A 58 -64.460 17.001 83.870 1.00 0.00 C ATOM 902 CD LYS A 58 -64.948 15.686 83.241 1.00 0.00 C ATOM 903 CE LYS A 58 -63.830 15.059 82.401 1.00 0.00 C ATOM 904 NZ LYS A 58 -62.829 14.373 83.254 1.00 0.00 N ATOM 0 H LYS A 58 -62.866 17.836 86.403 1.00 0.00 H new ATOM 0 HA LYS A 58 -65.043 19.459 85.242 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -65.027 16.475 85.877 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -66.261 17.351 84.992 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -64.618 17.821 83.169 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -63.387 16.941 84.053 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -65.259 14.993 84.023 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -65.821 15.874 82.616 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -64.259 14.346 81.696 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -63.338 15.833 81.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -61.883 14.483 82.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -62.838 14.793 84.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -63.063 13.362 83.320 1.00 0.00 H new ATOM 918 N VAL A 59 -66.440 19.557 87.346 1.00 0.00 N ATOM 919 CA VAL A 59 -67.270 19.669 88.556 1.00 0.00 C ATOM 920 C VAL A 59 -68.219 18.464 88.664 1.00 0.00 C ATOM 921 O VAL A 59 -68.853 18.088 87.680 1.00 0.00 O ATOM 922 CB VAL A 59 -68.055 20.998 88.574 1.00 0.00 C ATOM 923 CG1 VAL A 59 -68.894 21.153 89.852 1.00 0.00 C ATOM 924 CG2 VAL A 59 -67.091 22.191 88.508 1.00 0.00 C ATOM 0 H VAL A 59 -66.727 20.190 86.599 1.00 0.00 H new ATOM 0 HA VAL A 59 -66.611 19.668 89.424 1.00 0.00 H new ATOM 0 HB VAL A 59 -68.714 20.979 87.706 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -69.430 22.102 89.823 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -69.610 20.334 89.919 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -68.238 21.133 90.722 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -67.661 23.120 88.522 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -66.420 22.164 89.366 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -66.507 22.137 87.589 1.00 0.00 H new ATOM 934 N VAL A 60 -68.315 17.862 89.857 1.00 0.00 N ATOM 935 CA VAL A 60 -69.019 16.588 90.107 1.00 0.00 C ATOM 936 C VAL A 60 -69.928 16.569 91.348 1.00 0.00 C ATOM 937 O VAL A 60 -70.687 15.609 91.519 1.00 0.00 O ATOM 938 CB VAL A 60 -68.017 15.413 90.183 1.00 0.00 C ATOM 939 CG1 VAL A 60 -67.320 15.167 88.840 1.00 0.00 C ATOM 940 CG2 VAL A 60 -66.952 15.613 91.271 1.00 0.00 C ATOM 0 H VAL A 60 -67.896 18.254 90.700 1.00 0.00 H new ATOM 0 HA VAL A 60 -69.685 16.475 89.251 1.00 0.00 H new ATOM 0 HB VAL A 60 -68.616 14.540 90.442 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -66.625 14.333 88.938 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -68.066 14.930 88.081 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -66.773 16.062 88.544 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -66.276 14.758 91.280 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -66.386 16.521 91.064 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -67.437 15.702 92.243 1.00 0.00 H new ATOM 950 N GLY A 61 -69.908 17.603 92.199 1.00 0.00 N ATOM 951 CA GLY A 61 -70.670 17.656 93.457 1.00 0.00 C ATOM 952 C GLY A 61 -71.809 18.682 93.475 1.00 0.00 C ATOM 953 O GLY A 61 -71.886 19.549 92.605 1.00 0.00 O ATOM 0 H GLY A 61 -69.353 18.442 92.031 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -71.086 16.668 93.655 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -69.983 17.882 94.272 1.00 0.00 H new ATOM 957 N ARG A 62 -72.668 18.600 94.502 1.00 0.00 N ATOM 958 CA ARG A 62 -73.781 19.529 94.783 1.00 0.00 C ATOM 959 C ARG A 62 -73.739 19.956 96.252 1.00 0.00 C ATOM 960 O ARG A 62 -73.772 19.101 97.134 1.00 0.00 O ATOM 961 CB ARG A 62 -75.133 18.850 94.489 1.00 0.00 C ATOM 962 CG ARG A 62 -75.375 18.514 93.004 1.00 0.00 C ATOM 963 CD ARG A 62 -75.894 17.080 92.798 1.00 0.00 C ATOM 964 NE ARG A 62 -74.909 16.056 93.201 1.00 0.00 N ATOM 965 CZ ARG A 62 -73.763 15.741 92.623 1.00 0.00 C ATOM 966 NH1 ARG A 62 -73.339 16.288 91.512 1.00 0.00 N ATOM 967 NH2 ARG A 62 -72.990 14.859 93.190 1.00 0.00 N ATOM 0 H ARG A 62 -72.606 17.852 95.192 1.00 0.00 H new ATOM 0 HA ARG A 62 -73.675 20.404 94.142 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -75.196 17.930 95.071 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -75.935 19.502 94.835 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -76.094 19.220 92.588 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -74.445 18.643 92.450 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -76.810 16.943 93.372 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -76.151 16.938 91.748 1.00 0.00 H new ATOM 0 HE ARG A 62 -75.145 15.521 94.037 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -73.903 16.998 91.046 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -72.444 16.004 91.113 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -73.272 14.422 94.067 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -72.102 14.605 92.756 1.00 0.00 H new ATOM 981 N ILE A 63 -73.647 21.257 96.544 1.00 0.00 N ATOM 982 CA ILE A 63 -73.710 21.746 97.930 1.00 0.00 C ATOM 983 C ILE A 63 -75.163 21.714 98.429 1.00 0.00 C ATOM 984 O ILE A 63 -76.071 22.079 97.685 1.00 0.00 O ATOM 985 CB ILE A 63 -73.092 23.152 98.108 1.00 0.00 C ATOM 986 CG1 ILE A 63 -71.834 23.435 97.246 1.00 0.00 C ATOM 987 CG2 ILE A 63 -72.727 23.284 99.597 1.00 0.00 C ATOM 988 CD1 ILE A 63 -72.165 24.100 95.904 1.00 0.00 C ATOM 0 H ILE A 63 -73.529 21.990 95.844 1.00 0.00 H new ATOM 0 HA ILE A 63 -73.103 21.074 98.537 1.00 0.00 H new ATOM 0 HB ILE A 63 -73.829 23.881 97.771 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -71.154 24.077 97.806 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -71.308 22.498 97.061 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -72.285 24.264 99.778 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -73.626 23.175 100.203 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -72.011 22.507 99.866 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -71.244 24.273 95.347 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -72.822 23.449 95.327 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -72.665 25.052 96.083 1.00 0.00 H new ATOM 1000 N ILE A 64 -75.380 21.280 99.678 1.00 0.00 N ATOM 1001 CA ILE A 64 -76.716 21.031 100.244 1.00 0.00 C ATOM 1002 C ILE A 64 -77.073 22.050 101.326 1.00 0.00 C ATOM 1003 O ILE A 64 -78.218 22.489 101.405 1.00 0.00 O ATOM 1004 CB ILE A 64 -76.797 19.574 100.757 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -76.454 18.539 99.661 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -78.162 19.249 101.386 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -77.301 18.606 98.380 1.00 0.00 C ATOM 0 H ILE A 64 -74.623 21.089 100.334 1.00 0.00 H new ATOM 0 HA ILE A 64 -77.461 21.158 99.459 1.00 0.00 H new ATOM 0 HB ILE A 64 -76.039 19.499 101.537 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -75.406 18.664 99.387 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -76.555 17.541 100.088 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -78.167 18.215 101.730 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -78.341 19.914 102.231 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -78.947 19.388 100.643 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -76.971 17.834 97.685 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -78.350 18.446 98.629 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -77.184 19.586 97.917 1.00 0.00 H new ATOM 1019 N SER A 65 -76.088 22.505 102.120 1.00 0.00 N ATOM 1020 CA SER A 65 -76.206 23.535 103.156 1.00 0.00 C ATOM 1021 C SER A 65 -76.472 24.968 102.624 1.00 0.00 C ATOM 1022 O SER A 65 -75.948 25.941 103.175 1.00 0.00 O ATOM 1023 CB SER A 65 -74.935 23.472 104.011 1.00 0.00 C ATOM 1024 OG SER A 65 -74.971 24.423 105.046 1.00 0.00 O ATOM 0 H SER A 65 -75.138 22.141 102.049 1.00 0.00 H new ATOM 0 HA SER A 65 -77.095 23.319 103.749 1.00 0.00 H new ATOM 0 HB2 SER A 65 -74.828 22.473 104.435 1.00 0.00 H new ATOM 0 HB3 SER A 65 -74.062 23.647 103.383 1.00 0.00 H new ATOM 0 HG SER A 65 -75.209 25.299 104.677 1.00 0.00 H new ATOM 1030 N SER A 66 -77.295 25.105 101.578 1.00 0.00 N ATOM 1031 CA SER A 66 -77.503 26.322 100.781 1.00 0.00 C ATOM 1032 C SER A 66 -76.199 26.863 100.161 1.00 0.00 C ATOM 1033 O SER A 66 -75.164 26.199 100.181 1.00 0.00 O ATOM 1034 CB SER A 66 -78.263 27.366 101.615 1.00 0.00 C ATOM 1035 OG SER A 66 -78.788 28.388 100.787 1.00 0.00 O ATOM 0 H SER A 66 -77.866 24.328 101.246 1.00 0.00 H new ATOM 0 HA SER A 66 -78.123 26.068 99.922 1.00 0.00 H new ATOM 0 HB2 SER A 66 -79.073 26.882 102.161 1.00 0.00 H new ATOM 0 HB3 SER A 66 -77.594 27.801 102.357 1.00 0.00 H new ATOM 0 HG SER A 66 -79.269 29.040 101.338 1.00 0.00 H new ATOM 1041 N THR A 67 -76.264 28.051 99.552 1.00 0.00 N ATOM 1042 CA THR A 67 -75.124 28.761 98.953 1.00 0.00 C ATOM 1043 C THR A 67 -74.108 29.141 100.038 1.00 0.00 C ATOM 1044 O THR A 67 -74.430 30.022 100.858 1.00 0.00 O ATOM 1045 CB THR A 67 -75.579 30.018 98.196 1.00 0.00 C ATOM 1046 OG1 THR A 67 -76.646 29.726 97.325 1.00 0.00 O ATOM 1047 CG2 THR A 67 -74.443 30.566 97.333 1.00 0.00 C ATOM 0 H THR A 67 -77.140 28.564 99.458 1.00 0.00 H new ATOM 0 HA THR A 67 -74.652 28.089 98.236 1.00 0.00 H new ATOM 0 HB THR A 67 -75.886 30.745 98.948 1.00 0.00 H new ATOM 0 HG1 THR A 67 -76.918 30.542 96.856 1.00 0.00 H new ATOM 0 HG21 THR A 67 -74.784 31.456 96.805 1.00 0.00 H new ATOM 0 HG22 THR A 67 -73.595 30.824 97.968 1.00 0.00 H new ATOM 0 HG23 THR A 67 -74.138 29.810 96.610 1.00 0.00 H new ATOM 1055 N PRO A 68 -72.917 28.523 100.103 1.00 0.00 N ATOM 1056 CA PRO A 68 -71.947 28.704 101.186 1.00 0.00 C ATOM 1057 C PRO A 68 -71.573 30.158 101.480 1.00 0.00 C ATOM 1058 O PRO A 68 -71.279 30.933 100.567 1.00 0.00 O ATOM 1059 CB PRO A 68 -70.706 27.927 100.751 1.00 0.00 C ATOM 1060 CG PRO A 68 -71.310 26.794 99.945 1.00 0.00 C ATOM 1061 CD PRO A 68 -72.421 27.501 99.184 1.00 0.00 C ATOM 0 HA PRO A 68 -72.389 28.348 102.117 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -70.031 28.539 100.153 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -70.134 27.561 101.604 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -70.582 26.338 99.274 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -71.695 25.999 100.584 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -72.047 27.947 98.263 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -73.212 26.805 98.903 1.00 0.00 H new ATOM 1069 N LEU A 69 -71.511 30.509 102.767 1.00 0.00 N ATOM 1070 CA LEU A 69 -71.166 31.846 103.244 1.00 0.00 C ATOM 1071 C LEU A 69 -70.323 31.821 104.523 1.00 0.00 C ATOM 1072 O LEU A 69 -70.293 30.819 105.237 1.00 0.00 O ATOM 1073 CB LEU A 69 -72.444 32.704 103.371 1.00 0.00 C ATOM 1074 CG LEU A 69 -73.391 32.401 104.552 1.00 0.00 C ATOM 1075 CD1 LEU A 69 -74.485 33.473 104.579 1.00 0.00 C ATOM 1076 CD2 LEU A 69 -74.079 31.034 104.468 1.00 0.00 C ATOM 0 H LEU A 69 -71.705 29.853 103.523 1.00 0.00 H new ATOM 0 HA LEU A 69 -70.521 32.318 102.503 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -72.142 33.749 103.441 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -73.013 32.598 102.448 1.00 0.00 H new ATOM 0 HG LEU A 69 -72.775 32.396 105.451 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -75.166 33.277 105.407 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -74.029 34.455 104.708 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -75.039 33.451 103.641 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -74.726 30.899 105.334 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -74.676 30.982 103.557 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -73.325 30.247 104.452 1.00 0.00 H new ATOM 1088 N ALA A 70 -69.646 32.936 104.799 1.00 0.00 N ATOM 1089 CA ALA A 70 -68.837 33.164 105.994 1.00 0.00 C ATOM 1090 C ALA A 70 -68.945 34.641 106.390 1.00 0.00 C ATOM 1091 O ALA A 70 -68.688 35.523 105.571 1.00 0.00 O ATOM 1092 CB ALA A 70 -67.382 32.756 105.718 1.00 0.00 C ATOM 0 H ALA A 70 -69.647 33.738 104.169 1.00 0.00 H new ATOM 0 HA ALA A 70 -69.199 32.556 106.823 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -66.781 32.927 106.611 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -67.345 31.700 105.452 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -66.987 33.352 104.895 1.00 0.00 H new ATOM 1098 N GLU A 71 -69.370 34.928 107.624 1.00 0.00 N ATOM 1099 CA GLU A 71 -69.699 36.299 108.039 1.00 0.00 C ATOM 1100 C GLU A 71 -68.469 37.209 108.213 1.00 0.00 C ATOM 1101 O GLU A 71 -68.615 38.427 108.129 1.00 0.00 O ATOM 1102 CB GLU A 71 -70.526 36.280 109.337 1.00 0.00 C ATOM 1103 CG GLU A 71 -71.787 35.402 109.281 1.00 0.00 C ATOM 1104 CD GLU A 71 -72.779 35.840 108.196 1.00 0.00 C ATOM 1105 OE1 GLU A 71 -73.381 36.937 108.315 1.00 0.00 O ATOM 1106 OE2 GLU A 71 -73.039 35.059 107.257 1.00 0.00 O ATOM 0 H GLU A 71 -69.495 34.229 108.356 1.00 0.00 H new ATOM 0 HA GLU A 71 -70.285 36.727 107.225 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -69.892 35.930 110.151 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -70.821 37.301 109.579 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -71.494 34.368 109.101 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -72.284 35.428 110.251 1.00 0.00 H new ATOM 1113 N ASN A 72 -67.276 36.641 108.436 1.00 0.00 N ATOM 1114 CA ASN A 72 -65.977 37.307 108.603 1.00 0.00 C ATOM 1115 C ASN A 72 -64.842 36.259 108.548 1.00 0.00 C ATOM 1116 O ASN A 72 -65.107 35.064 108.684 1.00 0.00 O ATOM 1117 CB ASN A 72 -65.959 38.036 109.972 1.00 0.00 C ATOM 1118 CG ASN A 72 -65.877 39.552 109.864 1.00 0.00 C ATOM 1119 OD1 ASN A 72 -65.020 40.187 110.453 1.00 0.00 O ATOM 1120 ND2 ASN A 72 -66.791 40.176 109.154 1.00 0.00 N ATOM 0 H ASN A 72 -67.187 35.628 108.510 1.00 0.00 H new ATOM 0 HA ASN A 72 -65.826 38.030 107.801 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -66.859 37.769 110.526 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -65.109 37.677 110.552 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -66.784 41.194 109.095 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -67.507 39.642 108.662 1.00 0.00 H new ATOM 1127 N THR A 73 -63.576 36.695 108.471 1.00 0.00 N ATOM 1128 CA THR A 73 -62.385 35.843 108.693 1.00 0.00 C ATOM 1129 C THR A 73 -62.472 35.096 110.027 1.00 0.00 C ATOM 1130 O THR A 73 -62.264 33.892 110.084 1.00 0.00 O ATOM 1131 CB THR A 73 -61.090 36.669 108.583 1.00 0.00 C ATOM 1132 OG1 THR A 73 -60.859 36.945 107.217 1.00 0.00 O ATOM 1133 CG2 THR A 73 -59.838 36.007 109.157 1.00 0.00 C ATOM 0 H THR A 73 -63.341 37.663 108.250 1.00 0.00 H new ATOM 0 HA THR A 73 -62.361 35.088 107.907 1.00 0.00 H new ATOM 0 HB THR A 73 -61.254 37.564 109.184 1.00 0.00 H new ATOM 0 HG1 THR A 73 -59.930 36.728 106.992 1.00 0.00 H new ATOM 0 HG21 THR A 73 -58.984 36.672 109.029 1.00 0.00 H new ATOM 0 HG22 THR A 73 -59.986 35.807 110.218 1.00 0.00 H new ATOM 0 HG23 THR A 73 -59.650 35.069 108.634 1.00 0.00 H new ATOM 1141 N ASN A 74 -62.850 35.781 111.108 1.00 0.00 N ATOM 1142 CA ASN A 74 -63.039 35.172 112.429 1.00 0.00 C ATOM 1143 C ASN A 74 -64.277 34.259 112.535 1.00 0.00 C ATOM 1144 O ASN A 74 -64.532 33.733 113.627 1.00 0.00 O ATOM 1145 CB ASN A 74 -63.070 36.300 113.475 1.00 0.00 C ATOM 1146 CG ASN A 74 -61.779 37.107 113.476 1.00 0.00 C ATOM 1147 OD1 ASN A 74 -61.554 37.944 112.617 1.00 0.00 O ATOM 1148 ND2 ASN A 74 -60.889 36.865 114.417 1.00 0.00 N ATOM 0 H ASN A 74 -63.036 36.784 111.092 1.00 0.00 H new ATOM 0 HA ASN A 74 -62.200 34.500 112.613 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -63.912 36.962 113.271 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -63.233 35.873 114.465 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -60.008 37.378 114.429 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -61.081 36.164 115.133 1.00 0.00 H new ATOM 1155 N SER A 75 -65.063 34.062 111.471 1.00 0.00 N ATOM 1156 CA SER A 75 -66.243 33.186 111.464 1.00 0.00 C ATOM 1157 C SER A 75 -65.955 31.826 110.825 1.00 0.00 C ATOM 1158 O SER A 75 -65.056 31.682 109.995 1.00 0.00 O ATOM 1159 CB SER A 75 -67.396 33.853 110.711 1.00 0.00 C ATOM 1160 OG SER A 75 -67.649 35.116 111.281 1.00 0.00 O ATOM 0 H SER A 75 -64.895 34.515 110.573 1.00 0.00 H new ATOM 0 HA SER A 75 -66.517 33.021 112.506 1.00 0.00 H new ATOM 0 HB2 SER A 75 -67.144 33.960 109.656 1.00 0.00 H new ATOM 0 HB3 SER A 75 -68.289 33.231 110.764 1.00 0.00 H new ATOM 0 HG SER A 75 -68.508 35.096 111.752 1.00 0.00 H new ATOM 1166 N VAL A 76 -66.789 30.840 111.170 1.00 0.00 N ATOM 1167 CA VAL A 76 -66.741 29.475 110.644 1.00 0.00 C ATOM 1168 C VAL A 76 -68.114 29.044 110.132 1.00 0.00 C ATOM 1169 O VAL A 76 -69.133 29.522 110.632 1.00 0.00 O ATOM 1170 CB VAL A 76 -66.229 28.473 111.701 1.00 0.00 C ATOM 1171 CG1 VAL A 76 -64.775 28.750 112.085 1.00 0.00 C ATOM 1172 CG2 VAL A 76 -67.078 28.434 112.982 1.00 0.00 C ATOM 0 H VAL A 76 -67.541 30.976 111.846 1.00 0.00 H new ATOM 0 HA VAL A 76 -66.037 29.473 109.812 1.00 0.00 H new ATOM 0 HB VAL A 76 -66.310 27.499 111.217 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -64.451 28.024 112.831 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -64.143 28.668 111.201 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -64.693 29.756 112.498 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -66.656 27.707 113.676 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -67.081 29.420 113.446 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -68.100 28.147 112.733 1.00 0.00 H new ATOM 1182 N THR A 77 -68.134 28.103 109.184 1.00 0.00 N ATOM 1183 CA THR A 77 -69.377 27.584 108.589 1.00 0.00 C ATOM 1184 C THR A 77 -69.261 26.085 108.335 1.00 0.00 C ATOM 1185 O THR A 77 -68.426 25.646 107.536 1.00 0.00 O ATOM 1186 CB THR A 77 -69.754 28.323 107.286 1.00 0.00 C ATOM 1187 OG1 THR A 77 -69.577 29.717 107.400 1.00 0.00 O ATOM 1188 CG2 THR A 77 -71.227 28.094 106.940 1.00 0.00 C ATOM 0 H THR A 77 -67.289 27.676 108.804 1.00 0.00 H new ATOM 0 HA THR A 77 -70.177 27.764 109.307 1.00 0.00 H new ATOM 0 HB THR A 77 -69.098 27.924 106.513 1.00 0.00 H new ATOM 0 HG1 THR A 77 -69.554 30.118 106.506 1.00 0.00 H new ATOM 0 HG21 THR A 77 -71.471 28.623 106.019 1.00 0.00 H new ATOM 0 HG22 THR A 77 -71.407 27.028 106.804 1.00 0.00 H new ATOM 0 HG23 THR A 77 -71.853 28.468 107.750 1.00 0.00 H new ATOM 1196 N ASN A 78 -70.081 25.277 109.014 1.00 0.00 N ATOM 1197 CA ASN A 78 -70.331 23.881 108.663 1.00 0.00 C ATOM 1198 C ASN A 78 -71.124 23.794 107.346 1.00 0.00 C ATOM 1199 O ASN A 78 -72.100 24.518 107.171 1.00 0.00 O ATOM 1200 CB ASN A 78 -71.068 23.189 109.824 1.00 0.00 C ATOM 1201 CG ASN A 78 -72.344 23.914 110.234 1.00 0.00 C ATOM 1202 OD1 ASN A 78 -72.299 25.001 110.793 1.00 0.00 O ATOM 1203 ND2 ASN A 78 -73.505 23.347 109.978 1.00 0.00 N ATOM 0 H ASN A 78 -70.598 25.583 109.838 1.00 0.00 H new ATOM 0 HA ASN A 78 -69.385 23.364 108.503 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -71.314 22.168 109.534 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -70.401 23.124 110.684 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -74.371 23.814 110.246 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -73.538 22.440 109.512 1.00 0.00 H new ATOM 1210 N ILE A 79 -70.711 22.911 106.430 1.00 0.00 N ATOM 1211 CA ILE A 79 -71.263 22.789 105.075 1.00 0.00 C ATOM 1212 C ILE A 79 -71.565 21.316 104.763 1.00 0.00 C ATOM 1213 O ILE A 79 -70.652 20.534 104.490 1.00 0.00 O ATOM 1214 CB ILE A 79 -70.306 23.418 104.028 1.00 0.00 C ATOM 1215 CG1 ILE A 79 -70.046 24.930 104.233 1.00 0.00 C ATOM 1216 CG2 ILE A 79 -70.806 23.172 102.592 1.00 0.00 C ATOM 1217 CD1 ILE A 79 -71.259 25.852 104.038 1.00 0.00 C ATOM 0 H ILE A 79 -69.963 22.243 106.615 1.00 0.00 H new ATOM 0 HA ILE A 79 -72.200 23.343 105.022 1.00 0.00 H new ATOM 0 HB ILE A 79 -69.354 22.911 104.182 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -69.659 25.079 105.241 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -69.263 25.241 103.542 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -70.113 23.625 101.883 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -70.866 22.100 102.406 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -71.794 23.617 102.469 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -70.960 26.887 104.206 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -71.638 25.745 103.022 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -72.041 25.580 104.747 1.00 0.00 H new ATOM 1229 N GLU A 80 -72.852 20.949 104.791 1.00 0.00 N ATOM 1230 CA GLU A 80 -73.366 19.726 104.163 1.00 0.00 C ATOM 1231 C GLU A 80 -73.292 19.816 102.626 1.00 0.00 C ATOM 1232 O GLU A 80 -73.718 20.802 102.010 1.00 0.00 O ATOM 1233 CB GLU A 80 -74.806 19.422 104.616 1.00 0.00 C ATOM 1234 CG GLU A 80 -75.202 18.003 104.167 1.00 0.00 C ATOM 1235 CD GLU A 80 -76.639 17.579 104.495 1.00 0.00 C ATOM 1236 OE1 GLU A 80 -77.452 18.435 104.898 1.00 0.00 O ATOM 1237 OE2 GLU A 80 -76.914 16.368 104.285 1.00 0.00 O ATOM 0 H GLU A 80 -73.574 21.499 105.256 1.00 0.00 H new ATOM 0 HA GLU A 80 -72.730 18.903 104.489 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -74.882 19.505 105.700 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -75.493 20.154 104.191 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -75.058 17.929 103.089 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -74.518 17.291 104.629 1.00 0.00 H new ATOM 1244 N LEU A 81 -72.744 18.761 102.020 1.00 0.00 N ATOM 1245 CA LEU A 81 -72.256 18.718 100.649 1.00 0.00 C ATOM 1246 C LEU A 81 -72.394 17.294 100.066 1.00 0.00 C ATOM 1247 O LEU A 81 -72.233 16.307 100.782 1.00 0.00 O ATOM 1248 CB LEU A 81 -70.799 19.204 100.779 1.00 0.00 C ATOM 1249 CG LEU A 81 -69.932 19.160 99.525 1.00 0.00 C ATOM 1250 CD1 LEU A 81 -70.479 20.029 98.393 1.00 0.00 C ATOM 1251 CD2 LEU A 81 -68.525 19.660 99.874 1.00 0.00 C ATOM 0 H LEU A 81 -72.625 17.870 102.501 1.00 0.00 H new ATOM 0 HA LEU A 81 -72.817 19.339 99.951 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -70.817 20.232 101.140 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -70.311 18.605 101.548 1.00 0.00 H new ATOM 0 HG LEU A 81 -69.922 18.126 99.179 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -69.820 19.957 97.528 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -71.476 19.684 98.119 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -70.532 21.066 98.724 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -67.898 19.632 98.983 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -68.584 20.683 100.244 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -68.092 19.020 100.643 1.00 0.00 H new ATOM 1263 N GLU A 82 -72.688 17.167 98.767 1.00 0.00 N ATOM 1264 CA GLU A 82 -73.029 15.908 98.087 1.00 0.00 C ATOM 1265 C GLU A 82 -72.015 15.602 96.957 1.00 0.00 C ATOM 1266 O GLU A 82 -72.135 16.147 95.857 1.00 0.00 O ATOM 1267 CB GLU A 82 -74.501 15.976 97.625 1.00 0.00 C ATOM 1268 CG GLU A 82 -75.251 14.634 97.566 1.00 0.00 C ATOM 1269 CD GLU A 82 -75.086 13.819 96.278 1.00 0.00 C ATOM 1270 OE1 GLU A 82 -74.540 14.336 95.278 1.00 0.00 O ATOM 1271 OE2 GLU A 82 -75.502 12.635 96.307 1.00 0.00 O ATOM 0 H GLU A 82 -72.696 17.967 98.135 1.00 0.00 H new ATOM 0 HA GLU A 82 -72.949 15.062 98.769 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -75.042 16.643 98.297 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -74.530 16.430 96.634 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -74.920 14.020 98.404 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -76.313 14.829 97.714 1.00 0.00 H new ATOM 1278 N PRO A 83 -70.966 14.798 97.231 1.00 0.00 N ATOM 1279 CA PRO A 83 -69.991 14.317 96.240 1.00 0.00 C ATOM 1280 C PRO A 83 -70.522 13.135 95.409 1.00 0.00 C ATOM 1281 O PRO A 83 -71.521 12.527 95.784 1.00 0.00 O ATOM 1282 CB PRO A 83 -68.773 13.889 97.071 1.00 0.00 C ATOM 1283 CG PRO A 83 -69.351 13.504 98.429 1.00 0.00 C ATOM 1284 CD PRO A 83 -70.608 14.345 98.568 1.00 0.00 C ATOM 0 HA PRO A 83 -69.760 15.094 95.511 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -68.253 13.050 96.609 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -68.051 14.700 97.163 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -69.580 12.439 98.474 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -68.645 13.712 99.233 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -71.417 13.761 99.007 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -70.433 15.194 99.229 1.00 0.00 H new ATOM 1292 N PRO A 84 -69.857 12.729 94.308 1.00 0.00 N ATOM 1293 CA PRO A 84 -70.186 11.481 93.613 1.00 0.00 C ATOM 1294 C PRO A 84 -69.768 10.247 94.437 1.00 0.00 C ATOM 1295 O PRO A 84 -68.987 10.344 95.382 1.00 0.00 O ATOM 1296 CB PRO A 84 -69.419 11.561 92.291 1.00 0.00 C ATOM 1297 CG PRO A 84 -68.167 12.338 92.688 1.00 0.00 C ATOM 1298 CD PRO A 84 -68.704 13.365 93.687 1.00 0.00 C ATOM 0 HA PRO A 84 -71.259 11.370 93.457 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -69.177 10.572 91.901 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -69.991 12.077 91.520 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -67.416 11.690 93.139 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -67.699 12.817 91.828 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -67.949 13.623 94.430 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -68.988 14.290 93.186 1.00 0.00 H new ATOM 1306 N PHE A 85 -70.268 9.062 94.064 1.00 0.00 N ATOM 1307 CA PHE A 85 -69.875 7.783 94.666 1.00 0.00 C ATOM 1308 C PHE A 85 -68.486 7.329 94.182 1.00 0.00 C ATOM 1309 O PHE A 85 -68.361 6.423 93.361 1.00 0.00 O ATOM 1310 CB PHE A 85 -70.968 6.728 94.433 1.00 0.00 C ATOM 1311 CG PHE A 85 -72.231 6.989 95.235 1.00 0.00 C ATOM 1312 CD1 PHE A 85 -72.262 6.679 96.610 1.00 0.00 C ATOM 1313 CD2 PHE A 85 -73.364 7.557 94.624 1.00 0.00 C ATOM 1314 CE1 PHE A 85 -73.416 6.943 97.369 1.00 0.00 C ATOM 1315 CE2 PHE A 85 -74.520 7.815 95.382 1.00 0.00 C ATOM 1316 CZ PHE A 85 -74.546 7.511 96.754 1.00 0.00 C ATOM 0 H PHE A 85 -70.966 8.964 93.326 1.00 0.00 H new ATOM 0 HA PHE A 85 -69.781 7.918 95.744 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -71.218 6.701 93.372 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -70.576 5.745 94.693 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -71.397 6.237 97.082 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -73.346 7.795 93.571 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -73.434 6.710 98.423 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -75.389 8.247 94.909 1.00 0.00 H new ATOM 0 HZ PHE A 85 -75.433 7.713 97.336 1.00 0.00 H new ATOM 1326 N GLY A 86 -67.438 7.976 94.702 1.00 0.00 N ATOM 1327 CA GLY A 86 -66.041 7.686 94.389 1.00 0.00 C ATOM 1328 C GLY A 86 -65.078 8.670 95.057 1.00 0.00 C ATOM 1329 O GLY A 86 -65.472 9.420 95.953 1.00 0.00 O ATOM 0 H GLY A 86 -67.545 8.738 95.372 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -65.802 6.672 94.711 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -65.899 7.719 93.309 1.00 0.00 H new ATOM 1333 N ASP A 87 -63.815 8.643 94.613 1.00 0.00 N ATOM 1334 CA ASP A 87 -62.789 9.634 94.954 1.00 0.00 C ATOM 1335 C ASP A 87 -63.097 10.984 94.281 1.00 0.00 C ATOM 1336 O ASP A 87 -63.547 11.027 93.131 1.00 0.00 O ATOM 1337 CB ASP A 87 -61.409 9.124 94.505 1.00 0.00 C ATOM 1338 CG ASP A 87 -60.274 9.827 95.256 1.00 0.00 C ATOM 1339 OD1 ASP A 87 -60.172 9.581 96.475 1.00 0.00 O ATOM 1340 OD2 ASP A 87 -59.516 10.599 94.617 1.00 0.00 O ATOM 0 H ASP A 87 -63.471 7.912 93.991 1.00 0.00 H new ATOM 0 HA ASP A 87 -62.786 9.780 96.034 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -61.346 8.049 94.673 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -61.292 9.286 93.434 1.00 0.00 H new ATOM 1345 N SER A 88 -62.882 12.106 94.975 1.00 0.00 N ATOM 1346 CA SER A 88 -63.064 13.458 94.426 1.00 0.00 C ATOM 1347 C SER A 88 -62.378 14.531 95.279 1.00 0.00 C ATOM 1348 O SER A 88 -61.891 14.255 96.375 1.00 0.00 O ATOM 1349 CB SER A 88 -64.560 13.768 94.291 1.00 0.00 C ATOM 1350 OG SER A 88 -65.098 13.032 93.215 1.00 0.00 O ATOM 0 H SER A 88 -62.573 12.103 95.947 1.00 0.00 H new ATOM 0 HA SER A 88 -62.592 13.478 93.444 1.00 0.00 H new ATOM 0 HB2 SER A 88 -65.080 13.514 95.215 1.00 0.00 H new ATOM 0 HB3 SER A 88 -64.708 14.835 94.125 1.00 0.00 H new ATOM 0 HG SER A 88 -64.412 12.434 92.852 1.00 0.00 H new ATOM 1356 N TYR A 89 -62.335 15.764 94.758 1.00 0.00 N ATOM 1357 CA TYR A 89 -61.544 16.868 95.302 1.00 0.00 C ATOM 1358 C TYR A 89 -62.428 18.093 95.493 1.00 0.00 C ATOM 1359 O TYR A 89 -62.775 18.789 94.538 1.00 0.00 O ATOM 1360 CB TYR A 89 -60.310 17.124 94.421 1.00 0.00 C ATOM 1361 CG TYR A 89 -59.408 15.908 94.424 1.00 0.00 C ATOM 1362 CD1 TYR A 89 -59.707 14.833 93.568 1.00 0.00 C ATOM 1363 CD2 TYR A 89 -58.417 15.763 95.417 1.00 0.00 C ATOM 1364 CE1 TYR A 89 -59.124 13.577 93.794 1.00 0.00 C ATOM 1365 CE2 TYR A 89 -57.792 14.516 95.608 1.00 0.00 C ATOM 1366 CZ TYR A 89 -58.193 13.403 94.837 1.00 0.00 C ATOM 1367 OH TYR A 89 -57.722 12.159 95.107 1.00 0.00 O ATOM 0 H TYR A 89 -62.864 16.025 93.926 1.00 0.00 H new ATOM 0 HA TYR A 89 -61.160 16.607 96.288 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -60.622 17.353 93.402 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -59.764 17.992 94.790 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -60.384 14.974 92.738 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -58.138 16.607 96.030 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -59.390 12.740 93.166 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -57.007 14.411 96.343 1.00 0.00 H new ATOM 0 HH TYR A 89 -58.272 11.493 94.644 1.00 0.00 H new ATOM 1377 N ILE A 90 -62.834 18.321 96.742 1.00 0.00 N ATOM 1378 CA ILE A 90 -63.551 19.519 97.167 1.00 0.00 C ATOM 1379 C ILE A 90 -62.580 20.693 96.984 1.00 0.00 C ATOM 1380 O ILE A 90 -61.408 20.566 97.340 1.00 0.00 O ATOM 1381 CB ILE A 90 -64.015 19.374 98.638 1.00 0.00 C ATOM 1382 CG1 ILE A 90 -65.062 18.269 98.905 1.00 0.00 C ATOM 1383 CG2 ILE A 90 -64.658 20.684 99.119 1.00 0.00 C ATOM 1384 CD1 ILE A 90 -64.645 16.825 98.614 1.00 0.00 C ATOM 0 H ILE A 90 -62.669 17.662 97.502 1.00 0.00 H new ATOM 0 HA ILE A 90 -64.453 19.682 96.577 1.00 0.00 H new ATOM 0 HB ILE A 90 -63.101 19.109 99.170 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -65.358 18.330 99.952 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -65.947 18.491 98.309 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -64.981 20.572 100.154 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -63.930 21.493 99.051 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -65.519 20.918 98.493 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -65.472 16.154 98.845 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -64.382 16.728 97.561 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -63.784 16.564 99.229 1.00 0.00 H new ATOM 1396 N VAL A 91 -63.045 21.826 96.444 1.00 0.00 N ATOM 1397 CA VAL A 91 -62.224 23.042 96.326 1.00 0.00 C ATOM 1398 C VAL A 91 -62.957 24.220 96.967 1.00 0.00 C ATOM 1399 O VAL A 91 -64.105 24.488 96.610 1.00 0.00 O ATOM 1400 CB VAL A 91 -61.681 23.307 94.900 1.00 0.00 C ATOM 1401 CG1 VAL A 91 -61.353 22.015 94.139 1.00 0.00 C ATOM 1402 CG2 VAL A 91 -62.567 24.198 94.026 1.00 0.00 C ATOM 0 H VAL A 91 -63.992 21.928 96.079 1.00 0.00 H new ATOM 0 HA VAL A 91 -61.304 22.887 96.890 1.00 0.00 H new ATOM 0 HB VAL A 91 -60.761 23.861 95.088 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -60.977 22.263 93.146 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -60.595 21.454 94.685 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -62.254 21.410 94.045 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -62.103 24.325 93.048 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -63.545 23.732 93.906 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -62.685 25.172 94.501 1.00 0.00 H new ATOM 1412 N ILE A 92 -62.326 24.874 97.953 1.00 0.00 N ATOM 1413 CA ILE A 92 -62.921 25.956 98.760 1.00 0.00 C ATOM 1414 C ILE A 92 -62.048 27.215 98.668 1.00 0.00 C ATOM 1415 O ILE A 92 -60.952 27.260 99.229 1.00 0.00 O ATOM 1416 CB ILE A 92 -63.206 25.514 100.217 1.00 0.00 C ATOM 1417 CG1 ILE A 92 -64.020 24.204 100.224 1.00 0.00 C ATOM 1418 CG2 ILE A 92 -63.886 26.649 101.007 1.00 0.00 C ATOM 1419 CD1 ILE A 92 -64.444 23.686 101.598 1.00 0.00 C ATOM 0 H ILE A 92 -61.365 24.662 98.220 1.00 0.00 H new ATOM 0 HA ILE A 92 -63.899 26.202 98.346 1.00 0.00 H new ATOM 0 HB ILE A 92 -62.264 25.307 100.725 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -64.916 24.353 99.622 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -63.430 23.430 99.732 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -64.077 26.318 102.028 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -63.233 27.522 101.025 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -64.829 26.911 100.528 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -65.009 22.762 101.480 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -63.558 23.495 102.204 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -65.067 24.432 102.092 1.00 0.00 H new ATOM 1431 N GLY A 93 -62.529 28.208 97.911 1.00 0.00 N ATOM 1432 CA GLY A 93 -61.770 29.342 97.366 1.00 0.00 C ATOM 1433 C GLY A 93 -61.621 29.226 95.839 1.00 0.00 C ATOM 1434 O GLY A 93 -61.975 28.201 95.257 1.00 0.00 O ATOM 0 H GLY A 93 -63.514 28.245 97.647 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -62.275 30.275 97.615 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -60.784 29.380 97.829 1.00 0.00 H new ATOM 1438 N VAL A 94 -61.092 30.264 95.170 1.00 0.00 N ATOM 1439 CA VAL A 94 -60.845 30.241 93.711 1.00 0.00 C ATOM 1440 C VAL A 94 -59.395 29.849 93.414 1.00 0.00 C ATOM 1441 O VAL A 94 -58.484 30.444 93.979 1.00 0.00 O ATOM 1442 CB VAL A 94 -61.213 31.572 93.008 1.00 0.00 C ATOM 1443 CG1 VAL A 94 -62.636 32.022 93.358 1.00 0.00 C ATOM 1444 CG2 VAL A 94 -60.246 32.735 93.274 1.00 0.00 C ATOM 0 H VAL A 94 -60.823 31.140 95.618 1.00 0.00 H new ATOM 0 HA VAL A 94 -61.510 29.483 93.297 1.00 0.00 H new ATOM 0 HB VAL A 94 -61.137 31.334 91.947 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -62.858 32.959 92.846 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -63.347 31.259 93.042 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -62.717 32.169 94.435 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -60.588 33.622 92.740 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -60.215 32.945 94.343 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -59.248 32.465 92.928 1.00 0.00 H new ATOM 1454 N GLY A 95 -59.182 28.863 92.529 1.00 0.00 N ATOM 1455 CA GLY A 95 -57.888 28.337 92.057 1.00 0.00 C ATOM 1456 C GLY A 95 -56.702 28.496 93.021 1.00 0.00 C ATOM 1457 O GLY A 95 -56.529 27.688 93.929 1.00 0.00 O ATOM 0 H GLY A 95 -59.965 28.376 92.092 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -58.009 27.277 91.834 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -57.637 28.833 91.120 1.00 0.00 H new ATOM 1461 N ASN A 96 -55.903 29.556 92.844 1.00 0.00 N ATOM 1462 CA ASN A 96 -54.753 29.925 93.687 1.00 0.00 C ATOM 1463 C ASN A 96 -55.034 29.987 95.202 1.00 0.00 C ATOM 1464 O ASN A 96 -54.126 29.786 96.003 1.00 0.00 O ATOM 1465 CB ASN A 96 -54.212 31.280 93.195 1.00 0.00 C ATOM 1466 CG ASN A 96 -55.305 32.314 92.943 1.00 0.00 C ATOM 1467 OD1 ASN A 96 -55.695 32.535 91.809 1.00 0.00 O ATOM 1468 ND2 ASN A 96 -55.885 32.933 93.952 1.00 0.00 N ATOM 0 H ASN A 96 -56.045 30.211 92.075 1.00 0.00 H new ATOM 0 HA ASN A 96 -54.022 29.124 93.579 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -53.513 31.673 93.933 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -53.649 31.125 92.274 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -56.649 33.586 93.778 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -55.570 32.759 94.906 1.00 0.00 H new ATOM 1475 N SER A 97 -56.277 30.273 95.590 1.00 0.00 N ATOM 1476 CA SER A 97 -56.756 30.385 96.969 1.00 0.00 C ATOM 1477 C SER A 97 -57.517 29.136 97.442 1.00 0.00 C ATOM 1478 O SER A 97 -57.960 29.101 98.591 1.00 0.00 O ATOM 1479 CB SER A 97 -57.709 31.582 97.065 1.00 0.00 C ATOM 1480 OG SER A 97 -57.113 32.789 96.629 1.00 0.00 O ATOM 0 H SER A 97 -57.020 30.443 94.912 1.00 0.00 H new ATOM 0 HA SER A 97 -55.878 30.505 97.604 1.00 0.00 H new ATOM 0 HB2 SER A 97 -58.598 31.383 96.466 1.00 0.00 H new ATOM 0 HB3 SER A 97 -58.039 31.697 98.097 1.00 0.00 H new ATOM 0 HG SER A 97 -57.807 33.470 96.504 1.00 0.00 H new ATOM 1486 N ALA A 98 -57.724 28.146 96.561 1.00 0.00 N ATOM 1487 CA ALA A 98 -58.649 27.041 96.771 1.00 0.00 C ATOM 1488 C ALA A 98 -58.053 25.910 97.623 1.00 0.00 C ATOM 1489 O ALA A 98 -57.214 25.135 97.149 1.00 0.00 O ATOM 1490 CB ALA A 98 -59.133 26.515 95.417 1.00 0.00 C ATOM 0 H ALA A 98 -57.238 28.098 95.665 1.00 0.00 H new ATOM 0 HA ALA A 98 -59.496 27.426 97.339 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -59.825 25.688 95.574 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -59.640 27.314 94.876 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -58.279 26.168 94.835 1.00 0.00 H new ATOM 1496 N LEU A 99 -58.556 25.764 98.856 1.00 0.00 N ATOM 1497 CA LEU A 99 -58.390 24.559 99.674 1.00 0.00 C ATOM 1498 C LEU A 99 -58.863 23.345 98.872 1.00 0.00 C ATOM 1499 O LEU A 99 -60.064 23.111 98.766 1.00 0.00 O ATOM 1500 CB LEU A 99 -59.249 24.640 100.938 1.00 0.00 C ATOM 1501 CG LEU A 99 -58.883 25.703 101.973 1.00 0.00 C ATOM 1502 CD1 LEU A 99 -60.106 25.858 102.873 1.00 0.00 C ATOM 1503 CD2 LEU A 99 -57.673 25.260 102.802 1.00 0.00 C ATOM 0 H LEU A 99 -59.098 26.493 99.319 1.00 0.00 H new ATOM 0 HA LEU A 99 -57.339 24.472 99.948 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -60.282 24.809 100.633 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -59.217 23.667 101.429 1.00 0.00 H new ATOM 0 HG LEU A 99 -58.616 26.643 101.490 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -59.903 26.609 103.637 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -60.961 26.172 102.274 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -60.329 24.904 103.352 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -57.430 26.032 103.532 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -57.908 24.331 103.321 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -56.819 25.102 102.143 1.00 0.00 H new ATOM 1515 N THR A 100 -57.924 22.617 98.273 1.00 0.00 N ATOM 1516 CA THR A 100 -58.192 21.550 97.311 1.00 0.00 C ATOM 1517 C THR A 100 -57.995 20.215 98.027 1.00 0.00 C ATOM 1518 O THR A 100 -56.877 19.706 98.085 1.00 0.00 O ATOM 1519 CB THR A 100 -57.289 21.737 96.080 1.00 0.00 C ATOM 1520 OG1 THR A 100 -57.559 22.997 95.493 1.00 0.00 O ATOM 1521 CG2 THR A 100 -57.527 20.675 95.002 1.00 0.00 C ATOM 0 H THR A 100 -56.929 22.756 98.448 1.00 0.00 H new ATOM 0 HA THR A 100 -59.216 21.575 96.939 1.00 0.00 H new ATOM 0 HB THR A 100 -56.260 21.654 96.431 1.00 0.00 H new ATOM 0 HG1 THR A 100 -57.321 23.709 96.123 1.00 0.00 H new ATOM 0 HG21 THR A 100 -56.862 20.858 94.158 1.00 0.00 H new ATOM 0 HG22 THR A 100 -57.326 19.686 95.415 1.00 0.00 H new ATOM 0 HG23 THR A 100 -58.563 20.724 94.665 1.00 0.00 H new ATOM 1529 N LEU A 101 -59.067 19.693 98.638 1.00 0.00 N ATOM 1530 CA LEU A 101 -59.005 18.600 99.611 1.00 0.00 C ATOM 1531 C LEU A 101 -59.772 17.345 99.171 1.00 0.00 C ATOM 1532 O LEU A 101 -60.859 17.400 98.595 1.00 0.00 O ATOM 1533 CB LEU A 101 -59.360 19.076 101.037 1.00 0.00 C ATOM 1534 CG LEU A 101 -60.832 19.423 101.351 1.00 0.00 C ATOM 1535 CD1 LEU A 101 -61.032 19.424 102.866 1.00 0.00 C ATOM 1536 CD2 LEU A 101 -61.252 20.815 100.868 1.00 0.00 C ATOM 0 H LEU A 101 -60.016 20.025 98.466 1.00 0.00 H new ATOM 0 HA LEU A 101 -57.964 18.280 99.648 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -59.046 18.299 101.734 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -58.758 19.959 101.252 1.00 0.00 H new ATOM 0 HG LEU A 101 -61.432 18.674 100.834 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -62.069 19.668 103.096 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -60.794 18.438 103.265 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -60.375 20.167 103.319 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -62.297 20.989 101.123 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -60.631 21.570 101.350 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -61.127 20.878 99.787 1.00 0.00 H new ATOM 1548 N HIS A 102 -59.143 16.202 99.447 1.00 0.00 N ATOM 1549 CA HIS A 102 -59.555 14.849 99.092 1.00 0.00 C ATOM 1550 C HIS A 102 -60.814 14.366 99.816 1.00 0.00 C ATOM 1551 O HIS A 102 -60.965 14.558 101.019 1.00 0.00 O ATOM 1552 CB HIS A 102 -58.389 13.902 99.428 1.00 0.00 C ATOM 1553 CG HIS A 102 -57.777 14.027 100.816 1.00 0.00 C ATOM 1554 ND1 HIS A 102 -58.232 14.755 101.905 1.00 0.00 N ATOM 1555 CD2 HIS A 102 -56.587 13.458 101.186 1.00 0.00 C ATOM 1556 CE1 HIS A 102 -57.319 14.641 102.882 1.00 0.00 C ATOM 1557 NE2 HIS A 102 -56.308 13.852 102.497 1.00 0.00 N ATOM 0 H HIS A 102 -58.264 16.201 99.965 1.00 0.00 H new ATOM 0 HA HIS A 102 -59.802 14.852 98.030 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -58.738 12.877 99.302 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -57.600 14.062 98.694 1.00 0.00 H new ATOM 0 HD1 HIS A 102 -59.104 15.282 101.955 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -55.972 12.817 100.572 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -57.390 15.120 103.847 1.00 0.00 H new ATOM 1565 N TRP A 103 -61.658 13.616 99.108 1.00 0.00 N ATOM 1566 CA TRP A 103 -62.736 12.829 99.696 1.00 0.00 C ATOM 1567 C TRP A 103 -62.960 11.530 98.922 1.00 0.00 C ATOM 1568 O TRP A 103 -62.740 11.483 97.715 1.00 0.00 O ATOM 1569 CB TRP A 103 -64.014 13.662 99.687 1.00 0.00 C ATOM 1570 CG TRP A 103 -65.191 12.996 100.315 1.00 0.00 C ATOM 1571 CD1 TRP A 103 -66.286 12.552 99.663 1.00 0.00 C ATOM 1572 CD2 TRP A 103 -65.368 12.618 101.711 1.00 0.00 C ATOM 1573 NE1 TRP A 103 -67.155 11.975 100.570 1.00 0.00 N ATOM 1574 CE2 TRP A 103 -66.636 11.989 101.844 1.00 0.00 C ATOM 1575 CE3 TRP A 103 -64.573 12.711 102.870 1.00 0.00 C ATOM 1576 CZ2 TRP A 103 -67.116 11.527 103.073 1.00 0.00 C ATOM 1577 CZ3 TRP A 103 -65.029 12.211 104.103 1.00 0.00 C ATOM 1578 CH2 TRP A 103 -66.308 11.643 104.215 1.00 0.00 C ATOM 0 H TRP A 103 -61.609 13.538 98.092 1.00 0.00 H new ATOM 0 HA TRP A 103 -62.462 12.566 100.718 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -63.824 14.601 100.207 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -64.262 13.913 98.656 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -66.457 12.635 98.600 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -68.066 11.588 100.325 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -63.599 13.173 102.811 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -68.099 11.085 103.143 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -64.389 12.265 104.972 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -66.668 11.298 105.173 1.00 0.00 H new ATOM 1589 N PHE A 104 -63.489 10.514 99.612 1.00 0.00 N ATOM 1590 CA PHE A 104 -63.991 9.282 99.016 1.00 0.00 C ATOM 1591 C PHE A 104 -65.338 8.927 99.663 1.00 0.00 C ATOM 1592 O PHE A 104 -65.395 8.614 100.853 1.00 0.00 O ATOM 1593 CB PHE A 104 -62.950 8.164 99.161 1.00 0.00 C ATOM 1594 CG PHE A 104 -63.269 6.938 98.328 1.00 0.00 C ATOM 1595 CD1 PHE A 104 -64.288 6.057 98.730 1.00 0.00 C ATOM 1596 CD2 PHE A 104 -62.577 6.691 97.129 1.00 0.00 C ATOM 1597 CE1 PHE A 104 -64.636 4.952 97.933 1.00 0.00 C ATOM 1598 CE2 PHE A 104 -62.921 5.587 96.327 1.00 0.00 C ATOM 1599 CZ PHE A 104 -63.954 4.720 96.727 1.00 0.00 C ATOM 0 H PHE A 104 -63.580 10.531 100.628 1.00 0.00 H new ATOM 0 HA PHE A 104 -64.159 9.414 97.947 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -61.972 8.548 98.871 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -62.881 7.875 100.210 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -64.809 6.231 99.660 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -61.779 7.351 96.823 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -65.425 4.284 98.247 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -62.391 5.405 95.403 1.00 0.00 H new ATOM 0 HZ PHE A 104 -64.222 3.877 96.108 1.00 0.00 H new ATOM 1609 N ARG A 105 -66.436 9.015 98.900 1.00 0.00 N ATOM 1610 CA ARG A 105 -67.793 8.763 99.418 1.00 0.00 C ATOM 1611 C ARG A 105 -67.998 7.282 99.774 1.00 0.00 C ATOM 1612 O ARG A 105 -67.470 6.396 99.103 1.00 0.00 O ATOM 1613 CB ARG A 105 -68.805 9.256 98.375 1.00 0.00 C ATOM 1614 CG ARG A 105 -70.239 9.384 98.909 1.00 0.00 C ATOM 1615 CD ARG A 105 -71.158 9.936 97.815 1.00 0.00 C ATOM 1616 NE ARG A 105 -72.481 10.294 98.342 1.00 0.00 N ATOM 1617 CZ ARG A 105 -73.535 10.704 97.645 1.00 0.00 C ATOM 1618 NH1 ARG A 105 -73.520 10.896 96.354 1.00 0.00 N ATOM 1619 NH2 ARG A 105 -74.632 11.038 98.252 1.00 0.00 N ATOM 0 H ARG A 105 -66.412 9.262 97.911 1.00 0.00 H new ATOM 0 HA ARG A 105 -67.942 9.312 100.348 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -68.480 10.226 97.999 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -68.803 8.569 97.529 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -70.600 8.411 99.242 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -70.255 10.044 99.776 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -70.697 10.814 97.363 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -71.270 9.193 97.026 1.00 0.00 H new ATOM 0 HE ARG A 105 -72.604 10.220 99.352 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -72.665 10.730 95.824 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -74.364 11.212 95.876 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -74.688 10.986 99.269 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -75.438 11.352 97.712 1.00 0.00 H new ATOM 1633 N LYS A 106 -68.760 7.011 100.842 1.00 0.00 N ATOM 1634 CA LYS A 106 -69.009 5.722 101.520 1.00 0.00 C ATOM 1635 C LYS A 106 -67.764 5.009 102.075 1.00 0.00 C ATOM 1636 O LYS A 106 -67.862 4.380 103.124 1.00 0.00 O ATOM 1637 CB LYS A 106 -69.897 4.802 100.663 1.00 0.00 C ATOM 1638 CG LYS A 106 -71.345 5.307 100.487 1.00 0.00 C ATOM 1639 CD LYS A 106 -72.346 4.752 101.520 1.00 0.00 C ATOM 1640 CE LYS A 106 -72.178 5.256 102.962 1.00 0.00 C ATOM 1641 NZ LYS A 106 -72.604 6.666 103.124 1.00 0.00 N ATOM 0 H LYS A 106 -69.272 7.763 101.303 1.00 0.00 H new ATOM 0 HA LYS A 106 -69.562 5.982 102.423 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -69.441 4.689 99.679 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -69.922 3.812 101.119 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -71.347 6.395 100.547 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -71.690 5.042 99.487 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -73.354 4.997 101.186 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -72.267 3.665 101.525 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -72.759 4.625 103.634 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -71.133 5.159 103.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -72.455 6.963 104.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -72.044 7.273 102.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -73.612 6.754 102.885 1.00 0.00 H new