USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 836 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 84 ASN : amide:sc= -0.512 X(o=-5.9,f=-6!) USER MOD Set 1.2: A 87 ASN : amide:sc= -5.36! C(o=-5.9!,f=-5.8!) USER MOD Set 2.1: A 65 LYS NZ :NH3+ -131:sc= -0.541 (180deg=-1.52!) USER MOD Set 2.2: A 68 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 29 GLN : amide:sc= 0.405 K(o=0.28,f=-11!) USER MOD Set 3.2: A 31 LYS NZ :NH3+ 173:sc= -0.128 (180deg=-0.318) USER MOD Set 4.1: A 20 THR OG1 : rot -73:sc= -1.12 USER MOD Set 4.2: A 108 MET CE :methyl -142:sc= -0.0213 (180deg=-0.361) USER MOD Single : A 12 TYR OH : rot -120:sc= -2.03 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 152:sc= -0.41! USER MOD Single : A 24 SER OG : rot -78:sc= -0.703 USER MOD Single : A 27 SER OG : rot -81:sc= 0.652 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -0.173 X(o=-0.17,f=-0.48) USER MOD Single : A 34 GLN : amide:sc= -2.65 X(o=-2.6,f=-3) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 MET CE :methyl 138:sc= -3.82 (180deg=-7.9!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -3.28 X(o=-3.3,f=-3.4!) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot 180:sc= -0.661 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl -123:sc= -1.65 (180deg=-4.05!) USER MOD Single : A 73 THR OG1 : rot 57:sc= -5.84! USER MOD Single : A 75 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.25) USER MOD Single : A 77 LYS NZ :NH3+ 158:sc= 0.211 (180deg=-0.348) USER MOD Single : A 79 SER OG : rot 75:sc= 1.04 USER MOD Single : A 82 THR OG1 : rot -80:sc= -1.21 USER MOD Single : A 83 SER OG : rot -178:sc= -2.27! USER MOD Single : A 92 ASN : amide:sc= -0.241 K(o=-0.24,f=-3.1!) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 ASN : amide:sc= -0.107 X(o=-0.11,f=0) USER MOD Single : A 98 THR OG1 : rot -51:sc= -2.79 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot -43:sc= 1.24 USER MOD Single : A 112 HIS : no HD1:sc= -6.77! C(o=-6.8!,f=-9.9!) USER MOD ----------------------------------------------------------------- ATOM 193 N TYR A 12 -2.344 3.309 14.506 1.00 0.00 N ATOM 194 CA TYR A 12 -2.624 4.585 15.162 1.00 0.00 C ATOM 195 C TYR A 12 -4.005 5.114 14.782 1.00 0.00 C ATOM 196 O TYR A 12 -4.929 5.093 15.596 1.00 0.00 O ATOM 197 CB TYR A 12 -1.537 5.605 14.788 1.00 0.00 C ATOM 198 CG TYR A 12 -0.338 4.957 14.131 1.00 0.00 C ATOM 199 CD1 TYR A 12 0.356 3.949 14.782 1.00 0.00 C ATOM 200 CD2 TYR A 12 0.067 5.315 12.853 1.00 0.00 C ATOM 201 CE1 TYR A 12 1.420 3.314 14.186 1.00 0.00 C ATOM 202 CE2 TYR A 12 1.142 4.688 12.249 1.00 0.00 C ATOM 203 CZ TYR A 12 1.814 3.686 12.920 1.00 0.00 C ATOM 204 OH TYR A 12 2.879 3.054 12.322 1.00 0.00 O ATOM 0 HA TYR A 12 -2.618 4.428 16.241 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -1.959 6.350 14.113 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -1.215 6.133 15.685 1.00 0.00 H new ATOM 0 HD1 TYR A 12 0.055 3.657 15.777 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -0.463 6.093 12.323 1.00 0.00 H new ATOM 0 HE1 TYR A 12 1.944 2.527 14.708 1.00 0.00 H new ATOM 0 HE2 TYR A 12 1.454 4.981 11.257 1.00 0.00 H new ATOM 0 HH TYR A 12 3.577 3.711 12.119 1.00 0.00 H new ATOM 214 N GLY A 13 -4.142 5.587 13.547 1.00 0.00 N ATOM 215 CA GLY A 13 -5.420 6.110 13.101 1.00 0.00 C ATOM 216 C GLY A 13 -5.421 6.503 11.636 1.00 0.00 C ATOM 217 O GLY A 13 -5.792 5.706 10.775 1.00 0.00 O ATOM 0 H GLY A 13 -3.396 5.617 12.852 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -6.192 5.360 13.271 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -5.681 6.979 13.705 1.00 0.00 H new ATOM 221 N ILE A 14 -5.016 7.738 11.353 1.00 0.00 N ATOM 222 CA ILE A 14 -4.982 8.239 9.982 1.00 0.00 C ATOM 223 C ILE A 14 -4.277 7.264 9.044 1.00 0.00 C ATOM 224 O ILE A 14 -4.774 6.963 7.960 1.00 0.00 O ATOM 225 CB ILE A 14 -4.296 9.622 9.907 1.00 0.00 C ATOM 226 CG1 ILE A 14 -4.536 10.270 8.536 1.00 0.00 C ATOM 227 CG2 ILE A 14 -2.806 9.506 10.201 1.00 0.00 C ATOM 228 CD1 ILE A 14 -3.734 9.652 7.408 1.00 0.00 C ATOM 0 H ILE A 14 -4.707 8.410 12.055 1.00 0.00 H new ATOM 0 HA ILE A 14 -6.018 8.342 9.659 1.00 0.00 H new ATOM 0 HB ILE A 14 -4.738 10.264 10.669 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -5.596 10.200 8.294 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -4.294 11.331 8.600 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -2.346 10.492 10.142 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -2.663 9.098 11.202 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -2.341 8.844 9.470 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -3.962 10.167 6.475 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -2.670 9.746 7.624 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -3.993 8.597 7.313 1.00 0.00 H new ATOM 240 N GLU A 15 -3.119 6.768 9.467 1.00 0.00 N ATOM 241 CA GLU A 15 -2.360 5.825 8.658 1.00 0.00 C ATOM 242 C GLU A 15 -3.038 4.460 8.650 1.00 0.00 C ATOM 243 O GLU A 15 -2.950 3.717 7.673 1.00 0.00 O ATOM 244 CB GLU A 15 -0.927 5.702 9.180 1.00 0.00 C ATOM 245 CG GLU A 15 0.068 6.572 8.427 1.00 0.00 C ATOM 246 CD GLU A 15 0.921 7.419 9.351 1.00 0.00 C ATOM 247 OE1 GLU A 15 1.032 7.068 10.545 1.00 0.00 O ATOM 248 OE2 GLU A 15 1.478 8.434 8.881 1.00 0.00 O ATOM 0 H GLU A 15 -2.688 7.003 10.361 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.326 6.201 7.636 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -0.908 5.973 10.236 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -0.612 4.661 9.112 1.00 0.00 H new ATOM 0 HG2 GLU A 15 0.715 5.937 7.822 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -0.472 7.223 7.739 1.00 0.00 H new ATOM 255 N GLY A 16 -3.724 4.141 9.743 1.00 0.00 N ATOM 256 CA GLY A 16 -4.418 2.873 9.832 1.00 0.00 C ATOM 257 C GLY A 16 -5.704 2.874 9.034 1.00 0.00 C ATOM 258 O GLY A 16 -6.151 1.830 8.562 1.00 0.00 O ATOM 0 H GLY A 16 -3.811 4.737 10.566 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -3.767 2.077 9.470 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -4.639 2.653 10.876 1.00 0.00 H new ATOM 262 N ARG A 17 -6.298 4.056 8.878 1.00 0.00 N ATOM 263 CA ARG A 17 -7.538 4.194 8.126 1.00 0.00 C ATOM 264 C ARG A 17 -7.285 4.043 6.632 1.00 0.00 C ATOM 265 O ARG A 17 -8.182 3.669 5.880 1.00 0.00 O ATOM 266 CB ARG A 17 -8.188 5.548 8.413 1.00 0.00 C ATOM 267 CG ARG A 17 -9.584 5.689 7.830 1.00 0.00 C ATOM 268 CD ARG A 17 -9.939 7.146 7.579 1.00 0.00 C ATOM 269 NE ARG A 17 -9.711 7.532 6.188 1.00 0.00 N ATOM 270 CZ ARG A 17 -9.710 8.792 5.759 1.00 0.00 C ATOM 271 NH1 ARG A 17 -9.926 9.790 6.609 1.00 0.00 N ATOM 272 NH2 ARG A 17 -9.495 9.057 4.478 1.00 0.00 N ATOM 0 H ARG A 17 -5.939 4.930 9.263 1.00 0.00 H new ATOM 0 HA ARG A 17 -8.216 3.402 8.443 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -8.237 5.696 9.492 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -7.554 6.338 8.011 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -9.647 5.132 6.895 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -10.311 5.249 8.513 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -10.985 7.314 7.835 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -9.344 7.782 8.234 1.00 0.00 H new ATOM 0 HE ARG A 17 -9.543 6.792 5.506 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -10.094 9.592 7.596 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -9.924 10.754 6.275 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -9.330 8.295 3.820 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -9.494 10.023 4.150 1.00 0.00 H new ATOM 286 N TYR A 18 -6.058 4.326 6.201 1.00 0.00 N ATOM 287 CA TYR A 18 -5.703 4.204 4.793 1.00 0.00 C ATOM 288 C TYR A 18 -6.002 2.800 4.294 1.00 0.00 C ATOM 289 O TYR A 18 -6.669 2.614 3.276 1.00 0.00 O ATOM 290 CB TYR A 18 -4.218 4.519 4.589 1.00 0.00 C ATOM 291 CG TYR A 18 -3.954 5.873 3.976 1.00 0.00 C ATOM 292 CD1 TYR A 18 -4.363 7.037 4.613 1.00 0.00 C ATOM 293 CD2 TYR A 18 -3.288 5.988 2.761 1.00 0.00 C ATOM 294 CE1 TYR A 18 -4.117 8.276 4.057 1.00 0.00 C ATOM 295 CE2 TYR A 18 -3.038 7.224 2.199 1.00 0.00 C ATOM 296 CZ TYR A 18 -3.453 8.366 2.850 1.00 0.00 C ATOM 297 OH TYR A 18 -3.206 9.600 2.294 1.00 0.00 O ATOM 0 H TYR A 18 -5.298 4.640 6.804 1.00 0.00 H new ATOM 0 HA TYR A 18 -6.299 4.918 4.225 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -3.710 4.463 5.552 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -3.779 3.752 3.952 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -4.882 6.972 5.558 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -2.961 5.096 2.248 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -4.443 9.172 4.564 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -2.520 7.296 1.254 1.00 0.00 H new ATOM 0 HH TYR A 18 -2.729 9.487 1.445 1.00 0.00 H new ATOM 307 N ALA A 19 -5.507 1.814 5.027 1.00 0.00 N ATOM 308 CA ALA A 19 -5.720 0.422 4.674 1.00 0.00 C ATOM 309 C ALA A 19 -7.182 0.043 4.846 1.00 0.00 C ATOM 310 O ALA A 19 -7.764 -0.626 3.994 1.00 0.00 O ATOM 311 CB ALA A 19 -4.834 -0.477 5.522 1.00 0.00 C ATOM 0 H ALA A 19 -4.954 1.955 5.872 1.00 0.00 H new ATOM 0 HA ALA A 19 -5.453 0.286 3.626 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -5.003 -1.518 5.248 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.788 -0.222 5.352 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -5.075 -0.336 6.576 1.00 0.00 H new ATOM 317 N THR A 20 -7.774 0.476 5.952 1.00 0.00 N ATOM 318 CA THR A 20 -9.169 0.174 6.227 1.00 0.00 C ATOM 319 C THR A 20 -10.099 0.963 5.315 1.00 0.00 C ATOM 320 O THR A 20 -11.269 0.612 5.168 1.00 0.00 O ATOM 321 CB THR A 20 -9.504 0.435 7.692 1.00 0.00 C ATOM 322 OG1 THR A 20 -8.526 1.261 8.294 1.00 0.00 O ATOM 323 CG2 THR A 20 -9.593 -0.839 8.499 1.00 0.00 C ATOM 0 H THR A 20 -7.311 1.035 6.669 1.00 0.00 H new ATOM 0 HA THR A 20 -9.322 -0.886 6.023 1.00 0.00 H new ATOM 0 HB THR A 20 -10.477 0.927 7.693 1.00 0.00 H new ATOM 0 HG1 THR A 20 -7.704 0.746 8.434 1.00 0.00 H new ATOM 0 HG21 THR A 20 -9.834 -0.598 9.534 1.00 0.00 H new ATOM 0 HG22 THR A 20 -10.373 -1.478 8.085 1.00 0.00 H new ATOM 0 HG23 THR A 20 -8.637 -1.361 8.461 1.00 0.00 H new ATOM 331 N ALA A 21 -9.584 2.017 4.692 1.00 0.00 N ATOM 332 CA ALA A 21 -10.398 2.816 3.790 1.00 0.00 C ATOM 333 C ALA A 21 -10.199 2.379 2.346 1.00 0.00 C ATOM 334 O ALA A 21 -10.862 2.880 1.438 1.00 0.00 O ATOM 335 CB ALA A 21 -10.090 4.297 3.955 1.00 0.00 C ATOM 0 H ALA A 21 -8.620 2.333 4.794 1.00 0.00 H new ATOM 0 HA ALA A 21 -11.445 2.656 4.048 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -10.710 4.876 3.271 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -10.301 4.600 4.981 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.038 4.477 3.732 1.00 0.00 H new ATOM 341 N LEU A 22 -9.305 1.417 2.143 1.00 0.00 N ATOM 342 CA LEU A 22 -9.049 0.887 0.813 1.00 0.00 C ATOM 343 C LEU A 22 -9.443 -0.569 0.788 1.00 0.00 C ATOM 344 O LEU A 22 -10.029 -1.055 -0.180 1.00 0.00 O ATOM 345 CB LEU A 22 -7.582 1.052 0.426 1.00 0.00 C ATOM 346 CG LEU A 22 -7.267 0.721 -1.033 1.00 0.00 C ATOM 347 CD1 LEU A 22 -6.359 1.780 -1.639 1.00 0.00 C ATOM 348 CD2 LEU A 22 -6.635 -0.660 -1.143 1.00 0.00 C ATOM 0 H LEU A 22 -8.747 0.990 2.883 1.00 0.00 H new ATOM 0 HA LEU A 22 -9.641 1.443 0.086 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -7.281 2.081 0.624 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -6.976 0.413 1.069 1.00 0.00 H new ATOM 0 HG LEU A 22 -8.202 0.714 -1.594 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -6.147 1.526 -2.678 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.853 2.751 -1.596 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.426 1.823 -1.078 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.418 -0.878 -2.189 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -5.710 -0.684 -0.567 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -7.325 -1.408 -0.752 1.00 0.00 H new ATOM 360 N TYR A 23 -9.153 -1.252 1.881 1.00 0.00 N ATOM 361 CA TYR A 23 -9.513 -2.636 2.010 1.00 0.00 C ATOM 362 C TYR A 23 -10.982 -2.735 2.421 1.00 0.00 C ATOM 363 O TYR A 23 -11.604 -3.777 2.243 1.00 0.00 O ATOM 364 CB TYR A 23 -8.591 -3.339 3.016 1.00 0.00 C ATOM 365 CG TYR A 23 -9.287 -3.834 4.259 1.00 0.00 C ATOM 366 CD1 TYR A 23 -10.169 -4.898 4.191 1.00 0.00 C ATOM 367 CD2 TYR A 23 -9.077 -3.233 5.492 1.00 0.00 C ATOM 368 CE1 TYR A 23 -10.823 -5.360 5.310 1.00 0.00 C ATOM 369 CE2 TYR A 23 -9.727 -3.681 6.619 1.00 0.00 C ATOM 370 CZ TYR A 23 -10.599 -4.748 6.527 1.00 0.00 C ATOM 371 OH TYR A 23 -11.251 -5.195 7.652 1.00 0.00 O ATOM 0 H TYR A 23 -8.668 -0.862 2.689 1.00 0.00 H new ATOM 0 HA TYR A 23 -9.387 -3.142 1.053 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -8.112 -4.184 2.522 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -7.799 -2.649 3.308 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -10.348 -5.376 3.239 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -8.393 -2.401 5.568 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -11.505 -6.194 5.237 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -9.556 -3.201 7.571 1.00 0.00 H new ATOM 0 HH TYR A 23 -10.707 -5.002 8.444 1.00 0.00 H new ATOM 381 N SER A 24 -11.547 -1.636 2.952 1.00 0.00 N ATOM 382 CA SER A 24 -12.951 -1.636 3.348 1.00 0.00 C ATOM 383 C SER A 24 -13.796 -2.197 2.214 1.00 0.00 C ATOM 384 O SER A 24 -14.718 -2.981 2.434 1.00 0.00 O ATOM 385 CB SER A 24 -13.413 -0.225 3.710 1.00 0.00 C ATOM 386 OG SER A 24 -12.616 0.755 3.066 1.00 0.00 O ATOM 0 H SER A 24 -11.057 -0.756 3.111 1.00 0.00 H new ATOM 0 HA SER A 24 -13.070 -2.264 4.231 1.00 0.00 H new ATOM 0 HB2 SER A 24 -14.456 -0.096 3.422 1.00 0.00 H new ATOM 0 HB3 SER A 24 -13.361 -0.088 4.790 1.00 0.00 H new ATOM 0 HG SER A 24 -11.761 0.843 3.537 1.00 0.00 H new ATOM 392 N ALA A 25 -13.434 -1.819 0.993 1.00 0.00 N ATOM 393 CA ALA A 25 -14.115 -2.316 -0.189 1.00 0.00 C ATOM 394 C ALA A 25 -13.635 -3.730 -0.469 1.00 0.00 C ATOM 395 O ALA A 25 -14.404 -4.594 -0.890 1.00 0.00 O ATOM 396 CB ALA A 25 -13.853 -1.409 -1.383 1.00 0.00 C ATOM 0 H ALA A 25 -12.672 -1.169 0.799 1.00 0.00 H new ATOM 0 HA ALA A 25 -15.191 -2.324 -0.015 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -14.373 -1.800 -2.258 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -14.216 -0.405 -1.164 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.782 -1.372 -1.584 1.00 0.00 H new ATOM 402 N ALA A 26 -12.351 -3.956 -0.204 1.00 0.00 N ATOM 403 CA ALA A 26 -11.748 -5.267 -0.397 1.00 0.00 C ATOM 404 C ALA A 26 -12.409 -6.305 0.504 1.00 0.00 C ATOM 405 O ALA A 26 -12.569 -7.461 0.119 1.00 0.00 O ATOM 406 CB ALA A 26 -10.256 -5.207 -0.116 1.00 0.00 C ATOM 0 H ALA A 26 -11.709 -3.245 0.146 1.00 0.00 H new ATOM 0 HA ALA A 26 -11.902 -5.563 -1.435 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -9.818 -6.194 -0.264 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -9.786 -4.496 -0.795 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -10.092 -4.888 0.913 1.00 0.00 H new ATOM 412 N SER A 27 -12.789 -5.883 1.709 1.00 0.00 N ATOM 413 CA SER A 27 -13.434 -6.773 2.669 1.00 0.00 C ATOM 414 C SER A 27 -14.724 -7.344 2.089 1.00 0.00 C ATOM 415 O SER A 27 -14.970 -8.548 2.161 1.00 0.00 O ATOM 416 CB SER A 27 -13.734 -6.021 3.969 1.00 0.00 C ATOM 417 OG SER A 27 -15.006 -5.396 3.921 1.00 0.00 O ATOM 0 H SER A 27 -12.660 -4.928 2.043 1.00 0.00 H new ATOM 0 HA SER A 27 -12.754 -7.597 2.884 1.00 0.00 H new ATOM 0 HB2 SER A 27 -13.699 -6.714 4.809 1.00 0.00 H new ATOM 0 HB3 SER A 27 -12.964 -5.270 4.143 1.00 0.00 H new ATOM 0 HG SER A 27 -14.937 -4.551 3.430 1.00 0.00 H new ATOM 423 N LYS A 28 -15.542 -6.469 1.507 1.00 0.00 N ATOM 424 CA LYS A 28 -16.805 -6.885 0.906 1.00 0.00 C ATOM 425 C LYS A 28 -16.577 -8.021 -0.083 1.00 0.00 C ATOM 426 O LYS A 28 -17.421 -8.902 -0.242 1.00 0.00 O ATOM 427 CB LYS A 28 -17.475 -5.703 0.202 1.00 0.00 C ATOM 428 CG LYS A 28 -18.923 -5.964 -0.181 1.00 0.00 C ATOM 429 CD LYS A 28 -19.684 -4.667 -0.396 1.00 0.00 C ATOM 430 CE LYS A 28 -21.180 -4.912 -0.513 1.00 0.00 C ATOM 431 NZ LYS A 28 -21.973 -3.807 0.094 1.00 0.00 N ATOM 0 H LYS A 28 -15.352 -5.469 1.440 1.00 0.00 H new ATOM 0 HA LYS A 28 -17.462 -7.240 1.700 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -17.432 -4.831 0.854 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -16.909 -5.458 -0.696 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -18.958 -6.563 -1.091 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -19.408 -6.546 0.602 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -19.489 -3.988 0.434 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -19.323 -4.177 -1.300 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -21.449 -5.017 -1.564 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -21.433 -5.852 -0.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -22.988 -4.012 -0.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -21.735 -3.723 1.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -21.751 -2.914 -0.390 1.00 0.00 H new ATOM 445 N GLN A 29 -15.420 -7.997 -0.736 1.00 0.00 N ATOM 446 CA GLN A 29 -15.066 -9.027 -1.701 1.00 0.00 C ATOM 447 C GLN A 29 -14.344 -10.177 -1.009 1.00 0.00 C ATOM 448 O GLN A 29 -14.579 -11.343 -1.321 1.00 0.00 O ATOM 449 CB GLN A 29 -14.182 -8.442 -2.805 1.00 0.00 C ATOM 450 CG GLN A 29 -14.929 -7.526 -3.761 1.00 0.00 C ATOM 451 CD GLN A 29 -14.096 -6.336 -4.198 1.00 0.00 C ATOM 452 OE1 GLN A 29 -13.756 -6.200 -5.372 1.00 0.00 O ATOM 453 NE2 GLN A 29 -13.765 -5.466 -3.250 1.00 0.00 N ATOM 0 H GLN A 29 -14.712 -7.274 -0.613 1.00 0.00 H new ATOM 0 HA GLN A 29 -15.983 -9.408 -2.150 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -13.364 -7.886 -2.347 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -13.735 -9.259 -3.372 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -15.233 -8.094 -4.640 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -15.840 -7.170 -3.280 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -14.069 -5.619 -2.289 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -13.207 -4.645 -3.484 1.00 0.00 H new ATOM 462 N ASN A 30 -13.456 -9.826 -0.070 1.00 0.00 N ATOM 463 CA ASN A 30 -12.671 -10.802 0.690 1.00 0.00 C ATOM 464 C ASN A 30 -11.264 -10.884 0.125 1.00 0.00 C ATOM 465 O ASN A 30 -10.629 -11.938 0.150 1.00 0.00 O ATOM 466 CB ASN A 30 -13.320 -12.190 0.688 1.00 0.00 C ATOM 467 CG ASN A 30 -12.797 -13.075 1.803 1.00 0.00 C ATOM 468 OD1 ASN A 30 -11.880 -13.871 1.602 1.00 0.00 O ATOM 469 ND2 ASN A 30 -13.381 -12.940 2.989 1.00 0.00 N ATOM 0 H ASN A 30 -13.263 -8.857 0.183 1.00 0.00 H new ATOM 0 HA ASN A 30 -12.633 -10.461 1.725 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -14.400 -12.083 0.789 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -13.136 -12.673 -0.272 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -13.072 -13.509 3.777 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -14.138 -12.267 3.111 1.00 0.00 H new ATOM 476 N LYS A 31 -10.786 -9.757 -0.389 1.00 0.00 N ATOM 477 CA LYS A 31 -9.455 -9.689 -0.966 1.00 0.00 C ATOM 478 C LYS A 31 -8.410 -9.345 0.089 1.00 0.00 C ATOM 479 O LYS A 31 -7.252 -9.103 -0.243 1.00 0.00 O ATOM 480 CB LYS A 31 -9.420 -8.663 -2.099 1.00 0.00 C ATOM 481 CG LYS A 31 -9.700 -9.262 -3.468 1.00 0.00 C ATOM 482 CD LYS A 31 -11.164 -9.119 -3.851 1.00 0.00 C ATOM 483 CE LYS A 31 -11.360 -9.230 -5.354 1.00 0.00 C ATOM 484 NZ LYS A 31 -12.538 -8.448 -5.820 1.00 0.00 N ATOM 0 H LYS A 31 -11.303 -8.878 -0.417 1.00 0.00 H new ATOM 0 HA LYS A 31 -9.214 -10.673 -1.369 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -10.154 -7.883 -1.895 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -8.441 -8.183 -2.114 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -9.078 -8.770 -4.216 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -9.424 -10.317 -3.468 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -11.749 -9.889 -3.349 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -11.540 -8.156 -3.504 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -10.464 -8.875 -5.864 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -11.489 -10.277 -5.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -12.568 -8.452 -6.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -13.409 -8.876 -5.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -12.461 -7.468 -5.480 1.00 0.00 H new ATOM 498 N LEU A 32 -8.813 -9.330 1.364 1.00 0.00 N ATOM 499 CA LEU A 32 -7.895 -9.027 2.455 1.00 0.00 C ATOM 500 C LEU A 32 -6.561 -9.734 2.255 1.00 0.00 C ATOM 501 O LEU A 32 -5.512 -9.225 2.641 1.00 0.00 O ATOM 502 CB LEU A 32 -8.524 -9.451 3.782 1.00 0.00 C ATOM 503 CG LEU A 32 -9.519 -8.452 4.371 1.00 0.00 C ATOM 504 CD1 LEU A 32 -8.789 -7.446 5.244 1.00 0.00 C ATOM 505 CD2 LEU A 32 -10.295 -7.748 3.264 1.00 0.00 C ATOM 0 H LEU A 32 -9.769 -9.525 1.661 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.708 -7.953 2.468 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -9.031 -10.405 3.638 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -7.728 -9.619 4.507 1.00 0.00 H new ATOM 0 HG LEU A 32 -10.235 -8.993 4.989 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.505 -6.738 5.660 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -8.282 -7.968 6.056 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -8.054 -6.909 4.644 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -10.998 -7.041 3.705 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.600 -7.213 2.616 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -10.843 -8.486 2.678 1.00 0.00 H new ATOM 517 N GLU A 33 -6.611 -10.904 1.633 1.00 0.00 N ATOM 518 CA GLU A 33 -5.403 -11.676 1.364 1.00 0.00 C ATOM 519 C GLU A 33 -4.655 -11.096 0.167 1.00 0.00 C ATOM 520 O GLU A 33 -3.427 -11.119 0.116 1.00 0.00 O ATOM 521 CB GLU A 33 -5.752 -13.142 1.103 1.00 0.00 C ATOM 522 CG GLU A 33 -4.726 -14.120 1.654 1.00 0.00 C ATOM 523 CD GLU A 33 -4.460 -15.278 0.711 1.00 0.00 C ATOM 524 OE1 GLU A 33 -4.355 -15.037 -0.510 1.00 0.00 O ATOM 525 OE2 GLU A 33 -4.354 -16.424 1.194 1.00 0.00 O ATOM 0 H GLU A 33 -7.473 -11.340 1.305 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.758 -11.620 2.241 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -6.724 -13.360 1.546 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -5.850 -13.298 0.029 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.792 -13.591 1.847 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -5.076 -14.508 2.610 1.00 0.00 H new ATOM 532 N GLN A 34 -5.414 -10.567 -0.787 1.00 0.00 N ATOM 533 CA GLN A 34 -4.842 -9.965 -1.986 1.00 0.00 C ATOM 534 C GLN A 34 -4.465 -8.504 -1.749 1.00 0.00 C ATOM 535 O GLN A 34 -3.744 -7.906 -2.546 1.00 0.00 O ATOM 536 CB GLN A 34 -5.830 -10.069 -3.148 1.00 0.00 C ATOM 537 CG GLN A 34 -5.242 -9.654 -4.485 1.00 0.00 C ATOM 538 CD GLN A 34 -4.200 -10.630 -4.996 1.00 0.00 C ATOM 539 OE1 GLN A 34 -4.065 -11.739 -4.480 1.00 0.00 O ATOM 540 NE2 GLN A 34 -3.456 -10.219 -6.018 1.00 0.00 N ATOM 0 H GLN A 34 -6.433 -10.543 -0.752 1.00 0.00 H new ATOM 0 HA GLN A 34 -3.933 -10.512 -2.236 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -6.186 -11.097 -3.220 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -6.698 -9.446 -2.933 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -6.044 -9.568 -5.219 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -4.792 -8.666 -4.388 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -3.603 -9.291 -6.415 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -2.739 -10.832 -6.405 1.00 0.00 H new ATOM 549 N VAL A 35 -4.955 -7.931 -0.652 1.00 0.00 N ATOM 550 CA VAL A 35 -4.661 -6.539 -0.324 1.00 0.00 C ATOM 551 C VAL A 35 -3.684 -6.446 0.842 1.00 0.00 C ATOM 552 O VAL A 35 -2.929 -5.480 0.955 1.00 0.00 O ATOM 553 CB VAL A 35 -5.938 -5.741 0.039 1.00 0.00 C ATOM 554 CG1 VAL A 35 -5.823 -4.309 -0.457 1.00 0.00 C ATOM 555 CG2 VAL A 35 -7.200 -6.404 -0.514 1.00 0.00 C ATOM 0 H VAL A 35 -5.555 -8.407 0.022 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.217 -6.103 -1.219 1.00 0.00 H new ATOM 0 HB VAL A 35 -6.026 -5.733 1.125 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.727 -3.760 -0.195 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -4.961 -3.831 0.008 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.699 -4.308 -1.540 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -8.073 -5.813 -0.237 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -7.133 -6.465 -1.600 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.295 -7.408 -0.099 1.00 0.00 H new ATOM 565 N GLU A 36 -3.697 -7.457 1.699 1.00 0.00 N ATOM 566 CA GLU A 36 -2.805 -7.495 2.853 1.00 0.00 C ATOM 567 C GLU A 36 -1.461 -8.066 2.443 1.00 0.00 C ATOM 568 O GLU A 36 -0.411 -7.574 2.856 1.00 0.00 O ATOM 569 CB GLU A 36 -3.405 -8.336 3.982 1.00 0.00 C ATOM 570 CG GLU A 36 -2.648 -8.221 5.294 1.00 0.00 C ATOM 571 CD GLU A 36 -1.710 -9.388 5.530 1.00 0.00 C ATOM 572 OE1 GLU A 36 -0.795 -9.592 4.705 1.00 0.00 O ATOM 573 OE2 GLU A 36 -1.891 -10.100 6.541 1.00 0.00 O ATOM 0 H GLU A 36 -4.316 -8.264 1.618 1.00 0.00 H new ATOM 0 HA GLU A 36 -2.672 -6.477 3.219 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -4.439 -8.031 4.141 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.425 -9.381 3.674 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.076 -7.293 5.299 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.361 -8.161 6.116 1.00 0.00 H new ATOM 580 N LYS A 37 -1.501 -9.095 1.607 1.00 0.00 N ATOM 581 CA LYS A 37 -0.283 -9.713 1.120 1.00 0.00 C ATOM 582 C LYS A 37 0.425 -8.741 0.200 1.00 0.00 C ATOM 583 O LYS A 37 1.652 -8.642 0.209 1.00 0.00 O ATOM 584 CB LYS A 37 -0.585 -11.021 0.387 1.00 0.00 C ATOM 585 CG LYS A 37 -1.162 -12.103 1.284 1.00 0.00 C ATOM 586 CD LYS A 37 -1.545 -13.341 0.491 1.00 0.00 C ATOM 587 CE LYS A 37 -0.337 -13.956 -0.198 1.00 0.00 C ATOM 588 NZ LYS A 37 -0.487 -15.428 -0.372 1.00 0.00 N ATOM 0 H LYS A 37 -2.361 -9.515 1.255 1.00 0.00 H new ATOM 0 HA LYS A 37 0.360 -9.953 1.967 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -1.286 -10.820 -0.423 1.00 0.00 H new ATOM 0 HB3 LYS A 37 0.332 -11.391 -0.070 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -0.432 -12.371 2.048 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -2.039 -11.717 1.803 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -1.999 -14.075 1.157 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -2.296 -13.079 -0.254 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -0.197 -13.488 -1.172 1.00 0.00 H new ATOM 0 HE3 LYS A 37 0.559 -13.749 0.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 0.357 -15.809 -0.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -0.595 -15.878 0.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -1.328 -15.625 -0.952 1.00 0.00 H new ATOM 602 N GLU A 38 -0.359 -7.995 -0.571 1.00 0.00 N ATOM 603 CA GLU A 38 0.202 -7.007 -1.460 1.00 0.00 C ATOM 604 C GLU A 38 0.766 -5.856 -0.639 1.00 0.00 C ATOM 605 O GLU A 38 1.924 -5.478 -0.795 1.00 0.00 O ATOM 606 CB GLU A 38 -0.868 -6.507 -2.425 1.00 0.00 C ATOM 607 CG GLU A 38 -0.864 -7.228 -3.764 1.00 0.00 C ATOM 608 CD GLU A 38 -0.977 -8.733 -3.614 1.00 0.00 C ATOM 609 OE1 GLU A 38 -0.061 -9.340 -3.022 1.00 0.00 O ATOM 610 OE2 GLU A 38 -1.982 -9.302 -4.089 1.00 0.00 O ATOM 0 H GLU A 38 -1.377 -8.061 -0.592 1.00 0.00 H new ATOM 0 HA GLU A 38 1.007 -7.453 -2.044 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -1.847 -6.625 -1.961 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -0.722 -5.440 -2.596 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -1.692 -6.864 -4.372 1.00 0.00 H new ATOM 0 HG3 GLU A 38 0.054 -6.987 -4.300 1.00 0.00 H new ATOM 617 N LEU A 39 -0.055 -5.311 0.253 1.00 0.00 N ATOM 618 CA LEU A 39 0.372 -4.210 1.111 1.00 0.00 C ATOM 619 C LEU A 39 1.716 -4.520 1.761 1.00 0.00 C ATOM 620 O LEU A 39 2.524 -3.622 1.995 1.00 0.00 O ATOM 621 CB LEU A 39 -0.681 -3.931 2.187 1.00 0.00 C ATOM 622 CG LEU A 39 -1.587 -2.729 1.906 1.00 0.00 C ATOM 623 CD1 LEU A 39 -3.037 -3.062 2.228 1.00 0.00 C ATOM 624 CD2 LEU A 39 -1.125 -1.517 2.702 1.00 0.00 C ATOM 0 H LEU A 39 -1.018 -5.613 0.401 1.00 0.00 H new ATOM 0 HA LEU A 39 0.485 -3.321 0.490 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -1.304 -4.818 2.304 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -0.174 -3.771 3.138 1.00 0.00 H new ATOM 0 HG LEU A 39 -1.521 -2.489 0.845 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -3.664 -2.195 2.021 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -3.363 -3.900 1.612 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -3.124 -3.330 3.281 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -1.780 -0.672 2.491 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -1.161 -1.746 3.767 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -0.103 -1.264 2.419 1.00 0.00 H new ATOM 636 N LEU A 40 1.956 -5.799 2.043 1.00 0.00 N ATOM 637 CA LEU A 40 3.210 -6.217 2.657 1.00 0.00 C ATOM 638 C LEU A 40 4.373 -6.041 1.685 1.00 0.00 C ATOM 639 O LEU A 40 5.524 -5.902 2.097 1.00 0.00 O ATOM 640 CB LEU A 40 3.123 -7.675 3.111 1.00 0.00 C ATOM 641 CG LEU A 40 4.176 -8.099 4.136 1.00 0.00 C ATOM 642 CD1 LEU A 40 3.749 -7.694 5.539 1.00 0.00 C ATOM 643 CD2 LEU A 40 4.416 -9.600 4.062 1.00 0.00 C ATOM 0 H LEU A 40 1.301 -6.559 1.857 1.00 0.00 H new ATOM 0 HA LEU A 40 3.387 -5.586 3.528 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.134 -7.849 3.536 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.211 -8.318 2.235 1.00 0.00 H new ATOM 0 HG LEU A 40 5.110 -7.589 3.902 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.510 -8.004 6.255 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.628 -6.612 5.584 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.803 -8.176 5.785 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.168 -9.885 4.798 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.486 -10.128 4.271 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.767 -9.864 3.064 1.00 0.00 H new ATOM 655 N ARG A 41 4.064 -6.045 0.392 1.00 0.00 N ATOM 656 CA ARG A 41 5.080 -5.882 -0.639 1.00 0.00 C ATOM 657 C ARG A 41 5.489 -4.420 -0.778 1.00 0.00 C ATOM 658 O ARG A 41 6.615 -4.118 -1.173 1.00 0.00 O ATOM 659 CB ARG A 41 4.572 -6.416 -1.980 1.00 0.00 C ATOM 660 CG ARG A 41 5.001 -7.846 -2.267 1.00 0.00 C ATOM 661 CD ARG A 41 6.235 -7.891 -3.153 1.00 0.00 C ATOM 662 NE ARG A 41 7.038 -9.088 -2.913 1.00 0.00 N ATOM 663 CZ ARG A 41 7.885 -9.221 -1.895 1.00 0.00 C ATOM 664 NH1 ARG A 41 8.043 -8.235 -1.020 1.00 0.00 N ATOM 665 NH2 ARG A 41 8.577 -10.344 -1.751 1.00 0.00 N ATOM 0 H ARG A 41 3.116 -6.160 0.034 1.00 0.00 H new ATOM 0 HA ARG A 41 5.957 -6.456 -0.340 1.00 0.00 H new ATOM 0 HB2 ARG A 41 3.483 -6.362 -1.994 1.00 0.00 H new ATOM 0 HB3 ARG A 41 4.934 -5.770 -2.780 1.00 0.00 H new ATOM 0 HG2 ARG A 41 5.207 -8.360 -1.328 1.00 0.00 H new ATOM 0 HG3 ARG A 41 4.184 -8.382 -2.751 1.00 0.00 H new ATOM 0 HD2 ARG A 41 5.931 -7.862 -4.199 1.00 0.00 H new ATOM 0 HD3 ARG A 41 6.843 -7.004 -2.973 1.00 0.00 H new ATOM 0 HE ARG A 41 6.944 -9.868 -3.564 1.00 0.00 H new ATOM 0 HH11 ARG A 41 7.514 -7.370 -1.126 1.00 0.00 H new ATOM 0 HH12 ARG A 41 8.694 -8.343 -0.242 1.00 0.00 H new ATOM 0 HH21 ARG A 41 8.460 -11.105 -2.420 1.00 0.00 H new ATOM 0 HH22 ARG A 41 9.226 -10.446 -0.971 1.00 0.00 H new ATOM 679 N VAL A 42 4.574 -3.511 -0.446 1.00 0.00 N ATOM 680 CA VAL A 42 4.861 -2.085 -0.533 1.00 0.00 C ATOM 681 C VAL A 42 5.834 -1.666 0.563 1.00 0.00 C ATOM 682 O VAL A 42 6.586 -0.703 0.406 1.00 0.00 O ATOM 683 CB VAL A 42 3.584 -1.223 -0.423 1.00 0.00 C ATOM 684 CG1 VAL A 42 3.877 0.208 -0.841 1.00 0.00 C ATOM 685 CG2 VAL A 42 2.455 -1.800 -1.264 1.00 0.00 C ATOM 0 H VAL A 42 3.635 -3.736 -0.117 1.00 0.00 H new ATOM 0 HA VAL A 42 5.306 -1.917 -1.514 1.00 0.00 H new ATOM 0 HB VAL A 42 3.263 -1.228 0.618 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.968 0.804 -0.759 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.646 0.627 -0.192 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.227 0.221 -1.873 1.00 0.00 H new ATOM 0 HG21 VAL A 42 1.570 -1.171 -1.166 1.00 0.00 H new ATOM 0 HG22 VAL A 42 2.761 -1.835 -2.310 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.224 -2.808 -0.920 1.00 0.00 H new ATOM 695 N GLY A 43 5.820 -2.401 1.673 1.00 0.00 N ATOM 696 CA GLY A 43 6.710 -2.095 2.777 1.00 0.00 C ATOM 697 C GLY A 43 8.158 -2.385 2.440 1.00 0.00 C ATOM 698 O GLY A 43 9.038 -1.561 2.693 1.00 0.00 O ATOM 0 H GLY A 43 5.208 -3.202 1.826 1.00 0.00 H new ATOM 0 HA2 GLY A 43 6.605 -1.044 3.046 1.00 0.00 H new ATOM 0 HA3 GLY A 43 6.418 -2.679 3.650 1.00 0.00 H new ATOM 702 N GLN A 44 8.406 -3.558 1.864 1.00 0.00 N ATOM 703 CA GLN A 44 9.758 -3.950 1.486 1.00 0.00 C ATOM 704 C GLN A 44 10.343 -2.958 0.488 1.00 0.00 C ATOM 705 O GLN A 44 11.548 -2.706 0.478 1.00 0.00 O ATOM 706 CB GLN A 44 9.756 -5.357 0.885 1.00 0.00 C ATOM 707 CG GLN A 44 9.820 -6.464 1.925 1.00 0.00 C ATOM 708 CD GLN A 44 11.241 -6.888 2.237 1.00 0.00 C ATOM 709 OE1 GLN A 44 11.830 -6.447 3.224 1.00 0.00 O ATOM 710 NE2 GLN A 44 11.801 -7.750 1.396 1.00 0.00 N ATOM 0 H GLN A 44 7.689 -4.251 1.650 1.00 0.00 H new ATOM 0 HA GLN A 44 10.378 -3.950 2.383 1.00 0.00 H new ATOM 0 HB2 GLN A 44 8.855 -5.485 0.285 1.00 0.00 H new ATOM 0 HB3 GLN A 44 10.606 -5.455 0.209 1.00 0.00 H new ATOM 0 HG2 GLN A 44 9.336 -6.125 2.841 1.00 0.00 H new ATOM 0 HG3 GLN A 44 9.257 -7.326 1.568 1.00 0.00 H new ATOM 0 HE21 GLN A 44 11.276 -8.090 0.590 1.00 0.00 H new ATOM 0 HE22 GLN A 44 12.756 -8.072 1.556 1.00 0.00 H new ATOM 719 N ILE A 45 9.476 -2.392 -0.345 1.00 0.00 N ATOM 720 CA ILE A 45 9.897 -1.419 -1.345 1.00 0.00 C ATOM 721 C ILE A 45 10.499 -0.180 -0.685 1.00 0.00 C ATOM 722 O ILE A 45 11.216 0.585 -1.326 1.00 0.00 O ATOM 723 CB ILE A 45 8.715 -1.003 -2.246 1.00 0.00 C ATOM 724 CG1 ILE A 45 8.178 -2.216 -3.007 1.00 0.00 C ATOM 725 CG2 ILE A 45 9.135 0.092 -3.219 1.00 0.00 C ATOM 726 CD1 ILE A 45 6.764 -2.037 -3.514 1.00 0.00 C ATOM 0 H ILE A 45 8.476 -2.591 -0.347 1.00 0.00 H new ATOM 0 HA ILE A 45 10.659 -1.896 -1.962 1.00 0.00 H new ATOM 0 HB ILE A 45 7.922 -0.608 -1.611 1.00 0.00 H new ATOM 0 HG12 ILE A 45 8.834 -2.424 -3.852 1.00 0.00 H new ATOM 0 HG13 ILE A 45 8.213 -3.088 -2.354 1.00 0.00 H new ATOM 0 HG21 ILE A 45 8.286 0.369 -3.844 1.00 0.00 H new ATOM 0 HG22 ILE A 45 9.475 0.964 -2.661 1.00 0.00 H new ATOM 0 HG23 ILE A 45 9.946 -0.273 -3.850 1.00 0.00 H new ATOM 0 HD11 ILE A 45 6.451 -2.937 -4.043 1.00 0.00 H new ATOM 0 HD12 ILE A 45 6.095 -1.860 -2.672 1.00 0.00 H new ATOM 0 HD13 ILE A 45 6.726 -1.185 -4.193 1.00 0.00 H new ATOM 738 N LEU A 46 10.209 0.012 0.597 1.00 0.00 N ATOM 739 CA LEU A 46 10.733 1.157 1.328 1.00 0.00 C ATOM 740 C LEU A 46 12.111 0.840 1.899 1.00 0.00 C ATOM 741 O LEU A 46 13.001 1.692 1.910 1.00 0.00 O ATOM 742 CB LEU A 46 9.772 1.560 2.448 1.00 0.00 C ATOM 743 CG LEU A 46 9.121 2.933 2.274 1.00 0.00 C ATOM 744 CD1 LEU A 46 8.556 3.083 0.869 1.00 0.00 C ATOM 745 CD2 LEU A 46 8.032 3.140 3.315 1.00 0.00 C ATOM 0 H LEU A 46 9.616 -0.608 1.149 1.00 0.00 H new ATOM 0 HA LEU A 46 10.830 1.994 0.636 1.00 0.00 H new ATOM 0 HB2 LEU A 46 8.986 0.808 2.521 1.00 0.00 H new ATOM 0 HB3 LEU A 46 10.314 1.548 3.394 1.00 0.00 H new ATOM 0 HG LEU A 46 9.884 3.698 2.418 1.00 0.00 H new ATOM 0 HD11 LEU A 46 8.097 4.066 0.764 1.00 0.00 H new ATOM 0 HD12 LEU A 46 9.360 2.979 0.140 1.00 0.00 H new ATOM 0 HD13 LEU A 46 7.806 2.312 0.694 1.00 0.00 H new ATOM 0 HD21 LEU A 46 7.579 4.122 3.177 1.00 0.00 H new ATOM 0 HD22 LEU A 46 7.269 2.369 3.202 1.00 0.00 H new ATOM 0 HD23 LEU A 46 8.466 3.077 4.313 1.00 0.00 H new ATOM 757 N LYS A 47 12.281 -0.391 2.363 1.00 0.00 N ATOM 758 CA LYS A 47 13.552 -0.827 2.925 1.00 0.00 C ATOM 759 C LYS A 47 14.578 -1.063 1.820 1.00 0.00 C ATOM 760 O LYS A 47 15.785 -1.029 2.062 1.00 0.00 O ATOM 761 CB LYS A 47 13.362 -2.106 3.742 1.00 0.00 C ATOM 762 CG LYS A 47 12.499 -1.915 4.979 1.00 0.00 C ATOM 763 CD LYS A 47 11.687 -3.162 5.290 1.00 0.00 C ATOM 764 CE LYS A 47 10.834 -2.975 6.534 1.00 0.00 C ATOM 765 NZ LYS A 47 9.593 -3.796 6.485 1.00 0.00 N ATOM 0 H LYS A 47 11.554 -1.106 2.361 1.00 0.00 H new ATOM 0 HA LYS A 47 13.922 -0.039 3.581 1.00 0.00 H new ATOM 0 HB2 LYS A 47 12.910 -2.869 3.108 1.00 0.00 H new ATOM 0 HB3 LYS A 47 14.339 -2.482 4.045 1.00 0.00 H new ATOM 0 HG2 LYS A 47 13.132 -1.670 5.832 1.00 0.00 H new ATOM 0 HG3 LYS A 47 11.827 -1.070 4.828 1.00 0.00 H new ATOM 0 HD2 LYS A 47 11.047 -3.402 4.441 1.00 0.00 H new ATOM 0 HD3 LYS A 47 12.358 -4.009 5.432 1.00 0.00 H new ATOM 0 HE2 LYS A 47 11.414 -3.246 7.416 1.00 0.00 H new ATOM 0 HE3 LYS A 47 10.569 -1.923 6.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 9.039 -3.640 7.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 9.027 -3.520 5.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 9.845 -4.802 6.412 1.00 0.00 H new ATOM 779 N GLU A 48 14.090 -1.301 0.603 1.00 0.00 N ATOM 780 CA GLU A 48 14.963 -1.541 -0.539 1.00 0.00 C ATOM 781 C GLU A 48 15.925 -0.371 -0.747 1.00 0.00 C ATOM 782 O GLU A 48 15.496 0.775 -0.883 1.00 0.00 O ATOM 783 CB GLU A 48 14.128 -1.758 -1.802 1.00 0.00 C ATOM 784 CG GLU A 48 13.818 -3.219 -2.083 1.00 0.00 C ATOM 785 CD GLU A 48 13.008 -3.410 -3.351 1.00 0.00 C ATOM 786 OE1 GLU A 48 13.560 -3.180 -4.448 1.00 0.00 O ATOM 787 OE2 GLU A 48 11.823 -3.791 -3.248 1.00 0.00 O ATOM 0 H GLU A 48 13.094 -1.332 0.385 1.00 0.00 H new ATOM 0 HA GLU A 48 15.549 -2.437 -0.336 1.00 0.00 H new ATOM 0 HB2 GLU A 48 13.192 -1.208 -1.707 1.00 0.00 H new ATOM 0 HB3 GLU A 48 14.660 -1.337 -2.656 1.00 0.00 H new ATOM 0 HG2 GLU A 48 14.752 -3.775 -2.165 1.00 0.00 H new ATOM 0 HG3 GLU A 48 13.270 -3.639 -1.240 1.00 0.00 H new ATOM 794 N PRO A 49 17.245 -0.639 -0.774 1.00 0.00 N ATOM 795 CA PRO A 49 18.256 0.405 -0.967 1.00 0.00 C ATOM 796 C PRO A 49 18.008 1.225 -2.229 1.00 0.00 C ATOM 797 O PRO A 49 17.914 2.451 -2.176 1.00 0.00 O ATOM 798 CB PRO A 49 19.566 -0.380 -1.090 1.00 0.00 C ATOM 799 CG PRO A 49 19.305 -1.668 -0.391 1.00 0.00 C ATOM 800 CD PRO A 49 17.852 -1.974 -0.619 1.00 0.00 C ATOM 0 HA PRO A 49 18.253 1.127 -0.151 1.00 0.00 H new ATOM 0 HB2 PRO A 49 19.832 -0.544 -2.134 1.00 0.00 H new ATOM 0 HB3 PRO A 49 20.395 0.159 -0.630 1.00 0.00 H new ATOM 0 HG2 PRO A 49 19.938 -2.462 -0.787 1.00 0.00 H new ATOM 0 HG3 PRO A 49 19.524 -1.586 0.674 1.00 0.00 H new ATOM 0 HD2 PRO A 49 17.705 -2.589 -1.507 1.00 0.00 H new ATOM 0 HD3 PRO A 49 17.419 -2.518 0.220 1.00 0.00 H new ATOM 808 N LYS A 50 17.903 0.539 -3.363 1.00 0.00 N ATOM 809 CA LYS A 50 17.666 1.204 -4.640 1.00 0.00 C ATOM 810 C LYS A 50 16.365 1.999 -4.606 1.00 0.00 C ATOM 811 O LYS A 50 16.258 3.060 -5.220 1.00 0.00 O ATOM 812 CB LYS A 50 17.621 0.176 -5.772 1.00 0.00 C ATOM 813 CG LYS A 50 18.994 -0.220 -6.288 1.00 0.00 C ATOM 814 CD LYS A 50 19.481 -1.506 -5.640 1.00 0.00 C ATOM 815 CE LYS A 50 19.206 -2.714 -6.521 1.00 0.00 C ATOM 816 NZ LYS A 50 20.399 -3.099 -7.325 1.00 0.00 N ATOM 0 H LYS A 50 17.978 -0.476 -3.424 1.00 0.00 H new ATOM 0 HA LYS A 50 18.488 1.897 -4.820 1.00 0.00 H new ATOM 0 HB2 LYS A 50 17.103 -0.716 -5.421 1.00 0.00 H new ATOM 0 HB3 LYS A 50 17.035 0.581 -6.597 1.00 0.00 H new ATOM 0 HG2 LYS A 50 18.955 -0.348 -7.370 1.00 0.00 H new ATOM 0 HG3 LYS A 50 19.705 0.582 -6.088 1.00 0.00 H new ATOM 0 HD2 LYS A 50 20.551 -1.433 -5.444 1.00 0.00 H new ATOM 0 HD3 LYS A 50 18.989 -1.638 -4.676 1.00 0.00 H new ATOM 0 HE2 LYS A 50 18.901 -3.555 -5.899 1.00 0.00 H new ATOM 0 HE3 LYS A 50 18.374 -2.494 -7.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 20.170 -3.926 -7.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 20.675 -2.306 -7.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 21.186 -3.334 -6.687 1.00 0.00 H new ATOM 830 N MET A 51 15.377 1.478 -3.885 1.00 0.00 N ATOM 831 CA MET A 51 14.083 2.140 -3.772 1.00 0.00 C ATOM 832 C MET A 51 14.179 3.381 -2.891 1.00 0.00 C ATOM 833 O MET A 51 13.494 4.376 -3.126 1.00 0.00 O ATOM 834 CB MET A 51 13.042 1.178 -3.199 1.00 0.00 C ATOM 835 CG MET A 51 12.726 0.000 -4.108 1.00 0.00 C ATOM 836 SD MET A 51 12.262 0.506 -5.777 1.00 0.00 S ATOM 837 CE MET A 51 10.773 1.447 -5.447 1.00 0.00 C ATOM 0 H MET A 51 15.448 0.600 -3.371 1.00 0.00 H new ATOM 0 HA MET A 51 13.775 2.448 -4.771 1.00 0.00 H new ATOM 0 HB2 MET A 51 13.399 0.800 -2.241 1.00 0.00 H new ATOM 0 HB3 MET A 51 12.122 1.729 -3.001 1.00 0.00 H new ATOM 0 HG2 MET A 51 13.596 -0.655 -4.161 1.00 0.00 H new ATOM 0 HG3 MET A 51 11.914 -0.582 -3.671 1.00 0.00 H new ATOM 0 HE1 MET A 51 10.770 2.350 -6.058 1.00 0.00 H new ATOM 0 HE2 MET A 51 9.899 0.842 -5.689 1.00 0.00 H new ATOM 0 HE3 MET A 51 10.743 1.722 -4.393 1.00 0.00 H new ATOM 847 N ALA A 52 15.034 3.315 -1.875 1.00 0.00 N ATOM 848 CA ALA A 52 15.218 4.434 -0.957 1.00 0.00 C ATOM 849 C ALA A 52 15.651 5.692 -1.703 1.00 0.00 C ATOM 850 O ALA A 52 15.340 6.809 -1.289 1.00 0.00 O ATOM 851 CB ALA A 52 16.235 4.076 0.114 1.00 0.00 C ATOM 0 H ALA A 52 15.610 2.499 -1.667 1.00 0.00 H new ATOM 0 HA ALA A 52 14.261 4.640 -0.478 1.00 0.00 H new ATOM 0 HB1 ALA A 52 16.362 4.920 0.792 1.00 0.00 H new ATOM 0 HB2 ALA A 52 15.883 3.210 0.675 1.00 0.00 H new ATOM 0 HB3 ALA A 52 17.190 3.841 -0.355 1.00 0.00 H new ATOM 857 N ALA A 53 16.370 5.503 -2.803 1.00 0.00 N ATOM 858 CA ALA A 53 16.844 6.624 -3.606 1.00 0.00 C ATOM 859 C ALA A 53 15.736 7.182 -4.498 1.00 0.00 C ATOM 860 O ALA A 53 15.939 8.172 -5.204 1.00 0.00 O ATOM 861 CB ALA A 53 18.036 6.198 -4.450 1.00 0.00 C ATOM 0 H ALA A 53 16.637 4.585 -3.159 1.00 0.00 H new ATOM 0 HA ALA A 53 17.153 7.417 -2.925 1.00 0.00 H new ATOM 0 HB1 ALA A 53 18.381 7.043 -5.045 1.00 0.00 H new ATOM 0 HB2 ALA A 53 18.842 5.861 -3.798 1.00 0.00 H new ATOM 0 HB3 ALA A 53 17.741 5.384 -5.112 1.00 0.00 H new ATOM 867 N SER A 54 14.567 6.546 -4.469 1.00 0.00 N ATOM 868 CA SER A 54 13.439 6.988 -5.281 1.00 0.00 C ATOM 869 C SER A 54 12.234 7.334 -4.409 1.00 0.00 C ATOM 870 O SER A 54 11.517 8.297 -4.679 1.00 0.00 O ATOM 871 CB SER A 54 13.055 5.903 -6.289 1.00 0.00 C ATOM 872 OG SER A 54 14.160 5.549 -7.103 1.00 0.00 O ATOM 0 H SER A 54 14.378 5.725 -3.893 1.00 0.00 H new ATOM 0 HA SER A 54 13.744 7.887 -5.817 1.00 0.00 H new ATOM 0 HB2 SER A 54 12.692 5.022 -5.759 1.00 0.00 H new ATOM 0 HB3 SER A 54 12.237 6.257 -6.916 1.00 0.00 H new ATOM 0 HG SER A 54 13.889 4.853 -7.737 1.00 0.00 H new ATOM 878 N LEU A 55 12.014 6.540 -3.365 1.00 0.00 N ATOM 879 CA LEU A 55 10.892 6.763 -2.460 1.00 0.00 C ATOM 880 C LEU A 55 11.051 8.077 -1.698 1.00 0.00 C ATOM 881 O LEU A 55 10.067 8.755 -1.401 1.00 0.00 O ATOM 882 CB LEU A 55 10.758 5.589 -1.481 1.00 0.00 C ATOM 883 CG LEU A 55 11.660 5.652 -0.245 1.00 0.00 C ATOM 884 CD1 LEU A 55 11.019 6.501 0.844 1.00 0.00 C ATOM 885 CD2 LEU A 55 11.948 4.251 0.274 1.00 0.00 C ATOM 0 H LEU A 55 12.597 5.738 -3.125 1.00 0.00 H new ATOM 0 HA LEU A 55 9.983 6.830 -3.057 1.00 0.00 H new ATOM 0 HB2 LEU A 55 9.721 5.532 -1.150 1.00 0.00 H new ATOM 0 HB3 LEU A 55 10.972 4.665 -2.018 1.00 0.00 H new ATOM 0 HG LEU A 55 12.603 6.117 -0.532 1.00 0.00 H new ATOM 0 HD11 LEU A 55 11.675 6.533 1.714 1.00 0.00 H new ATOM 0 HD12 LEU A 55 10.861 7.513 0.471 1.00 0.00 H new ATOM 0 HD13 LEU A 55 10.061 6.065 1.128 1.00 0.00 H new ATOM 0 HD21 LEU A 55 12.590 4.313 1.152 1.00 0.00 H new ATOM 0 HD22 LEU A 55 11.011 3.763 0.543 1.00 0.00 H new ATOM 0 HD23 LEU A 55 12.449 3.672 -0.501 1.00 0.00 H new ATOM 897 N LEU A 56 12.292 8.428 -1.382 1.00 0.00 N ATOM 898 CA LEU A 56 12.574 9.658 -0.650 1.00 0.00 C ATOM 899 C LEU A 56 13.169 10.729 -1.564 1.00 0.00 C ATOM 900 O LEU A 56 13.650 11.759 -1.093 1.00 0.00 O ATOM 901 CB LEU A 56 13.533 9.375 0.508 1.00 0.00 C ATOM 902 CG LEU A 56 13.894 10.591 1.365 1.00 0.00 C ATOM 903 CD1 LEU A 56 13.828 10.242 2.844 1.00 0.00 C ATOM 904 CD2 LEU A 56 15.277 11.110 0.999 1.00 0.00 C ATOM 0 H LEU A 56 13.118 7.880 -1.621 1.00 0.00 H new ATOM 0 HA LEU A 56 11.630 10.034 -0.256 1.00 0.00 H new ATOM 0 HB2 LEU A 56 13.087 8.616 1.151 1.00 0.00 H new ATOM 0 HB3 LEU A 56 14.451 8.950 0.103 1.00 0.00 H new ATOM 0 HG LEU A 56 13.167 11.379 1.166 1.00 0.00 H new ATOM 0 HD11 LEU A 56 14.088 11.119 3.437 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.818 9.919 3.097 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.531 9.437 3.060 1.00 0.00 H new ATOM 0 HD21 LEU A 56 15.517 11.974 1.618 1.00 0.00 H new ATOM 0 HD22 LEU A 56 16.016 10.327 1.168 1.00 0.00 H new ATOM 0 HD23 LEU A 56 15.290 11.401 -0.051 1.00 0.00 H new ATOM 916 N ASN A 57 13.134 10.487 -2.872 1.00 0.00 N ATOM 917 CA ASN A 57 13.673 11.439 -3.835 1.00 0.00 C ATOM 918 C ASN A 57 12.603 12.439 -4.273 1.00 0.00 C ATOM 919 O ASN A 57 11.472 12.054 -4.573 1.00 0.00 O ATOM 920 CB ASN A 57 14.232 10.701 -5.053 1.00 0.00 C ATOM 921 CG ASN A 57 15.726 10.903 -5.218 1.00 0.00 C ATOM 922 OD1 ASN A 57 16.439 11.166 -4.249 1.00 0.00 O ATOM 923 ND2 ASN A 57 16.209 10.780 -6.448 1.00 0.00 N ATOM 0 H ASN A 57 12.739 9.643 -3.287 1.00 0.00 H new ATOM 0 HA ASN A 57 14.480 11.990 -3.352 1.00 0.00 H new ATOM 0 HB2 ASN A 57 14.021 9.636 -4.957 1.00 0.00 H new ATOM 0 HB3 ASN A 57 13.720 11.048 -5.951 1.00 0.00 H new ATOM 0 HD21 ASN A 57 17.207 10.904 -6.619 1.00 0.00 H new ATOM 0 HD22 ASN A 57 15.582 10.561 -7.222 1.00 0.00 H new ATOM 930 N PRO A 58 12.945 13.739 -4.320 1.00 0.00 N ATOM 931 CA PRO A 58 12.006 14.787 -4.729 1.00 0.00 C ATOM 932 C PRO A 58 11.810 14.836 -6.244 1.00 0.00 C ATOM 933 O PRO A 58 11.047 15.657 -6.753 1.00 0.00 O ATOM 934 CB PRO A 58 12.680 16.065 -4.238 1.00 0.00 C ATOM 935 CG PRO A 58 14.137 15.760 -4.289 1.00 0.00 C ATOM 936 CD PRO A 58 14.273 14.291 -3.984 1.00 0.00 C ATOM 0 HA PRO A 58 11.008 14.626 -4.321 1.00 0.00 H new ATOM 0 HB2 PRO A 58 12.430 16.915 -4.873 1.00 0.00 H new ATOM 0 HB3 PRO A 58 12.362 16.318 -3.226 1.00 0.00 H new ATOM 0 HG2 PRO A 58 14.549 15.993 -5.271 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.685 16.360 -3.563 1.00 0.00 H new ATOM 0 HD2 PRO A 58 15.061 13.830 -4.580 1.00 0.00 H new ATOM 0 HD3 PRO A 58 14.524 14.121 -2.937 1.00 0.00 H new ATOM 944 N TYR A 59 12.503 13.953 -6.958 1.00 0.00 N ATOM 945 CA TYR A 59 12.409 13.896 -8.410 1.00 0.00 C ATOM 946 C TYR A 59 11.210 13.060 -8.847 1.00 0.00 C ATOM 947 O TYR A 59 10.643 13.282 -9.917 1.00 0.00 O ATOM 948 CB TYR A 59 13.696 13.309 -8.994 1.00 0.00 C ATOM 949 CG TYR A 59 14.952 13.946 -8.445 1.00 0.00 C ATOM 950 CD1 TYR A 59 15.468 13.564 -7.212 1.00 0.00 C ATOM 951 CD2 TYR A 59 15.623 14.933 -9.158 1.00 0.00 C ATOM 952 CE1 TYR A 59 16.613 14.146 -6.706 1.00 0.00 C ATOM 953 CE2 TYR A 59 16.769 15.520 -8.658 1.00 0.00 C ATOM 954 CZ TYR A 59 17.260 15.123 -7.432 1.00 0.00 C ATOM 955 OH TYR A 59 18.403 15.705 -6.932 1.00 0.00 O ATOM 0 H TYR A 59 13.137 13.266 -6.551 1.00 0.00 H new ATOM 0 HA TYR A 59 12.273 14.911 -8.784 1.00 0.00 H new ATOM 0 HB2 TYR A 59 13.722 12.238 -8.791 1.00 0.00 H new ATOM 0 HB3 TYR A 59 13.681 13.428 -10.077 1.00 0.00 H new ATOM 0 HD1 TYR A 59 14.964 12.799 -6.640 1.00 0.00 H new ATOM 0 HD2 TYR A 59 15.242 15.246 -10.119 1.00 0.00 H new ATOM 0 HE1 TYR A 59 17.000 13.837 -5.746 1.00 0.00 H new ATOM 0 HE2 TYR A 59 17.278 16.286 -9.224 1.00 0.00 H new ATOM 0 HH TYR A 59 18.735 16.373 -7.567 1.00 0.00 H new ATOM 965 N VAL A 60 10.828 12.100 -8.011 1.00 0.00 N ATOM 966 CA VAL A 60 9.696 11.232 -8.308 1.00 0.00 C ATOM 967 C VAL A 60 8.383 11.880 -7.883 1.00 0.00 C ATOM 968 O VAL A 60 7.631 11.323 -7.082 1.00 0.00 O ATOM 969 CB VAL A 60 9.838 9.867 -7.607 1.00 0.00 C ATOM 970 CG1 VAL A 60 11.031 9.102 -8.162 1.00 0.00 C ATOM 971 CG2 VAL A 60 9.966 10.051 -6.103 1.00 0.00 C ATOM 0 H VAL A 60 11.287 11.904 -7.121 1.00 0.00 H new ATOM 0 HA VAL A 60 9.687 11.077 -9.387 1.00 0.00 H new ATOM 0 HB VAL A 60 8.939 9.283 -7.803 1.00 0.00 H new ATOM 0 HG11 VAL A 60 11.115 8.141 -7.655 1.00 0.00 H new ATOM 0 HG12 VAL A 60 10.893 8.937 -9.231 1.00 0.00 H new ATOM 0 HG13 VAL A 60 11.941 9.679 -7.999 1.00 0.00 H new ATOM 0 HG21 VAL A 60 10.065 9.077 -5.624 1.00 0.00 H new ATOM 0 HG22 VAL A 60 10.847 10.654 -5.884 1.00 0.00 H new ATOM 0 HG23 VAL A 60 9.078 10.554 -5.721 1.00 0.00 H new ATOM 981 N LYS A 61 8.114 13.064 -8.423 1.00 0.00 N ATOM 982 CA LYS A 61 6.892 13.796 -8.102 1.00 0.00 C ATOM 983 C LYS A 61 5.657 12.930 -8.329 1.00 0.00 C ATOM 984 O LYS A 61 5.761 11.777 -8.745 1.00 0.00 O ATOM 985 CB LYS A 61 6.799 15.068 -8.946 1.00 0.00 C ATOM 986 CG LYS A 61 6.808 14.807 -10.444 1.00 0.00 C ATOM 987 CD LYS A 61 6.911 16.101 -11.235 1.00 0.00 C ATOM 988 CE LYS A 61 8.333 16.637 -11.240 1.00 0.00 C ATOM 989 NZ LYS A 61 9.085 16.207 -12.452 1.00 0.00 N ATOM 0 H LYS A 61 8.726 13.539 -9.086 1.00 0.00 H new ATOM 0 HA LYS A 61 6.930 14.068 -7.047 1.00 0.00 H new ATOM 0 HB2 LYS A 61 5.885 15.602 -8.684 1.00 0.00 H new ATOM 0 HB3 LYS A 61 7.634 15.723 -8.695 1.00 0.00 H new ATOM 0 HG2 LYS A 61 7.646 14.158 -10.696 1.00 0.00 H new ATOM 0 HG3 LYS A 61 5.898 14.278 -10.728 1.00 0.00 H new ATOM 0 HD2 LYS A 61 6.582 15.930 -12.260 1.00 0.00 H new ATOM 0 HD3 LYS A 61 6.241 16.846 -10.805 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.311 17.726 -11.194 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.854 16.291 -10.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 10.050 16.593 -12.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 9.129 15.168 -12.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 8.602 16.559 -13.303 1.00 0.00 H new ATOM 1003 N ARG A 62 4.485 13.495 -8.052 1.00 0.00 N ATOM 1004 CA ARG A 62 3.228 12.777 -8.224 1.00 0.00 C ATOM 1005 C ARG A 62 3.058 12.311 -9.667 1.00 0.00 C ATOM 1006 O ARG A 62 3.590 12.922 -10.593 1.00 0.00 O ATOM 1007 CB ARG A 62 2.050 13.666 -7.822 1.00 0.00 C ATOM 1008 CG ARG A 62 0.700 12.979 -7.941 1.00 0.00 C ATOM 1009 CD ARG A 62 -0.370 13.709 -7.146 1.00 0.00 C ATOM 1010 NE ARG A 62 -0.858 14.896 -7.844 1.00 0.00 N ATOM 1011 CZ ARG A 62 -1.693 14.856 -8.879 1.00 0.00 C ATOM 1012 NH1 ARG A 62 -2.136 13.691 -9.338 1.00 0.00 N ATOM 1013 NH2 ARG A 62 -2.087 15.982 -9.457 1.00 0.00 N ATOM 0 H ARG A 62 4.381 14.449 -7.707 1.00 0.00 H new ATOM 0 HA ARG A 62 3.250 11.899 -7.578 1.00 0.00 H new ATOM 0 HB2 ARG A 62 2.190 13.997 -6.793 1.00 0.00 H new ATOM 0 HB3 ARG A 62 2.050 14.559 -8.447 1.00 0.00 H new ATOM 0 HG2 ARG A 62 0.406 12.931 -8.990 1.00 0.00 H new ATOM 0 HG3 ARG A 62 0.781 11.952 -7.586 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -1.203 13.033 -6.955 1.00 0.00 H new ATOM 0 HD3 ARG A 62 0.034 13.999 -6.176 1.00 0.00 H new ATOM 0 HE ARG A 62 -0.540 15.809 -7.519 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -1.836 12.822 -8.897 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -2.776 13.666 -10.132 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -1.750 16.879 -9.108 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -2.727 15.951 -10.251 1.00 0.00 H new ATOM 1027 N SER A 63 2.313 11.222 -9.847 1.00 0.00 N ATOM 1028 CA SER A 63 2.064 10.659 -11.174 1.00 0.00 C ATOM 1029 C SER A 63 3.269 9.863 -11.666 1.00 0.00 C ATOM 1030 O SER A 63 3.148 8.688 -12.011 1.00 0.00 O ATOM 1031 CB SER A 63 1.719 11.763 -12.178 1.00 0.00 C ATOM 1032 OG SER A 63 1.113 12.869 -11.532 1.00 0.00 O ATOM 0 H SER A 63 1.869 10.709 -9.086 1.00 0.00 H new ATOM 0 HA SER A 63 1.213 9.983 -11.092 1.00 0.00 H new ATOM 0 HB2 SER A 63 2.624 12.089 -12.691 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.046 11.369 -12.939 1.00 0.00 H new ATOM 0 HG SER A 63 0.904 13.560 -12.194 1.00 0.00 H new ATOM 1038 N VAL A 64 4.430 10.510 -11.697 1.00 0.00 N ATOM 1039 CA VAL A 64 5.655 9.859 -12.147 1.00 0.00 C ATOM 1040 C VAL A 64 5.922 8.585 -11.353 1.00 0.00 C ATOM 1041 O VAL A 64 6.069 7.505 -11.924 1.00 0.00 O ATOM 1042 CB VAL A 64 6.870 10.796 -12.020 1.00 0.00 C ATOM 1043 CG1 VAL A 64 8.101 10.167 -12.653 1.00 0.00 C ATOM 1044 CG2 VAL A 64 6.569 12.147 -12.650 1.00 0.00 C ATOM 0 H VAL A 64 4.548 11.483 -11.416 1.00 0.00 H new ATOM 0 HA VAL A 64 5.512 9.606 -13.198 1.00 0.00 H new ATOM 0 HB VAL A 64 7.076 10.951 -10.961 1.00 0.00 H new ATOM 0 HG11 VAL A 64 8.948 10.845 -12.553 1.00 0.00 H new ATOM 0 HG12 VAL A 64 8.328 9.226 -12.151 1.00 0.00 H new ATOM 0 HG13 VAL A 64 7.911 9.978 -13.710 1.00 0.00 H new ATOM 0 HG21 VAL A 64 7.439 12.796 -12.551 1.00 0.00 H new ATOM 0 HG22 VAL A 64 6.335 12.012 -13.706 1.00 0.00 H new ATOM 0 HG23 VAL A 64 5.717 12.602 -12.145 1.00 0.00 H new ATOM 1054 N LYS A 65 5.977 8.718 -10.032 1.00 0.00 N ATOM 1055 CA LYS A 65 6.220 7.575 -9.162 1.00 0.00 C ATOM 1056 C LYS A 65 5.087 6.561 -9.280 1.00 0.00 C ATOM 1057 O LYS A 65 5.292 5.361 -9.090 1.00 0.00 O ATOM 1058 CB LYS A 65 6.367 8.033 -7.709 1.00 0.00 C ATOM 1059 CG LYS A 65 7.543 7.395 -6.988 1.00 0.00 C ATOM 1060 CD LYS A 65 7.231 5.969 -6.564 1.00 0.00 C ATOM 1061 CE LYS A 65 8.439 5.060 -6.735 1.00 0.00 C ATOM 1062 NZ LYS A 65 8.600 4.607 -8.145 1.00 0.00 N ATOM 0 H LYS A 65 5.857 9.604 -9.542 1.00 0.00 H new ATOM 0 HA LYS A 65 7.148 7.097 -9.475 1.00 0.00 H new ATOM 0 HB2 LYS A 65 6.483 9.117 -7.688 1.00 0.00 H new ATOM 0 HB3 LYS A 65 5.450 7.800 -7.168 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.416 7.399 -7.640 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.798 7.989 -6.110 1.00 0.00 H new ATOM 0 HD2 LYS A 65 6.912 5.960 -5.522 1.00 0.00 H new ATOM 0 HD3 LYS A 65 6.399 5.586 -7.155 1.00 0.00 H new ATOM 0 HE2 LYS A 65 9.338 5.589 -6.419 1.00 0.00 H new ATOM 0 HE3 LYS A 65 8.334 4.192 -6.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 8.736 3.576 -8.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 7.749 4.854 -8.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 9.428 5.074 -8.567 1.00 0.00 H new ATOM 1076 N VAL A 66 3.891 7.049 -9.598 1.00 0.00 N ATOM 1077 CA VAL A 66 2.727 6.184 -9.744 1.00 0.00 C ATOM 1078 C VAL A 66 2.835 5.332 -11.004 1.00 0.00 C ATOM 1079 O VAL A 66 2.384 4.186 -11.029 1.00 0.00 O ATOM 1080 CB VAL A 66 1.422 7.001 -9.799 1.00 0.00 C ATOM 1081 CG1 VAL A 66 0.212 6.079 -9.799 1.00 0.00 C ATOM 1082 CG2 VAL A 66 1.354 7.978 -8.634 1.00 0.00 C ATOM 0 H VAL A 66 3.704 8.039 -9.759 1.00 0.00 H new ATOM 0 HA VAL A 66 2.701 5.535 -8.869 1.00 0.00 H new ATOM 0 HB VAL A 66 1.414 7.573 -10.727 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.700 6.675 -9.838 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.254 5.423 -10.669 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.213 5.477 -8.890 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.426 8.546 -8.689 1.00 0.00 H new ATOM 0 HG22 VAL A 66 1.386 7.427 -7.694 1.00 0.00 H new ATOM 0 HG23 VAL A 66 2.201 8.662 -8.683 1.00 0.00 H new ATOM 1092 N LYS A 67 3.434 5.896 -12.047 1.00 0.00 N ATOM 1093 CA LYS A 67 3.600 5.184 -13.309 1.00 0.00 C ATOM 1094 C LYS A 67 4.645 4.081 -13.175 1.00 0.00 C ATOM 1095 O LYS A 67 4.503 3.004 -13.752 1.00 0.00 O ATOM 1096 CB LYS A 67 4.003 6.155 -14.419 1.00 0.00 C ATOM 1097 CG LYS A 67 3.402 5.816 -15.773 1.00 0.00 C ATOM 1098 CD LYS A 67 4.217 4.757 -16.496 1.00 0.00 C ATOM 1099 CE LYS A 67 3.611 3.374 -16.324 1.00 0.00 C ATOM 1100 NZ LYS A 67 2.751 2.998 -17.480 1.00 0.00 N ATOM 0 H LYS A 67 3.812 6.843 -12.044 1.00 0.00 H new ATOM 0 HA LYS A 67 2.645 4.726 -13.569 1.00 0.00 H new ATOM 0 HB2 LYS A 67 3.697 7.163 -14.137 1.00 0.00 H new ATOM 0 HB3 LYS A 67 5.090 6.164 -14.505 1.00 0.00 H new ATOM 0 HG2 LYS A 67 2.380 5.462 -15.640 1.00 0.00 H new ATOM 0 HG3 LYS A 67 3.350 6.717 -16.385 1.00 0.00 H new ATOM 0 HD2 LYS A 67 4.273 5.001 -17.557 1.00 0.00 H new ATOM 0 HD3 LYS A 67 5.238 4.758 -16.114 1.00 0.00 H new ATOM 0 HE2 LYS A 67 4.408 2.640 -16.210 1.00 0.00 H new ATOM 0 HE3 LYS A 67 3.021 3.347 -15.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 2.356 2.048 -17.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 1.975 3.684 -17.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 3.320 2.998 -18.351 1.00 0.00 H new ATOM 1114 N SER A 68 5.694 4.359 -12.408 1.00 0.00 N ATOM 1115 CA SER A 68 6.763 3.391 -12.195 1.00 0.00 C ATOM 1116 C SER A 68 6.317 2.295 -11.232 1.00 0.00 C ATOM 1117 O SER A 68 6.772 1.155 -11.320 1.00 0.00 O ATOM 1118 CB SER A 68 8.010 4.091 -11.651 1.00 0.00 C ATOM 1119 OG SER A 68 8.878 3.170 -11.014 1.00 0.00 O ATOM 0 H SER A 68 5.826 5.247 -11.924 1.00 0.00 H new ATOM 0 HA SER A 68 7.003 2.931 -13.154 1.00 0.00 H new ATOM 0 HB2 SER A 68 8.537 4.587 -12.466 1.00 0.00 H new ATOM 0 HB3 SER A 68 7.716 4.866 -10.944 1.00 0.00 H new ATOM 0 HG SER A 68 9.667 3.643 -10.677 1.00 0.00 H new ATOM 1125 N LEU A 69 5.423 2.649 -10.314 1.00 0.00 N ATOM 1126 CA LEU A 69 4.915 1.694 -9.337 1.00 0.00 C ATOM 1127 C LEU A 69 3.887 0.760 -9.970 1.00 0.00 C ATOM 1128 O LEU A 69 3.746 -0.392 -9.563 1.00 0.00 O ATOM 1129 CB LEU A 69 4.292 2.432 -8.148 1.00 0.00 C ATOM 1130 CG LEU A 69 4.968 2.176 -6.800 1.00 0.00 C ATOM 1131 CD1 LEU A 69 6.069 3.196 -6.553 1.00 0.00 C ATOM 1132 CD2 LEU A 69 3.944 2.211 -5.676 1.00 0.00 C ATOM 0 H LEU A 69 5.036 3.589 -10.227 1.00 0.00 H new ATOM 0 HA LEU A 69 5.753 1.093 -8.983 1.00 0.00 H new ATOM 0 HB2 LEU A 69 4.316 3.503 -8.352 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.243 2.145 -8.071 1.00 0.00 H new ATOM 0 HG LEU A 69 5.419 1.184 -6.823 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.539 2.998 -5.589 1.00 0.00 H new ATOM 0 HD12 LEU A 69 6.817 3.123 -7.343 1.00 0.00 H new ATOM 0 HD13 LEU A 69 5.642 4.199 -6.549 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.442 2.027 -4.724 1.00 0.00 H new ATOM 0 HD22 LEU A 69 3.464 3.189 -5.651 1.00 0.00 H new ATOM 0 HD23 LEU A 69 3.191 1.442 -5.846 1.00 0.00 H new ATOM 1144 N SER A 70 3.169 1.270 -10.965 1.00 0.00 N ATOM 1145 CA SER A 70 2.149 0.487 -11.652 1.00 0.00 C ATOM 1146 C SER A 70 2.776 -0.537 -12.591 1.00 0.00 C ATOM 1147 O SER A 70 2.196 -1.591 -12.847 1.00 0.00 O ATOM 1148 CB SER A 70 1.208 1.406 -12.432 1.00 0.00 C ATOM 1149 OG SER A 70 0.379 0.662 -13.309 1.00 0.00 O ATOM 0 H SER A 70 3.275 2.223 -11.314 1.00 0.00 H new ATOM 0 HA SER A 70 1.577 -0.051 -10.896 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.590 1.974 -11.736 1.00 0.00 H new ATOM 0 HB3 SER A 70 1.791 2.129 -13.003 1.00 0.00 H new ATOM 0 HG SER A 70 -0.214 1.272 -13.795 1.00 0.00 H new ATOM 1155 N ASP A 71 3.963 -0.230 -13.097 1.00 0.00 N ATOM 1156 CA ASP A 71 4.657 -1.141 -13.996 1.00 0.00 C ATOM 1157 C ASP A 71 5.513 -2.106 -13.196 1.00 0.00 C ATOM 1158 O ASP A 71 5.625 -3.284 -13.536 1.00 0.00 O ATOM 1159 CB ASP A 71 5.521 -0.366 -14.994 1.00 0.00 C ATOM 1160 CG ASP A 71 5.644 -1.078 -16.327 1.00 0.00 C ATOM 1161 OD1 ASP A 71 4.681 -1.766 -16.723 1.00 0.00 O ATOM 1162 OD2 ASP A 71 6.704 -0.946 -16.974 1.00 0.00 O ATOM 0 H ASP A 71 4.463 0.638 -12.902 1.00 0.00 H new ATOM 0 HA ASP A 71 3.914 -1.707 -14.558 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.091 0.623 -15.152 1.00 0.00 H new ATOM 0 HB3 ASP A 71 6.515 -0.217 -14.571 1.00 0.00 H new ATOM 1167 N MET A 72 6.097 -1.607 -12.115 1.00 0.00 N ATOM 1168 CA MET A 72 6.918 -2.436 -11.252 1.00 0.00 C ATOM 1169 C MET A 72 6.036 -3.362 -10.431 1.00 0.00 C ATOM 1170 O MET A 72 6.482 -4.417 -9.983 1.00 0.00 O ATOM 1171 CB MET A 72 7.794 -1.572 -10.337 1.00 0.00 C ATOM 1172 CG MET A 72 7.040 -0.940 -9.177 1.00 0.00 C ATOM 1173 SD MET A 72 7.179 -1.896 -7.656 1.00 0.00 S ATOM 1174 CE MET A 72 5.553 -1.648 -6.950 1.00 0.00 C ATOM 0 H MET A 72 6.016 -0.635 -11.818 1.00 0.00 H new ATOM 0 HA MET A 72 7.578 -3.039 -11.875 1.00 0.00 H new ATOM 0 HB2 MET A 72 8.603 -2.185 -9.940 1.00 0.00 H new ATOM 0 HB3 MET A 72 8.254 -0.783 -10.931 1.00 0.00 H new ATOM 0 HG2 MET A 72 7.422 0.066 -9.005 1.00 0.00 H new ATOM 0 HG3 MET A 72 5.988 -0.840 -9.444 1.00 0.00 H new ATOM 0 HE1 MET A 72 5.651 -1.215 -5.954 1.00 0.00 H new ATOM 0 HE2 MET A 72 4.980 -0.972 -7.585 1.00 0.00 H new ATOM 0 HE3 MET A 72 5.037 -2.605 -6.880 1.00 0.00 H new ATOM 1184 N THR A 73 4.772 -2.977 -10.247 1.00 0.00 N ATOM 1185 CA THR A 73 3.855 -3.810 -9.494 1.00 0.00 C ATOM 1186 C THR A 73 3.643 -5.127 -10.214 1.00 0.00 C ATOM 1187 O THR A 73 3.439 -6.163 -9.581 1.00 0.00 O ATOM 1188 CB THR A 73 2.513 -3.129 -9.270 1.00 0.00 C ATOM 1189 OG1 THR A 73 1.716 -3.931 -8.434 1.00 0.00 O ATOM 1190 CG2 THR A 73 1.721 -2.896 -10.528 1.00 0.00 C ATOM 0 H THR A 73 4.373 -2.109 -10.604 1.00 0.00 H new ATOM 0 HA THR A 73 4.304 -3.987 -8.517 1.00 0.00 H new ATOM 0 HB THR A 73 2.750 -2.159 -8.833 1.00 0.00 H new ATOM 0 HG1 THR A 73 2.190 -4.099 -7.593 1.00 0.00 H new ATOM 0 HG21 THR A 73 0.779 -2.407 -10.280 1.00 0.00 H new ATOM 0 HG22 THR A 73 2.292 -2.261 -11.205 1.00 0.00 H new ATOM 0 HG23 THR A 73 1.517 -3.851 -11.012 1.00 0.00 H new ATOM 1198 N ALA A 74 3.711 -5.090 -11.544 1.00 0.00 N ATOM 1199 CA ALA A 74 3.545 -6.302 -12.330 1.00 0.00 C ATOM 1200 C ALA A 74 4.444 -7.403 -11.779 1.00 0.00 C ATOM 1201 O ALA A 74 4.133 -8.589 -11.887 1.00 0.00 O ATOM 1202 CB ALA A 74 3.855 -6.037 -13.796 1.00 0.00 C ATOM 0 H ALA A 74 3.878 -4.245 -12.090 1.00 0.00 H new ATOM 0 HA ALA A 74 2.507 -6.628 -12.260 1.00 0.00 H new ATOM 0 HB1 ALA A 74 3.725 -6.956 -14.367 1.00 0.00 H new ATOM 0 HB2 ALA A 74 3.178 -5.273 -14.179 1.00 0.00 H new ATOM 0 HB3 ALA A 74 4.884 -5.692 -13.894 1.00 0.00 H new ATOM 1208 N LYS A 75 5.557 -6.992 -11.172 1.00 0.00 N ATOM 1209 CA LYS A 75 6.497 -7.933 -10.584 1.00 0.00 C ATOM 1210 C LYS A 75 6.351 -7.978 -9.063 1.00 0.00 C ATOM 1211 O LYS A 75 6.779 -8.938 -8.422 1.00 0.00 O ATOM 1212 CB LYS A 75 7.931 -7.562 -10.963 1.00 0.00 C ATOM 1213 CG LYS A 75 8.423 -8.249 -12.227 1.00 0.00 C ATOM 1214 CD LYS A 75 8.063 -7.450 -13.470 1.00 0.00 C ATOM 1215 CE LYS A 75 8.887 -7.888 -14.671 1.00 0.00 C ATOM 1216 NZ LYS A 75 8.939 -9.370 -14.798 1.00 0.00 N ATOM 0 H LYS A 75 5.826 -6.013 -11.077 1.00 0.00 H new ATOM 0 HA LYS A 75 6.271 -8.924 -10.979 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.995 -6.482 -11.098 1.00 0.00 H new ATOM 0 HB3 LYS A 75 8.594 -7.820 -10.137 1.00 0.00 H new ATOM 0 HG2 LYS A 75 9.504 -8.377 -12.176 1.00 0.00 H new ATOM 0 HG3 LYS A 75 7.987 -9.246 -12.294 1.00 0.00 H new ATOM 0 HD2 LYS A 75 7.003 -7.575 -13.690 1.00 0.00 H new ATOM 0 HD3 LYS A 75 8.227 -6.389 -13.282 1.00 0.00 H new ATOM 0 HE2 LYS A 75 8.461 -7.461 -15.579 1.00 0.00 H new ATOM 0 HE3 LYS A 75 9.900 -7.496 -14.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 9.282 -9.625 -15.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 9.584 -9.758 -14.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 7.987 -9.764 -14.657 1.00 0.00 H new ATOM 1230 N GLU A 76 5.744 -6.940 -8.487 1.00 0.00 N ATOM 1231 CA GLU A 76 5.549 -6.882 -7.045 1.00 0.00 C ATOM 1232 C GLU A 76 4.457 -7.850 -6.606 1.00 0.00 C ATOM 1233 O GLU A 76 4.724 -8.803 -5.874 1.00 0.00 O ATOM 1234 CB GLU A 76 5.197 -5.459 -6.612 1.00 0.00 C ATOM 1235 CG GLU A 76 5.716 -5.101 -5.230 1.00 0.00 C ATOM 1236 CD GLU A 76 7.183 -4.715 -5.238 1.00 0.00 C ATOM 1237 OE1 GLU A 76 7.721 -4.447 -6.333 1.00 0.00 O ATOM 1238 OE2 GLU A 76 7.794 -4.680 -4.149 1.00 0.00 O ATOM 0 H GLU A 76 5.382 -6.134 -8.997 1.00 0.00 H new ATOM 0 HA GLU A 76 6.482 -7.176 -6.564 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.604 -4.755 -7.338 1.00 0.00 H new ATOM 0 HB3 GLU A 76 4.114 -5.341 -6.627 1.00 0.00 H new ATOM 0 HG2 GLU A 76 5.129 -4.275 -4.829 1.00 0.00 H new ATOM 0 HG3 GLU A 76 5.571 -5.949 -4.561 1.00 0.00 H new ATOM 1245 N LYS A 77 3.229 -7.600 -7.065 1.00 0.00 N ATOM 1246 CA LYS A 77 2.083 -8.451 -6.728 1.00 0.00 C ATOM 1247 C LYS A 77 0.763 -7.706 -6.928 1.00 0.00 C ATOM 1248 O LYS A 77 -0.239 -8.301 -7.321 1.00 0.00 O ATOM 1249 CB LYS A 77 2.170 -8.948 -5.280 1.00 0.00 C ATOM 1250 CG LYS A 77 2.621 -10.395 -5.159 1.00 0.00 C ATOM 1251 CD LYS A 77 3.439 -10.620 -3.899 1.00 0.00 C ATOM 1252 CE LYS A 77 2.633 -10.310 -2.648 1.00 0.00 C ATOM 1253 NZ LYS A 77 3.378 -10.657 -1.406 1.00 0.00 N ATOM 0 H LYS A 77 3.001 -6.813 -7.673 1.00 0.00 H new ATOM 0 HA LYS A 77 2.112 -9.308 -7.401 1.00 0.00 H new ATOM 0 HB2 LYS A 77 2.863 -8.313 -4.728 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.193 -8.840 -4.808 1.00 0.00 H new ATOM 0 HG2 LYS A 77 1.749 -11.049 -5.150 1.00 0.00 H new ATOM 0 HG3 LYS A 77 3.214 -10.667 -6.032 1.00 0.00 H new ATOM 0 HD2 LYS A 77 3.781 -11.655 -3.866 1.00 0.00 H new ATOM 0 HD3 LYS A 77 4.329 -9.991 -3.925 1.00 0.00 H new ATOM 0 HE2 LYS A 77 2.378 -9.250 -2.634 1.00 0.00 H new ATOM 0 HE3 LYS A 77 1.694 -10.863 -2.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 2.992 -10.115 -0.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 3.279 -11.674 -1.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 4.384 -10.425 -1.528 1.00 0.00 H new ATOM 1267 N PHE A 78 0.765 -6.405 -6.639 1.00 0.00 N ATOM 1268 CA PHE A 78 -0.440 -5.588 -6.773 1.00 0.00 C ATOM 1269 C PHE A 78 -1.099 -5.777 -8.112 1.00 0.00 C ATOM 1270 O PHE A 78 -0.589 -6.485 -8.980 1.00 0.00 O ATOM 1271 CB PHE A 78 -0.130 -4.105 -6.603 1.00 0.00 C ATOM 1272 CG PHE A 78 0.908 -3.847 -5.574 1.00 0.00 C ATOM 1273 CD1 PHE A 78 0.734 -4.313 -4.291 1.00 0.00 C ATOM 1274 CD2 PHE A 78 2.065 -3.166 -5.894 1.00 0.00 C ATOM 1275 CE1 PHE A 78 1.703 -4.104 -3.338 1.00 0.00 C ATOM 1276 CE2 PHE A 78 3.036 -2.948 -4.946 1.00 0.00 C ATOM 1277 CZ PHE A 78 2.857 -3.421 -3.664 1.00 0.00 C ATOM 0 H PHE A 78 1.586 -5.895 -6.311 1.00 0.00 H new ATOM 0 HA PHE A 78 -1.116 -5.919 -5.985 1.00 0.00 H new ATOM 0 HB2 PHE A 78 0.202 -3.697 -7.557 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -1.044 -3.577 -6.331 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -0.169 -4.846 -4.031 1.00 0.00 H new ATOM 0 HD2 PHE A 78 2.209 -2.801 -6.900 1.00 0.00 H new ATOM 0 HE1 PHE A 78 1.561 -4.475 -2.334 1.00 0.00 H new ATOM 0 HE2 PHE A 78 3.935 -2.408 -5.205 1.00 0.00 H new ATOM 0 HZ PHE A 78 3.618 -3.257 -2.916 1.00 0.00 H new ATOM 1287 N SER A 79 -2.225 -5.098 -8.264 1.00 0.00 N ATOM 1288 CA SER A 79 -2.995 -5.125 -9.498 1.00 0.00 C ATOM 1289 C SER A 79 -4.488 -4.979 -9.238 1.00 0.00 C ATOM 1290 O SER A 79 -5.182 -4.277 -9.972 1.00 0.00 O ATOM 1291 CB SER A 79 -2.749 -6.407 -10.303 1.00 0.00 C ATOM 1292 OG SER A 79 -1.648 -6.257 -11.182 1.00 0.00 O ATOM 0 H SER A 79 -2.631 -4.512 -7.535 1.00 0.00 H new ATOM 0 HA SER A 79 -2.651 -4.272 -10.082 1.00 0.00 H new ATOM 0 HB2 SER A 79 -2.563 -7.237 -9.622 1.00 0.00 H new ATOM 0 HB3 SER A 79 -3.643 -6.658 -10.875 1.00 0.00 H new ATOM 0 HG SER A 79 -0.814 -6.286 -10.669 1.00 0.00 H new ATOM 1298 N PRO A 80 -5.029 -5.690 -8.235 1.00 0.00 N ATOM 1299 CA PRO A 80 -6.446 -5.668 -7.944 1.00 0.00 C ATOM 1300 C PRO A 80 -6.858 -4.776 -6.780 1.00 0.00 C ATOM 1301 O PRO A 80 -7.458 -3.722 -6.994 1.00 0.00 O ATOM 1302 CB PRO A 80 -6.715 -7.136 -7.625 1.00 0.00 C ATOM 1303 CG PRO A 80 -5.416 -7.666 -7.071 1.00 0.00 C ATOM 1304 CD PRO A 80 -4.342 -6.633 -7.356 1.00 0.00 C ATOM 0 HA PRO A 80 -7.017 -5.248 -8.772 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -7.523 -7.240 -6.901 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -7.015 -7.684 -8.518 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -5.501 -7.845 -5.999 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -5.163 -8.620 -7.534 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -3.990 -6.153 -6.443 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -3.471 -7.077 -7.839 1.00 0.00 H new ATOM 1312 N LEU A 81 -6.557 -5.184 -5.552 1.00 0.00 N ATOM 1313 CA LEU A 81 -6.936 -4.382 -4.403 1.00 0.00 C ATOM 1314 C LEU A 81 -5.786 -3.488 -3.998 1.00 0.00 C ATOM 1315 O LEU A 81 -5.840 -2.793 -2.985 1.00 0.00 O ATOM 1316 CB LEU A 81 -7.358 -5.268 -3.237 1.00 0.00 C ATOM 1317 CG LEU A 81 -8.854 -5.586 -3.186 1.00 0.00 C ATOM 1318 CD1 LEU A 81 -9.664 -4.315 -2.973 1.00 0.00 C ATOM 1319 CD2 LEU A 81 -9.292 -6.290 -4.461 1.00 0.00 C ATOM 0 H LEU A 81 -6.062 -6.048 -5.332 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.788 -3.761 -4.679 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.803 -6.204 -3.290 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.072 -4.780 -2.305 1.00 0.00 H new ATOM 0 HG LEU A 81 -9.035 -6.254 -2.344 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -10.725 -4.561 -2.939 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -9.370 -3.849 -2.032 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -9.478 -3.623 -3.794 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -10.358 -6.509 -4.408 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -9.096 -5.646 -5.318 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -8.736 -7.221 -4.572 1.00 0.00 H new ATOM 1331 N THR A 82 -4.746 -3.517 -4.811 1.00 0.00 N ATOM 1332 CA THR A 82 -3.573 -2.722 -4.569 1.00 0.00 C ATOM 1333 C THR A 82 -3.262 -1.834 -5.766 1.00 0.00 C ATOM 1334 O THR A 82 -2.318 -1.049 -5.731 1.00 0.00 O ATOM 1335 CB THR A 82 -2.396 -3.624 -4.241 1.00 0.00 C ATOM 1336 OG1 THR A 82 -2.819 -4.969 -4.090 1.00 0.00 O ATOM 1337 CG2 THR A 82 -1.696 -3.216 -2.963 1.00 0.00 C ATOM 0 H THR A 82 -4.698 -4.092 -5.652 1.00 0.00 H new ATOM 0 HA THR A 82 -3.762 -2.071 -3.716 1.00 0.00 H new ATOM 0 HB THR A 82 -1.702 -3.527 -5.076 1.00 0.00 H new ATOM 0 HG1 THR A 82 -3.204 -5.093 -3.197 1.00 0.00 H new ATOM 0 HG21 THR A 82 -0.862 -3.892 -2.773 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.322 -2.197 -3.062 1.00 0.00 H new ATOM 0 HG23 THR A 82 -2.399 -3.265 -2.132 1.00 0.00 H new ATOM 1345 N SER A 83 -4.072 -1.933 -6.823 1.00 0.00 N ATOM 1346 CA SER A 83 -3.860 -1.102 -7.997 1.00 0.00 C ATOM 1347 C SER A 83 -4.560 0.243 -7.829 1.00 0.00 C ATOM 1348 O SER A 83 -4.932 0.900 -8.802 1.00 0.00 O ATOM 1349 CB SER A 83 -4.369 -1.792 -9.259 1.00 0.00 C ATOM 1350 OG SER A 83 -3.298 -2.311 -10.024 1.00 0.00 O ATOM 0 H SER A 83 -4.866 -2.570 -6.885 1.00 0.00 H new ATOM 0 HA SER A 83 -2.787 -0.939 -8.100 1.00 0.00 H new ATOM 0 HB2 SER A 83 -5.050 -2.599 -8.987 1.00 0.00 H new ATOM 0 HB3 SER A 83 -4.939 -1.083 -9.860 1.00 0.00 H new ATOM 0 HG SER A 83 -3.649 -2.721 -10.842 1.00 0.00 H new ATOM 1356 N ASN A 84 -4.711 0.638 -6.580 1.00 0.00 N ATOM 1357 CA ASN A 84 -5.335 1.896 -6.212 1.00 0.00 C ATOM 1358 C ASN A 84 -4.565 2.427 -5.028 1.00 0.00 C ATOM 1359 O ASN A 84 -4.150 3.586 -4.996 1.00 0.00 O ATOM 1360 CB ASN A 84 -6.809 1.695 -5.855 1.00 0.00 C ATOM 1361 CG ASN A 84 -7.650 2.919 -6.164 1.00 0.00 C ATOM 1362 OD1 ASN A 84 -7.192 3.851 -6.824 1.00 0.00 O ATOM 1363 ND2 ASN A 84 -8.890 2.921 -5.687 1.00 0.00 N ATOM 0 H ASN A 84 -4.400 0.087 -5.780 1.00 0.00 H new ATOM 0 HA ASN A 84 -5.310 2.599 -7.044 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -7.200 0.840 -6.406 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -6.894 1.457 -4.795 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -9.503 3.717 -5.864 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -9.229 2.127 -5.144 1.00 0.00 H new ATOM 1370 N LEU A 85 -4.312 1.525 -4.085 1.00 0.00 N ATOM 1371 CA LEU A 85 -3.516 1.849 -2.927 1.00 0.00 C ATOM 1372 C LEU A 85 -2.113 2.189 -3.410 1.00 0.00 C ATOM 1373 O LEU A 85 -1.361 2.888 -2.733 1.00 0.00 O ATOM 1374 CB LEU A 85 -3.469 0.664 -1.956 1.00 0.00 C ATOM 1375 CG LEU A 85 -3.003 1.004 -0.538 1.00 0.00 C ATOM 1376 CD1 LEU A 85 -3.768 0.183 0.489 1.00 0.00 C ATOM 1377 CD2 LEU A 85 -1.506 0.771 -0.400 1.00 0.00 C ATOM 0 H LEU A 85 -4.652 0.564 -4.109 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.953 2.694 -2.396 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -4.464 0.222 -1.899 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -2.805 -0.097 -2.367 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.207 2.059 -0.353 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -3.422 0.439 1.490 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -4.833 0.399 0.407 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -3.597 -0.878 0.307 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -1.191 1.018 0.614 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.280 -0.275 -0.606 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -0.972 1.404 -1.109 1.00 0.00 H new ATOM 1389 N ILE A 86 -1.774 1.693 -4.612 1.00 0.00 N ATOM 1390 CA ILE A 86 -0.476 1.955 -5.196 1.00 0.00 C ATOM 1391 C ILE A 86 -0.370 3.419 -5.613 1.00 0.00 C ATOM 1392 O ILE A 86 0.594 4.107 -5.275 1.00 0.00 O ATOM 1393 CB ILE A 86 -0.204 1.031 -6.412 1.00 0.00 C ATOM 1394 CG1 ILE A 86 0.781 -0.072 -6.025 1.00 0.00 C ATOM 1395 CG2 ILE A 86 0.327 1.815 -7.608 1.00 0.00 C ATOM 1396 CD1 ILE A 86 0.271 -0.973 -4.925 1.00 0.00 C ATOM 0 H ILE A 86 -2.387 1.113 -5.185 1.00 0.00 H new ATOM 0 HA ILE A 86 0.279 1.743 -4.439 1.00 0.00 H new ATOM 0 HB ILE A 86 -1.152 0.581 -6.706 1.00 0.00 H new ATOM 0 HG12 ILE A 86 1.003 -0.676 -6.905 1.00 0.00 H new ATOM 0 HG13 ILE A 86 1.718 0.384 -5.706 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.505 1.133 -8.440 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -0.405 2.566 -7.905 1.00 0.00 H new ATOM 0 HG23 ILE A 86 1.261 2.307 -7.335 1.00 0.00 H new ATOM 0 HD11 ILE A 86 1.020 -1.733 -4.700 1.00 0.00 H new ATOM 0 HD12 ILE A 86 0.075 -0.381 -4.031 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.651 -1.457 -5.249 1.00 0.00 H new ATOM 1408 N ASN A 87 -1.376 3.885 -6.346 1.00 0.00 N ATOM 1409 CA ASN A 87 -1.410 5.264 -6.809 1.00 0.00 C ATOM 1410 C ASN A 87 -1.589 6.219 -5.633 1.00 0.00 C ATOM 1411 O ASN A 87 -1.066 7.333 -5.639 1.00 0.00 O ATOM 1412 CB ASN A 87 -2.538 5.452 -7.832 1.00 0.00 C ATOM 1413 CG ASN A 87 -3.898 5.654 -7.186 1.00 0.00 C ATOM 1414 OD1 ASN A 87 -4.715 4.736 -7.131 1.00 0.00 O ATOM 1415 ND2 ASN A 87 -4.146 6.863 -6.696 1.00 0.00 N ATOM 0 H ASN A 87 -2.179 3.325 -6.632 1.00 0.00 H new ATOM 0 HA ASN A 87 -0.460 5.492 -7.293 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -2.310 6.312 -8.462 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -2.578 4.580 -8.485 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -5.043 7.059 -6.252 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -3.439 7.595 -6.763 1.00 0.00 H new ATOM 1422 N LEU A 88 -2.335 5.771 -4.629 1.00 0.00 N ATOM 1423 CA LEU A 88 -2.590 6.579 -3.442 1.00 0.00 C ATOM 1424 C LEU A 88 -1.340 6.695 -2.581 1.00 0.00 C ATOM 1425 O LEU A 88 -1.066 7.752 -2.013 1.00 0.00 O ATOM 1426 CB LEU A 88 -3.736 5.977 -2.626 1.00 0.00 C ATOM 1427 CG LEU A 88 -4.682 6.997 -1.988 1.00 0.00 C ATOM 1428 CD1 LEU A 88 -6.099 6.449 -1.933 1.00 0.00 C ATOM 1429 CD2 LEU A 88 -4.198 7.371 -0.595 1.00 0.00 C ATOM 0 H LEU A 88 -2.775 4.851 -4.614 1.00 0.00 H new ATOM 0 HA LEU A 88 -2.874 7.579 -3.769 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -4.317 5.321 -3.274 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -3.313 5.354 -1.838 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.687 7.896 -2.604 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -6.757 7.188 -1.476 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -6.444 6.231 -2.944 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -6.113 5.535 -1.340 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -4.882 8.097 -0.155 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -4.165 6.479 0.030 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -3.200 7.805 -0.661 1.00 0.00 H new ATOM 1441 N LEU A 89 -0.579 5.609 -2.488 1.00 0.00 N ATOM 1442 CA LEU A 89 0.641 5.615 -1.695 1.00 0.00 C ATOM 1443 C LEU A 89 1.703 6.473 -2.366 1.00 0.00 C ATOM 1444 O LEU A 89 2.480 7.160 -1.703 1.00 0.00 O ATOM 1445 CB LEU A 89 1.156 4.190 -1.495 1.00 0.00 C ATOM 1446 CG LEU A 89 0.924 3.626 -0.096 1.00 0.00 C ATOM 1447 CD1 LEU A 89 -0.553 3.674 0.261 1.00 0.00 C ATOM 1448 CD2 LEU A 89 1.455 2.204 0.004 1.00 0.00 C ATOM 0 H LEU A 89 -0.784 4.722 -2.948 1.00 0.00 H new ATOM 0 HA LEU A 89 0.416 6.041 -0.717 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.673 3.537 -2.222 1.00 0.00 H new ATOM 0 HB3 LEU A 89 2.225 4.170 -1.709 1.00 0.00 H new ATOM 0 HG LEU A 89 1.469 4.244 0.618 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -0.699 3.268 1.262 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.900 4.707 0.234 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -1.120 3.082 -0.457 1.00 0.00 H new ATOM 0 HD21 LEU A 89 1.280 1.820 1.009 1.00 0.00 H new ATOM 0 HD22 LEU A 89 0.941 1.572 -0.720 1.00 0.00 H new ATOM 0 HD23 LEU A 89 2.525 2.200 -0.205 1.00 0.00 H new ATOM 1460 N ALA A 90 1.719 6.431 -3.691 1.00 0.00 N ATOM 1461 CA ALA A 90 2.673 7.208 -4.471 1.00 0.00 C ATOM 1462 C ALA A 90 1.995 8.405 -5.131 1.00 0.00 C ATOM 1463 O ALA A 90 2.472 8.918 -6.144 1.00 0.00 O ATOM 1464 CB ALA A 90 3.335 6.328 -5.521 1.00 0.00 C ATOM 0 H ALA A 90 1.080 5.865 -4.250 1.00 0.00 H new ATOM 0 HA ALA A 90 3.439 7.585 -3.794 1.00 0.00 H new ATOM 0 HB1 ALA A 90 4.046 6.921 -6.097 1.00 0.00 H new ATOM 0 HB2 ALA A 90 3.860 5.508 -5.030 1.00 0.00 H new ATOM 0 HB3 ALA A 90 2.574 5.924 -6.189 1.00 0.00 H new ATOM 1470 N GLU A 91 0.882 8.851 -4.551 1.00 0.00 N ATOM 1471 CA GLU A 91 0.147 9.991 -5.085 1.00 0.00 C ATOM 1472 C GLU A 91 0.733 11.296 -4.564 1.00 0.00 C ATOM 1473 O GLU A 91 1.068 12.193 -5.337 1.00 0.00 O ATOM 1474 CB GLU A 91 -1.334 9.897 -4.709 1.00 0.00 C ATOM 1475 CG GLU A 91 -2.271 10.008 -5.899 1.00 0.00 C ATOM 1476 CD GLU A 91 -3.711 9.703 -5.539 1.00 0.00 C ATOM 1477 OE1 GLU A 91 -4.044 9.745 -4.335 1.00 0.00 O ATOM 1478 OE2 GLU A 91 -4.507 9.422 -6.460 1.00 0.00 O ATOM 0 H GLU A 91 0.472 8.440 -3.713 1.00 0.00 H new ATOM 0 HA GLU A 91 0.236 9.975 -6.171 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.513 8.948 -4.204 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -1.570 10.687 -3.996 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -2.209 11.015 -6.312 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -1.943 9.322 -6.680 1.00 0.00 H new ATOM 1485 N ASN A 92 0.851 11.394 -3.244 1.00 0.00 N ATOM 1486 CA ASN A 92 1.395 12.589 -2.616 1.00 0.00 C ATOM 1487 C ASN A 92 2.754 12.302 -1.983 1.00 0.00 C ATOM 1488 O ASN A 92 3.604 13.187 -1.886 1.00 0.00 O ATOM 1489 CB ASN A 92 0.428 13.124 -1.558 1.00 0.00 C ATOM 1490 CG ASN A 92 -0.995 13.220 -2.073 1.00 0.00 C ATOM 1491 OD1 ASN A 92 -1.235 13.175 -3.279 1.00 0.00 O ATOM 1492 ND2 ASN A 92 -1.947 13.353 -1.157 1.00 0.00 N ATOM 0 H ASN A 92 0.577 10.660 -2.590 1.00 0.00 H new ATOM 0 HA ASN A 92 1.527 13.345 -3.390 1.00 0.00 H new ATOM 0 HB2 ASN A 92 0.452 12.473 -0.684 1.00 0.00 H new ATOM 0 HB3 ASN A 92 0.760 14.109 -1.230 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -2.924 13.422 -1.443 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -1.702 13.386 -0.167 1.00 0.00 H new ATOM 1499 N GLY A 93 2.949 11.060 -1.552 1.00 0.00 N ATOM 1500 CA GLY A 93 4.205 10.679 -0.933 1.00 0.00 C ATOM 1501 C GLY A 93 4.003 9.900 0.352 1.00 0.00 C ATOM 1502 O GLY A 93 4.500 10.292 1.408 1.00 0.00 O ATOM 0 H GLY A 93 2.260 10.311 -1.620 1.00 0.00 H new ATOM 0 HA2 GLY A 93 4.784 10.076 -1.633 1.00 0.00 H new ATOM 0 HA3 GLY A 93 4.790 11.574 -0.724 1.00 0.00 H new ATOM 1506 N ARG A 94 3.270 8.795 0.262 1.00 0.00 N ATOM 1507 CA ARG A 94 3.003 7.960 1.427 1.00 0.00 C ATOM 1508 C ARG A 94 4.010 6.817 1.532 1.00 0.00 C ATOM 1509 O ARG A 94 3.762 5.823 2.213 1.00 0.00 O ATOM 1510 CB ARG A 94 1.582 7.396 1.361 1.00 0.00 C ATOM 1511 CG ARG A 94 0.978 7.108 2.727 1.00 0.00 C ATOM 1512 CD ARG A 94 0.310 8.341 3.317 1.00 0.00 C ATOM 1513 NE ARG A 94 1.142 9.536 3.183 1.00 0.00 N ATOM 1514 CZ ARG A 94 1.030 10.418 2.190 1.00 0.00 C ATOM 1515 NH1 ARG A 94 0.127 10.245 1.231 1.00 0.00 N ATOM 1516 NH2 ARG A 94 1.826 11.478 2.156 1.00 0.00 N ATOM 0 H ARG A 94 2.851 8.458 -0.605 1.00 0.00 H new ATOM 0 HA ARG A 94 3.102 8.585 2.315 1.00 0.00 H new ATOM 0 HB2 ARG A 94 0.943 8.104 0.832 1.00 0.00 H new ATOM 0 HB3 ARG A 94 1.592 6.476 0.776 1.00 0.00 H new ATOM 0 HG2 ARG A 94 0.247 6.304 2.640 1.00 0.00 H new ATOM 0 HG3 ARG A 94 1.758 6.757 3.403 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -0.646 8.508 2.820 1.00 0.00 H new ATOM 0 HD3 ARG A 94 0.095 8.166 4.371 1.00 0.00 H new ATOM 0 HE ARG A 94 1.853 9.705 3.894 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -0.488 9.432 1.251 1.00 0.00 H new ATOM 0 HH12 ARG A 94 0.049 10.926 0.475 1.00 0.00 H new ATOM 0 HH21 ARG A 94 2.522 11.617 2.889 1.00 0.00 H new ATOM 0 HH22 ARG A 94 1.742 12.154 1.397 1.00 0.00 H new ATOM 1530 N LEU A 95 5.148 6.964 0.857 1.00 0.00 N ATOM 1531 CA LEU A 95 6.185 5.940 0.886 1.00 0.00 C ATOM 1532 C LEU A 95 7.225 6.260 1.956 1.00 0.00 C ATOM 1533 O LEU A 95 8.429 6.235 1.705 1.00 0.00 O ATOM 1534 CB LEU A 95 6.848 5.814 -0.491 1.00 0.00 C ATOM 1535 CG LEU A 95 6.426 4.588 -1.302 1.00 0.00 C ATOM 1536 CD1 LEU A 95 4.909 4.510 -1.407 1.00 0.00 C ATOM 1537 CD2 LEU A 95 7.055 4.623 -2.687 1.00 0.00 C ATOM 0 H LEU A 95 5.373 7.779 0.286 1.00 0.00 H new ATOM 0 HA LEU A 95 5.722 4.985 1.135 1.00 0.00 H new ATOM 0 HB2 LEU A 95 6.621 6.709 -1.070 1.00 0.00 H new ATOM 0 HB3 LEU A 95 7.929 5.787 -0.356 1.00 0.00 H new ATOM 0 HG LEU A 95 6.780 3.696 -0.784 1.00 0.00 H new ATOM 0 HD11 LEU A 95 4.629 3.631 -1.988 1.00 0.00 H new ATOM 0 HD12 LEU A 95 4.478 4.437 -0.408 1.00 0.00 H new ATOM 0 HD13 LEU A 95 4.532 5.406 -1.900 1.00 0.00 H new ATOM 0 HD21 LEU A 95 6.744 3.743 -3.250 1.00 0.00 H new ATOM 0 HD22 LEU A 95 6.731 5.522 -3.211 1.00 0.00 H new ATOM 0 HD23 LEU A 95 8.141 4.629 -2.593 1.00 0.00 H new ATOM 1549 N THR A 96 6.738 6.550 3.155 1.00 0.00 N ATOM 1550 CA THR A 96 7.599 6.869 4.287 1.00 0.00 C ATOM 1551 C THR A 96 7.141 6.097 5.515 1.00 0.00 C ATOM 1552 O THR A 96 7.940 5.459 6.201 1.00 0.00 O ATOM 1553 CB THR A 96 7.578 8.372 4.571 1.00 0.00 C ATOM 1554 OG1 THR A 96 7.452 9.108 3.367 1.00 0.00 O ATOM 1555 CG2 THR A 96 8.821 8.862 5.281 1.00 0.00 C ATOM 0 H THR A 96 5.741 6.571 3.370 1.00 0.00 H new ATOM 0 HA THR A 96 8.621 6.580 4.043 1.00 0.00 H new ATOM 0 HB THR A 96 6.719 8.532 5.223 1.00 0.00 H new ATOM 0 HG1 THR A 96 7.439 10.067 3.570 1.00 0.00 H new ATOM 0 HG21 THR A 96 8.743 9.936 5.453 1.00 0.00 H new ATOM 0 HG22 THR A 96 8.920 8.348 6.237 1.00 0.00 H new ATOM 0 HG23 THR A 96 9.697 8.656 4.666 1.00 0.00 H new ATOM 1563 N ASN A 97 5.837 6.142 5.767 1.00 0.00 N ATOM 1564 CA ASN A 97 5.245 5.430 6.890 1.00 0.00 C ATOM 1565 C ASN A 97 4.392 4.271 6.380 1.00 0.00 C ATOM 1566 O ASN A 97 3.567 3.723 7.110 1.00 0.00 O ATOM 1567 CB ASN A 97 4.391 6.379 7.733 1.00 0.00 C ATOM 1568 CG ASN A 97 5.213 7.483 8.371 1.00 0.00 C ATOM 1569 OD1 ASN A 97 5.586 7.399 9.541 1.00 0.00 O ATOM 1570 ND2 ASN A 97 5.498 8.528 7.602 1.00 0.00 N ATOM 0 H ASN A 97 5.168 6.668 5.204 1.00 0.00 H new ATOM 0 HA ASN A 97 6.046 5.035 7.515 1.00 0.00 H new ATOM 0 HB2 ASN A 97 3.617 6.822 7.106 1.00 0.00 H new ATOM 0 HB3 ASN A 97 3.883 5.811 8.512 1.00 0.00 H new ATOM 0 HD21 ASN A 97 6.046 9.302 7.976 1.00 0.00 H new ATOM 0 HD22 ASN A 97 5.168 8.556 6.637 1.00 0.00 H new ATOM 1577 N THR A 98 4.604 3.907 5.113 1.00 0.00 N ATOM 1578 CA THR A 98 3.867 2.819 4.478 1.00 0.00 C ATOM 1579 C THR A 98 3.736 1.604 5.397 1.00 0.00 C ATOM 1580 O THR A 98 2.628 1.139 5.658 1.00 0.00 O ATOM 1581 CB THR A 98 4.560 2.417 3.176 1.00 0.00 C ATOM 1582 OG1 THR A 98 5.388 3.466 2.705 1.00 0.00 O ATOM 1583 CG2 THR A 98 3.591 2.069 2.070 1.00 0.00 C ATOM 0 H THR A 98 5.288 4.357 4.504 1.00 0.00 H new ATOM 0 HA THR A 98 2.860 3.179 4.265 1.00 0.00 H new ATOM 0 HB THR A 98 5.145 1.530 3.420 1.00 0.00 H new ATOM 0 HG1 THR A 98 4.874 4.300 2.673 1.00 0.00 H new ATOM 0 HG21 THR A 98 4.146 1.793 1.174 1.00 0.00 H new ATOM 0 HG22 THR A 98 2.967 1.232 2.383 1.00 0.00 H new ATOM 0 HG23 THR A 98 2.960 2.931 1.855 1.00 0.00 H new ATOM 1591 N PRO A 99 4.865 1.068 5.904 1.00 0.00 N ATOM 1592 CA PRO A 99 4.857 -0.095 6.793 1.00 0.00 C ATOM 1593 C PRO A 99 3.767 -0.006 7.856 1.00 0.00 C ATOM 1594 O PRO A 99 3.262 -1.025 8.330 1.00 0.00 O ATOM 1595 CB PRO A 99 6.253 -0.075 7.443 1.00 0.00 C ATOM 1596 CG PRO A 99 6.935 1.155 6.929 1.00 0.00 C ATOM 1597 CD PRO A 99 6.232 1.536 5.659 1.00 0.00 C ATOM 0 HA PRO A 99 4.647 -1.016 6.249 1.00 0.00 H new ATOM 0 HB2 PRO A 99 6.176 -0.052 8.530 1.00 0.00 H new ATOM 0 HB3 PRO A 99 6.817 -0.971 7.182 1.00 0.00 H new ATOM 0 HG2 PRO A 99 6.880 1.962 7.659 1.00 0.00 H new ATOM 0 HG3 PRO A 99 7.992 0.963 6.744 1.00 0.00 H new ATOM 0 HD2 PRO A 99 6.268 2.611 5.481 1.00 0.00 H new ATOM 0 HD3 PRO A 99 6.677 1.054 4.788 1.00 0.00 H new ATOM 1605 N ALA A 100 3.403 1.219 8.223 1.00 0.00 N ATOM 1606 CA ALA A 100 2.369 1.440 9.225 1.00 0.00 C ATOM 1607 C ALA A 100 0.998 1.036 8.693 1.00 0.00 C ATOM 1608 O ALA A 100 0.184 0.465 9.418 1.00 0.00 O ATOM 1609 CB ALA A 100 2.358 2.899 9.656 1.00 0.00 C ATOM 0 H ALA A 100 3.809 2.073 7.841 1.00 0.00 H new ATOM 0 HA ALA A 100 2.595 0.817 10.090 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.581 3.051 10.405 1.00 0.00 H new ATOM 0 HB2 ALA A 100 3.327 3.160 10.080 1.00 0.00 H new ATOM 0 HB3 ALA A 100 2.158 3.532 8.792 1.00 0.00 H new ATOM 1615 N VAL A 101 0.750 1.335 7.421 1.00 0.00 N ATOM 1616 CA VAL A 101 -0.522 1.002 6.791 1.00 0.00 C ATOM 1617 C VAL A 101 -0.686 -0.508 6.648 1.00 0.00 C ATOM 1618 O VAL A 101 -1.803 -1.022 6.632 1.00 0.00 O ATOM 1619 CB VAL A 101 -0.647 1.656 5.402 1.00 0.00 C ATOM 1620 CG1 VAL A 101 -2.049 1.464 4.844 1.00 0.00 C ATOM 1621 CG2 VAL A 101 -0.292 3.134 5.474 1.00 0.00 C ATOM 0 H VAL A 101 1.414 1.807 6.807 1.00 0.00 H new ATOM 0 HA VAL A 101 -1.308 1.389 7.439 1.00 0.00 H new ATOM 0 HB VAL A 101 0.057 1.169 4.727 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -2.117 1.933 3.862 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -2.262 0.399 4.753 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -2.774 1.922 5.516 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -0.386 3.579 4.484 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -0.969 3.638 6.164 1.00 0.00 H new ATOM 0 HG23 VAL A 101 0.734 3.245 5.826 1.00 0.00 H new ATOM 1631 N ILE A 102 0.436 -1.214 6.542 1.00 0.00 N ATOM 1632 CA ILE A 102 0.414 -2.665 6.399 1.00 0.00 C ATOM 1633 C ILE A 102 0.078 -3.344 7.722 1.00 0.00 C ATOM 1634 O ILE A 102 -0.717 -4.283 7.765 1.00 0.00 O ATOM 1635 CB ILE A 102 1.767 -3.202 5.893 1.00 0.00 C ATOM 1636 CG1 ILE A 102 2.231 -2.413 4.668 1.00 0.00 C ATOM 1637 CG2 ILE A 102 1.661 -4.683 5.564 1.00 0.00 C ATOM 1638 CD1 ILE A 102 3.675 -2.673 4.294 1.00 0.00 C ATOM 0 H ILE A 102 1.370 -0.805 6.552 1.00 0.00 H new ATOM 0 HA ILE A 102 -0.359 -2.896 5.666 1.00 0.00 H new ATOM 0 HB ILE A 102 2.506 -3.076 6.684 1.00 0.00 H new ATOM 0 HG12 ILE A 102 1.593 -2.665 3.821 1.00 0.00 H new ATOM 0 HG13 ILE A 102 2.100 -1.348 4.860 1.00 0.00 H new ATOM 0 HG21 ILE A 102 2.625 -5.047 5.208 1.00 0.00 H new ATOM 0 HG22 ILE A 102 1.373 -5.235 6.459 1.00 0.00 H new ATOM 0 HG23 ILE A 102 0.909 -4.831 4.789 1.00 0.00 H new ATOM 0 HD11 ILE A 102 3.936 -2.081 3.417 1.00 0.00 H new ATOM 0 HD12 ILE A 102 4.322 -2.394 5.126 1.00 0.00 H new ATOM 0 HD13 ILE A 102 3.808 -3.731 4.070 1.00 0.00 H new ATOM 1650 N SER A 103 0.689 -2.866 8.801 1.00 0.00 N ATOM 1651 CA SER A 103 0.456 -3.430 10.126 1.00 0.00 C ATOM 1652 C SER A 103 -0.999 -3.256 10.545 1.00 0.00 C ATOM 1653 O SER A 103 -1.675 -4.224 10.893 1.00 0.00 O ATOM 1654 CB SER A 103 1.378 -2.770 11.153 1.00 0.00 C ATOM 1655 OG SER A 103 1.750 -3.688 12.168 1.00 0.00 O ATOM 0 H SER A 103 1.350 -2.089 8.784 1.00 0.00 H new ATOM 0 HA SER A 103 0.676 -4.497 10.083 1.00 0.00 H new ATOM 0 HB2 SER A 103 2.271 -2.392 10.655 1.00 0.00 H new ATOM 0 HB3 SER A 103 0.875 -1.913 11.600 1.00 0.00 H new ATOM 0 HG SER A 103 2.340 -3.243 12.811 1.00 0.00 H new ATOM 1661 N ALA A 104 -1.477 -2.016 10.511 1.00 0.00 N ATOM 1662 CA ALA A 104 -2.854 -1.715 10.886 1.00 0.00 C ATOM 1663 C ALA A 104 -3.841 -2.549 10.075 1.00 0.00 C ATOM 1664 O ALA A 104 -4.950 -2.831 10.528 1.00 0.00 O ATOM 1665 CB ALA A 104 -3.137 -0.231 10.707 1.00 0.00 C ATOM 0 H ALA A 104 -0.930 -1.203 10.227 1.00 0.00 H new ATOM 0 HA ALA A 104 -2.983 -1.973 11.937 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -4.168 -0.020 10.990 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -2.462 0.347 11.338 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -2.984 0.045 9.664 1.00 0.00 H new ATOM 1671 N PHE A 105 -3.430 -2.941 8.872 1.00 0.00 N ATOM 1672 CA PHE A 105 -4.277 -3.743 7.997 1.00 0.00 C ATOM 1673 C PHE A 105 -4.532 -5.121 8.594 1.00 0.00 C ATOM 1674 O PHE A 105 -5.644 -5.643 8.525 1.00 0.00 O ATOM 1675 CB PHE A 105 -3.625 -3.888 6.621 1.00 0.00 C ATOM 1676 CG PHE A 105 -4.557 -4.400 5.560 1.00 0.00 C ATOM 1677 CD1 PHE A 105 -5.075 -5.684 5.626 1.00 0.00 C ATOM 1678 CD2 PHE A 105 -4.914 -3.596 4.491 1.00 0.00 C ATOM 1679 CE1 PHE A 105 -5.928 -6.153 4.648 1.00 0.00 C ATOM 1680 CE2 PHE A 105 -5.766 -4.061 3.510 1.00 0.00 C ATOM 1681 CZ PHE A 105 -6.273 -5.341 3.589 1.00 0.00 C ATOM 0 H PHE A 105 -2.515 -2.716 8.482 1.00 0.00 H new ATOM 0 HA PHE A 105 -5.234 -3.231 7.892 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -3.233 -2.919 6.311 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -2.774 -4.565 6.702 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -4.808 -6.325 6.453 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -4.521 -2.592 4.424 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -6.325 -7.155 4.712 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -6.035 -3.423 2.681 1.00 0.00 H new ATOM 0 HZ PHE A 105 -6.940 -5.707 2.822 1.00 0.00 H new ATOM 1691 N SER A 106 -3.492 -5.709 9.178 1.00 0.00 N ATOM 1692 CA SER A 106 -3.604 -7.031 9.782 1.00 0.00 C ATOM 1693 C SER A 106 -4.655 -7.043 10.886 1.00 0.00 C ATOM 1694 O SER A 106 -5.493 -7.942 10.948 1.00 0.00 O ATOM 1695 CB SER A 106 -2.252 -7.476 10.342 1.00 0.00 C ATOM 1696 OG SER A 106 -2.240 -8.869 10.602 1.00 0.00 O ATOM 0 H SER A 106 -2.564 -5.291 9.245 1.00 0.00 H new ATOM 0 HA SER A 106 -3.916 -7.730 9.005 1.00 0.00 H new ATOM 0 HB2 SER A 106 -1.462 -7.229 9.633 1.00 0.00 H new ATOM 0 HB3 SER A 106 -2.038 -6.930 11.261 1.00 0.00 H new ATOM 0 HG SER A 106 -1.364 -9.128 10.957 1.00 0.00 H new ATOM 1702 N THR A 107 -4.605 -6.041 11.757 1.00 0.00 N ATOM 1703 CA THR A 107 -5.554 -5.943 12.858 1.00 0.00 C ATOM 1704 C THR A 107 -6.953 -5.648 12.342 1.00 0.00 C ATOM 1705 O THR A 107 -7.926 -6.265 12.777 1.00 0.00 O ATOM 1706 CB THR A 107 -5.117 -4.865 13.849 1.00 0.00 C ATOM 1707 OG1 THR A 107 -3.811 -5.124 14.329 1.00 0.00 O ATOM 1708 CG2 THR A 107 -6.032 -4.748 15.048 1.00 0.00 C ATOM 0 H THR A 107 -3.919 -5.287 11.722 1.00 0.00 H new ATOM 0 HA THR A 107 -5.574 -6.903 13.373 1.00 0.00 H new ATOM 0 HB THR A 107 -5.154 -3.929 13.291 1.00 0.00 H new ATOM 0 HG1 THR A 107 -3.549 -4.422 14.961 1.00 0.00 H new ATOM 0 HG21 THR A 107 -5.664 -3.965 15.711 1.00 0.00 H new ATOM 0 HG22 THR A 107 -7.039 -4.498 14.714 1.00 0.00 H new ATOM 0 HG23 THR A 107 -6.053 -5.697 15.584 1.00 0.00 H new ATOM 1716 N MET A 108 -7.057 -4.717 11.401 1.00 0.00 N ATOM 1717 CA MET A 108 -8.346 -4.378 10.832 1.00 0.00 C ATOM 1718 C MET A 108 -8.853 -5.533 9.981 1.00 0.00 C ATOM 1719 O MET A 108 -10.054 -5.681 9.761 1.00 0.00 O ATOM 1720 CB MET A 108 -8.243 -3.109 9.993 1.00 0.00 C ATOM 1721 CG MET A 108 -7.835 -1.884 10.795 1.00 0.00 C ATOM 1722 SD MET A 108 -9.059 -1.429 12.038 1.00 0.00 S ATOM 1723 CE MET A 108 -8.899 0.356 12.032 1.00 0.00 C ATOM 0 H MET A 108 -6.270 -4.191 11.022 1.00 0.00 H new ATOM 0 HA MET A 108 -9.051 -4.196 11.643 1.00 0.00 H new ATOM 0 HB2 MET A 108 -7.518 -3.269 9.194 1.00 0.00 H new ATOM 0 HB3 MET A 108 -9.205 -2.918 9.517 1.00 0.00 H new ATOM 0 HG2 MET A 108 -6.880 -2.076 11.284 1.00 0.00 H new ATOM 0 HG3 MET A 108 -7.682 -1.045 10.117 1.00 0.00 H new ATOM 0 HE1 MET A 108 -8.997 0.734 13.050 1.00 0.00 H new ATOM 0 HE2 MET A 108 -7.922 0.632 11.635 1.00 0.00 H new ATOM 0 HE3 MET A 108 -9.680 0.789 11.407 1.00 0.00 H new ATOM 1733 N MET A 109 -7.920 -6.361 9.516 1.00 0.00 N ATOM 1734 CA MET A 109 -8.259 -7.514 8.701 1.00 0.00 C ATOM 1735 C MET A 109 -8.876 -8.619 9.557 1.00 0.00 C ATOM 1736 O MET A 109 -9.403 -9.594 9.028 1.00 0.00 O ATOM 1737 CB MET A 109 -7.010 -8.035 7.980 1.00 0.00 C ATOM 1738 CG MET A 109 -7.175 -9.425 7.381 1.00 0.00 C ATOM 1739 SD MET A 109 -6.722 -10.736 8.533 1.00 0.00 S ATOM 1740 CE MET A 109 -5.202 -11.327 7.793 1.00 0.00 C ATOM 0 H MET A 109 -6.922 -6.250 9.693 1.00 0.00 H new ATOM 0 HA MET A 109 -8.994 -7.207 7.957 1.00 0.00 H new ATOM 0 HB2 MET A 109 -6.744 -7.338 7.186 1.00 0.00 H new ATOM 0 HB3 MET A 109 -6.177 -8.050 8.683 1.00 0.00 H new ATOM 0 HG2 MET A 109 -8.211 -9.562 7.070 1.00 0.00 H new ATOM 0 HG3 MET A 109 -6.560 -9.506 6.485 1.00 0.00 H new ATOM 0 HE1 MET A 109 -4.798 -12.143 8.393 1.00 0.00 H new ATOM 0 HE2 MET A 109 -5.404 -11.685 6.783 1.00 0.00 H new ATOM 0 HE3 MET A 109 -4.477 -10.514 7.752 1.00 0.00 H new ATOM 1750 N SER A 110 -8.806 -8.473 10.880 1.00 0.00 N ATOM 1751 CA SER A 110 -9.369 -9.475 11.779 1.00 0.00 C ATOM 1752 C SER A 110 -10.756 -9.061 12.258 1.00 0.00 C ATOM 1753 O SER A 110 -11.551 -9.902 12.681 1.00 0.00 O ATOM 1754 CB SER A 110 -8.445 -9.701 12.976 1.00 0.00 C ATOM 1755 OG SER A 110 -8.538 -8.632 13.902 1.00 0.00 O ATOM 0 H SER A 110 -8.369 -7.679 11.348 1.00 0.00 H new ATOM 0 HA SER A 110 -9.462 -10.409 11.225 1.00 0.00 H new ATOM 0 HB2 SER A 110 -8.706 -10.637 13.469 1.00 0.00 H new ATOM 0 HB3 SER A 110 -7.416 -9.799 12.631 1.00 0.00 H new ATOM 0 HG SER A 110 -8.545 -7.780 13.418 1.00 0.00 H new ATOM 1761 N VAL A 111 -11.050 -7.767 12.185 1.00 0.00 N ATOM 1762 CA VAL A 111 -12.348 -7.259 12.608 1.00 0.00 C ATOM 1763 C VAL A 111 -13.402 -7.475 11.524 1.00 0.00 C ATOM 1764 O VAL A 111 -14.601 -7.401 11.791 1.00 0.00 O ATOM 1765 CB VAL A 111 -12.283 -5.759 12.962 1.00 0.00 C ATOM 1766 CG1 VAL A 111 -11.944 -4.925 11.733 1.00 0.00 C ATOM 1767 CG2 VAL A 111 -13.595 -5.302 13.581 1.00 0.00 C ATOM 0 H VAL A 111 -10.409 -7.054 11.838 1.00 0.00 H new ATOM 0 HA VAL A 111 -12.630 -7.818 13.501 1.00 0.00 H new ATOM 0 HB VAL A 111 -11.489 -5.614 13.694 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -11.904 -3.871 12.008 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -10.976 -5.234 11.339 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -12.709 -5.072 10.971 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -13.532 -4.241 13.825 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -14.407 -5.464 12.873 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -13.787 -5.873 14.490 1.00 0.00 H new ATOM 1777 N HIS A 112 -12.951 -7.742 10.299 1.00 0.00 N ATOM 1778 CA HIS A 112 -13.857 -7.965 9.188 1.00 0.00 C ATOM 1779 C HIS A 112 -14.470 -9.361 9.260 1.00 0.00 C ATOM 1780 O HIS A 112 -15.563 -9.596 8.744 1.00 0.00 O ATOM 1781 CB HIS A 112 -13.108 -7.779 7.869 1.00 0.00 C ATOM 1782 CG HIS A 112 -12.409 -9.012 7.389 1.00 0.00 C ATOM 1783 ND1 HIS A 112 -11.694 -9.853 8.214 1.00 0.00 N ATOM 1784 CD2 HIS A 112 -12.333 -9.547 6.158 1.00 0.00 C ATOM 1785 CE1 HIS A 112 -11.211 -10.856 7.503 1.00 0.00 C ATOM 1786 NE2 HIS A 112 -11.586 -10.694 6.250 1.00 0.00 N ATOM 0 H HIS A 112 -11.962 -7.808 10.057 1.00 0.00 H new ATOM 0 HA HIS A 112 -14.667 -7.238 9.245 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -13.813 -7.453 7.105 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -12.375 -6.981 7.988 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -12.779 -9.146 5.260 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -10.611 -11.670 7.883 1.00 0.00 H new ATOM 0 HE2 HIS A 112 -11.358 -11.318 5.476 1.00 0.00 H new ATOM 1795 N ARG A 113 -13.755 -10.287 9.896 1.00 0.00 N ATOM 1796 CA ARG A 113 -14.233 -11.657 10.022 1.00 0.00 C ATOM 1797 C ARG A 113 -15.452 -11.726 10.935 1.00 0.00 C ATOM 1798 O ARG A 113 -16.367 -12.518 10.708 1.00 0.00 O ATOM 1799 CB ARG A 113 -13.122 -12.559 10.564 1.00 0.00 C ATOM 1800 CG ARG A 113 -13.117 -13.950 9.951 1.00 0.00 C ATOM 1801 CD ARG A 113 -11.700 -14.471 9.764 1.00 0.00 C ATOM 1802 NE ARG A 113 -11.683 -15.828 9.223 1.00 0.00 N ATOM 1803 CZ ARG A 113 -10.620 -16.382 8.646 1.00 0.00 C ATOM 1804 NH1 ARG A 113 -9.487 -15.700 8.530 1.00 0.00 N ATOM 1805 NH2 ARG A 113 -10.690 -17.623 8.181 1.00 0.00 N ATOM 0 H ARG A 113 -12.848 -10.113 10.329 1.00 0.00 H new ATOM 0 HA ARG A 113 -14.524 -12.007 9.032 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -12.158 -12.086 10.379 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -13.231 -12.647 11.645 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -13.676 -14.633 10.591 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -13.627 -13.926 8.988 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -11.155 -13.807 9.094 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -11.179 -14.456 10.721 1.00 0.00 H new ATOM 0 HE ARG A 113 -12.536 -16.383 9.292 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -9.428 -14.745 8.884 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -8.676 -16.131 8.087 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -11.558 -18.151 8.266 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -9.875 -18.048 7.738 1.00 0.00 H new