USER MOD reduce.3.24.130724 H: found=0, std=0, add=940, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 940 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 57 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 50 THR OG1 : rot -150:sc= 0.822 USER MOD Set 2.2: A 54 SER OG : rot 160:sc= 0.918 USER MOD Single : A 19 TYR OH : rot 180:sc= -0.764 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 HIS : no HD1:sc= -3.81! C(o=-3.8!,f=-7!) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 91:sc= -0.482 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 CYS SG : rot 54:sc= -0.33 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 CYS SG : rot -102:sc= 0.305 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 GLN : amide:sc= -0.552 K(o=-0.55,f=-1.4) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot 124:sc= 0.147 USER MOD Single : A 97 ASN : amide:sc= -0.263 K(o=-0.26,f=-3.3!) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 81:sc= 0.896 USER MOD Single : A 112 THR OG1 : rot -65:sc= -1.14 USER MOD Single : A 115 SER OG : rot 180:sc= 0.178 USER MOD Single : A 118 GLN : amide:sc= -0.0057 X(o=-0.0057,f=0) USER MOD Single : A 119 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 GLN : amide:sc= -2.03! K(o=-2!,f=-0.9) USER MOD Single : A 129 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0103) USER MOD Single : A 131 HIS : no HD1:sc=-0.00224 X(o=-0.0022,f=-0.32) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 225 N PRO A 17 -3.274 5.621 2.615 1.00 0.00 N ATOM 226 CA PRO A 17 -4.699 5.449 2.840 1.00 0.00 C ATOM 227 C PRO A 17 -5.494 6.598 2.217 1.00 0.00 C ATOM 228 O PRO A 17 -5.417 7.735 2.681 1.00 0.00 O ATOM 229 CB PRO A 17 -4.852 5.371 4.350 1.00 0.00 C ATOM 230 CG PRO A 17 -3.578 5.965 4.930 1.00 0.00 C ATOM 231 CD PRO A 17 -2.556 6.060 3.808 1.00 0.00 C ATOM 0 HA PRO A 17 -5.095 4.551 2.366 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -5.729 5.927 4.683 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -4.986 4.340 4.676 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -3.774 6.950 5.352 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -3.200 5.341 5.739 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -2.186 7.079 3.695 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -1.691 5.427 4.005 1.00 0.00 H new ATOM 239 N LEU A 18 -6.241 6.262 1.175 1.00 0.00 N ATOM 240 CA LEU A 18 -7.049 7.252 0.484 1.00 0.00 C ATOM 241 C LEU A 18 -7.994 7.921 1.484 1.00 0.00 C ATOM 242 O LEU A 18 -8.606 7.248 2.312 1.00 0.00 O ATOM 243 CB LEU A 18 -7.767 6.618 -0.710 1.00 0.00 C ATOM 244 CG LEU A 18 -8.835 7.480 -1.386 1.00 0.00 C ATOM 245 CD1 LEU A 18 -10.050 7.663 -0.474 1.00 0.00 C ATOM 246 CD2 LEU A 18 -8.252 8.820 -1.839 1.00 0.00 C ATOM 0 H LEU A 18 -6.303 5.318 0.793 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.417 8.036 0.068 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -7.020 6.349 -1.457 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -8.234 5.691 -0.377 1.00 0.00 H new ATOM 0 HG LEU A 18 -9.179 6.959 -2.280 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -10.794 8.279 -0.978 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -10.482 6.689 -0.243 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -9.741 8.151 0.450 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -9.032 9.413 -2.316 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -7.864 9.359 -0.975 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -7.444 8.644 -2.549 1.00 0.00 H new ATOM 258 N TYR A 19 -8.082 9.239 1.375 1.00 0.00 N ATOM 259 CA TYR A 19 -8.941 10.007 2.260 1.00 0.00 C ATOM 260 C TYR A 19 -10.091 10.652 1.483 1.00 0.00 C ATOM 261 O TYR A 19 -11.151 10.921 2.046 1.00 0.00 O ATOM 262 CB TYR A 19 -8.060 11.109 2.851 1.00 0.00 C ATOM 263 CG TYR A 19 -6.930 10.590 3.743 1.00 0.00 C ATOM 264 CD1 TYR A 19 -7.088 9.410 4.440 1.00 0.00 C ATOM 265 CD2 TYR A 19 -5.753 11.303 3.850 1.00 0.00 C ATOM 266 CE1 TYR A 19 -6.024 8.922 5.279 1.00 0.00 C ATOM 267 CE2 TYR A 19 -4.689 10.815 4.689 1.00 0.00 C ATOM 268 CZ TYR A 19 -4.877 9.648 5.362 1.00 0.00 C ATOM 269 OH TYR A 19 -3.873 9.187 6.155 1.00 0.00 O ATOM 0 H TYR A 19 -7.573 9.794 0.687 1.00 0.00 H new ATOM 0 HA TYR A 19 -9.377 9.365 3.025 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -7.628 11.691 2.037 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -8.685 11.788 3.431 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -8.009 8.852 4.357 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -5.630 12.227 3.304 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -6.135 8.000 5.830 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -3.763 11.363 4.782 1.00 0.00 H new ATOM 0 HH TYR A 19 -3.115 9.807 6.116 1.00 0.00 H new ATOM 279 N PHE A 20 -9.842 10.881 0.202 1.00 0.00 N ATOM 280 CA PHE A 20 -10.844 11.490 -0.657 1.00 0.00 C ATOM 281 C PHE A 20 -10.354 11.560 -2.105 1.00 0.00 C ATOM 282 O PHE A 20 -9.170 11.777 -2.354 1.00 0.00 O ATOM 283 CB PHE A 20 -11.073 12.911 -0.140 1.00 0.00 C ATOM 284 CG PHE A 20 -12.218 13.649 -0.836 1.00 0.00 C ATOM 285 CD1 PHE A 20 -13.324 12.966 -1.237 1.00 0.00 C ATOM 286 CD2 PHE A 20 -12.131 14.989 -1.053 1.00 0.00 C ATOM 287 CE1 PHE A 20 -14.387 13.651 -1.883 1.00 0.00 C ATOM 288 CE2 PHE A 20 -13.194 15.674 -1.699 1.00 0.00 C ATOM 289 CZ PHE A 20 -14.300 14.991 -2.100 1.00 0.00 C ATOM 0 H PHE A 20 -8.962 10.656 -0.262 1.00 0.00 H new ATOM 0 HA PHE A 20 -11.759 10.898 -0.639 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -11.279 12.869 0.930 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -10.155 13.485 -0.266 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -13.394 11.902 -1.064 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -11.254 15.532 -0.734 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -15.264 13.108 -2.202 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -13.124 16.738 -1.872 1.00 0.00 H new ATOM 0 HZ PHE A 20 -15.109 15.512 -2.590 1.00 0.00 H new ATOM 299 N GLU A 21 -11.291 11.370 -3.022 1.00 0.00 N ATOM 300 CA GLU A 21 -10.970 11.409 -4.439 1.00 0.00 C ATOM 301 C GLU A 21 -12.115 12.050 -5.226 1.00 0.00 C ATOM 302 O GLU A 21 -13.286 11.804 -4.937 1.00 0.00 O ATOM 303 CB GLU A 21 -10.658 10.008 -4.969 1.00 0.00 C ATOM 304 CG GLU A 21 -11.841 9.063 -4.750 1.00 0.00 C ATOM 305 CD GLU A 21 -11.715 8.327 -3.414 1.00 0.00 C ATOM 306 OE1 GLU A 21 -11.044 7.272 -3.408 1.00 0.00 O ATOM 307 OE2 GLU A 21 -12.291 8.836 -2.429 1.00 0.00 O ATOM 0 H GLU A 21 -12.272 11.189 -2.812 1.00 0.00 H new ATOM 0 HA GLU A 21 -10.077 12.020 -4.572 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.423 10.061 -6.032 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -9.775 9.613 -4.466 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -12.772 9.629 -4.771 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.889 8.340 -5.564 1.00 0.00 H new ATOM 314 N GLY A 22 -11.738 12.860 -6.204 1.00 0.00 N ATOM 315 CA GLY A 22 -12.719 13.538 -7.034 1.00 0.00 C ATOM 316 C GLY A 22 -12.040 14.507 -8.005 1.00 0.00 C ATOM 317 O GLY A 22 -11.277 15.376 -7.587 1.00 0.00 O ATOM 0 H GLY A 22 -10.767 13.062 -6.440 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -13.298 12.803 -7.593 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -13.421 14.083 -6.402 1.00 0.00 H new ATOM 321 N PHE A 23 -12.343 14.324 -9.282 1.00 0.00 N ATOM 322 CA PHE A 23 -11.771 15.171 -10.315 1.00 0.00 C ATOM 323 C PHE A 23 -11.655 16.619 -9.835 1.00 0.00 C ATOM 324 O PHE A 23 -12.632 17.366 -9.862 1.00 0.00 O ATOM 325 CB PHE A 23 -12.722 15.118 -11.513 1.00 0.00 C ATOM 326 CG PHE A 23 -12.506 13.908 -12.425 1.00 0.00 C ATOM 327 CD1 PHE A 23 -11.251 13.577 -12.829 1.00 0.00 C ATOM 328 CD2 PHE A 23 -13.570 13.166 -12.832 1.00 0.00 C ATOM 329 CE1 PHE A 23 -11.051 12.455 -13.676 1.00 0.00 C ATOM 330 CE2 PHE A 23 -13.370 12.043 -13.679 1.00 0.00 C ATOM 331 CZ PHE A 23 -12.115 11.712 -14.083 1.00 0.00 C ATOM 0 H PHE A 23 -12.977 13.602 -9.625 1.00 0.00 H new ATOM 0 HA PHE A 23 -10.771 14.821 -10.572 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -13.749 15.107 -11.148 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -12.602 16.029 -12.100 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -10.406 14.167 -12.506 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -14.567 13.430 -12.512 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -10.054 12.192 -13.997 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -14.215 11.453 -14.002 1.00 0.00 H new ATOM 0 HZ PHE A 23 -11.963 10.859 -14.727 1.00 0.00 H new ATOM 341 N LEU A 24 -10.452 16.972 -9.406 1.00 0.00 N ATOM 342 CA LEU A 24 -10.195 18.317 -8.921 1.00 0.00 C ATOM 343 C LEU A 24 -9.495 19.124 -10.015 1.00 0.00 C ATOM 344 O LEU A 24 -8.763 18.566 -10.831 1.00 0.00 O ATOM 345 CB LEU A 24 -9.424 18.272 -7.600 1.00 0.00 C ATOM 346 CG LEU A 24 -9.367 19.582 -6.812 1.00 0.00 C ATOM 347 CD1 LEU A 24 -10.752 19.968 -6.290 1.00 0.00 C ATOM 348 CD2 LEU A 24 -8.332 19.500 -5.688 1.00 0.00 C ATOM 0 H LEU A 24 -9.644 16.349 -9.384 1.00 0.00 H new ATOM 0 HA LEU A 24 -11.132 18.828 -8.699 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -9.874 17.509 -6.965 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -8.403 17.952 -7.809 1.00 0.00 H new ATOM 0 HG LEU A 24 -9.046 20.375 -7.488 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -10.684 20.903 -5.733 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.435 20.095 -7.130 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -11.126 19.182 -5.634 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -8.311 20.444 -5.143 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -8.599 18.693 -5.006 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -7.348 19.305 -6.113 1.00 0.00 H new ATOM 360 N LEU A 25 -9.743 20.426 -9.997 1.00 0.00 N ATOM 361 CA LEU A 25 -9.145 21.315 -10.978 1.00 0.00 C ATOM 362 C LEU A 25 -7.969 22.056 -10.338 1.00 0.00 C ATOM 363 O LEU A 25 -8.127 22.703 -9.304 1.00 0.00 O ATOM 364 CB LEU A 25 -10.205 22.244 -11.575 1.00 0.00 C ATOM 365 CG LEU A 25 -11.142 21.615 -12.609 1.00 0.00 C ATOM 366 CD1 LEU A 25 -12.542 22.224 -12.522 1.00 0.00 C ATOM 367 CD2 LEU A 25 -10.555 21.724 -14.018 1.00 0.00 C ATOM 0 H LEU A 25 -10.350 20.886 -9.318 1.00 0.00 H new ATOM 0 HA LEU A 25 -8.745 20.744 -11.816 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -10.810 22.643 -10.761 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -9.698 23.090 -12.040 1.00 0.00 H new ATOM 0 HG LEU A 25 -11.239 20.553 -12.382 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -13.188 21.760 -13.267 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -12.953 22.051 -11.527 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -12.485 23.296 -12.709 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -11.240 21.270 -14.734 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -10.409 22.774 -14.271 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -9.597 21.206 -14.054 1.00 0.00 H new ATOM 379 N ILE A 26 -6.816 21.936 -10.980 1.00 0.00 N ATOM 380 CA ILE A 26 -5.614 22.586 -10.487 1.00 0.00 C ATOM 381 C ILE A 26 -5.193 23.683 -11.468 1.00 0.00 C ATOM 382 O ILE A 26 -5.227 23.482 -12.681 1.00 0.00 O ATOM 383 CB ILE A 26 -4.520 21.552 -10.214 1.00 0.00 C ATOM 384 CG1 ILE A 26 -5.086 20.336 -9.479 1.00 0.00 C ATOM 385 CG2 ILE A 26 -3.346 22.182 -9.461 1.00 0.00 C ATOM 386 CD1 ILE A 26 -5.504 20.701 -8.054 1.00 0.00 C ATOM 0 H ILE A 26 -6.689 21.398 -11.837 1.00 0.00 H new ATOM 0 HA ILE A 26 -5.808 23.071 -9.530 1.00 0.00 H new ATOM 0 HB ILE A 26 -4.137 21.199 -11.171 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -5.945 19.944 -10.024 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -4.338 19.544 -9.450 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -2.582 21.426 -9.279 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -2.922 22.990 -10.058 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -3.696 22.580 -8.509 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -5.903 19.818 -7.554 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -4.638 21.069 -7.504 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -6.270 21.476 -8.087 1.00 0.00 H new ATOM 398 N LYS A 27 -4.807 24.819 -10.905 1.00 0.00 N ATOM 399 CA LYS A 27 -4.380 25.947 -11.715 1.00 0.00 C ATOM 400 C LYS A 27 -3.186 26.628 -11.044 1.00 0.00 C ATOM 401 O LYS A 27 -3.273 27.787 -10.641 1.00 0.00 O ATOM 402 CB LYS A 27 -5.555 26.890 -11.982 1.00 0.00 C ATOM 403 CG LYS A 27 -5.216 27.890 -13.089 1.00 0.00 C ATOM 404 CD LYS A 27 -5.579 29.316 -12.670 1.00 0.00 C ATOM 405 CE LYS A 27 -6.776 29.833 -13.471 1.00 0.00 C ATOM 406 NZ LYS A 27 -6.487 31.174 -14.027 1.00 0.00 N ATOM 0 H LYS A 27 -4.781 24.982 -9.898 1.00 0.00 H new ATOM 0 HA LYS A 27 -4.045 25.607 -12.695 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -6.433 26.311 -12.267 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -5.810 27.427 -11.068 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -4.152 27.835 -13.320 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -5.754 27.626 -13.999 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -5.812 29.338 -11.605 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -4.723 29.973 -12.823 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -7.007 29.140 -14.280 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -7.657 29.880 -12.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -7.309 31.510 -14.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -6.289 31.837 -13.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -5.659 31.119 -14.654 1.00 0.00 H new ATOM 522 N TYR A 34 -7.634 26.166 -15.555 1.00 0.00 N ATOM 523 CA TYR A 34 -7.930 25.006 -14.732 1.00 0.00 C ATOM 524 C TYR A 34 -7.996 23.734 -15.579 1.00 0.00 C ATOM 525 O TYR A 34 -8.714 23.685 -16.577 1.00 0.00 O ATOM 526 CB TYR A 34 -9.307 25.266 -14.117 1.00 0.00 C ATOM 527 CG TYR A 34 -9.294 26.276 -12.968 1.00 0.00 C ATOM 528 CD1 TYR A 34 -8.741 25.930 -11.751 1.00 0.00 C ATOM 529 CD2 TYR A 34 -9.836 27.532 -13.147 1.00 0.00 C ATOM 530 CE1 TYR A 34 -8.729 26.881 -10.670 1.00 0.00 C ATOM 531 CE2 TYR A 34 -9.825 28.483 -12.066 1.00 0.00 C ATOM 532 CZ TYR A 34 -9.272 28.110 -10.880 1.00 0.00 C ATOM 533 OH TYR A 34 -9.261 29.008 -9.859 1.00 0.00 O ATOM 0 HA TYR A 34 -7.155 24.863 -13.979 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -9.979 25.626 -14.896 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -9.715 24.323 -13.754 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -8.318 24.946 -11.610 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -10.269 27.802 -14.099 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -8.298 26.624 -9.714 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -10.246 29.469 -12.194 1.00 0.00 H new ATOM 0 HH TYR A 34 -9.681 29.843 -10.153 1.00 0.00 H new ATOM 543 N GLU A 35 -7.236 22.736 -15.152 1.00 0.00 N ATOM 544 CA GLU A 35 -7.199 21.467 -15.859 1.00 0.00 C ATOM 545 C GLU A 35 -8.019 20.417 -15.108 1.00 0.00 C ATOM 546 O GLU A 35 -8.126 20.467 -13.884 1.00 0.00 O ATOM 547 CB GLU A 35 -5.758 20.996 -16.063 1.00 0.00 C ATOM 548 CG GLU A 35 -4.985 21.965 -16.960 1.00 0.00 C ATOM 549 CD GLU A 35 -5.430 21.836 -18.418 1.00 0.00 C ATOM 550 OE1 GLU A 35 -5.278 20.721 -18.961 1.00 0.00 O ATOM 551 OE2 GLU A 35 -5.913 22.856 -18.956 1.00 0.00 O ATOM 0 H GLU A 35 -6.641 22.781 -14.325 1.00 0.00 H new ATOM 0 HA GLU A 35 -7.643 21.608 -16.844 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -5.259 20.912 -15.097 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -5.757 20.002 -16.510 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -5.142 22.988 -16.617 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -3.917 21.764 -16.883 1.00 0.00 H new ATOM 558 N HIS A 36 -8.576 19.489 -15.873 1.00 0.00 N ATOM 559 CA HIS A 36 -9.383 18.428 -15.295 1.00 0.00 C ATOM 560 C HIS A 36 -8.527 17.173 -15.115 1.00 0.00 C ATOM 561 O HIS A 36 -8.246 16.465 -16.080 1.00 0.00 O ATOM 562 CB HIS A 36 -10.635 18.177 -16.138 1.00 0.00 C ATOM 563 CG HIS A 36 -11.538 17.098 -15.591 1.00 0.00 C ATOM 564 ND1 HIS A 36 -11.647 15.846 -16.170 1.00 0.00 N ATOM 565 CD2 HIS A 36 -12.372 17.097 -14.511 1.00 0.00 C ATOM 566 CE1 HIS A 36 -12.511 15.132 -15.463 1.00 0.00 C ATOM 567 NE2 HIS A 36 -12.959 15.909 -14.436 1.00 0.00 N ATOM 0 H HIS A 36 -8.484 19.450 -16.888 1.00 0.00 H new ATOM 0 HA HIS A 36 -9.735 18.730 -14.309 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -11.201 19.105 -16.215 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -10.331 17.904 -17.149 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -12.528 17.923 -13.832 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -12.808 14.113 -15.665 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -13.634 15.624 -13.727 1.00 0.00 H new ATOM 575 N TYR A 37 -8.138 16.935 -13.871 1.00 0.00 N ATOM 576 CA TYR A 37 -7.320 15.777 -13.552 1.00 0.00 C ATOM 577 C TYR A 37 -7.907 14.999 -12.372 1.00 0.00 C ATOM 578 O TYR A 37 -8.521 15.585 -11.482 1.00 0.00 O ATOM 579 CB TYR A 37 -5.949 16.327 -13.152 1.00 0.00 C ATOM 580 CG TYR A 37 -5.102 16.804 -14.334 1.00 0.00 C ATOM 581 CD1 TYR A 37 -4.621 15.892 -15.251 1.00 0.00 C ATOM 582 CD2 TYR A 37 -4.818 18.146 -14.482 1.00 0.00 C ATOM 583 CE1 TYR A 37 -3.824 16.341 -16.363 1.00 0.00 C ATOM 584 CE2 TYR A 37 -4.021 18.596 -15.594 1.00 0.00 C ATOM 585 CZ TYR A 37 -3.563 17.671 -16.479 1.00 0.00 C ATOM 586 OH TYR A 37 -2.810 18.095 -17.529 1.00 0.00 O ATOM 0 H TYR A 37 -8.374 17.524 -13.072 1.00 0.00 H new ATOM 0 HA TYR A 37 -7.267 15.098 -14.403 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -6.090 17.157 -12.460 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -5.401 15.553 -12.614 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -4.842 14.841 -15.135 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -5.194 18.860 -13.764 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -3.442 15.638 -17.088 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -3.792 19.644 -15.722 1.00 0.00 H new ATOM 0 HH TYR A 37 -2.706 19.068 -17.485 1.00 0.00 H new ATOM 596 N TRP A 38 -7.699 13.691 -12.405 1.00 0.00 N ATOM 597 CA TRP A 38 -8.200 12.827 -11.349 1.00 0.00 C ATOM 598 C TRP A 38 -7.344 13.058 -10.103 1.00 0.00 C ATOM 599 O TRP A 38 -6.324 12.396 -9.915 1.00 0.00 O ATOM 600 CB TRP A 38 -8.218 11.365 -11.800 1.00 0.00 C ATOM 601 CG TRP A 38 -8.666 10.385 -10.715 1.00 0.00 C ATOM 602 CD1 TRP A 38 -7.921 9.485 -10.057 1.00 0.00 C ATOM 603 CD2 TRP A 38 -10.000 10.241 -10.183 1.00 0.00 C ATOM 604 NE1 TRP A 38 -8.674 8.775 -9.145 1.00 0.00 N ATOM 605 CE2 TRP A 38 -9.978 9.249 -9.224 1.00 0.00 C ATOM 606 CE3 TRP A 38 -11.185 10.926 -10.502 1.00 0.00 C ATOM 607 CZ2 TRP A 38 -11.113 8.853 -8.506 1.00 0.00 C ATOM 608 CZ3 TRP A 38 -12.310 10.518 -9.776 1.00 0.00 C ATOM 609 CH2 TRP A 38 -12.305 9.522 -8.807 1.00 0.00 C ATOM 0 H TRP A 38 -7.191 13.208 -13.146 1.00 0.00 H new ATOM 0 HA TRP A 38 -9.235 13.071 -11.110 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -8.882 11.269 -12.659 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -7.219 11.087 -12.136 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -6.864 9.335 -10.221 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -8.336 8.038 -8.526 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -11.224 11.706 -11.248 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -11.071 8.073 -7.760 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -13.248 11.012 -9.983 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -13.217 9.265 -8.288 1.00 0.00 H new ATOM 620 N THR A 39 -7.790 13.999 -9.283 1.00 0.00 N ATOM 621 CA THR A 39 -7.077 14.325 -8.060 1.00 0.00 C ATOM 622 C THR A 39 -7.495 13.380 -6.931 1.00 0.00 C ATOM 623 O THR A 39 -8.678 13.085 -6.770 1.00 0.00 O ATOM 624 CB THR A 39 -7.332 15.800 -7.743 1.00 0.00 C ATOM 625 OG1 THR A 39 -6.936 16.483 -8.929 1.00 0.00 O ATOM 626 CG2 THR A 39 -6.387 16.340 -6.668 1.00 0.00 C ATOM 0 H THR A 39 -8.636 14.546 -9.442 1.00 0.00 H new ATOM 0 HA THR A 39 -6.003 14.184 -8.179 1.00 0.00 H new ATOM 0 HB THR A 39 -8.364 15.928 -7.416 1.00 0.00 H new ATOM 0 HG1 THR A 39 -7.707 16.575 -9.526 1.00 0.00 H new ATOM 0 HG21 THR A 39 -6.611 17.390 -6.481 1.00 0.00 H new ATOM 0 HG22 THR A 39 -6.520 15.771 -5.748 1.00 0.00 H new ATOM 0 HG23 THR A 39 -5.356 16.244 -7.008 1.00 0.00 H new ATOM 634 N GLU A 40 -6.500 12.931 -6.180 1.00 0.00 N ATOM 635 CA GLU A 40 -6.749 12.025 -5.071 1.00 0.00 C ATOM 636 C GLU A 40 -5.986 12.486 -3.828 1.00 0.00 C ATOM 637 O GLU A 40 -4.803 12.816 -3.908 1.00 0.00 O ATOM 638 CB GLU A 40 -6.376 10.589 -5.443 1.00 0.00 C ATOM 639 CG GLU A 40 -7.412 9.981 -6.391 1.00 0.00 C ATOM 640 CD GLU A 40 -7.313 8.454 -6.404 1.00 0.00 C ATOM 641 OE1 GLU A 40 -7.761 7.848 -5.407 1.00 0.00 O ATOM 642 OE2 GLU A 40 -6.793 7.928 -7.412 1.00 0.00 O ATOM 0 H GLU A 40 -5.520 13.178 -6.318 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.815 12.041 -4.845 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -5.394 10.575 -5.915 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -6.304 9.983 -4.540 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -8.413 10.282 -6.082 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.259 10.368 -7.399 1.00 0.00 H new ATOM 649 N LEU A 41 -6.693 12.494 -2.708 1.00 0.00 N ATOM 650 CA LEU A 41 -6.097 12.909 -1.449 1.00 0.00 C ATOM 651 C LEU A 41 -5.511 11.686 -0.740 1.00 0.00 C ATOM 652 O LEU A 41 -6.242 10.771 -0.366 1.00 0.00 O ATOM 653 CB LEU A 41 -7.112 13.681 -0.604 1.00 0.00 C ATOM 654 CG LEU A 41 -6.529 14.670 0.407 1.00 0.00 C ATOM 655 CD1 LEU A 41 -7.613 15.192 1.352 1.00 0.00 C ATOM 656 CD2 LEU A 41 -5.356 14.048 1.168 1.00 0.00 C ATOM 0 H LEU A 41 -7.673 12.220 -2.646 1.00 0.00 H new ATOM 0 HA LEU A 41 -5.274 13.601 -1.627 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -7.774 14.227 -1.276 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -7.728 12.961 -0.065 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.139 15.528 -0.141 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.171 15.893 2.060 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.386 15.698 0.774 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.055 14.357 1.896 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.960 14.772 1.880 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.698 13.162 1.703 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.573 13.767 0.463 1.00 0.00 H new ATOM 668 N ARG A 42 -4.196 11.711 -0.576 1.00 0.00 N ATOM 669 CA ARG A 42 -3.503 10.616 0.081 1.00 0.00 C ATOM 670 C ARG A 42 -2.489 11.159 1.089 1.00 0.00 C ATOM 671 O ARG A 42 -1.650 11.990 0.745 1.00 0.00 O ATOM 672 CB ARG A 42 -2.778 9.733 -0.936 1.00 0.00 C ATOM 673 CG ARG A 42 -3.727 8.691 -1.533 1.00 0.00 C ATOM 674 CD ARG A 42 -2.946 7.529 -2.152 1.00 0.00 C ATOM 675 NE ARG A 42 -3.444 7.256 -3.518 1.00 0.00 N ATOM 676 CZ ARG A 42 -3.256 6.100 -4.169 1.00 0.00 C ATOM 677 NH1 ARG A 42 -2.579 5.103 -3.582 1.00 0.00 N ATOM 678 NH2 ARG A 42 -3.743 5.941 -5.407 1.00 0.00 N ATOM 0 H ARG A 42 -3.593 12.472 -0.887 1.00 0.00 H new ATOM 0 HA ARG A 42 -4.250 10.015 0.599 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -2.365 10.353 -1.732 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -1.938 9.232 -0.455 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -4.393 8.314 -0.757 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -4.354 9.158 -2.292 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -1.884 7.771 -2.185 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -3.051 6.638 -1.533 1.00 0.00 H new ATOM 0 HE ARG A 42 -3.963 7.994 -3.994 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -2.207 5.224 -2.640 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -2.436 4.223 -4.077 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -4.257 6.700 -5.854 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -3.600 5.061 -5.902 1.00 0.00 H new ATOM 692 N GLY A 43 -2.599 10.667 2.315 1.00 0.00 N ATOM 693 CA GLY A 43 -1.702 11.092 3.375 1.00 0.00 C ATOM 694 C GLY A 43 -1.739 12.612 3.549 1.00 0.00 C ATOM 695 O GLY A 43 -2.688 13.153 4.114 1.00 0.00 O ATOM 0 H GLY A 43 -3.296 9.978 2.597 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -1.984 10.608 4.310 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -0.685 10.773 3.145 1.00 0.00 H new ATOM 699 N THR A 44 -0.695 13.258 3.051 1.00 0.00 N ATOM 700 CA THR A 44 -0.597 14.705 3.144 1.00 0.00 C ATOM 701 C THR A 44 -0.062 15.288 1.834 1.00 0.00 C ATOM 702 O THR A 44 0.353 16.445 1.789 1.00 0.00 O ATOM 703 CB THR A 44 0.270 15.043 4.358 1.00 0.00 C ATOM 704 OG1 THR A 44 1.299 14.057 4.336 1.00 0.00 O ATOM 705 CG2 THR A 44 -0.455 14.796 5.682 1.00 0.00 C ATOM 0 H THR A 44 0.090 12.806 2.582 1.00 0.00 H new ATOM 0 HA THR A 44 -1.577 15.160 3.290 1.00 0.00 H new ATOM 0 HB THR A 44 0.580 16.087 4.303 1.00 0.00 H new ATOM 0 HG1 THR A 44 1.908 14.203 5.090 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.205 15.052 6.511 1.00 0.00 H new ATOM 0 HG22 THR A 44 -1.351 15.415 5.727 1.00 0.00 H new ATOM 0 HG23 THR A 44 -0.736 13.745 5.753 1.00 0.00 H new ATOM 713 N THR A 45 -0.089 14.460 0.800 1.00 0.00 N ATOM 714 CA THR A 45 0.388 14.879 -0.507 1.00 0.00 C ATOM 715 C THR A 45 -0.706 14.690 -1.559 1.00 0.00 C ATOM 716 O THR A 45 -1.243 13.594 -1.712 1.00 0.00 O ATOM 717 CB THR A 45 1.669 14.100 -0.815 1.00 0.00 C ATOM 718 OG1 THR A 45 2.691 14.832 -0.144 1.00 0.00 O ATOM 719 CG2 THR A 45 2.061 14.179 -2.292 1.00 0.00 C ATOM 0 H THR A 45 -0.434 13.501 0.841 1.00 0.00 H new ATOM 0 HA THR A 45 0.627 15.942 -0.519 1.00 0.00 H new ATOM 0 HB THR A 45 1.536 13.056 -0.530 1.00 0.00 H new ATOM 0 HG1 THR A 45 3.556 14.395 -0.290 1.00 0.00 H new ATOM 0 HG21 THR A 45 2.976 13.610 -2.457 1.00 0.00 H new ATOM 0 HG22 THR A 45 1.260 13.763 -2.904 1.00 0.00 H new ATOM 0 HG23 THR A 45 2.226 15.220 -2.569 1.00 0.00 H new ATOM 727 N LEU A 46 -1.004 15.776 -2.258 1.00 0.00 N ATOM 728 CA LEU A 46 -2.024 15.744 -3.292 1.00 0.00 C ATOM 729 C LEU A 46 -1.463 15.052 -4.535 1.00 0.00 C ATOM 730 O LEU A 46 -0.417 15.445 -5.049 1.00 0.00 O ATOM 731 CB LEU A 46 -2.559 17.152 -3.560 1.00 0.00 C ATOM 732 CG LEU A 46 -3.652 17.647 -2.611 1.00 0.00 C ATOM 733 CD1 LEU A 46 -3.906 19.144 -2.799 1.00 0.00 C ATOM 734 CD2 LEU A 46 -4.932 16.824 -2.771 1.00 0.00 C ATOM 0 H LEU A 46 -0.557 16.683 -2.128 1.00 0.00 H new ATOM 0 HA LEU A 46 -2.883 15.159 -2.962 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.724 17.851 -3.516 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.948 17.184 -4.578 1.00 0.00 H new ATOM 0 HG LEU A 46 -3.304 17.506 -1.588 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.687 19.470 -2.112 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -2.989 19.697 -2.594 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -4.223 19.333 -3.825 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -5.692 17.197 -2.085 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -5.294 16.910 -3.796 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -4.722 15.778 -2.547 1.00 0.00 H new ATOM 746 N PHE A 47 -2.183 14.034 -4.983 1.00 0.00 N ATOM 747 CA PHE A 47 -1.770 13.284 -6.156 1.00 0.00 C ATOM 748 C PHE A 47 -2.765 13.469 -7.304 1.00 0.00 C ATOM 749 O PHE A 47 -3.942 13.136 -7.170 1.00 0.00 O ATOM 750 CB PHE A 47 -1.741 11.807 -5.756 1.00 0.00 C ATOM 751 CG PHE A 47 -0.629 11.453 -4.766 1.00 0.00 C ATOM 752 CD1 PHE A 47 0.598 11.085 -5.224 1.00 0.00 C ATOM 753 CD2 PHE A 47 -0.867 11.506 -3.428 1.00 0.00 C ATOM 754 CE1 PHE A 47 1.629 10.757 -4.306 1.00 0.00 C ATOM 755 CE2 PHE A 47 0.165 11.178 -2.510 1.00 0.00 C ATOM 756 CZ PHE A 47 1.391 10.810 -2.968 1.00 0.00 C ATOM 0 H PHE A 47 -3.050 13.711 -4.554 1.00 0.00 H new ATOM 0 HA PHE A 47 -0.795 13.633 -6.496 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -2.703 11.541 -5.317 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -1.621 11.200 -6.654 1.00 0.00 H new ATOM 0 HD1 PHE A 47 0.787 11.043 -6.286 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -1.841 11.798 -3.064 1.00 0.00 H new ATOM 0 HE1 PHE A 47 2.603 10.465 -4.670 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -0.024 11.221 -1.448 1.00 0.00 H new ATOM 0 HZ PHE A 47 2.176 10.560 -2.269 1.00 0.00 H new ATOM 766 N PHE A 48 -2.256 13.999 -8.406 1.00 0.00 N ATOM 767 CA PHE A 48 -3.085 14.233 -9.576 1.00 0.00 C ATOM 768 C PHE A 48 -2.871 13.141 -10.627 1.00 0.00 C ATOM 769 O PHE A 48 -1.739 12.733 -10.881 1.00 0.00 O ATOM 770 CB PHE A 48 -2.660 15.580 -10.164 1.00 0.00 C ATOM 771 CG PHE A 48 -2.658 16.727 -9.152 1.00 0.00 C ATOM 772 CD1 PHE A 48 -3.812 17.085 -8.527 1.00 0.00 C ATOM 773 CD2 PHE A 48 -1.503 17.390 -8.878 1.00 0.00 C ATOM 774 CE1 PHE A 48 -3.810 18.150 -7.587 1.00 0.00 C ATOM 775 CE2 PHE A 48 -1.501 18.455 -7.939 1.00 0.00 C ATOM 776 CZ PHE A 48 -2.655 18.813 -7.313 1.00 0.00 C ATOM 0 H PHE A 48 -1.279 14.273 -8.514 1.00 0.00 H new ATOM 0 HA PHE A 48 -4.138 14.227 -9.293 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -1.661 15.481 -10.588 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -3.330 15.834 -10.985 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -4.730 16.559 -8.746 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -0.587 17.106 -9.375 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -4.726 18.433 -7.090 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -0.583 18.981 -7.721 1.00 0.00 H new ATOM 0 HZ PHE A 48 -2.653 19.623 -6.599 1.00 0.00 H new ATOM 786 N TYR A 49 -3.976 12.699 -11.209 1.00 0.00 N ATOM 787 CA TYR A 49 -3.924 11.663 -12.226 1.00 0.00 C ATOM 788 C TYR A 49 -4.729 12.067 -13.462 1.00 0.00 C ATOM 789 O TYR A 49 -5.504 13.021 -13.418 1.00 0.00 O ATOM 790 CB TYR A 49 -4.564 10.423 -11.598 1.00 0.00 C ATOM 791 CG TYR A 49 -3.698 9.748 -10.532 1.00 0.00 C ATOM 792 CD1 TYR A 49 -2.705 8.866 -10.908 1.00 0.00 C ATOM 793 CD2 TYR A 49 -3.910 10.021 -9.196 1.00 0.00 C ATOM 794 CE1 TYR A 49 -1.890 8.230 -9.905 1.00 0.00 C ATOM 795 CE2 TYR A 49 -3.095 9.385 -8.194 1.00 0.00 C ATOM 796 CZ TYR A 49 -2.125 8.521 -8.597 1.00 0.00 C ATOM 797 OH TYR A 49 -1.355 7.921 -7.650 1.00 0.00 O ATOM 0 H TYR A 49 -4.913 13.040 -10.995 1.00 0.00 H new ATOM 0 HA TYR A 49 -2.896 11.488 -12.543 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -5.517 10.705 -11.152 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -4.782 9.701 -12.385 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -2.539 8.653 -11.954 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -4.687 10.711 -8.902 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -1.110 7.538 -10.185 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -3.251 9.590 -7.145 1.00 0.00 H new ATOM 0 HH TYR A 49 -1.635 8.224 -6.761 1.00 0.00 H new ATOM 807 N THR A 50 -4.517 11.321 -14.537 1.00 0.00 N ATOM 808 CA THR A 50 -5.214 11.589 -15.783 1.00 0.00 C ATOM 809 C THR A 50 -6.436 10.679 -15.918 1.00 0.00 C ATOM 810 O THR A 50 -7.440 11.066 -16.513 1.00 0.00 O ATOM 811 CB THR A 50 -4.211 11.434 -16.928 1.00 0.00 C ATOM 812 OG1 THR A 50 -3.714 10.107 -16.776 1.00 0.00 O ATOM 813 CG2 THR A 50 -2.975 12.318 -16.748 1.00 0.00 C ATOM 0 H THR A 50 -3.872 10.531 -14.570 1.00 0.00 H new ATOM 0 HA THR A 50 -5.603 12.607 -15.807 1.00 0.00 H new ATOM 0 HB THR A 50 -4.697 11.679 -17.872 1.00 0.00 H new ATOM 0 HG1 THR A 50 -2.793 10.063 -17.107 1.00 0.00 H new ATOM 0 HG21 THR A 50 -2.296 12.169 -17.588 1.00 0.00 H new ATOM 0 HG22 THR A 50 -3.279 13.364 -16.708 1.00 0.00 H new ATOM 0 HG23 THR A 50 -2.469 12.051 -15.820 1.00 0.00 H new ATOM 821 N ASP A 51 -6.310 9.486 -15.356 1.00 0.00 N ATOM 822 CA ASP A 51 -7.392 8.517 -15.406 1.00 0.00 C ATOM 823 C ASP A 51 -7.199 7.486 -14.292 1.00 0.00 C ATOM 824 O ASP A 51 -6.192 7.510 -13.586 1.00 0.00 O ATOM 825 CB ASP A 51 -7.404 7.773 -16.742 1.00 0.00 C ATOM 826 CG ASP A 51 -7.872 8.602 -17.940 1.00 0.00 C ATOM 827 OD1 ASP A 51 -9.104 8.662 -18.142 1.00 0.00 O ATOM 828 OD2 ASP A 51 -6.987 9.158 -18.626 1.00 0.00 O ATOM 0 H ASP A 51 -5.475 9.168 -14.864 1.00 0.00 H new ATOM 0 HA ASP A 51 -8.332 9.055 -15.285 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -6.398 7.405 -16.945 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -8.050 6.900 -16.649 1.00 0.00 H new ATOM 833 N LYS A 52 -8.180 6.603 -14.170 1.00 0.00 N ATOM 834 CA LYS A 52 -8.131 5.565 -13.155 1.00 0.00 C ATOM 835 C LYS A 52 -7.228 4.428 -13.637 1.00 0.00 C ATOM 836 O LYS A 52 -6.719 3.650 -12.831 1.00 0.00 O ATOM 837 CB LYS A 52 -9.544 5.113 -12.782 1.00 0.00 C ATOM 838 CG LYS A 52 -10.350 4.748 -14.031 1.00 0.00 C ATOM 839 CD LYS A 52 -11.475 3.769 -13.691 1.00 0.00 C ATOM 840 CE LYS A 52 -11.817 2.888 -14.893 1.00 0.00 C ATOM 841 NZ LYS A 52 -12.445 1.623 -14.448 1.00 0.00 N ATOM 0 H LYS A 52 -9.013 6.586 -14.758 1.00 0.00 H new ATOM 0 HA LYS A 52 -7.692 5.952 -12.235 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -9.490 4.253 -12.115 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -10.052 5.908 -12.236 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -10.770 5.651 -14.474 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -9.690 4.305 -14.777 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -11.175 3.143 -12.850 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -12.360 4.322 -13.377 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -12.493 3.421 -15.561 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -10.913 2.671 -15.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -12.671 1.037 -15.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -11.787 1.108 -13.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -13.319 1.834 -13.925 1.00 0.00 H new ATOM 855 N LYS A 53 -7.056 4.368 -14.949 1.00 0.00 N ATOM 856 CA LYS A 53 -6.224 3.339 -15.549 1.00 0.00 C ATOM 857 C LYS A 53 -4.750 3.703 -15.352 1.00 0.00 C ATOM 858 O LYS A 53 -3.876 2.844 -15.459 1.00 0.00 O ATOM 859 CB LYS A 53 -6.613 3.119 -17.012 1.00 0.00 C ATOM 860 CG LYS A 53 -7.945 2.374 -17.119 1.00 0.00 C ATOM 861 CD LYS A 53 -7.768 0.887 -16.807 1.00 0.00 C ATOM 862 CE LYS A 53 -7.177 0.142 -18.005 1.00 0.00 C ATOM 863 NZ LYS A 53 -6.404 -1.037 -17.553 1.00 0.00 N ATOM 0 H LYS A 53 -7.479 5.016 -15.614 1.00 0.00 H new ATOM 0 HA LYS A 53 -6.386 2.382 -15.054 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -6.688 4.080 -17.521 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -5.833 2.551 -17.518 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -8.667 2.811 -16.428 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -8.352 2.493 -18.123 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -7.115 0.768 -15.942 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -8.731 0.450 -16.542 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -7.977 -0.175 -18.674 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -6.532 0.811 -18.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -6.010 -1.531 -18.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -5.629 -0.727 -16.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -7.029 -1.682 -17.030 1.00 0.00 H new ATOM 877 N SER A 54 -4.521 4.976 -15.069 1.00 0.00 N ATOM 878 CA SER A 54 -3.169 5.464 -14.856 1.00 0.00 C ATOM 879 C SER A 54 -2.667 5.032 -13.477 1.00 0.00 C ATOM 880 O SER A 54 -3.395 5.128 -12.490 1.00 0.00 O ATOM 881 CB SER A 54 -3.105 6.987 -14.991 1.00 0.00 C ATOM 882 OG SER A 54 -2.950 7.396 -16.347 1.00 0.00 O ATOM 0 H SER A 54 -5.249 5.685 -14.982 1.00 0.00 H new ATOM 0 HA SER A 54 -2.525 5.031 -15.622 1.00 0.00 H new ATOM 0 HB2 SER A 54 -4.015 7.426 -14.582 1.00 0.00 H new ATOM 0 HB3 SER A 54 -2.273 7.369 -14.400 1.00 0.00 H new ATOM 0 HG SER A 54 -3.227 8.331 -16.440 1.00 0.00 H new ATOM 888 N ILE A 55 -1.427 4.565 -13.453 1.00 0.00 N ATOM 889 CA ILE A 55 -0.820 4.118 -12.211 1.00 0.00 C ATOM 890 C ILE A 55 0.007 5.259 -11.613 1.00 0.00 C ATOM 891 O ILE A 55 -0.097 5.547 -10.422 1.00 0.00 O ATOM 892 CB ILE A 55 -0.022 2.833 -12.438 1.00 0.00 C ATOM 893 CG1 ILE A 55 -0.901 1.742 -13.052 1.00 0.00 C ATOM 894 CG2 ILE A 55 0.648 2.368 -11.143 1.00 0.00 C ATOM 895 CD1 ILE A 55 -1.888 1.189 -12.022 1.00 0.00 C ATOM 0 H ILE A 55 -0.826 4.487 -14.274 1.00 0.00 H new ATOM 0 HA ILE A 55 -1.588 3.864 -11.480 1.00 0.00 H new ATOM 0 HB ILE A 55 0.772 3.046 -13.153 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -1.447 2.147 -13.904 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -0.274 0.935 -13.430 1.00 0.00 H new ATOM 0 HG21 ILE A 55 1.209 1.453 -11.332 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.327 3.143 -10.786 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -0.114 2.177 -10.387 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -2.501 0.415 -12.484 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -1.338 0.763 -11.183 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -2.530 1.994 -11.664 1.00 0.00 H new ATOM 907 N ILE A 56 0.808 5.877 -12.468 1.00 0.00 N ATOM 908 CA ILE A 56 1.652 6.979 -12.039 1.00 0.00 C ATOM 909 C ILE A 56 0.876 8.291 -12.171 1.00 0.00 C ATOM 910 O ILE A 56 0.227 8.533 -13.187 1.00 0.00 O ATOM 911 CB ILE A 56 2.977 6.969 -12.805 1.00 0.00 C ATOM 912 CG1 ILE A 56 3.650 5.598 -12.718 1.00 0.00 C ATOM 913 CG2 ILE A 56 3.898 8.091 -12.322 1.00 0.00 C ATOM 914 CD1 ILE A 56 3.838 4.991 -14.110 1.00 0.00 C ATOM 0 H ILE A 56 0.890 5.636 -13.456 1.00 0.00 H new ATOM 0 HA ILE A 56 1.917 6.869 -10.987 1.00 0.00 H new ATOM 0 HB ILE A 56 2.765 7.157 -13.857 1.00 0.00 H new ATOM 0 HG12 ILE A 56 4.618 5.694 -12.226 1.00 0.00 H new ATOM 0 HG13 ILE A 56 3.045 4.930 -12.105 1.00 0.00 H new ATOM 0 HG21 ILE A 56 4.832 8.061 -12.882 1.00 0.00 H new ATOM 0 HG22 ILE A 56 3.411 9.054 -12.478 1.00 0.00 H new ATOM 0 HG23 ILE A 56 4.107 7.958 -11.261 1.00 0.00 H new ATOM 0 HD11 ILE A 56 4.318 4.017 -14.020 1.00 0.00 H new ATOM 0 HD12 ILE A 56 2.866 4.874 -14.590 1.00 0.00 H new ATOM 0 HD13 ILE A 56 4.463 5.650 -14.713 1.00 0.00 H new ATOM 926 N TYR A 57 0.969 9.103 -11.128 1.00 0.00 N ATOM 927 CA TYR A 57 0.283 10.384 -11.114 1.00 0.00 C ATOM 928 C TYR A 57 0.984 11.391 -12.028 1.00 0.00 C ATOM 929 O TYR A 57 2.200 11.560 -11.955 1.00 0.00 O ATOM 930 CB TYR A 57 0.357 10.887 -9.671 1.00 0.00 C ATOM 931 CG TYR A 57 1.783 11.029 -9.134 1.00 0.00 C ATOM 932 CD1 TYR A 57 2.482 12.202 -9.334 1.00 0.00 C ATOM 933 CD2 TYR A 57 2.370 9.984 -8.449 1.00 0.00 C ATOM 934 CE1 TYR A 57 3.824 12.336 -8.829 1.00 0.00 C ATOM 935 CE2 TYR A 57 3.712 10.118 -7.944 1.00 0.00 C ATOM 936 CZ TYR A 57 4.372 11.287 -8.159 1.00 0.00 C ATOM 937 OH TYR A 57 5.640 11.414 -7.682 1.00 0.00 O ATOM 0 H TYR A 57 1.509 8.899 -10.287 1.00 0.00 H new ATOM 0 HA TYR A 57 -0.743 10.274 -11.466 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -0.142 11.854 -9.608 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -0.195 10.201 -9.029 1.00 0.00 H new ATOM 0 HD1 TYR A 57 2.022 13.020 -9.869 1.00 0.00 H new ATOM 0 HD2 TYR A 57 1.823 9.066 -8.292 1.00 0.00 H new ATOM 0 HE1 TYR A 57 4.382 13.248 -8.979 1.00 0.00 H new ATOM 0 HE2 TYR A 57 4.183 9.308 -7.407 1.00 0.00 H new ATOM 0 HH TYR A 57 5.902 10.588 -7.224 1.00 0.00 H new ATOM 947 N VAL A 58 0.186 12.034 -12.869 1.00 0.00 N ATOM 948 CA VAL A 58 0.715 13.019 -13.797 1.00 0.00 C ATOM 949 C VAL A 58 1.536 14.052 -13.023 1.00 0.00 C ATOM 950 O VAL A 58 2.570 14.515 -13.504 1.00 0.00 O ATOM 951 CB VAL A 58 -0.426 13.644 -14.602 1.00 0.00 C ATOM 952 CG1 VAL A 58 -1.349 14.466 -13.699 1.00 0.00 C ATOM 953 CG2 VAL A 58 0.117 14.496 -15.752 1.00 0.00 C ATOM 0 H VAL A 58 -0.822 11.892 -12.927 1.00 0.00 H new ATOM 0 HA VAL A 58 1.383 12.546 -14.517 1.00 0.00 H new ATOM 0 HB VAL A 58 -1.014 12.834 -15.033 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -2.151 14.899 -14.296 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -1.776 13.821 -12.931 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -0.778 15.264 -13.225 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -0.714 14.929 -16.308 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.740 15.295 -15.350 1.00 0.00 H new ATOM 0 HG23 VAL A 58 0.713 13.872 -16.418 1.00 0.00 H new ATOM 963 N ASP A 59 1.046 14.384 -11.838 1.00 0.00 N ATOM 964 CA ASP A 59 1.722 15.354 -10.993 1.00 0.00 C ATOM 965 C ASP A 59 1.173 15.254 -9.569 1.00 0.00 C ATOM 966 O ASP A 59 0.055 14.783 -9.362 1.00 0.00 O ATOM 967 CB ASP A 59 1.484 16.780 -11.493 1.00 0.00 C ATOM 968 CG ASP A 59 2.642 17.751 -11.254 1.00 0.00 C ATOM 969 OD1 ASP A 59 2.747 18.238 -10.108 1.00 0.00 O ATOM 970 OD2 ASP A 59 3.396 17.984 -12.223 1.00 0.00 O ATOM 0 H ASP A 59 0.188 13.998 -11.443 1.00 0.00 H new ATOM 0 HA ASP A 59 2.790 15.137 -11.018 1.00 0.00 H new ATOM 0 HB2 ASP A 59 1.275 16.744 -12.562 1.00 0.00 H new ATOM 0 HB3 ASP A 59 0.592 17.175 -11.007 1.00 0.00 H new ATOM 975 N LYS A 60 1.984 15.704 -8.623 1.00 0.00 N ATOM 976 CA LYS A 60 1.593 15.672 -7.224 1.00 0.00 C ATOM 977 C LYS A 60 1.973 16.997 -6.561 1.00 0.00 C ATOM 978 O LYS A 60 2.757 17.768 -7.112 1.00 0.00 O ATOM 979 CB LYS A 60 2.187 14.445 -6.530 1.00 0.00 C ATOM 980 CG LYS A 60 3.684 14.631 -6.273 1.00 0.00 C ATOM 981 CD LYS A 60 4.179 13.670 -5.190 1.00 0.00 C ATOM 982 CE LYS A 60 5.594 14.034 -4.739 1.00 0.00 C ATOM 983 NZ LYS A 60 6.318 12.828 -4.278 1.00 0.00 N ATOM 0 H LYS A 60 2.911 16.093 -8.798 1.00 0.00 H new ATOM 0 HA LYS A 60 0.512 15.569 -7.134 1.00 0.00 H new ATOM 0 HB2 LYS A 60 1.671 14.272 -5.586 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.027 13.561 -7.147 1.00 0.00 H new ATOM 0 HG2 LYS A 60 4.239 14.461 -7.196 1.00 0.00 H new ATOM 0 HG3 LYS A 60 3.879 15.659 -5.968 1.00 0.00 H new ATOM 0 HD2 LYS A 60 3.502 13.699 -4.336 1.00 0.00 H new ATOM 0 HD3 LYS A 60 4.166 12.649 -5.571 1.00 0.00 H new ATOM 0 HE2 LYS A 60 6.136 14.498 -5.563 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.548 14.768 -3.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 7.277 13.093 -3.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 5.808 12.402 -3.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 6.378 12.141 -5.056 1.00 0.00 H new ATOM 997 N LEU A 61 1.399 17.222 -5.388 1.00 0.00 N ATOM 998 CA LEU A 61 1.668 18.441 -4.645 1.00 0.00 C ATOM 999 C LEU A 61 1.880 18.097 -3.169 1.00 0.00 C ATOM 1000 O LEU A 61 1.785 16.934 -2.779 1.00 0.00 O ATOM 1001 CB LEU A 61 0.560 19.469 -4.883 1.00 0.00 C ATOM 1002 CG LEU A 61 0.822 20.493 -5.990 1.00 0.00 C ATOM 1003 CD1 LEU A 61 -0.447 21.279 -6.322 1.00 0.00 C ATOM 1004 CD2 LEU A 61 1.987 21.414 -5.620 1.00 0.00 C ATOM 0 H LEU A 61 0.749 16.581 -4.934 1.00 0.00 H new ATOM 0 HA LEU A 61 2.587 18.908 -5.000 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -0.360 18.934 -5.120 1.00 0.00 H new ATOM 0 HB3 LEU A 61 0.385 20.007 -3.951 1.00 0.00 H new ATOM 0 HG LEU A 61 1.111 19.954 -6.892 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -0.233 21.999 -7.111 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -1.223 20.592 -6.659 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -0.791 21.807 -5.433 1.00 0.00 H new ATOM 0 HD21 LEU A 61 2.152 22.132 -6.423 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.751 21.947 -4.699 1.00 0.00 H new ATOM 0 HD23 LEU A 61 2.889 20.819 -5.474 1.00 0.00 H new ATOM 1016 N ASP A 62 2.163 19.129 -2.389 1.00 0.00 N ATOM 1017 CA ASP A 62 2.390 18.951 -0.965 1.00 0.00 C ATOM 1018 C ASP A 62 1.764 20.121 -0.203 1.00 0.00 C ATOM 1019 O ASP A 62 1.942 21.278 -0.579 1.00 0.00 O ATOM 1020 CB ASP A 62 3.885 18.924 -0.644 1.00 0.00 C ATOM 1021 CG ASP A 62 4.432 17.557 -0.227 1.00 0.00 C ATOM 1022 OD1 ASP A 62 4.009 17.081 0.849 1.00 0.00 O ATOM 1023 OD2 ASP A 62 5.261 17.020 -0.993 1.00 0.00 O ATOM 0 H ASP A 62 2.240 20.092 -2.716 1.00 0.00 H new ATOM 0 HA ASP A 62 1.941 18.003 -0.668 1.00 0.00 H new ATOM 0 HB2 ASP A 62 4.436 19.267 -1.520 1.00 0.00 H new ATOM 0 HB3 ASP A 62 4.082 19.637 0.156 1.00 0.00 H new ATOM 1028 N ILE A 63 1.044 19.779 0.856 1.00 0.00 N ATOM 1029 CA ILE A 63 0.390 20.786 1.674 1.00 0.00 C ATOM 1030 C ILE A 63 0.636 20.475 3.152 1.00 0.00 C ATOM 1031 O ILE A 63 -0.033 21.025 4.025 1.00 0.00 O ATOM 1032 CB ILE A 63 -1.091 20.897 1.306 1.00 0.00 C ATOM 1033 CG1 ILE A 63 -1.740 19.515 1.223 1.00 0.00 C ATOM 1034 CG2 ILE A 63 -1.277 21.697 0.015 1.00 0.00 C ATOM 1035 CD1 ILE A 63 -3.244 19.599 1.490 1.00 0.00 C ATOM 0 H ILE A 63 0.899 18.818 1.166 1.00 0.00 H new ATOM 0 HA ILE A 63 0.817 21.770 1.480 1.00 0.00 H new ATOM 0 HB ILE A 63 -1.600 21.444 2.099 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.566 19.086 0.236 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.275 18.847 1.948 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -2.339 21.761 -0.224 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.874 22.701 0.148 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.751 21.200 -0.800 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.681 18.603 1.425 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -3.414 20.006 2.487 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -3.709 20.249 0.749 1.00 0.00 H new ATOM 1047 N VAL A 64 1.596 19.593 3.386 1.00 0.00 N ATOM 1048 CA VAL A 64 1.938 19.201 4.743 1.00 0.00 C ATOM 1049 C VAL A 64 2.429 20.427 5.514 1.00 0.00 C ATOM 1050 O VAL A 64 2.241 20.519 6.726 1.00 0.00 O ATOM 1051 CB VAL A 64 2.959 18.062 4.717 1.00 0.00 C ATOM 1052 CG1 VAL A 64 4.204 18.459 3.921 1.00 0.00 C ATOM 1053 CG2 VAL A 64 3.331 17.627 6.136 1.00 0.00 C ATOM 0 H VAL A 64 2.148 19.138 2.659 1.00 0.00 H new ATOM 0 HA VAL A 64 1.060 18.820 5.264 1.00 0.00 H new ATOM 0 HB VAL A 64 2.498 17.211 4.215 1.00 0.00 H new ATOM 0 HG11 VAL A 64 4.913 17.631 3.918 1.00 0.00 H new ATOM 0 HG12 VAL A 64 3.920 18.697 2.896 1.00 0.00 H new ATOM 0 HG13 VAL A 64 4.667 19.332 4.381 1.00 0.00 H new ATOM 0 HG21 VAL A 64 4.058 16.816 6.089 1.00 0.00 H new ATOM 0 HG22 VAL A 64 3.763 18.471 6.674 1.00 0.00 H new ATOM 0 HG23 VAL A 64 2.437 17.283 6.657 1.00 0.00 H new ATOM 1063 N ASP A 65 3.051 21.339 4.780 1.00 0.00 N ATOM 1064 CA ASP A 65 3.571 22.555 5.381 1.00 0.00 C ATOM 1065 C ASP A 65 2.630 23.719 5.061 1.00 0.00 C ATOM 1066 O ASP A 65 2.976 24.879 5.280 1.00 0.00 O ATOM 1067 CB ASP A 65 4.953 22.898 4.822 1.00 0.00 C ATOM 1068 CG ASP A 65 6.066 23.000 5.867 1.00 0.00 C ATOM 1069 OD1 ASP A 65 5.714 23.078 7.064 1.00 0.00 O ATOM 1070 OD2 ASP A 65 7.243 22.997 5.446 1.00 0.00 O ATOM 0 H ASP A 65 3.206 21.260 3.775 1.00 0.00 H new ATOM 0 HA ASP A 65 3.646 22.394 6.456 1.00 0.00 H new ATOM 0 HB2 ASP A 65 5.231 22.140 4.090 1.00 0.00 H new ATOM 0 HB3 ASP A 65 4.888 23.847 4.289 1.00 0.00 H new ATOM 1075 N LEU A 66 1.460 23.369 4.548 1.00 0.00 N ATOM 1076 CA LEU A 66 0.467 24.369 4.196 1.00 0.00 C ATOM 1077 C LEU A 66 0.422 25.442 5.286 1.00 0.00 C ATOM 1078 O LEU A 66 0.267 25.128 6.465 1.00 0.00 O ATOM 1079 CB LEU A 66 -0.886 23.710 3.925 1.00 0.00 C ATOM 1080 CG LEU A 66 -2.061 24.661 3.689 1.00 0.00 C ATOM 1081 CD1 LEU A 66 -2.443 24.703 2.208 1.00 0.00 C ATOM 1082 CD2 LEU A 66 -3.251 24.294 4.577 1.00 0.00 C ATOM 0 H LEU A 66 1.177 22.406 4.368 1.00 0.00 H new ATOM 0 HA LEU A 66 0.742 24.869 3.267 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.785 23.065 3.052 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -1.130 23.066 4.770 1.00 0.00 H new ATOM 0 HG LEU A 66 -1.748 25.667 3.970 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -3.281 25.386 2.068 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -1.591 25.048 1.622 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.730 23.705 1.878 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.072 24.986 4.389 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -3.574 23.278 4.351 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.956 24.357 5.625 1.00 0.00 H new ATOM 1094 N THR A 67 0.560 26.687 4.853 1.00 0.00 N ATOM 1095 CA THR A 67 0.536 27.807 5.778 1.00 0.00 C ATOM 1096 C THR A 67 -0.900 28.117 6.204 1.00 0.00 C ATOM 1097 O THR A 67 -1.165 28.350 7.383 1.00 0.00 O ATOM 1098 CB THR A 67 1.239 28.989 5.106 1.00 0.00 C ATOM 1099 OG1 THR A 67 2.605 28.843 5.486 1.00 0.00 O ATOM 1100 CG2 THR A 67 0.827 30.334 5.708 1.00 0.00 C ATOM 0 H THR A 67 0.689 26.944 3.874 1.00 0.00 H new ATOM 0 HA THR A 67 1.070 27.572 6.698 1.00 0.00 H new ATOM 0 HB THR A 67 1.016 28.985 4.039 1.00 0.00 H new ATOM 0 HG1 THR A 67 3.134 29.568 5.092 1.00 0.00 H new ATOM 0 HG21 THR A 67 1.354 31.139 5.196 1.00 0.00 H new ATOM 0 HG22 THR A 67 -0.248 30.472 5.590 1.00 0.00 H new ATOM 0 HG23 THR A 67 1.081 30.351 6.768 1.00 0.00 H new ATOM 1108 N CYS A 68 -1.789 28.109 5.222 1.00 0.00 N ATOM 1109 CA CYS A 68 -3.192 28.387 5.481 1.00 0.00 C ATOM 1110 C CYS A 68 -3.955 28.280 4.159 1.00 0.00 C ATOM 1111 O CYS A 68 -3.368 27.973 3.123 1.00 0.00 O ATOM 1112 CB CYS A 68 -3.386 29.752 6.143 1.00 0.00 C ATOM 1113 SG CYS A 68 -3.641 29.545 7.943 1.00 0.00 S ATOM 0 H CYS A 68 -1.566 27.915 4.246 1.00 0.00 H new ATOM 0 HA CYS A 68 -3.586 27.656 6.187 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -2.514 30.381 5.961 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -4.243 30.260 5.702 1.00 0.00 H new ATOM 0 HG CYS A 68 -2.669 28.839 8.441 1.00 0.00 H new ATOM 1119 N LEU A 69 -5.252 28.538 4.239 1.00 0.00 N ATOM 1120 CA LEU A 69 -6.101 28.474 3.061 1.00 0.00 C ATOM 1121 C LEU A 69 -7.034 29.687 3.045 1.00 0.00 C ATOM 1122 O LEU A 69 -7.752 29.936 4.012 1.00 0.00 O ATOM 1123 CB LEU A 69 -6.835 27.133 3.002 1.00 0.00 C ATOM 1124 CG LEU A 69 -7.788 26.942 1.820 1.00 0.00 C ATOM 1125 CD1 LEU A 69 -7.529 25.607 1.117 1.00 0.00 C ATOM 1126 CD2 LEU A 69 -9.245 27.083 2.262 1.00 0.00 C ATOM 0 H LEU A 69 -5.736 28.792 5.100 1.00 0.00 H new ATOM 0 HA LEU A 69 -5.499 28.522 2.154 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.092 26.336 2.977 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.403 27.011 3.924 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.594 27.732 1.094 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.219 25.496 0.281 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -6.504 25.584 0.747 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.679 24.789 1.822 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.901 26.943 1.403 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -9.471 26.330 3.017 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.404 28.077 2.681 1.00 0.00 H new ATOM 1138 N THR A 70 -6.994 30.409 1.935 1.00 0.00 N ATOM 1139 CA THR A 70 -7.826 31.590 1.779 1.00 0.00 C ATOM 1140 C THR A 70 -9.075 31.257 0.960 1.00 0.00 C ATOM 1141 O THR A 70 -9.371 30.088 0.719 1.00 0.00 O ATOM 1142 CB THR A 70 -6.969 32.695 1.160 1.00 0.00 C ATOM 1143 OG1 THR A 70 -6.862 32.324 -0.212 1.00 0.00 O ATOM 1144 CG2 THR A 70 -5.525 32.670 1.667 1.00 0.00 C ATOM 0 H THR A 70 -6.398 30.199 1.134 1.00 0.00 H new ATOM 0 HA THR A 70 -8.192 31.946 2.742 1.00 0.00 H new ATOM 0 HB THR A 70 -7.414 33.665 1.380 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.323 32.988 -0.689 1.00 0.00 H new ATOM 0 HG21 THR A 70 -4.960 33.475 1.196 1.00 0.00 H new ATOM 0 HG22 THR A 70 -5.517 32.805 2.749 1.00 0.00 H new ATOM 0 HG23 THR A 70 -5.068 31.712 1.418 1.00 0.00 H new ATOM 1152 N GLU A 71 -9.773 32.307 0.553 1.00 0.00 N ATOM 1153 CA GLU A 71 -10.983 32.142 -0.235 1.00 0.00 C ATOM 1154 C GLU A 71 -10.931 33.030 -1.480 1.00 0.00 C ATOM 1155 O GLU A 71 -10.130 33.961 -1.550 1.00 0.00 O ATOM 1156 CB GLU A 71 -12.227 32.444 0.601 1.00 0.00 C ATOM 1157 CG GLU A 71 -12.814 31.161 1.194 1.00 0.00 C ATOM 1158 CD GLU A 71 -14.299 31.335 1.519 1.00 0.00 C ATOM 1159 OE1 GLU A 71 -14.661 32.457 1.935 1.00 0.00 O ATOM 1160 OE2 GLU A 71 -15.039 30.343 1.344 1.00 0.00 O ATOM 0 H GLU A 71 -9.524 33.275 0.754 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.045 31.102 -0.556 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -11.971 33.136 1.403 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.975 32.938 -0.019 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.686 30.339 0.489 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.269 30.892 2.099 1.00 0.00 H new ATOM 1274 N CYS A 79 -20.261 28.463 -5.279 1.00 0.00 N ATOM 1275 CA CYS A 79 -19.179 27.508 -5.447 1.00 0.00 C ATOM 1276 C CYS A 79 -18.131 27.774 -4.365 1.00 0.00 C ATOM 1277 O CYS A 79 -18.293 28.680 -3.548 1.00 0.00 O ATOM 1278 CB CYS A 79 -18.578 27.575 -6.852 1.00 0.00 C ATOM 1279 SG CYS A 79 -19.376 26.334 -7.934 1.00 0.00 S ATOM 0 HA CYS A 79 -19.565 26.495 -5.336 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -18.715 28.573 -7.268 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -17.504 27.393 -6.806 1.00 0.00 H new ATOM 0 HG CYS A 79 -18.591 25.307 -8.069 1.00 0.00 H new ATOM 1285 N ALA A 80 -17.078 26.970 -4.394 1.00 0.00 N ATOM 1286 CA ALA A 80 -16.004 27.108 -3.426 1.00 0.00 C ATOM 1287 C ALA A 80 -14.676 27.283 -4.165 1.00 0.00 C ATOM 1288 O ALA A 80 -14.279 26.421 -4.949 1.00 0.00 O ATOM 1289 CB ALA A 80 -15.997 25.894 -2.495 1.00 0.00 C ATOM 0 H ALA A 80 -16.946 26.221 -5.073 1.00 0.00 H new ATOM 0 HA ALA A 80 -16.156 27.993 -2.808 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -15.191 25.997 -1.768 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -16.951 25.831 -1.972 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -15.844 24.987 -3.080 1.00 0.00 H new ATOM 1295 N LYS A 81 -14.026 28.404 -3.891 1.00 0.00 N ATOM 1296 CA LYS A 81 -12.751 28.703 -4.520 1.00 0.00 C ATOM 1297 C LYS A 81 -11.767 29.200 -3.459 1.00 0.00 C ATOM 1298 O LYS A 81 -11.973 30.254 -2.860 1.00 0.00 O ATOM 1299 CB LYS A 81 -12.944 29.678 -5.684 1.00 0.00 C ATOM 1300 CG LYS A 81 -13.664 29.002 -6.852 1.00 0.00 C ATOM 1301 CD LYS A 81 -14.266 30.041 -7.800 1.00 0.00 C ATOM 1302 CE LYS A 81 -13.307 30.356 -8.949 1.00 0.00 C ATOM 1303 NZ LYS A 81 -14.061 30.679 -10.180 1.00 0.00 N ATOM 0 H LYS A 81 -14.359 29.117 -3.241 1.00 0.00 H new ATOM 0 HA LYS A 81 -12.321 27.801 -4.956 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -13.519 30.541 -5.348 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.975 30.050 -6.016 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.964 28.369 -7.398 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -14.452 28.352 -6.471 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -15.209 29.670 -8.200 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -14.491 30.954 -7.249 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -12.667 31.195 -8.677 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -12.653 29.502 -9.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -13.395 30.890 -10.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -14.653 29.867 -10.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -14.666 31.507 -10.009 1.00 0.00 H new ATOM 1317 N PHE A 82 -10.717 28.416 -3.258 1.00 0.00 N ATOM 1318 CA PHE A 82 -9.701 28.762 -2.279 1.00 0.00 C ATOM 1319 C PHE A 82 -8.302 28.430 -2.801 1.00 0.00 C ATOM 1320 O PHE A 82 -8.140 27.534 -3.629 1.00 0.00 O ATOM 1321 CB PHE A 82 -9.979 27.925 -1.030 1.00 0.00 C ATOM 1322 CG PHE A 82 -10.285 26.454 -1.322 1.00 0.00 C ATOM 1323 CD1 PHE A 82 -9.279 25.605 -1.663 1.00 0.00 C ATOM 1324 CD2 PHE A 82 -11.563 25.996 -1.240 1.00 0.00 C ATOM 1325 CE1 PHE A 82 -9.563 24.240 -1.935 1.00 0.00 C ATOM 1326 CE2 PHE A 82 -11.847 24.632 -1.511 1.00 0.00 C ATOM 1327 CZ PHE A 82 -10.841 23.782 -1.853 1.00 0.00 C ATOM 0 H PHE A 82 -10.549 27.542 -3.757 1.00 0.00 H new ATOM 0 HA PHE A 82 -9.737 29.831 -2.068 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -9.115 27.981 -0.368 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -10.821 28.361 -0.493 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -8.264 25.969 -1.727 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -12.362 26.670 -0.969 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -8.764 23.566 -2.207 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -12.862 24.269 -1.446 1.00 0.00 H new ATOM 0 HZ PHE A 82 -11.057 22.744 -2.059 1.00 0.00 H new ATOM 1337 N THR A 83 -7.325 29.169 -2.295 1.00 0.00 N ATOM 1338 CA THR A 83 -5.945 28.963 -2.700 1.00 0.00 C ATOM 1339 C THR A 83 -5.142 28.337 -1.558 1.00 0.00 C ATOM 1340 O THR A 83 -5.390 28.626 -0.389 1.00 0.00 O ATOM 1341 CB THR A 83 -5.385 30.307 -3.170 1.00 0.00 C ATOM 1342 OG1 THR A 83 -5.907 30.459 -4.488 1.00 0.00 O ATOM 1343 CG2 THR A 83 -3.869 30.272 -3.372 1.00 0.00 C ATOM 0 H THR A 83 -7.462 29.911 -1.608 1.00 0.00 H new ATOM 0 HA THR A 83 -5.877 28.258 -3.528 1.00 0.00 H new ATOM 0 HB THR A 83 -5.636 31.079 -2.442 1.00 0.00 H new ATOM 0 HG1 THR A 83 -5.595 31.307 -4.868 1.00 0.00 H new ATOM 0 HG21 THR A 83 -3.524 31.251 -3.706 1.00 0.00 H new ATOM 0 HG22 THR A 83 -3.382 30.017 -2.431 1.00 0.00 H new ATOM 0 HG23 THR A 83 -3.619 29.524 -4.124 1.00 0.00 H new ATOM 1351 N LEU A 84 -4.196 27.491 -1.938 1.00 0.00 N ATOM 1352 CA LEU A 84 -3.355 26.821 -0.960 1.00 0.00 C ATOM 1353 C LEU A 84 -2.089 27.649 -0.730 1.00 0.00 C ATOM 1354 O LEU A 84 -1.286 27.830 -1.645 1.00 0.00 O ATOM 1355 CB LEU A 84 -3.077 25.380 -1.390 1.00 0.00 C ATOM 1356 CG LEU A 84 -4.287 24.444 -1.422 1.00 0.00 C ATOM 1357 CD1 LEU A 84 -4.678 24.006 -0.009 1.00 0.00 C ATOM 1358 CD2 LEU A 84 -5.458 25.087 -2.167 1.00 0.00 C ATOM 0 H LEU A 84 -3.993 27.254 -2.909 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.869 26.750 -0.001 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.630 25.398 -2.384 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.333 24.957 -0.714 1.00 0.00 H new ATOM 0 HG LEU A 84 -4.010 23.545 -1.973 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.541 23.341 -0.060 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.842 23.481 0.454 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -4.930 24.883 0.587 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -6.305 24.401 -2.175 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -5.745 26.011 -1.666 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -5.160 25.308 -3.192 1.00 0.00 H new ATOM 1370 N VAL A 85 -1.949 28.130 0.497 1.00 0.00 N ATOM 1371 CA VAL A 85 -0.795 28.935 0.858 1.00 0.00 C ATOM 1372 C VAL A 85 0.295 28.026 1.431 1.00 0.00 C ATOM 1373 O VAL A 85 0.070 27.326 2.417 1.00 0.00 O ATOM 1374 CB VAL A 85 -1.213 30.047 1.822 1.00 0.00 C ATOM 1375 CG1 VAL A 85 -0.049 31.002 2.096 1.00 0.00 C ATOM 1376 CG2 VAL A 85 -2.430 30.805 1.289 1.00 0.00 C ATOM 0 H VAL A 85 -2.616 27.977 1.253 1.00 0.00 H new ATOM 0 HA VAL A 85 -0.381 29.426 -0.023 1.00 0.00 H new ATOM 0 HB VAL A 85 -1.495 29.583 2.767 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -0.373 31.783 2.784 1.00 0.00 H new ATOM 0 HG12 VAL A 85 0.779 30.449 2.539 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.277 31.456 1.160 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -2.707 31.590 1.993 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.187 31.251 0.325 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -3.265 30.115 1.169 1.00 0.00 H new ATOM 1386 N LEU A 86 1.453 28.067 0.788 1.00 0.00 N ATOM 1387 CA LEU A 86 2.578 27.257 1.221 1.00 0.00 C ATOM 1388 C LEU A 86 3.787 28.161 1.470 1.00 0.00 C ATOM 1389 O LEU A 86 3.859 29.268 0.938 1.00 0.00 O ATOM 1390 CB LEU A 86 2.847 26.134 0.217 1.00 0.00 C ATOM 1391 CG LEU A 86 1.612 25.431 -0.350 1.00 0.00 C ATOM 1392 CD1 LEU A 86 1.861 24.956 -1.783 1.00 0.00 C ATOM 1393 CD2 LEU A 86 1.164 24.288 0.563 1.00 0.00 C ATOM 0 H LEU A 86 1.636 28.649 -0.030 1.00 0.00 H new ATOM 0 HA LEU A 86 2.350 26.762 2.165 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.420 26.546 -0.614 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.477 25.386 0.699 1.00 0.00 H new ATOM 0 HG LEU A 86 0.796 26.152 -0.387 1.00 0.00 H new ATOM 0 HD11 LEU A 86 0.968 24.460 -2.162 1.00 0.00 H new ATOM 0 HD12 LEU A 86 2.096 25.813 -2.415 1.00 0.00 H new ATOM 0 HD13 LEU A 86 2.697 24.257 -1.794 1.00 0.00 H new ATOM 0 HD21 LEU A 86 0.285 23.805 0.137 1.00 0.00 H new ATOM 0 HD22 LEU A 86 1.969 23.559 0.655 1.00 0.00 H new ATOM 0 HD23 LEU A 86 0.919 24.684 1.548 1.00 0.00 H new ATOM 1405 N PRO A 87 4.731 27.643 2.301 1.00 0.00 N ATOM 1406 CA PRO A 87 5.933 28.392 2.628 1.00 0.00 C ATOM 1407 C PRO A 87 6.915 28.390 1.455 1.00 0.00 C ATOM 1408 O PRO A 87 7.995 28.972 1.544 1.00 0.00 O ATOM 1409 CB PRO A 87 6.490 27.718 3.870 1.00 0.00 C ATOM 1410 CG PRO A 87 5.846 26.342 3.924 1.00 0.00 C ATOM 1411 CD PRO A 87 4.679 26.337 2.950 1.00 0.00 C ATOM 0 HA PRO A 87 5.734 29.446 2.819 1.00 0.00 H new ATOM 0 HB2 PRO A 87 7.576 27.639 3.817 1.00 0.00 H new ATOM 0 HB3 PRO A 87 6.255 28.294 4.765 1.00 0.00 H new ATOM 0 HG2 PRO A 87 6.569 25.571 3.658 1.00 0.00 H new ATOM 0 HG3 PRO A 87 5.501 26.121 4.934 1.00 0.00 H new ATOM 0 HD2 PRO A 87 4.773 25.530 2.223 1.00 0.00 H new ATOM 0 HD3 PRO A 87 3.731 26.190 3.468 1.00 0.00 H new ATOM 1419 N LYS A 88 6.505 27.730 0.382 1.00 0.00 N ATOM 1420 CA LYS A 88 7.335 27.645 -0.808 1.00 0.00 C ATOM 1421 C LYS A 88 6.649 28.384 -1.958 1.00 0.00 C ATOM 1422 O LYS A 88 7.230 29.290 -2.553 1.00 0.00 O ATOM 1423 CB LYS A 88 7.667 26.185 -1.126 1.00 0.00 C ATOM 1424 CG LYS A 88 8.614 25.597 -0.077 1.00 0.00 C ATOM 1425 CD LYS A 88 9.766 24.841 -0.742 1.00 0.00 C ATOM 1426 CE LYS A 88 9.764 23.367 -0.330 1.00 0.00 C ATOM 1427 NZ LYS A 88 11.149 22.854 -0.238 1.00 0.00 N ATOM 0 H LYS A 88 5.608 27.249 0.312 1.00 0.00 H new ATOM 0 HA LYS A 88 8.293 28.137 -0.640 1.00 0.00 H new ATOM 0 HB2 LYS A 88 6.749 25.599 -1.161 1.00 0.00 H new ATOM 0 HB3 LYS A 88 8.125 26.119 -2.113 1.00 0.00 H new ATOM 0 HG2 LYS A 88 9.012 26.396 0.548 1.00 0.00 H new ATOM 0 HG3 LYS A 88 8.063 24.923 0.579 1.00 0.00 H new ATOM 0 HD2 LYS A 88 9.680 24.920 -1.826 1.00 0.00 H new ATOM 0 HD3 LYS A 88 10.715 25.299 -0.464 1.00 0.00 H new ATOM 0 HE2 LYS A 88 9.263 23.252 0.631 1.00 0.00 H new ATOM 0 HE3 LYS A 88 9.200 22.781 -1.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 11.130 21.853 0.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 11.615 22.946 -1.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 11.676 23.402 0.471 1.00 0.00 H new ATOM 1441 N GLU A 89 5.422 27.970 -2.237 1.00 0.00 N ATOM 1442 CA GLU A 89 4.650 28.582 -3.305 1.00 0.00 C ATOM 1443 C GLU A 89 3.160 28.289 -3.118 1.00 0.00 C ATOM 1444 O GLU A 89 2.791 27.243 -2.585 1.00 0.00 O ATOM 1445 CB GLU A 89 5.135 28.104 -4.675 1.00 0.00 C ATOM 1446 CG GLU A 89 3.982 28.054 -5.679 1.00 0.00 C ATOM 1447 CD GLU A 89 4.473 27.609 -7.058 1.00 0.00 C ATOM 1448 OE1 GLU A 89 4.954 26.459 -7.144 1.00 0.00 O ATOM 1449 OE2 GLU A 89 4.357 28.430 -7.993 1.00 0.00 O ATOM 0 H GLU A 89 4.943 27.218 -1.742 1.00 0.00 H new ATOM 0 HA GLU A 89 4.796 29.661 -3.260 1.00 0.00 H new ATOM 0 HB2 GLU A 89 5.913 28.773 -5.043 1.00 0.00 H new ATOM 0 HB3 GLU A 89 5.583 27.115 -4.581 1.00 0.00 H new ATOM 0 HG2 GLU A 89 3.215 27.366 -5.323 1.00 0.00 H new ATOM 0 HG3 GLU A 89 3.518 29.037 -5.754 1.00 0.00 H new ATOM 1456 N GLU A 90 2.343 29.230 -3.568 1.00 0.00 N ATOM 1457 CA GLU A 90 0.902 29.086 -3.457 1.00 0.00 C ATOM 1458 C GLU A 90 0.344 28.368 -4.687 1.00 0.00 C ATOM 1459 O GLU A 90 0.946 28.405 -5.759 1.00 0.00 O ATOM 1460 CB GLU A 90 0.228 30.446 -3.264 1.00 0.00 C ATOM 1461 CG GLU A 90 0.933 31.258 -2.175 1.00 0.00 C ATOM 1462 CD GLU A 90 1.336 32.639 -2.696 1.00 0.00 C ATOM 1463 OE1 GLU A 90 1.841 32.690 -3.838 1.00 0.00 O ATOM 1464 OE2 GLU A 90 1.129 33.613 -1.940 1.00 0.00 O ATOM 0 H GLU A 90 2.652 30.096 -4.010 1.00 0.00 H new ATOM 0 HA GLU A 90 0.684 28.481 -2.577 1.00 0.00 H new ATOM 0 HB2 GLU A 90 0.243 31.000 -4.203 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -0.819 30.302 -2.995 1.00 0.00 H new ATOM 0 HG2 GLU A 90 0.274 31.368 -1.314 1.00 0.00 H new ATOM 0 HG3 GLU A 90 1.818 30.722 -1.832 1.00 0.00 H new ATOM 1471 N VAL A 91 -0.801 27.730 -4.492 1.00 0.00 N ATOM 1472 CA VAL A 91 -1.446 27.003 -5.572 1.00 0.00 C ATOM 1473 C VAL A 91 -2.945 27.310 -5.562 1.00 0.00 C ATOM 1474 O VAL A 91 -3.497 27.697 -4.533 1.00 0.00 O ATOM 1475 CB VAL A 91 -1.141 25.509 -5.454 1.00 0.00 C ATOM 1476 CG1 VAL A 91 -2.053 24.689 -6.369 1.00 0.00 C ATOM 1477 CG2 VAL A 91 0.333 25.225 -5.750 1.00 0.00 C ATOM 0 H VAL A 91 -1.298 27.702 -3.602 1.00 0.00 H new ATOM 0 HA VAL A 91 -1.054 27.325 -6.537 1.00 0.00 H new ATOM 0 HB VAL A 91 -1.340 25.207 -4.426 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.815 23.630 -6.266 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.093 24.856 -6.090 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -1.901 24.996 -7.404 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.523 24.156 -5.659 1.00 0.00 H new ATOM 0 HG22 VAL A 91 0.570 25.551 -6.763 1.00 0.00 H new ATOM 0 HG23 VAL A 91 0.958 25.766 -5.039 1.00 0.00 H new ATOM 1487 N GLN A 92 -3.562 27.125 -6.720 1.00 0.00 N ATOM 1488 CA GLN A 92 -4.987 27.377 -6.858 1.00 0.00 C ATOM 1489 C GLN A 92 -5.762 26.058 -6.854 1.00 0.00 C ATOM 1490 O GLN A 92 -5.296 25.059 -7.399 1.00 0.00 O ATOM 1491 CB GLN A 92 -5.281 28.183 -8.125 1.00 0.00 C ATOM 1492 CG GLN A 92 -4.760 29.615 -7.997 1.00 0.00 C ATOM 1493 CD GLN A 92 -4.998 30.402 -9.288 1.00 0.00 C ATOM 1494 OE1 GLN A 92 -4.188 30.409 -10.199 1.00 0.00 O ATOM 1495 NE2 GLN A 92 -6.153 31.063 -9.313 1.00 0.00 N ATOM 0 H GLN A 92 -3.101 26.804 -7.571 1.00 0.00 H new ATOM 0 HA GLN A 92 -5.316 27.971 -6.005 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -4.817 27.699 -8.984 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -6.355 28.198 -8.310 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -5.258 30.114 -7.166 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -3.695 29.599 -7.768 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -6.786 31.014 -8.515 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -6.405 31.619 -10.130 1.00 0.00 H new ATOM 1504 N LEU A 93 -6.931 26.098 -6.233 1.00 0.00 N ATOM 1505 CA LEU A 93 -7.776 24.918 -6.151 1.00 0.00 C ATOM 1506 C LEU A 93 -9.212 25.298 -6.514 1.00 0.00 C ATOM 1507 O LEU A 93 -9.768 26.244 -5.958 1.00 0.00 O ATOM 1508 CB LEU A 93 -7.643 24.259 -4.776 1.00 0.00 C ATOM 1509 CG LEU A 93 -6.919 22.911 -4.746 1.00 0.00 C ATOM 1510 CD1 LEU A 93 -5.410 23.103 -4.585 1.00 0.00 C ATOM 1511 CD2 LEU A 93 -7.500 22.001 -3.662 1.00 0.00 C ATOM 0 H LEU A 93 -7.314 26.929 -5.782 1.00 0.00 H new ATOM 0 HA LEU A 93 -7.453 24.167 -6.872 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -7.116 24.947 -4.115 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -8.642 24.122 -4.363 1.00 0.00 H new ATOM 0 HG LEU A 93 -7.080 22.415 -5.703 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -4.919 22.130 -4.567 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -5.026 23.687 -5.421 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -5.208 23.629 -3.652 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -6.968 21.050 -3.662 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -7.390 22.479 -2.688 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -8.557 21.825 -3.862 1.00 0.00 H new ATOM 1523 N LYS A 94 -9.773 24.540 -7.445 1.00 0.00 N ATOM 1524 CA LYS A 94 -11.135 24.786 -7.890 1.00 0.00 C ATOM 1525 C LYS A 94 -11.839 23.448 -8.126 1.00 0.00 C ATOM 1526 O LYS A 94 -11.225 22.496 -8.606 1.00 0.00 O ATOM 1527 CB LYS A 94 -11.142 25.709 -9.110 1.00 0.00 C ATOM 1528 CG LYS A 94 -12.568 26.125 -9.474 1.00 0.00 C ATOM 1529 CD LYS A 94 -12.634 26.665 -10.904 1.00 0.00 C ATOM 1530 CE LYS A 94 -13.652 25.886 -11.738 1.00 0.00 C ATOM 1531 NZ LYS A 94 -14.134 26.709 -12.870 1.00 0.00 N ATOM 0 H LYS A 94 -9.310 23.755 -7.903 1.00 0.00 H new ATOM 0 HA LYS A 94 -11.699 25.312 -7.119 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.542 26.595 -8.903 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -10.680 25.202 -9.957 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -13.237 25.270 -9.373 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.917 26.887 -8.777 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -12.905 27.721 -10.886 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -11.650 26.597 -11.368 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -13.197 24.970 -12.115 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -14.494 25.590 -11.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -14.824 26.165 -13.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -14.586 27.571 -12.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -13.330 26.970 -13.476 1.00 0.00 H new ATOM 1545 N THR A 95 -13.117 23.418 -7.778 1.00 0.00 N ATOM 1546 CA THR A 95 -13.910 22.213 -7.946 1.00 0.00 C ATOM 1547 C THR A 95 -15.082 22.474 -8.895 1.00 0.00 C ATOM 1548 O THR A 95 -15.051 23.421 -9.680 1.00 0.00 O ATOM 1549 CB THR A 95 -14.346 21.736 -6.559 1.00 0.00 C ATOM 1550 OG1 THR A 95 -15.399 22.626 -6.201 1.00 0.00 O ATOM 1551 CG2 THR A 95 -13.275 21.978 -5.494 1.00 0.00 C ATOM 0 H THR A 95 -13.623 24.209 -7.380 1.00 0.00 H new ATOM 0 HA THR A 95 -13.327 21.418 -8.410 1.00 0.00 H new ATOM 0 HB THR A 95 -14.585 20.673 -6.599 1.00 0.00 H new ATOM 0 HG1 THR A 95 -16.206 22.111 -5.994 1.00 0.00 H new ATOM 0 HG21 THR A 95 -13.635 21.622 -4.529 1.00 0.00 H new ATOM 0 HG22 THR A 95 -12.366 21.440 -5.763 1.00 0.00 H new ATOM 0 HG23 THR A 95 -13.060 23.045 -5.430 1.00 0.00 H new ATOM 1559 N GLU A 96 -16.088 21.618 -8.791 1.00 0.00 N ATOM 1560 CA GLU A 96 -17.268 21.744 -9.630 1.00 0.00 C ATOM 1561 C GLU A 96 -18.371 22.498 -8.884 1.00 0.00 C ATOM 1562 O GLU A 96 -18.725 23.616 -9.257 1.00 0.00 O ATOM 1563 CB GLU A 96 -17.760 20.372 -10.094 1.00 0.00 C ATOM 1564 CG GLU A 96 -16.736 19.706 -11.016 1.00 0.00 C ATOM 1565 CD GLU A 96 -16.929 18.188 -11.043 1.00 0.00 C ATOM 1566 OE1 GLU A 96 -17.856 17.747 -11.756 1.00 0.00 O ATOM 1567 OE2 GLU A 96 -16.145 17.504 -10.351 1.00 0.00 O ATOM 0 H GLU A 96 -16.110 20.834 -8.138 1.00 0.00 H new ATOM 0 HA GLU A 96 -16.999 22.316 -10.518 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -17.944 19.736 -9.228 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -18.710 20.480 -10.617 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -16.835 20.107 -12.025 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -15.728 19.942 -10.676 1.00 0.00 H new ATOM 1574 N ASN A 97 -18.883 21.857 -7.844 1.00 0.00 N ATOM 1575 CA ASN A 97 -19.939 22.453 -7.043 1.00 0.00 C ATOM 1576 C ASN A 97 -19.375 22.847 -5.677 1.00 0.00 C ATOM 1577 O ASN A 97 -18.253 22.478 -5.334 1.00 0.00 O ATOM 1578 CB ASN A 97 -21.083 21.463 -6.815 1.00 0.00 C ATOM 1579 CG ASN A 97 -21.520 20.817 -8.131 1.00 0.00 C ATOM 1580 OD1 ASN A 97 -21.142 21.235 -9.213 1.00 0.00 O ATOM 1581 ND2 ASN A 97 -22.334 19.776 -7.978 1.00 0.00 N ATOM 0 H ASN A 97 -18.586 20.931 -7.537 1.00 0.00 H new ATOM 0 HA ASN A 97 -20.318 23.324 -7.578 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -20.766 20.691 -6.114 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -21.929 21.978 -6.360 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -22.681 19.275 -8.796 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -22.611 19.479 -7.043 1.00 0.00 H new ATOM 1588 N THR A 98 -20.179 23.593 -4.933 1.00 0.00 N ATOM 1589 CA THR A 98 -19.775 24.042 -3.612 1.00 0.00 C ATOM 1590 C THR A 98 -19.551 22.843 -2.687 1.00 0.00 C ATOM 1591 O THR A 98 -18.604 22.829 -1.902 1.00 0.00 O ATOM 1592 CB THR A 98 -20.836 25.016 -3.097 1.00 0.00 C ATOM 1593 OG1 THR A 98 -20.110 25.908 -2.256 1.00 0.00 O ATOM 1594 CG2 THR A 98 -21.838 24.347 -2.154 1.00 0.00 C ATOM 0 H THR A 98 -21.109 23.898 -5.221 1.00 0.00 H new ATOM 0 HA THR A 98 -18.821 24.568 -3.648 1.00 0.00 H new ATOM 0 HB THR A 98 -21.369 25.451 -3.942 1.00 0.00 H new ATOM 0 HG1 THR A 98 -20.722 26.575 -1.881 1.00 0.00 H new ATOM 0 HG21 THR A 98 -22.569 25.083 -1.818 1.00 0.00 H new ATOM 0 HG22 THR A 98 -22.350 23.541 -2.680 1.00 0.00 H new ATOM 0 HG23 THR A 98 -21.310 23.940 -1.292 1.00 0.00 H new ATOM 1602 N GLU A 99 -20.438 21.867 -2.811 1.00 0.00 N ATOM 1603 CA GLU A 99 -20.349 20.668 -1.996 1.00 0.00 C ATOM 1604 C GLU A 99 -18.924 20.113 -2.021 1.00 0.00 C ATOM 1605 O GLU A 99 -18.269 20.027 -0.983 1.00 0.00 O ATOM 1606 CB GLU A 99 -21.356 19.613 -2.460 1.00 0.00 C ATOM 1607 CG GLU A 99 -22.782 20.169 -2.439 1.00 0.00 C ATOM 1608 CD GLU A 99 -23.569 19.613 -1.250 1.00 0.00 C ATOM 1609 OE1 GLU A 99 -23.739 18.375 -1.211 1.00 0.00 O ATOM 1610 OE2 GLU A 99 -23.983 20.438 -0.408 1.00 0.00 O ATOM 0 H GLU A 99 -21.222 21.882 -3.464 1.00 0.00 H new ATOM 0 HA GLU A 99 -20.597 20.933 -0.968 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -21.105 19.284 -3.468 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -21.294 18.737 -1.814 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -22.751 21.257 -2.383 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -23.290 19.912 -3.368 1.00 0.00 H new ATOM 1617 N SER A 100 -18.485 19.751 -3.218 1.00 0.00 N ATOM 1618 CA SER A 100 -17.149 19.207 -3.392 1.00 0.00 C ATOM 1619 C SER A 100 -16.109 20.189 -2.849 1.00 0.00 C ATOM 1620 O SER A 100 -14.997 19.793 -2.503 1.00 0.00 O ATOM 1621 CB SER A 100 -16.868 18.896 -4.863 1.00 0.00 C ATOM 1622 OG SER A 100 -16.373 17.573 -5.045 1.00 0.00 O ATOM 0 H SER A 100 -19.031 19.824 -4.076 1.00 0.00 H new ATOM 0 HA SER A 100 -17.085 18.274 -2.833 1.00 0.00 H new ATOM 0 HB2 SER A 100 -17.783 19.023 -5.441 1.00 0.00 H new ATOM 0 HB3 SER A 100 -16.143 19.611 -5.252 1.00 0.00 H new ATOM 0 HG SER A 100 -16.208 17.414 -5.998 1.00 0.00 H new ATOM 1628 N GLY A 101 -16.508 21.451 -2.789 1.00 0.00 N ATOM 1629 CA GLY A 101 -15.625 22.493 -2.294 1.00 0.00 C ATOM 1630 C GLY A 101 -15.374 22.331 -0.793 1.00 0.00 C ATOM 1631 O GLY A 101 -14.241 22.109 -0.370 1.00 0.00 O ATOM 0 H GLY A 101 -17.432 21.775 -3.075 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -14.677 22.457 -2.831 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -16.065 23.471 -2.489 1.00 0.00 H new ATOM 1635 N GLU A 102 -16.450 22.449 -0.030 1.00 0.00 N ATOM 1636 CA GLU A 102 -16.361 22.319 1.414 1.00 0.00 C ATOM 1637 C GLU A 102 -15.670 21.006 1.787 1.00 0.00 C ATOM 1638 O GLU A 102 -15.065 20.900 2.853 1.00 0.00 O ATOM 1639 CB GLU A 102 -17.746 22.412 2.060 1.00 0.00 C ATOM 1640 CG GLU A 102 -18.119 23.868 2.347 1.00 0.00 C ATOM 1641 CD GLU A 102 -19.024 24.429 1.248 1.00 0.00 C ATOM 1642 OE1 GLU A 102 -19.771 23.618 0.659 1.00 0.00 O ATOM 1643 OE2 GLU A 102 -18.949 25.656 1.021 1.00 0.00 O ATOM 0 H GLU A 102 -17.388 22.633 -0.385 1.00 0.00 H new ATOM 0 HA GLU A 102 -15.761 23.145 1.797 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -18.490 21.965 1.400 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -17.758 21.840 2.988 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -18.626 23.934 3.310 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -17.214 24.471 2.421 1.00 0.00 H new ATOM 1650 N GLU A 103 -15.784 20.038 0.890 1.00 0.00 N ATOM 1651 CA GLU A 103 -15.178 18.737 1.111 1.00 0.00 C ATOM 1652 C GLU A 103 -13.655 18.866 1.187 1.00 0.00 C ATOM 1653 O GLU A 103 -13.066 18.693 2.253 1.00 0.00 O ATOM 1654 CB GLU A 103 -15.590 17.747 0.019 1.00 0.00 C ATOM 1655 CG GLU A 103 -16.701 16.818 0.513 1.00 0.00 C ATOM 1656 CD GLU A 103 -16.207 15.932 1.658 1.00 0.00 C ATOM 1657 OE1 GLU A 103 -15.134 16.261 2.208 1.00 0.00 O ATOM 1658 OE2 GLU A 103 -16.914 14.946 1.958 1.00 0.00 O ATOM 0 H GLU A 103 -16.288 20.129 0.008 1.00 0.00 H new ATOM 0 HA GLU A 103 -15.538 18.348 2.063 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -15.931 18.292 -0.861 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -14.726 17.157 -0.287 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -17.553 17.410 0.848 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -17.051 16.194 -0.310 1.00 0.00 H new ATOM 1665 N TRP A 104 -13.061 19.171 0.042 1.00 0.00 N ATOM 1666 CA TRP A 104 -11.618 19.326 -0.034 1.00 0.00 C ATOM 1667 C TRP A 104 -11.193 20.331 1.038 1.00 0.00 C ATOM 1668 O TRP A 104 -10.364 20.020 1.892 1.00 0.00 O ATOM 1669 CB TRP A 104 -11.185 19.736 -1.443 1.00 0.00 C ATOM 1670 CG TRP A 104 -11.279 18.610 -2.475 1.00 0.00 C ATOM 1671 CD1 TRP A 104 -12.270 18.370 -3.345 1.00 0.00 C ATOM 1672 CD2 TRP A 104 -10.301 17.576 -2.712 1.00 0.00 C ATOM 1673 NE1 TRP A 104 -12.002 17.261 -4.122 1.00 0.00 N ATOM 1674 CE2 TRP A 104 -10.767 16.763 -3.724 1.00 0.00 C ATOM 1675 CE3 TRP A 104 -9.063 17.336 -2.090 1.00 0.00 C ATOM 1676 CZ2 TRP A 104 -10.059 15.655 -4.205 1.00 0.00 C ATOM 1677 CZ3 TRP A 104 -8.367 16.225 -2.582 1.00 0.00 C ATOM 1678 CH2 TRP A 104 -8.823 15.396 -3.601 1.00 0.00 C ATOM 0 H TRP A 104 -13.553 19.315 -0.840 1.00 0.00 H new ATOM 0 HA TRP A 104 -11.117 18.378 0.160 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -11.803 20.571 -1.774 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -10.157 20.096 -1.406 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -13.165 18.969 -3.428 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -12.600 16.878 -4.854 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -8.679 17.959 -1.296 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -10.446 15.034 -4.999 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -7.409 15.996 -2.139 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -8.226 14.556 -3.925 1.00 0.00 H new ATOM 1689 N ARG A 105 -11.781 21.516 0.959 1.00 0.00 N ATOM 1690 CA ARG A 105 -11.473 22.568 1.913 1.00 0.00 C ATOM 1691 C ARG A 105 -11.361 21.989 3.325 1.00 0.00 C ATOM 1692 O ARG A 105 -10.468 22.363 4.083 1.00 0.00 O ATOM 1693 CB ARG A 105 -12.549 23.656 1.899 1.00 0.00 C ATOM 1694 CG ARG A 105 -11.935 25.038 2.129 1.00 0.00 C ATOM 1695 CD ARG A 105 -12.979 26.018 2.669 1.00 0.00 C ATOM 1696 NE ARG A 105 -12.768 26.235 4.118 1.00 0.00 N ATOM 1697 CZ ARG A 105 -11.959 27.173 4.627 1.00 0.00 C ATOM 1698 NH1 ARG A 105 -11.278 27.987 3.809 1.00 0.00 N ATOM 1699 NH2 ARG A 105 -11.829 27.297 5.955 1.00 0.00 N ATOM 0 H ARG A 105 -12.468 21.771 0.250 1.00 0.00 H new ATOM 0 HA ARG A 105 -10.520 23.011 1.622 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -13.073 23.642 0.943 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -13.289 23.450 2.672 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -11.106 24.959 2.833 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -11.524 25.418 1.194 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -12.909 26.967 2.137 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -13.981 25.628 2.494 1.00 0.00 H new ATOM 0 HE ARG A 105 -13.270 25.632 4.770 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -11.376 27.892 2.798 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -10.662 28.701 4.197 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -12.346 26.677 6.578 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -11.213 28.011 6.343 1.00 0.00 H new ATOM 1713 N GLY A 106 -12.280 21.087 3.634 1.00 0.00 N ATOM 1714 CA GLY A 106 -12.295 20.453 4.942 1.00 0.00 C ATOM 1715 C GLY A 106 -11.261 19.327 5.017 1.00 0.00 C ATOM 1716 O GLY A 106 -10.385 19.341 5.880 1.00 0.00 O ATOM 0 H GLY A 106 -13.019 20.780 3.002 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -12.086 21.195 5.712 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -13.289 20.053 5.145 1.00 0.00 H new ATOM 1720 N PHE A 107 -11.398 18.379 4.102 1.00 0.00 N ATOM 1721 CA PHE A 107 -10.487 17.248 4.055 1.00 0.00 C ATOM 1722 C PHE A 107 -9.034 17.709 4.178 1.00 0.00 C ATOM 1723 O PHE A 107 -8.242 17.095 4.892 1.00 0.00 O ATOM 1724 CB PHE A 107 -10.682 16.573 2.695 1.00 0.00 C ATOM 1725 CG PHE A 107 -11.594 15.345 2.735 1.00 0.00 C ATOM 1726 CD1 PHE A 107 -11.231 14.252 3.458 1.00 0.00 C ATOM 1727 CD2 PHE A 107 -12.768 15.347 2.048 1.00 0.00 C ATOM 1728 CE1 PHE A 107 -12.077 13.112 3.494 1.00 0.00 C ATOM 1729 CE2 PHE A 107 -13.614 14.207 2.085 1.00 0.00 C ATOM 1730 CZ PHE A 107 -13.250 13.114 2.807 1.00 0.00 C ATOM 0 H PHE A 107 -12.126 18.371 3.387 1.00 0.00 H new ATOM 0 HA PHE A 107 -10.695 16.568 4.881 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -11.098 17.299 1.997 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -9.708 16.277 2.305 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -10.300 14.251 4.005 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -13.057 16.215 1.474 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -11.788 12.243 4.067 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -14.546 14.208 1.540 1.00 0.00 H new ATOM 0 HZ PHE A 107 -13.893 12.247 2.835 1.00 0.00 H new ATOM 1740 N ILE A 108 -8.726 18.787 3.471 1.00 0.00 N ATOM 1741 CA ILE A 108 -7.382 19.338 3.492 1.00 0.00 C ATOM 1742 C ILE A 108 -7.094 19.914 4.880 1.00 0.00 C ATOM 1743 O ILE A 108 -6.151 19.492 5.548 1.00 0.00 O ATOM 1744 CB ILE A 108 -7.199 20.347 2.357 1.00 0.00 C ATOM 1745 CG1 ILE A 108 -7.106 19.639 1.004 1.00 0.00 C ATOM 1746 CG2 ILE A 108 -5.990 21.250 2.616 1.00 0.00 C ATOM 1747 CD1 ILE A 108 -8.392 19.829 0.197 1.00 0.00 C ATOM 0 H ILE A 108 -9.385 19.294 2.880 1.00 0.00 H new ATOM 0 HA ILE A 108 -6.646 18.555 3.312 1.00 0.00 H new ATOM 0 HB ILE A 108 -8.079 20.989 2.325 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -6.258 20.031 0.442 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -6.922 18.576 1.158 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -5.882 21.958 1.794 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -6.136 21.795 3.548 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -5.090 20.640 2.690 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -8.300 19.316 -0.760 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -9.234 19.414 0.751 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -8.559 20.892 0.024 1.00 0.00 H new ATOM 1759 N LEU A 109 -7.923 20.870 5.273 1.00 0.00 N ATOM 1760 CA LEU A 109 -7.769 21.508 6.569 1.00 0.00 C ATOM 1761 C LEU A 109 -7.509 20.439 7.632 1.00 0.00 C ATOM 1762 O LEU A 109 -6.882 20.714 8.654 1.00 0.00 O ATOM 1763 CB LEU A 109 -8.974 22.399 6.875 1.00 0.00 C ATOM 1764 CG LEU A 109 -9.041 23.724 6.111 1.00 0.00 C ATOM 1765 CD1 LEU A 109 -10.437 24.342 6.206 1.00 0.00 C ATOM 1766 CD2 LEU A 109 -7.953 24.687 6.591 1.00 0.00 C ATOM 0 H LEU A 109 -8.704 21.218 4.716 1.00 0.00 H new ATOM 0 HA LEU A 109 -6.904 22.172 6.566 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -9.882 21.834 6.663 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -8.977 22.618 7.943 1.00 0.00 H new ATOM 0 HG LEU A 109 -8.851 23.522 5.057 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -10.457 25.282 5.655 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -11.169 23.656 5.779 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -10.682 24.529 7.252 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -8.022 25.621 6.033 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -8.088 24.888 7.654 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -6.973 24.239 6.429 1.00 0.00 H new ATOM 1778 N THR A 110 -8.004 19.242 7.354 1.00 0.00 N ATOM 1779 CA THR A 110 -7.834 18.130 8.274 1.00 0.00 C ATOM 1780 C THR A 110 -6.426 17.543 8.146 1.00 0.00 C ATOM 1781 O THR A 110 -5.790 17.224 9.149 1.00 0.00 O ATOM 1782 CB THR A 110 -8.943 17.113 7.997 1.00 0.00 C ATOM 1783 OG1 THR A 110 -10.146 17.840 8.228 1.00 0.00 O ATOM 1784 CG2 THR A 110 -8.981 15.990 9.036 1.00 0.00 C ATOM 0 H THR A 110 -8.523 19.018 6.505 1.00 0.00 H new ATOM 0 HA THR A 110 -7.924 18.457 9.310 1.00 0.00 H new ATOM 0 HB THR A 110 -8.803 16.685 7.005 1.00 0.00 H new ATOM 0 HG1 THR A 110 -10.360 18.378 7.437 1.00 0.00 H new ATOM 0 HG21 THR A 110 -9.786 15.296 8.793 1.00 0.00 H new ATOM 0 HG22 THR A 110 -8.030 15.458 9.032 1.00 0.00 H new ATOM 0 HG23 THR A 110 -9.155 16.415 10.025 1.00 0.00 H new ATOM 1792 N VAL A 111 -5.982 17.419 6.904 1.00 0.00 N ATOM 1793 CA VAL A 111 -4.662 16.876 6.633 1.00 0.00 C ATOM 1794 C VAL A 111 -3.648 18.021 6.567 1.00 0.00 C ATOM 1795 O VAL A 111 -2.656 17.936 5.846 1.00 0.00 O ATOM 1796 CB VAL A 111 -4.695 16.033 5.356 1.00 0.00 C ATOM 1797 CG1 VAL A 111 -5.667 14.861 5.499 1.00 0.00 C ATOM 1798 CG2 VAL A 111 -5.046 16.893 4.141 1.00 0.00 C ATOM 0 H VAL A 111 -6.513 17.685 6.075 1.00 0.00 H new ATOM 0 HA VAL A 111 -4.350 16.211 7.438 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.697 15.623 5.198 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -5.672 14.278 4.578 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -5.353 14.227 6.328 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -6.670 15.242 5.693 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -5.063 16.270 3.247 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -6.027 17.345 4.287 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -4.299 17.678 4.022 1.00 0.00 H new ATOM 1808 N THR A 112 -3.934 19.066 7.330 1.00 0.00 N ATOM 1809 CA THR A 112 -3.060 20.226 7.368 1.00 0.00 C ATOM 1810 C THR A 112 -3.119 20.894 8.743 1.00 0.00 C ATOM 1811 O THR A 112 -2.087 21.245 9.312 1.00 0.00 O ATOM 1812 CB THR A 112 -3.460 21.157 6.222 1.00 0.00 C ATOM 1813 OG1 THR A 112 -4.867 21.316 6.379 1.00 0.00 O ATOM 1814 CG2 THR A 112 -3.311 20.495 4.851 1.00 0.00 C ATOM 0 H THR A 112 -4.759 19.133 7.927 1.00 0.00 H new ATOM 0 HA THR A 112 -2.018 19.941 7.225 1.00 0.00 H new ATOM 0 HB THR A 112 -2.850 22.059 6.258 1.00 0.00 H new ATOM 0 HG1 THR A 112 -5.312 20.456 6.227 1.00 0.00 H new ATOM 0 HG21 THR A 112 -3.608 21.198 4.073 1.00 0.00 H new ATOM 0 HG22 THR A 112 -2.272 20.203 4.699 1.00 0.00 H new ATOM 0 HG23 THR A 112 -3.947 19.611 4.803 1.00 0.00 H new ATOM 1822 N GLU A 113 -4.339 21.051 9.237 1.00 0.00 N ATOM 1823 CA GLU A 113 -4.547 21.671 10.534 1.00 0.00 C ATOM 1824 C GLU A 113 -4.489 20.617 11.642 1.00 0.00 C ATOM 1825 O GLU A 113 -4.512 20.953 12.825 1.00 0.00 O ATOM 1826 CB GLU A 113 -5.873 22.433 10.572 1.00 0.00 C ATOM 1827 CG GLU A 113 -6.009 23.358 9.360 1.00 0.00 C ATOM 1828 CD GLU A 113 -6.577 24.718 9.770 1.00 0.00 C ATOM 1829 OE1 GLU A 113 -7.807 24.778 9.984 1.00 0.00 O ATOM 1830 OE2 GLU A 113 -5.769 25.667 9.861 1.00 0.00 O ATOM 0 H GLU A 113 -5.193 20.759 8.762 1.00 0.00 H new ATOM 0 HA GLU A 113 -3.747 22.392 10.702 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -6.702 21.726 10.589 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -5.934 23.018 11.489 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -5.035 23.493 8.890 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -6.660 22.897 8.617 1.00 0.00 H new ATOM 1837 N LEU A 114 -4.413 19.364 11.219 1.00 0.00 N ATOM 1838 CA LEU A 114 -4.351 18.259 12.160 1.00 0.00 C ATOM 1839 C LEU A 114 -5.583 18.298 13.067 1.00 0.00 C ATOM 1840 O LEU A 114 -5.556 17.772 14.179 1.00 0.00 O ATOM 1841 CB LEU A 114 -3.025 18.278 12.922 1.00 0.00 C ATOM 1842 CG LEU A 114 -1.888 17.456 12.312 1.00 0.00 C ATOM 1843 CD1 LEU A 114 -2.068 15.966 12.611 1.00 0.00 C ATOM 1844 CD2 LEU A 114 -1.759 17.728 10.812 1.00 0.00 C ATOM 0 H LEU A 114 -4.393 19.089 10.237 1.00 0.00 H new ATOM 0 HA LEU A 114 -4.374 17.306 11.631 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -2.693 19.313 13.008 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -3.205 17.916 13.934 1.00 0.00 H new ATOM 0 HG LEU A 114 -0.953 17.767 12.777 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -1.247 15.404 12.166 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -2.073 15.809 13.690 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -3.013 15.622 12.190 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -0.944 17.131 10.403 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -2.690 17.461 10.312 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -1.551 18.786 10.651 1.00 0.00 H new ATOM 1856 N SER A 115 -6.633 18.926 12.559 1.00 0.00 N ATOM 1857 CA SER A 115 -7.872 19.040 13.310 1.00 0.00 C ATOM 1858 C SER A 115 -9.068 18.824 12.381 1.00 0.00 C ATOM 1859 O SER A 115 -8.902 18.412 11.234 1.00 0.00 O ATOM 1860 CB SER A 115 -7.975 20.402 13.999 1.00 0.00 C ATOM 1861 OG SER A 115 -8.870 20.373 15.107 1.00 0.00 O ATOM 0 H SER A 115 -6.652 19.361 11.637 1.00 0.00 H new ATOM 0 HA SER A 115 -7.876 18.271 14.082 1.00 0.00 H new ATOM 0 HB2 SER A 115 -6.987 20.712 14.339 1.00 0.00 H new ATOM 0 HB3 SER A 115 -8.313 21.148 13.279 1.00 0.00 H new ATOM 0 HG SER A 115 -8.907 21.260 15.521 1.00 0.00 H new ATOM 1867 N VAL A 116 -10.248 19.110 12.912 1.00 0.00 N ATOM 1868 CA VAL A 116 -11.472 18.952 12.145 1.00 0.00 C ATOM 1869 C VAL A 116 -12.283 20.248 12.214 1.00 0.00 C ATOM 1870 O VAL A 116 -12.664 20.689 13.297 1.00 0.00 O ATOM 1871 CB VAL A 116 -12.249 17.733 12.645 1.00 0.00 C ATOM 1872 CG1 VAL A 116 -13.526 17.524 11.828 1.00 0.00 C ATOM 1873 CG2 VAL A 116 -11.374 16.479 12.626 1.00 0.00 C ATOM 0 H VAL A 116 -10.382 19.450 13.864 1.00 0.00 H new ATOM 0 HA VAL A 116 -11.244 18.767 11.095 1.00 0.00 H new ATOM 0 HB VAL A 116 -12.540 17.922 13.678 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -14.060 16.651 12.204 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -14.163 18.404 11.916 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -13.267 17.367 10.781 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -11.951 15.627 12.986 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -11.038 16.285 11.607 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -10.508 16.630 13.271 1.00 0.00 H new ATOM 1883 N PRO A 117 -12.529 20.836 11.013 1.00 0.00 N ATOM 1884 CA PRO A 117 -13.287 22.073 10.926 1.00 0.00 C ATOM 1885 C PRO A 117 -14.780 21.816 11.145 1.00 0.00 C ATOM 1886 O PRO A 117 -15.390 21.026 10.427 1.00 0.00 O ATOM 1887 CB PRO A 117 -12.977 22.630 9.547 1.00 0.00 C ATOM 1888 CG PRO A 117 -12.430 21.463 8.740 1.00 0.00 C ATOM 1889 CD PRO A 117 -12.093 20.343 9.710 1.00 0.00 C ATOM 0 HA PRO A 117 -13.013 22.790 11.700 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -13.873 23.041 9.081 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -12.249 23.439 9.607 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -13.165 21.127 8.009 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -11.543 21.766 8.184 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -12.608 19.420 9.443 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -11.025 20.124 9.707 1.00 0.00 H new ATOM 1897 N GLN A 118 -15.325 22.500 12.141 1.00 0.00 N ATOM 1898 CA GLN A 118 -16.734 22.356 12.464 1.00 0.00 C ATOM 1899 C GLN A 118 -17.559 23.408 11.720 1.00 0.00 C ATOM 1900 O GLN A 118 -18.786 23.330 11.686 1.00 0.00 O ATOM 1901 CB GLN A 118 -16.963 22.447 13.974 1.00 0.00 C ATOM 1902 CG GLN A 118 -16.928 21.059 14.618 1.00 0.00 C ATOM 1903 CD GLN A 118 -16.151 21.086 15.936 1.00 0.00 C ATOM 1904 OE1 GLN A 118 -14.942 21.249 15.970 1.00 0.00 O ATOM 1905 NE2 GLN A 118 -16.909 20.918 17.015 1.00 0.00 N ATOM 0 H GLN A 118 -14.816 23.155 12.734 1.00 0.00 H new ATOM 0 HA GLN A 118 -17.062 21.369 12.139 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -16.198 23.080 14.424 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -17.925 22.920 14.172 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -17.945 20.712 14.798 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -16.465 20.348 13.933 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -17.916 20.787 16.916 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -16.484 20.921 17.942 1.00 0.00 H new ATOM 1914 N ASN A 119 -16.852 24.369 11.143 1.00 0.00 N ATOM 1915 CA ASN A 119 -17.503 25.435 10.402 1.00 0.00 C ATOM 1916 C ASN A 119 -17.573 25.054 8.922 1.00 0.00 C ATOM 1917 O ASN A 119 -16.962 25.709 8.079 1.00 0.00 O ATOM 1918 CB ASN A 119 -16.719 26.744 10.517 1.00 0.00 C ATOM 1919 CG ASN A 119 -16.881 27.360 11.908 1.00 0.00 C ATOM 1920 OD1 ASN A 119 -17.901 27.938 12.244 1.00 0.00 O ATOM 1921 ND2 ASN A 119 -15.820 27.205 12.695 1.00 0.00 N ATOM 0 H ASN A 119 -15.834 24.431 11.174 1.00 0.00 H new ATOM 0 HA ASN A 119 -18.501 25.574 10.819 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -15.663 26.558 10.318 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -17.067 27.448 9.761 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -15.829 27.581 13.643 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -14.997 26.710 12.350 1.00 0.00 H new ATOM 1928 N VAL A 120 -18.322 23.995 8.651 1.00 0.00 N ATOM 1929 CA VAL A 120 -18.479 23.518 7.287 1.00 0.00 C ATOM 1930 C VAL A 120 -19.961 23.267 7.007 1.00 0.00 C ATOM 1931 O VAL A 120 -20.774 23.233 7.930 1.00 0.00 O ATOM 1932 CB VAL A 120 -17.609 22.279 7.063 1.00 0.00 C ATOM 1933 CG1 VAL A 120 -16.123 22.639 7.097 1.00 0.00 C ATOM 1934 CG2 VAL A 120 -17.933 21.190 8.087 1.00 0.00 C ATOM 0 H VAL A 120 -18.827 23.454 9.353 1.00 0.00 H new ATOM 0 HA VAL A 120 -18.137 24.271 6.577 1.00 0.00 H new ATOM 0 HB VAL A 120 -17.835 21.885 6.072 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -15.527 21.741 6.935 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -15.906 23.364 6.313 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -15.875 23.069 8.067 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -17.301 20.321 7.906 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -17.749 21.569 9.092 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -18.980 20.903 7.994 1.00 0.00 H new ATOM 1944 N SER A 121 -20.269 23.097 5.729 1.00 0.00 N ATOM 1945 CA SER A 121 -21.640 22.850 5.316 1.00 0.00 C ATOM 1946 C SER A 121 -21.877 21.346 5.164 1.00 0.00 C ATOM 1947 O SER A 121 -23.004 20.913 4.930 1.00 0.00 O ATOM 1948 CB SER A 121 -21.959 23.573 4.006 1.00 0.00 C ATOM 1949 OG SER A 121 -23.189 24.289 4.077 1.00 0.00 O ATOM 0 H SER A 121 -19.592 23.126 4.966 1.00 0.00 H new ATOM 0 HA SER A 121 -22.305 23.240 6.086 1.00 0.00 H new ATOM 0 HB2 SER A 121 -21.151 24.264 3.767 1.00 0.00 H new ATOM 0 HB3 SER A 121 -22.008 22.847 3.194 1.00 0.00 H new ATOM 0 HG SER A 121 -23.356 24.738 3.222 1.00 0.00 H new ATOM 1955 N LEU A 122 -20.797 20.592 5.303 1.00 0.00 N ATOM 1956 CA LEU A 122 -20.874 19.146 5.184 1.00 0.00 C ATOM 1957 C LEU A 122 -21.917 18.612 6.168 1.00 0.00 C ATOM 1958 O LEU A 122 -22.556 19.385 6.880 1.00 0.00 O ATOM 1959 CB LEU A 122 -19.488 18.519 5.357 1.00 0.00 C ATOM 1960 CG LEU A 122 -18.841 17.963 4.087 1.00 0.00 C ATOM 1961 CD1 LEU A 122 -19.204 18.814 2.868 1.00 0.00 C ATOM 1962 CD2 LEU A 122 -17.327 17.825 4.259 1.00 0.00 C ATOM 0 H LEU A 122 -19.864 20.955 5.497 1.00 0.00 H new ATOM 0 HA LEU A 122 -21.204 18.864 4.184 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -18.822 19.270 5.782 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -19.564 17.712 6.086 1.00 0.00 H new ATOM 0 HG LEU A 122 -19.238 16.963 3.911 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -18.731 18.397 1.979 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -20.286 18.817 2.736 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -18.854 19.835 3.020 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -16.891 17.428 3.342 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -16.894 18.802 4.472 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -17.115 17.146 5.085 1.00 0.00 H new ATOM 1974 N LEU A 123 -22.056 17.294 6.176 1.00 0.00 N ATOM 1975 CA LEU A 123 -23.011 16.648 7.060 1.00 0.00 C ATOM 1976 C LEU A 123 -22.255 15.899 8.160 1.00 0.00 C ATOM 1977 O LEU A 123 -21.029 15.966 8.231 1.00 0.00 O ATOM 1978 CB LEU A 123 -23.969 15.764 6.260 1.00 0.00 C ATOM 1979 CG LEU A 123 -24.001 16.004 4.750 1.00 0.00 C ATOM 1980 CD1 LEU A 123 -24.567 14.789 4.013 1.00 0.00 C ATOM 1981 CD2 LEU A 123 -24.767 17.285 4.414 1.00 0.00 C ATOM 0 H LEU A 123 -21.523 16.656 5.584 1.00 0.00 H new ATOM 0 HA LEU A 123 -23.638 17.391 7.553 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -23.703 14.722 6.436 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -24.976 15.907 6.652 1.00 0.00 H new ATOM 0 HG LEU A 123 -22.976 16.141 4.405 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -24.579 14.987 2.941 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -23.943 13.918 4.215 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -25.583 14.595 4.357 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -24.774 17.432 3.334 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -25.792 17.202 4.776 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -24.281 18.135 4.892 1.00 0.00 H new ATOM 1993 N PRO A 124 -23.038 15.185 9.011 1.00 0.00 N ATOM 1994 CA PRO A 124 -22.456 14.424 10.104 1.00 0.00 C ATOM 1995 C PRO A 124 -21.791 13.146 9.588 1.00 0.00 C ATOM 1996 O PRO A 124 -21.013 12.515 10.302 1.00 0.00 O ATOM 1997 CB PRO A 124 -23.611 14.151 11.053 1.00 0.00 C ATOM 1998 CG PRO A 124 -24.878 14.362 10.240 1.00 0.00 C ATOM 1999 CD PRO A 124 -24.494 15.083 8.958 1.00 0.00 C ATOM 0 HA PRO A 124 -21.658 14.964 10.615 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -23.563 13.135 11.444 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -23.580 14.824 11.910 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -25.350 13.406 10.014 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -25.602 14.949 10.806 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -24.820 14.528 8.079 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -24.958 16.068 8.903 1.00 0.00 H new ATOM 2007 N GLY A 125 -22.122 12.802 8.352 1.00 0.00 N ATOM 2008 CA GLY A 125 -21.567 11.611 7.733 1.00 0.00 C ATOM 2009 C GLY A 125 -20.283 11.938 6.967 1.00 0.00 C ATOM 2010 O GLY A 125 -19.417 11.080 6.805 1.00 0.00 O ATOM 0 H GLY A 125 -22.768 13.328 7.763 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -21.358 10.863 8.498 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -22.299 11.175 7.053 1.00 0.00 H new ATOM 2014 N GLN A 126 -20.201 13.182 6.518 1.00 0.00 N ATOM 2015 CA GLN A 126 -19.037 13.633 5.773 1.00 0.00 C ATOM 2016 C GLN A 126 -17.943 14.105 6.733 1.00 0.00 C ATOM 2017 O GLN A 126 -16.757 13.918 6.468 1.00 0.00 O ATOM 2018 CB GLN A 126 -19.414 14.739 4.785 1.00 0.00 C ATOM 2019 CG GLN A 126 -20.471 14.251 3.793 1.00 0.00 C ATOM 2020 CD GLN A 126 -19.824 13.787 2.486 1.00 0.00 C ATOM 2021 OE1 GLN A 126 -19.721 12.605 2.200 1.00 0.00 O ATOM 2022 NE2 GLN A 126 -19.395 14.780 1.713 1.00 0.00 N ATOM 0 H GLN A 126 -20.921 13.891 6.655 1.00 0.00 H new ATOM 0 HA GLN A 126 -18.650 12.793 5.197 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -19.793 15.604 5.329 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -18.526 15.066 4.244 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -21.037 13.431 4.234 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -21.180 15.053 3.587 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -19.513 15.748 2.013 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -18.948 14.574 0.820 1.00 0.00 H new ATOM 2031 N VAL A 127 -18.381 14.707 7.829 1.00 0.00 N ATOM 2032 CA VAL A 127 -17.454 15.207 8.830 1.00 0.00 C ATOM 2033 C VAL A 127 -16.626 14.043 9.378 1.00 0.00 C ATOM 2034 O VAL A 127 -15.457 14.216 9.721 1.00 0.00 O ATOM 2035 CB VAL A 127 -18.218 15.962 9.920 1.00 0.00 C ATOM 2036 CG1 VAL A 127 -17.414 16.007 11.221 1.00 0.00 C ATOM 2037 CG2 VAL A 127 -18.587 17.372 9.454 1.00 0.00 C ATOM 0 H VAL A 127 -19.366 14.860 8.046 1.00 0.00 H new ATOM 0 HA VAL A 127 -16.759 15.920 8.385 1.00 0.00 H new ATOM 0 HB VAL A 127 -19.144 15.421 10.117 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -17.979 16.549 11.979 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -17.224 14.991 11.567 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -16.465 16.513 11.045 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -19.129 17.887 10.247 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -17.679 17.926 9.216 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -19.216 17.309 8.566 1.00 0.00 H new ATOM 2047 N ILE A 128 -17.263 12.883 9.442 1.00 0.00 N ATOM 2048 CA ILE A 128 -16.599 11.691 9.942 1.00 0.00 C ATOM 2049 C ILE A 128 -15.246 11.536 9.246 1.00 0.00 C ATOM 2050 O ILE A 128 -14.225 11.337 9.903 1.00 0.00 O ATOM 2051 CB ILE A 128 -17.509 10.470 9.795 1.00 0.00 C ATOM 2052 CG1 ILE A 128 -18.725 10.578 10.719 1.00 0.00 C ATOM 2053 CG2 ILE A 128 -16.729 9.174 10.024 1.00 0.00 C ATOM 2054 CD1 ILE A 128 -19.901 9.766 10.173 1.00 0.00 C ATOM 0 H ILE A 128 -18.232 12.743 9.156 1.00 0.00 H new ATOM 0 HA ILE A 128 -16.400 11.785 11.009 1.00 0.00 H new ATOM 0 HB ILE A 128 -17.883 10.444 8.772 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -18.463 10.221 11.715 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -19.017 11.623 10.822 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -17.399 8.322 9.914 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -15.924 9.100 9.293 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -16.307 9.176 11.029 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -20.752 9.859 10.848 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -20.176 10.142 9.188 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -19.614 8.717 10.094 1.00 0.00 H new ATOM 2066 N LYS A 129 -15.281 11.634 7.925 1.00 0.00 N ATOM 2067 CA LYS A 129 -14.069 11.507 7.133 1.00 0.00 C ATOM 2068 C LYS A 129 -12.964 12.360 7.758 1.00 0.00 C ATOM 2069 O LYS A 129 -11.894 11.852 8.089 1.00 0.00 O ATOM 2070 CB LYS A 129 -14.350 11.843 5.667 1.00 0.00 C ATOM 2071 CG LYS A 129 -15.381 10.882 5.072 1.00 0.00 C ATOM 2072 CD LYS A 129 -14.767 9.502 4.827 1.00 0.00 C ATOM 2073 CE LYS A 129 -14.083 9.441 3.460 1.00 0.00 C ATOM 2074 NZ LYS A 129 -15.084 9.253 2.387 1.00 0.00 N ATOM 0 H LYS A 129 -16.129 11.800 7.383 1.00 0.00 H new ATOM 0 HA LYS A 129 -13.717 10.475 7.138 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -14.715 12.867 5.588 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -13.424 11.789 5.094 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -16.231 10.791 5.748 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -15.762 11.286 4.134 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -14.043 9.278 5.610 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -15.544 8.739 4.883 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -13.523 10.360 3.286 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -13.364 8.622 3.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -14.597 9.129 1.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -15.657 8.410 2.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -15.702 10.088 2.338 1.00 0.00 H new ATOM 2088 N LEU A 130 -13.262 13.643 7.902 1.00 0.00 N ATOM 2089 CA LEU A 130 -12.307 14.572 8.482 1.00 0.00 C ATOM 2090 C LEU A 130 -11.729 13.969 9.764 1.00 0.00 C ATOM 2091 O LEU A 130 -10.521 14.020 9.989 1.00 0.00 O ATOM 2092 CB LEU A 130 -12.950 15.946 8.684 1.00 0.00 C ATOM 2093 CG LEU A 130 -13.734 16.501 7.493 1.00 0.00 C ATOM 2094 CD1 LEU A 130 -14.028 17.991 7.677 1.00 0.00 C ATOM 2095 CD2 LEU A 130 -13.006 16.218 6.177 1.00 0.00 C ATOM 0 H LEU A 130 -14.151 14.061 7.627 1.00 0.00 H new ATOM 0 HA LEU A 130 -11.472 14.734 7.801 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -13.621 15.889 9.541 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -12.166 16.658 8.941 1.00 0.00 H new ATOM 0 HG LEU A 130 -14.694 15.987 7.446 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -14.586 18.361 6.817 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -14.618 18.136 8.582 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -13.090 18.539 7.764 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -13.585 16.623 5.347 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -12.023 16.688 6.197 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -12.892 15.142 6.049 1.00 0.00 H new ATOM 2107 N HIS A 131 -12.620 13.412 10.571 1.00 0.00 N ATOM 2108 CA HIS A 131 -12.214 12.799 11.825 1.00 0.00 C ATOM 2109 C HIS A 131 -11.292 11.612 11.541 1.00 0.00 C ATOM 2110 O HIS A 131 -10.179 11.549 12.061 1.00 0.00 O ATOM 2111 CB HIS A 131 -13.436 12.414 12.662 1.00 0.00 C ATOM 2112 CG HIS A 131 -13.786 13.417 13.735 1.00 0.00 C ATOM 2113 ND1 HIS A 131 -12.919 13.750 14.761 1.00 0.00 N ATOM 2114 CD2 HIS A 131 -14.916 14.155 13.931 1.00 0.00 C ATOM 2115 CE1 HIS A 131 -13.511 14.648 15.534 1.00 0.00 C ATOM 2116 NE2 HIS A 131 -14.748 14.898 15.019 1.00 0.00 N ATOM 0 H HIS A 131 -13.621 13.372 10.381 1.00 0.00 H new ATOM 0 HA HIS A 131 -11.650 13.518 12.420 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -14.293 12.292 12.000 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -13.253 11.446 13.129 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -15.798 14.138 13.307 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -13.088 15.103 16.418 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -15.432 15.549 15.406 1.00 0.00 H new ATOM 2124 N GLU A 132 -11.789 10.701 10.718 1.00 0.00 N ATOM 2125 CA GLU A 132 -11.023 9.519 10.359 1.00 0.00 C ATOM 2126 C GLU A 132 -9.697 9.923 9.712 1.00 0.00 C ATOM 2127 O GLU A 132 -8.627 9.590 10.220 1.00 0.00 O ATOM 2128 CB GLU A 132 -11.828 8.604 9.435 1.00 0.00 C ATOM 2129 CG GLU A 132 -12.974 7.930 10.193 1.00 0.00 C ATOM 2130 CD GLU A 132 -13.683 6.900 9.311 1.00 0.00 C ATOM 2131 OE1 GLU A 132 -12.968 6.219 8.545 1.00 0.00 O ATOM 2132 OE2 GLU A 132 -14.926 6.817 9.423 1.00 0.00 O ATOM 0 H GLU A 132 -12.713 10.757 10.289 1.00 0.00 H new ATOM 0 HA GLU A 132 -10.805 8.960 11.269 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.229 9.183 8.603 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -11.173 7.844 9.009 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -12.586 7.443 11.088 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.688 8.684 10.525 1.00 0.00 H new ATOM 2139 N VAL A 133 -9.810 10.634 8.599 1.00 0.00 N ATOM 2140 CA VAL A 133 -8.633 11.087 7.877 1.00 0.00 C ATOM 2141 C VAL A 133 -7.600 11.614 8.875 1.00 0.00 C ATOM 2142 O VAL A 133 -6.417 11.288 8.779 1.00 0.00 O ATOM 2143 CB VAL A 133 -9.032 12.123 6.825 1.00 0.00 C ATOM 2144 CG1 VAL A 133 -7.795 12.776 6.203 1.00 0.00 C ATOM 2145 CG2 VAL A 133 -9.921 11.497 5.749 1.00 0.00 C ATOM 0 H VAL A 133 -10.699 10.907 8.180 1.00 0.00 H new ATOM 0 HA VAL A 133 -8.172 10.259 7.339 1.00 0.00 H new ATOM 0 HB VAL A 133 -9.608 12.903 7.323 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -8.106 13.509 5.458 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -7.216 13.273 6.981 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -7.181 12.012 5.726 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -10.190 12.255 5.013 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -9.381 10.689 5.256 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -10.826 11.101 6.210 1.00 0.00 H new ATOM 2155 N LEU A 134 -8.083 12.420 9.808 1.00 0.00 N ATOM 2156 CA LEU A 134 -7.216 12.996 10.822 1.00 0.00 C ATOM 2157 C LEU A 134 -6.474 11.873 11.549 1.00 0.00 C ATOM 2158 O LEU A 134 -5.267 11.709 11.377 1.00 0.00 O ATOM 2159 CB LEU A 134 -8.015 13.909 11.754 1.00 0.00 C ATOM 2160 CG LEU A 134 -7.278 14.405 13.000 1.00 0.00 C ATOM 2161 CD1 LEU A 134 -5.822 14.745 12.677 1.00 0.00 C ATOM 2162 CD2 LEU A 134 -8.014 15.585 13.639 1.00 0.00 C ATOM 0 H LEU A 134 -9.064 12.688 9.884 1.00 0.00 H new ATOM 0 HA LEU A 134 -6.460 13.632 10.361 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -8.348 14.776 11.183 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -8.910 13.375 12.074 1.00 0.00 H new ATOM 0 HG LEU A 134 -7.265 13.598 13.733 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -5.321 15.095 13.580 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -5.315 13.856 12.302 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -5.791 15.527 11.918 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -7.469 15.918 14.522 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -8.079 16.404 12.923 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -9.018 15.274 13.928 1.00 0.00 H new ATOM 2174 N GLU A 135 -7.226 11.129 12.347 1.00 0.00 N ATOM 2175 CA GLU A 135 -6.654 10.027 13.101 1.00 0.00 C ATOM 2176 C GLU A 135 -5.761 9.173 12.199 1.00 0.00 C ATOM 2177 O GLU A 135 -4.767 8.611 12.655 1.00 0.00 O ATOM 2178 CB GLU A 135 -7.751 9.178 13.749 1.00 0.00 C ATOM 2179 CG GLU A 135 -8.522 9.985 14.795 1.00 0.00 C ATOM 2180 CD GLU A 135 -9.502 9.094 15.561 1.00 0.00 C ATOM 2181 OE1 GLU A 135 -10.097 8.211 14.906 1.00 0.00 O ATOM 2182 OE2 GLU A 135 -9.634 9.317 16.784 1.00 0.00 O ATOM 0 H GLU A 135 -8.227 11.268 12.488 1.00 0.00 H new ATOM 0 HA GLU A 135 -6.040 10.440 13.901 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -8.438 8.818 12.983 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -7.307 8.299 14.217 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -7.822 10.446 15.492 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -9.065 10.794 14.307 1.00 0.00 H new ATOM 2189 N ARG A 136 -6.149 9.101 10.934 1.00 0.00 N ATOM 2190 CA ARG A 136 -5.396 8.325 9.963 1.00 0.00 C ATOM 2191 C ARG A 136 -3.986 8.897 9.805 1.00 0.00 C ATOM 2192 O ARG A 136 -3.009 8.150 9.774 1.00 0.00 O ATOM 2193 CB ARG A 136 -6.093 8.322 8.601 1.00 0.00 C ATOM 2194 CG ARG A 136 -6.831 7.003 8.366 1.00 0.00 C ATOM 2195 CD ARG A 136 -5.881 5.929 7.833 1.00 0.00 C ATOM 2196 NE ARG A 136 -6.655 4.783 7.308 1.00 0.00 N ATOM 2197 CZ ARG A 136 -6.138 3.568 7.078 1.00 0.00 C ATOM 2198 NH1 ARG A 136 -4.842 3.334 7.327 1.00 0.00 N ATOM 2199 NH2 ARG A 136 -6.916 2.587 6.600 1.00 0.00 N ATOM 0 H ARG A 136 -6.975 9.567 10.559 1.00 0.00 H new ATOM 0 HA ARG A 136 -5.337 7.301 10.331 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -6.798 9.152 8.547 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -5.357 8.477 7.812 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -7.282 6.664 9.298 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -7.644 7.159 7.657 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -5.253 6.346 7.045 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -5.215 5.594 8.628 1.00 0.00 H new ATOM 0 HE ARG A 136 -7.645 4.926 7.108 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -4.250 4.080 7.691 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -4.448 2.410 7.152 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -7.902 2.765 6.411 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -6.522 1.663 6.425 1.00 0.00 H new ATOM 2213 N GLU A 137 -3.924 10.217 9.709 1.00 0.00 N ATOM 2214 CA GLU A 137 -2.650 10.898 9.555 1.00 0.00 C ATOM 2215 C GLU A 137 -1.950 11.027 10.909 1.00 0.00 C ATOM 2216 O GLU A 137 -0.722 11.070 10.976 1.00 0.00 O ATOM 2217 CB GLU A 137 -2.836 12.269 8.901 1.00 0.00 C ATOM 2218 CG GLU A 137 -3.662 13.195 9.795 1.00 0.00 C ATOM 2219 CD GLU A 137 -3.309 14.662 9.540 1.00 0.00 C ATOM 2220 OE1 GLU A 137 -2.205 14.894 9.002 1.00 0.00 O ATOM 2221 OE2 GLU A 137 -4.151 15.517 9.889 1.00 0.00 O ATOM 0 H GLU A 137 -4.736 10.833 9.735 1.00 0.00 H new ATOM 0 HA GLU A 137 -2.019 10.301 8.897 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -1.862 12.718 8.707 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -3.331 12.152 7.937 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -4.724 13.035 9.608 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -3.483 12.951 10.842 1.00 0.00 H new ATOM 2228 N LYS A 138 -2.761 11.085 11.956 1.00 0.00 N ATOM 2229 CA LYS A 138 -2.235 11.208 13.304 1.00 0.00 C ATOM 2230 C LYS A 138 -1.174 10.130 13.534 1.00 0.00 C ATOM 2231 O LYS A 138 -0.134 10.395 14.136 1.00 0.00 O ATOM 2232 CB LYS A 138 -3.372 11.179 14.328 1.00 0.00 C ATOM 2233 CG LYS A 138 -4.073 12.537 14.406 1.00 0.00 C ATOM 2234 CD LYS A 138 -5.256 12.488 15.376 1.00 0.00 C ATOM 2235 CE LYS A 138 -5.356 13.783 16.184 1.00 0.00 C ATOM 2236 NZ LYS A 138 -6.309 13.622 17.305 1.00 0.00 N ATOM 0 H LYS A 138 -3.779 11.049 11.897 1.00 0.00 H new ATOM 0 HA LYS A 138 -1.744 12.172 13.434 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -4.093 10.409 14.055 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -2.977 10.913 15.308 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -3.364 13.298 14.730 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -4.422 12.828 13.415 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -6.180 12.330 14.820 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -5.142 11.641 16.052 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -4.374 14.054 16.570 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -5.681 14.598 15.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -6.365 14.510 17.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -7.249 13.385 16.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -5.983 12.858 17.931 1.00 0.00 H new ATOM 2250 N LYS A 139 -1.473 8.936 13.042 1.00 0.00 N ATOM 2251 CA LYS A 139 -0.558 7.817 13.186 1.00 0.00 C ATOM 2252 C LYS A 139 0.800 8.194 12.589 1.00 0.00 C ATOM 2253 O LYS A 139 1.791 8.298 13.310 1.00 0.00 O ATOM 2254 CB LYS A 139 -1.164 6.548 12.582 1.00 0.00 C ATOM 2255 CG LYS A 139 -1.963 5.771 13.630 1.00 0.00 C ATOM 2256 CD LYS A 139 -3.456 6.087 13.525 1.00 0.00 C ATOM 2257 CE LYS A 139 -4.291 4.805 13.549 1.00 0.00 C ATOM 2258 NZ LYS A 139 -5.646 5.078 14.078 1.00 0.00 N ATOM 0 H LYS A 139 -2.336 8.720 12.543 1.00 0.00 H new ATOM 0 HA LYS A 139 -0.393 7.593 14.240 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -1.813 6.812 11.747 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -0.371 5.916 12.182 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -1.804 4.701 13.495 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -1.603 6.023 14.628 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -3.753 6.734 14.350 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -3.651 6.635 12.603 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -4.364 4.392 12.543 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -3.798 4.054 14.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -6.199 4.197 14.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -5.572 5.451 15.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -6.120 5.778 13.473 1.00 0.00 H new ATOM 2272 N ARG A 140 0.801 8.387 11.278 1.00 0.00 N ATOM 2273 CA ARG A 140 2.021 8.751 10.577 1.00 0.00 C ATOM 2274 C ARG A 140 2.831 9.751 11.403 1.00 0.00 C ATOM 2275 O ARG A 140 4.026 9.558 11.622 1.00 0.00 O ATOM 2276 CB ARG A 140 1.709 9.363 9.210 1.00 0.00 C ATOM 2277 CG ARG A 140 2.222 8.470 8.079 1.00 0.00 C ATOM 2278 CD ARG A 140 1.295 8.537 6.863 1.00 0.00 C ATOM 2279 NE ARG A 140 -0.028 7.968 7.203 1.00 0.00 N ATOM 2280 CZ ARG A 140 -0.274 6.656 7.316 1.00 0.00 C ATOM 2281 NH1 ARG A 140 0.711 5.770 7.117 1.00 0.00 N ATOM 2282 NH2 ARG A 140 -1.506 6.230 7.628 1.00 0.00 N ATOM 0 H ARG A 140 -0.023 8.298 10.683 1.00 0.00 H new ATOM 0 HA ARG A 140 2.603 7.841 10.431 1.00 0.00 H new ATOM 0 HB2 ARG A 140 0.633 9.503 9.108 1.00 0.00 H new ATOM 0 HB3 ARG A 140 2.168 10.349 9.136 1.00 0.00 H new ATOM 0 HG2 ARG A 140 3.227 8.781 7.792 1.00 0.00 H new ATOM 0 HG3 ARG A 140 2.295 7.440 8.429 1.00 0.00 H new ATOM 0 HD2 ARG A 140 1.182 9.571 6.538 1.00 0.00 H new ATOM 0 HD3 ARG A 140 1.734 7.987 6.030 1.00 0.00 H new ATOM 0 HE ARG A 140 -0.801 8.615 7.361 1.00 0.00 H new ATOM 0 HH11 ARG A 140 1.648 6.094 6.879 1.00 0.00 H new ATOM 0 HH12 ARG A 140 0.524 4.771 7.203 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -2.256 6.905 7.779 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -1.694 5.231 7.714 1.00 0.00 H new