USER MOD reduce.3.24.130724 H: found=0, std=0, add=727, rem=0, adj=26 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 27 THR OG1 : rot -136:sc= 1.07 USER MOD Set 1.2: A 29 HIS : no HE2:sc= 1.19 K(o=4.3,f=-1.1!) USER MOD Set 1.3: A 31 THR OG1 : rot -152:sc= 1.99 USER MOD Set 2.1: A 19 SER OG : rot 131:sc= 0.476 USER MOD Set 2.2: A 37 LYS NZ :NH3+ -159:sc= 1.59 (180deg=1.05) USER MOD Single : A 13 MET CE :methyl -163:sc= 0 (180deg=-0.187) USER MOD Single : A 15 SER OG : rot 180:sc=0.000613 USER MOD Single : A 17 LYS NZ :NH3+ -173:sc= 2.36 (180deg=2.29) USER MOD Single : A 22 LYS NZ :NH3+ 151:sc= 2.47 (180deg=1.43) USER MOD Single : A 24 MET CE :methyl 146:sc= -0.435 (180deg=-0.857) USER MOD Single : A 28 GLN : amide:sc= -0.0389 K(o=-0.039,f=-2.8!) USER MOD Single : A 32 THR OG1 : rot 143:sc= 0.689 USER MOD Single : A 35 LYS NZ :NH3+ 133:sc= 2.36 (180deg=0.399) USER MOD Single : A 38 TYR OH : rot 130:sc= -0.0643 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= 1.28 K(o=1.3,f=-0.79) USER MOD Single : A 56 LYS NZ :NH3+ -172:sc= 3.2 (180deg=2.94) USER MOD Single : A 58 LYS NZ :NH3+ -143:sc= 2.11 (180deg=-1.6) USER MOD Single : A 65 SER OG : rot -39:sc= 1.12 USER MOD Single : A 66 SER OG : rot 180:sc=0.000227 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= 1.23 K(o=1.2,f=-0.03) USER MOD Single : A 73 THR OG1 : rot 25:sc= 0.164 USER MOD Single : A 74 ASN : amide:sc= -0.0119 K(o=-0.012,f=-0.96) USER MOD Single : A 75 SER OG : rot -100:sc= 0 USER MOD Single : A 77 THR OG1 : rot 170:sc= 1.13 USER MOD Single : A 78 ASN : amide:sc=-0.00641 X(o=-0.0064,f=-0.45) USER MOD Single : A 88 SER OG : rot 9:sc= 1.13 USER MOD Single : A 89 TYR OH : rot -7:sc= 1.14 USER MOD Single : A 96 ASN : amide:sc= -0.271 X(o=-0.27,f=-0.6) USER MOD Single : A 97 SER OG : rot -124:sc= 1.22 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 HIS : no HD1:sc= 0.422 K(o=0.42,f=-2.4!) USER MOD Single : A 106 LYS NZ :NH3+ 151:sc= 1.27 (180deg=1.15) USER MOD ----------------------------------------------------------------- ATOM 211 N MET A 13 -68.304 36.195 95.251 1.00 0.00 N ATOM 212 CA MET A 13 -67.312 36.812 96.153 1.00 0.00 C ATOM 213 C MET A 13 -65.894 36.199 96.122 1.00 0.00 C ATOM 214 O MET A 13 -65.135 36.475 95.199 1.00 0.00 O ATOM 215 CB MET A 13 -67.932 36.907 97.565 1.00 0.00 C ATOM 216 CG MET A 13 -68.828 38.140 97.728 1.00 0.00 C ATOM 217 SD MET A 13 -67.958 39.730 97.774 1.00 0.00 S ATOM 218 CE MET A 13 -67.127 39.622 99.382 1.00 0.00 C ATOM 0 HA MET A 13 -67.105 37.814 95.777 1.00 0.00 H new ATOM 0 HB2 MET A 13 -68.516 36.008 97.764 1.00 0.00 H new ATOM 0 HB3 MET A 13 -67.135 36.940 98.307 1.00 0.00 H new ATOM 0 HG2 MET A 13 -69.544 38.160 96.906 1.00 0.00 H new ATOM 0 HG3 MET A 13 -69.402 38.032 98.648 1.00 0.00 H new ATOM 0 HE1 MET A 13 -66.806 40.616 99.693 1.00 0.00 H new ATOM 0 HE2 MET A 13 -67.817 39.216 100.122 1.00 0.00 H new ATOM 0 HE3 MET A 13 -66.258 38.969 99.299 1.00 0.00 H new ATOM 228 N CYS A 14 -65.466 35.509 97.188 1.00 0.00 N ATOM 229 CA CYS A 14 -64.094 35.658 97.687 1.00 0.00 C ATOM 230 C CYS A 14 -63.025 34.876 96.916 1.00 0.00 C ATOM 231 O CYS A 14 -62.867 33.672 97.096 1.00 0.00 O ATOM 232 CB CYS A 14 -64.055 35.306 99.174 1.00 0.00 C ATOM 233 SG CYS A 14 -64.687 36.631 100.228 1.00 0.00 S ATOM 0 H CYS A 14 -66.041 34.851 97.714 1.00 0.00 H new ATOM 0 HA CYS A 14 -63.831 36.703 97.526 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -64.641 34.403 99.344 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -63.028 35.078 99.461 1.00 0.00 H new ATOM 238 N SER A 15 -62.204 35.602 96.151 1.00 0.00 N ATOM 239 CA SER A 15 -60.935 35.118 95.597 1.00 0.00 C ATOM 240 C SER A 15 -59.829 34.889 96.647 1.00 0.00 C ATOM 241 O SER A 15 -58.796 34.297 96.320 1.00 0.00 O ATOM 242 CB SER A 15 -60.443 36.112 94.538 1.00 0.00 C ATOM 243 OG SER A 15 -60.324 37.400 95.113 1.00 0.00 O ATOM 0 H SER A 15 -62.409 36.567 95.893 1.00 0.00 H new ATOM 0 HA SER A 15 -61.139 34.139 95.163 1.00 0.00 H new ATOM 0 HB2 SER A 15 -59.480 35.789 94.142 1.00 0.00 H new ATOM 0 HB3 SER A 15 -61.139 36.140 93.700 1.00 0.00 H new ATOM 0 HG SER A 15 -60.008 38.033 94.435 1.00 0.00 H new ATOM 249 N GLY A 16 -60.035 35.319 97.901 1.00 0.00 N ATOM 250 CA GLY A 16 -59.115 35.139 99.030 1.00 0.00 C ATOM 251 C GLY A 16 -59.211 33.764 99.713 1.00 0.00 C ATOM 252 O GLY A 16 -60.084 32.956 99.408 1.00 0.00 O ATOM 0 H GLY A 16 -60.882 35.822 98.165 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -58.094 35.286 98.678 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -59.312 35.914 99.771 1.00 0.00 H new ATOM 256 N LYS A 17 -58.275 33.501 100.636 1.00 0.00 N ATOM 257 CA LYS A 17 -58.036 32.189 101.260 1.00 0.00 C ATOM 258 C LYS A 17 -59.053 31.812 102.350 1.00 0.00 C ATOM 259 O LYS A 17 -59.673 32.669 102.977 1.00 0.00 O ATOM 260 CB LYS A 17 -56.610 32.184 101.847 1.00 0.00 C ATOM 261 CG LYS A 17 -55.937 30.804 101.749 1.00 0.00 C ATOM 262 CD LYS A 17 -54.601 30.739 102.505 1.00 0.00 C ATOM 263 CE LYS A 17 -54.751 30.844 104.031 1.00 0.00 C ATOM 264 NZ LYS A 17 -55.379 29.647 104.634 1.00 0.00 N ATOM 0 H LYS A 17 -57.640 34.221 100.982 1.00 0.00 H new ATOM 0 HA LYS A 17 -58.154 31.436 100.480 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -56.001 32.920 101.321 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -56.650 32.492 102.892 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -56.612 30.046 102.147 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -55.768 30.561 100.700 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -54.101 29.802 102.261 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -53.956 31.545 102.156 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -53.768 30.996 104.478 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -55.350 31.722 104.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -55.562 29.822 105.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -56.276 29.444 104.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -54.740 28.832 104.534 1.00 0.00 H new ATOM 278 N PHE A 18 -59.121 30.515 102.650 1.00 0.00 N ATOM 279 CA PHE A 18 -59.901 29.885 103.721 1.00 0.00 C ATOM 280 C PHE A 18 -59.002 28.928 104.535 1.00 0.00 C ATOM 281 O PHE A 18 -57.866 28.672 104.127 1.00 0.00 O ATOM 282 CB PHE A 18 -61.097 29.155 103.068 1.00 0.00 C ATOM 283 CG PHE A 18 -62.101 30.088 102.417 1.00 0.00 C ATOM 284 CD1 PHE A 18 -61.884 30.570 101.110 1.00 0.00 C ATOM 285 CD2 PHE A 18 -63.224 30.526 103.144 1.00 0.00 C ATOM 286 CE1 PHE A 18 -62.734 31.549 100.568 1.00 0.00 C ATOM 287 CE2 PHE A 18 -64.068 31.509 102.605 1.00 0.00 C ATOM 288 CZ PHE A 18 -63.809 32.037 101.326 1.00 0.00 C ATOM 0 H PHE A 18 -58.595 29.825 102.113 1.00 0.00 H new ATOM 0 HA PHE A 18 -60.282 30.627 104.422 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -60.721 28.460 102.317 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -61.606 28.560 103.826 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -61.062 30.186 100.524 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -63.436 30.106 104.116 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -62.560 31.925 99.571 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -64.917 31.861 103.172 1.00 0.00 H new ATOM 0 HZ PHE A 18 -64.439 32.819 100.928 1.00 0.00 H new ATOM 298 N SER A 19 -59.502 28.354 105.640 1.00 0.00 N ATOM 299 CA SER A 19 -58.952 27.133 106.258 1.00 0.00 C ATOM 300 C SER A 19 -59.977 26.002 106.303 1.00 0.00 C ATOM 301 O SER A 19 -61.160 26.229 106.574 1.00 0.00 O ATOM 302 CB SER A 19 -58.394 27.356 107.666 1.00 0.00 C ATOM 303 OG SER A 19 -59.416 27.541 108.623 1.00 0.00 O ATOM 0 H SER A 19 -60.310 28.728 106.137 1.00 0.00 H new ATOM 0 HA SER A 19 -58.122 26.849 105.611 1.00 0.00 H new ATOM 0 HB2 SER A 19 -57.782 26.501 107.952 1.00 0.00 H new ATOM 0 HB3 SER A 19 -57.741 28.228 107.662 1.00 0.00 H new ATOM 0 HG SER A 19 -59.254 26.955 109.392 1.00 0.00 H new ATOM 309 N ILE A 20 -59.490 24.775 106.091 1.00 0.00 N ATOM 310 CA ILE A 20 -60.194 23.540 106.419 1.00 0.00 C ATOM 311 C ILE A 20 -60.200 23.413 107.946 1.00 0.00 C ATOM 312 O ILE A 20 -59.185 23.125 108.572 1.00 0.00 O ATOM 313 CB ILE A 20 -59.597 22.330 105.656 1.00 0.00 C ATOM 314 CG1 ILE A 20 -60.318 21.010 105.996 1.00 0.00 C ATOM 315 CG2 ILE A 20 -58.078 22.137 105.838 1.00 0.00 C ATOM 316 CD1 ILE A 20 -61.786 21.003 105.559 1.00 0.00 C ATOM 0 H ILE A 20 -58.572 24.614 105.676 1.00 0.00 H new ATOM 0 HA ILE A 20 -61.231 23.560 106.084 1.00 0.00 H new ATOM 0 HB ILE A 20 -59.764 22.583 104.609 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -59.797 20.183 105.514 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -60.263 20.838 107.071 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -57.751 21.267 105.268 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -57.553 23.023 105.481 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -57.855 21.984 106.894 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -62.240 20.049 105.825 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -62.319 21.811 106.061 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -61.845 21.145 104.480 1.00 0.00 H new ATOM 328 N ASP A 21 -61.334 23.759 108.549 1.00 0.00 N ATOM 329 CA ASP A 21 -61.470 24.029 109.980 1.00 0.00 C ATOM 330 C ASP A 21 -62.210 22.873 110.696 1.00 0.00 C ATOM 331 O ASP A 21 -62.143 22.740 111.918 1.00 0.00 O ATOM 332 CB ASP A 21 -62.118 25.422 110.091 1.00 0.00 C ATOM 333 CG ASP A 21 -61.865 26.141 111.418 1.00 0.00 C ATOM 334 OD1 ASP A 21 -62.641 25.880 112.372 1.00 0.00 O ATOM 335 OD2 ASP A 21 -60.929 26.974 111.436 1.00 0.00 O ATOM 0 H ASP A 21 -62.212 23.863 108.040 1.00 0.00 H new ATOM 0 HA ASP A 21 -60.516 24.061 110.506 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -61.746 26.046 109.278 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -63.194 25.320 109.948 1.00 0.00 H new ATOM 340 N LYS A 22 -62.842 21.971 109.926 1.00 0.00 N ATOM 341 CA LYS A 22 -63.043 20.544 110.222 1.00 0.00 C ATOM 342 C LYS A 22 -63.075 19.764 108.904 1.00 0.00 C ATOM 343 O LYS A 22 -63.693 20.218 107.940 1.00 0.00 O ATOM 344 CB LYS A 22 -64.349 20.293 111.005 1.00 0.00 C ATOM 345 CG LYS A 22 -64.401 18.878 111.607 1.00 0.00 C ATOM 346 CD LYS A 22 -65.767 18.485 112.194 1.00 0.00 C ATOM 347 CE LYS A 22 -66.896 18.273 111.167 1.00 0.00 C ATOM 348 NZ LYS A 22 -66.570 17.247 110.150 1.00 0.00 N ATOM 0 H LYS A 22 -63.249 22.234 109.029 1.00 0.00 H new ATOM 0 HA LYS A 22 -62.217 20.207 110.849 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -64.440 21.030 111.803 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -65.202 20.436 110.341 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -64.131 18.158 110.835 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -63.647 18.802 112.391 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -65.645 17.567 112.768 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -66.078 19.260 112.895 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -67.806 17.980 111.691 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -67.106 19.218 110.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -67.446 16.795 109.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -66.087 17.696 109.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -65.947 16.528 110.570 1.00 0.00 H new ATOM 362 N GLU A 23 -62.461 18.578 108.923 1.00 0.00 N ATOM 363 CA GLU A 23 -62.544 17.490 107.939 1.00 0.00 C ATOM 364 C GLU A 23 -63.976 17.135 107.500 1.00 0.00 C ATOM 365 O GLU A 23 -64.956 17.595 108.083 1.00 0.00 O ATOM 366 CB GLU A 23 -61.811 16.259 108.525 1.00 0.00 C ATOM 367 CG GLU A 23 -62.159 15.835 109.973 1.00 0.00 C ATOM 368 CD GLU A 23 -63.460 15.029 110.113 1.00 0.00 C ATOM 369 OE1 GLU A 23 -63.381 13.798 109.901 1.00 0.00 O ATOM 370 OE2 GLU A 23 -64.511 15.626 110.451 1.00 0.00 O ATOM 0 H GLU A 23 -61.839 18.331 109.693 1.00 0.00 H new ATOM 0 HA GLU A 23 -62.063 17.833 107.023 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -62.007 15.409 107.871 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -60.740 16.455 108.481 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -61.336 15.241 110.371 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -62.234 16.730 110.591 1.00 0.00 H new ATOM 377 N MET A 24 -64.114 16.300 106.467 1.00 0.00 N ATOM 378 CA MET A 24 -65.402 15.745 106.039 1.00 0.00 C ATOM 379 C MET A 24 -65.861 14.537 106.877 1.00 0.00 C ATOM 380 O MET A 24 -65.115 13.579 107.093 1.00 0.00 O ATOM 381 CB MET A 24 -65.308 15.366 104.558 1.00 0.00 C ATOM 382 CG MET A 24 -65.838 16.504 103.695 1.00 0.00 C ATOM 383 SD MET A 24 -65.538 16.319 101.927 1.00 0.00 S ATOM 384 CE MET A 24 -63.811 16.861 101.923 1.00 0.00 C ATOM 0 H MET A 24 -63.327 15.987 105.898 1.00 0.00 H new ATOM 0 HA MET A 24 -66.158 16.515 106.193 1.00 0.00 H new ATOM 0 HB2 MET A 24 -64.273 15.150 104.294 1.00 0.00 H new ATOM 0 HB3 MET A 24 -65.881 14.458 104.369 1.00 0.00 H new ATOM 0 HG2 MET A 24 -66.912 16.595 103.859 1.00 0.00 H new ATOM 0 HG3 MET A 24 -65.384 17.437 104.030 1.00 0.00 H new ATOM 0 HE1 MET A 24 -63.257 16.306 101.165 1.00 0.00 H new ATOM 0 HE2 MET A 24 -63.765 17.927 101.699 1.00 0.00 H new ATOM 0 HE3 MET A 24 -63.370 16.677 102.902 1.00 0.00 H new ATOM 394 N ALA A 25 -67.138 14.559 107.276 1.00 0.00 N ATOM 395 CA ALA A 25 -67.827 13.497 108.013 1.00 0.00 C ATOM 396 C ALA A 25 -69.153 13.126 107.322 1.00 0.00 C ATOM 397 O ALA A 25 -70.047 13.968 107.228 1.00 0.00 O ATOM 398 CB ALA A 25 -68.050 13.977 109.452 1.00 0.00 C ATOM 0 H ALA A 25 -67.746 15.355 107.084 1.00 0.00 H new ATOM 0 HA ALA A 25 -67.219 12.592 108.028 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -68.563 13.200 110.019 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -67.088 14.191 109.917 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -68.658 14.881 109.444 1.00 0.00 H new ATOM 404 N GLU A 26 -69.270 11.894 106.803 1.00 0.00 N ATOM 405 CA GLU A 26 -70.466 11.437 106.076 1.00 0.00 C ATOM 406 C GLU A 26 -71.681 11.217 106.993 1.00 0.00 C ATOM 407 O GLU A 26 -71.543 10.862 108.163 1.00 0.00 O ATOM 408 CB GLU A 26 -70.158 10.168 105.259 1.00 0.00 C ATOM 409 CG GLU A 26 -70.748 10.227 103.838 1.00 0.00 C ATOM 410 CD GLU A 26 -70.244 9.084 102.956 1.00 0.00 C ATOM 411 OE1 GLU A 26 -69.011 9.001 102.732 1.00 0.00 O ATOM 412 OE2 GLU A 26 -71.057 8.231 102.540 1.00 0.00 O ATOM 0 H GLU A 26 -68.539 11.186 106.875 1.00 0.00 H new ATOM 0 HA GLU A 26 -70.738 12.240 105.391 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -69.078 10.033 105.196 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -70.558 9.298 105.780 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -71.836 10.187 103.896 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -70.489 11.180 103.378 1.00 0.00 H new ATOM 419 N THR A 27 -72.882 11.385 106.436 1.00 0.00 N ATOM 420 CA THR A 27 -74.175 11.268 107.122 1.00 0.00 C ATOM 421 C THR A 27 -74.909 9.975 106.735 1.00 0.00 C ATOM 422 O THR A 27 -74.574 9.317 105.747 1.00 0.00 O ATOM 423 CB THR A 27 -75.065 12.472 106.762 1.00 0.00 C ATOM 424 OG1 THR A 27 -75.370 12.393 105.392 1.00 0.00 O ATOM 425 CG2 THR A 27 -74.427 13.831 107.046 1.00 0.00 C ATOM 0 H THR A 27 -72.987 11.617 105.448 1.00 0.00 H new ATOM 0 HA THR A 27 -73.978 11.246 108.194 1.00 0.00 H new ATOM 0 HB THR A 27 -75.951 12.414 107.394 1.00 0.00 H new ATOM 0 HG1 THR A 27 -75.277 13.279 104.984 1.00 0.00 H new ATOM 0 HG21 THR A 27 -75.120 14.624 106.764 1.00 0.00 H new ATOM 0 HG22 THR A 27 -74.198 13.910 108.109 1.00 0.00 H new ATOM 0 HG23 THR A 27 -73.508 13.929 106.468 1.00 0.00 H new ATOM 433 N GLN A 28 -75.986 9.642 107.461 1.00 0.00 N ATOM 434 CA GLN A 28 -76.949 8.616 107.030 1.00 0.00 C ATOM 435 C GLN A 28 -77.735 9.034 105.767 1.00 0.00 C ATOM 436 O GLN A 28 -78.126 8.180 104.977 1.00 0.00 O ATOM 437 CB GLN A 28 -77.877 8.193 108.191 1.00 0.00 C ATOM 438 CG GLN A 28 -78.400 9.301 109.127 1.00 0.00 C ATOM 439 CD GLN A 28 -79.074 10.450 108.392 1.00 0.00 C ATOM 440 OE1 GLN A 28 -78.440 11.449 108.085 1.00 0.00 O ATOM 441 NE2 GLN A 28 -80.340 10.331 108.045 1.00 0.00 N ATOM 0 H GLN A 28 -76.214 10.072 108.357 1.00 0.00 H new ATOM 0 HA GLN A 28 -76.373 7.737 106.743 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -78.739 7.681 107.763 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -77.342 7.464 108.800 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -79.109 8.866 109.831 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -77.568 9.693 109.713 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -80.863 9.495 108.304 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -80.796 11.075 107.517 1.00 0.00 H new ATOM 450 N HIS A 29 -77.890 10.344 105.537 1.00 0.00 N ATOM 451 CA HIS A 29 -78.366 10.979 104.306 1.00 0.00 C ATOM 452 C HIS A 29 -77.374 10.805 103.130 1.00 0.00 C ATOM 453 O HIS A 29 -77.711 11.110 101.989 1.00 0.00 O ATOM 454 CB HIS A 29 -78.659 12.454 104.669 1.00 0.00 C ATOM 455 CG HIS A 29 -79.170 13.380 103.590 1.00 0.00 C ATOM 456 ND1 HIS A 29 -78.930 14.737 103.530 1.00 0.00 N ATOM 457 CD2 HIS A 29 -80.032 13.069 102.572 1.00 0.00 C ATOM 458 CE1 HIS A 29 -79.634 15.227 102.497 1.00 0.00 C ATOM 459 NE2 HIS A 29 -80.318 14.250 101.882 1.00 0.00 N ATOM 0 H HIS A 29 -77.671 11.033 106.256 1.00 0.00 H new ATOM 0 HA HIS A 29 -79.274 10.502 103.937 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -79.388 12.456 105.479 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -77.740 12.885 105.066 1.00 0.00 H new ATOM 0 HD1 HIS A 29 -78.327 15.271 104.156 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -80.421 12.088 102.344 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -79.648 16.266 102.201 1.00 0.00 H new ATOM 467 N GLY A 30 -76.161 10.283 103.376 1.00 0.00 N ATOM 468 CA GLY A 30 -75.139 9.998 102.366 1.00 0.00 C ATOM 469 C GLY A 30 -74.402 11.237 101.852 1.00 0.00 C ATOM 470 O GLY A 30 -73.548 11.112 100.974 1.00 0.00 O ATOM 0 H GLY A 30 -75.858 10.041 104.319 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -74.411 9.305 102.788 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -75.609 9.493 101.522 1.00 0.00 H new ATOM 474 N THR A 31 -74.745 12.419 102.366 1.00 0.00 N ATOM 475 CA THR A 31 -73.991 13.673 102.281 1.00 0.00 C ATOM 476 C THR A 31 -72.767 13.619 103.199 1.00 0.00 C ATOM 477 O THR A 31 -72.617 12.692 103.992 1.00 0.00 O ATOM 478 CB THR A 31 -74.895 14.836 102.727 1.00 0.00 C ATOM 479 OG1 THR A 31 -75.423 14.568 104.014 1.00 0.00 O ATOM 480 CG2 THR A 31 -76.053 15.045 101.756 1.00 0.00 C ATOM 0 H THR A 31 -75.614 12.535 102.887 1.00 0.00 H new ATOM 0 HA THR A 31 -73.663 13.820 101.252 1.00 0.00 H new ATOM 0 HB THR A 31 -74.286 15.740 102.747 1.00 0.00 H new ATOM 0 HG1 THR A 31 -76.285 15.022 104.115 1.00 0.00 H new ATOM 0 HG21 THR A 31 -76.672 15.874 102.101 1.00 0.00 H new ATOM 0 HG22 THR A 31 -75.660 15.273 100.765 1.00 0.00 H new ATOM 0 HG23 THR A 31 -76.656 14.138 101.708 1.00 0.00 H new ATOM 488 N THR A 32 -71.895 14.626 103.141 1.00 0.00 N ATOM 489 CA THR A 32 -70.773 14.796 104.065 1.00 0.00 C ATOM 490 C THR A 32 -70.689 16.234 104.570 1.00 0.00 C ATOM 491 O THR A 32 -71.051 17.169 103.855 1.00 0.00 O ATOM 492 CB THR A 32 -69.474 14.288 103.420 1.00 0.00 C ATOM 493 OG1 THR A 32 -68.449 14.264 104.378 1.00 0.00 O ATOM 494 CG2 THR A 32 -68.995 15.097 102.215 1.00 0.00 C ATOM 0 H THR A 32 -71.950 15.361 102.436 1.00 0.00 H new ATOM 0 HA THR A 32 -70.938 14.185 104.953 1.00 0.00 H new ATOM 0 HB THR A 32 -69.709 13.291 103.048 1.00 0.00 H new ATOM 0 HG1 THR A 32 -67.882 13.479 104.230 1.00 0.00 H new ATOM 0 HG21 THR A 32 -68.073 14.663 101.829 1.00 0.00 H new ATOM 0 HG22 THR A 32 -69.759 15.078 101.437 1.00 0.00 H new ATOM 0 HG23 THR A 32 -68.811 16.128 102.518 1.00 0.00 H new ATOM 502 N VAL A 33 -70.259 16.399 105.827 1.00 0.00 N ATOM 503 CA VAL A 33 -70.304 17.663 106.569 1.00 0.00 C ATOM 504 C VAL A 33 -68.887 18.148 106.882 1.00 0.00 C ATOM 505 O VAL A 33 -68.209 17.608 107.764 1.00 0.00 O ATOM 506 CB VAL A 33 -71.187 17.584 107.833 1.00 0.00 C ATOM 507 CG1 VAL A 33 -71.490 19.003 108.342 1.00 0.00 C ATOM 508 CG2 VAL A 33 -72.530 16.887 107.570 1.00 0.00 C ATOM 0 H VAL A 33 -69.859 15.634 106.371 1.00 0.00 H new ATOM 0 HA VAL A 33 -70.782 18.403 105.927 1.00 0.00 H new ATOM 0 HB VAL A 33 -70.630 17.004 108.568 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -72.113 18.944 109.234 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -70.556 19.510 108.585 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -72.016 19.563 107.568 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -73.112 16.858 108.491 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -73.083 17.438 106.809 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -72.350 15.870 107.223 1.00 0.00 H new ATOM 518 N VAL A 34 -68.453 19.157 106.120 1.00 0.00 N ATOM 519 CA VAL A 34 -67.185 19.892 106.274 1.00 0.00 C ATOM 520 C VAL A 34 -67.361 21.048 107.272 1.00 0.00 C ATOM 521 O VAL A 34 -68.496 21.435 107.560 1.00 0.00 O ATOM 522 CB VAL A 34 -66.710 20.484 104.914 1.00 0.00 C ATOM 523 CG1 VAL A 34 -65.181 20.407 104.815 1.00 0.00 C ATOM 524 CG2 VAL A 34 -67.320 19.838 103.657 1.00 0.00 C ATOM 0 H VAL A 34 -69.004 19.505 105.335 1.00 0.00 H new ATOM 0 HA VAL A 34 -66.439 19.187 106.640 1.00 0.00 H new ATOM 0 HB VAL A 34 -67.068 21.514 104.924 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -64.857 20.823 103.861 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -64.734 20.977 105.630 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -64.864 19.366 104.884 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -66.921 20.325 102.767 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -67.068 18.778 103.634 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -68.404 19.953 103.678 1.00 0.00 H new ATOM 534 N LYS A 35 -66.267 21.685 107.723 1.00 0.00 N ATOM 535 CA LYS A 35 -66.308 23.038 108.310 1.00 0.00 C ATOM 536 C LYS A 35 -65.197 23.921 107.735 1.00 0.00 C ATOM 537 O LYS A 35 -64.022 23.554 107.788 1.00 0.00 O ATOM 538 CB LYS A 35 -66.266 22.963 109.848 1.00 0.00 C ATOM 539 CG LYS A 35 -66.706 24.245 110.580 1.00 0.00 C ATOM 540 CD LYS A 35 -65.714 24.686 111.670 1.00 0.00 C ATOM 541 CE LYS A 35 -65.424 23.673 112.782 1.00 0.00 C ATOM 542 NZ LYS A 35 -64.094 23.923 113.391 1.00 0.00 N ATOM 0 H LYS A 35 -65.332 21.279 107.692 1.00 0.00 H new ATOM 0 HA LYS A 35 -67.253 23.509 108.038 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -66.904 22.141 110.173 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -65.249 22.719 110.156 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -66.821 25.050 109.854 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -67.684 24.081 111.032 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -64.771 24.943 111.189 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -66.096 25.597 112.130 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -66.197 23.736 113.548 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -65.459 22.662 112.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -64.178 23.905 114.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -63.428 23.186 113.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -63.743 24.854 113.088 1.00 0.00 H new ATOM 556 N VAL A 36 -65.574 25.079 107.186 1.00 0.00 N ATOM 557 CA VAL A 36 -64.644 26.107 106.690 1.00 0.00 C ATOM 558 C VAL A 36 -64.427 27.190 107.749 1.00 0.00 C ATOM 559 O VAL A 36 -65.254 27.357 108.647 1.00 0.00 O ATOM 560 CB VAL A 36 -65.133 26.754 105.365 1.00 0.00 C ATOM 561 CG1 VAL A 36 -65.839 25.749 104.448 1.00 0.00 C ATOM 562 CG2 VAL A 36 -66.072 27.956 105.549 1.00 0.00 C ATOM 0 H VAL A 36 -66.554 25.337 107.070 1.00 0.00 H new ATOM 0 HA VAL A 36 -63.698 25.606 106.483 1.00 0.00 H new ATOM 0 HB VAL A 36 -64.209 27.108 104.908 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -66.161 26.252 103.536 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -65.151 24.943 104.194 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -66.708 25.337 104.961 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -66.363 28.343 104.573 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -66.962 27.642 106.095 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -65.558 28.736 106.111 1.00 0.00 H new ATOM 572 N LYS A 37 -63.385 28.002 107.550 1.00 0.00 N ATOM 573 CA LYS A 37 -63.231 29.358 108.096 1.00 0.00 C ATOM 574 C LYS A 37 -62.633 30.258 107.007 1.00 0.00 C ATOM 575 O LYS A 37 -61.823 29.769 106.221 1.00 0.00 O ATOM 576 CB LYS A 37 -62.305 29.269 109.318 1.00 0.00 C ATOM 577 CG LYS A 37 -62.236 30.563 110.137 1.00 0.00 C ATOM 578 CD LYS A 37 -60.812 31.129 110.273 1.00 0.00 C ATOM 579 CE LYS A 37 -59.959 30.379 111.307 1.00 0.00 C ATOM 580 NZ LYS A 37 -59.133 29.300 110.721 1.00 0.00 N ATOM 0 H LYS A 37 -62.588 27.721 106.978 1.00 0.00 H new ATOM 0 HA LYS A 37 -64.187 29.782 108.403 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -62.647 28.459 109.963 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -61.301 29.008 108.983 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -62.873 31.314 109.670 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -62.640 30.376 111.132 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -60.317 31.086 109.303 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -60.871 32.180 110.554 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -59.307 31.091 111.813 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -60.615 29.952 112.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -58.870 28.622 111.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -59.676 28.810 109.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -58.272 29.709 110.305 1.00 0.00 H new ATOM 594 N TYR A 38 -63.002 31.544 106.929 1.00 0.00 N ATOM 595 CA TYR A 38 -62.382 32.476 105.971 1.00 0.00 C ATOM 596 C TYR A 38 -61.087 33.079 106.526 1.00 0.00 C ATOM 597 O TYR A 38 -61.007 33.387 107.708 1.00 0.00 O ATOM 598 CB TYR A 38 -63.372 33.582 105.576 1.00 0.00 C ATOM 599 CG TYR A 38 -62.822 34.587 104.574 1.00 0.00 C ATOM 600 CD1 TYR A 38 -62.237 34.133 103.377 1.00 0.00 C ATOM 601 CD2 TYR A 38 -62.893 35.972 104.819 1.00 0.00 C ATOM 602 CE1 TYR A 38 -61.754 35.036 102.419 1.00 0.00 C ATOM 603 CE2 TYR A 38 -62.419 36.891 103.859 1.00 0.00 C ATOM 604 CZ TYR A 38 -61.857 36.419 102.649 1.00 0.00 C ATOM 605 OH TYR A 38 -61.408 37.277 101.696 1.00 0.00 O ATOM 0 H TYR A 38 -63.724 31.964 107.515 1.00 0.00 H new ATOM 0 HA TYR A 38 -62.122 31.907 105.078 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -64.266 33.120 105.156 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -63.681 34.115 106.475 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -62.159 33.072 103.193 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -63.312 36.333 105.747 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -61.304 34.670 101.508 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -62.485 37.952 104.047 1.00 0.00 H new ATOM 0 HH TYR A 38 -62.099 37.946 101.506 1.00 0.00 H new ATOM 615 N GLU A 39 -60.071 33.303 105.686 1.00 0.00 N ATOM 616 CA GLU A 39 -58.763 33.820 106.125 1.00 0.00 C ATOM 617 C GLU A 39 -58.185 34.919 105.219 1.00 0.00 C ATOM 618 O GLU A 39 -57.209 35.557 105.599 1.00 0.00 O ATOM 619 CB GLU A 39 -57.772 32.651 106.289 1.00 0.00 C ATOM 620 CG GLU A 39 -58.226 31.713 107.422 1.00 0.00 C ATOM 621 CD GLU A 39 -57.179 30.687 107.854 1.00 0.00 C ATOM 622 OE1 GLU A 39 -56.346 30.287 107.006 1.00 0.00 O ATOM 623 OE2 GLU A 39 -57.276 30.252 109.027 1.00 0.00 O ATOM 0 H GLU A 39 -60.129 33.132 104.682 1.00 0.00 H new ATOM 0 HA GLU A 39 -58.925 34.306 107.087 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -57.700 32.094 105.355 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -56.777 33.038 106.507 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -58.503 32.316 108.287 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -59.123 31.184 107.101 1.00 0.00 H new ATOM 630 N GLY A 40 -58.780 35.179 104.048 1.00 0.00 N ATOM 631 CA GLY A 40 -58.195 36.054 103.035 1.00 0.00 C ATOM 632 C GLY A 40 -58.186 37.552 103.354 1.00 0.00 C ATOM 633 O GLY A 40 -57.253 38.229 102.931 1.00 0.00 O ATOM 0 H GLY A 40 -59.682 34.786 103.780 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -57.167 35.735 102.860 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -58.738 35.907 102.101 1.00 0.00 H new ATOM 637 N ALA A 41 -59.219 38.091 104.024 1.00 0.00 N ATOM 638 CA ALA A 41 -59.406 39.549 104.104 1.00 0.00 C ATOM 639 C ALA A 41 -60.239 40.078 105.293 1.00 0.00 C ATOM 640 O ALA A 41 -60.672 41.229 105.249 1.00 0.00 O ATOM 641 CB ALA A 41 -60.018 40.036 102.777 1.00 0.00 C ATOM 0 H ALA A 41 -59.929 37.546 104.513 1.00 0.00 H new ATOM 0 HA ALA A 41 -58.411 39.957 104.284 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -60.164 41.115 102.818 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -59.345 39.792 101.955 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -60.979 39.546 102.618 1.00 0.00 H new ATOM 647 N GLY A 42 -60.543 39.283 106.328 1.00 0.00 N ATOM 648 CA GLY A 42 -61.312 39.763 107.488 1.00 0.00 C ATOM 649 C GLY A 42 -62.830 39.819 107.264 1.00 0.00 C ATOM 650 O GLY A 42 -63.598 39.433 108.141 1.00 0.00 O ATOM 0 H GLY A 42 -60.268 38.302 106.387 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -61.106 39.113 108.339 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -60.959 40.759 107.755 1.00 0.00 H new ATOM 654 N ALA A 43 -63.251 40.323 106.102 1.00 0.00 N ATOM 655 CA ALA A 43 -64.626 40.645 105.719 1.00 0.00 C ATOM 656 C ALA A 43 -65.491 39.418 105.301 1.00 0.00 C ATOM 657 O ALA A 43 -64.981 38.297 105.260 1.00 0.00 O ATOM 658 CB ALA A 43 -64.490 41.686 104.595 1.00 0.00 C ATOM 0 H ALA A 43 -62.593 40.531 105.351 1.00 0.00 H new ATOM 0 HA ALA A 43 -65.177 41.030 106.577 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -65.481 41.981 104.251 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -63.961 42.561 104.972 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -63.931 41.254 103.765 1.00 0.00 H new ATOM 664 N PRO A 44 -66.805 39.591 105.017 1.00 0.00 N ATOM 665 CA PRO A 44 -67.700 38.523 104.547 1.00 0.00 C ATOM 666 C PRO A 44 -67.379 37.960 103.154 1.00 0.00 C ATOM 667 O PRO A 44 -66.677 38.581 102.359 1.00 0.00 O ATOM 668 CB PRO A 44 -69.108 39.137 104.492 1.00 0.00 C ATOM 669 CG PRO A 44 -69.016 40.352 105.396 1.00 0.00 C ATOM 670 CD PRO A 44 -67.575 40.807 105.225 1.00 0.00 C ATOM 0 HA PRO A 44 -67.591 37.684 105.235 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -69.382 39.417 103.475 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -69.864 38.434 104.844 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -69.721 41.129 105.099 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -69.238 40.100 106.433 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -67.475 41.484 104.377 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -67.227 41.346 106.106 1.00 0.00 H new ATOM 678 N CYS A 45 -68.021 36.830 102.828 1.00 0.00 N ATOM 679 CA CYS A 45 -68.035 36.180 101.514 1.00 0.00 C ATOM 680 C CYS A 45 -69.375 35.457 101.272 1.00 0.00 C ATOM 681 O CYS A 45 -70.016 35.027 102.233 1.00 0.00 O ATOM 682 CB CYS A 45 -66.923 35.117 101.478 1.00 0.00 C ATOM 683 SG CYS A 45 -65.250 35.646 101.905 1.00 0.00 S ATOM 0 H CYS A 45 -68.575 36.318 103.514 1.00 0.00 H new ATOM 0 HA CYS A 45 -67.889 36.944 100.750 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -67.205 34.312 102.157 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -66.896 34.693 100.474 1.00 0.00 H new ATOM 688 N LYS A 46 -69.715 35.151 100.006 1.00 0.00 N ATOM 689 CA LYS A 46 -70.142 33.782 99.675 1.00 0.00 C ATOM 690 C LYS A 46 -68.884 32.990 99.337 1.00 0.00 C ATOM 691 O LYS A 46 -67.997 33.543 98.678 1.00 0.00 O ATOM 692 CB LYS A 46 -71.237 33.669 98.603 1.00 0.00 C ATOM 693 CG LYS A 46 -70.859 33.937 97.136 1.00 0.00 C ATOM 694 CD LYS A 46 -71.844 33.271 96.156 1.00 0.00 C ATOM 695 CE LYS A 46 -73.312 33.419 96.581 1.00 0.00 C ATOM 696 NZ LYS A 46 -74.247 33.356 95.437 1.00 0.00 N ATOM 0 H LYS A 46 -69.704 35.806 99.224 1.00 0.00 H new ATOM 0 HA LYS A 46 -70.646 33.360 100.544 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -71.654 32.663 98.659 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -72.036 34.360 98.871 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -70.840 35.012 96.957 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -69.852 33.565 96.947 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -71.713 33.708 95.166 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -71.602 32.212 96.071 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -73.561 32.631 97.292 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -73.442 34.369 97.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -75.223 33.461 95.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -74.030 34.123 94.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -74.146 32.439 94.956 1.00 0.00 H new ATOM 710 N VAL A 47 -68.766 31.757 99.839 1.00 0.00 N ATOM 711 CA VAL A 47 -67.504 31.011 99.755 1.00 0.00 C ATOM 712 C VAL A 47 -67.501 30.066 98.555 1.00 0.00 C ATOM 713 O VAL A 47 -68.514 29.417 98.281 1.00 0.00 O ATOM 714 CB VAL A 47 -66.986 30.406 101.083 1.00 0.00 C ATOM 715 CG1 VAL A 47 -67.743 30.829 102.338 1.00 0.00 C ATOM 716 CG2 VAL A 47 -66.744 28.899 101.142 1.00 0.00 C ATOM 0 H VAL A 47 -69.523 31.256 100.305 1.00 0.00 H new ATOM 0 HA VAL A 47 -66.729 31.754 99.564 1.00 0.00 H new ATOM 0 HB VAL A 47 -66.001 30.873 101.078 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -67.299 30.349 103.210 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -67.684 31.912 102.451 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -68.787 30.529 102.251 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -66.384 28.627 102.134 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -67.676 28.373 100.938 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -65.999 28.621 100.396 1.00 0.00 H new ATOM 726 N PRO A 48 -66.395 30.019 97.791 1.00 0.00 N ATOM 727 CA PRO A 48 -66.380 29.451 96.454 1.00 0.00 C ATOM 728 C PRO A 48 -66.117 27.952 96.584 1.00 0.00 C ATOM 729 O PRO A 48 -64.964 27.524 96.639 1.00 0.00 O ATOM 730 CB PRO A 48 -65.295 30.229 95.683 1.00 0.00 C ATOM 731 CG PRO A 48 -64.689 31.187 96.711 1.00 0.00 C ATOM 732 CD PRO A 48 -65.073 30.573 98.045 1.00 0.00 C ATOM 0 HA PRO A 48 -67.318 29.544 95.906 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -64.540 29.556 95.277 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -65.723 30.773 94.841 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -63.607 31.261 96.601 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -65.090 32.195 96.604 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -64.366 29.802 98.351 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -65.095 31.319 98.840 1.00 0.00 H new ATOM 740 N ILE A 49 -67.198 27.174 96.719 1.00 0.00 N ATOM 741 CA ILE A 49 -67.137 25.722 96.908 1.00 0.00 C ATOM 742 C ILE A 49 -67.547 24.982 95.645 1.00 0.00 C ATOM 743 O ILE A 49 -68.656 25.145 95.137 1.00 0.00 O ATOM 744 CB ILE A 49 -67.915 25.244 98.156 1.00 0.00 C ATOM 745 CG1 ILE A 49 -67.231 25.882 99.386 1.00 0.00 C ATOM 746 CG2 ILE A 49 -67.956 23.705 98.250 1.00 0.00 C ATOM 747 CD1 ILE A 49 -67.394 25.196 100.751 1.00 0.00 C ATOM 0 H ILE A 49 -68.150 27.541 96.700 1.00 0.00 H new ATOM 0 HA ILE A 49 -66.094 25.472 97.104 1.00 0.00 H new ATOM 0 HB ILE A 49 -68.958 25.557 98.099 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -66.164 25.950 99.174 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -67.603 26.902 99.481 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -68.511 23.410 99.140 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -68.446 23.299 97.365 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -66.939 23.317 98.311 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -66.856 25.764 101.510 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -68.451 25.152 101.012 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -66.990 24.185 100.701 1.00 0.00 H new ATOM 759 N GLU A 50 -66.652 24.097 95.213 1.00 0.00 N ATOM 760 CA GLU A 50 -66.938 23.048 94.245 1.00 0.00 C ATOM 761 C GLU A 50 -66.532 21.694 94.831 1.00 0.00 C ATOM 762 O GLU A 50 -65.680 21.612 95.720 1.00 0.00 O ATOM 763 CB GLU A 50 -66.151 23.258 92.940 1.00 0.00 C ATOM 764 CG GLU A 50 -66.223 24.658 92.311 1.00 0.00 C ATOM 765 CD GLU A 50 -65.215 24.757 91.163 1.00 0.00 C ATOM 766 OE1 GLU A 50 -65.229 23.873 90.281 1.00 0.00 O ATOM 767 OE2 GLU A 50 -64.334 25.646 91.185 1.00 0.00 O ATOM 0 H GLU A 50 -65.685 24.092 95.536 1.00 0.00 H new ATOM 0 HA GLU A 50 -68.005 23.078 94.026 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -65.104 23.024 93.132 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -66.509 22.536 92.206 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -67.230 24.851 91.942 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -66.009 25.417 93.063 1.00 0.00 H new ATOM 774 N ILE A 51 -67.049 20.622 94.229 1.00 0.00 N ATOM 775 CA ILE A 51 -66.363 19.335 94.205 1.00 0.00 C ATOM 776 C ILE A 51 -66.103 19.006 92.750 1.00 0.00 C ATOM 777 O ILE A 51 -67.044 19.007 91.954 1.00 0.00 O ATOM 778 CB ILE A 51 -67.163 18.206 94.874 1.00 0.00 C ATOM 779 CG1 ILE A 51 -67.619 18.628 96.281 1.00 0.00 C ATOM 780 CG2 ILE A 51 -66.279 16.952 94.885 1.00 0.00 C ATOM 781 CD1 ILE A 51 -68.010 17.465 97.207 1.00 0.00 C ATOM 0 H ILE A 51 -67.949 20.623 93.748 1.00 0.00 H new ATOM 0 HA ILE A 51 -65.440 19.413 94.779 1.00 0.00 H new ATOM 0 HB ILE A 51 -68.075 17.987 94.319 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -66.817 19.196 96.753 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -68.472 19.300 96.185 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -66.819 16.130 95.355 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -66.022 16.679 93.862 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -65.367 17.155 95.447 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -68.317 17.859 98.176 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -68.835 16.908 96.763 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -67.155 16.802 97.340 1.00 0.00 H new ATOM 793 N ARG A 52 -64.843 18.711 92.425 1.00 0.00 N ATOM 794 CA ARG A 52 -64.422 18.301 91.095 1.00 0.00 C ATOM 795 C ARG A 52 -63.992 16.837 91.045 1.00 0.00 C ATOM 796 O ARG A 52 -63.714 16.201 92.065 1.00 0.00 O ATOM 797 CB ARG A 52 -63.297 19.215 90.602 1.00 0.00 C ATOM 798 CG ARG A 52 -63.712 20.690 90.525 1.00 0.00 C ATOM 799 CD ARG A 52 -62.566 21.444 89.859 1.00 0.00 C ATOM 800 NE ARG A 52 -62.754 22.893 89.894 1.00 0.00 N ATOM 801 CZ ARG A 52 -61.825 23.804 89.662 1.00 0.00 C ATOM 802 NH1 ARG A 52 -60.624 23.473 89.233 1.00 0.00 N ATOM 803 NH2 ARG A 52 -62.092 25.070 89.869 1.00 0.00 N ATOM 0 H ARG A 52 -64.076 18.753 93.096 1.00 0.00 H new ATOM 0 HA ARG A 52 -65.282 18.396 90.432 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -62.440 19.119 91.269 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -62.972 18.883 89.616 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -64.632 20.802 89.951 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -63.907 21.088 91.521 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -61.630 21.190 90.357 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -62.474 21.118 88.823 1.00 0.00 H new ATOM 0 HE ARG A 52 -63.689 23.233 90.118 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -60.392 22.493 89.072 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -59.926 24.197 89.062 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -63.013 25.348 90.208 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -61.379 25.777 89.692 1.00 0.00 H new ATOM 817 N ASP A 53 -63.947 16.336 89.814 1.00 0.00 N ATOM 818 CA ASP A 53 -63.443 15.032 89.415 1.00 0.00 C ATOM 819 C ASP A 53 -61.972 14.809 89.805 1.00 0.00 C ATOM 820 O ASP A 53 -61.268 15.719 90.245 1.00 0.00 O ATOM 821 CB ASP A 53 -63.675 14.849 87.901 1.00 0.00 C ATOM 822 CG ASP A 53 -62.855 15.748 86.953 1.00 0.00 C ATOM 823 OD1 ASP A 53 -62.327 16.806 87.374 1.00 0.00 O ATOM 824 OD2 ASP A 53 -62.775 15.364 85.763 1.00 0.00 O ATOM 0 H ASP A 53 -64.287 16.871 89.015 1.00 0.00 H new ATOM 0 HA ASP A 53 -63.997 14.269 89.962 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -63.464 13.810 87.649 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -64.732 15.018 87.698 1.00 0.00 H new ATOM 829 N VAL A 54 -61.486 13.576 89.622 1.00 0.00 N ATOM 830 CA VAL A 54 -60.109 13.195 89.967 1.00 0.00 C ATOM 831 C VAL A 54 -59.051 14.043 89.248 1.00 0.00 C ATOM 832 O VAL A 54 -58.014 14.355 89.840 1.00 0.00 O ATOM 833 CB VAL A 54 -59.869 11.682 89.790 1.00 0.00 C ATOM 834 CG1 VAL A 54 -60.780 10.881 90.731 1.00 0.00 C ATOM 835 CG2 VAL A 54 -60.093 11.191 88.354 1.00 0.00 C ATOM 0 H VAL A 54 -62.036 12.812 89.230 1.00 0.00 H new ATOM 0 HA VAL A 54 -59.990 13.415 91.028 1.00 0.00 H new ATOM 0 HB VAL A 54 -58.819 11.519 90.034 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -60.598 9.815 90.593 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -60.567 11.155 91.764 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -61.823 11.103 90.504 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -59.906 10.118 88.303 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -61.121 11.395 88.056 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -59.410 11.710 87.681 1.00 0.00 H new ATOM 845 N ASN A 55 -59.361 14.489 88.024 1.00 0.00 N ATOM 846 CA ASN A 55 -58.560 15.403 87.209 1.00 0.00 C ATOM 847 C ASN A 55 -58.618 16.869 87.690 1.00 0.00 C ATOM 848 O ASN A 55 -57.787 17.673 87.272 1.00 0.00 O ATOM 849 CB ASN A 55 -59.056 15.346 85.757 1.00 0.00 C ATOM 850 CG ASN A 55 -58.959 14.014 85.035 1.00 0.00 C ATOM 851 OD1 ASN A 55 -58.570 12.984 85.564 1.00 0.00 O ATOM 852 ND2 ASN A 55 -59.321 14.027 83.770 1.00 0.00 N ATOM 0 H ASN A 55 -60.221 14.206 87.554 1.00 0.00 H new ATOM 0 HA ASN A 55 -57.524 15.075 87.297 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -60.100 15.660 85.746 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -58.496 16.082 85.181 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -59.279 13.170 83.219 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -59.644 14.894 83.341 1.00 0.00 H new ATOM 859 N LYS A 56 -59.556 17.212 88.590 1.00 0.00 N ATOM 860 CA LYS A 56 -59.707 18.514 89.266 1.00 0.00 C ATOM 861 C LYS A 56 -60.123 19.649 88.310 1.00 0.00 C ATOM 862 O LYS A 56 -59.887 20.831 88.580 1.00 0.00 O ATOM 863 CB LYS A 56 -58.484 18.822 90.167 1.00 0.00 C ATOM 864 CG LYS A 56 -57.916 17.546 90.820 1.00 0.00 C ATOM 865 CD LYS A 56 -56.940 17.761 91.980 1.00 0.00 C ATOM 866 CE LYS A 56 -56.051 16.520 92.193 1.00 0.00 C ATOM 867 NZ LYS A 56 -56.808 15.241 92.194 1.00 0.00 N ATOM 0 H LYS A 56 -60.273 16.548 88.883 1.00 0.00 H new ATOM 0 HA LYS A 56 -60.556 18.443 89.946 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -57.707 19.303 89.573 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -58.774 19.529 90.944 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -58.750 16.944 91.181 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -57.411 16.962 90.050 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -56.314 18.630 91.777 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -57.496 17.975 92.893 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -55.296 16.485 91.408 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -55.522 16.620 93.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -56.176 14.464 92.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -57.598 15.306 92.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -57.180 15.057 91.240 1.00 0.00 H new ATOM 881 N GLU A 57 -60.803 19.280 87.220 1.00 0.00 N ATOM 882 CA GLU A 57 -61.260 20.151 86.123 1.00 0.00 C ATOM 883 C GLU A 57 -62.789 20.218 86.002 1.00 0.00 C ATOM 884 O GLU A 57 -63.307 21.282 85.668 1.00 0.00 O ATOM 885 CB GLU A 57 -60.653 19.727 84.761 1.00 0.00 C ATOM 886 CG GLU A 57 -60.521 18.201 84.596 1.00 0.00 C ATOM 887 CD GLU A 57 -60.677 17.616 83.185 1.00 0.00 C ATOM 888 OE1 GLU A 57 -61.350 18.231 82.335 1.00 0.00 O ATOM 889 OE2 GLU A 57 -60.275 16.435 83.005 1.00 0.00 O ATOM 0 H GLU A 57 -61.067 18.307 87.067 1.00 0.00 H new ATOM 0 HA GLU A 57 -60.903 21.148 86.381 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -61.276 20.119 83.957 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -59.669 20.183 84.653 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -59.542 17.907 84.974 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -61.265 17.729 85.238 1.00 0.00 H new ATOM 896 N LYS A 58 -63.521 19.126 86.285 1.00 0.00 N ATOM 897 CA LYS A 58 -64.967 19.024 86.022 1.00 0.00 C ATOM 898 C LYS A 58 -65.740 18.866 87.326 1.00 0.00 C ATOM 899 O LYS A 58 -65.390 18.017 88.140 1.00 0.00 O ATOM 900 CB LYS A 58 -65.289 17.834 85.100 1.00 0.00 C ATOM 901 CG LYS A 58 -64.366 17.694 83.884 1.00 0.00 C ATOM 902 CD LYS A 58 -64.798 16.506 83.011 1.00 0.00 C ATOM 903 CE LYS A 58 -63.613 15.942 82.222 1.00 0.00 C ATOM 904 NZ LYS A 58 -62.664 15.216 83.100 1.00 0.00 N ATOM 0 H LYS A 58 -63.124 18.285 86.705 1.00 0.00 H new ATOM 0 HA LYS A 58 -65.270 19.946 85.525 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -65.238 16.915 85.685 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -66.316 17.932 84.749 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -64.389 18.612 83.296 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -63.337 17.553 84.216 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -65.225 15.725 83.640 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -65.580 16.823 82.321 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -63.979 15.269 81.447 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -63.092 16.755 81.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -61.691 15.389 82.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -62.769 15.552 84.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -62.865 14.196 83.061 1.00 0.00 H new ATOM 918 N VAL A 59 -66.795 19.660 87.523 1.00 0.00 N ATOM 919 CA VAL A 59 -67.637 19.626 88.731 1.00 0.00 C ATOM 920 C VAL A 59 -68.461 18.329 88.806 1.00 0.00 C ATOM 921 O VAL A 59 -69.016 17.882 87.804 1.00 0.00 O ATOM 922 CB VAL A 59 -68.549 20.869 88.788 1.00 0.00 C ATOM 923 CG1 VAL A 59 -69.438 20.883 90.042 1.00 0.00 C ATOM 924 CG2 VAL A 59 -67.706 22.151 88.811 1.00 0.00 C ATOM 0 H VAL A 59 -67.096 20.356 86.841 1.00 0.00 H new ATOM 0 HA VAL A 59 -66.980 19.643 89.600 1.00 0.00 H new ATOM 0 HB VAL A 59 -69.178 20.826 87.899 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -70.061 21.777 90.036 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -70.074 19.998 90.047 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -68.810 20.884 90.933 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -68.364 23.019 88.851 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -67.059 22.145 89.688 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -67.095 22.201 87.910 1.00 0.00 H new ATOM 934 N VAL A 60 -68.562 17.746 90.010 1.00 0.00 N ATOM 935 CA VAL A 60 -69.247 16.471 90.292 1.00 0.00 C ATOM 936 C VAL A 60 -70.167 16.483 91.529 1.00 0.00 C ATOM 937 O VAL A 60 -70.938 15.535 91.703 1.00 0.00 O ATOM 938 CB VAL A 60 -68.232 15.312 90.422 1.00 0.00 C ATOM 939 CG1 VAL A 60 -67.463 15.057 89.121 1.00 0.00 C ATOM 940 CG2 VAL A 60 -67.222 15.542 91.555 1.00 0.00 C ATOM 0 H VAL A 60 -68.154 18.163 90.847 1.00 0.00 H new ATOM 0 HA VAL A 60 -69.897 16.319 89.430 1.00 0.00 H new ATOM 0 HB VAL A 60 -68.835 14.434 90.655 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -66.764 14.234 89.267 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -68.165 14.801 88.328 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -66.912 15.955 88.842 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -66.532 14.700 91.604 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -66.663 16.458 91.364 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -67.753 15.632 92.503 1.00 0.00 H new ATOM 950 N GLY A 61 -70.134 17.521 92.380 1.00 0.00 N ATOM 951 CA GLY A 61 -70.876 17.570 93.655 1.00 0.00 C ATOM 952 C GLY A 61 -72.054 18.554 93.703 1.00 0.00 C ATOM 953 O GLY A 61 -72.208 19.398 92.821 1.00 0.00 O ATOM 0 H GLY A 61 -69.585 18.362 92.202 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -71.252 16.571 93.874 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -70.178 17.829 94.451 1.00 0.00 H new ATOM 957 N ARG A 62 -72.865 18.460 94.769 1.00 0.00 N ATOM 958 CA ARG A 62 -74.021 19.322 95.087 1.00 0.00 C ATOM 959 C ARG A 62 -73.956 19.794 96.546 1.00 0.00 C ATOM 960 O ARG A 62 -74.158 18.993 97.459 1.00 0.00 O ATOM 961 CB ARG A 62 -75.341 18.556 94.862 1.00 0.00 C ATOM 962 CG ARG A 62 -75.647 18.203 93.396 1.00 0.00 C ATOM 963 CD ARG A 62 -76.132 16.751 93.232 1.00 0.00 C ATOM 964 NE ARG A 62 -75.095 15.759 93.579 1.00 0.00 N ATOM 965 CZ ARG A 62 -73.959 15.499 92.954 1.00 0.00 C ATOM 966 NH1 ARG A 62 -73.591 16.100 91.852 1.00 0.00 N ATOM 967 NH2 ARG A 62 -73.143 14.618 93.462 1.00 0.00 N ATOM 0 H ARG A 62 -72.725 17.738 95.476 1.00 0.00 H new ATOM 0 HA ARG A 62 -73.987 20.188 94.426 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -75.312 17.634 95.443 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -76.163 19.155 95.255 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -76.408 18.883 93.012 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -74.751 18.354 92.794 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -77.007 16.591 93.863 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -76.449 16.593 92.201 1.00 0.00 H new ATOM 0 HE ARG A 62 -75.279 15.200 94.412 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -74.192 16.809 91.433 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -72.703 15.860 91.412 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -73.385 14.140 94.330 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -72.263 14.407 92.991 1.00 0.00 H new ATOM 981 N ILE A 63 -73.651 21.074 96.786 1.00 0.00 N ATOM 982 CA ILE A 63 -73.649 21.666 98.136 1.00 0.00 C ATOM 983 C ILE A 63 -75.086 21.745 98.680 1.00 0.00 C ATOM 984 O ILE A 63 -75.898 22.519 98.177 1.00 0.00 O ATOM 985 CB ILE A 63 -72.937 23.045 98.224 1.00 0.00 C ATOM 986 CG1 ILE A 63 -71.984 23.426 97.068 1.00 0.00 C ATOM 987 CG2 ILE A 63 -72.145 23.066 99.540 1.00 0.00 C ATOM 988 CD1 ILE A 63 -72.726 24.070 95.888 1.00 0.00 C ATOM 0 H ILE A 63 -73.397 21.733 96.050 1.00 0.00 H new ATOM 0 HA ILE A 63 -73.057 21.000 98.763 1.00 0.00 H new ATOM 0 HB ILE A 63 -73.734 23.786 98.162 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -71.226 24.116 97.438 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -71.461 22.534 96.722 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -71.629 24.021 99.639 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -72.829 22.934 100.378 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -71.414 22.257 99.538 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -72.013 24.319 95.102 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -73.466 23.371 95.498 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -73.227 24.978 96.225 1.00 0.00 H new ATOM 1000 N ILE A 64 -75.413 20.909 99.673 1.00 0.00 N ATOM 1001 CA ILE A 64 -76.769 20.772 100.226 1.00 0.00 C ATOM 1002 C ILE A 64 -77.094 21.909 101.195 1.00 0.00 C ATOM 1003 O ILE A 64 -78.208 22.429 101.175 1.00 0.00 O ATOM 1004 CB ILE A 64 -76.926 19.381 100.883 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -76.782 18.244 99.848 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -78.243 19.229 101.664 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -77.681 18.335 98.606 1.00 0.00 C ATOM 0 H ILE A 64 -74.732 20.298 100.124 1.00 0.00 H new ATOM 0 HA ILE A 64 -77.492 20.847 99.414 1.00 0.00 H new ATOM 0 HB ILE A 64 -76.113 19.302 101.605 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -75.744 18.212 99.517 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -76.986 17.298 100.349 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -78.294 18.232 102.101 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -78.284 19.976 102.457 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -79.086 19.372 100.988 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -77.489 17.482 97.955 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -78.727 18.329 98.913 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -77.466 19.258 98.068 1.00 0.00 H new ATOM 1019 N SER A 65 -76.113 22.368 101.979 1.00 0.00 N ATOM 1020 CA SER A 65 -76.199 23.531 102.874 1.00 0.00 C ATOM 1021 C SER A 65 -76.340 24.894 102.151 1.00 0.00 C ATOM 1022 O SER A 65 -75.941 25.923 102.706 1.00 0.00 O ATOM 1023 CB SER A 65 -74.973 23.505 103.792 1.00 0.00 C ATOM 1024 OG SER A 65 -75.067 24.532 104.749 1.00 0.00 O ATOM 0 H SER A 65 -75.197 21.921 102.010 1.00 0.00 H new ATOM 0 HA SER A 65 -77.122 23.445 103.447 1.00 0.00 H new ATOM 0 HB2 SER A 65 -74.902 22.538 104.290 1.00 0.00 H new ATOM 0 HB3 SER A 65 -74.064 23.628 103.203 1.00 0.00 H new ATOM 0 HG SER A 65 -75.435 25.337 104.329 1.00 0.00 H new ATOM 1030 N SER A 66 -76.902 24.909 100.934 1.00 0.00 N ATOM 1031 CA SER A 66 -76.940 26.016 99.971 1.00 0.00 C ATOM 1032 C SER A 66 -75.546 26.432 99.472 1.00 0.00 C ATOM 1033 O SER A 66 -74.531 25.839 99.837 1.00 0.00 O ATOM 1034 CB SER A 66 -77.733 27.197 100.551 1.00 0.00 C ATOM 1035 OG SER A 66 -78.128 28.080 99.517 1.00 0.00 O ATOM 0 H SER A 66 -77.378 24.083 100.571 1.00 0.00 H new ATOM 0 HA SER A 66 -77.461 25.659 99.083 1.00 0.00 H new ATOM 0 HB2 SER A 66 -78.612 26.829 101.079 1.00 0.00 H new ATOM 0 HB3 SER A 66 -77.123 27.730 101.280 1.00 0.00 H new ATOM 0 HG SER A 66 -78.634 28.827 99.900 1.00 0.00 H new ATOM 1041 N THR A 67 -75.497 27.458 98.613 1.00 0.00 N ATOM 1042 CA THR A 67 -74.264 28.136 98.201 1.00 0.00 C ATOM 1043 C THR A 67 -73.602 28.766 99.441 1.00 0.00 C ATOM 1044 O THR A 67 -74.178 29.699 100.007 1.00 0.00 O ATOM 1045 CB THR A 67 -74.535 29.208 97.136 1.00 0.00 C ATOM 1046 OG1 THR A 67 -75.254 28.664 96.053 1.00 0.00 O ATOM 1047 CG2 THR A 67 -73.225 29.762 96.568 1.00 0.00 C ATOM 0 H THR A 67 -76.332 27.847 98.176 1.00 0.00 H new ATOM 0 HA THR A 67 -73.594 27.401 97.754 1.00 0.00 H new ATOM 0 HB THR A 67 -75.106 29.998 97.624 1.00 0.00 H new ATOM 0 HG1 THR A 67 -75.419 29.363 95.386 1.00 0.00 H new ATOM 0 HG21 THR A 67 -73.446 30.519 95.816 1.00 0.00 H new ATOM 0 HG22 THR A 67 -72.640 30.209 97.372 1.00 0.00 H new ATOM 0 HG23 THR A 67 -72.655 28.953 96.111 1.00 0.00 H new ATOM 1055 N PRO A 68 -72.444 28.251 99.901 1.00 0.00 N ATOM 1056 CA PRO A 68 -71.825 28.619 101.180 1.00 0.00 C ATOM 1057 C PRO A 68 -71.558 30.113 101.375 1.00 0.00 C ATOM 1058 O PRO A 68 -71.374 30.859 100.412 1.00 0.00 O ATOM 1059 CB PRO A 68 -70.495 27.870 101.198 1.00 0.00 C ATOM 1060 CG PRO A 68 -70.814 26.620 100.401 1.00 0.00 C ATOM 1061 CD PRO A 68 -71.685 27.170 99.288 1.00 0.00 C ATOM 0 HA PRO A 68 -72.512 28.360 101.986 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -69.695 28.451 100.739 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -70.175 27.634 102.213 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -69.914 26.141 100.016 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -71.339 25.877 101.001 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -71.080 27.534 98.457 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -72.346 26.401 98.888 1.00 0.00 H new ATOM 1069 N LEU A 69 -71.409 30.537 102.636 1.00 0.00 N ATOM 1070 CA LEU A 69 -71.020 31.903 102.988 1.00 0.00 C ATOM 1071 C LEU A 69 -70.072 31.982 104.187 1.00 0.00 C ATOM 1072 O LEU A 69 -69.881 30.999 104.900 1.00 0.00 O ATOM 1073 CB LEU A 69 -72.283 32.765 103.176 1.00 0.00 C ATOM 1074 CG LEU A 69 -73.099 32.392 104.434 1.00 0.00 C ATOM 1075 CD1 LEU A 69 -73.397 33.638 105.267 1.00 0.00 C ATOM 1076 CD2 LEU A 69 -74.414 31.709 104.057 1.00 0.00 C ATOM 0 H LEU A 69 -71.557 29.934 103.446 1.00 0.00 H new ATOM 0 HA LEU A 69 -70.438 32.305 102.159 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -71.992 33.814 103.238 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -72.918 32.662 102.296 1.00 0.00 H new ATOM 0 HG LEU A 69 -72.499 31.697 105.021 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -73.972 33.357 106.149 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -72.460 34.101 105.577 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -73.971 34.346 104.670 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -74.966 31.458 104.963 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -75.011 32.383 103.443 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -74.203 30.798 103.497 1.00 0.00 H new ATOM 1088 N ALA A 70 -69.499 33.169 104.393 1.00 0.00 N ATOM 1089 CA ALA A 70 -68.708 33.547 105.559 1.00 0.00 C ATOM 1090 C ALA A 70 -69.124 34.959 105.985 1.00 0.00 C ATOM 1091 O ALA A 70 -69.297 35.838 105.140 1.00 0.00 O ATOM 1092 CB ALA A 70 -67.214 33.479 105.216 1.00 0.00 C ATOM 0 H ALA A 70 -69.580 33.928 103.716 1.00 0.00 H new ATOM 0 HA ALA A 70 -68.886 32.860 106.387 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -66.627 33.762 106.090 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -66.955 32.463 104.918 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -66.997 34.164 104.396 1.00 0.00 H new ATOM 1098 N GLU A 71 -69.300 35.184 107.289 1.00 0.00 N ATOM 1099 CA GLU A 71 -69.747 36.472 107.842 1.00 0.00 C ATOM 1100 C GLU A 71 -68.584 37.392 108.269 1.00 0.00 C ATOM 1101 O GLU A 71 -68.798 38.592 108.477 1.00 0.00 O ATOM 1102 CB GLU A 71 -70.704 36.188 109.016 1.00 0.00 C ATOM 1103 CG GLU A 71 -72.105 35.732 108.568 1.00 0.00 C ATOM 1104 CD GLU A 71 -72.944 36.845 107.920 1.00 0.00 C ATOM 1105 OE1 GLU A 71 -72.477 38.008 107.851 1.00 0.00 O ATOM 1106 OE2 GLU A 71 -74.074 36.566 107.464 1.00 0.00 O ATOM 0 H GLU A 71 -69.136 34.472 108.001 1.00 0.00 H new ATOM 0 HA GLU A 71 -70.265 37.022 107.056 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -70.267 35.420 109.653 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -70.800 37.089 109.623 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -72.000 34.910 107.859 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -72.643 35.341 109.432 1.00 0.00 H new ATOM 1113 N ASN A 72 -67.371 36.837 108.375 1.00 0.00 N ATOM 1114 CA ASN A 72 -66.078 37.434 108.726 1.00 0.00 C ATOM 1115 C ASN A 72 -64.986 36.356 108.576 1.00 0.00 C ATOM 1116 O ASN A 72 -65.305 35.174 108.430 1.00 0.00 O ATOM 1117 CB ASN A 72 -66.122 37.943 110.191 1.00 0.00 C ATOM 1118 CG ASN A 72 -66.024 39.455 110.311 1.00 0.00 C ATOM 1119 OD1 ASN A 72 -65.199 39.987 111.034 1.00 0.00 O ATOM 1120 ND2 ASN A 72 -66.887 40.183 109.636 1.00 0.00 N ATOM 0 H ASN A 72 -67.260 35.839 108.195 1.00 0.00 H new ATOM 0 HA ASN A 72 -65.860 38.276 108.069 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -67.050 37.609 110.656 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -65.304 37.488 110.750 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -66.869 41.200 109.715 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -67.574 39.731 109.033 1.00 0.00 H new ATOM 1127 N THR A 73 -63.704 36.724 108.708 1.00 0.00 N ATOM 1128 CA THR A 73 -62.607 35.760 108.914 1.00 0.00 C ATOM 1129 C THR A 73 -62.848 34.918 110.161 1.00 0.00 C ATOM 1130 O THR A 73 -62.839 33.699 110.090 1.00 0.00 O ATOM 1131 CB THR A 73 -61.230 36.448 108.937 1.00 0.00 C ATOM 1132 OG1 THR A 73 -60.768 36.511 107.604 1.00 0.00 O ATOM 1133 CG2 THR A 73 -60.115 35.781 109.752 1.00 0.00 C ATOM 0 H THR A 73 -63.396 37.696 108.675 1.00 0.00 H new ATOM 0 HA THR A 73 -62.598 35.084 108.059 1.00 0.00 H new ATOM 0 HB THR A 73 -61.413 37.405 109.426 1.00 0.00 H new ATOM 0 HG1 THR A 73 -61.533 36.491 106.991 1.00 0.00 H new ATOM 0 HG21 THR A 73 -59.204 36.375 109.677 1.00 0.00 H new ATOM 0 HG22 THR A 73 -60.419 35.713 110.797 1.00 0.00 H new ATOM 0 HG23 THR A 73 -59.929 34.780 109.363 1.00 0.00 H new ATOM 1141 N ASN A 74 -63.147 35.546 111.299 1.00 0.00 N ATOM 1142 CA ASN A 74 -63.467 34.860 112.551 1.00 0.00 C ATOM 1143 C ASN A 74 -64.788 34.055 112.518 1.00 0.00 C ATOM 1144 O ASN A 74 -65.166 33.481 113.538 1.00 0.00 O ATOM 1145 CB ASN A 74 -63.445 35.901 113.684 1.00 0.00 C ATOM 1146 CG ASN A 74 -62.065 36.527 113.841 1.00 0.00 C ATOM 1147 OD1 ASN A 74 -61.636 37.336 113.033 1.00 0.00 O ATOM 1148 ND2 ASN A 74 -61.324 36.158 114.866 1.00 0.00 N ATOM 0 H ASN A 74 -63.174 36.563 111.378 1.00 0.00 H new ATOM 0 HA ASN A 74 -62.709 34.096 112.723 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -64.178 36.681 113.477 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -63.739 35.427 114.620 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -60.389 36.548 114.986 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -61.685 35.482 115.539 1.00 0.00 H new ATOM 1155 N SER A 75 -65.489 33.988 111.376 1.00 0.00 N ATOM 1156 CA SER A 75 -66.679 33.162 111.183 1.00 0.00 C ATOM 1157 C SER A 75 -66.328 31.846 110.491 1.00 0.00 C ATOM 1158 O SER A 75 -65.767 31.826 109.392 1.00 0.00 O ATOM 1159 CB SER A 75 -67.732 33.899 110.356 1.00 0.00 C ATOM 1160 OG SER A 75 -68.073 35.126 110.970 1.00 0.00 O ATOM 0 H SER A 75 -65.234 34.521 110.545 1.00 0.00 H new ATOM 0 HA SER A 75 -67.086 32.949 112.171 1.00 0.00 H new ATOM 0 HB2 SER A 75 -67.351 34.082 109.351 1.00 0.00 H new ATOM 0 HB3 SER A 75 -68.622 33.278 110.252 1.00 0.00 H new ATOM 0 HG SER A 75 -68.916 35.024 111.460 1.00 0.00 H new ATOM 1166 N VAL A 76 -66.707 30.742 111.137 1.00 0.00 N ATOM 1167 CA VAL A 76 -66.727 29.412 110.528 1.00 0.00 C ATOM 1168 C VAL A 76 -68.051 29.147 109.807 1.00 0.00 C ATOM 1169 O VAL A 76 -69.067 29.774 110.115 1.00 0.00 O ATOM 1170 CB VAL A 76 -66.492 28.313 111.577 1.00 0.00 C ATOM 1171 CG1 VAL A 76 -65.073 28.382 112.148 1.00 0.00 C ATOM 1172 CG2 VAL A 76 -67.507 28.325 112.733 1.00 0.00 C ATOM 0 H VAL A 76 -67.012 30.747 112.110 1.00 0.00 H new ATOM 0 HA VAL A 76 -65.916 29.387 109.800 1.00 0.00 H new ATOM 0 HB VAL A 76 -66.631 27.376 111.038 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -64.939 27.592 112.887 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -64.350 28.252 111.343 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -64.918 29.351 112.622 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -67.274 27.520 113.430 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -67.455 29.282 113.253 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -68.512 28.181 112.336 1.00 0.00 H new ATOM 1182 N THR A 77 -68.052 28.148 108.920 1.00 0.00 N ATOM 1183 CA THR A 77 -69.264 27.654 108.249 1.00 0.00 C ATOM 1184 C THR A 77 -69.175 26.136 108.110 1.00 0.00 C ATOM 1185 O THR A 77 -68.376 25.635 107.315 1.00 0.00 O ATOM 1186 CB THR A 77 -69.499 28.320 106.872 1.00 0.00 C ATOM 1187 OG1 THR A 77 -69.084 29.669 106.882 1.00 0.00 O ATOM 1188 CG2 THR A 77 -70.980 28.291 106.494 1.00 0.00 C ATOM 0 H THR A 77 -67.205 27.653 108.643 1.00 0.00 H new ATOM 0 HA THR A 77 -70.122 27.922 108.865 1.00 0.00 H new ATOM 0 HB THR A 77 -68.915 27.754 106.146 1.00 0.00 H new ATOM 0 HG1 THR A 77 -69.094 30.021 105.967 1.00 0.00 H new ATOM 0 HG21 THR A 77 -71.117 28.765 105.522 1.00 0.00 H new ATOM 0 HG22 THR A 77 -71.323 27.257 106.445 1.00 0.00 H new ATOM 0 HG23 THR A 77 -71.558 28.829 107.245 1.00 0.00 H new ATOM 1196 N ASN A 78 -69.954 25.386 108.901 1.00 0.00 N ATOM 1197 CA ASN A 78 -70.163 23.962 108.641 1.00 0.00 C ATOM 1198 C ASN A 78 -71.086 23.780 107.425 1.00 0.00 C ATOM 1199 O ASN A 78 -72.080 24.489 107.293 1.00 0.00 O ATOM 1200 CB ASN A 78 -70.662 23.234 109.898 1.00 0.00 C ATOM 1201 CG ASN A 78 -72.029 23.708 110.356 1.00 0.00 C ATOM 1202 OD1 ASN A 78 -72.152 24.736 111.003 1.00 0.00 O ATOM 1203 ND2 ASN A 78 -73.079 22.977 110.044 1.00 0.00 N ATOM 0 H ASN A 78 -70.446 25.742 109.721 1.00 0.00 H new ATOM 0 HA ASN A 78 -69.209 23.497 108.391 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -70.703 22.163 109.698 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -69.944 23.380 110.705 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -74.010 23.267 110.343 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -72.961 22.120 109.503 1.00 0.00 H new ATOM 1210 N ILE A 79 -70.738 22.849 106.533 1.00 0.00 N ATOM 1211 CA ILE A 79 -71.345 22.702 105.206 1.00 0.00 C ATOM 1212 C ILE A 79 -71.633 21.226 104.920 1.00 0.00 C ATOM 1213 O ILE A 79 -70.707 20.438 104.717 1.00 0.00 O ATOM 1214 CB ILE A 79 -70.434 23.354 104.130 1.00 0.00 C ATOM 1215 CG1 ILE A 79 -70.387 24.899 104.227 1.00 0.00 C ATOM 1216 CG2 ILE A 79 -70.822 22.945 102.699 1.00 0.00 C ATOM 1217 CD1 ILE A 79 -71.726 25.625 104.016 1.00 0.00 C ATOM 0 H ILE A 79 -70.009 22.160 106.717 1.00 0.00 H new ATOM 0 HA ILE A 79 -72.301 23.225 105.176 1.00 0.00 H new ATOM 0 HB ILE A 79 -69.437 22.969 104.346 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -69.999 25.171 105.209 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -69.675 25.269 103.489 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -70.153 23.430 101.988 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -70.740 21.863 102.595 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -71.848 23.252 102.498 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -71.575 26.701 104.106 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -72.112 25.395 103.023 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -72.441 25.295 104.769 1.00 0.00 H new ATOM 1229 N GLU A 80 -72.921 20.862 104.907 1.00 0.00 N ATOM 1230 CA GLU A 80 -73.420 19.612 104.325 1.00 0.00 C ATOM 1231 C GLU A 80 -73.379 19.672 102.785 1.00 0.00 C ATOM 1232 O GLU A 80 -73.850 20.633 102.168 1.00 0.00 O ATOM 1233 CB GLU A 80 -74.849 19.321 104.817 1.00 0.00 C ATOM 1234 CG GLU A 80 -75.283 17.914 104.373 1.00 0.00 C ATOM 1235 CD GLU A 80 -76.696 17.495 104.794 1.00 0.00 C ATOM 1236 OE1 GLU A 80 -77.489 18.359 105.218 1.00 0.00 O ATOM 1237 OE2 GLU A 80 -76.978 16.279 104.633 1.00 0.00 O ATOM 0 H GLU A 80 -73.659 21.440 105.309 1.00 0.00 H new ATOM 0 HA GLU A 80 -72.771 18.800 104.652 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -74.891 19.397 105.904 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -75.538 20.066 104.419 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -75.215 17.858 103.287 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -74.574 17.190 104.775 1.00 0.00 H new ATOM 1244 N LEU A 81 -72.806 18.635 102.167 1.00 0.00 N ATOM 1245 CA LEU A 81 -72.428 18.605 100.756 1.00 0.00 C ATOM 1246 C LEU A 81 -72.463 17.164 100.205 1.00 0.00 C ATOM 1247 O LEU A 81 -72.154 16.214 100.918 1.00 0.00 O ATOM 1248 CB LEU A 81 -71.046 19.292 100.733 1.00 0.00 C ATOM 1249 CG LEU A 81 -70.151 19.129 99.505 1.00 0.00 C ATOM 1250 CD1 LEU A 81 -70.789 19.590 98.198 1.00 0.00 C ATOM 1251 CD2 LEU A 81 -68.876 19.952 99.740 1.00 0.00 C ATOM 0 H LEU A 81 -72.586 17.766 102.654 1.00 0.00 H new ATOM 0 HA LEU A 81 -73.115 19.129 100.092 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -71.208 20.360 100.881 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -70.487 18.932 101.596 1.00 0.00 H new ATOM 0 HG LEU A 81 -69.955 18.063 99.392 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -70.087 19.440 97.378 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -71.694 19.012 98.011 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -71.042 20.648 98.270 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -68.216 19.855 98.878 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -69.140 21.000 99.878 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -68.366 19.586 100.631 1.00 0.00 H new ATOM 1263 N GLU A 82 -72.859 16.986 98.938 1.00 0.00 N ATOM 1264 CA GLU A 82 -73.124 15.691 98.295 1.00 0.00 C ATOM 1265 C GLU A 82 -72.150 15.455 97.112 1.00 0.00 C ATOM 1266 O GLU A 82 -72.361 16.006 96.030 1.00 0.00 O ATOM 1267 CB GLU A 82 -74.621 15.646 97.910 1.00 0.00 C ATOM 1268 CG GLU A 82 -75.277 14.255 97.894 1.00 0.00 C ATOM 1269 CD GLU A 82 -75.186 13.477 96.574 1.00 0.00 C ATOM 1270 OE1 GLU A 82 -74.620 13.992 95.583 1.00 0.00 O ATOM 1271 OE2 GLU A 82 -75.660 12.316 96.572 1.00 0.00 O ATOM 0 H GLU A 82 -73.010 17.772 98.306 1.00 0.00 H new ATOM 0 HA GLU A 82 -72.935 14.861 98.976 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -75.173 16.277 98.607 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -74.734 16.089 96.921 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -74.821 13.652 98.679 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -76.330 14.370 98.152 1.00 0.00 H new ATOM 1278 N PRO A 83 -71.038 14.713 97.309 1.00 0.00 N ATOM 1279 CA PRO A 83 -70.124 14.269 96.243 1.00 0.00 C ATOM 1280 C PRO A 83 -70.678 13.066 95.451 1.00 0.00 C ATOM 1281 O PRO A 83 -71.654 12.451 95.878 1.00 0.00 O ATOM 1282 CB PRO A 83 -68.826 13.879 96.966 1.00 0.00 C ATOM 1283 CG PRO A 83 -69.237 13.570 98.402 1.00 0.00 C ATOM 1284 CD PRO A 83 -70.555 14.298 98.616 1.00 0.00 C ATOM 0 HA PRO A 83 -69.979 15.060 95.507 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -68.360 13.013 96.496 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -68.099 14.690 96.932 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -69.353 12.497 98.554 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -68.481 13.912 99.108 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -71.279 13.646 99.104 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -70.416 15.162 99.266 1.00 0.00 H new ATOM 1292 N PRO A 84 -70.057 12.646 94.330 1.00 0.00 N ATOM 1293 CA PRO A 84 -70.381 11.373 93.681 1.00 0.00 C ATOM 1294 C PRO A 84 -69.956 10.175 94.547 1.00 0.00 C ATOM 1295 O PRO A 84 -69.136 10.304 95.458 1.00 0.00 O ATOM 1296 CB PRO A 84 -69.599 11.390 92.363 1.00 0.00 C ATOM 1297 CG PRO A 84 -68.358 12.199 92.731 1.00 0.00 C ATOM 1298 CD PRO A 84 -68.933 13.277 93.651 1.00 0.00 C ATOM 0 HA PRO A 84 -71.454 11.265 93.525 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -69.344 10.384 92.028 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -70.167 11.859 91.559 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -67.610 11.589 93.237 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -67.877 12.629 91.852 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -68.186 13.623 94.366 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -69.257 14.148 93.081 1.00 0.00 H new ATOM 1306 N PHE A 85 -70.472 8.982 94.234 1.00 0.00 N ATOM 1307 CA PHE A 85 -69.958 7.718 94.769 1.00 0.00 C ATOM 1308 C PHE A 85 -68.612 7.381 94.105 1.00 0.00 C ATOM 1309 O PHE A 85 -68.567 6.717 93.071 1.00 0.00 O ATOM 1310 CB PHE A 85 -70.999 6.602 94.602 1.00 0.00 C ATOM 1311 CG PHE A 85 -72.289 6.851 95.363 1.00 0.00 C ATOM 1312 CD1 PHE A 85 -72.350 6.615 96.751 1.00 0.00 C ATOM 1313 CD2 PHE A 85 -73.428 7.329 94.687 1.00 0.00 C ATOM 1314 CE1 PHE A 85 -73.543 6.857 97.457 1.00 0.00 C ATOM 1315 CE2 PHE A 85 -74.620 7.571 95.393 1.00 0.00 C ATOM 1316 CZ PHE A 85 -74.678 7.335 96.778 1.00 0.00 C ATOM 0 H PHE A 85 -71.262 8.866 93.599 1.00 0.00 H new ATOM 0 HA PHE A 85 -69.776 7.817 95.839 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -71.229 6.487 93.543 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -70.566 5.660 94.938 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -71.479 6.248 97.274 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -73.386 7.510 93.623 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -73.587 6.676 98.521 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -75.491 7.938 94.871 1.00 0.00 H new ATOM 0 HZ PHE A 85 -75.594 7.521 97.320 1.00 0.00 H new ATOM 1326 N GLY A 86 -67.519 7.890 94.679 1.00 0.00 N ATOM 1327 CA GLY A 86 -66.170 7.808 94.125 1.00 0.00 C ATOM 1328 C GLY A 86 -65.180 8.692 94.889 1.00 0.00 C ATOM 1329 O GLY A 86 -65.531 9.267 95.923 1.00 0.00 O ATOM 0 H GLY A 86 -67.552 8.386 95.570 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -65.829 6.773 94.154 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -66.190 8.108 93.077 1.00 0.00 H new ATOM 1333 N ASP A 87 -63.948 8.786 94.370 1.00 0.00 N ATOM 1334 CA ASP A 87 -62.971 9.810 94.766 1.00 0.00 C ATOM 1335 C ASP A 87 -63.377 11.181 94.196 1.00 0.00 C ATOM 1336 O ASP A 87 -64.161 11.273 93.243 1.00 0.00 O ATOM 1337 CB ASP A 87 -61.556 9.407 94.297 1.00 0.00 C ATOM 1338 CG ASP A 87 -60.447 10.340 94.818 1.00 0.00 C ATOM 1339 OD1 ASP A 87 -60.646 10.947 95.889 1.00 0.00 O ATOM 1340 OD2 ASP A 87 -59.403 10.483 94.136 1.00 0.00 O ATOM 0 H ASP A 87 -63.598 8.147 93.656 1.00 0.00 H new ATOM 0 HA ASP A 87 -62.957 9.887 95.853 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -61.349 8.389 94.627 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -61.531 9.400 93.207 1.00 0.00 H new ATOM 1345 N SER A 88 -62.874 12.268 94.782 1.00 0.00 N ATOM 1346 CA SER A 88 -63.215 13.642 94.411 1.00 0.00 C ATOM 1347 C SER A 88 -62.334 14.679 95.107 1.00 0.00 C ATOM 1348 O SER A 88 -61.782 14.431 96.182 1.00 0.00 O ATOM 1349 CB SER A 88 -64.665 13.922 94.799 1.00 0.00 C ATOM 1350 OG SER A 88 -65.540 13.303 93.883 1.00 0.00 O ATOM 0 H SER A 88 -62.201 12.216 95.547 1.00 0.00 H new ATOM 0 HA SER A 88 -63.058 13.728 93.336 1.00 0.00 H new ATOM 0 HB2 SER A 88 -64.858 13.551 95.806 1.00 0.00 H new ATOM 0 HB3 SER A 88 -64.844 14.997 94.815 1.00 0.00 H new ATOM 0 HG SER A 88 -65.029 12.711 93.292 1.00 0.00 H new ATOM 1356 N TYR A 89 -62.266 15.876 94.507 1.00 0.00 N ATOM 1357 CA TYR A 89 -61.417 16.979 94.956 1.00 0.00 C ATOM 1358 C TYR A 89 -62.251 18.241 95.160 1.00 0.00 C ATOM 1359 O TYR A 89 -62.702 18.898 94.222 1.00 0.00 O ATOM 1360 CB TYR A 89 -60.198 17.145 94.042 1.00 0.00 C ATOM 1361 CG TYR A 89 -59.345 15.893 94.113 1.00 0.00 C ATOM 1362 CD1 TYR A 89 -59.668 14.806 93.283 1.00 0.00 C ATOM 1363 CD2 TYR A 89 -58.390 15.734 95.140 1.00 0.00 C ATOM 1364 CE1 TYR A 89 -59.107 13.542 93.530 1.00 0.00 C ATOM 1365 CE2 TYR A 89 -57.803 14.471 95.367 1.00 0.00 C ATOM 1366 CZ TYR A 89 -58.199 13.358 94.591 1.00 0.00 C ATOM 1367 OH TYR A 89 -57.716 12.116 94.847 1.00 0.00 O ATOM 0 H TYR A 89 -62.814 16.105 93.678 1.00 0.00 H new ATOM 0 HA TYR A 89 -60.996 16.749 95.935 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -60.520 17.322 93.016 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -59.615 18.014 94.348 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -60.348 14.942 92.455 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -58.109 16.578 95.752 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -59.374 12.705 92.902 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -57.051 14.355 96.134 1.00 0.00 H new ATOM 0 HH TYR A 89 -58.177 11.463 94.280 1.00 0.00 H new ATOM 1377 N ILE A 90 -62.510 18.504 96.435 1.00 0.00 N ATOM 1378 CA ILE A 90 -63.285 19.596 96.995 1.00 0.00 C ATOM 1379 C ILE A 90 -62.395 20.833 96.953 1.00 0.00 C ATOM 1380 O ILE A 90 -61.288 20.799 97.490 1.00 0.00 O ATOM 1381 CB ILE A 90 -63.689 19.240 98.445 1.00 0.00 C ATOM 1382 CG1 ILE A 90 -64.632 18.025 98.548 1.00 0.00 C ATOM 1383 CG2 ILE A 90 -64.397 20.434 99.114 1.00 0.00 C ATOM 1384 CD1 ILE A 90 -64.061 16.643 98.216 1.00 0.00 C ATOM 0 H ILE A 90 -62.146 17.898 97.170 1.00 0.00 H new ATOM 0 HA ILE A 90 -64.202 19.779 96.434 1.00 0.00 H new ATOM 0 HB ILE A 90 -62.755 18.990 98.948 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -65.022 17.990 99.565 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -65.480 18.204 97.887 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -64.675 20.167 100.134 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -63.724 21.291 99.134 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -65.293 20.689 98.549 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -64.840 15.890 98.333 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -63.701 16.636 97.187 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -63.235 16.419 98.891 1.00 0.00 H new ATOM 1396 N VAL A 91 -62.871 21.920 96.337 1.00 0.00 N ATOM 1397 CA VAL A 91 -62.138 23.193 96.304 1.00 0.00 C ATOM 1398 C VAL A 91 -62.937 24.241 97.072 1.00 0.00 C ATOM 1399 O VAL A 91 -64.140 24.362 96.855 1.00 0.00 O ATOM 1400 CB VAL A 91 -61.688 23.639 94.889 1.00 0.00 C ATOM 1401 CG1 VAL A 91 -61.393 22.456 93.954 1.00 0.00 C ATOM 1402 CG2 VAL A 91 -62.630 24.622 94.185 1.00 0.00 C ATOM 0 H VAL A 91 -63.767 21.945 95.851 1.00 0.00 H new ATOM 0 HA VAL A 91 -61.182 23.052 96.809 1.00 0.00 H new ATOM 0 HB VAL A 91 -60.763 24.179 95.090 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -61.083 22.832 92.979 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -60.595 21.847 94.379 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -62.291 21.849 93.840 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -62.227 24.872 93.204 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -63.612 24.164 94.068 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -62.721 25.529 94.782 1.00 0.00 H new ATOM 1412 N ILE A 92 -62.280 24.960 97.991 1.00 0.00 N ATOM 1413 CA ILE A 92 -62.872 26.020 98.820 1.00 0.00 C ATOM 1414 C ILE A 92 -61.992 27.271 98.715 1.00 0.00 C ATOM 1415 O ILE A 92 -60.974 27.392 99.402 1.00 0.00 O ATOM 1416 CB ILE A 92 -63.084 25.566 100.282 1.00 0.00 C ATOM 1417 CG1 ILE A 92 -63.772 24.184 100.370 1.00 0.00 C ATOM 1418 CG2 ILE A 92 -63.810 26.665 101.081 1.00 0.00 C ATOM 1419 CD1 ILE A 92 -64.062 23.707 101.795 1.00 0.00 C ATOM 0 H ILE A 92 -61.289 24.816 98.185 1.00 0.00 H new ATOM 0 HA ILE A 92 -63.869 26.256 98.448 1.00 0.00 H new ATOM 0 HB ILE A 92 -62.108 25.424 100.746 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -64.710 24.224 99.816 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -63.141 23.446 99.875 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -63.953 26.333 102.109 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -63.211 27.576 101.074 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -64.780 26.865 100.626 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -64.545 22.730 101.761 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -63.127 23.631 102.350 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -64.721 24.420 102.290 1.00 0.00 H new ATOM 1431 N GLY A 93 -62.367 28.167 97.801 1.00 0.00 N ATOM 1432 CA GLY A 93 -61.575 29.302 97.319 1.00 0.00 C ATOM 1433 C GLY A 93 -61.485 29.259 95.789 1.00 0.00 C ATOM 1434 O GLY A 93 -62.165 28.454 95.155 1.00 0.00 O ATOM 0 H GLY A 93 -63.281 28.119 97.352 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -62.032 30.238 97.640 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -60.575 29.270 97.752 1.00 0.00 H new ATOM 1438 N VAL A 94 -60.644 30.102 95.181 1.00 0.00 N ATOM 1439 CA VAL A 94 -60.408 30.079 93.720 1.00 0.00 C ATOM 1440 C VAL A 94 -58.960 29.674 93.410 1.00 0.00 C ATOM 1441 O VAL A 94 -58.180 29.421 94.324 1.00 0.00 O ATOM 1442 CB VAL A 94 -60.857 31.390 93.038 1.00 0.00 C ATOM 1443 CG1 VAL A 94 -62.281 31.802 93.441 1.00 0.00 C ATOM 1444 CG2 VAL A 94 -59.888 32.542 93.305 1.00 0.00 C ATOM 0 H VAL A 94 -60.109 30.816 95.675 1.00 0.00 H new ATOM 0 HA VAL A 94 -61.041 29.309 93.279 1.00 0.00 H new ATOM 0 HB VAL A 94 -60.854 31.180 91.969 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -62.549 32.729 92.935 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -62.981 31.017 93.155 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -62.325 31.952 94.520 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -60.246 33.442 92.805 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -59.825 32.723 94.378 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -58.901 32.283 92.923 1.00 0.00 H new ATOM 1454 N GLY A 95 -58.572 29.583 92.132 1.00 0.00 N ATOM 1455 CA GLY A 95 -57.299 28.976 91.708 1.00 0.00 C ATOM 1456 C GLY A 95 -56.014 29.537 92.348 1.00 0.00 C ATOM 1457 O GLY A 95 -55.003 28.844 92.361 1.00 0.00 O ATOM 0 H GLY A 95 -59.135 29.930 91.356 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -57.345 27.908 91.919 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -57.215 29.084 90.627 1.00 0.00 H new ATOM 1461 N ASN A 96 -56.047 30.756 92.905 1.00 0.00 N ATOM 1462 CA ASN A 96 -54.937 31.384 93.632 1.00 0.00 C ATOM 1463 C ASN A 96 -55.007 31.230 95.170 1.00 0.00 C ATOM 1464 O ASN A 96 -54.175 31.811 95.865 1.00 0.00 O ATOM 1465 CB ASN A 96 -54.879 32.869 93.225 1.00 0.00 C ATOM 1466 CG ASN A 96 -56.111 33.650 93.667 1.00 0.00 C ATOM 1467 OD1 ASN A 96 -57.005 33.914 92.882 1.00 0.00 O ATOM 1468 ND2 ASN A 96 -56.210 33.988 94.937 1.00 0.00 N ATOM 0 H ASN A 96 -56.875 31.351 92.860 1.00 0.00 H new ATOM 0 HA ASN A 96 -54.023 30.861 93.351 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -53.990 33.326 93.659 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -54.778 32.941 92.142 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -57.041 34.476 95.272 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -55.456 33.762 95.585 1.00 0.00 H new ATOM 1475 N SER A 97 -56.028 30.558 95.720 1.00 0.00 N ATOM 1476 CA SER A 97 -56.334 30.571 97.162 1.00 0.00 C ATOM 1477 C SER A 97 -57.085 29.348 97.707 1.00 0.00 C ATOM 1478 O SER A 97 -57.244 29.233 98.924 1.00 0.00 O ATOM 1479 CB SER A 97 -57.167 31.817 97.469 1.00 0.00 C ATOM 1480 OG SER A 97 -58.369 31.829 96.717 1.00 0.00 O ATOM 0 H SER A 97 -56.671 29.985 95.174 1.00 0.00 H new ATOM 0 HA SER A 97 -55.364 30.560 97.658 1.00 0.00 H new ATOM 0 HB2 SER A 97 -57.401 31.848 98.533 1.00 0.00 H new ATOM 0 HB3 SER A 97 -56.585 32.711 97.244 1.00 0.00 H new ATOM 0 HG SER A 97 -58.422 32.658 96.198 1.00 0.00 H new ATOM 1486 N ALA A 98 -57.560 28.449 96.841 1.00 0.00 N ATOM 1487 CA ALA A 98 -58.417 27.329 97.197 1.00 0.00 C ATOM 1488 C ALA A 98 -57.756 26.314 98.131 1.00 0.00 C ATOM 1489 O ALA A 98 -56.730 25.714 97.800 1.00 0.00 O ATOM 1490 CB ALA A 98 -58.909 26.633 95.925 1.00 0.00 C ATOM 0 H ALA A 98 -57.349 28.487 95.844 1.00 0.00 H new ATOM 0 HA ALA A 98 -59.256 27.746 97.754 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -59.551 25.794 96.194 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -59.473 27.341 95.318 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -58.054 26.268 95.356 1.00 0.00 H new ATOM 1496 N LEU A 99 -58.447 26.006 99.233 1.00 0.00 N ATOM 1497 CA LEU A 99 -58.310 24.714 99.895 1.00 0.00 C ATOM 1498 C LEU A 99 -58.762 23.640 98.904 1.00 0.00 C ATOM 1499 O LEU A 99 -59.960 23.440 98.724 1.00 0.00 O ATOM 1500 CB LEU A 99 -59.190 24.635 101.147 1.00 0.00 C ATOM 1501 CG LEU A 99 -58.959 25.720 102.197 1.00 0.00 C ATOM 1502 CD1 LEU A 99 -60.207 25.775 103.075 1.00 0.00 C ATOM 1503 CD2 LEU A 99 -57.717 25.381 103.022 1.00 0.00 C ATOM 0 H LEU A 99 -59.108 26.639 99.683 1.00 0.00 H new ATOM 0 HA LEU A 99 -57.274 24.572 100.201 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -60.234 24.674 100.836 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -59.033 23.664 101.616 1.00 0.00 H new ATOM 0 HG LEU A 99 -58.789 26.692 101.734 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -60.080 26.541 103.840 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -61.074 26.016 102.460 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -60.359 24.807 103.552 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -57.554 26.157 103.770 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -57.861 24.422 103.519 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -56.849 25.323 102.365 1.00 0.00 H new ATOM 1515 N THR A 100 -57.815 22.995 98.226 1.00 0.00 N ATOM 1516 CA THR A 100 -58.086 21.844 97.363 1.00 0.00 C ATOM 1517 C THR A 100 -57.817 20.578 98.171 1.00 0.00 C ATOM 1518 O THR A 100 -56.659 20.217 98.374 1.00 0.00 O ATOM 1519 CB THR A 100 -57.254 21.913 96.076 1.00 0.00 C ATOM 1520 OG1 THR A 100 -57.576 23.113 95.406 1.00 0.00 O ATOM 1521 CG2 THR A 100 -57.560 20.750 95.129 1.00 0.00 C ATOM 0 H THR A 100 -56.830 23.257 98.259 1.00 0.00 H new ATOM 0 HA THR A 100 -59.127 21.842 97.040 1.00 0.00 H new ATOM 0 HB THR A 100 -56.201 21.864 96.352 1.00 0.00 H new ATOM 0 HG1 THR A 100 -57.052 23.177 94.580 1.00 0.00 H new ATOM 0 HG21 THR A 100 -56.948 20.841 94.232 1.00 0.00 H new ATOM 0 HG22 THR A 100 -57.336 19.807 95.627 1.00 0.00 H new ATOM 0 HG23 THR A 100 -58.614 20.773 94.853 1.00 0.00 H new ATOM 1529 N LEU A 101 -58.879 19.939 98.674 1.00 0.00 N ATOM 1530 CA LEU A 101 -58.807 18.760 99.539 1.00 0.00 C ATOM 1531 C LEU A 101 -59.640 17.586 98.999 1.00 0.00 C ATOM 1532 O LEU A 101 -60.445 17.726 98.082 1.00 0.00 O ATOM 1533 CB LEU A 101 -59.144 19.134 101.000 1.00 0.00 C ATOM 1534 CG LEU A 101 -60.573 19.674 101.232 1.00 0.00 C ATOM 1535 CD1 LEU A 101 -61.201 19.047 102.475 1.00 0.00 C ATOM 1536 CD2 LEU A 101 -60.598 21.191 101.420 1.00 0.00 C ATOM 0 H LEU A 101 -59.836 20.237 98.485 1.00 0.00 H new ATOM 0 HA LEU A 101 -57.778 18.399 99.535 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -59.001 18.253 101.625 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -58.430 19.885 101.339 1.00 0.00 H new ATOM 0 HG LEU A 101 -61.138 19.410 100.338 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -62.206 19.445 102.615 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -61.253 17.965 102.350 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -60.593 19.283 103.348 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -61.625 21.521 101.580 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -59.992 21.461 102.285 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -60.196 21.675 100.530 1.00 0.00 H new ATOM 1548 N HIS A 102 -59.400 16.403 99.555 1.00 0.00 N ATOM 1549 CA HIS A 102 -59.856 15.108 99.055 1.00 0.00 C ATOM 1550 C HIS A 102 -61.104 14.560 99.753 1.00 0.00 C ATOM 1551 O HIS A 102 -61.311 14.780 100.946 1.00 0.00 O ATOM 1552 CB HIS A 102 -58.702 14.111 99.245 1.00 0.00 C ATOM 1553 CG HIS A 102 -58.037 14.082 100.614 1.00 0.00 C ATOM 1554 ND1 HIS A 102 -58.389 14.760 101.774 1.00 0.00 N ATOM 1555 CD2 HIS A 102 -56.874 13.412 100.881 1.00 0.00 C ATOM 1556 CE1 HIS A 102 -57.436 14.519 102.688 1.00 0.00 C ATOM 1557 NE2 HIS A 102 -56.505 13.691 102.198 1.00 0.00 N ATOM 0 H HIS A 102 -58.853 16.316 100.412 1.00 0.00 H new ATOM 0 HA HIS A 102 -60.137 15.244 98.011 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -59.078 13.111 99.029 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -57.937 14.331 98.501 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -56.335 12.778 100.193 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -57.422 14.937 103.684 1.00 0.00 H new ATOM 0 HE2 HIS A 102 -55.686 13.334 102.691 1.00 0.00 H new ATOM 1565 N TRP A 103 -61.874 13.731 99.039 1.00 0.00 N ATOM 1566 CA TRP A 103 -62.866 12.842 99.644 1.00 0.00 C ATOM 1567 C TRP A 103 -63.067 11.575 98.823 1.00 0.00 C ATOM 1568 O TRP A 103 -63.073 11.631 97.598 1.00 0.00 O ATOM 1569 CB TRP A 103 -64.209 13.560 99.736 1.00 0.00 C ATOM 1570 CG TRP A 103 -65.279 12.837 100.488 1.00 0.00 C ATOM 1571 CD1 TRP A 103 -66.437 12.374 99.966 1.00 0.00 C ATOM 1572 CD2 TRP A 103 -65.303 12.478 101.898 1.00 0.00 C ATOM 1573 NE1 TRP A 103 -67.215 11.840 100.975 1.00 0.00 N ATOM 1574 CE2 TRP A 103 -66.566 11.889 102.187 1.00 0.00 C ATOM 1575 CE3 TRP A 103 -64.385 12.591 102.963 1.00 0.00 C ATOM 1576 CZ2 TRP A 103 -66.932 11.498 103.480 1.00 0.00 C ATOM 1577 CZ3 TRP A 103 -64.725 12.150 104.253 1.00 0.00 C ATOM 1578 CH2 TRP A 103 -66.005 11.637 104.524 1.00 0.00 C ATOM 0 H TRP A 103 -61.825 13.659 98.023 1.00 0.00 H new ATOM 0 HA TRP A 103 -62.496 12.569 100.632 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -64.050 14.530 100.208 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -64.568 13.752 98.725 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -66.711 12.415 98.922 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -68.151 11.458 100.839 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -63.410 13.021 102.785 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -67.915 11.094 103.672 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -63.994 12.206 105.046 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -66.274 11.351 105.530 1.00 0.00 H new ATOM 1589 N PHE A 104 -63.365 10.469 99.507 1.00 0.00 N ATOM 1590 CA PHE A 104 -63.898 9.261 98.892 1.00 0.00 C ATOM 1591 C PHE A 104 -65.216 8.893 99.582 1.00 0.00 C ATOM 1592 O PHE A 104 -65.229 8.552 100.767 1.00 0.00 O ATOM 1593 CB PHE A 104 -62.867 8.131 98.933 1.00 0.00 C ATOM 1594 CG PHE A 104 -63.409 6.862 98.305 1.00 0.00 C ATOM 1595 CD1 PHE A 104 -63.345 6.667 96.916 1.00 0.00 C ATOM 1596 CD2 PHE A 104 -64.086 5.930 99.106 1.00 0.00 C ATOM 1597 CE1 PHE A 104 -63.997 5.569 96.325 1.00 0.00 C ATOM 1598 CE2 PHE A 104 -64.729 4.824 98.523 1.00 0.00 C ATOM 1599 CZ PHE A 104 -64.700 4.654 97.128 1.00 0.00 C ATOM 0 H PHE A 104 -63.240 10.390 100.516 1.00 0.00 H new ATOM 0 HA PHE A 104 -64.109 9.436 97.837 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -61.964 8.442 98.407 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -62.582 7.934 99.967 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -62.794 7.362 96.300 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -64.113 6.063 100.177 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -63.957 5.429 95.255 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -65.244 4.107 99.145 1.00 0.00 H new ATOM 0 HZ PHE A 104 -65.217 3.822 96.674 1.00 0.00 H new ATOM 1609 N ARG A 105 -66.333 9.013 98.853 1.00 0.00 N ATOM 1610 CA ARG A 105 -67.674 8.769 99.402 1.00 0.00 C ATOM 1611 C ARG A 105 -67.870 7.293 99.763 1.00 0.00 C ATOM 1612 O ARG A 105 -67.372 6.396 99.087 1.00 0.00 O ATOM 1613 CB ARG A 105 -68.719 9.275 98.399 1.00 0.00 C ATOM 1614 CG ARG A 105 -70.154 9.291 98.950 1.00 0.00 C ATOM 1615 CD ARG A 105 -71.102 9.949 97.942 1.00 0.00 C ATOM 1616 NE ARG A 105 -72.434 10.199 98.515 1.00 0.00 N ATOM 1617 CZ ARG A 105 -73.527 10.522 97.840 1.00 0.00 C ATOM 1618 NH1 ARG A 105 -73.557 10.720 96.551 1.00 0.00 N ATOM 1619 NH2 ARG A 105 -74.637 10.765 98.476 1.00 0.00 N ATOM 0 H ARG A 105 -66.333 9.281 97.869 1.00 0.00 H new ATOM 0 HA ARG A 105 -67.796 9.320 100.335 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -68.449 10.284 98.086 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -68.689 8.646 97.509 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -70.483 8.273 99.158 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -70.182 9.834 99.895 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -70.672 10.891 97.602 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -71.200 9.308 97.065 1.00 0.00 H new ATOM 0 HE ARG A 105 -72.524 10.116 99.528 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -72.703 10.628 96.001 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -74.434 10.967 96.093 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -74.665 10.707 99.494 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -75.479 11.014 97.956 1.00 0.00 H new ATOM 1633 N LYS A 106 -68.606 7.044 100.848 1.00 0.00 N ATOM 1634 CA LYS A 106 -68.895 5.757 101.497 1.00 0.00 C ATOM 1635 C LYS A 106 -67.698 4.981 102.067 1.00 0.00 C ATOM 1636 O LYS A 106 -67.891 4.263 103.044 1.00 0.00 O ATOM 1637 CB LYS A 106 -69.825 4.883 100.630 1.00 0.00 C ATOM 1638 CG LYS A 106 -71.305 4.950 101.042 1.00 0.00 C ATOM 1639 CD LYS A 106 -71.656 4.163 102.323 1.00 0.00 C ATOM 1640 CE LYS A 106 -71.300 4.823 103.666 1.00 0.00 C ATOM 1641 NZ LYS A 106 -71.977 6.131 103.853 1.00 0.00 N ATOM 0 H LYS A 106 -69.060 7.811 101.345 1.00 0.00 H new ATOM 0 HA LYS A 106 -69.430 6.038 102.404 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -69.733 5.194 99.589 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -69.489 3.847 100.684 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -71.580 5.995 101.187 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -71.914 4.571 100.221 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -72.728 3.965 102.316 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -71.153 3.197 102.276 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -71.577 4.154 104.481 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -70.221 4.965 103.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -72.127 6.303 104.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -71.384 6.888 103.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -72.895 6.120 103.365 1.00 0.00 H new