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 66 SER OG : rot 180:sc= 0.33 USER MOD Set 1.2: A 67 THR OG1 : rot 36:sc= 1.08 USER MOD Set 2.1: A 27 THR OG1 : rot -125:sc= 1.17 USER MOD Set 2.2: A 31 THR OG1 : rot -149:sc= 2.06 USER MOD Set 3.1: A 19 SER OG : rot -58:sc= 1.84 USER MOD Set 3.2: A 37 LYS NZ :NH3+ 167:sc= 2.34 (180deg=0.533) USER MOD Single : A 13 MET CE :methyl -122:sc= 0 (180deg=-0.101) USER MOD Single : A 15 SER OG : rot 180:sc= 0.00539 USER MOD Single : A 17 LYS NZ :NH3+ -164:sc= 1.04 (180deg=0.623) USER MOD Single : A 22 LYS NZ :NH3+ 152:sc= 2.26 (180deg=0.653) USER MOD Single : A 24 MET CE :methyl -149:sc= -0.452 (180deg=-2.4) USER MOD Single : A 28 GLN : amide:sc= 0.175 K(o=0.17,f=-4.9!) USER MOD Single : A 29 HIS : no HE2:sc= 1.09 K(o=1.1,f=-4.2!) USER MOD Single : A 32 THR OG1 : rot 132:sc= 0.236 USER MOD Single : A 35 LYS NZ :NH3+ 140:sc= 2.35 (180deg=0.268) USER MOD Single : A 38 TYR OH : rot 96:sc= 0.0315 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= 1.13 K(o=1.1,f=-1.3) USER MOD Single : A 56 LYS NZ :NH3+ -179:sc= 3.15 (180deg=3.14) USER MOD Single : A 58 LYS NZ :NH3+ -165:sc= 1.38 (180deg=-0.0211) USER MOD Single : A 65 SER OG : rot -54:sc= 1.17 USER MOD Single : A 72 ASN : amide:sc= 1.2 K(o=1.2,f=-0.058) USER MOD Single : A 73 THR OG1 : rot -131:sc= 1.42 USER MOD Single : A 74 ASN : amide:sc= 0.00561 K(o=0.0056,f=-0.97) USER MOD Single : A 75 SER OG : rot -100:sc= 0 USER MOD Single : A 77 THR OG1 : rot 175:sc= 1.17 USER MOD Single : A 78 ASN : amide:sc= 0.938 K(o=0.94,f=-0.14) USER MOD Single : A 88 SER OG : rot 71:sc= 0.747 USER MOD Single : A 89 TYR OH : rot -59:sc= 1.01 USER MOD Single : A 96 ASN : amide:sc= 1.22 K(o=1.2,f=-0.083) USER MOD Single : A 97 SER OG : rot -142:sc= 1.28 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 HIS : no HE2:sc= 0.0333 K(o=0.033,f=-2.2!) USER MOD Single : A 106 LYS NZ :NH3+ -177:sc= 2.34 (180deg=2.25) USER MOD ----------------------------------------------------------------- ATOM 211 N MET A 13 -68.565 36.693 95.445 1.00 0.00 N ATOM 212 CA MET A 13 -67.487 37.217 96.301 1.00 0.00 C ATOM 213 C MET A 13 -66.132 36.485 96.198 1.00 0.00 C ATOM 214 O MET A 13 -65.384 36.720 95.252 1.00 0.00 O ATOM 215 CB MET A 13 -68.020 37.349 97.746 1.00 0.00 C ATOM 216 CG MET A 13 -68.942 38.557 97.944 1.00 0.00 C ATOM 217 SD MET A 13 -68.141 40.178 97.795 1.00 0.00 S ATOM 218 CE MET A 13 -67.109 40.191 99.287 1.00 0.00 C ATOM 0 HA MET A 13 -67.223 38.204 95.921 1.00 0.00 H new ATOM 0 HB2 MET A 13 -68.561 36.441 98.011 1.00 0.00 H new ATOM 0 HB3 MET A 13 -67.176 37.429 98.431 1.00 0.00 H new ATOM 0 HG2 MET A 13 -69.749 38.501 97.213 1.00 0.00 H new ATOM 0 HG3 MET A 13 -69.400 38.486 98.931 1.00 0.00 H new ATOM 0 HE1 MET A 13 -67.370 41.052 99.902 1.00 0.00 H new ATOM 0 HE2 MET A 13 -67.277 39.275 99.854 1.00 0.00 H new ATOM 0 HE3 MET A 13 -66.059 40.253 99.002 1.00 0.00 H new ATOM 228 N CYS A 14 -65.725 35.735 97.231 1.00 0.00 N ATOM 229 CA CYS A 14 -64.340 35.824 97.704 1.00 0.00 C ATOM 230 C CYS A 14 -63.325 34.954 96.952 1.00 0.00 C ATOM 231 O CYS A 14 -63.293 33.735 97.104 1.00 0.00 O ATOM 232 CB CYS A 14 -64.295 35.533 99.203 1.00 0.00 C ATOM 233 SG CYS A 14 -64.922 36.904 100.199 1.00 0.00 S ATOM 0 H CYS A 14 -66.316 35.079 97.741 1.00 0.00 H new ATOM 0 HA CYS A 14 -64.024 36.846 97.494 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -64.882 34.639 99.413 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -63.268 35.316 99.496 1.00 0.00 H new ATOM 238 N SER A 15 -62.412 35.623 96.241 1.00 0.00 N ATOM 239 CA SER A 15 -61.160 35.065 95.722 1.00 0.00 C ATOM 240 C SER A 15 -60.121 34.710 96.802 1.00 0.00 C ATOM 241 O SER A 15 -59.132 34.046 96.491 1.00 0.00 O ATOM 242 CB SER A 15 -60.539 36.070 94.744 1.00 0.00 C ATOM 243 OG SER A 15 -60.372 37.323 95.384 1.00 0.00 O ATOM 0 H SER A 15 -62.530 36.608 96.002 1.00 0.00 H new ATOM 0 HA SER A 15 -61.423 34.126 95.235 1.00 0.00 H new ATOM 0 HB2 SER A 15 -59.576 35.700 94.391 1.00 0.00 H new ATOM 0 HB3 SER A 15 -61.178 36.181 93.868 1.00 0.00 H new ATOM 0 HG SER A 15 -59.973 37.961 94.756 1.00 0.00 H new ATOM 249 N GLY A 16 -60.319 35.124 98.061 1.00 0.00 N ATOM 250 CA GLY A 16 -59.377 34.902 99.160 1.00 0.00 C ATOM 251 C GLY A 16 -59.267 33.442 99.630 1.00 0.00 C ATOM 252 O GLY A 16 -60.046 32.576 99.241 1.00 0.00 O ATOM 0 H GLY A 16 -61.156 35.632 98.347 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -58.390 35.244 98.849 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -59.676 35.520 100.007 1.00 0.00 H new ATOM 256 N LYS A 17 -58.278 33.185 100.494 1.00 0.00 N ATOM 257 CA LYS A 17 -57.969 31.878 101.098 1.00 0.00 C ATOM 258 C LYS A 17 -58.919 31.559 102.272 1.00 0.00 C ATOM 259 O LYS A 17 -59.442 32.468 102.920 1.00 0.00 O ATOM 260 CB LYS A 17 -56.483 31.909 101.536 1.00 0.00 C ATOM 261 CG LYS A 17 -55.627 30.705 101.088 1.00 0.00 C ATOM 262 CD LYS A 17 -55.704 29.459 101.982 1.00 0.00 C ATOM 263 CE LYS A 17 -55.066 29.758 103.345 1.00 0.00 C ATOM 264 NZ LYS A 17 -55.432 28.779 104.390 1.00 0.00 N ATOM 0 H LYS A 17 -57.639 33.916 100.808 1.00 0.00 H new ATOM 0 HA LYS A 17 -58.122 31.077 100.375 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -56.028 32.820 101.147 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -56.445 31.973 102.623 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -55.929 30.424 100.079 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -54.586 31.024 101.032 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -56.743 29.159 102.115 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -55.190 28.625 101.504 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -53.982 29.773 103.235 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -55.368 30.754 103.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -55.204 29.170 105.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -56.451 28.579 104.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -54.898 27.899 104.243 1.00 0.00 H new ATOM 278 N PHE A 18 -59.084 30.268 102.578 1.00 0.00 N ATOM 279 CA PHE A 18 -59.936 29.701 103.638 1.00 0.00 C ATOM 280 C PHE A 18 -59.151 28.682 104.492 1.00 0.00 C ATOM 281 O PHE A 18 -58.086 28.229 104.068 1.00 0.00 O ATOM 282 CB PHE A 18 -61.158 29.034 102.966 1.00 0.00 C ATOM 283 CG PHE A 18 -62.127 30.006 102.317 1.00 0.00 C ATOM 284 CD1 PHE A 18 -61.883 30.501 101.021 1.00 0.00 C ATOM 285 CD2 PHE A 18 -63.259 30.452 103.029 1.00 0.00 C ATOM 286 CE1 PHE A 18 -62.714 31.494 100.474 1.00 0.00 C ATOM 287 CE2 PHE A 18 -64.080 31.455 102.488 1.00 0.00 C ATOM 288 CZ PHE A 18 -63.790 31.996 101.222 1.00 0.00 C ATOM 0 H PHE A 18 -58.594 29.539 102.059 1.00 0.00 H new ATOM 0 HA PHE A 18 -60.268 30.492 104.311 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -60.804 28.334 102.209 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -61.695 28.450 103.714 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -61.054 30.116 100.445 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -63.495 30.022 103.991 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -62.525 31.870 99.479 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -64.934 31.811 103.044 1.00 0.00 H new ATOM 0 HZ PHE A 18 -64.396 32.798 100.826 1.00 0.00 H new ATOM 298 N SER A 19 -59.685 28.259 105.649 1.00 0.00 N ATOM 299 CA SER A 19 -59.184 27.113 106.433 1.00 0.00 C ATOM 300 C SER A 19 -60.141 25.922 106.339 1.00 0.00 C ATOM 301 O SER A 19 -61.355 26.092 106.485 1.00 0.00 O ATOM 302 CB SER A 19 -59.030 27.404 107.935 1.00 0.00 C ATOM 303 OG SER A 19 -58.575 28.702 108.259 1.00 0.00 O ATOM 0 H SER A 19 -60.493 28.711 106.076 1.00 0.00 H new ATOM 0 HA SER A 19 -58.207 26.901 105.999 1.00 0.00 H new ATOM 0 HB2 SER A 19 -59.993 27.244 108.419 1.00 0.00 H new ATOM 0 HB3 SER A 19 -58.336 26.678 108.359 1.00 0.00 H new ATOM 0 HG SER A 19 -57.709 28.862 107.829 1.00 0.00 H new ATOM 309 N ILE A 20 -59.586 24.715 106.172 1.00 0.00 N ATOM 310 CA ILE A 20 -60.274 23.459 106.482 1.00 0.00 C ATOM 311 C ILE A 20 -60.286 23.300 108.009 1.00 0.00 C ATOM 312 O ILE A 20 -59.321 22.860 108.626 1.00 0.00 O ATOM 313 CB ILE A 20 -59.673 22.261 105.700 1.00 0.00 C ATOM 314 CG1 ILE A 20 -60.384 20.933 106.043 1.00 0.00 C ATOM 315 CG2 ILE A 20 -58.150 22.080 105.855 1.00 0.00 C ATOM 316 CD1 ILE A 20 -61.854 20.912 105.611 1.00 0.00 C ATOM 0 H ILE A 20 -58.640 24.583 105.815 1.00 0.00 H new ATOM 0 HA ILE A 20 -61.309 23.481 106.142 1.00 0.00 H new ATOM 0 HB ILE A 20 -59.850 22.520 104.656 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -59.857 20.110 105.560 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -60.324 20.762 107.118 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -57.825 21.218 105.272 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -57.639 22.974 105.497 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -57.908 21.920 106.906 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -62.298 19.954 105.879 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -62.393 21.715 106.114 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -61.918 21.052 104.532 1.00 0.00 H new ATOM 328 N ASP A 21 -61.364 23.777 108.631 1.00 0.00 N ATOM 329 CA ASP A 21 -61.458 24.017 110.071 1.00 0.00 C ATOM 330 C ASP A 21 -62.089 22.822 110.819 1.00 0.00 C ATOM 331 O ASP A 21 -61.963 22.707 112.039 1.00 0.00 O ATOM 332 CB ASP A 21 -62.204 25.349 110.242 1.00 0.00 C ATOM 333 CG ASP A 21 -61.954 26.020 111.592 1.00 0.00 C ATOM 334 OD1 ASP A 21 -62.723 25.743 112.542 1.00 0.00 O ATOM 335 OD2 ASP A 21 -61.005 26.837 111.640 1.00 0.00 O ATOM 0 H ASP A 21 -62.221 24.014 108.132 1.00 0.00 H new ATOM 0 HA ASP A 21 -60.474 24.101 110.532 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -61.903 26.030 109.446 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -63.274 25.175 110.125 1.00 0.00 H new ATOM 340 N LYS A 22 -62.701 21.881 110.087 1.00 0.00 N ATOM 341 CA LYS A 22 -62.772 20.453 110.425 1.00 0.00 C ATOM 342 C LYS A 22 -62.817 19.623 109.137 1.00 0.00 C ATOM 343 O LYS A 22 -63.496 20.007 108.185 1.00 0.00 O ATOM 344 CB LYS A 22 -63.996 20.134 111.308 1.00 0.00 C ATOM 345 CG LYS A 22 -63.848 18.757 111.981 1.00 0.00 C ATOM 346 CD LYS A 22 -65.098 18.265 112.725 1.00 0.00 C ATOM 347 CE LYS A 22 -66.290 17.887 111.828 1.00 0.00 C ATOM 348 NZ LYS A 22 -65.951 16.834 110.842 1.00 0.00 N ATOM 0 H LYS A 22 -63.177 22.101 109.212 1.00 0.00 H new ATOM 0 HA LYS A 22 -61.881 20.196 110.998 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -64.110 20.905 112.070 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -64.901 20.150 110.701 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -63.583 18.023 111.220 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -63.017 18.800 112.685 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -64.826 17.396 113.325 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -65.418 19.043 113.418 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -67.115 17.543 112.452 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -66.639 18.775 111.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -66.806 16.290 110.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -65.573 17.275 109.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -65.236 16.197 111.247 1.00 0.00 H new ATOM 362 N GLU A 23 -62.138 18.472 109.168 1.00 0.00 N ATOM 363 CA GLU A 23 -62.204 17.376 108.194 1.00 0.00 C ATOM 364 C GLU A 23 -63.638 16.932 107.853 1.00 0.00 C ATOM 365 O GLU A 23 -64.595 17.228 108.573 1.00 0.00 O ATOM 366 CB GLU A 23 -61.339 16.197 108.699 1.00 0.00 C ATOM 367 CG GLU A 23 -61.495 15.765 110.177 1.00 0.00 C ATOM 368 CD GLU A 23 -62.751 14.935 110.477 1.00 0.00 C ATOM 369 OE1 GLU A 23 -62.734 13.731 110.140 1.00 0.00 O ATOM 370 OE2 GLU A 23 -63.715 15.484 111.058 1.00 0.00 O ATOM 0 H GLU A 23 -61.484 18.267 109.924 1.00 0.00 H new ATOM 0 HA GLU A 23 -61.802 17.749 107.252 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -61.556 15.331 108.073 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -60.293 16.455 108.535 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -60.617 15.187 110.466 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -61.509 16.658 110.802 1.00 0.00 H new ATOM 377 N MET A 24 -63.792 16.212 106.742 1.00 0.00 N ATOM 378 CA MET A 24 -65.087 15.730 106.260 1.00 0.00 C ATOM 379 C MET A 24 -65.638 14.555 107.079 1.00 0.00 C ATOM 380 O MET A 24 -64.952 13.557 107.312 1.00 0.00 O ATOM 381 CB MET A 24 -64.947 15.347 104.783 1.00 0.00 C ATOM 382 CG MET A 24 -65.307 16.544 103.911 1.00 0.00 C ATOM 383 SD MET A 24 -64.982 16.368 102.143 1.00 0.00 S ATOM 384 CE MET A 24 -63.178 16.259 102.204 1.00 0.00 C ATOM 0 H MET A 24 -63.011 15.943 106.143 1.00 0.00 H new ATOM 0 HA MET A 24 -65.812 16.536 106.378 1.00 0.00 H new ATOM 0 HB2 MET A 24 -63.926 15.026 104.575 1.00 0.00 H new ATOM 0 HB3 MET A 24 -65.600 14.505 104.551 1.00 0.00 H new ATOM 0 HG2 MET A 24 -66.367 16.759 104.045 1.00 0.00 H new ATOM 0 HG3 MET A 24 -64.757 17.412 104.276 1.00 0.00 H new ATOM 0 HE1 MET A 24 -62.757 16.685 101.293 1.00 0.00 H new ATOM 0 HE2 MET A 24 -62.809 16.812 103.068 1.00 0.00 H new ATOM 0 HE3 MET A 24 -62.879 15.214 102.288 1.00 0.00 H new ATOM 394 N ALA A 25 -66.917 14.653 107.458 1.00 0.00 N ATOM 395 CA ALA A 25 -67.675 13.594 108.128 1.00 0.00 C ATOM 396 C ALA A 25 -68.972 13.297 107.362 1.00 0.00 C ATOM 397 O ALA A 25 -69.777 14.202 107.134 1.00 0.00 O ATOM 398 CB ALA A 25 -67.938 14.008 109.579 1.00 0.00 C ATOM 0 H ALA A 25 -67.468 15.497 107.302 1.00 0.00 H new ATOM 0 HA ALA A 25 -67.098 12.669 108.138 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -68.502 13.224 110.084 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -66.988 14.160 110.092 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -68.511 14.935 109.595 1.00 0.00 H new ATOM 404 N GLU A 26 -69.159 12.041 106.934 1.00 0.00 N ATOM 405 CA GLU A 26 -70.305 11.638 106.113 1.00 0.00 C ATOM 406 C GLU A 26 -71.593 11.392 106.907 1.00 0.00 C ATOM 407 O GLU A 26 -71.574 11.133 108.110 1.00 0.00 O ATOM 408 CB GLU A 26 -69.959 10.400 105.264 1.00 0.00 C ATOM 409 CG GLU A 26 -70.350 10.657 103.801 1.00 0.00 C ATOM 410 CD GLU A 26 -69.847 9.579 102.859 1.00 0.00 C ATOM 411 OE1 GLU A 26 -70.317 8.435 103.030 1.00 0.00 O ATOM 412 OE2 GLU A 26 -69.026 9.878 101.963 1.00 0.00 O ATOM 0 H GLU A 26 -68.519 11.277 107.148 1.00 0.00 H new ATOM 0 HA GLU A 26 -70.510 12.489 105.463 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -68.893 10.184 105.334 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -70.487 9.526 105.645 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -71.436 10.721 103.726 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -69.951 11.622 103.487 1.00 0.00 H new ATOM 419 N THR A 27 -72.720 11.418 106.192 1.00 0.00 N ATOM 420 CA THR A 27 -74.075 11.287 106.730 1.00 0.00 C ATOM 421 C THR A 27 -74.758 9.989 106.263 1.00 0.00 C ATOM 422 O THR A 27 -74.307 9.310 105.330 1.00 0.00 O ATOM 423 CB THR A 27 -74.918 12.499 106.292 1.00 0.00 C ATOM 424 OG1 THR A 27 -75.132 12.395 104.907 1.00 0.00 O ATOM 425 CG2 THR A 27 -74.295 13.860 106.615 1.00 0.00 C ATOM 0 H THR A 27 -72.712 11.536 105.179 1.00 0.00 H new ATOM 0 HA THR A 27 -74.001 11.249 107.817 1.00 0.00 H new ATOM 0 HB THR A 27 -75.848 12.467 106.860 1.00 0.00 H new ATOM 0 HG1 THR A 27 -74.835 13.219 104.467 1.00 0.00 H new ATOM 0 HG21 THR A 27 -74.957 14.654 106.271 1.00 0.00 H new ATOM 0 HG22 THR A 27 -74.152 13.948 107.692 1.00 0.00 H new ATOM 0 HG23 THR A 27 -73.332 13.948 106.112 1.00 0.00 H new ATOM 433 N GLN A 28 -75.909 9.679 106.874 1.00 0.00 N ATOM 434 CA GLN A 28 -76.862 8.679 106.372 1.00 0.00 C ATOM 435 C GLN A 28 -77.481 9.088 105.020 1.00 0.00 C ATOM 436 O GLN A 28 -77.778 8.226 104.199 1.00 0.00 O ATOM 437 CB GLN A 28 -77.946 8.352 107.427 1.00 0.00 C ATOM 438 CG GLN A 28 -78.446 9.489 108.343 1.00 0.00 C ATOM 439 CD GLN A 28 -78.904 10.734 107.594 1.00 0.00 C ATOM 440 OE1 GLN A 28 -78.106 11.605 107.285 1.00 0.00 O ATOM 441 NE2 GLN A 28 -80.170 10.856 107.249 1.00 0.00 N ATOM 0 H GLN A 28 -76.209 10.121 107.743 1.00 0.00 H new ATOM 0 HA GLN A 28 -76.297 7.765 106.189 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -78.810 7.946 106.901 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -77.559 7.558 108.065 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -79.273 9.117 108.948 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -77.647 9.765 109.031 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -80.840 10.131 107.505 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -80.479 11.675 106.726 1.00 0.00 H new ATOM 450 N HIS A 29 -77.601 10.395 104.758 1.00 0.00 N ATOM 451 CA HIS A 29 -78.000 10.997 103.484 1.00 0.00 C ATOM 452 C HIS A 29 -76.936 10.811 102.374 1.00 0.00 C ATOM 453 O HIS A 29 -77.223 11.051 101.204 1.00 0.00 O ATOM 454 CB HIS A 29 -78.326 12.477 103.784 1.00 0.00 C ATOM 455 CG HIS A 29 -78.832 13.337 102.654 1.00 0.00 C ATOM 456 ND1 HIS A 29 -78.657 14.702 102.563 1.00 0.00 N ATOM 457 CD2 HIS A 29 -79.607 12.947 101.594 1.00 0.00 C ATOM 458 CE1 HIS A 29 -79.308 15.117 101.463 1.00 0.00 C ATOM 459 NE2 HIS A 29 -79.900 14.087 100.842 1.00 0.00 N ATOM 0 H HIS A 29 -77.411 11.099 105.471 1.00 0.00 H new ATOM 0 HA HIS A 29 -78.878 10.496 103.076 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -79.071 12.499 104.579 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -77.424 12.943 104.179 1.00 0.00 H new ATOM 0 HD1 HIS A 29 -78.131 15.288 103.211 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -79.933 11.940 101.379 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -79.349 16.142 101.125 1.00 0.00 H new ATOM 467 N GLY A 30 -75.717 10.356 102.708 1.00 0.00 N ATOM 468 CA GLY A 30 -74.617 10.130 101.757 1.00 0.00 C ATOM 469 C GLY A 30 -73.843 11.402 101.392 1.00 0.00 C ATOM 470 O GLY A 30 -72.861 11.346 100.651 1.00 0.00 O ATOM 0 H GLY A 30 -75.464 10.130 103.670 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -73.924 9.404 102.183 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -75.022 9.688 100.846 1.00 0.00 H new ATOM 474 N THR A 31 -74.280 12.546 101.910 1.00 0.00 N ATOM 475 CA THR A 31 -73.559 13.817 101.940 1.00 0.00 C ATOM 476 C THR A 31 -72.417 13.777 102.954 1.00 0.00 C ATOM 477 O THR A 31 -72.379 12.922 103.837 1.00 0.00 O ATOM 478 CB THR A 31 -74.531 14.933 102.344 1.00 0.00 C ATOM 479 OG1 THR A 31 -75.221 14.576 103.529 1.00 0.00 O ATOM 480 CG2 THR A 31 -75.554 15.190 101.244 1.00 0.00 C ATOM 0 H THR A 31 -75.200 12.616 102.345 1.00 0.00 H new ATOM 0 HA THR A 31 -73.144 14.001 100.949 1.00 0.00 H new ATOM 0 HB THR A 31 -73.946 15.837 102.510 1.00 0.00 H new ATOM 0 HG1 THR A 31 -76.117 14.973 103.518 1.00 0.00 H new ATOM 0 HG21 THR A 31 -76.231 15.985 101.555 1.00 0.00 H new ATOM 0 HG22 THR A 31 -75.039 15.489 100.331 1.00 0.00 H new ATOM 0 HG23 THR A 31 -76.125 14.280 101.058 1.00 0.00 H new ATOM 488 N THR A 32 -71.504 14.741 102.874 1.00 0.00 N ATOM 489 CA THR A 32 -70.429 14.951 103.841 1.00 0.00 C ATOM 490 C THR A 32 -70.452 16.384 104.358 1.00 0.00 C ATOM 491 O THR A 32 -70.834 17.304 103.636 1.00 0.00 O ATOM 492 CB THR A 32 -69.084 14.526 103.237 1.00 0.00 C ATOM 493 OG1 THR A 32 -68.136 14.412 104.267 1.00 0.00 O ATOM 494 CG2 THR A 32 -68.538 15.461 102.156 1.00 0.00 C ATOM 0 H THR A 32 -71.491 15.418 102.112 1.00 0.00 H new ATOM 0 HA THR A 32 -70.582 14.317 104.714 1.00 0.00 H new ATOM 0 HB THR A 32 -69.267 13.573 102.740 1.00 0.00 H new ATOM 0 HG1 THR A 32 -67.657 13.562 104.178 1.00 0.00 H new ATOM 0 HG21 THR A 32 -67.585 15.078 101.790 1.00 0.00 H new ATOM 0 HG22 THR A 32 -69.248 15.516 101.331 1.00 0.00 H new ATOM 0 HG23 THR A 32 -68.391 16.456 102.576 1.00 0.00 H new ATOM 502 N VAL A 33 -70.084 16.567 105.627 1.00 0.00 N ATOM 503 CA VAL A 33 -70.164 17.846 106.336 1.00 0.00 C ATOM 504 C VAL A 33 -68.755 18.387 106.553 1.00 0.00 C ATOM 505 O VAL A 33 -67.931 17.744 107.208 1.00 0.00 O ATOM 506 CB VAL A 33 -70.951 17.723 107.657 1.00 0.00 C ATOM 507 CG1 VAL A 33 -71.175 19.113 108.274 1.00 0.00 C ATOM 508 CG2 VAL A 33 -72.329 17.077 107.443 1.00 0.00 C ATOM 0 H VAL A 33 -69.713 15.812 106.204 1.00 0.00 H new ATOM 0 HA VAL A 33 -70.720 18.557 105.725 1.00 0.00 H new ATOM 0 HB VAL A 33 -70.357 17.094 108.320 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -71.732 19.012 109.206 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -70.212 19.581 108.476 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -71.741 19.733 107.579 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -72.851 17.009 108.397 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -72.913 17.686 106.753 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -72.202 16.078 107.027 1.00 0.00 H new ATOM 518 N VAL A 34 -68.490 19.568 105.983 1.00 0.00 N ATOM 519 CA VAL A 34 -67.186 20.247 105.987 1.00 0.00 C ATOM 520 C VAL A 34 -67.290 21.527 106.813 1.00 0.00 C ATOM 521 O VAL A 34 -68.153 22.353 106.519 1.00 0.00 O ATOM 522 CB VAL A 34 -66.721 20.607 104.552 1.00 0.00 C ATOM 523 CG1 VAL A 34 -65.189 20.655 104.520 1.00 0.00 C ATOM 524 CG2 VAL A 34 -67.226 19.653 103.460 1.00 0.00 C ATOM 0 H VAL A 34 -69.205 20.099 105.486 1.00 0.00 H new ATOM 0 HA VAL A 34 -66.453 19.566 106.420 1.00 0.00 H new ATOM 0 HB VAL A 34 -67.159 21.579 104.324 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -64.854 20.908 103.514 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -64.834 21.410 105.221 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -64.788 19.681 104.802 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -66.853 19.981 102.490 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -66.868 18.644 103.665 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -68.316 19.656 103.449 1.00 0.00 H new ATOM 534 N LYS A 35 -66.438 21.723 107.831 1.00 0.00 N ATOM 535 CA LYS A 35 -66.392 22.992 108.577 1.00 0.00 C ATOM 536 C LYS A 35 -65.293 23.879 107.994 1.00 0.00 C ATOM 537 O LYS A 35 -64.111 23.553 108.108 1.00 0.00 O ATOM 538 CB LYS A 35 -66.244 22.759 110.092 1.00 0.00 C ATOM 539 CG LYS A 35 -66.725 23.963 110.934 1.00 0.00 C ATOM 540 CD LYS A 35 -65.694 24.447 111.962 1.00 0.00 C ATOM 541 CE LYS A 35 -65.319 23.412 113.028 1.00 0.00 C ATOM 542 NZ LYS A 35 -63.976 23.691 113.593 1.00 0.00 N ATOM 0 H LYS A 35 -65.773 21.022 108.157 1.00 0.00 H new ATOM 0 HA LYS A 35 -67.341 23.515 108.461 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -66.812 21.873 110.376 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -65.199 22.555 110.323 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -66.973 24.787 110.265 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -67.642 23.688 111.454 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -64.789 24.749 111.435 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -66.085 25.335 112.459 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -66.062 23.421 113.826 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -65.333 22.414 112.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -63.989 23.521 114.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -63.275 23.066 113.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -63.722 24.683 113.410 1.00 0.00 H new ATOM 556 N VAL A 36 -65.681 24.974 107.337 1.00 0.00 N ATOM 557 CA VAL A 36 -64.742 25.977 106.812 1.00 0.00 C ATOM 558 C VAL A 36 -64.515 27.081 107.849 1.00 0.00 C ATOM 559 O VAL A 36 -65.366 27.310 108.711 1.00 0.00 O ATOM 560 CB VAL A 36 -65.208 26.579 105.459 1.00 0.00 C ATOM 561 CG1 VAL A 36 -65.873 25.534 104.554 1.00 0.00 C ATOM 562 CG2 VAL A 36 -66.168 27.770 105.589 1.00 0.00 C ATOM 0 H VAL A 36 -66.660 25.194 107.151 1.00 0.00 H new ATOM 0 HA VAL A 36 -63.798 25.467 106.618 1.00 0.00 H new ATOM 0 HB VAL A 36 -64.281 26.937 105.011 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -66.181 26.005 103.620 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -65.164 24.734 104.340 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -66.747 25.120 105.057 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -66.442 28.127 104.596 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -67.066 27.457 106.122 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -65.679 28.573 106.141 1.00 0.00 H new ATOM 572 N LYS A 37 -63.425 27.832 107.675 1.00 0.00 N ATOM 573 CA LYS A 37 -63.217 29.195 108.186 1.00 0.00 C ATOM 574 C LYS A 37 -62.734 30.063 107.018 1.00 0.00 C ATOM 575 O LYS A 37 -62.097 29.522 106.113 1.00 0.00 O ATOM 576 CB LYS A 37 -62.165 29.144 109.306 1.00 0.00 C ATOM 577 CG LYS A 37 -62.087 30.414 110.168 1.00 0.00 C ATOM 578 CD LYS A 37 -60.658 30.934 110.396 1.00 0.00 C ATOM 579 CE LYS A 37 -59.825 30.168 111.431 1.00 0.00 C ATOM 580 NZ LYS A 37 -59.403 28.830 110.959 1.00 0.00 N ATOM 0 H LYS A 37 -62.621 27.491 107.148 1.00 0.00 H new ATOM 0 HA LYS A 37 -64.136 29.617 108.594 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -62.383 28.294 109.953 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -61.187 28.963 108.860 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -62.676 31.199 109.693 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -62.547 30.212 111.135 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -60.128 30.913 109.444 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -60.717 31.978 110.705 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -58.941 30.754 111.683 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -60.406 30.058 112.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -58.672 28.452 111.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -60.222 28.189 110.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -59.018 28.907 109.996 1.00 0.00 H new ATOM 594 N TYR A 38 -62.978 31.376 107.011 1.00 0.00 N ATOM 595 CA TYR A 38 -62.326 32.260 106.031 1.00 0.00 C ATOM 596 C TYR A 38 -60.970 32.756 106.555 1.00 0.00 C ATOM 597 O TYR A 38 -60.718 32.748 107.754 1.00 0.00 O ATOM 598 CB TYR A 38 -63.275 33.399 105.622 1.00 0.00 C ATOM 599 CG TYR A 38 -62.747 34.347 104.549 1.00 0.00 C ATOM 600 CD1 TYR A 38 -62.142 33.828 103.390 1.00 0.00 C ATOM 601 CD2 TYR A 38 -62.903 35.742 104.674 1.00 0.00 C ATOM 602 CE1 TYR A 38 -61.729 34.670 102.348 1.00 0.00 C ATOM 603 CE2 TYR A 38 -62.483 36.601 103.637 1.00 0.00 C ATOM 604 CZ TYR A 38 -61.911 36.059 102.461 1.00 0.00 C ATOM 605 OH TYR A 38 -61.560 36.849 101.411 1.00 0.00 O ATOM 0 H TYR A 38 -63.610 31.848 107.658 1.00 0.00 H new ATOM 0 HA TYR A 38 -62.109 31.694 105.125 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -64.207 32.960 105.266 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -63.516 33.983 106.510 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -61.993 32.762 103.301 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -63.346 36.155 105.568 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -61.273 34.253 101.462 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -62.598 37.670 103.740 1.00 0.00 H new ATOM 0 HH TYR A 38 -62.351 37.037 100.864 1.00 0.00 H new ATOM 615 N GLU A 39 -60.080 33.195 105.663 1.00 0.00 N ATOM 616 CA GLU A 39 -58.801 33.814 106.026 1.00 0.00 C ATOM 617 C GLU A 39 -58.592 35.123 105.259 1.00 0.00 C ATOM 618 O GLU A 39 -58.346 36.156 105.883 1.00 0.00 O ATOM 619 CB GLU A 39 -57.634 32.832 105.809 1.00 0.00 C ATOM 620 CG GLU A 39 -57.586 31.736 106.886 1.00 0.00 C ATOM 621 CD GLU A 39 -56.580 30.631 106.555 1.00 0.00 C ATOM 622 OE1 GLU A 39 -55.476 30.918 106.046 1.00 0.00 O ATOM 623 OE2 GLU A 39 -56.920 29.437 106.738 1.00 0.00 O ATOM 0 H GLU A 39 -60.228 33.130 104.656 1.00 0.00 H new ATOM 0 HA GLU A 39 -58.827 34.059 107.088 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -57.729 32.369 104.827 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -56.693 33.383 105.812 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -57.325 32.185 107.845 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -58.578 31.298 106.998 1.00 0.00 H new ATOM 630 N GLY A 40 -58.711 35.080 103.926 1.00 0.00 N ATOM 631 CA GLY A 40 -58.013 35.959 102.986 1.00 0.00 C ATOM 632 C GLY A 40 -58.294 37.468 102.984 1.00 0.00 C ATOM 633 O GLY A 40 -57.546 38.166 102.303 1.00 0.00 O ATOM 0 H GLY A 40 -59.318 34.407 103.458 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -56.944 35.830 103.156 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -58.223 35.590 101.982 1.00 0.00 H new ATOM 637 N ALA A 41 -59.324 37.993 103.667 1.00 0.00 N ATOM 638 CA ALA A 41 -59.636 39.435 103.598 1.00 0.00 C ATOM 639 C ALA A 41 -60.292 40.072 104.839 1.00 0.00 C ATOM 640 O ALA A 41 -60.640 41.252 104.789 1.00 0.00 O ATOM 641 CB ALA A 41 -60.491 39.709 102.351 1.00 0.00 C ATOM 0 H ALA A 41 -59.948 37.452 104.266 1.00 0.00 H new ATOM 0 HA ALA A 41 -58.662 39.921 103.547 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -60.724 40.772 102.296 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -59.939 39.412 101.459 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -61.417 39.138 102.412 1.00 0.00 H new ATOM 647 N GLY A 42 -60.511 39.344 105.942 1.00 0.00 N ATOM 648 CA GLY A 42 -61.147 39.886 107.148 1.00 0.00 C ATOM 649 C GLY A 42 -62.671 39.982 107.031 1.00 0.00 C ATOM 650 O GLY A 42 -63.389 39.432 107.861 1.00 0.00 O ATOM 0 H GLY A 42 -60.251 38.361 106.022 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -60.893 39.256 108.000 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -60.741 40.877 107.352 1.00 0.00 H new ATOM 654 N ALA A 43 -63.146 40.698 106.010 1.00 0.00 N ATOM 655 CA ALA A 43 -64.543 41.034 105.735 1.00 0.00 C ATOM 656 C ALA A 43 -65.403 39.835 105.226 1.00 0.00 C ATOM 657 O ALA A 43 -64.863 38.746 105.016 1.00 0.00 O ATOM 658 CB ALA A 43 -64.487 42.208 104.744 1.00 0.00 C ATOM 0 H ALA A 43 -62.520 41.085 105.304 1.00 0.00 H new ATOM 0 HA ALA A 43 -65.060 41.309 106.654 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -65.501 42.518 104.489 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -63.956 43.044 105.200 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -63.965 41.896 103.840 1.00 0.00 H new ATOM 664 N PRO A 44 -66.739 40.001 105.057 1.00 0.00 N ATOM 665 CA PRO A 44 -67.655 38.929 104.646 1.00 0.00 C ATOM 666 C PRO A 44 -67.437 38.353 103.237 1.00 0.00 C ATOM 667 O PRO A 44 -66.841 38.987 102.365 1.00 0.00 O ATOM 668 CB PRO A 44 -69.068 39.527 104.697 1.00 0.00 C ATOM 669 CG PRO A 44 -68.947 40.782 105.549 1.00 0.00 C ATOM 670 CD PRO A 44 -67.500 41.209 105.350 1.00 0.00 C ATOM 0 HA PRO A 44 -67.481 38.093 105.323 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -69.430 39.765 103.697 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -69.777 38.823 105.133 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -69.642 41.556 105.224 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -69.165 40.578 106.597 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -67.418 41.925 104.532 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -67.116 41.700 106.244 1.00 0.00 H new ATOM 678 N CYS A 45 -68.050 37.188 102.995 1.00 0.00 N ATOM 679 CA CYS A 45 -68.093 36.450 101.734 1.00 0.00 C ATOM 680 C CYS A 45 -69.421 35.684 101.576 1.00 0.00 C ATOM 681 O CYS A 45 -69.925 35.132 102.557 1.00 0.00 O ATOM 682 CB CYS A 45 -66.969 35.401 101.768 1.00 0.00 C ATOM 683 SG CYS A 45 -65.292 36.025 101.983 1.00 0.00 S ATOM 0 H CYS A 45 -68.565 36.704 103.731 1.00 0.00 H new ATOM 0 HA CYS A 45 -67.987 37.158 100.912 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -67.179 34.702 102.578 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -67.005 34.832 100.839 1.00 0.00 H new ATOM 688 N LYS A 46 -69.875 35.466 100.328 1.00 0.00 N ATOM 689 CA LYS A 46 -70.261 34.100 99.934 1.00 0.00 C ATOM 690 C LYS A 46 -69.001 33.373 99.456 1.00 0.00 C ATOM 691 O LYS A 46 -68.133 34.013 98.852 1.00 0.00 O ATOM 692 CB LYS A 46 -71.429 34.019 98.934 1.00 0.00 C ATOM 693 CG LYS A 46 -71.166 34.420 97.472 1.00 0.00 C ATOM 694 CD LYS A 46 -71.838 33.478 96.454 1.00 0.00 C ATOM 695 CE LYS A 46 -73.304 33.088 96.720 1.00 0.00 C ATOM 696 NZ LYS A 46 -74.222 34.246 96.778 1.00 0.00 N ATOM 0 H LYS A 46 -69.980 36.179 99.607 1.00 0.00 H new ATOM 0 HA LYS A 46 -70.672 33.596 100.809 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -71.798 32.993 98.936 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -72.235 34.649 99.312 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -71.526 35.436 97.310 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -70.091 34.431 97.293 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -71.786 33.949 95.472 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -71.249 32.562 96.400 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -73.639 32.408 95.936 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -73.361 32.542 97.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -75.190 33.913 96.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -73.927 34.885 97.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -74.196 34.756 95.872 1.00 0.00 H new ATOM 710 N VAL A 47 -68.873 32.079 99.761 1.00 0.00 N ATOM 711 CA VAL A 47 -67.611 31.348 99.549 1.00 0.00 C ATOM 712 C VAL A 47 -67.709 30.442 98.314 1.00 0.00 C ATOM 713 O VAL A 47 -68.727 29.767 98.144 1.00 0.00 O ATOM 714 CB VAL A 47 -67.045 30.652 100.814 1.00 0.00 C ATOM 715 CG1 VAL A 47 -67.630 31.162 102.137 1.00 0.00 C ATOM 716 CG2 VAL A 47 -67.060 29.125 100.844 1.00 0.00 C ATOM 0 H VAL A 47 -69.624 31.512 100.155 1.00 0.00 H new ATOM 0 HA VAL A 47 -66.847 32.095 99.336 1.00 0.00 H new ATOM 0 HB VAL A 47 -66.002 30.953 100.722 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -67.178 30.620 102.968 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -67.420 32.227 102.241 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -68.708 31.002 102.144 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -66.636 28.775 101.785 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -68.086 28.769 100.754 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -66.469 28.739 100.014 1.00 0.00 H new ATOM 726 N PRO A 48 -66.694 30.418 97.428 1.00 0.00 N ATOM 727 CA PRO A 48 -66.697 29.539 96.266 1.00 0.00 C ATOM 728 C PRO A 48 -66.453 28.096 96.727 1.00 0.00 C ATOM 729 O PRO A 48 -65.334 27.763 97.113 1.00 0.00 O ATOM 730 CB PRO A 48 -65.593 30.051 95.327 1.00 0.00 C ATOM 731 CG PRO A 48 -64.908 31.193 96.081 1.00 0.00 C ATOM 732 CD PRO A 48 -65.402 31.086 97.517 1.00 0.00 C ATOM 0 HA PRO A 48 -67.650 29.543 95.738 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -64.884 29.259 95.087 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -66.012 30.400 94.383 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -63.823 31.101 96.031 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -65.166 32.160 95.648 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -64.705 30.516 98.132 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -65.498 32.071 97.975 1.00 0.00 H new ATOM 740 N ILE A 49 -67.496 27.256 96.713 1.00 0.00 N ATOM 741 CA ILE A 49 -67.378 25.811 96.951 1.00 0.00 C ATOM 742 C ILE A 49 -67.763 25.050 95.693 1.00 0.00 C ATOM 743 O ILE A 49 -68.842 25.256 95.138 1.00 0.00 O ATOM 744 CB ILE A 49 -68.197 25.315 98.164 1.00 0.00 C ATOM 745 CG1 ILE A 49 -67.724 26.091 99.407 1.00 0.00 C ATOM 746 CG2 ILE A 49 -68.067 23.785 98.345 1.00 0.00 C ATOM 747 CD1 ILE A 49 -68.133 25.523 100.769 1.00 0.00 C ATOM 0 H ILE A 49 -68.453 27.562 96.535 1.00 0.00 H new ATOM 0 HA ILE A 49 -66.335 25.615 97.198 1.00 0.00 H new ATOM 0 HB ILE A 49 -69.258 25.505 98.003 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -66.636 26.152 99.377 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -68.102 27.111 99.336 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -68.655 23.469 99.207 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -68.433 23.280 97.451 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -67.021 23.525 98.505 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -67.739 26.159 101.562 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -69.220 25.489 100.838 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -67.731 24.516 100.879 1.00 0.00 H new ATOM 759 N GLU A 50 -66.903 24.111 95.308 1.00 0.00 N ATOM 760 CA GLU A 50 -67.206 23.084 94.320 1.00 0.00 C ATOM 761 C GLU A 50 -66.737 21.716 94.824 1.00 0.00 C ATOM 762 O GLU A 50 -66.000 21.602 95.807 1.00 0.00 O ATOM 763 CB GLU A 50 -66.523 23.384 92.974 1.00 0.00 C ATOM 764 CG GLU A 50 -66.669 24.823 92.456 1.00 0.00 C ATOM 765 CD GLU A 50 -65.920 24.976 91.133 1.00 0.00 C ATOM 766 OE1 GLU A 50 -64.724 24.622 91.067 1.00 0.00 O ATOM 767 OE2 GLU A 50 -66.524 25.383 90.117 1.00 0.00 O ATOM 0 H GLU A 50 -65.957 24.043 95.683 1.00 0.00 H new ATOM 0 HA GLU A 50 -68.286 23.077 94.171 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -65.461 23.158 93.069 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -66.928 22.705 92.223 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -67.723 25.064 92.318 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -66.275 25.525 93.191 1.00 0.00 H new ATOM 774 N ILE A 51 -67.089 20.674 94.072 1.00 0.00 N ATOM 775 CA ILE A 51 -66.369 19.406 94.071 1.00 0.00 C ATOM 776 C ILE A 51 -66.029 19.119 92.621 1.00 0.00 C ATOM 777 O ILE A 51 -66.940 19.111 91.788 1.00 0.00 O ATOM 778 CB ILE A 51 -67.185 18.240 94.666 1.00 0.00 C ATOM 779 CG1 ILE A 51 -68.025 18.652 95.892 1.00 0.00 C ATOM 780 CG2 ILE A 51 -66.215 17.088 94.977 1.00 0.00 C ATOM 781 CD1 ILE A 51 -68.795 17.476 96.494 1.00 0.00 C ATOM 0 H ILE A 51 -67.890 20.689 93.441 1.00 0.00 H new ATOM 0 HA ILE A 51 -65.484 19.490 94.702 1.00 0.00 H new ATOM 0 HB ILE A 51 -67.922 17.912 93.933 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -67.370 19.080 96.651 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -68.728 19.432 95.601 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -66.769 16.250 95.400 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -65.721 16.770 94.059 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -65.466 17.426 95.693 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -69.370 17.820 97.354 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -69.472 17.063 95.746 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -68.092 16.706 96.812 1.00 0.00 H new ATOM 793 N ARG A 52 -64.749 18.887 92.324 1.00 0.00 N ATOM 794 CA ARG A 52 -64.292 18.449 91.008 1.00 0.00 C ATOM 795 C ARG A 52 -63.822 16.990 91.043 1.00 0.00 C ATOM 796 O ARG A 52 -63.625 16.392 92.107 1.00 0.00 O ATOM 797 CB ARG A 52 -63.271 19.448 90.416 1.00 0.00 C ATOM 798 CG ARG A 52 -63.909 20.837 90.199 1.00 0.00 C ATOM 799 CD ARG A 52 -63.102 21.769 89.283 1.00 0.00 C ATOM 800 NE ARG A 52 -63.811 23.053 89.105 1.00 0.00 N ATOM 801 CZ ARG A 52 -64.144 23.722 88.007 1.00 0.00 C ATOM 802 NH1 ARG A 52 -63.805 23.365 86.791 1.00 0.00 N ATOM 803 NH2 ARG A 52 -64.875 24.804 88.102 1.00 0.00 N ATOM 0 H ARG A 52 -63.993 19.000 93.000 1.00 0.00 H new ATOM 0 HA ARG A 52 -65.132 18.456 90.313 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -62.416 19.538 91.086 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -62.893 19.066 89.467 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -64.905 20.704 89.776 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -64.036 21.320 91.168 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -62.116 21.947 89.712 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -62.948 21.294 88.314 1.00 0.00 H new ATOM 0 HE ARG A 52 -64.093 23.503 89.976 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -63.249 22.523 86.643 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -64.098 23.930 85.993 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -65.187 25.130 89.017 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -65.133 25.321 87.261 1.00 0.00 H new ATOM 817 N ASP A 53 -63.734 16.416 89.846 1.00 0.00 N ATOM 818 CA ASP A 53 -63.309 15.052 89.540 1.00 0.00 C ATOM 819 C ASP A 53 -61.894 14.721 90.050 1.00 0.00 C ATOM 820 O ASP A 53 -61.168 15.586 90.537 1.00 0.00 O ATOM 821 CB ASP A 53 -63.462 14.811 88.020 1.00 0.00 C ATOM 822 CG ASP A 53 -62.670 15.738 87.076 1.00 0.00 C ATOM 823 OD1 ASP A 53 -62.078 16.746 87.528 1.00 0.00 O ATOM 824 OD2 ASP A 53 -62.682 15.448 85.859 1.00 0.00 O ATOM 0 H ASP A 53 -63.976 16.931 89.000 1.00 0.00 H new ATOM 0 HA ASP A 53 -63.957 14.363 90.082 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -63.167 13.783 87.810 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -64.519 14.897 87.769 1.00 0.00 H new ATOM 829 N VAL A 54 -61.470 13.454 89.930 1.00 0.00 N ATOM 830 CA VAL A 54 -60.128 13.015 90.363 1.00 0.00 C ATOM 831 C VAL A 54 -59.000 13.810 89.693 1.00 0.00 C ATOM 832 O VAL A 54 -58.005 14.137 90.345 1.00 0.00 O ATOM 833 CB VAL A 54 -59.922 11.494 90.211 1.00 0.00 C ATOM 834 CG1 VAL A 54 -60.904 10.730 91.104 1.00 0.00 C ATOM 835 CG2 VAL A 54 -60.063 10.980 88.773 1.00 0.00 C ATOM 0 H VAL A 54 -62.040 12.707 89.534 1.00 0.00 H new ATOM 0 HA VAL A 54 -60.077 13.235 91.429 1.00 0.00 H new ATOM 0 HB VAL A 54 -58.891 11.313 90.516 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -60.746 9.658 90.985 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -60.741 11.008 92.145 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -61.926 10.980 90.818 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -59.903 9.902 88.755 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -61.063 11.205 88.403 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -59.323 11.467 88.138 1.00 0.00 H new ATOM 845 N ASN A 55 -59.211 14.194 88.427 1.00 0.00 N ATOM 846 CA ASN A 55 -58.353 15.067 87.627 1.00 0.00 C ATOM 847 C ASN A 55 -58.395 16.548 88.071 1.00 0.00 C ATOM 848 O ASN A 55 -57.517 17.318 87.686 1.00 0.00 O ATOM 849 CB ASN A 55 -58.801 14.991 86.159 1.00 0.00 C ATOM 850 CG ASN A 55 -58.734 13.644 85.460 1.00 0.00 C ATOM 851 OD1 ASN A 55 -58.454 12.601 86.030 1.00 0.00 O ATOM 852 ND2 ASN A 55 -59.011 13.659 84.173 1.00 0.00 N ATOM 0 H ASN A 55 -60.032 13.884 87.908 1.00 0.00 H new ATOM 0 HA ASN A 55 -57.330 14.716 87.764 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -59.831 15.343 86.106 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -58.194 15.694 85.588 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -58.994 12.791 83.637 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -59.243 14.539 83.711 1.00 0.00 H new ATOM 859 N LYS A 56 -59.377 16.938 88.900 1.00 0.00 N ATOM 860 CA LYS A 56 -59.566 18.256 89.537 1.00 0.00 C ATOM 861 C LYS A 56 -59.915 19.377 88.544 1.00 0.00 C ATOM 862 O LYS A 56 -59.727 20.555 88.834 1.00 0.00 O ATOM 863 CB LYS A 56 -58.395 18.594 90.493 1.00 0.00 C ATOM 864 CG LYS A 56 -57.873 17.342 91.219 1.00 0.00 C ATOM 865 CD LYS A 56 -56.945 17.599 92.408 1.00 0.00 C ATOM 866 CE LYS A 56 -56.094 16.351 92.705 1.00 0.00 C ATOM 867 NZ LYS A 56 -56.884 15.093 92.714 1.00 0.00 N ATOM 0 H LYS A 56 -60.119 16.290 89.164 1.00 0.00 H new ATOM 0 HA LYS A 56 -60.457 18.182 90.161 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -57.583 19.051 89.927 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -58.725 19.329 91.227 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -58.729 16.765 91.569 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -57.343 16.721 90.497 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -56.295 18.447 92.193 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -57.534 17.863 93.287 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -55.304 16.271 91.958 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -55.606 16.473 93.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -56.259 14.292 92.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -57.632 15.158 93.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -57.315 14.947 91.779 1.00 0.00 H new ATOM 881 N GLU A 57 -60.460 19.007 87.383 1.00 0.00 N ATOM 882 CA GLU A 57 -60.778 19.885 86.247 1.00 0.00 C ATOM 883 C GLU A 57 -62.287 20.093 86.064 1.00 0.00 C ATOM 884 O GLU A 57 -62.677 21.195 85.679 1.00 0.00 O ATOM 885 CB GLU A 57 -60.156 19.370 84.925 1.00 0.00 C ATOM 886 CG GLU A 57 -60.172 17.839 84.828 1.00 0.00 C ATOM 887 CD GLU A 57 -60.142 17.222 83.428 1.00 0.00 C ATOM 888 OE1 GLU A 57 -60.964 17.636 82.579 1.00 0.00 O ATOM 889 OE2 GLU A 57 -59.504 16.156 83.277 1.00 0.00 O ATOM 0 H GLU A 57 -60.706 18.035 87.197 1.00 0.00 H new ATOM 0 HA GLU A 57 -60.333 20.850 86.490 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -60.703 19.790 84.081 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -59.129 19.725 84.847 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -59.315 17.457 85.383 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -61.067 17.479 85.336 1.00 0.00 H new ATOM 896 N LYS A 58 -63.148 19.109 86.372 1.00 0.00 N ATOM 897 CA LYS A 58 -64.585 19.154 86.033 1.00 0.00 C ATOM 898 C LYS A 58 -65.467 18.905 87.253 1.00 0.00 C ATOM 899 O LYS A 58 -65.188 18.009 88.043 1.00 0.00 O ATOM 900 CB LYS A 58 -64.901 18.139 84.921 1.00 0.00 C ATOM 901 CG LYS A 58 -64.119 18.446 83.635 1.00 0.00 C ATOM 902 CD LYS A 58 -64.432 17.492 82.472 1.00 0.00 C ATOM 903 CE LYS A 58 -64.164 16.003 82.750 1.00 0.00 C ATOM 904 NZ LYS A 58 -62.779 15.756 83.209 1.00 0.00 N ATOM 0 H LYS A 58 -62.870 18.259 86.863 1.00 0.00 H new ATOM 0 HA LYS A 58 -64.808 20.158 85.673 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -64.656 17.134 85.265 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -65.970 18.152 84.709 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -64.339 19.467 83.323 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -63.052 18.401 83.851 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -65.481 17.610 82.199 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -63.842 17.795 81.607 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -64.864 15.645 83.506 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -64.352 15.427 81.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -62.566 14.740 83.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -62.115 16.290 82.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -62.681 16.064 84.197 1.00 0.00 H new ATOM 918 N VAL A 59 -66.525 19.710 87.402 1.00 0.00 N ATOM 919 CA VAL A 59 -67.453 19.700 88.546 1.00 0.00 C ATOM 920 C VAL A 59 -68.270 18.400 88.601 1.00 0.00 C ATOM 921 O VAL A 59 -68.801 17.955 87.587 1.00 0.00 O ATOM 922 CB VAL A 59 -68.383 20.935 88.508 1.00 0.00 C ATOM 923 CG1 VAL A 59 -69.314 20.993 89.729 1.00 0.00 C ATOM 924 CG2 VAL A 59 -67.574 22.243 88.486 1.00 0.00 C ATOM 0 H VAL A 59 -66.770 20.413 86.705 1.00 0.00 H new ATOM 0 HA VAL A 59 -66.855 19.748 89.456 1.00 0.00 H new ATOM 0 HB VAL A 59 -68.973 20.834 87.597 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -69.949 21.876 89.661 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -69.937 20.099 89.754 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -68.717 21.045 90.640 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -68.256 23.093 88.459 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -66.955 22.303 89.381 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -66.937 22.262 87.602 1.00 0.00 H new ATOM 934 N VAL A 60 -68.393 17.818 89.802 1.00 0.00 N ATOM 935 CA VAL A 60 -69.092 16.547 90.072 1.00 0.00 C ATOM 936 C VAL A 60 -70.070 16.593 91.258 1.00 0.00 C ATOM 937 O VAL A 60 -70.865 15.662 91.415 1.00 0.00 O ATOM 938 CB VAL A 60 -68.085 15.393 90.283 1.00 0.00 C ATOM 939 CG1 VAL A 60 -67.259 15.114 89.023 1.00 0.00 C ATOM 940 CG2 VAL A 60 -67.131 15.639 91.462 1.00 0.00 C ATOM 0 H VAL A 60 -67.995 18.232 90.645 1.00 0.00 H new ATOM 0 HA VAL A 60 -69.694 16.369 89.181 1.00 0.00 H new ATOM 0 HB VAL A 60 -68.697 14.521 90.513 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -66.565 14.296 89.217 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -67.925 14.839 88.205 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -66.699 16.008 88.750 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -66.448 14.795 91.560 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -66.559 16.549 91.283 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -67.708 15.747 92.380 1.00 0.00 H new ATOM 950 N GLY A 61 -70.055 17.649 92.083 1.00 0.00 N ATOM 951 CA GLY A 61 -70.788 17.708 93.356 1.00 0.00 C ATOM 952 C GLY A 61 -71.940 18.714 93.423 1.00 0.00 C ATOM 953 O GLY A 61 -72.086 19.559 92.540 1.00 0.00 O ATOM 0 H GLY A 61 -69.526 18.498 91.882 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -71.186 16.716 93.569 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -70.079 17.945 94.150 1.00 0.00 H new ATOM 957 N ARG A 62 -72.728 18.643 94.508 1.00 0.00 N ATOM 958 CA ARG A 62 -73.819 19.582 94.844 1.00 0.00 C ATOM 959 C ARG A 62 -73.731 20.013 96.313 1.00 0.00 C ATOM 960 O ARG A 62 -73.647 19.163 97.194 1.00 0.00 O ATOM 961 CB ARG A 62 -75.191 18.927 94.581 1.00 0.00 C ATOM 962 CG ARG A 62 -75.500 18.678 93.092 1.00 0.00 C ATOM 963 CD ARG A 62 -76.022 17.258 92.811 1.00 0.00 C ATOM 964 NE ARG A 62 -75.033 16.216 93.142 1.00 0.00 N ATOM 965 CZ ARG A 62 -73.901 15.918 92.528 1.00 0.00 C ATOM 966 NH1 ARG A 62 -73.491 16.507 91.434 1.00 0.00 N ATOM 967 NH2 ARG A 62 -73.122 15.010 93.045 1.00 0.00 N ATOM 0 H ARG A 62 -72.622 17.904 95.203 1.00 0.00 H new ATOM 0 HA ARG A 62 -73.713 20.463 94.210 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -75.235 17.977 95.113 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -75.971 19.563 95.000 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -76.240 19.404 92.755 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -74.597 18.849 92.507 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -76.931 17.088 93.388 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -76.293 17.176 91.758 1.00 0.00 H new ATOM 0 HE ARG A 62 -75.253 15.646 93.959 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -74.056 17.242 91.008 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -72.606 16.232 91.007 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -73.389 14.541 93.911 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -72.245 14.768 92.584 1.00 0.00 H new ATOM 981 N ILE A 63 -73.760 21.318 96.596 1.00 0.00 N ATOM 982 CA ILE A 63 -73.830 21.835 97.972 1.00 0.00 C ATOM 983 C ILE A 63 -75.281 21.751 98.465 1.00 0.00 C ATOM 984 O ILE A 63 -76.177 22.284 97.813 1.00 0.00 O ATOM 985 CB ILE A 63 -73.297 23.284 98.100 1.00 0.00 C ATOM 986 CG1 ILE A 63 -72.034 23.593 97.256 1.00 0.00 C ATOM 987 CG2 ILE A 63 -72.977 23.520 99.585 1.00 0.00 C ATOM 988 CD1 ILE A 63 -72.366 24.185 95.879 1.00 0.00 C ATOM 0 H ILE A 63 -73.736 22.047 95.883 1.00 0.00 H new ATOM 0 HA ILE A 63 -73.182 21.216 98.593 1.00 0.00 H new ATOM 0 HB ILE A 63 -74.071 23.948 97.714 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -71.400 24.291 97.803 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -71.459 22.677 97.123 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -72.597 24.533 99.719 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -73.883 23.391 100.177 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -72.224 22.804 99.913 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -71.442 24.380 95.335 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -72.976 23.478 95.317 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -72.916 25.117 96.007 1.00 0.00 H new ATOM 1000 N ILE A 64 -75.520 21.075 99.596 1.00 0.00 N ATOM 1001 CA ILE A 64 -76.870 20.843 100.136 1.00 0.00 C ATOM 1002 C ILE A 64 -77.227 21.880 101.204 1.00 0.00 C ATOM 1003 O ILE A 64 -78.356 22.365 101.235 1.00 0.00 O ATOM 1004 CB ILE A 64 -76.983 19.398 100.671 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -76.631 18.351 99.589 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -78.369 19.101 101.269 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -77.355 18.483 98.241 1.00 0.00 C ATOM 0 H ILE A 64 -74.778 20.670 100.167 1.00 0.00 H new ATOM 0 HA ILE A 64 -77.595 20.962 99.331 1.00 0.00 H new ATOM 0 HB ILE A 64 -76.250 19.318 101.474 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -75.558 18.399 99.405 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -76.841 17.361 99.993 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -78.397 18.073 101.631 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -78.561 19.782 102.098 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -79.132 19.237 100.503 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -77.022 17.691 97.570 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -78.431 18.398 98.396 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -77.127 19.453 97.799 1.00 0.00 H new ATOM 1019 N SER A 65 -76.255 22.288 102.026 1.00 0.00 N ATOM 1020 CA SER A 65 -76.369 23.328 103.062 1.00 0.00 C ATOM 1021 C SER A 65 -76.554 24.767 102.515 1.00 0.00 C ATOM 1022 O SER A 65 -76.068 25.728 103.121 1.00 0.00 O ATOM 1023 CB SER A 65 -75.142 23.200 103.969 1.00 0.00 C ATOM 1024 OG SER A 65 -75.106 24.203 104.956 1.00 0.00 O ATOM 0 H SER A 65 -75.319 21.884 101.988 1.00 0.00 H new ATOM 0 HA SER A 65 -77.288 23.161 103.624 1.00 0.00 H new ATOM 0 HB2 SER A 65 -75.146 22.221 104.448 1.00 0.00 H new ATOM 0 HB3 SER A 65 -74.237 23.255 103.364 1.00 0.00 H new ATOM 0 HG SER A 65 -75.176 25.083 104.531 1.00 0.00 H new ATOM 1030 N SER A 66 -77.277 24.928 101.400 1.00 0.00 N ATOM 1031 CA SER A 66 -77.497 26.180 100.665 1.00 0.00 C ATOM 1032 C SER A 66 -76.194 26.859 100.196 1.00 0.00 C ATOM 1033 O SER A 66 -75.120 26.259 100.214 1.00 0.00 O ATOM 1034 CB SER A 66 -78.414 27.101 101.488 1.00 0.00 C ATOM 1035 OG SER A 66 -78.933 28.144 100.682 1.00 0.00 O ATOM 0 H SER A 66 -77.753 24.140 100.960 1.00 0.00 H new ATOM 0 HA SER A 66 -78.006 25.942 99.731 1.00 0.00 H new ATOM 0 HB2 SER A 66 -79.234 26.521 101.912 1.00 0.00 H new ATOM 0 HB3 SER A 66 -77.857 27.524 102.324 1.00 0.00 H new ATOM 0 HG SER A 66 -79.515 28.717 101.224 1.00 0.00 H new ATOM 1041 N THR A 67 -76.306 28.093 99.696 1.00 0.00 N ATOM 1042 CA THR A 67 -75.223 28.932 99.165 1.00 0.00 C ATOM 1043 C THR A 67 -74.203 29.287 100.266 1.00 0.00 C ATOM 1044 O THR A 67 -74.549 30.088 101.141 1.00 0.00 O ATOM 1045 CB THR A 67 -75.785 30.228 98.552 1.00 0.00 C ATOM 1046 OG1 THR A 67 -76.469 30.959 99.543 1.00 0.00 O ATOM 1047 CG2 THR A 67 -76.731 29.963 97.378 1.00 0.00 C ATOM 0 H THR A 67 -77.210 28.563 99.647 1.00 0.00 H new ATOM 0 HA THR A 67 -74.718 28.358 98.388 1.00 0.00 H new ATOM 0 HB THR A 67 -74.938 30.797 98.168 1.00 0.00 H new ATOM 0 HG1 THR A 67 -76.008 30.856 100.402 1.00 0.00 H new ATOM 0 HG21 THR A 67 -77.097 30.911 96.985 1.00 0.00 H new ATOM 0 HG22 THR A 67 -76.196 29.427 96.594 1.00 0.00 H new ATOM 0 HG23 THR A 67 -77.574 29.362 97.719 1.00 0.00 H new ATOM 1055 N PRO A 68 -72.977 28.728 100.251 1.00 0.00 N ATOM 1056 CA PRO A 68 -71.963 28.932 101.290 1.00 0.00 C ATOM 1057 C PRO A 68 -71.605 30.389 101.583 1.00 0.00 C ATOM 1058 O PRO A 68 -71.471 31.197 100.664 1.00 0.00 O ATOM 1059 CB PRO A 68 -70.719 28.225 100.758 1.00 0.00 C ATOM 1060 CG PRO A 68 -71.305 27.084 99.949 1.00 0.00 C ATOM 1061 CD PRO A 68 -72.476 27.774 99.268 1.00 0.00 C ATOM 0 HA PRO A 68 -72.353 28.550 102.233 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -70.109 28.886 100.143 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -70.082 27.864 101.565 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -70.591 26.680 99.231 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -71.626 26.255 100.580 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -72.160 28.278 98.355 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -73.247 27.057 98.986 1.00 0.00 H new ATOM 1069 N LEU A 69 -71.340 30.703 102.856 1.00 0.00 N ATOM 1070 CA LEU A 69 -70.936 32.041 103.291 1.00 0.00 C ATOM 1071 C LEU A 69 -69.976 32.041 104.487 1.00 0.00 C ATOM 1072 O LEU A 69 -69.817 31.034 105.180 1.00 0.00 O ATOM 1073 CB LEU A 69 -72.202 32.873 103.562 1.00 0.00 C ATOM 1074 CG LEU A 69 -73.020 32.372 104.775 1.00 0.00 C ATOM 1075 CD1 LEU A 69 -72.952 33.377 105.929 1.00 0.00 C ATOM 1076 CD2 LEU A 69 -74.470 32.105 104.366 1.00 0.00 C ATOM 0 H LEU A 69 -71.401 30.028 103.619 1.00 0.00 H new ATOM 0 HA LEU A 69 -70.359 32.497 102.487 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -71.916 33.911 103.730 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -72.835 32.857 102.675 1.00 0.00 H new ATOM 0 HG LEU A 69 -72.585 31.435 105.122 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -73.535 33.004 106.771 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -71.914 33.509 106.236 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -73.359 34.334 105.602 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -75.033 31.753 105.230 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -74.918 33.026 103.992 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -74.494 31.346 103.584 1.00 0.00 H new ATOM 1088 N ALA A 70 -69.372 33.209 104.720 1.00 0.00 N ATOM 1089 CA ALA A 70 -68.557 33.547 105.882 1.00 0.00 C ATOM 1090 C ALA A 70 -68.794 35.025 106.219 1.00 0.00 C ATOM 1091 O ALA A 70 -68.593 35.883 105.365 1.00 0.00 O ATOM 1092 CB ALA A 70 -67.080 33.276 105.565 1.00 0.00 C ATOM 0 H ALA A 70 -69.445 33.986 104.063 1.00 0.00 H new ATOM 0 HA ALA A 70 -68.831 32.937 106.743 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -66.470 33.528 106.432 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -66.948 32.222 105.322 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -66.772 33.886 104.715 1.00 0.00 H new ATOM 1098 N GLU A 71 -69.247 35.341 107.435 1.00 0.00 N ATOM 1099 CA GLU A 71 -69.547 36.730 107.821 1.00 0.00 C ATOM 1100 C GLU A 71 -68.275 37.553 108.119 1.00 0.00 C ATOM 1101 O GLU A 71 -68.329 38.781 108.124 1.00 0.00 O ATOM 1102 CB GLU A 71 -70.498 36.746 109.030 1.00 0.00 C ATOM 1103 CG GLU A 71 -71.850 36.054 108.785 1.00 0.00 C ATOM 1104 CD GLU A 71 -72.765 36.831 107.832 1.00 0.00 C ATOM 1105 OE1 GLU A 71 -72.572 36.768 106.595 1.00 0.00 O ATOM 1106 OE2 GLU A 71 -73.743 37.455 108.308 1.00 0.00 O ATOM 0 H GLU A 71 -69.415 34.656 108.172 1.00 0.00 H new ATOM 0 HA GLU A 71 -70.033 37.205 106.969 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -70.003 36.262 109.872 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -70.681 37.781 109.319 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -71.672 35.059 108.376 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -72.360 35.920 109.739 1.00 0.00 H new ATOM 1113 N ASN A 72 -67.132 36.897 108.349 1.00 0.00 N ATOM 1114 CA ASN A 72 -65.795 37.453 108.577 1.00 0.00 C ATOM 1115 C ASN A 72 -64.740 36.338 108.410 1.00 0.00 C ATOM 1116 O ASN A 72 -65.087 35.157 108.411 1.00 0.00 O ATOM 1117 CB ASN A 72 -65.734 38.034 110.015 1.00 0.00 C ATOM 1118 CG ASN A 72 -65.590 39.548 110.070 1.00 0.00 C ATOM 1119 OD1 ASN A 72 -64.728 40.081 110.750 1.00 0.00 O ATOM 1120 ND2 ASN A 72 -66.452 40.286 109.403 1.00 0.00 N ATOM 0 H ASN A 72 -67.118 35.878 108.383 1.00 0.00 H new ATOM 0 HA ASN A 72 -65.589 38.244 107.856 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -66.639 37.747 110.550 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -64.895 37.581 110.543 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -66.400 41.303 109.454 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -67.172 39.841 108.835 1.00 0.00 H new ATOM 1127 N THR A 73 -63.447 36.694 108.384 1.00 0.00 N ATOM 1128 CA THR A 73 -62.320 35.756 108.577 1.00 0.00 C ATOM 1129 C THR A 73 -62.532 34.918 109.838 1.00 0.00 C ATOM 1130 O THR A 73 -62.490 33.697 109.787 1.00 0.00 O ATOM 1131 CB THR A 73 -60.973 36.503 108.577 1.00 0.00 C ATOM 1132 OG1 THR A 73 -60.619 36.754 107.231 1.00 0.00 O ATOM 1133 CG2 THR A 73 -59.805 35.779 109.250 1.00 0.00 C ATOM 0 H THR A 73 -63.145 37.656 108.226 1.00 0.00 H new ATOM 0 HA THR A 73 -62.288 35.064 107.736 1.00 0.00 H new ATOM 0 HB THR A 73 -61.134 37.405 109.168 1.00 0.00 H new ATOM 0 HG1 THR A 73 -59.690 36.481 107.081 1.00 0.00 H new ATOM 0 HG21 THR A 73 -58.910 36.398 109.190 1.00 0.00 H new ATOM 0 HG22 THR A 73 -60.047 35.592 110.296 1.00 0.00 H new ATOM 0 HG23 THR A 73 -59.625 34.830 108.744 1.00 0.00 H new ATOM 1141 N ASN A 74 -62.841 35.553 110.970 1.00 0.00 N ATOM 1142 CA ASN A 74 -63.103 34.874 112.239 1.00 0.00 C ATOM 1143 C ASN A 74 -64.388 34.011 112.263 1.00 0.00 C ATOM 1144 O ASN A 74 -64.638 33.357 113.274 1.00 0.00 O ATOM 1145 CB ASN A 74 -63.103 35.934 113.354 1.00 0.00 C ATOM 1146 CG ASN A 74 -61.779 36.683 113.419 1.00 0.00 C ATOM 1147 OD1 ASN A 74 -61.496 37.545 112.602 1.00 0.00 O ATOM 1148 ND2 ASN A 74 -60.921 36.361 114.366 1.00 0.00 N ATOM 0 H ASN A 74 -62.917 36.568 111.031 1.00 0.00 H new ATOM 0 HA ASN A 74 -62.307 34.146 112.395 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -63.914 36.642 113.183 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -63.297 35.453 114.313 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -60.018 36.832 114.418 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -61.160 35.640 115.047 1.00 0.00 H new ATOM 1155 N SER A 75 -65.203 33.985 111.196 1.00 0.00 N ATOM 1156 CA SER A 75 -66.388 33.124 111.114 1.00 0.00 C ATOM 1157 C SER A 75 -66.045 31.719 110.615 1.00 0.00 C ATOM 1158 O SER A 75 -65.242 31.547 109.696 1.00 0.00 O ATOM 1159 CB SER A 75 -67.432 33.715 110.163 1.00 0.00 C ATOM 1160 OG SER A 75 -67.800 35.017 110.566 1.00 0.00 O ATOM 0 H SER A 75 -65.057 34.561 110.367 1.00 0.00 H new ATOM 0 HA SER A 75 -66.786 33.062 112.127 1.00 0.00 H new ATOM 0 HB2 SER A 75 -67.032 33.743 109.149 1.00 0.00 H new ATOM 0 HB3 SER A 75 -68.313 33.074 110.140 1.00 0.00 H new ATOM 0 HG SER A 75 -68.652 34.982 111.048 1.00 0.00 H new ATOM 1166 N VAL A 76 -66.751 30.724 111.163 1.00 0.00 N ATOM 1167 CA VAL A 76 -66.756 29.336 110.691 1.00 0.00 C ATOM 1168 C VAL A 76 -68.133 28.957 110.147 1.00 0.00 C ATOM 1169 O VAL A 76 -69.150 29.462 110.625 1.00 0.00 O ATOM 1170 CB VAL A 76 -66.333 28.345 111.794 1.00 0.00 C ATOM 1171 CG1 VAL A 76 -64.835 28.448 112.088 1.00 0.00 C ATOM 1172 CG2 VAL A 76 -67.112 28.510 113.108 1.00 0.00 C ATOM 0 H VAL A 76 -67.354 30.868 111.973 1.00 0.00 H new ATOM 0 HA VAL A 76 -66.022 29.270 109.888 1.00 0.00 H new ATOM 0 HB VAL A 76 -66.571 27.360 111.394 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -64.568 27.737 112.870 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -64.270 28.222 111.184 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -64.598 29.459 112.420 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -66.759 27.779 113.835 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -66.956 29.515 113.500 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -68.175 28.353 112.923 1.00 0.00 H new ATOM 1182 N THR A 77 -68.163 28.027 109.185 1.00 0.00 N ATOM 1183 CA THR A 77 -69.397 27.573 108.526 1.00 0.00 C ATOM 1184 C THR A 77 -69.317 26.064 108.275 1.00 0.00 C ATOM 1185 O THR A 77 -68.451 25.615 107.524 1.00 0.00 O ATOM 1186 CB THR A 77 -69.663 28.340 107.206 1.00 0.00 C ATOM 1187 OG1 THR A 77 -69.408 29.722 107.344 1.00 0.00 O ATOM 1188 CG2 THR A 77 -71.120 28.204 106.763 1.00 0.00 C ATOM 0 H THR A 77 -67.324 27.563 108.838 1.00 0.00 H new ATOM 0 HA THR A 77 -70.237 27.785 109.188 1.00 0.00 H new ATOM 0 HB THR A 77 -68.992 27.899 106.469 1.00 0.00 H new ATOM 0 HG1 THR A 77 -69.501 30.160 106.472 1.00 0.00 H new ATOM 0 HG21 THR A 77 -71.271 28.754 105.834 1.00 0.00 H new ATOM 0 HG22 THR A 77 -71.355 27.152 106.604 1.00 0.00 H new ATOM 0 HG23 THR A 77 -71.774 28.609 107.535 1.00 0.00 H new ATOM 1196 N ASN A 78 -70.192 25.270 108.913 1.00 0.00 N ATOM 1197 CA ASN A 78 -70.325 23.830 108.655 1.00 0.00 C ATOM 1198 C ASN A 78 -71.337 23.548 107.532 1.00 0.00 C ATOM 1199 O ASN A 78 -72.491 23.968 107.611 1.00 0.00 O ATOM 1200 CB ASN A 78 -70.599 23.038 109.949 1.00 0.00 C ATOM 1201 CG ASN A 78 -71.746 23.518 110.833 1.00 0.00 C ATOM 1202 OD1 ASN A 78 -71.604 23.611 112.040 1.00 0.00 O ATOM 1203 ND2 ASN A 78 -72.907 23.814 110.290 1.00 0.00 N ATOM 0 H ASN A 78 -70.832 25.614 109.629 1.00 0.00 H new ATOM 0 HA ASN A 78 -69.365 23.465 108.288 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -70.795 22.001 109.675 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -69.688 23.043 110.547 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -73.682 24.119 110.878 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -73.032 23.738 109.281 1.00 0.00 H new ATOM 1210 N ILE A 79 -70.888 22.858 106.481 1.00 0.00 N ATOM 1211 CA ILE A 79 -71.552 22.794 105.177 1.00 0.00 C ATOM 1212 C ILE A 79 -71.717 21.332 104.749 1.00 0.00 C ATOM 1213 O ILE A 79 -70.735 20.649 104.454 1.00 0.00 O ATOM 1214 CB ILE A 79 -70.755 23.633 104.149 1.00 0.00 C ATOM 1215 CG1 ILE A 79 -70.714 25.112 104.608 1.00 0.00 C ATOM 1216 CG2 ILE A 79 -71.361 23.525 102.735 1.00 0.00 C ATOM 1217 CD1 ILE A 79 -69.866 26.024 103.726 1.00 0.00 C ATOM 0 H ILE A 79 -70.027 22.312 106.515 1.00 0.00 H new ATOM 0 HA ILE A 79 -72.552 23.222 105.239 1.00 0.00 H new ATOM 0 HB ILE A 79 -69.740 23.238 104.099 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -71.733 25.499 104.636 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -70.329 25.153 105.627 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -70.775 24.127 102.041 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -71.348 22.484 102.412 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -72.389 23.887 102.751 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -69.894 27.040 104.120 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -68.836 25.666 103.717 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -70.261 26.018 102.710 1.00 0.00 H new ATOM 1229 N GLU A 80 -72.969 20.867 104.721 1.00 0.00 N ATOM 1230 CA GLU A 80 -73.393 19.624 104.070 1.00 0.00 C ATOM 1231 C GLU A 80 -73.274 19.723 102.534 1.00 0.00 C ATOM 1232 O GLU A 80 -73.840 20.622 101.898 1.00 0.00 O ATOM 1233 CB GLU A 80 -74.832 19.275 104.492 1.00 0.00 C ATOM 1234 CG GLU A 80 -75.188 17.855 104.027 1.00 0.00 C ATOM 1235 CD GLU A 80 -76.623 17.403 104.328 1.00 0.00 C ATOM 1236 OE1 GLU A 80 -77.423 18.207 104.847 1.00 0.00 O ATOM 1237 OE2 GLU A 80 -76.904 16.223 103.992 1.00 0.00 O ATOM 0 H GLU A 80 -73.742 21.362 105.166 1.00 0.00 H new ATOM 0 HA GLU A 80 -72.729 18.823 104.394 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -74.929 19.346 105.575 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -75.530 19.993 104.061 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -75.023 17.792 102.951 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -74.498 17.154 104.497 1.00 0.00 H new ATOM 1244 N LEU A 81 -72.533 18.776 101.950 1.00 0.00 N ATOM 1245 CA LEU A 81 -72.032 18.771 100.577 1.00 0.00 C ATOM 1246 C LEU A 81 -72.119 17.344 99.987 1.00 0.00 C ATOM 1247 O LEU A 81 -71.910 16.370 100.703 1.00 0.00 O ATOM 1248 CB LEU A 81 -70.593 19.316 100.707 1.00 0.00 C ATOM 1249 CG LEU A 81 -69.751 19.409 99.431 1.00 0.00 C ATOM 1250 CD1 LEU A 81 -70.407 20.291 98.369 1.00 0.00 C ATOM 1251 CD2 LEU A 81 -68.382 20.005 99.759 1.00 0.00 C ATOM 0 H LEU A 81 -72.250 17.939 102.460 1.00 0.00 H new ATOM 0 HA LEU A 81 -72.608 19.383 99.883 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -70.650 20.312 101.145 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -70.058 18.685 101.417 1.00 0.00 H new ATOM 0 HG LEU A 81 -69.658 18.397 99.037 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -69.773 20.326 97.483 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -71.380 19.878 98.103 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -70.537 21.299 98.763 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -67.786 20.070 98.849 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -68.511 21.002 100.180 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -67.872 19.369 100.482 1.00 0.00 H new ATOM 1263 N GLU A 82 -72.446 17.193 98.697 1.00 0.00 N ATOM 1264 CA GLU A 82 -72.831 15.921 98.056 1.00 0.00 C ATOM 1265 C GLU A 82 -71.854 15.544 96.918 1.00 0.00 C ATOM 1266 O GLU A 82 -71.949 16.115 95.827 1.00 0.00 O ATOM 1267 CB GLU A 82 -74.297 16.030 97.584 1.00 0.00 C ATOM 1268 CG GLU A 82 -75.083 14.708 97.517 1.00 0.00 C ATOM 1269 CD GLU A 82 -74.925 13.895 96.228 1.00 0.00 C ATOM 1270 OE1 GLU A 82 -74.617 14.480 95.165 1.00 0.00 O ATOM 1271 OE2 GLU A 82 -75.133 12.662 96.317 1.00 0.00 O ATOM 0 H GLU A 82 -72.451 17.978 98.045 1.00 0.00 H new ATOM 0 HA GLU A 82 -72.764 15.105 98.775 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -74.824 16.710 98.253 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -74.307 16.486 96.594 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -74.777 14.084 98.356 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -76.141 14.930 97.655 1.00 0.00 H new ATOM 1278 N PRO A 83 -70.874 14.645 97.166 1.00 0.00 N ATOM 1279 CA PRO A 83 -69.968 14.102 96.148 1.00 0.00 C ATOM 1280 C PRO A 83 -70.593 12.973 95.306 1.00 0.00 C ATOM 1281 O PRO A 83 -71.627 12.424 95.680 1.00 0.00 O ATOM 1282 CB PRO A 83 -68.743 13.583 96.922 1.00 0.00 C ATOM 1283 CG PRO A 83 -69.124 13.588 98.403 1.00 0.00 C ATOM 1284 CD PRO A 83 -70.576 14.048 98.457 1.00 0.00 C ATOM 0 HA PRO A 83 -69.716 14.879 95.426 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -68.476 12.578 96.595 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -67.875 14.218 96.744 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -69.012 12.595 98.839 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -68.480 14.260 98.970 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -71.241 13.208 98.657 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -70.724 14.770 99.260 1.00 0.00 H new ATOM 1292 N PRO A 84 -69.945 12.556 94.198 1.00 0.00 N ATOM 1293 CA PRO A 84 -70.233 11.281 93.540 1.00 0.00 C ATOM 1294 C PRO A 84 -69.747 10.096 94.395 1.00 0.00 C ATOM 1295 O PRO A 84 -68.934 10.259 95.303 1.00 0.00 O ATOM 1296 CB PRO A 84 -69.472 11.351 92.211 1.00 0.00 C ATOM 1297 CG PRO A 84 -68.242 12.180 92.575 1.00 0.00 C ATOM 1298 CD PRO A 84 -68.811 13.208 93.554 1.00 0.00 C ATOM 0 HA PRO A 84 -71.302 11.125 93.394 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -69.200 10.360 91.847 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -70.064 11.826 91.429 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -67.464 11.570 93.034 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -67.800 12.655 91.699 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -68.062 13.506 94.288 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -69.124 14.113 93.033 1.00 0.00 H new ATOM 1306 N PHE A 85 -70.203 8.877 94.081 1.00 0.00 N ATOM 1307 CA PHE A 85 -69.738 7.642 94.725 1.00 0.00 C ATOM 1308 C PHE A 85 -68.312 7.260 94.280 1.00 0.00 C ATOM 1309 O PHE A 85 -68.117 6.317 93.517 1.00 0.00 O ATOM 1310 CB PHE A 85 -70.751 6.511 94.488 1.00 0.00 C ATOM 1311 CG PHE A 85 -72.075 6.717 95.200 1.00 0.00 C ATOM 1312 CD1 PHE A 85 -72.170 6.468 96.582 1.00 0.00 C ATOM 1313 CD2 PHE A 85 -73.215 7.140 94.486 1.00 0.00 C ATOM 1314 CE1 PHE A 85 -73.394 6.648 97.251 1.00 0.00 C ATOM 1315 CE2 PHE A 85 -74.442 7.306 95.154 1.00 0.00 C ATOM 1316 CZ PHE A 85 -74.530 7.065 96.536 1.00 0.00 C ATOM 0 H PHE A 85 -70.912 8.719 93.365 1.00 0.00 H new ATOM 0 HA PHE A 85 -69.676 7.816 95.799 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -70.935 6.419 93.418 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -70.314 5.569 94.819 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -71.300 6.138 97.130 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -73.146 7.337 93.426 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -73.461 6.466 98.313 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -75.317 7.619 94.604 1.00 0.00 H new ATOM 0 HZ PHE A 85 -75.471 7.200 97.049 1.00 0.00 H new ATOM 1326 N GLY A 86 -67.308 7.999 94.768 1.00 0.00 N ATOM 1327 CA GLY A 86 -65.895 7.747 94.493 1.00 0.00 C ATOM 1328 C GLY A 86 -64.955 8.811 95.066 1.00 0.00 C ATOM 1329 O GLY A 86 -65.368 9.714 95.804 1.00 0.00 O ATOM 0 H GLY A 86 -67.462 8.803 95.376 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -65.622 6.775 94.904 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -65.749 7.689 93.414 1.00 0.00 H new ATOM 1333 N ASP A 87 -63.670 8.684 94.716 1.00 0.00 N ATOM 1334 CA ASP A 87 -62.628 9.656 95.050 1.00 0.00 C ATOM 1335 C ASP A 87 -62.938 11.015 94.391 1.00 0.00 C ATOM 1336 O ASP A 87 -63.280 11.080 93.209 1.00 0.00 O ATOM 1337 CB ASP A 87 -61.246 9.109 94.657 1.00 0.00 C ATOM 1338 CG ASP A 87 -60.136 9.718 95.519 1.00 0.00 C ATOM 1339 OD1 ASP A 87 -60.088 9.355 96.712 1.00 0.00 O ATOM 1340 OD2 ASP A 87 -59.349 10.538 94.986 1.00 0.00 O ATOM 0 H ASP A 87 -63.321 7.887 94.183 1.00 0.00 H new ATOM 0 HA ASP A 87 -62.611 9.820 96.127 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -61.239 8.024 94.765 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -61.053 9.326 93.606 1.00 0.00 H new ATOM 1345 N SER A 88 -62.902 12.091 95.178 1.00 0.00 N ATOM 1346 CA SER A 88 -63.481 13.399 94.852 1.00 0.00 C ATOM 1347 C SER A 88 -62.630 14.536 95.429 1.00 0.00 C ATOM 1348 O SER A 88 -62.022 14.363 96.487 1.00 0.00 O ATOM 1349 CB SER A 88 -64.886 13.481 95.468 1.00 0.00 C ATOM 1350 OG SER A 88 -65.748 12.448 95.022 1.00 0.00 O ATOM 0 H SER A 88 -62.453 12.077 96.094 1.00 0.00 H new ATOM 0 HA SER A 88 -63.519 13.504 93.768 1.00 0.00 H new ATOM 0 HB2 SER A 88 -64.804 13.434 96.554 1.00 0.00 H new ATOM 0 HB3 SER A 88 -65.328 14.447 95.223 1.00 0.00 H new ATOM 0 HG SER A 88 -65.462 11.594 95.408 1.00 0.00 H new ATOM 1356 N TYR A 89 -62.620 15.714 94.782 1.00 0.00 N ATOM 1357 CA TYR A 89 -61.779 16.850 95.189 1.00 0.00 C ATOM 1358 C TYR A 89 -62.616 18.103 95.425 1.00 0.00 C ATOM 1359 O TYR A 89 -63.011 18.806 94.497 1.00 0.00 O ATOM 1360 CB TYR A 89 -60.599 17.040 94.226 1.00 0.00 C ATOM 1361 CG TYR A 89 -59.653 15.864 94.362 1.00 0.00 C ATOM 1362 CD1 TYR A 89 -59.942 14.678 93.665 1.00 0.00 C ATOM 1363 CD2 TYR A 89 -58.637 15.876 95.340 1.00 0.00 C ATOM 1364 CE1 TYR A 89 -59.300 13.480 94.017 1.00 0.00 C ATOM 1365 CE2 TYR A 89 -57.959 14.684 95.661 1.00 0.00 C ATOM 1366 CZ TYR A 89 -58.332 13.470 95.042 1.00 0.00 C ATOM 1367 OH TYR A 89 -57.756 12.300 95.413 1.00 0.00 O ATOM 0 H TYR A 89 -63.196 15.904 93.962 1.00 0.00 H new ATOM 0 HA TYR A 89 -61.326 16.627 96.155 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -60.959 17.116 93.200 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -60.077 17.970 94.450 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -60.659 14.688 92.857 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -58.379 16.797 95.842 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -59.548 12.564 93.501 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -57.154 14.698 96.381 1.00 0.00 H new ATOM 0 HH TYR A 89 -58.449 11.675 95.712 1.00 0.00 H new ATOM 1377 N ILE A 90 -62.918 18.339 96.702 1.00 0.00 N ATOM 1378 CA ILE A 90 -63.675 19.473 97.216 1.00 0.00 C ATOM 1379 C ILE A 90 -62.769 20.705 97.121 1.00 0.00 C ATOM 1380 O ILE A 90 -61.648 20.670 97.631 1.00 0.00 O ATOM 1381 CB ILE A 90 -64.124 19.188 98.671 1.00 0.00 C ATOM 1382 CG1 ILE A 90 -65.170 18.055 98.795 1.00 0.00 C ATOM 1383 CG2 ILE A 90 -64.732 20.456 99.296 1.00 0.00 C ATOM 1384 CD1 ILE A 90 -64.655 16.632 98.544 1.00 0.00 C ATOM 0 H ILE A 90 -62.622 17.706 97.445 1.00 0.00 H new ATOM 0 HA ILE A 90 -64.582 19.648 96.637 1.00 0.00 H new ATOM 0 HB ILE A 90 -63.222 18.870 99.194 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -65.600 18.093 99.796 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -65.979 18.256 98.093 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -65.044 20.244 100.319 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -63.987 21.252 99.302 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -65.596 20.772 98.711 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -65.475 15.923 98.658 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -64.254 16.563 97.533 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -63.869 16.397 99.262 1.00 0.00 H new ATOM 1396 N VAL A 91 -63.242 21.781 96.480 1.00 0.00 N ATOM 1397 CA VAL A 91 -62.494 23.038 96.326 1.00 0.00 C ATOM 1398 C VAL A 91 -63.242 24.157 97.056 1.00 0.00 C ATOM 1399 O VAL A 91 -64.430 24.354 96.805 1.00 0.00 O ATOM 1400 CB VAL A 91 -62.085 23.371 94.862 1.00 0.00 C ATOM 1401 CG1 VAL A 91 -62.072 22.149 93.929 1.00 0.00 C ATOM 1402 CG2 VAL A 91 -62.884 24.496 94.191 1.00 0.00 C ATOM 0 H VAL A 91 -64.166 21.805 96.048 1.00 0.00 H new ATOM 0 HA VAL A 91 -61.521 22.919 96.802 1.00 0.00 H new ATOM 0 HB VAL A 91 -61.066 23.733 94.998 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -61.778 22.460 92.927 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -61.361 21.413 94.304 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -63.068 21.707 93.894 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -62.518 24.646 93.175 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -63.939 24.224 94.160 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -62.763 25.418 94.760 1.00 0.00 H new ATOM 1412 N ILE A 92 -62.572 24.844 97.992 1.00 0.00 N ATOM 1413 CA ILE A 92 -63.145 25.917 98.828 1.00 0.00 C ATOM 1414 C ILE A 92 -62.247 27.163 98.740 1.00 0.00 C ATOM 1415 O ILE A 92 -61.195 27.230 99.380 1.00 0.00 O ATOM 1416 CB ILE A 92 -63.414 25.437 100.277 1.00 0.00 C ATOM 1417 CG1 ILE A 92 -64.296 24.167 100.269 1.00 0.00 C ATOM 1418 CG2 ILE A 92 -64.027 26.565 101.128 1.00 0.00 C ATOM 1419 CD1 ILE A 92 -64.649 23.598 101.646 1.00 0.00 C ATOM 0 H ILE A 92 -61.589 24.666 98.197 1.00 0.00 H new ATOM 0 HA ILE A 92 -64.127 26.196 98.445 1.00 0.00 H new ATOM 0 HB ILE A 92 -62.463 25.173 100.740 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -65.222 24.393 99.741 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -63.783 23.394 99.697 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -64.206 26.201 102.140 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -63.339 27.410 101.162 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -64.971 26.883 100.685 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -65.269 22.710 101.525 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -63.734 23.332 102.175 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -65.195 24.347 102.220 1.00 0.00 H new ATOM 1431 N GLY A 93 -62.646 28.113 97.887 1.00 0.00 N ATOM 1432 CA GLY A 93 -61.860 29.240 97.367 1.00 0.00 C ATOM 1433 C GLY A 93 -61.783 29.185 95.830 1.00 0.00 C ATOM 1434 O GLY A 93 -62.423 28.335 95.214 1.00 0.00 O ATOM 0 H GLY A 93 -63.595 28.115 97.514 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -62.312 30.181 97.680 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -60.855 29.214 97.788 1.00 0.00 H new ATOM 1438 N VAL A 94 -61.009 30.079 95.195 1.00 0.00 N ATOM 1439 CA VAL A 94 -60.788 30.059 93.728 1.00 0.00 C ATOM 1440 C VAL A 94 -59.379 29.550 93.402 1.00 0.00 C ATOM 1441 O VAL A 94 -58.530 29.536 94.282 1.00 0.00 O ATOM 1442 CB VAL A 94 -61.051 31.431 93.068 1.00 0.00 C ATOM 1443 CG1 VAL A 94 -62.442 31.978 93.414 1.00 0.00 C ATOM 1444 CG2 VAL A 94 -59.990 32.483 93.412 1.00 0.00 C ATOM 0 H VAL A 94 -60.519 30.834 95.674 1.00 0.00 H new ATOM 0 HA VAL A 94 -61.516 29.368 93.304 1.00 0.00 H new ATOM 0 HB VAL A 94 -60.997 31.242 91.996 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -62.584 32.944 92.929 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -63.204 31.281 93.065 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -62.527 32.098 94.494 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -60.235 33.422 92.916 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -59.967 32.637 94.491 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -59.013 32.138 93.074 1.00 0.00 H new ATOM 1454 N GLY A 95 -59.108 29.168 92.147 1.00 0.00 N ATOM 1455 CA GLY A 95 -57.858 28.567 91.639 1.00 0.00 C ATOM 1456 C GLY A 95 -56.635 28.558 92.577 1.00 0.00 C ATOM 1457 O GLY A 95 -56.275 27.510 93.106 1.00 0.00 O ATOM 0 H GLY A 95 -59.800 29.276 91.406 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -58.072 27.536 91.357 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -57.578 29.095 90.728 1.00 0.00 H new ATOM 1461 N ASN A 96 -55.987 29.716 92.772 1.00 0.00 N ATOM 1462 CA ASN A 96 -54.739 29.850 93.539 1.00 0.00 C ATOM 1463 C ASN A 96 -54.928 29.985 95.074 1.00 0.00 C ATOM 1464 O ASN A 96 -53.938 30.027 95.805 1.00 0.00 O ATOM 1465 CB ASN A 96 -53.948 31.040 92.948 1.00 0.00 C ATOM 1466 CG ASN A 96 -52.430 30.880 93.006 1.00 0.00 C ATOM 1467 OD1 ASN A 96 -51.742 31.026 92.011 1.00 0.00 O ATOM 1468 ND2 ASN A 96 -51.861 30.587 94.156 1.00 0.00 N ATOM 0 H ASN A 96 -56.322 30.602 92.394 1.00 0.00 H new ATOM 0 HA ASN A 96 -54.181 28.919 93.435 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -54.247 31.179 91.909 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -54.226 31.947 93.484 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -50.848 30.483 94.212 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -52.433 30.464 94.991 1.00 0.00 H new ATOM 1475 N SER A 97 -56.166 30.059 95.578 1.00 0.00 N ATOM 1476 CA SER A 97 -56.521 30.214 96.999 1.00 0.00 C ATOM 1477 C SER A 97 -57.433 29.100 97.542 1.00 0.00 C ATOM 1478 O SER A 97 -57.626 28.997 98.755 1.00 0.00 O ATOM 1479 CB SER A 97 -57.184 31.578 97.204 1.00 0.00 C ATOM 1480 OG SER A 97 -58.422 31.645 96.523 1.00 0.00 O ATOM 0 H SER A 97 -56.990 30.010 94.978 1.00 0.00 H new ATOM 0 HA SER A 97 -55.592 30.141 97.565 1.00 0.00 H new ATOM 0 HB2 SER A 97 -57.340 31.755 98.268 1.00 0.00 H new ATOM 0 HB3 SER A 97 -56.523 32.366 96.843 1.00 0.00 H new ATOM 0 HG SER A 97 -58.539 32.541 96.144 1.00 0.00 H new ATOM 1486 N ALA A 98 -57.969 28.256 96.656 1.00 0.00 N ATOM 1487 CA ALA A 98 -58.831 27.125 96.950 1.00 0.00 C ATOM 1488 C ALA A 98 -58.148 26.076 97.831 1.00 0.00 C ATOM 1489 O ALA A 98 -57.203 25.407 97.400 1.00 0.00 O ATOM 1490 CB ALA A 98 -59.306 26.499 95.633 1.00 0.00 C ATOM 0 H ALA A 98 -57.798 28.357 95.656 1.00 0.00 H new ATOM 0 HA ALA A 98 -59.685 27.493 97.518 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -59.954 25.649 95.847 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -59.859 27.240 95.056 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -58.443 26.162 95.058 1.00 0.00 H new ATOM 1496 N LEU A 99 -58.715 25.846 99.021 1.00 0.00 N ATOM 1497 CA LEU A 99 -58.565 24.576 99.727 1.00 0.00 C ATOM 1498 C LEU A 99 -59.058 23.463 98.799 1.00 0.00 C ATOM 1499 O LEU A 99 -60.263 23.264 98.679 1.00 0.00 O ATOM 1500 CB LEU A 99 -59.428 24.554 100.994 1.00 0.00 C ATOM 1501 CG LEU A 99 -59.088 25.546 102.105 1.00 0.00 C ATOM 1502 CD1 LEU A 99 -60.306 25.596 103.027 1.00 0.00 C ATOM 1503 CD2 LEU A 99 -57.855 25.086 102.887 1.00 0.00 C ATOM 0 H LEU A 99 -59.286 26.532 99.516 1.00 0.00 H new ATOM 0 HA LEU A 99 -57.520 24.441 100.005 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -60.463 24.725 100.697 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -59.379 23.550 101.415 1.00 0.00 H new ATOM 0 HG LEU A 99 -58.859 26.528 101.691 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -60.116 26.293 103.843 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -61.177 25.927 102.462 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -60.494 24.603 103.435 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -57.632 25.808 103.673 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -58.051 24.112 103.335 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -57.003 25.010 102.211 1.00 0.00 H new ATOM 1515 N THR A 100 -58.144 22.787 98.106 1.00 0.00 N ATOM 1516 CA THR A 100 -58.453 21.677 97.202 1.00 0.00 C ATOM 1517 C THR A 100 -58.140 20.379 97.937 1.00 0.00 C ATOM 1518 O THR A 100 -56.980 19.971 97.987 1.00 0.00 O ATOM 1519 CB THR A 100 -57.675 21.814 95.885 1.00 0.00 C ATOM 1520 OG1 THR A 100 -57.988 23.059 95.297 1.00 0.00 O ATOM 1521 CG2 THR A 100 -58.044 20.711 94.889 1.00 0.00 C ATOM 0 H THR A 100 -57.147 22.998 98.157 1.00 0.00 H new ATOM 0 HA THR A 100 -59.507 21.682 96.926 1.00 0.00 H new ATOM 0 HB THR A 100 -56.612 21.735 96.114 1.00 0.00 H new ATOM 0 HG1 THR A 100 -57.495 23.157 94.456 1.00 0.00 H new ATOM 0 HG21 THR A 100 -57.472 20.844 93.971 1.00 0.00 H new ATOM 0 HG22 THR A 100 -57.814 19.738 95.322 1.00 0.00 H new ATOM 0 HG23 THR A 100 -59.109 20.765 94.664 1.00 0.00 H new ATOM 1529 N LEU A 101 -59.155 19.765 98.557 1.00 0.00 N ATOM 1530 CA LEU A 101 -58.984 18.632 99.468 1.00 0.00 C ATOM 1531 C LEU A 101 -59.791 17.388 99.066 1.00 0.00 C ATOM 1532 O LEU A 101 -60.807 17.447 98.374 1.00 0.00 O ATOM 1533 CB LEU A 101 -59.217 19.063 100.930 1.00 0.00 C ATOM 1534 CG LEU A 101 -60.666 19.459 101.294 1.00 0.00 C ATOM 1535 CD1 LEU A 101 -61.000 18.960 102.696 1.00 0.00 C ATOM 1536 CD2 LEU A 101 -60.877 20.975 101.298 1.00 0.00 C ATOM 0 H LEU A 101 -60.128 20.046 98.437 1.00 0.00 H new ATOM 0 HA LEU A 101 -57.945 18.313 99.384 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -58.909 18.246 101.583 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -58.564 19.908 101.148 1.00 0.00 H new ATOM 0 HG LEU A 101 -61.307 19.009 100.536 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -62.022 19.241 102.948 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -60.904 17.875 102.728 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -60.313 19.407 103.415 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -61.911 21.198 101.560 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -60.211 21.433 102.029 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -60.659 21.375 100.308 1.00 0.00 H new ATOM 1548 N HIS A 102 -59.275 16.244 99.508 1.00 0.00 N ATOM 1549 CA HIS A 102 -59.654 14.886 99.134 1.00 0.00 C ATOM 1550 C HIS A 102 -60.862 14.335 99.901 1.00 0.00 C ATOM 1551 O HIS A 102 -60.914 14.412 101.124 1.00 0.00 O ATOM 1552 CB HIS A 102 -58.429 13.986 99.398 1.00 0.00 C ATOM 1553 CG HIS A 102 -57.668 14.225 100.695 1.00 0.00 C ATOM 1554 ND1 HIS A 102 -58.115 14.820 101.865 1.00 0.00 N ATOM 1555 CD2 HIS A 102 -56.341 13.937 100.879 1.00 0.00 C ATOM 1556 CE1 HIS A 102 -57.077 14.888 102.713 1.00 0.00 C ATOM 1557 NE2 HIS A 102 -55.973 14.372 102.155 1.00 0.00 N ATOM 0 H HIS A 102 -58.519 16.244 100.193 1.00 0.00 H new ATOM 0 HA HIS A 102 -59.954 14.899 98.086 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -58.761 12.948 99.385 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -57.733 14.108 98.568 1.00 0.00 H new ATOM 0 HD1 HIS A 102 -59.063 15.148 102.048 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -55.692 13.457 100.162 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -57.125 15.302 103.709 1.00 0.00 H new ATOM 1565 N TRP A 103 -61.767 13.649 99.199 1.00 0.00 N ATOM 1566 CA TRP A 103 -62.760 12.749 99.792 1.00 0.00 C ATOM 1567 C TRP A 103 -62.842 11.433 99.019 1.00 0.00 C ATOM 1568 O TRP A 103 -62.577 11.413 97.824 1.00 0.00 O ATOM 1569 CB TRP A 103 -64.133 13.425 99.821 1.00 0.00 C ATOM 1570 CG TRP A 103 -65.165 12.723 100.651 1.00 0.00 C ATOM 1571 CD1 TRP A 103 -66.345 12.216 100.217 1.00 0.00 C ATOM 1572 CD2 TRP A 103 -65.097 12.416 102.074 1.00 0.00 C ATOM 1573 NE1 TRP A 103 -67.024 11.652 101.286 1.00 0.00 N ATOM 1574 CE2 TRP A 103 -66.302 11.763 102.447 1.00 0.00 C ATOM 1575 CE3 TRP A 103 -64.138 12.606 103.090 1.00 0.00 C ATOM 1576 CZ2 TRP A 103 -66.563 11.355 103.757 1.00 0.00 C ATOM 1577 CZ3 TRP A 103 -64.391 12.191 104.410 1.00 0.00 C ATOM 1578 CH2 TRP A 103 -65.610 11.586 104.755 1.00 0.00 C ATOM 0 H TRP A 103 -61.832 13.704 98.183 1.00 0.00 H new ATOM 0 HA TRP A 103 -62.448 12.526 100.812 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -64.014 14.441 100.198 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -64.503 13.506 98.799 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -66.701 12.247 99.198 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -67.942 11.212 101.218 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -63.196 13.077 102.851 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -67.494 10.864 103.998 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -63.637 12.340 105.169 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -65.810 11.302 105.778 1.00 0.00 H new ATOM 1589 N PHE A 104 -63.309 10.367 99.677 1.00 0.00 N ATOM 1590 CA PHE A 104 -63.795 9.150 99.029 1.00 0.00 C ATOM 1591 C PHE A 104 -65.165 8.815 99.618 1.00 0.00 C ATOM 1592 O PHE A 104 -65.276 8.481 100.804 1.00 0.00 O ATOM 1593 CB PHE A 104 -62.802 7.989 99.180 1.00 0.00 C ATOM 1594 CG PHE A 104 -63.281 6.727 98.485 1.00 0.00 C ATOM 1595 CD1 PHE A 104 -64.183 5.862 99.133 1.00 0.00 C ATOM 1596 CD2 PHE A 104 -62.886 6.449 97.164 1.00 0.00 C ATOM 1597 CE1 PHE A 104 -64.711 4.747 98.460 1.00 0.00 C ATOM 1598 CE2 PHE A 104 -63.408 5.330 96.489 1.00 0.00 C ATOM 1599 CZ PHE A 104 -64.327 4.483 97.135 1.00 0.00 C ATOM 0 H PHE A 104 -63.360 10.328 100.695 1.00 0.00 H new ATOM 0 HA PHE A 104 -63.891 9.316 97.956 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -61.837 8.284 98.768 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -62.647 7.782 100.239 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -64.471 6.057 100.155 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -62.180 7.097 96.666 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -65.411 4.094 98.961 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -63.103 5.121 95.474 1.00 0.00 H new ATOM 0 HZ PHE A 104 -64.737 3.631 96.613 1.00 0.00 H new ATOM 1609 N ARG A 105 -66.220 8.953 98.809 1.00 0.00 N ATOM 1610 CA ARG A 105 -67.592 8.785 99.294 1.00 0.00 C ATOM 1611 C ARG A 105 -67.872 7.365 99.795 1.00 0.00 C ATOM 1612 O ARG A 105 -67.505 6.389 99.145 1.00 0.00 O ATOM 1613 CB ARG A 105 -68.573 9.255 98.225 1.00 0.00 C ATOM 1614 CG ARG A 105 -70.047 9.058 98.622 1.00 0.00 C ATOM 1615 CD ARG A 105 -70.927 10.161 98.035 1.00 0.00 C ATOM 1616 NE ARG A 105 -72.157 9.654 97.402 1.00 0.00 N ATOM 1617 CZ ARG A 105 -73.219 10.419 97.208 1.00 0.00 C ATOM 1618 NH1 ARG A 105 -73.542 11.396 98.008 1.00 0.00 N ATOM 1619 NH2 ARG A 105 -74.007 10.255 96.179 1.00 0.00 N ATOM 0 H ARG A 105 -66.150 9.180 97.817 1.00 0.00 H new ATOM 0 HA ARG A 105 -67.730 9.414 100.173 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -68.397 10.311 98.020 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -68.378 8.714 97.299 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -70.394 8.086 98.272 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -70.137 9.056 99.708 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -71.196 10.860 98.826 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -70.352 10.721 97.297 1.00 0.00 H new ATOM 0 HE ARG A 105 -72.191 8.679 97.103 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -72.966 11.598 98.825 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -74.371 11.959 97.817 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -73.811 9.521 95.498 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -74.818 10.861 96.056 1.00 0.00 H new ATOM 1633 N LYS A 106 -68.536 7.268 100.955 1.00 0.00 N ATOM 1634 CA LYS A 106 -68.835 6.029 101.693 1.00 0.00 C ATOM 1635 C LYS A 106 -67.588 5.187 102.020 1.00 0.00 C ATOM 1636 O LYS A 106 -67.682 3.971 102.166 1.00 0.00 O ATOM 1637 CB LYS A 106 -70.001 5.267 101.012 1.00 0.00 C ATOM 1638 CG LYS A 106 -71.375 5.929 101.254 1.00 0.00 C ATOM 1639 CD LYS A 106 -71.968 5.560 102.631 1.00 0.00 C ATOM 1640 CE LYS A 106 -73.110 6.495 103.071 1.00 0.00 C ATOM 1641 NZ LYS A 106 -72.617 7.545 103.994 1.00 0.00 N ATOM 0 H LYS A 106 -68.899 8.094 101.430 1.00 0.00 H new ATOM 0 HA LYS A 106 -69.191 6.298 102.687 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -69.814 5.211 99.940 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -70.026 4.243 101.385 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -71.272 7.012 101.184 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -72.067 5.623 100.469 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -72.339 4.536 102.597 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -71.176 5.587 103.379 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -73.561 6.960 102.194 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -73.891 5.914 103.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -73.416 8.129 104.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -72.163 7.099 104.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -71.926 8.145 103.500 1.00 0.00 H new