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 96 ASN : amide:sc= 1.03 K(o=2.2,f=-0.43) USER MOD Set 1.2: A 97 SER OG : rot 10:sc= 1.15 USER MOD Set 2.1: A 55 ASN : amide:sc= 1.17 K(o=3.5,f=2.2) USER MOD Set 2.2: A 58 LYS NZ :NH3+ -151:sc= 2.33 (180deg=-0.526) USER MOD Set 3.1: A 27 THR OG1 : rot -132:sc= 1.17 USER MOD Set 3.2: A 31 THR OG1 : rot -144:sc= 2.03 USER MOD Single : A 13 MET CE :methyl -156:sc= -0.0415 (180deg=-0.268) USER MOD Single : A 15 SER OG : rot 180:sc= 0.0146 USER MOD Single : A 17 LYS NZ :NH3+ -172:sc= 0.578! (180deg=0.503) USER MOD Single : A 19 SER OG : rot -74:sc= 0.418 USER MOD Single : A 22 LYS NZ :NH3+ 151:sc= 2.4 (180deg=0.751) USER MOD Single : A 24 MET CE :methyl -163:sc= -0.37 (180deg=-0.816) USER MOD Single : A 28 GLN : amide:sc= 0.233 K(o=0.23,f=-4.3!) USER MOD Single : A 29 HIS : no HE2:sc= 1.14 K(o=1.1,f=-4.2!) USER MOD Single : A 32 THR OG1 : rot 140:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -120:sc= 2.32 (180deg=-0.689) USER MOD Single : A 37 LYS NZ :NH3+ -173:sc= 1.26 (180deg=1.02) USER MOD Single : A 38 TYR OH : rot 165:sc= 0.136 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 176:sc= 3.05 (180deg=3.01) USER MOD Single : A 65 SER OG : rot -46:sc= 0.933 USER MOD Single : A 66 SER OG : rot -58:sc= 1.29 USER MOD Single : A 67 THR OG1 : rot 40:sc= 0.92 USER MOD Single : A 72 ASN : amide:sc= 1.21 K(o=1.2,f=-0.015) USER MOD Single : A 73 THR OG1 : rot -78:sc= 0.515 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 75 SER OG : rot -90:sc= -0.121 USER MOD Single : A 77 THR OG1 : rot -149:sc= 1.22 USER MOD Single : A 78 ASN : amide:sc= 0.733 K(o=0.73,f=-0.38) USER MOD Single : A 88 SER OG : rot -46:sc= 1.23 USER MOD Single : A 89 TYR OH : rot -17:sc= 1.05 USER MOD Single : A 100 THR OG1 : rot 68:sc= 1.25 USER MOD Single : A 102 HIS : no HE2:sc= -0.212 K(o=-0.21,f=-2.2) USER MOD Single : A 106 LYS NZ :NH3+ 171:sc= 1.25 (180deg=0.895) USER MOD ----------------------------------------------------------------- ATOM 211 N MET A 13 -68.376 37.021 95.596 1.00 0.00 N ATOM 212 CA MET A 13 -67.255 37.490 96.425 1.00 0.00 C ATOM 213 C MET A 13 -65.944 36.692 96.310 1.00 0.00 C ATOM 214 O MET A 13 -65.030 37.141 95.625 1.00 0.00 O ATOM 215 CB MET A 13 -67.721 37.609 97.890 1.00 0.00 C ATOM 216 CG MET A 13 -68.597 38.839 98.156 1.00 0.00 C ATOM 217 SD MET A 13 -67.812 40.454 97.898 1.00 0.00 S ATOM 218 CE MET A 13 -66.409 40.354 99.045 1.00 0.00 C ATOM 0 HA MET A 13 -66.982 38.466 96.024 1.00 0.00 H new ATOM 0 HB2 MET A 13 -68.277 36.711 98.160 1.00 0.00 H new ATOM 0 HB3 MET A 13 -66.846 37.649 98.539 1.00 0.00 H new ATOM 0 HG2 MET A 13 -69.476 38.779 97.514 1.00 0.00 H new ATOM 0 HG3 MET A 13 -68.951 38.791 99.186 1.00 0.00 H new ATOM 0 HE1 MET A 13 -66.095 41.360 99.324 1.00 0.00 H new ATOM 0 HE2 MET A 13 -66.708 39.806 99.939 1.00 0.00 H new ATOM 0 HE3 MET A 13 -65.580 39.836 98.562 1.00 0.00 H new ATOM 228 N CYS A 14 -65.774 35.619 97.095 1.00 0.00 N ATOM 229 CA CYS A 14 -64.476 35.375 97.735 1.00 0.00 C ATOM 230 C CYS A 14 -63.335 34.909 96.811 1.00 0.00 C ATOM 231 O CYS A 14 -63.203 33.726 96.496 1.00 0.00 O ATOM 232 CB CYS A 14 -64.643 34.458 98.949 1.00 0.00 C ATOM 233 SG CYS A 14 -64.111 35.236 100.493 1.00 0.00 S ATOM 0 H CYS A 14 -66.495 34.926 97.298 1.00 0.00 H new ATOM 0 HA CYS A 14 -64.138 36.359 98.060 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -65.689 34.165 99.037 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -64.069 33.545 98.791 1.00 0.00 H new ATOM 238 N SER A 15 -62.464 35.855 96.442 1.00 0.00 N ATOM 239 CA SER A 15 -61.218 35.645 95.702 1.00 0.00 C ATOM 240 C SER A 15 -60.039 35.133 96.551 1.00 0.00 C ATOM 241 O SER A 15 -59.017 34.747 95.981 1.00 0.00 O ATOM 242 CB SER A 15 -60.820 36.966 95.035 1.00 0.00 C ATOM 243 OG SER A 15 -60.715 37.987 96.010 1.00 0.00 O ATOM 0 H SER A 15 -62.619 36.838 96.664 1.00 0.00 H new ATOM 0 HA SER A 15 -61.422 34.858 94.976 1.00 0.00 H new ATOM 0 HB2 SER A 15 -59.869 36.849 94.515 1.00 0.00 H new ATOM 0 HB3 SER A 15 -61.561 37.242 94.285 1.00 0.00 H new ATOM 0 HG SER A 15 -60.459 38.828 95.577 1.00 0.00 H new ATOM 249 N GLY A 16 -60.156 35.131 97.888 1.00 0.00 N ATOM 250 CA GLY A 16 -59.073 34.834 98.835 1.00 0.00 C ATOM 251 C GLY A 16 -59.255 33.532 99.627 1.00 0.00 C ATOM 252 O GLY A 16 -60.295 32.878 99.555 1.00 0.00 O ATOM 0 H GLY A 16 -61.038 35.344 98.354 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -58.133 34.781 98.286 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -58.986 35.662 99.538 1.00 0.00 H new ATOM 256 N LYS A 17 -58.207 33.148 100.374 1.00 0.00 N ATOM 257 CA LYS A 17 -58.070 31.828 101.012 1.00 0.00 C ATOM 258 C LYS A 17 -58.967 31.632 102.239 1.00 0.00 C ATOM 259 O LYS A 17 -59.372 32.578 102.917 1.00 0.00 O ATOM 260 CB LYS A 17 -56.584 31.578 101.353 1.00 0.00 C ATOM 261 CG LYS A 17 -56.195 30.085 101.285 1.00 0.00 C ATOM 262 CD LYS A 17 -54.769 29.787 101.773 1.00 0.00 C ATOM 263 CE LYS A 17 -54.551 30.090 103.262 1.00 0.00 C ATOM 264 NZ LYS A 17 -55.279 29.175 104.175 1.00 0.00 N ATOM 0 H LYS A 17 -57.412 33.761 100.555 1.00 0.00 H new ATOM 0 HA LYS A 17 -58.417 31.086 100.293 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -55.958 32.143 100.663 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -56.377 31.957 102.354 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -56.901 29.509 101.884 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -56.295 29.741 100.256 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -54.543 28.737 101.588 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -54.063 30.373 101.185 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -53.485 30.034 103.482 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -54.865 31.114 103.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -55.195 29.520 105.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -56.283 29.141 103.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -54.871 28.221 104.109 1.00 0.00 H new ATOM 278 N PHE A 18 -59.188 30.358 102.551 1.00 0.00 N ATOM 279 CA PHE A 18 -59.908 29.820 103.700 1.00 0.00 C ATOM 280 C PHE A 18 -58.998 28.852 104.477 1.00 0.00 C ATOM 281 O PHE A 18 -57.931 28.469 103.988 1.00 0.00 O ATOM 282 CB PHE A 18 -61.174 29.115 103.173 1.00 0.00 C ATOM 283 CG PHE A 18 -62.220 30.055 102.606 1.00 0.00 C ATOM 284 CD1 PHE A 18 -62.087 30.549 101.294 1.00 0.00 C ATOM 285 CD2 PHE A 18 -63.313 30.457 103.397 1.00 0.00 C ATOM 286 CE1 PHE A 18 -63.007 31.485 100.797 1.00 0.00 C ATOM 287 CE2 PHE A 18 -64.236 31.391 102.899 1.00 0.00 C ATOM 288 CZ PHE A 18 -64.071 31.916 101.606 1.00 0.00 C ATOM 0 H PHE A 18 -58.836 29.610 101.953 1.00 0.00 H new ATOM 0 HA PHE A 18 -60.199 30.612 104.390 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -60.884 28.403 102.400 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -61.620 28.540 103.984 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -61.275 30.207 100.669 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -63.442 30.047 104.388 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -62.897 31.873 99.795 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -65.071 31.705 103.508 1.00 0.00 H new ATOM 0 HZ PHE A 18 -64.765 32.654 101.233 1.00 0.00 H new ATOM 298 N SER A 19 -59.451 28.409 105.652 1.00 0.00 N ATOM 299 CA SER A 19 -58.900 27.290 106.420 1.00 0.00 C ATOM 300 C SER A 19 -59.883 26.117 106.400 1.00 0.00 C ATOM 301 O SER A 19 -61.094 26.316 106.546 1.00 0.00 O ATOM 302 CB SER A 19 -58.647 27.657 107.892 1.00 0.00 C ATOM 303 OG SER A 19 -58.274 29.001 108.102 1.00 0.00 O ATOM 0 H SER A 19 -60.250 28.841 106.116 1.00 0.00 H new ATOM 0 HA SER A 19 -57.951 27.027 105.953 1.00 0.00 H new ATOM 0 HB2 SER A 19 -59.550 27.450 108.466 1.00 0.00 H new ATOM 0 HB3 SER A 19 -57.863 27.010 108.286 1.00 0.00 H new ATOM 0 HG SER A 19 -57.349 29.134 107.808 1.00 0.00 H new ATOM 309 N ILE A 20 -59.358 24.894 106.263 1.00 0.00 N ATOM 310 CA ILE A 20 -60.095 23.661 106.548 1.00 0.00 C ATOM 311 C ILE A 20 -60.233 23.529 108.072 1.00 0.00 C ATOM 312 O ILE A 20 -59.281 23.206 108.779 1.00 0.00 O ATOM 313 CB ILE A 20 -59.462 22.439 105.836 1.00 0.00 C ATOM 314 CG1 ILE A 20 -60.221 21.128 106.140 1.00 0.00 C ATOM 315 CG2 ILE A 20 -57.960 22.235 106.113 1.00 0.00 C ATOM 316 CD1 ILE A 20 -61.677 21.152 105.659 1.00 0.00 C ATOM 0 H ILE A 20 -58.401 24.733 105.948 1.00 0.00 H new ATOM 0 HA ILE A 20 -61.102 23.701 106.134 1.00 0.00 H new ATOM 0 HB ILE A 20 -59.557 22.682 104.778 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -59.701 20.296 105.666 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -60.202 20.945 107.214 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -57.606 21.357 105.573 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -57.406 23.113 105.781 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -57.803 22.091 107.182 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -62.156 20.203 105.902 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -62.210 21.964 106.153 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -61.701 21.305 104.580 1.00 0.00 H new ATOM 328 N ASP A 21 -61.411 23.880 108.586 1.00 0.00 N ATOM 329 CA ASP A 21 -61.671 24.131 110.004 1.00 0.00 C ATOM 330 C ASP A 21 -62.375 22.937 110.687 1.00 0.00 C ATOM 331 O ASP A 21 -62.443 22.869 111.915 1.00 0.00 O ATOM 332 CB ASP A 21 -62.442 25.459 110.076 1.00 0.00 C ATOM 333 CG ASP A 21 -62.506 26.078 111.470 1.00 0.00 C ATOM 334 OD1 ASP A 21 -61.566 26.833 111.814 1.00 0.00 O ATOM 335 OD2 ASP A 21 -63.524 25.840 112.159 1.00 0.00 O ATOM 0 H ASP A 21 -62.241 24.002 108.006 1.00 0.00 H new ATOM 0 HA ASP A 21 -60.747 24.226 110.574 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -61.976 26.173 109.396 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -63.458 25.295 109.718 1.00 0.00 H new ATOM 340 N LYS A 22 -62.837 21.949 109.905 1.00 0.00 N ATOM 341 CA LYS A 22 -62.952 20.537 110.303 1.00 0.00 C ATOM 342 C LYS A 22 -62.867 19.633 109.067 1.00 0.00 C ATOM 343 O LYS A 22 -63.427 19.968 108.024 1.00 0.00 O ATOM 344 CB LYS A 22 -64.266 20.264 111.062 1.00 0.00 C ATOM 345 CG LYS A 22 -64.207 18.938 111.837 1.00 0.00 C ATOM 346 CD LYS A 22 -65.536 18.521 112.485 1.00 0.00 C ATOM 347 CE LYS A 22 -66.647 18.111 111.503 1.00 0.00 C ATOM 348 NZ LYS A 22 -66.250 16.979 110.634 1.00 0.00 N ATOM 0 H LYS A 22 -63.151 22.116 108.949 1.00 0.00 H new ATOM 0 HA LYS A 22 -62.124 20.315 110.976 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -64.464 21.082 111.754 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -65.096 20.237 110.356 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -63.885 18.149 111.158 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -63.448 19.019 112.615 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -65.346 17.687 113.161 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -65.900 19.349 113.094 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -67.540 17.837 112.064 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -66.911 18.966 110.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -67.094 16.433 110.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -65.790 17.345 109.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -65.587 16.363 111.147 1.00 0.00 H new ATOM 362 N GLU A 23 -62.225 18.474 109.240 1.00 0.00 N ATOM 363 CA GLU A 23 -62.224 17.313 108.338 1.00 0.00 C ATOM 364 C GLU A 23 -63.630 16.842 107.928 1.00 0.00 C ATOM 365 O GLU A 23 -64.636 17.236 108.520 1.00 0.00 O ATOM 366 CB GLU A 23 -61.418 16.173 109.000 1.00 0.00 C ATOM 367 CG GLU A 23 -61.783 15.804 110.458 1.00 0.00 C ATOM 368 CD GLU A 23 -63.123 15.072 110.626 1.00 0.00 C ATOM 369 OE1 GLU A 23 -63.206 13.911 110.168 1.00 0.00 O ATOM 370 OE2 GLU A 23 -64.059 15.651 111.223 1.00 0.00 O ATOM 0 H GLU A 23 -61.653 18.308 110.068 1.00 0.00 H new ATOM 0 HA GLU A 23 -61.751 17.619 107.405 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -61.531 15.279 108.387 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -60.363 16.446 108.974 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -60.990 15.178 110.868 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -61.808 16.717 111.053 1.00 0.00 H new ATOM 377 N MET A 24 -63.706 15.982 106.910 1.00 0.00 N ATOM 378 CA MET A 24 -64.971 15.508 106.345 1.00 0.00 C ATOM 379 C MET A 24 -65.508 14.240 107.017 1.00 0.00 C ATOM 380 O MET A 24 -64.783 13.267 107.234 1.00 0.00 O ATOM 381 CB MET A 24 -64.775 15.284 104.846 1.00 0.00 C ATOM 382 CG MET A 24 -64.770 16.643 104.156 1.00 0.00 C ATOM 383 SD MET A 24 -64.619 16.569 102.363 1.00 0.00 S ATOM 384 CE MET A 24 -62.844 16.240 102.256 1.00 0.00 C ATOM 0 H MET A 24 -62.883 15.591 106.450 1.00 0.00 H new ATOM 0 HA MET A 24 -65.726 16.273 106.529 1.00 0.00 H new ATOM 0 HB2 MET A 24 -63.838 14.760 104.660 1.00 0.00 H new ATOM 0 HB3 MET A 24 -65.574 14.659 104.448 1.00 0.00 H new ATOM 0 HG2 MET A 24 -65.691 17.168 104.409 1.00 0.00 H new ATOM 0 HG3 MET A 24 -63.946 17.235 104.553 1.00 0.00 H new ATOM 0 HE1 MET A 24 -62.494 16.455 101.246 1.00 0.00 H new ATOM 0 HE2 MET A 24 -62.313 16.873 102.967 1.00 0.00 H new ATOM 0 HE3 MET A 24 -62.653 15.193 102.490 1.00 0.00 H new ATOM 394 N ALA A 25 -66.817 14.239 107.282 1.00 0.00 N ATOM 395 CA ALA A 25 -67.570 13.123 107.849 1.00 0.00 C ATOM 396 C ALA A 25 -68.919 12.983 107.126 1.00 0.00 C ATOM 397 O ALA A 25 -69.617 13.983 106.931 1.00 0.00 O ATOM 398 CB ALA A 25 -67.753 13.369 109.352 1.00 0.00 C ATOM 0 H ALA A 25 -67.404 15.053 107.098 1.00 0.00 H new ATOM 0 HA ALA A 25 -67.029 12.187 107.713 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -68.314 12.544 109.790 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -66.776 13.439 109.831 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -68.299 14.300 109.504 1.00 0.00 H new ATOM 404 N GLU A 26 -69.263 11.755 106.712 1.00 0.00 N ATOM 405 CA GLU A 26 -70.491 11.465 105.964 1.00 0.00 C ATOM 406 C GLU A 26 -71.728 11.308 106.871 1.00 0.00 C ATOM 407 O GLU A 26 -71.616 11.000 108.057 1.00 0.00 O ATOM 408 CB GLU A 26 -70.301 10.225 105.059 1.00 0.00 C ATOM 409 CG GLU A 26 -70.818 10.510 103.637 1.00 0.00 C ATOM 410 CD GLU A 26 -70.535 9.389 102.638 1.00 0.00 C ATOM 411 OE1 GLU A 26 -69.376 9.295 102.163 1.00 0.00 O ATOM 412 OE2 GLU A 26 -71.498 8.658 102.304 1.00 0.00 O ATOM 0 H GLU A 26 -68.691 10.929 106.889 1.00 0.00 H new ATOM 0 HA GLU A 26 -70.685 12.333 105.333 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -69.246 9.954 105.021 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -70.834 9.374 105.482 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -71.894 10.682 103.680 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -70.362 11.431 103.273 1.00 0.00 H new ATOM 419 N THR A 27 -72.917 11.486 106.288 1.00 0.00 N ATOM 420 CA THR A 27 -74.226 11.459 106.955 1.00 0.00 C ATOM 421 C THR A 27 -75.050 10.225 106.550 1.00 0.00 C ATOM 422 O THR A 27 -74.732 9.534 105.580 1.00 0.00 O ATOM 423 CB THR A 27 -75.015 12.732 106.594 1.00 0.00 C ATOM 424 OG1 THR A 27 -75.324 12.685 105.221 1.00 0.00 O ATOM 425 CG2 THR A 27 -74.281 14.040 106.901 1.00 0.00 C ATOM 0 H THR A 27 -72.999 11.662 105.287 1.00 0.00 H new ATOM 0 HA THR A 27 -74.049 11.411 108.029 1.00 0.00 H new ATOM 0 HB THR A 27 -75.908 12.738 107.219 1.00 0.00 H new ATOM 0 HG1 THR A 27 -75.102 13.545 104.806 1.00 0.00 H new ATOM 0 HG21 THR A 27 -74.908 14.885 106.616 1.00 0.00 H new ATOM 0 HG22 THR A 27 -74.063 14.093 107.968 1.00 0.00 H new ATOM 0 HG23 THR A 27 -73.348 14.075 106.338 1.00 0.00 H new ATOM 433 N GLN A 28 -76.179 9.982 107.232 1.00 0.00 N ATOM 434 CA GLN A 28 -77.197 9.017 106.781 1.00 0.00 C ATOM 435 C GLN A 28 -77.874 9.438 105.459 1.00 0.00 C ATOM 436 O GLN A 28 -78.263 8.580 104.673 1.00 0.00 O ATOM 437 CB GLN A 28 -78.232 8.718 107.890 1.00 0.00 C ATOM 438 CG GLN A 28 -78.672 9.883 108.800 1.00 0.00 C ATOM 439 CD GLN A 28 -79.122 11.123 108.038 1.00 0.00 C ATOM 440 OE1 GLN A 28 -78.316 11.982 107.711 1.00 0.00 O ATOM 441 NE2 GLN A 28 -80.389 11.245 107.698 1.00 0.00 N ATOM 0 H GLN A 28 -76.413 10.447 108.109 1.00 0.00 H new ATOM 0 HA GLN A 28 -76.669 8.087 106.569 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -79.124 8.310 107.414 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -77.823 7.933 108.526 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -79.488 9.545 109.439 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -77.844 10.152 109.456 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -81.062 10.528 107.971 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -80.697 12.056 107.162 1.00 0.00 H new ATOM 450 N HIS A 29 -77.940 10.744 105.175 1.00 0.00 N ATOM 451 CA HIS A 29 -78.296 11.329 103.879 1.00 0.00 C ATOM 452 C HIS A 29 -77.222 11.057 102.799 1.00 0.00 C ATOM 453 O HIS A 29 -77.462 11.272 101.614 1.00 0.00 O ATOM 454 CB HIS A 29 -78.549 12.833 104.127 1.00 0.00 C ATOM 455 CG HIS A 29 -78.994 13.677 102.958 1.00 0.00 C ATOM 456 ND1 HIS A 29 -78.754 15.030 102.822 1.00 0.00 N ATOM 457 CD2 HIS A 29 -79.763 13.285 101.894 1.00 0.00 C ATOM 458 CE1 HIS A 29 -79.361 15.434 101.693 1.00 0.00 C ATOM 459 NE2 HIS A 29 -79.987 14.408 101.094 1.00 0.00 N ATOM 0 H HIS A 29 -77.737 11.455 105.877 1.00 0.00 H new ATOM 0 HA HIS A 29 -79.196 10.865 103.476 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -79.303 12.921 104.909 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -77.630 13.266 104.521 1.00 0.00 H new ATOM 0 HD1 HIS A 29 -78.215 15.615 103.461 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -80.130 12.287 101.707 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -79.347 16.447 101.318 1.00 0.00 H new ATOM 467 N GLY A 30 -76.040 10.548 103.181 1.00 0.00 N ATOM 468 CA GLY A 30 -74.925 10.237 102.291 1.00 0.00 C ATOM 469 C GLY A 30 -74.161 11.466 101.796 1.00 0.00 C ATOM 470 O GLY A 30 -73.289 11.326 100.937 1.00 0.00 O ATOM 0 H GLY A 30 -75.833 10.336 104.157 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -74.232 9.577 102.812 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -75.304 9.687 101.430 1.00 0.00 H new ATOM 474 N THR A 31 -74.510 12.654 102.282 1.00 0.00 N ATOM 475 CA THR A 31 -73.747 13.899 102.168 1.00 0.00 C ATOM 476 C THR A 31 -72.548 13.874 103.114 1.00 0.00 C ATOM 477 O THR A 31 -72.498 13.064 104.034 1.00 0.00 O ATOM 478 CB THR A 31 -74.651 15.086 102.541 1.00 0.00 C ATOM 479 OG1 THR A 31 -75.312 14.841 103.773 1.00 0.00 O ATOM 480 CG2 THR A 31 -75.692 15.316 101.449 1.00 0.00 C ATOM 0 H THR A 31 -75.382 12.784 102.795 1.00 0.00 H new ATOM 0 HA THR A 31 -73.394 14.002 101.142 1.00 0.00 H new ATOM 0 HB THR A 31 -74.025 15.973 102.642 1.00 0.00 H new ATOM 0 HG1 THR A 31 -76.216 15.218 103.740 1.00 0.00 H new ATOM 0 HG21 THR A 31 -76.327 16.159 101.723 1.00 0.00 H new ATOM 0 HG22 THR A 31 -75.189 15.532 100.506 1.00 0.00 H new ATOM 0 HG23 THR A 31 -76.305 14.422 101.336 1.00 0.00 H new ATOM 488 N THR A 32 -71.600 14.792 102.937 1.00 0.00 N ATOM 489 CA THR A 32 -70.497 15.035 103.869 1.00 0.00 C ATOM 490 C THR A 32 -70.558 16.467 104.394 1.00 0.00 C ATOM 491 O THR A 32 -71.092 17.356 103.727 1.00 0.00 O ATOM 492 CB THR A 32 -69.151 14.673 103.220 1.00 0.00 C ATOM 493 OG1 THR A 32 -68.145 14.645 104.201 1.00 0.00 O ATOM 494 CG2 THR A 32 -68.696 15.627 102.113 1.00 0.00 C ATOM 0 H THR A 32 -71.576 15.404 102.121 1.00 0.00 H new ATOM 0 HA THR A 32 -70.597 14.383 104.737 1.00 0.00 H new ATOM 0 HB THR A 32 -69.311 13.698 102.759 1.00 0.00 H new ATOM 0 HG1 THR A 32 -67.544 13.890 104.032 1.00 0.00 H new ATOM 0 HG21 THR A 32 -67.738 15.292 101.715 1.00 0.00 H new ATOM 0 HG22 THR A 32 -69.437 15.637 101.314 1.00 0.00 H new ATOM 0 HG23 THR A 32 -68.588 16.632 102.521 1.00 0.00 H new ATOM 502 N VAL A 33 -70.026 16.687 105.602 1.00 0.00 N ATOM 503 CA VAL A 33 -70.081 17.978 106.302 1.00 0.00 C ATOM 504 C VAL A 33 -68.670 18.545 106.458 1.00 0.00 C ATOM 505 O VAL A 33 -67.845 17.980 107.178 1.00 0.00 O ATOM 506 CB VAL A 33 -70.825 17.866 107.648 1.00 0.00 C ATOM 507 CG1 VAL A 33 -70.920 19.239 108.333 1.00 0.00 C ATOM 508 CG2 VAL A 33 -72.256 17.341 107.452 1.00 0.00 C ATOM 0 H VAL A 33 -69.538 15.963 106.129 1.00 0.00 H new ATOM 0 HA VAL A 33 -70.659 18.679 105.699 1.00 0.00 H new ATOM 0 HB VAL A 33 -70.257 17.171 108.266 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -71.449 19.137 109.281 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -69.917 19.624 108.516 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -71.462 19.931 107.688 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -72.754 17.273 108.419 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -72.809 18.023 106.806 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -72.221 16.354 106.992 1.00 0.00 H new ATOM 518 N VAL A 34 -68.407 19.664 105.772 1.00 0.00 N ATOM 519 CA VAL A 34 -67.096 20.328 105.687 1.00 0.00 C ATOM 520 C VAL A 34 -67.163 21.673 106.414 1.00 0.00 C ATOM 521 O VAL A 34 -67.930 22.546 106.006 1.00 0.00 O ATOM 522 CB VAL A 34 -66.645 20.548 104.218 1.00 0.00 C ATOM 523 CG1 VAL A 34 -65.111 20.540 104.162 1.00 0.00 C ATOM 524 CG2 VAL A 34 -67.200 19.530 103.208 1.00 0.00 C ATOM 0 H VAL A 34 -69.127 20.152 105.240 1.00 0.00 H new ATOM 0 HA VAL A 34 -66.360 19.677 106.160 1.00 0.00 H new ATOM 0 HB VAL A 34 -67.059 21.510 103.917 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -64.784 20.694 103.134 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -64.720 21.340 104.791 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -64.739 19.581 104.522 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -66.829 19.767 102.211 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -66.876 18.527 103.487 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -68.289 19.573 103.209 1.00 0.00 H new ATOM 534 N LYS A 35 -66.392 21.864 107.497 1.00 0.00 N ATOM 535 CA LYS A 35 -66.347 23.158 108.201 1.00 0.00 C ATOM 536 C LYS A 35 -65.225 24.031 107.647 1.00 0.00 C ATOM 537 O LYS A 35 -64.052 23.666 107.718 1.00 0.00 O ATOM 538 CB LYS A 35 -66.314 22.978 109.728 1.00 0.00 C ATOM 539 CG LYS A 35 -66.422 24.317 110.481 1.00 0.00 C ATOM 540 CD LYS A 35 -66.885 24.179 111.943 1.00 0.00 C ATOM 541 CE LYS A 35 -66.061 23.228 112.825 1.00 0.00 C ATOM 542 NZ LYS A 35 -64.709 23.744 113.147 1.00 0.00 N ATOM 0 H LYS A 35 -65.794 21.144 107.903 1.00 0.00 H new ATOM 0 HA LYS A 35 -67.274 23.698 108.007 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -67.133 22.327 110.032 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -65.388 22.479 110.012 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -65.451 24.811 110.464 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -67.119 24.965 109.950 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -66.874 25.168 112.401 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -67.920 23.838 111.945 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -66.602 23.045 113.753 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -65.964 22.268 112.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -63.991 23.083 112.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -64.577 24.675 112.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -64.609 23.837 114.178 1.00 0.00 H new ATOM 556 N VAL A 36 -65.605 25.178 107.079 1.00 0.00 N ATOM 557 CA VAL A 36 -64.686 26.208 106.576 1.00 0.00 C ATOM 558 C VAL A 36 -64.490 27.303 107.629 1.00 0.00 C ATOM 559 O VAL A 36 -65.357 27.507 108.480 1.00 0.00 O ATOM 560 CB VAL A 36 -65.181 26.821 105.238 1.00 0.00 C ATOM 561 CG1 VAL A 36 -65.844 25.775 104.330 1.00 0.00 C ATOM 562 CG2 VAL A 36 -66.167 27.986 105.401 1.00 0.00 C ATOM 0 H VAL A 36 -66.586 25.425 106.952 1.00 0.00 H new ATOM 0 HA VAL A 36 -63.727 25.728 106.379 1.00 0.00 H new ATOM 0 HB VAL A 36 -64.268 27.204 104.783 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -66.174 26.251 103.407 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -65.126 24.989 104.096 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -66.703 25.342 104.842 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -66.461 28.354 104.418 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -67.050 27.642 105.939 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -65.691 28.790 105.962 1.00 0.00 H new ATOM 572 N LYS A 37 -63.399 28.065 107.496 1.00 0.00 N ATOM 573 CA LYS A 37 -63.146 29.359 108.151 1.00 0.00 C ATOM 574 C LYS A 37 -62.444 30.276 107.145 1.00 0.00 C ATOM 575 O LYS A 37 -61.748 29.761 106.275 1.00 0.00 O ATOM 576 CB LYS A 37 -62.282 29.085 109.387 1.00 0.00 C ATOM 577 CG LYS A 37 -62.054 30.297 110.302 1.00 0.00 C ATOM 578 CD LYS A 37 -60.589 30.751 110.396 1.00 0.00 C ATOM 579 CE LYS A 37 -59.600 29.676 110.877 1.00 0.00 C ATOM 580 NZ LYS A 37 -60.036 28.979 112.111 1.00 0.00 N ATOM 0 H LYS A 37 -62.624 27.782 106.896 1.00 0.00 H new ATOM 0 HA LYS A 37 -64.063 29.854 108.470 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -62.750 28.292 109.970 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -61.313 28.710 109.058 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -62.658 31.129 109.940 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -62.412 30.055 111.303 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -60.270 31.102 109.414 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -60.532 31.603 111.073 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -59.461 28.941 110.084 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -58.630 30.140 111.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -59.274 28.355 112.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -60.257 29.680 112.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -60.884 28.412 111.908 1.00 0.00 H new ATOM 594 N TYR A 38 -62.611 31.600 107.210 1.00 0.00 N ATOM 595 CA TYR A 38 -62.051 32.502 106.188 1.00 0.00 C ATOM 596 C TYR A 38 -60.724 33.147 106.619 1.00 0.00 C ATOM 597 O TYR A 38 -60.508 33.417 107.799 1.00 0.00 O ATOM 598 CB TYR A 38 -63.104 33.553 105.796 1.00 0.00 C ATOM 599 CG TYR A 38 -62.646 34.525 104.721 1.00 0.00 C ATOM 600 CD1 TYR A 38 -62.089 34.041 103.520 1.00 0.00 C ATOM 601 CD2 TYR A 38 -62.755 35.915 104.925 1.00 0.00 C ATOM 602 CE1 TYR A 38 -61.623 34.933 102.540 1.00 0.00 C ATOM 603 CE2 TYR A 38 -62.327 36.812 103.929 1.00 0.00 C ATOM 604 CZ TYR A 38 -61.764 36.320 102.733 1.00 0.00 C ATOM 605 OH TYR A 38 -61.371 37.184 101.760 1.00 0.00 O ATOM 0 H TYR A 38 -63.125 32.073 107.953 1.00 0.00 H new ATOM 0 HA TYR A 38 -61.806 31.903 105.311 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -64.000 33.040 105.448 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -63.385 34.118 106.685 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -62.020 32.976 103.352 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -63.168 36.293 105.848 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -61.158 34.556 101.641 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -62.429 37.876 104.080 1.00 0.00 H new ATOM 0 HH TYR A 38 -61.748 38.071 101.938 1.00 0.00 H new ATOM 615 N GLU A 39 -59.850 33.469 105.659 1.00 0.00 N ATOM 616 CA GLU A 39 -58.574 34.158 105.890 1.00 0.00 C ATOM 617 C GLU A 39 -58.438 35.385 104.975 1.00 0.00 C ATOM 618 O GLU A 39 -58.389 36.508 105.471 1.00 0.00 O ATOM 619 CB GLU A 39 -57.400 33.178 105.701 1.00 0.00 C ATOM 620 CG GLU A 39 -57.350 32.075 106.769 1.00 0.00 C ATOM 621 CD GLU A 39 -56.336 30.986 106.406 1.00 0.00 C ATOM 622 OE1 GLU A 39 -55.244 31.294 105.888 1.00 0.00 O ATOM 623 OE2 GLU A 39 -56.666 29.782 106.537 1.00 0.00 O ATOM 0 H GLU A 39 -60.014 33.253 104.676 1.00 0.00 H new ATOM 0 HA GLU A 39 -58.552 34.518 106.918 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -57.476 32.717 104.716 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -56.464 33.736 105.721 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -57.087 32.512 107.732 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -58.339 31.630 106.880 1.00 0.00 H new ATOM 630 N GLY A 40 -58.391 35.152 103.653 1.00 0.00 N ATOM 631 CA GLY A 40 -58.060 36.066 102.551 1.00 0.00 C ATOM 632 C GLY A 40 -57.887 37.548 102.901 1.00 0.00 C ATOM 633 O GLY A 40 -56.773 38.064 102.863 1.00 0.00 O ATOM 0 H GLY A 40 -58.607 34.222 103.294 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -57.137 35.718 102.088 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -58.844 35.986 101.798 1.00 0.00 H new ATOM 637 N ALA A 41 -58.999 38.227 103.193 1.00 0.00 N ATOM 638 CA ALA A 41 -59.070 39.659 103.486 1.00 0.00 C ATOM 639 C ALA A 41 -59.941 39.992 104.718 1.00 0.00 C ATOM 640 O ALA A 41 -60.402 41.125 104.853 1.00 0.00 O ATOM 641 CB ALA A 41 -59.552 40.374 102.214 1.00 0.00 C ATOM 0 H ALA A 41 -59.912 37.774 103.233 1.00 0.00 H new ATOM 0 HA ALA A 41 -58.078 40.015 103.762 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -59.615 41.446 102.401 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -58.848 40.188 101.403 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -60.535 39.996 101.934 1.00 0.00 H new ATOM 647 N GLY A 42 -60.221 39.021 105.601 1.00 0.00 N ATOM 648 CA GLY A 42 -60.978 39.217 106.851 1.00 0.00 C ATOM 649 C GLY A 42 -62.496 39.431 106.710 1.00 0.00 C ATOM 650 O GLY A 42 -63.266 38.864 107.482 1.00 0.00 O ATOM 0 H GLY A 42 -59.922 38.056 105.464 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -60.814 38.348 107.489 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -60.559 40.078 107.372 1.00 0.00 H new ATOM 654 N ALA A 43 -62.909 40.258 105.744 1.00 0.00 N ATOM 655 CA ALA A 43 -64.273 40.704 105.439 1.00 0.00 C ATOM 656 C ALA A 43 -65.269 39.562 105.091 1.00 0.00 C ATOM 657 O ALA A 43 -64.839 38.445 104.801 1.00 0.00 O ATOM 658 CB ALA A 43 -64.118 41.699 104.275 1.00 0.00 C ATOM 0 H ALA A 43 -62.236 40.670 105.097 1.00 0.00 H new ATOM 0 HA ALA A 43 -64.720 41.154 106.325 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -65.099 42.079 103.988 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -63.485 42.529 104.588 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -63.661 41.195 103.424 1.00 0.00 H new ATOM 664 N PRO A 44 -66.600 39.813 105.084 1.00 0.00 N ATOM 665 CA PRO A 44 -67.596 38.795 104.728 1.00 0.00 C ATOM 666 C PRO A 44 -67.557 38.379 103.251 1.00 0.00 C ATOM 667 O PRO A 44 -67.154 39.150 102.380 1.00 0.00 O ATOM 668 CB PRO A 44 -68.964 39.407 105.057 1.00 0.00 C ATOM 669 CG PRO A 44 -68.706 40.909 104.973 1.00 0.00 C ATOM 670 CD PRO A 44 -67.279 41.034 105.499 1.00 0.00 C ATOM 0 HA PRO A 44 -67.388 37.884 105.289 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -69.728 39.090 104.347 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -69.308 39.113 106.048 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -68.795 41.279 103.951 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -69.412 41.476 105.580 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -66.786 41.915 105.089 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -67.269 41.139 106.584 1.00 0.00 H new ATOM 678 N CYS A 45 -68.072 37.177 102.969 1.00 0.00 N ATOM 679 CA CYS A 45 -68.185 36.599 101.629 1.00 0.00 C ATOM 680 C CYS A 45 -69.365 35.617 101.522 1.00 0.00 C ATOM 681 O CYS A 45 -69.702 34.964 102.511 1.00 0.00 O ATOM 682 CB CYS A 45 -66.898 35.807 101.348 1.00 0.00 C ATOM 683 SG CYS A 45 -65.444 36.736 100.816 1.00 0.00 S ATOM 0 H CYS A 45 -68.434 36.559 103.695 1.00 0.00 H new ATOM 0 HA CYS A 45 -68.343 37.411 100.919 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -66.635 35.261 102.254 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -67.121 35.064 100.582 1.00 0.00 H new ATOM 688 N LYS A 46 -69.875 35.378 100.298 1.00 0.00 N ATOM 689 CA LYS A 46 -70.284 34.015 99.907 1.00 0.00 C ATOM 690 C LYS A 46 -69.039 33.222 99.499 1.00 0.00 C ATOM 691 O LYS A 46 -68.156 33.773 98.834 1.00 0.00 O ATOM 692 CB LYS A 46 -71.381 33.963 98.827 1.00 0.00 C ATOM 693 CG LYS A 46 -71.010 34.500 97.433 1.00 0.00 C ATOM 694 CD LYS A 46 -71.269 33.525 96.268 1.00 0.00 C ATOM 695 CE LYS A 46 -72.705 32.991 96.099 1.00 0.00 C ATOM 696 NZ LYS A 46 -73.732 34.059 96.082 1.00 0.00 N ATOM 0 H LYS A 46 -70.011 36.090 99.580 1.00 0.00 H new ATOM 0 HA LYS A 46 -70.752 33.554 100.777 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -71.701 32.927 98.718 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -72.241 34.526 99.190 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -71.572 35.416 97.252 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -69.954 34.769 97.433 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -70.983 34.023 95.342 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -70.603 32.670 96.389 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -72.767 32.423 95.171 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -72.925 32.298 96.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -74.674 33.633 95.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -73.699 34.587 96.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -73.545 34.708 95.291 1.00 0.00 H new ATOM 710 N VAL A 47 -68.951 31.958 99.917 1.00 0.00 N ATOM 711 CA VAL A 47 -67.732 31.148 99.753 1.00 0.00 C ATOM 712 C VAL A 47 -67.859 30.258 98.502 1.00 0.00 C ATOM 713 O VAL A 47 -68.837 29.516 98.396 1.00 0.00 O ATOM 714 CB VAL A 47 -67.273 30.409 101.042 1.00 0.00 C ATOM 715 CG1 VAL A 47 -67.990 30.845 102.329 1.00 0.00 C ATOM 716 CG2 VAL A 47 -67.240 28.882 100.996 1.00 0.00 C ATOM 0 H VAL A 47 -69.716 31.465 100.377 1.00 0.00 H new ATOM 0 HA VAL A 47 -66.899 31.829 99.579 1.00 0.00 H new ATOM 0 HB VAL A 47 -66.237 30.745 101.072 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -67.602 30.274 103.173 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -67.817 31.908 102.500 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -69.060 30.663 102.229 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -66.903 28.496 101.958 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -68.239 28.503 100.783 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -66.554 28.556 100.214 1.00 0.00 H new ATOM 726 N PRO A 48 -66.925 30.333 97.530 1.00 0.00 N ATOM 727 CA PRO A 48 -66.896 29.413 96.394 1.00 0.00 C ATOM 728 C PRO A 48 -66.662 27.979 96.884 1.00 0.00 C ATOM 729 O PRO A 48 -65.668 27.734 97.567 1.00 0.00 O ATOM 730 CB PRO A 48 -65.747 29.868 95.480 1.00 0.00 C ATOM 731 CG PRO A 48 -65.266 31.196 96.060 1.00 0.00 C ATOM 732 CD PRO A 48 -65.763 31.206 97.498 1.00 0.00 C ATOM 0 HA PRO A 48 -67.843 29.424 95.854 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -64.943 29.132 95.465 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -66.088 29.989 94.452 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -64.180 31.274 96.018 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -65.668 32.040 95.499 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -64.990 30.851 98.180 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -66.026 32.216 97.812 1.00 0.00 H new ATOM 740 N ILE A 49 -67.556 27.045 96.536 1.00 0.00 N ATOM 741 CA ILE A 49 -67.407 25.613 96.825 1.00 0.00 C ATOM 742 C ILE A 49 -67.712 24.799 95.569 1.00 0.00 C ATOM 743 O ILE A 49 -68.761 24.971 94.950 1.00 0.00 O ATOM 744 CB ILE A 49 -68.276 25.160 98.025 1.00 0.00 C ATOM 745 CG1 ILE A 49 -67.808 25.921 99.284 1.00 0.00 C ATOM 746 CG2 ILE A 49 -68.204 23.630 98.225 1.00 0.00 C ATOM 747 CD1 ILE A 49 -68.357 25.434 100.627 1.00 0.00 C ATOM 0 H ILE A 49 -68.418 27.267 96.037 1.00 0.00 H new ATOM 0 HA ILE A 49 -66.373 25.433 97.118 1.00 0.00 H new ATOM 0 HB ILE A 49 -69.322 25.396 97.829 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -66.720 25.874 99.325 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -68.078 26.971 99.167 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -68.824 23.345 99.075 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -68.565 23.128 97.327 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -67.172 23.336 98.415 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -67.953 26.050 101.430 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -69.444 25.509 100.624 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -68.065 24.396 100.784 1.00 0.00 H new ATOM 759 N GLU A 50 -66.815 23.866 95.247 1.00 0.00 N ATOM 760 CA GLU A 50 -67.027 22.800 94.270 1.00 0.00 C ATOM 761 C GLU A 50 -66.660 21.438 94.882 1.00 0.00 C ATOM 762 O GLU A 50 -65.945 21.360 95.884 1.00 0.00 O ATOM 763 CB GLU A 50 -66.153 23.012 93.018 1.00 0.00 C ATOM 764 CG GLU A 50 -66.210 24.392 92.343 1.00 0.00 C ATOM 765 CD GLU A 50 -65.154 24.469 91.232 1.00 0.00 C ATOM 766 OE1 GLU A 50 -65.125 23.559 90.376 1.00 0.00 O ATOM 767 OE2 GLU A 50 -64.290 25.374 91.255 1.00 0.00 O ATOM 0 H GLU A 50 -65.890 23.832 95.675 1.00 0.00 H new ATOM 0 HA GLU A 50 -68.080 22.821 93.988 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -65.117 22.813 93.292 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -66.436 22.263 92.278 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -67.203 24.563 91.927 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -66.034 25.176 93.080 1.00 0.00 H new ATOM 774 N ILE A 51 -67.039 20.360 94.189 1.00 0.00 N ATOM 775 CA ILE A 51 -66.277 19.110 94.181 1.00 0.00 C ATOM 776 C ILE A 51 -65.976 18.794 92.731 1.00 0.00 C ATOM 777 O ILE A 51 -66.896 18.764 91.910 1.00 0.00 O ATOM 778 CB ILE A 51 -67.012 17.925 94.839 1.00 0.00 C ATOM 779 CG1 ILE A 51 -67.386 18.277 96.287 1.00 0.00 C ATOM 780 CG2 ILE A 51 -66.119 16.670 94.787 1.00 0.00 C ATOM 781 CD1 ILE A 51 -67.954 17.131 97.132 1.00 0.00 C ATOM 0 H ILE A 51 -67.883 20.331 93.618 1.00 0.00 H new ATOM 0 HA ILE A 51 -65.374 19.250 94.775 1.00 0.00 H new ATOM 0 HB ILE A 51 -67.932 17.717 94.293 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -66.498 18.665 96.787 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -68.118 19.084 96.266 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -66.640 15.833 95.252 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -65.895 16.426 93.749 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -65.190 16.862 95.323 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -68.181 17.496 98.134 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -68.865 16.754 96.668 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -67.220 16.328 97.196 1.00 0.00 H new ATOM 793 N ARG A 52 -64.701 18.534 92.439 1.00 0.00 N ATOM 794 CA ARG A 52 -64.218 18.126 91.129 1.00 0.00 C ATOM 795 C ARG A 52 -63.748 16.671 91.117 1.00 0.00 C ATOM 796 O ARG A 52 -63.538 16.037 92.156 1.00 0.00 O ATOM 797 CB ARG A 52 -63.101 19.069 90.676 1.00 0.00 C ATOM 798 CG ARG A 52 -63.558 20.529 90.555 1.00 0.00 C ATOM 799 CD ARG A 52 -62.367 21.317 90.023 1.00 0.00 C ATOM 800 NE ARG A 52 -62.576 22.762 90.054 1.00 0.00 N ATOM 801 CZ ARG A 52 -61.642 23.682 89.887 1.00 0.00 C ATOM 802 NH1 ARG A 52 -60.409 23.366 89.546 1.00 0.00 N ATOM 803 NH2 ARG A 52 -61.942 24.943 90.074 1.00 0.00 N ATOM 0 H ARG A 52 -63.957 18.605 93.133 1.00 0.00 H new ATOM 0 HA ARG A 52 -65.049 18.191 90.426 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -62.275 19.011 91.385 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -62.719 18.733 89.712 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -64.410 20.613 89.881 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -63.877 20.916 91.523 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -61.484 21.071 90.612 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -62.163 21.007 88.998 1.00 0.00 H new ATOM 0 HE ARG A 52 -63.527 23.090 90.219 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -60.154 22.389 89.404 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -59.710 24.099 89.424 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -62.889 25.207 90.346 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -61.229 25.661 89.948 1.00 0.00 H new ATOM 817 N ASP A 53 -63.618 16.163 89.898 1.00 0.00 N ATOM 818 CA ASP A 53 -63.101 14.852 89.536 1.00 0.00 C ATOM 819 C ASP A 53 -61.649 14.617 89.993 1.00 0.00 C ATOM 820 O ASP A 53 -60.972 15.520 90.484 1.00 0.00 O ATOM 821 CB ASP A 53 -63.231 14.711 88.011 1.00 0.00 C ATOM 822 CG ASP A 53 -62.197 15.520 87.213 1.00 0.00 C ATOM 823 OD1 ASP A 53 -61.959 16.716 87.504 1.00 0.00 O ATOM 824 OD2 ASP A 53 -61.635 14.917 86.268 1.00 0.00 O ATOM 0 H ASP A 53 -63.893 16.699 89.075 1.00 0.00 H new ATOM 0 HA ASP A 53 -63.684 14.090 90.054 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -63.135 13.658 87.745 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -64.231 15.026 87.712 1.00 0.00 H new ATOM 829 N VAL A 54 -61.137 13.399 89.777 1.00 0.00 N ATOM 830 CA VAL A 54 -59.759 13.025 90.133 1.00 0.00 C ATOM 831 C VAL A 54 -58.697 13.938 89.502 1.00 0.00 C ATOM 832 O VAL A 54 -57.688 14.225 90.149 1.00 0.00 O ATOM 833 CB VAL A 54 -59.472 11.536 89.844 1.00 0.00 C ATOM 834 CG1 VAL A 54 -60.380 10.630 90.688 1.00 0.00 C ATOM 835 CG2 VAL A 54 -59.626 11.160 88.362 1.00 0.00 C ATOM 0 H VAL A 54 -61.668 12.641 89.349 1.00 0.00 H new ATOM 0 HA VAL A 54 -59.683 13.174 91.210 1.00 0.00 H new ATOM 0 HB VAL A 54 -58.428 11.381 90.115 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -60.159 9.586 90.467 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -60.203 10.822 91.746 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -61.423 10.838 90.451 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -59.410 10.100 88.231 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -60.647 11.365 88.039 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -58.931 11.749 87.763 1.00 0.00 H new ATOM 845 N ASN A 55 -58.957 14.453 88.290 1.00 0.00 N ATOM 846 CA ASN A 55 -58.106 15.406 87.566 1.00 0.00 C ATOM 847 C ASN A 55 -58.265 16.859 88.060 1.00 0.00 C ATOM 848 O ASN A 55 -57.469 17.718 87.687 1.00 0.00 O ATOM 849 CB ASN A 55 -58.401 15.326 86.057 1.00 0.00 C ATOM 850 CG ASN A 55 -58.454 13.904 85.522 1.00 0.00 C ATOM 851 OD1 ASN A 55 -57.446 13.282 85.233 1.00 0.00 O ATOM 852 ND2 ASN A 55 -59.641 13.343 85.396 1.00 0.00 N ATOM 0 H ASN A 55 -59.798 14.207 87.769 1.00 0.00 H new ATOM 0 HA ASN A 55 -57.073 15.121 87.763 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -59.353 15.817 85.855 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -57.635 15.881 85.516 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -59.719 12.385 85.056 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -60.481 13.867 85.639 1.00 0.00 H new ATOM 859 N LYS A 56 -59.243 17.122 88.942 1.00 0.00 N ATOM 860 CA LYS A 56 -59.463 18.378 89.679 1.00 0.00 C ATOM 861 C LYS A 56 -59.861 19.548 88.766 1.00 0.00 C ATOM 862 O LYS A 56 -59.584 20.715 89.060 1.00 0.00 O ATOM 863 CB LYS A 56 -58.290 18.668 90.648 1.00 0.00 C ATOM 864 CG LYS A 56 -57.744 17.373 91.279 1.00 0.00 C ATOM 865 CD LYS A 56 -56.825 17.555 92.490 1.00 0.00 C ATOM 866 CE LYS A 56 -55.961 16.299 92.716 1.00 0.00 C ATOM 867 NZ LYS A 56 -56.736 15.034 92.635 1.00 0.00 N ATOM 0 H LYS A 56 -59.945 16.420 89.174 1.00 0.00 H new ATOM 0 HA LYS A 56 -60.340 18.248 90.314 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -57.490 19.177 90.110 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -58.625 19.344 91.435 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -58.589 16.753 91.579 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -57.199 16.820 90.514 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -56.182 18.421 92.337 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -57.423 17.755 93.379 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -55.163 16.277 91.974 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -55.485 16.364 93.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -56.090 14.224 92.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -57.437 15.007 93.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -57.224 14.984 91.718 1.00 0.00 H new ATOM 881 N GLU A 57 -60.582 19.234 87.683 1.00 0.00 N ATOM 882 CA GLU A 57 -60.998 20.177 86.633 1.00 0.00 C ATOM 883 C GLU A 57 -62.492 20.110 86.265 1.00 0.00 C ATOM 884 O GLU A 57 -63.014 21.093 85.742 1.00 0.00 O ATOM 885 CB GLU A 57 -60.129 19.999 85.374 1.00 0.00 C ATOM 886 CG GLU A 57 -59.966 18.534 84.938 1.00 0.00 C ATOM 887 CD GLU A 57 -59.759 18.373 83.429 1.00 0.00 C ATOM 888 OE1 GLU A 57 -58.896 19.079 82.868 1.00 0.00 O ATOM 889 OE2 GLU A 57 -60.473 17.512 82.858 1.00 0.00 O ATOM 0 H GLU A 57 -60.904 18.283 87.506 1.00 0.00 H new ATOM 0 HA GLU A 57 -60.845 21.169 87.058 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -60.572 20.566 84.555 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -59.143 20.425 85.560 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -59.116 18.098 85.463 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -60.850 17.972 85.239 1.00 0.00 H new ATOM 896 N LYS A 58 -63.199 19.007 86.555 1.00 0.00 N ATOM 897 CA LYS A 58 -64.591 18.781 86.132 1.00 0.00 C ATOM 898 C LYS A 58 -65.487 18.555 87.350 1.00 0.00 C ATOM 899 O LYS A 58 -65.225 17.654 88.140 1.00 0.00 O ATOM 900 CB LYS A 58 -64.655 17.595 85.153 1.00 0.00 C ATOM 901 CG LYS A 58 -63.865 17.880 83.864 1.00 0.00 C ATOM 902 CD LYS A 58 -63.933 16.751 82.826 1.00 0.00 C ATOM 903 CE LYS A 58 -63.366 15.396 83.281 1.00 0.00 C ATOM 904 NZ LYS A 58 -61.940 15.472 83.671 1.00 0.00 N ATOM 0 H LYS A 58 -62.814 18.234 87.099 1.00 0.00 H new ATOM 0 HA LYS A 58 -64.959 19.666 85.613 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -64.256 16.703 85.635 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -65.695 17.384 84.904 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -64.244 18.797 83.413 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -62.821 18.060 84.122 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -64.974 16.610 82.536 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -63.394 17.069 81.934 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -63.950 15.028 84.125 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -63.479 14.671 82.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -61.483 14.555 83.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -61.466 16.209 83.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -61.869 15.706 84.682 1.00 0.00 H new ATOM 918 N VAL A 59 -66.517 19.393 87.514 1.00 0.00 N ATOM 919 CA VAL A 59 -67.445 19.379 88.660 1.00 0.00 C ATOM 920 C VAL A 59 -68.255 18.074 88.717 1.00 0.00 C ATOM 921 O VAL A 59 -68.803 17.633 87.709 1.00 0.00 O ATOM 922 CB VAL A 59 -68.392 20.600 88.626 1.00 0.00 C ATOM 923 CG1 VAL A 59 -69.322 20.638 89.850 1.00 0.00 C ATOM 924 CG2 VAL A 59 -67.602 21.917 88.612 1.00 0.00 C ATOM 0 H VAL A 59 -66.738 20.122 86.836 1.00 0.00 H new ATOM 0 HA VAL A 59 -66.839 19.438 89.564 1.00 0.00 H new ATOM 0 HB VAL A 59 -68.981 20.496 87.714 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -69.971 21.511 89.787 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -69.931 19.734 89.872 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -68.724 20.695 90.760 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -68.296 22.757 88.588 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -66.985 21.981 89.509 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -66.963 21.949 87.729 1.00 0.00 H new ATOM 934 N VAL A 60 -68.347 17.476 89.912 1.00 0.00 N ATOM 935 CA VAL A 60 -68.991 16.175 90.179 1.00 0.00 C ATOM 936 C VAL A 60 -69.859 16.140 91.451 1.00 0.00 C ATOM 937 O VAL A 60 -70.578 15.157 91.653 1.00 0.00 O ATOM 938 CB VAL A 60 -67.943 15.040 90.236 1.00 0.00 C ATOM 939 CG1 VAL A 60 -67.308 14.765 88.868 1.00 0.00 C ATOM 940 CG2 VAL A 60 -66.834 15.340 91.250 1.00 0.00 C ATOM 0 H VAL A 60 -67.960 17.899 90.756 1.00 0.00 H new ATOM 0 HA VAL A 60 -69.669 16.022 89.340 1.00 0.00 H new ATOM 0 HB VAL A 60 -68.488 14.151 90.553 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -66.579 13.960 88.960 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -68.083 14.473 88.159 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -66.810 15.666 88.510 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -66.118 14.518 91.260 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -66.325 16.262 90.970 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -67.270 15.453 92.243 1.00 0.00 H new ATOM 950 N GLY A 61 -69.854 17.189 92.288 1.00 0.00 N ATOM 951 CA GLY A 61 -70.645 17.271 93.527 1.00 0.00 C ATOM 952 C GLY A 61 -71.699 18.384 93.541 1.00 0.00 C ATOM 953 O GLY A 61 -71.709 19.249 92.666 1.00 0.00 O ATOM 0 H GLY A 61 -69.289 18.021 92.120 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -71.143 16.315 93.688 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -69.966 17.422 94.366 1.00 0.00 H new ATOM 957 N ARG A 62 -72.577 18.365 94.557 1.00 0.00 N ATOM 958 CA ARG A 62 -73.704 19.299 94.751 1.00 0.00 C ATOM 959 C ARG A 62 -73.727 19.840 96.186 1.00 0.00 C ATOM 960 O ARG A 62 -73.831 19.066 97.135 1.00 0.00 O ATOM 961 CB ARG A 62 -75.036 18.587 94.437 1.00 0.00 C ATOM 962 CG ARG A 62 -75.215 18.201 92.956 1.00 0.00 C ATOM 963 CD ARG A 62 -75.771 16.778 92.773 1.00 0.00 C ATOM 964 NE ARG A 62 -74.832 15.739 93.239 1.00 0.00 N ATOM 965 CZ ARG A 62 -73.685 15.360 92.699 1.00 0.00 C ATOM 966 NH1 ARG A 62 -73.225 15.840 91.572 1.00 0.00 N ATOM 967 NH2 ARG A 62 -72.948 14.484 93.323 1.00 0.00 N ATOM 0 H ARG A 62 -72.520 17.668 95.300 1.00 0.00 H new ATOM 0 HA ARG A 62 -73.573 20.140 94.070 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -75.105 17.686 95.046 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -75.860 19.236 94.733 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -75.888 18.913 92.479 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -74.255 18.279 92.446 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -76.710 16.686 93.319 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -75.997 16.613 91.720 1.00 0.00 H new ATOM 0 HE ARG A 62 -75.103 15.248 94.091 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -73.758 16.544 91.062 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -72.333 15.510 91.203 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -73.258 14.100 94.216 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -72.061 14.183 92.918 1.00 0.00 H new ATOM 981 N ILE A 63 -73.610 21.159 96.363 1.00 0.00 N ATOM 982 CA ILE A 63 -73.691 21.821 97.676 1.00 0.00 C ATOM 983 C ILE A 63 -75.142 21.802 98.179 1.00 0.00 C ATOM 984 O ILE A 63 -76.031 22.298 97.488 1.00 0.00 O ATOM 985 CB ILE A 63 -73.139 23.271 97.654 1.00 0.00 C ATOM 986 CG1 ILE A 63 -71.944 23.519 96.700 1.00 0.00 C ATOM 987 CG2 ILE A 63 -72.709 23.626 99.087 1.00 0.00 C ATOM 988 CD1 ILE A 63 -72.380 23.978 95.300 1.00 0.00 C ATOM 0 H ILE A 63 -73.454 21.808 95.592 1.00 0.00 H new ATOM 0 HA ILE A 63 -73.057 21.260 98.363 1.00 0.00 H new ATOM 0 HB ILE A 63 -73.943 23.900 97.272 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -71.288 24.273 97.136 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -71.361 22.602 96.611 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -72.315 24.642 99.107 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -73.569 23.557 99.753 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -71.938 22.931 99.418 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -71.499 24.135 94.678 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -73.012 23.214 94.847 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -72.939 24.911 95.380 1.00 0.00 H new ATOM 1000 N ILE A 64 -75.390 21.222 99.360 1.00 0.00 N ATOM 1001 CA ILE A 64 -76.746 21.038 99.907 1.00 0.00 C ATOM 1002 C ILE A 64 -77.111 22.145 100.901 1.00 0.00 C ATOM 1003 O ILE A 64 -78.259 22.576 100.942 1.00 0.00 O ATOM 1004 CB ILE A 64 -76.871 19.635 100.541 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -76.540 18.507 99.538 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -78.254 19.393 101.169 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -77.317 18.528 98.211 1.00 0.00 C ATOM 0 H ILE A 64 -74.654 20.864 99.968 1.00 0.00 H new ATOM 0 HA ILE A 64 -77.461 21.110 99.088 1.00 0.00 H new ATOM 0 HB ILE A 64 -76.130 19.609 101.340 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -75.475 18.552 99.312 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -76.722 17.550 100.027 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -78.288 18.392 101.600 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -78.433 20.131 101.951 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -79.023 19.484 100.402 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -77.000 17.690 97.590 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -78.385 18.446 98.413 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -77.118 19.463 97.687 1.00 0.00 H new ATOM 1019 N SER A 65 -76.128 22.658 101.651 1.00 0.00 N ATOM 1020 CA SER A 65 -76.245 23.692 102.693 1.00 0.00 C ATOM 1021 C SER A 65 -76.747 25.085 102.242 1.00 0.00 C ATOM 1022 O SER A 65 -76.505 26.075 102.944 1.00 0.00 O ATOM 1023 CB SER A 65 -74.867 23.835 103.339 1.00 0.00 C ATOM 1024 OG SER A 65 -74.945 24.612 104.510 1.00 0.00 O ATOM 0 H SER A 65 -75.164 22.342 101.541 1.00 0.00 H new ATOM 0 HA SER A 65 -77.022 23.347 103.375 1.00 0.00 H new ATOM 0 HB2 SER A 65 -74.467 22.849 103.577 1.00 0.00 H new ATOM 0 HB3 SER A 65 -74.176 24.298 102.635 1.00 0.00 H new ATOM 0 HG SER A 65 -75.481 25.414 104.336 1.00 0.00 H new ATOM 1030 N SER A 66 -77.423 25.199 101.093 1.00 0.00 N ATOM 1031 CA SER A 66 -77.674 26.436 100.337 1.00 0.00 C ATOM 1032 C SER A 66 -76.371 27.131 99.891 1.00 0.00 C ATOM 1033 O SER A 66 -75.293 26.542 99.946 1.00 0.00 O ATOM 1034 CB SER A 66 -78.636 27.361 101.105 1.00 0.00 C ATOM 1035 OG SER A 66 -77.958 28.009 102.159 1.00 0.00 O ATOM 0 H SER A 66 -77.834 24.384 100.638 1.00 0.00 H new ATOM 0 HA SER A 66 -78.176 26.166 99.408 1.00 0.00 H new ATOM 0 HB2 SER A 66 -79.058 28.102 100.426 1.00 0.00 H new ATOM 0 HB3 SER A 66 -79.469 26.781 101.502 1.00 0.00 H new ATOM 0 HG SER A 66 -77.565 27.339 102.756 1.00 0.00 H new ATOM 1041 N THR A 67 -76.474 28.371 99.397 1.00 0.00 N ATOM 1042 CA THR A 67 -75.361 29.239 98.990 1.00 0.00 C ATOM 1043 C THR A 67 -74.424 29.535 100.180 1.00 0.00 C ATOM 1044 O THR A 67 -74.828 30.311 101.053 1.00 0.00 O ATOM 1045 CB THR A 67 -75.909 30.564 98.436 1.00 0.00 C ATOM 1046 OG1 THR A 67 -76.759 31.138 99.403 1.00 0.00 O ATOM 1047 CG2 THR A 67 -76.690 30.379 97.134 1.00 0.00 C ATOM 0 H THR A 67 -77.381 28.819 99.264 1.00 0.00 H new ATOM 0 HA THR A 67 -74.792 28.720 98.219 1.00 0.00 H new ATOM 0 HB THR A 67 -75.059 31.210 98.217 1.00 0.00 H new ATOM 0 HG1 THR A 67 -76.368 31.019 100.294 1.00 0.00 H new ATOM 0 HG21 THR A 67 -77.054 31.346 96.788 1.00 0.00 H new ATOM 0 HG22 THR A 67 -76.037 29.944 96.377 1.00 0.00 H new ATOM 0 HG23 THR A 67 -77.536 29.714 97.309 1.00 0.00 H new ATOM 1055 N PRO A 68 -73.212 28.945 100.249 1.00 0.00 N ATOM 1056 CA PRO A 68 -72.302 29.089 101.390 1.00 0.00 C ATOM 1057 C PRO A 68 -71.914 30.542 101.681 1.00 0.00 C ATOM 1058 O PRO A 68 -71.657 31.306 100.750 1.00 0.00 O ATOM 1059 CB PRO A 68 -71.042 28.309 101.001 1.00 0.00 C ATOM 1060 CG PRO A 68 -71.542 27.283 99.995 1.00 0.00 C ATOM 1061 CD PRO A 68 -72.610 28.069 99.250 1.00 0.00 C ATOM 0 HA PRO A 68 -72.790 28.723 102.293 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -70.287 28.962 100.564 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -70.586 27.830 101.867 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -70.748 26.942 99.331 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -71.952 26.399 100.483 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -72.176 28.645 98.433 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -73.354 27.404 98.811 1.00 0.00 H new ATOM 1069 N LEU A 69 -71.751 30.900 102.962 1.00 0.00 N ATOM 1070 CA LEU A 69 -71.186 32.192 103.360 1.00 0.00 C ATOM 1071 C LEU A 69 -70.232 32.109 104.559 1.00 0.00 C ATOM 1072 O LEU A 69 -70.180 31.103 105.270 1.00 0.00 O ATOM 1073 CB LEU A 69 -72.306 33.235 103.568 1.00 0.00 C ATOM 1074 CG LEU A 69 -73.203 33.015 104.807 1.00 0.00 C ATOM 1075 CD1 LEU A 69 -73.495 34.356 105.488 1.00 0.00 C ATOM 1076 CD2 LEU A 69 -74.532 32.360 104.425 1.00 0.00 C ATOM 0 H LEU A 69 -72.007 30.302 103.748 1.00 0.00 H new ATOM 0 HA LEU A 69 -70.559 32.526 102.534 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -71.849 34.222 103.643 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -72.939 33.244 102.681 1.00 0.00 H new ATOM 0 HG LEU A 69 -72.666 32.354 105.487 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -74.128 34.191 106.360 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -72.558 34.817 105.801 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -74.007 35.016 104.788 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -75.139 32.220 105.320 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -75.065 33.001 103.722 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -74.341 31.393 103.961 1.00 0.00 H new ATOM 1088 N ALA A 70 -69.504 33.208 104.772 1.00 0.00 N ATOM 1089 CA ALA A 70 -68.665 33.490 105.929 1.00 0.00 C ATOM 1090 C ALA A 70 -68.859 34.964 106.320 1.00 0.00 C ATOM 1091 O ALA A 70 -68.700 35.856 105.486 1.00 0.00 O ATOM 1092 CB ALA A 70 -67.204 33.173 105.587 1.00 0.00 C ATOM 0 H ALA A 70 -69.487 33.971 104.095 1.00 0.00 H new ATOM 0 HA ALA A 70 -68.944 32.868 106.779 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -66.574 33.383 106.451 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -67.113 32.120 105.319 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -66.885 33.790 104.747 1.00 0.00 H new ATOM 1098 N GLU A 71 -69.251 35.221 107.574 1.00 0.00 N ATOM 1099 CA GLU A 71 -69.541 36.569 108.083 1.00 0.00 C ATOM 1100 C GLU A 71 -68.270 37.402 108.352 1.00 0.00 C ATOM 1101 O GLU A 71 -68.335 38.635 108.309 1.00 0.00 O ATOM 1102 CB GLU A 71 -70.366 36.452 109.377 1.00 0.00 C ATOM 1103 CG GLU A 71 -71.783 35.886 109.191 1.00 0.00 C ATOM 1104 CD GLU A 71 -72.816 36.895 108.672 1.00 0.00 C ATOM 1105 OE1 GLU A 71 -72.520 38.114 108.556 1.00 0.00 O ATOM 1106 OE2 GLU A 71 -73.970 36.477 108.432 1.00 0.00 O ATOM 0 H GLU A 71 -69.378 34.490 108.274 1.00 0.00 H new ATOM 0 HA GLU A 71 -70.102 37.093 107.309 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -69.826 35.817 110.079 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -70.442 37.439 109.833 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -71.736 35.047 108.497 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -72.130 35.491 110.146 1.00 0.00 H new ATOM 1113 N ASN A 72 -67.135 36.748 108.636 1.00 0.00 N ATOM 1114 CA ASN A 72 -65.794 37.308 108.846 1.00 0.00 C ATOM 1115 C ASN A 72 -64.762 36.169 108.965 1.00 0.00 C ATOM 1116 O ASN A 72 -65.141 35.006 109.103 1.00 0.00 O ATOM 1117 CB ASN A 72 -65.783 38.168 110.134 1.00 0.00 C ATOM 1118 CG ASN A 72 -65.451 39.624 109.854 1.00 0.00 C ATOM 1119 OD1 ASN A 72 -64.482 40.170 110.351 1.00 0.00 O ATOM 1120 ND2 ASN A 72 -66.266 40.291 109.066 1.00 0.00 N ATOM 0 H ASN A 72 -67.132 35.733 108.732 1.00 0.00 H new ATOM 0 HA ASN A 72 -65.531 37.936 107.995 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -66.758 38.107 110.617 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -65.054 37.760 110.834 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -66.090 41.275 108.866 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -67.074 39.824 108.655 1.00 0.00 H new ATOM 1127 N THR A 73 -63.464 36.496 109.014 1.00 0.00 N ATOM 1128 CA THR A 73 -62.388 35.529 109.310 1.00 0.00 C ATOM 1129 C THR A 73 -62.609 34.744 110.602 1.00 0.00 C ATOM 1130 O THR A 73 -62.360 33.544 110.636 1.00 0.00 O ATOM 1131 CB THR A 73 -61.007 36.214 109.285 1.00 0.00 C ATOM 1132 OG1 THR A 73 -60.479 36.001 108.004 1.00 0.00 O ATOM 1133 CG2 THR A 73 -59.947 35.690 110.260 1.00 0.00 C ATOM 0 H THR A 73 -63.124 37.444 108.849 1.00 0.00 H new ATOM 0 HA THR A 73 -62.416 34.787 108.512 1.00 0.00 H new ATOM 0 HB THR A 73 -61.197 37.248 109.573 1.00 0.00 H new ATOM 0 HG1 THR A 73 -60.133 35.086 107.941 1.00 0.00 H new ATOM 0 HG21 THR A 73 -59.026 36.260 110.137 1.00 0.00 H new ATOM 0 HG22 THR A 73 -60.307 35.800 111.283 1.00 0.00 H new ATOM 0 HG23 THR A 73 -59.753 34.637 110.055 1.00 0.00 H new ATOM 1141 N ASN A 74 -63.115 35.385 111.657 1.00 0.00 N ATOM 1142 CA ASN A 74 -63.432 34.726 112.925 1.00 0.00 C ATOM 1143 C ASN A 74 -64.685 33.827 112.863 1.00 0.00 C ATOM 1144 O ASN A 74 -65.024 33.202 113.865 1.00 0.00 O ATOM 1145 CB ASN A 74 -63.570 35.807 114.010 1.00 0.00 C ATOM 1146 CG ASN A 74 -62.303 36.639 114.138 1.00 0.00 C ATOM 1147 OD1 ASN A 74 -62.068 37.553 113.365 1.00 0.00 O ATOM 1148 ND2 ASN A 74 -61.445 36.333 115.089 1.00 0.00 N ATOM 0 H ASN A 74 -63.318 36.385 111.655 1.00 0.00 H new ATOM 0 HA ASN A 74 -62.615 34.045 113.165 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -64.411 36.458 113.770 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -63.794 35.336 114.967 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -60.578 36.861 115.183 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -61.648 35.568 115.732 1.00 0.00 H new ATOM 1155 N SER A 75 -65.387 33.765 111.722 1.00 0.00 N ATOM 1156 CA SER A 75 -66.581 32.931 111.534 1.00 0.00 C ATOM 1157 C SER A 75 -66.236 31.582 110.905 1.00 0.00 C ATOM 1158 O SER A 75 -65.256 31.455 110.169 1.00 0.00 O ATOM 1159 CB SER A 75 -67.586 33.651 110.635 1.00 0.00 C ATOM 1160 OG SER A 75 -67.785 34.953 111.139 1.00 0.00 O ATOM 0 H SER A 75 -65.136 34.302 110.892 1.00 0.00 H new ATOM 0 HA SER A 75 -67.012 32.755 112.519 1.00 0.00 H new ATOM 0 HB2 SER A 75 -67.215 33.694 109.611 1.00 0.00 H new ATOM 0 HB3 SER A 75 -68.530 33.106 110.610 1.00 0.00 H new ATOM 0 HG SER A 75 -68.525 34.946 111.781 1.00 0.00 H new ATOM 1166 N VAL A 76 -67.095 30.588 111.149 1.00 0.00 N ATOM 1167 CA VAL A 76 -66.949 29.222 110.642 1.00 0.00 C ATOM 1168 C VAL A 76 -68.268 28.739 110.040 1.00 0.00 C ATOM 1169 O VAL A 76 -69.335 29.114 110.527 1.00 0.00 O ATOM 1170 CB VAL A 76 -66.448 28.259 111.742 1.00 0.00 C ATOM 1171 CG1 VAL A 76 -65.095 28.707 112.305 1.00 0.00 C ATOM 1172 CG2 VAL A 76 -67.424 28.100 112.919 1.00 0.00 C ATOM 0 H VAL A 76 -67.932 30.715 111.719 1.00 0.00 H new ATOM 0 HA VAL A 76 -66.193 29.230 109.856 1.00 0.00 H new ATOM 0 HB VAL A 76 -66.358 27.295 111.242 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -64.772 28.008 113.076 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -64.357 28.729 111.503 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -65.192 29.703 112.737 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -67.003 27.409 113.650 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -67.589 29.070 113.389 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -68.373 27.708 112.554 1.00 0.00 H new ATOM 1182 N THR A 77 -68.197 27.889 109.010 1.00 0.00 N ATOM 1183 CA THR A 77 -69.390 27.423 108.282 1.00 0.00 C ATOM 1184 C THR A 77 -69.274 25.933 107.954 1.00 0.00 C ATOM 1185 O THR A 77 -68.498 25.545 107.081 1.00 0.00 O ATOM 1186 CB THR A 77 -69.676 28.260 107.012 1.00 0.00 C ATOM 1187 OG1 THR A 77 -69.430 29.636 107.226 1.00 0.00 O ATOM 1188 CG2 THR A 77 -71.143 28.127 106.604 1.00 0.00 C ATOM 0 H THR A 77 -67.320 27.505 108.657 1.00 0.00 H new ATOM 0 HA THR A 77 -70.246 27.565 108.942 1.00 0.00 H new ATOM 0 HB THR A 77 -69.013 27.879 106.235 1.00 0.00 H new ATOM 0 HG1 THR A 77 -70.032 30.167 106.664 1.00 0.00 H new ATOM 0 HG21 THR A 77 -71.327 28.722 105.709 1.00 0.00 H new ATOM 0 HG22 THR A 77 -71.370 27.081 106.398 1.00 0.00 H new ATOM 0 HG23 THR A 77 -71.780 28.483 107.414 1.00 0.00 H new ATOM 1196 N ASN A 78 -70.021 25.095 108.685 1.00 0.00 N ATOM 1197 CA ASN A 78 -70.173 23.650 108.464 1.00 0.00 C ATOM 1198 C ASN A 78 -71.157 23.346 107.319 1.00 0.00 C ATOM 1199 O ASN A 78 -72.361 23.198 107.531 1.00 0.00 O ATOM 1200 CB ASN A 78 -70.518 22.945 109.793 1.00 0.00 C ATOM 1201 CG ASN A 78 -71.558 23.652 110.652 1.00 0.00 C ATOM 1202 OD1 ASN A 78 -71.279 24.066 111.764 1.00 0.00 O ATOM 1203 ND2 ASN A 78 -72.759 23.842 110.150 1.00 0.00 N ATOM 0 H ASN A 78 -70.562 25.422 109.485 1.00 0.00 H new ATOM 0 HA ASN A 78 -69.222 23.238 108.128 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -70.877 21.940 109.570 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -69.603 22.835 110.375 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -73.466 24.339 110.692 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -72.984 23.492 109.219 1.00 0.00 H new ATOM 1210 N ILE A 79 -70.628 23.264 106.097 1.00 0.00 N ATOM 1211 CA ILE A 79 -71.368 23.044 104.854 1.00 0.00 C ATOM 1212 C ILE A 79 -71.637 21.550 104.625 1.00 0.00 C ATOM 1213 O ILE A 79 -70.706 20.767 104.433 1.00 0.00 O ATOM 1214 CB ILE A 79 -70.575 23.668 103.680 1.00 0.00 C ATOM 1215 CG1 ILE A 79 -70.457 25.207 103.808 1.00 0.00 C ATOM 1216 CG2 ILE A 79 -71.156 23.279 102.308 1.00 0.00 C ATOM 1217 CD1 ILE A 79 -71.782 25.982 103.780 1.00 0.00 C ATOM 0 H ILE A 79 -69.624 23.354 105.940 1.00 0.00 H new ATOM 0 HA ILE A 79 -72.342 23.529 104.921 1.00 0.00 H new ATOM 0 HB ILE A 79 -69.570 23.250 103.742 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -69.943 25.437 104.741 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -69.826 25.573 102.998 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -70.565 23.742 101.518 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -71.128 22.195 102.195 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -72.188 23.624 102.239 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -71.582 27.049 103.877 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -72.294 25.793 102.837 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -72.412 25.655 104.607 1.00 0.00 H new ATOM 1229 N GLU A 80 -72.921 21.173 104.596 1.00 0.00 N ATOM 1230 CA GLU A 80 -73.398 19.928 103.984 1.00 0.00 C ATOM 1231 C GLU A 80 -73.262 19.966 102.445 1.00 0.00 C ATOM 1232 O GLU A 80 -73.753 20.882 101.772 1.00 0.00 O ATOM 1233 CB GLU A 80 -74.857 19.646 104.390 1.00 0.00 C ATOM 1234 CG GLU A 80 -75.237 18.214 103.973 1.00 0.00 C ATOM 1235 CD GLU A 80 -76.687 17.801 104.253 1.00 0.00 C ATOM 1236 OE1 GLU A 80 -77.534 18.680 104.509 1.00 0.00 O ATOM 1237 OE2 GLU A 80 -76.939 16.572 104.146 1.00 0.00 O ATOM 0 H GLU A 80 -73.669 21.734 105.004 1.00 0.00 H new ATOM 0 HA GLU A 80 -72.771 19.117 104.354 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -74.976 19.767 105.467 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -75.524 20.364 103.913 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -75.047 18.104 102.905 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -74.575 17.518 104.488 1.00 0.00 H new ATOM 1244 N LEU A 81 -72.603 18.941 101.896 1.00 0.00 N ATOM 1245 CA LEU A 81 -72.170 18.826 100.504 1.00 0.00 C ATOM 1246 C LEU A 81 -72.313 17.367 100.018 1.00 0.00 C ATOM 1247 O LEU A 81 -72.141 16.438 100.801 1.00 0.00 O ATOM 1248 CB LEU A 81 -70.716 19.335 100.518 1.00 0.00 C ATOM 1249 CG LEU A 81 -69.920 19.299 99.209 1.00 0.00 C ATOM 1250 CD1 LEU A 81 -70.546 20.138 98.101 1.00 0.00 C ATOM 1251 CD2 LEU A 81 -68.516 19.848 99.484 1.00 0.00 C ATOM 0 H LEU A 81 -72.343 18.122 102.446 1.00 0.00 H new ATOM 0 HA LEU A 81 -72.771 19.406 99.804 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -70.728 20.366 100.871 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -70.167 18.752 101.257 1.00 0.00 H new ATOM 0 HG LEU A 81 -69.905 18.264 98.868 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -69.933 20.069 97.202 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -71.548 19.768 97.886 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -70.605 21.178 98.421 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -67.932 19.831 98.564 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -68.591 20.873 99.847 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -68.025 19.231 100.237 1.00 0.00 H new ATOM 1263 N GLU A 82 -72.624 17.142 98.735 1.00 0.00 N ATOM 1264 CA GLU A 82 -72.971 15.831 98.158 1.00 0.00 C ATOM 1265 C GLU A 82 -71.953 15.434 97.061 1.00 0.00 C ATOM 1266 O GLU A 82 -72.040 15.947 95.943 1.00 0.00 O ATOM 1267 CB GLU A 82 -74.437 15.886 97.675 1.00 0.00 C ATOM 1268 CG GLU A 82 -75.209 14.555 97.695 1.00 0.00 C ATOM 1269 CD GLU A 82 -75.085 13.684 96.441 1.00 0.00 C ATOM 1270 OE1 GLU A 82 -74.542 14.145 95.412 1.00 0.00 O ATOM 1271 OE2 GLU A 82 -75.513 12.507 96.523 1.00 0.00 O ATOM 0 H GLU A 82 -72.642 17.892 98.044 1.00 0.00 H new ATOM 0 HA GLU A 82 -72.904 15.039 98.904 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -74.975 16.604 98.294 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -74.448 16.273 96.656 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -74.868 13.974 98.551 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -76.264 14.773 97.858 1.00 0.00 H new ATOM 1278 N PRO A 83 -70.931 14.603 97.372 1.00 0.00 N ATOM 1279 CA PRO A 83 -69.906 14.139 96.420 1.00 0.00 C ATOM 1280 C PRO A 83 -70.421 13.077 95.423 1.00 0.00 C ATOM 1281 O PRO A 83 -71.508 12.533 95.612 1.00 0.00 O ATOM 1282 CB PRO A 83 -68.784 13.535 97.286 1.00 0.00 C ATOM 1283 CG PRO A 83 -69.127 13.897 98.727 1.00 0.00 C ATOM 1284 CD PRO A 83 -70.631 14.095 98.701 1.00 0.00 C ATOM 0 HA PRO A 83 -69.577 14.976 95.804 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -68.730 12.454 97.157 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -67.812 13.939 97.003 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -68.840 13.105 99.418 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -68.610 14.802 99.046 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -71.154 13.158 98.890 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -70.948 14.798 99.471 1.00 0.00 H new ATOM 1292 N PRO A 84 -69.641 12.682 94.398 1.00 0.00 N ATOM 1293 CA PRO A 84 -69.912 11.466 93.625 1.00 0.00 C ATOM 1294 C PRO A 84 -69.585 10.203 94.445 1.00 0.00 C ATOM 1295 O PRO A 84 -68.844 10.262 95.424 1.00 0.00 O ATOM 1296 CB PRO A 84 -68.994 11.574 92.406 1.00 0.00 C ATOM 1297 CG PRO A 84 -67.769 12.270 92.992 1.00 0.00 C ATOM 1298 CD PRO A 84 -68.382 13.275 93.971 1.00 0.00 C ATOM 0 HA PRO A 84 -70.963 11.381 93.348 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -68.749 10.596 91.992 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -69.448 12.155 91.603 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -67.107 11.566 93.497 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -67.179 12.765 92.221 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -67.722 13.448 94.821 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -68.545 14.240 93.492 1.00 0.00 H new ATOM 1306 N PHE A 85 -70.091 9.038 94.025 1.00 0.00 N ATOM 1307 CA PHE A 85 -69.767 7.744 94.640 1.00 0.00 C ATOM 1308 C PHE A 85 -68.384 7.232 94.194 1.00 0.00 C ATOM 1309 O PHE A 85 -68.275 6.310 93.388 1.00 0.00 O ATOM 1310 CB PHE A 85 -70.894 6.738 94.359 1.00 0.00 C ATOM 1311 CG PHE A 85 -72.205 7.092 95.037 1.00 0.00 C ATOM 1312 CD1 PHE A 85 -72.373 6.837 96.413 1.00 0.00 C ATOM 1313 CD2 PHE A 85 -73.252 7.684 94.303 1.00 0.00 C ATOM 1314 CE1 PHE A 85 -73.583 7.167 97.048 1.00 0.00 C ATOM 1315 CE2 PHE A 85 -74.461 8.015 94.941 1.00 0.00 C ATOM 1316 CZ PHE A 85 -74.627 7.756 96.313 1.00 0.00 C ATOM 0 H PHE A 85 -70.742 8.965 93.243 1.00 0.00 H new ATOM 0 HA PHE A 85 -69.699 7.873 95.720 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -71.056 6.677 93.283 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -70.578 5.749 94.691 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -71.571 6.388 96.980 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -73.126 7.884 93.249 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -73.711 6.968 98.102 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -75.262 8.468 94.377 1.00 0.00 H new ATOM 0 HZ PHE A 85 -75.556 8.009 96.802 1.00 0.00 H new ATOM 1326 N GLY A 86 -67.322 7.848 94.724 1.00 0.00 N ATOM 1327 CA GLY A 86 -65.926 7.516 94.434 1.00 0.00 C ATOM 1328 C GLY A 86 -64.963 8.511 95.084 1.00 0.00 C ATOM 1329 O GLY A 86 -65.381 9.306 95.930 1.00 0.00 O ATOM 0 H GLY A 86 -67.415 8.616 95.388 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -65.708 6.510 94.794 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -65.770 7.509 93.355 1.00 0.00 H new ATOM 1333 N ASP A 87 -63.681 8.458 94.693 1.00 0.00 N ATOM 1334 CA ASP A 87 -62.711 9.506 95.033 1.00 0.00 C ATOM 1335 C ASP A 87 -63.052 10.824 94.326 1.00 0.00 C ATOM 1336 O ASP A 87 -63.532 10.840 93.189 1.00 0.00 O ATOM 1337 CB ASP A 87 -61.268 9.085 94.699 1.00 0.00 C ATOM 1338 CG ASP A 87 -60.248 10.054 95.320 1.00 0.00 C ATOM 1339 OD1 ASP A 87 -60.541 10.576 96.418 1.00 0.00 O ATOM 1340 OD2 ASP A 87 -59.198 10.304 94.683 1.00 0.00 O ATOM 0 H ASP A 87 -63.292 7.696 94.138 1.00 0.00 H new ATOM 0 HA ASP A 87 -62.775 9.658 96.110 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -61.086 8.076 95.068 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -61.136 9.057 93.617 1.00 0.00 H new ATOM 1345 N SER A 88 -62.805 11.937 95.013 1.00 0.00 N ATOM 1346 CA SER A 88 -63.256 13.264 94.609 1.00 0.00 C ATOM 1347 C SER A 88 -62.466 14.365 95.319 1.00 0.00 C ATOM 1348 O SER A 88 -61.848 14.117 96.355 1.00 0.00 O ATOM 1349 CB SER A 88 -64.752 13.377 94.920 1.00 0.00 C ATOM 1350 OG SER A 88 -65.018 13.417 96.310 1.00 0.00 O ATOM 0 H SER A 88 -62.274 11.940 95.884 1.00 0.00 H new ATOM 0 HA SER A 88 -63.085 13.396 93.541 1.00 0.00 H new ATOM 0 HB2 SER A 88 -65.150 14.277 94.452 1.00 0.00 H new ATOM 0 HB3 SER A 88 -65.276 12.530 94.478 1.00 0.00 H new ATOM 0 HG SER A 88 -64.505 12.715 96.762 1.00 0.00 H new ATOM 1356 N TYR A 89 -62.482 15.580 94.762 1.00 0.00 N ATOM 1357 CA TYR A 89 -61.646 16.691 95.222 1.00 0.00 C ATOM 1358 C TYR A 89 -62.496 17.937 95.444 1.00 0.00 C ATOM 1359 O TYR A 89 -62.844 18.655 94.507 1.00 0.00 O ATOM 1360 CB TYR A 89 -60.447 16.887 94.279 1.00 0.00 C ATOM 1361 CG TYR A 89 -59.524 15.683 94.348 1.00 0.00 C ATOM 1362 CD1 TYR A 89 -59.819 14.546 93.575 1.00 0.00 C ATOM 1363 CD2 TYR A 89 -58.499 15.627 95.315 1.00 0.00 C ATOM 1364 CE1 TYR A 89 -59.173 13.326 93.840 1.00 0.00 C ATOM 1365 CE2 TYR A 89 -57.814 14.418 95.546 1.00 0.00 C ATOM 1366 CZ TYR A 89 -58.189 13.249 94.846 1.00 0.00 C ATOM 1367 OH TYR A 89 -57.587 12.062 95.110 1.00 0.00 O ATOM 0 H TYR A 89 -63.081 15.821 93.972 1.00 0.00 H new ATOM 0 HA TYR A 89 -61.212 16.459 96.195 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -60.798 17.027 93.257 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -59.901 17.789 94.555 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -60.543 14.610 92.776 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -58.239 16.511 95.878 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -59.431 12.445 93.271 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -57.002 14.384 96.258 1.00 0.00 H new ATOM 0 HH TYR A 89 -58.120 11.333 94.729 1.00 0.00 H new ATOM 1377 N ILE A 90 -62.861 18.156 96.709 1.00 0.00 N ATOM 1378 CA ILE A 90 -63.539 19.349 97.207 1.00 0.00 C ATOM 1379 C ILE A 90 -62.617 20.543 96.938 1.00 0.00 C ATOM 1380 O ILE A 90 -61.423 20.458 97.223 1.00 0.00 O ATOM 1381 CB ILE A 90 -63.834 19.201 98.724 1.00 0.00 C ATOM 1382 CG1 ILE A 90 -64.888 18.150 99.126 1.00 0.00 C ATOM 1383 CG2 ILE A 90 -64.332 20.532 99.307 1.00 0.00 C ATOM 1384 CD1 ILE A 90 -64.606 16.698 98.731 1.00 0.00 C ATOM 0 H ILE A 90 -62.683 17.474 97.446 1.00 0.00 H new ATOM 0 HA ILE A 90 -64.495 19.495 96.704 1.00 0.00 H new ATOM 0 HB ILE A 90 -62.873 18.872 99.120 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -65.010 18.189 100.208 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -65.842 18.442 98.687 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -64.534 20.410 100.371 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -63.569 21.298 99.168 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -65.247 20.833 98.796 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -65.423 16.063 99.073 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -64.519 16.626 97.647 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -63.674 16.370 99.192 1.00 0.00 H new ATOM 1396 N VAL A 91 -63.160 21.656 96.434 1.00 0.00 N ATOM 1397 CA VAL A 91 -62.423 22.922 96.290 1.00 0.00 C ATOM 1398 C VAL A 91 -63.209 24.034 96.990 1.00 0.00 C ATOM 1399 O VAL A 91 -64.390 24.220 96.698 1.00 0.00 O ATOM 1400 CB VAL A 91 -61.966 23.242 94.837 1.00 0.00 C ATOM 1401 CG1 VAL A 91 -62.025 22.045 93.875 1.00 0.00 C ATOM 1402 CG2 VAL A 91 -62.653 24.446 94.178 1.00 0.00 C ATOM 0 H VAL A 91 -64.127 21.707 96.112 1.00 0.00 H new ATOM 0 HA VAL A 91 -61.462 22.826 96.795 1.00 0.00 H new ATOM 0 HB VAL A 91 -60.922 23.510 95.000 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -61.690 22.356 92.886 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -61.377 21.250 94.244 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -63.050 21.679 93.812 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -62.262 24.581 93.169 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -63.728 24.270 94.130 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -62.458 25.343 94.766 1.00 0.00 H new ATOM 1412 N ILE A 92 -62.580 24.730 97.947 1.00 0.00 N ATOM 1413 CA ILE A 92 -63.195 25.809 98.743 1.00 0.00 C ATOM 1414 C ILE A 92 -62.342 27.079 98.629 1.00 0.00 C ATOM 1415 O ILE A 92 -61.217 27.129 99.126 1.00 0.00 O ATOM 1416 CB ILE A 92 -63.461 25.375 100.205 1.00 0.00 C ATOM 1417 CG1 ILE A 92 -64.334 24.101 100.224 1.00 0.00 C ATOM 1418 CG2 ILE A 92 -64.083 26.525 101.018 1.00 0.00 C ATOM 1419 CD1 ILE A 92 -64.736 23.583 101.606 1.00 0.00 C ATOM 0 H ILE A 92 -61.607 24.557 98.197 1.00 0.00 H new ATOM 0 HA ILE A 92 -64.181 26.035 98.336 1.00 0.00 H new ATOM 0 HB ILE A 92 -62.513 25.134 100.685 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -65.242 24.298 99.654 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -63.796 23.309 99.703 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -64.260 26.193 102.041 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -63.402 27.376 101.025 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -65.029 26.821 100.564 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -65.346 22.687 101.495 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -63.840 23.344 102.180 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -65.308 24.349 102.129 1.00 0.00 H new ATOM 1431 N GLY A 93 -62.878 28.084 97.928 1.00 0.00 N ATOM 1432 CA GLY A 93 -62.152 29.231 97.375 1.00 0.00 C ATOM 1433 C GLY A 93 -61.920 29.073 95.865 1.00 0.00 C ATOM 1434 O GLY A 93 -62.036 27.974 95.324 1.00 0.00 O ATOM 0 H GLY A 93 -63.876 28.121 97.722 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -62.715 30.145 97.564 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -61.193 29.336 97.883 1.00 0.00 H new ATOM 1438 N VAL A 94 -61.578 30.167 95.171 1.00 0.00 N ATOM 1439 CA VAL A 94 -61.213 30.143 93.740 1.00 0.00 C ATOM 1440 C VAL A 94 -59.739 29.756 93.531 1.00 0.00 C ATOM 1441 O VAL A 94 -58.954 29.782 94.474 1.00 0.00 O ATOM 1442 CB VAL A 94 -61.512 31.491 93.052 1.00 0.00 C ATOM 1443 CG1 VAL A 94 -63.007 31.825 93.081 1.00 0.00 C ATOM 1444 CG2 VAL A 94 -60.726 32.649 93.673 1.00 0.00 C ATOM 0 H VAL A 94 -61.545 31.099 95.584 1.00 0.00 H new ATOM 0 HA VAL A 94 -61.834 29.377 93.276 1.00 0.00 H new ATOM 0 HB VAL A 94 -61.193 31.371 92.017 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -63.176 32.782 92.587 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -63.564 31.045 92.562 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -63.346 31.886 94.115 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -60.972 33.575 93.154 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -60.989 32.743 94.727 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -59.658 32.454 93.581 1.00 0.00 H new ATOM 1454 N GLY A 95 -59.352 29.435 92.288 1.00 0.00 N ATOM 1455 CA GLY A 95 -58.047 28.893 91.867 1.00 0.00 C ATOM 1456 C GLY A 95 -56.822 29.302 92.702 1.00 0.00 C ATOM 1457 O GLY A 95 -56.162 28.444 93.280 1.00 0.00 O ATOM 0 H GLY A 95 -59.983 29.554 91.495 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -58.114 27.805 91.873 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -57.871 29.196 90.835 1.00 0.00 H new ATOM 1461 N ASN A 96 -56.531 30.606 92.791 1.00 0.00 N ATOM 1462 CA ASN A 96 -55.403 31.189 93.537 1.00 0.00 C ATOM 1463 C ASN A 96 -55.472 31.022 95.075 1.00 0.00 C ATOM 1464 O ASN A 96 -54.672 31.620 95.801 1.00 0.00 O ATOM 1465 CB ASN A 96 -55.320 32.681 93.160 1.00 0.00 C ATOM 1466 CG ASN A 96 -56.593 33.424 93.538 1.00 0.00 C ATOM 1467 OD1 ASN A 96 -57.529 33.479 92.757 1.00 0.00 O ATOM 1468 ND2 ASN A 96 -56.676 33.940 94.749 1.00 0.00 N ATOM 0 H ASN A 96 -57.098 31.315 92.326 1.00 0.00 H new ATOM 0 HA ASN A 96 -54.507 30.639 93.250 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -54.468 33.138 93.664 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -55.146 32.777 92.088 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -57.536 34.398 95.051 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -55.880 33.881 95.384 1.00 0.00 H new ATOM 1475 N SER A 97 -56.477 30.327 95.611 1.00 0.00 N ATOM 1476 CA SER A 97 -56.771 30.249 97.047 1.00 0.00 C ATOM 1477 C SER A 97 -57.678 29.069 97.445 1.00 0.00 C ATOM 1478 O SER A 97 -58.168 29.022 98.573 1.00 0.00 O ATOM 1479 CB SER A 97 -57.377 31.595 97.454 1.00 0.00 C ATOM 1480 OG SER A 97 -56.318 32.519 97.635 1.00 0.00 O ATOM 0 H SER A 97 -57.129 29.786 95.043 1.00 0.00 H new ATOM 0 HA SER A 97 -55.843 30.052 97.584 1.00 0.00 H new ATOM 0 HB2 SER A 97 -58.065 31.950 96.687 1.00 0.00 H new ATOM 0 HB3 SER A 97 -57.952 31.491 98.374 1.00 0.00 H new ATOM 0 HG SER A 97 -55.483 32.129 97.302 1.00 0.00 H new ATOM 1486 N ALA A 98 -57.902 28.113 96.536 1.00 0.00 N ATOM 1487 CA ALA A 98 -58.792 26.974 96.713 1.00 0.00 C ATOM 1488 C ALA A 98 -58.198 25.910 97.651 1.00 0.00 C ATOM 1489 O ALA A 98 -57.304 25.155 97.251 1.00 0.00 O ATOM 1490 CB ALA A 98 -59.104 26.380 95.332 1.00 0.00 C ATOM 0 H ALA A 98 -57.447 28.118 95.623 1.00 0.00 H new ATOM 0 HA ALA A 98 -59.711 27.317 97.189 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -59.770 25.525 95.446 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -59.586 27.135 94.711 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -58.178 26.057 94.857 1.00 0.00 H new ATOM 1496 N LEU A 99 -58.748 25.787 98.868 1.00 0.00 N ATOM 1497 CA LEU A 99 -58.594 24.592 99.706 1.00 0.00 C ATOM 1498 C LEU A 99 -59.057 23.375 98.900 1.00 0.00 C ATOM 1499 O LEU A 99 -60.258 23.169 98.739 1.00 0.00 O ATOM 1500 CB LEU A 99 -59.465 24.683 100.965 1.00 0.00 C ATOM 1501 CG LEU A 99 -59.075 25.697 102.042 1.00 0.00 C ATOM 1502 CD1 LEU A 99 -60.234 25.733 103.040 1.00 0.00 C ATOM 1503 CD2 LEU A 99 -57.794 25.277 102.768 1.00 0.00 C ATOM 0 H LEU A 99 -59.314 26.518 99.299 1.00 0.00 H new ATOM 0 HA LEU A 99 -57.548 24.507 100.002 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -60.484 24.908 100.649 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -59.485 23.696 101.428 1.00 0.00 H new ATOM 0 HG LEU A 99 -58.887 26.672 101.591 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -60.008 26.444 103.834 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -61.146 26.039 102.528 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -60.375 24.741 103.470 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -57.546 26.019 103.526 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -57.947 24.309 103.244 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -56.977 25.204 102.051 1.00 0.00 H new ATOM 1515 N THR A 100 -58.105 22.617 98.358 1.00 0.00 N ATOM 1516 CA THR A 100 -58.348 21.578 97.356 1.00 0.00 C ATOM 1517 C THR A 100 -58.053 20.220 97.989 1.00 0.00 C ATOM 1518 O THR A 100 -56.891 19.824 98.068 1.00 0.00 O ATOM 1519 CB THR A 100 -57.518 21.853 96.091 1.00 0.00 C ATOM 1520 OG1 THR A 100 -57.820 23.141 95.590 1.00 0.00 O ATOM 1521 CG2 THR A 100 -57.837 20.854 94.976 1.00 0.00 C ATOM 0 H THR A 100 -57.121 22.710 98.608 1.00 0.00 H new ATOM 0 HA THR A 100 -59.390 21.579 97.036 1.00 0.00 H new ATOM 0 HB THR A 100 -56.469 21.767 96.375 1.00 0.00 H new ATOM 0 HG1 THR A 100 -57.498 23.820 96.219 1.00 0.00 H new ATOM 0 HG21 THR A 100 -57.231 21.081 94.099 1.00 0.00 H new ATOM 0 HG22 THR A 100 -57.615 19.843 95.319 1.00 0.00 H new ATOM 0 HG23 THR A 100 -58.893 20.925 94.715 1.00 0.00 H new ATOM 1529 N LEU A 101 -59.088 19.545 98.507 1.00 0.00 N ATOM 1530 CA LEU A 101 -58.948 18.402 99.414 1.00 0.00 C ATOM 1531 C LEU A 101 -59.778 17.170 99.017 1.00 0.00 C ATOM 1532 O LEU A 101 -60.871 17.256 98.462 1.00 0.00 O ATOM 1533 CB LEU A 101 -59.164 18.827 100.884 1.00 0.00 C ATOM 1534 CG LEU A 101 -60.598 19.187 101.330 1.00 0.00 C ATOM 1535 CD1 LEU A 101 -60.665 19.165 102.859 1.00 0.00 C ATOM 1536 CD2 LEU A 101 -61.043 20.587 100.891 1.00 0.00 C ATOM 0 H LEU A 101 -60.059 19.782 98.304 1.00 0.00 H new ATOM 0 HA LEU A 101 -57.916 18.065 99.315 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -58.809 18.017 101.522 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -58.527 19.689 101.080 1.00 0.00 H new ATOM 0 HG LEU A 101 -61.254 18.453 100.862 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -61.675 19.418 103.183 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -60.407 18.169 103.220 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -59.961 19.892 103.265 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -62.059 20.771 101.239 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -60.372 21.333 101.318 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -61.014 20.654 99.803 1.00 0.00 H new ATOM 1548 N HIS A 102 -59.200 16.009 99.318 1.00 0.00 N ATOM 1549 CA HIS A 102 -59.621 14.654 98.970 1.00 0.00 C ATOM 1550 C HIS A 102 -60.847 14.140 99.741 1.00 0.00 C ATOM 1551 O HIS A 102 -60.900 14.252 100.963 1.00 0.00 O ATOM 1552 CB HIS A 102 -58.417 13.739 99.263 1.00 0.00 C ATOM 1553 CG HIS A 102 -57.711 13.949 100.597 1.00 0.00 C ATOM 1554 ND1 HIS A 102 -58.181 14.597 101.730 1.00 0.00 N ATOM 1555 CD2 HIS A 102 -56.445 13.512 100.885 1.00 0.00 C ATOM 1556 CE1 HIS A 102 -57.211 14.560 102.657 1.00 0.00 C ATOM 1557 NE2 HIS A 102 -56.136 13.910 102.188 1.00 0.00 N ATOM 0 H HIS A 102 -58.340 15.993 99.866 1.00 0.00 H new ATOM 0 HA HIS A 102 -59.927 14.655 97.924 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -58.756 12.704 99.216 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -57.686 13.872 98.466 1.00 0.00 H new ATOM 0 HD1 HIS A 102 -59.100 15.025 101.839 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -55.799 12.957 100.221 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -57.286 14.993 103.643 1.00 0.00 H new ATOM 1565 N TRP A 103 -61.774 13.462 99.056 1.00 0.00 N ATOM 1566 CA TRP A 103 -62.828 12.657 99.681 1.00 0.00 C ATOM 1567 C TRP A 103 -63.243 11.463 98.819 1.00 0.00 C ATOM 1568 O TRP A 103 -63.761 11.644 97.714 1.00 0.00 O ATOM 1569 CB TRP A 103 -64.066 13.509 99.957 1.00 0.00 C ATOM 1570 CG TRP A 103 -65.146 12.793 100.705 1.00 0.00 C ATOM 1571 CD1 TRP A 103 -66.326 12.383 100.189 1.00 0.00 C ATOM 1572 CD2 TRP A 103 -65.141 12.349 102.094 1.00 0.00 C ATOM 1573 NE1 TRP A 103 -67.079 11.778 101.180 1.00 0.00 N ATOM 1574 CE2 TRP A 103 -66.394 11.731 102.370 1.00 0.00 C ATOM 1575 CE3 TRP A 103 -64.201 12.390 103.144 1.00 0.00 C ATOM 1576 CZ2 TRP A 103 -66.721 11.224 103.634 1.00 0.00 C ATOM 1577 CZ3 TRP A 103 -64.516 11.874 104.414 1.00 0.00 C ATOM 1578 CH2 TRP A 103 -65.780 11.314 104.670 1.00 0.00 C ATOM 0 H TRP A 103 -61.813 13.457 98.037 1.00 0.00 H new ATOM 0 HA TRP A 103 -62.410 12.281 100.614 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -63.768 14.390 100.525 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -64.469 13.863 99.008 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -66.634 12.508 99.161 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -68.022 11.414 101.044 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -63.227 12.823 102.971 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -67.685 10.770 103.809 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -63.778 11.908 105.202 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -66.025 10.955 105.659 1.00 0.00 H new ATOM 1589 N PHE A 104 -63.101 10.253 99.373 1.00 0.00 N ATOM 1590 CA PHE A 104 -63.743 9.050 98.853 1.00 0.00 C ATOM 1591 C PHE A 104 -65.093 8.841 99.549 1.00 0.00 C ATOM 1592 O PHE A 104 -65.135 8.479 100.728 1.00 0.00 O ATOM 1593 CB PHE A 104 -62.812 7.839 98.995 1.00 0.00 C ATOM 1594 CG PHE A 104 -63.270 6.619 98.211 1.00 0.00 C ATOM 1595 CD1 PHE A 104 -64.397 5.882 98.620 1.00 0.00 C ATOM 1596 CD2 PHE A 104 -62.583 6.230 97.046 1.00 0.00 C ATOM 1597 CE1 PHE A 104 -64.849 4.787 97.866 1.00 0.00 C ATOM 1598 CE2 PHE A 104 -63.033 5.136 96.285 1.00 0.00 C ATOM 1599 CZ PHE A 104 -64.170 4.416 96.693 1.00 0.00 C ATOM 0 H PHE A 104 -62.531 10.085 100.202 1.00 0.00 H new ATOM 0 HA PHE A 104 -63.939 9.170 97.788 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -61.813 8.119 98.662 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -62.734 7.574 100.049 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -64.920 6.161 99.523 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -61.704 6.775 96.734 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -65.717 4.231 98.187 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -62.505 4.849 95.387 1.00 0.00 H new ATOM 0 HZ PHE A 104 -64.521 3.580 96.106 1.00 0.00 H new ATOM 1609 N ARG A 105 -66.199 9.069 98.830 1.00 0.00 N ATOM 1610 CA ARG A 105 -67.556 8.858 99.359 1.00 0.00 C ATOM 1611 C ARG A 105 -67.797 7.380 99.681 1.00 0.00 C ATOM 1612 O ARG A 105 -67.505 6.517 98.856 1.00 0.00 O ATOM 1613 CB ARG A 105 -68.574 9.398 98.353 1.00 0.00 C ATOM 1614 CG ARG A 105 -69.973 9.590 98.953 1.00 0.00 C ATOM 1615 CD ARG A 105 -70.941 10.117 97.892 1.00 0.00 C ATOM 1616 NE ARG A 105 -72.248 10.447 98.475 1.00 0.00 N ATOM 1617 CZ ARG A 105 -73.349 10.771 97.812 1.00 0.00 C ATOM 1618 NH1 ARG A 105 -73.411 10.911 96.518 1.00 0.00 N ATOM 1619 NH2 ARG A 105 -74.439 11.058 98.463 1.00 0.00 N ATOM 0 H ARG A 105 -66.181 9.404 97.867 1.00 0.00 H new ATOM 0 HA ARG A 105 -67.671 9.402 100.296 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -68.219 10.352 97.963 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -68.639 8.712 97.508 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -70.339 8.643 99.349 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -69.924 10.288 99.789 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -70.518 11.003 97.419 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -71.068 9.369 97.110 1.00 0.00 H new ATOM 0 HE ARG A 105 -72.315 10.425 99.493 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -72.576 10.769 95.949 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -74.294 11.162 96.074 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -74.445 11.033 99.483 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -75.287 11.307 97.953 1.00 0.00 H new ATOM 1633 N LYS A 106 -68.328 7.095 100.877 1.00 0.00 N ATOM 1634 CA LYS A 106 -68.477 5.747 101.460 1.00 0.00 C ATOM 1635 C LYS A 106 -67.181 4.923 101.390 1.00 0.00 C ATOM 1636 O LYS A 106 -67.155 3.800 100.891 1.00 0.00 O ATOM 1637 CB LYS A 106 -69.708 5.029 100.866 1.00 0.00 C ATOM 1638 CG LYS A 106 -70.980 5.793 101.244 1.00 0.00 C ATOM 1639 CD LYS A 106 -72.283 5.128 100.786 1.00 0.00 C ATOM 1640 CE LYS A 106 -73.482 5.706 101.556 1.00 0.00 C ATOM 1641 NZ LYS A 106 -73.552 7.187 101.488 1.00 0.00 N ATOM 0 H LYS A 106 -68.682 7.826 101.494 1.00 0.00 H new ATOM 0 HA LYS A 106 -68.667 5.861 102.527 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -69.617 4.967 99.782 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -69.761 4.007 101.240 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -71.009 5.911 102.327 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -70.928 6.794 100.815 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -72.421 5.284 99.716 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -72.225 4.051 100.947 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -74.403 5.285 101.153 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -73.420 5.398 102.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -74.455 7.511 101.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -72.764 7.597 102.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -73.486 7.492 100.496 1.00 0.00 H new