USER MOD reduce.3.24.130724 H: found=0, std=0, add=603, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 603 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 Single : A 73 SER OG : rot -22:sc= 0.269 USER MOD Single : A 79 ASN : amide:sc= -0.0748 X(o=-0.075,f=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 156:sc= -0.0741 (180deg=-0.466) USER MOD Single : A 95 LYS NZ :NH3+ -155:sc= -0.0938 (180deg=-0.505) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 HIS : no HD1:sc= -2.43! K(o=-2.4!,f=-1.9) USER MOD Single : A 106 LYS NZ :NH3+ -159:sc= -0.0212 (180deg=-0.232) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ -116:sc= 1.07 (180deg=-0.0567) USER MOD Single : A 130 ASN : amide:sc= -0.0684 X(o=-0.068,f=-0.13) USER MOD Single : A 131 MET CE :methyl -118:sc= -2.38! (180deg=-6.09!) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 199 N SER A 73 -4.506 3.638 6.630 1.00 0.00 N ATOM 200 CA SER A 73 -3.222 2.982 6.414 1.00 0.00 C ATOM 201 C SER A 73 -3.218 2.215 5.096 1.00 0.00 C ATOM 202 O SER A 73 -2.775 1.068 5.034 1.00 0.00 O ATOM 203 CB SER A 73 -2.909 2.032 7.572 1.00 0.00 C ATOM 204 OG SER A 73 -4.034 1.232 7.892 1.00 0.00 O ATOM 0 HA SER A 73 -2.452 3.752 6.368 1.00 0.00 H new ATOM 0 HB2 SER A 73 -2.068 1.392 7.305 1.00 0.00 H new ATOM 0 HB3 SER A 73 -2.607 2.607 8.447 1.00 0.00 H new ATOM 0 HG SER A 73 -4.849 1.670 7.570 1.00 0.00 H new ATOM 210 N ARG A 74 -3.716 2.856 4.044 1.00 0.00 N ATOM 211 CA ARG A 74 -3.772 2.234 2.726 1.00 0.00 C ATOM 212 C ARG A 74 -2.744 2.858 1.786 1.00 0.00 C ATOM 213 O ARG A 74 -2.836 4.037 1.443 1.00 0.00 O ATOM 214 CB ARG A 74 -5.174 2.375 2.131 1.00 0.00 C ATOM 215 CG ARG A 74 -6.137 1.287 2.578 1.00 0.00 C ATOM 216 CD ARG A 74 -7.421 1.311 1.763 1.00 0.00 C ATOM 217 NE ARG A 74 -7.232 0.752 0.427 1.00 0.00 N ATOM 218 CZ ARG A 74 -8.233 0.376 -0.361 1.00 0.00 C ATOM 219 NH1 ARG A 74 -9.487 0.499 0.051 1.00 0.00 N ATOM 220 NH2 ARG A 74 -7.980 -0.123 -1.564 1.00 0.00 N ATOM 0 H ARG A 74 -4.087 3.806 4.078 1.00 0.00 H new ATOM 0 HA ARG A 74 -3.538 1.176 2.841 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -5.582 3.347 2.410 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -5.101 2.360 1.044 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -5.659 0.313 2.477 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -6.372 1.419 3.634 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -8.193 0.747 2.286 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -7.778 2.337 1.679 1.00 0.00 H new ATOM 0 HE ARG A 74 -6.279 0.644 0.080 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -9.685 0.883 0.975 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -10.254 0.210 -0.556 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -7.016 -0.218 -1.884 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -8.749 -0.412 -2.169 1.00 0.00 H new ATOM 234 N LEU A 75 -1.766 2.059 1.374 1.00 0.00 N ATOM 235 CA LEU A 75 -0.720 2.533 0.474 1.00 0.00 C ATOM 236 C LEU A 75 -1.053 2.193 -0.975 1.00 0.00 C ATOM 237 O LEU A 75 -1.331 1.040 -1.305 1.00 0.00 O ATOM 238 CB LEU A 75 0.627 1.917 0.857 1.00 0.00 C ATOM 239 CG LEU A 75 1.285 2.473 2.121 1.00 0.00 C ATOM 240 CD1 LEU A 75 2.531 1.675 2.469 1.00 0.00 C ATOM 241 CD2 LEU A 75 1.625 3.945 1.941 1.00 0.00 C ATOM 0 H LEU A 75 -1.675 1.081 1.648 1.00 0.00 H new ATOM 0 HA LEU A 75 -0.658 3.617 0.569 1.00 0.00 H new ATOM 0 HB2 LEU A 75 0.489 0.843 0.985 1.00 0.00 H new ATOM 0 HB3 LEU A 75 1.316 2.053 0.023 1.00 0.00 H new ATOM 0 HG LEU A 75 0.578 2.382 2.946 1.00 0.00 H new ATOM 0 HD11 LEU A 75 2.986 2.085 3.371 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.260 0.633 2.641 1.00 0.00 H new ATOM 0 HD13 LEU A 75 3.242 1.734 1.645 1.00 0.00 H new ATOM 0 HD21 LEU A 75 2.092 4.324 2.850 1.00 0.00 H new ATOM 0 HD22 LEU A 75 2.314 4.060 1.104 1.00 0.00 H new ATOM 0 HD23 LEU A 75 0.713 4.507 1.740 1.00 0.00 H new ATOM 253 N PHE A 76 -1.022 3.205 -1.836 1.00 0.00 N ATOM 254 CA PHE A 76 -1.320 3.014 -3.251 1.00 0.00 C ATOM 255 C PHE A 76 -0.041 2.783 -4.050 1.00 0.00 C ATOM 256 O PHE A 76 0.813 3.665 -4.144 1.00 0.00 O ATOM 257 CB PHE A 76 -2.069 4.228 -3.805 1.00 0.00 C ATOM 258 CG PHE A 76 -2.387 4.119 -5.269 1.00 0.00 C ATOM 259 CD1 PHE A 76 -1.447 4.472 -6.223 1.00 0.00 C ATOM 260 CD2 PHE A 76 -3.626 3.664 -5.690 1.00 0.00 C ATOM 261 CE1 PHE A 76 -1.737 4.374 -7.571 1.00 0.00 C ATOM 262 CE2 PHE A 76 -3.922 3.563 -7.037 1.00 0.00 C ATOM 263 CZ PHE A 76 -2.975 3.918 -7.978 1.00 0.00 C ATOM 0 H PHE A 76 -0.794 4.165 -1.579 1.00 0.00 H new ATOM 0 HA PHE A 76 -1.952 2.131 -3.347 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -2.997 4.357 -3.248 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -1.469 5.123 -3.637 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -0.476 4.828 -5.910 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -4.369 3.385 -4.958 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -0.996 4.654 -8.305 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -4.892 3.207 -7.353 1.00 0.00 H new ATOM 0 HZ PHE A 76 -3.203 3.839 -9.031 1.00 0.00 H new ATOM 273 N VAL A 77 0.085 1.590 -4.623 1.00 0.00 N ATOM 274 CA VAL A 77 1.259 1.243 -5.414 1.00 0.00 C ATOM 275 C VAL A 77 0.909 1.123 -6.893 1.00 0.00 C ATOM 276 O VAL A 77 0.157 0.236 -7.294 1.00 0.00 O ATOM 277 CB VAL A 77 1.885 -0.081 -4.938 1.00 0.00 C ATOM 278 CG1 VAL A 77 3.170 -0.369 -5.699 1.00 0.00 C ATOM 279 CG2 VAL A 77 2.142 -0.039 -3.439 1.00 0.00 C ATOM 0 H VAL A 77 -0.612 0.848 -4.554 1.00 0.00 H new ATOM 0 HA VAL A 77 1.981 2.048 -5.278 1.00 0.00 H new ATOM 0 HB VAL A 77 1.182 -0.889 -5.141 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.598 -1.308 -5.349 1.00 0.00 H new ATOM 0 HG12 VAL A 77 2.953 -0.444 -6.764 1.00 0.00 H new ATOM 0 HG13 VAL A 77 3.882 0.439 -5.530 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.584 -0.982 -3.119 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.825 0.779 -3.210 1.00 0.00 H new ATOM 0 HG23 VAL A 77 1.200 0.117 -2.913 1.00 0.00 H new ATOM 289 N GLY A 78 1.462 2.023 -7.701 1.00 0.00 N ATOM 290 CA GLY A 78 1.196 2.001 -9.128 1.00 0.00 C ATOM 291 C GLY A 78 2.421 1.628 -9.940 1.00 0.00 C ATOM 292 O GLY A 78 3.514 1.480 -9.394 1.00 0.00 O ATOM 0 H GLY A 78 2.089 2.766 -7.393 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.396 1.290 -9.335 1.00 0.00 H new ATOM 0 HA3 GLY A 78 0.840 2.982 -9.443 1.00 0.00 H new ATOM 296 N ASN A 79 2.238 1.472 -11.247 1.00 0.00 N ATOM 297 CA ASN A 79 3.337 1.111 -12.135 1.00 0.00 C ATOM 298 C ASN A 79 3.892 -0.265 -11.781 1.00 0.00 C ATOM 299 O ASN A 79 5.096 -0.505 -11.880 1.00 0.00 O ATOM 300 CB ASN A 79 4.449 2.158 -12.056 1.00 0.00 C ATOM 301 CG ASN A 79 5.214 2.290 -13.359 1.00 0.00 C ATOM 302 OD1 ASN A 79 4.846 3.077 -14.231 1.00 0.00 O ATOM 303 ND2 ASN A 79 6.284 1.516 -13.498 1.00 0.00 N ATOM 0 H ASN A 79 1.339 1.590 -11.715 1.00 0.00 H new ATOM 0 HA ASN A 79 2.952 1.077 -13.154 1.00 0.00 H new ATOM 0 HB2 ASN A 79 4.017 3.123 -11.792 1.00 0.00 H new ATOM 0 HB3 ASN A 79 5.141 1.890 -11.258 1.00 0.00 H new ATOM 0 HD21 ASN A 79 6.837 1.560 -14.354 1.00 0.00 H new ATOM 0 HD22 ASN A 79 6.553 0.878 -12.749 1.00 0.00 H new ATOM 310 N LEU A 80 3.007 -1.166 -11.369 1.00 0.00 N ATOM 311 CA LEU A 80 3.408 -2.519 -11.001 1.00 0.00 C ATOM 312 C LEU A 80 3.801 -3.326 -12.235 1.00 0.00 C ATOM 313 O LEU A 80 3.161 -3.253 -13.284 1.00 0.00 O ATOM 314 CB LEU A 80 2.272 -3.225 -10.258 1.00 0.00 C ATOM 315 CG LEU A 80 2.093 -2.843 -8.788 1.00 0.00 C ATOM 316 CD1 LEU A 80 0.718 -3.260 -8.291 1.00 0.00 C ATOM 317 CD2 LEU A 80 3.184 -3.475 -7.936 1.00 0.00 C ATOM 0 H LEU A 80 2.007 -0.984 -11.281 1.00 0.00 H new ATOM 0 HA LEU A 80 4.275 -2.448 -10.344 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.339 -3.020 -10.782 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.440 -4.300 -10.315 1.00 0.00 H new ATOM 0 HG LEU A 80 2.174 -1.759 -8.702 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.609 -2.980 -7.243 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -0.049 -2.760 -8.882 1.00 0.00 H new ATOM 0 HD13 LEU A 80 0.607 -4.340 -8.391 1.00 0.00 H new ATOM 0 HD21 LEU A 80 3.041 -3.192 -6.893 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.135 -4.560 -8.028 1.00 0.00 H new ATOM 0 HD23 LEU A 80 4.159 -3.126 -8.276 1.00 0.00 H new ATOM 329 N PRO A 81 4.878 -4.115 -12.108 1.00 0.00 N ATOM 330 CA PRO A 81 5.379 -4.953 -13.202 1.00 0.00 C ATOM 331 C PRO A 81 4.443 -6.114 -13.518 1.00 0.00 C ATOM 332 O PRO A 81 3.684 -6.580 -12.668 1.00 0.00 O ATOM 333 CB PRO A 81 6.715 -5.473 -12.666 1.00 0.00 C ATOM 334 CG PRO A 81 6.572 -5.432 -11.184 1.00 0.00 C ATOM 335 CD PRO A 81 5.689 -4.251 -10.886 1.00 0.00 C ATOM 0 HA PRO A 81 5.466 -4.397 -14.135 1.00 0.00 H new ATOM 0 HB2 PRO A 81 6.915 -6.486 -13.016 1.00 0.00 H new ATOM 0 HB3 PRO A 81 7.545 -4.851 -13.001 1.00 0.00 H new ATOM 0 HG2 PRO A 81 6.129 -6.355 -10.809 1.00 0.00 H new ATOM 0 HG3 PRO A 81 7.543 -5.325 -10.701 1.00 0.00 H new ATOM 0 HD2 PRO A 81 5.067 -4.426 -10.008 1.00 0.00 H new ATOM 0 HD3 PRO A 81 6.273 -3.352 -10.689 1.00 0.00 H new ATOM 343 N PRO A 82 4.497 -6.595 -14.769 1.00 0.00 N ATOM 344 CA PRO A 82 3.661 -7.709 -15.225 1.00 0.00 C ATOM 345 C PRO A 82 4.068 -9.036 -14.593 1.00 0.00 C ATOM 346 O PRO A 82 3.463 -10.074 -14.863 1.00 0.00 O ATOM 347 CB PRO A 82 3.904 -7.740 -16.736 1.00 0.00 C ATOM 348 CG PRO A 82 5.249 -7.124 -16.915 1.00 0.00 C ATOM 349 CD PRO A 82 5.378 -6.088 -15.834 1.00 0.00 C ATOM 0 HA PRO A 82 2.615 -7.572 -14.950 1.00 0.00 H new ATOM 0 HB2 PRO A 82 3.881 -8.760 -17.120 1.00 0.00 H new ATOM 0 HB3 PRO A 82 3.137 -7.180 -17.272 1.00 0.00 H new ATOM 0 HG2 PRO A 82 6.036 -7.874 -16.832 1.00 0.00 H new ATOM 0 HG3 PRO A 82 5.343 -6.671 -17.902 1.00 0.00 H new ATOM 0 HD2 PRO A 82 6.408 -5.991 -15.491 1.00 0.00 H new ATOM 0 HD3 PRO A 82 5.064 -5.104 -16.181 1.00 0.00 H new ATOM 357 N ASP A 83 5.095 -8.995 -13.752 1.00 0.00 N ATOM 358 CA ASP A 83 5.582 -10.194 -13.080 1.00 0.00 C ATOM 359 C ASP A 83 5.408 -10.079 -11.569 1.00 0.00 C ATOM 360 O ASP A 83 6.193 -10.634 -10.800 1.00 0.00 O ATOM 361 CB ASP A 83 7.054 -10.433 -13.420 1.00 0.00 C ATOM 362 CG ASP A 83 7.282 -10.621 -14.906 1.00 0.00 C ATOM 363 OD1 ASP A 83 6.358 -11.107 -15.591 1.00 0.00 O ATOM 364 OD2 ASP A 83 8.385 -10.284 -15.386 1.00 0.00 O ATOM 0 H ASP A 83 5.607 -8.144 -13.519 1.00 0.00 H new ATOM 0 HA ASP A 83 4.994 -11.042 -13.432 1.00 0.00 H new ATOM 0 HB2 ASP A 83 7.647 -9.588 -13.069 1.00 0.00 H new ATOM 0 HB3 ASP A 83 7.408 -11.315 -12.887 1.00 0.00 H new ATOM 369 N ILE A 84 4.375 -9.355 -11.151 1.00 0.00 N ATOM 370 CA ILE A 84 4.098 -9.168 -9.732 1.00 0.00 C ATOM 371 C ILE A 84 2.926 -10.033 -9.282 1.00 0.00 C ATOM 372 O ILE A 84 1.884 -10.077 -9.937 1.00 0.00 O ATOM 373 CB ILE A 84 3.788 -7.694 -9.409 1.00 0.00 C ATOM 374 CG1 ILE A 84 3.577 -7.513 -7.904 1.00 0.00 C ATOM 375 CG2 ILE A 84 2.563 -7.229 -10.181 1.00 0.00 C ATOM 376 CD1 ILE A 84 4.862 -7.304 -7.134 1.00 0.00 C ATOM 0 H ILE A 84 3.716 -8.888 -11.775 1.00 0.00 H new ATOM 0 HA ILE A 84 4.996 -9.469 -9.193 1.00 0.00 H new ATOM 0 HB ILE A 84 4.638 -7.084 -9.714 1.00 0.00 H new ATOM 0 HG12 ILE A 84 2.920 -6.659 -7.738 1.00 0.00 H new ATOM 0 HG13 ILE A 84 3.065 -8.390 -7.509 1.00 0.00 H new ATOM 0 HG21 ILE A 84 2.357 -6.186 -9.942 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.748 -7.327 -11.251 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.705 -7.841 -9.904 1.00 0.00 H new ATOM 0 HD11 ILE A 84 4.636 -7.183 -6.075 1.00 0.00 H new ATOM 0 HD12 ILE A 84 5.512 -8.168 -7.270 1.00 0.00 H new ATOM 0 HD13 ILE A 84 5.365 -6.410 -7.502 1.00 0.00 H new ATOM 388 N THR A 85 3.101 -10.719 -8.157 1.00 0.00 N ATOM 389 CA THR A 85 2.058 -11.582 -7.617 1.00 0.00 C ATOM 390 C THR A 85 1.862 -11.341 -6.125 1.00 0.00 C ATOM 391 O THR A 85 2.682 -10.689 -5.480 1.00 0.00 O ATOM 392 CB THR A 85 2.386 -13.070 -7.846 1.00 0.00 C ATOM 393 OG1 THR A 85 3.550 -13.436 -7.096 1.00 0.00 O ATOM 394 CG2 THR A 85 2.619 -13.352 -9.323 1.00 0.00 C ATOM 0 H THR A 85 3.956 -10.694 -7.602 1.00 0.00 H new ATOM 0 HA THR A 85 1.138 -11.334 -8.146 1.00 0.00 H new ATOM 0 HB THR A 85 1.536 -13.663 -7.509 1.00 0.00 H new ATOM 0 HG1 THR A 85 3.751 -14.383 -7.245 1.00 0.00 H new ATOM 0 HG21 THR A 85 2.849 -14.409 -9.460 1.00 0.00 H new ATOM 0 HG22 THR A 85 1.721 -13.100 -9.888 1.00 0.00 H new ATOM 0 HG23 THR A 85 3.454 -12.750 -9.681 1.00 0.00 H new ATOM 402 N GLU A 86 0.770 -11.871 -5.583 1.00 0.00 N ATOM 403 CA GLU A 86 0.467 -11.712 -4.165 1.00 0.00 C ATOM 404 C GLU A 86 1.672 -12.086 -3.306 1.00 0.00 C ATOM 405 O GLU A 86 1.899 -11.498 -2.249 1.00 0.00 O ATOM 406 CB GLU A 86 -0.736 -12.574 -3.778 1.00 0.00 C ATOM 407 CG GLU A 86 -1.418 -12.126 -2.496 1.00 0.00 C ATOM 408 CD GLU A 86 -2.858 -12.593 -2.408 1.00 0.00 C ATOM 409 OE1 GLU A 86 -3.093 -13.815 -2.509 1.00 0.00 O ATOM 410 OE2 GLU A 86 -3.750 -11.736 -2.237 1.00 0.00 O ATOM 0 H GLU A 86 0.081 -12.414 -6.104 1.00 0.00 H new ATOM 0 HA GLU A 86 0.226 -10.664 -3.986 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -1.462 -12.556 -4.591 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -0.410 -13.608 -3.664 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -0.863 -12.509 -1.640 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -1.388 -11.038 -2.434 1.00 0.00 H new ATOM 417 N GLU A 87 2.439 -13.068 -3.769 1.00 0.00 N ATOM 418 CA GLU A 87 3.620 -13.521 -3.043 1.00 0.00 C ATOM 419 C GLU A 87 4.661 -12.409 -2.949 1.00 0.00 C ATOM 420 O GLU A 87 5.096 -12.043 -1.857 1.00 0.00 O ATOM 421 CB GLU A 87 4.227 -14.747 -3.726 1.00 0.00 C ATOM 422 CG GLU A 87 3.651 -16.065 -3.236 1.00 0.00 C ATOM 423 CD GLU A 87 4.348 -16.580 -1.992 1.00 0.00 C ATOM 424 OE1 GLU A 87 5.590 -16.472 -1.920 1.00 0.00 O ATOM 425 OE2 GLU A 87 3.651 -17.090 -1.090 1.00 0.00 O ATOM 0 H GLU A 87 2.264 -13.565 -4.643 1.00 0.00 H new ATOM 0 HA GLU A 87 3.312 -13.793 -2.033 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.069 -14.669 -4.802 1.00 0.00 H new ATOM 0 HB3 GLU A 87 5.305 -14.748 -3.562 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.589 -15.937 -3.026 1.00 0.00 H new ATOM 0 HG3 GLU A 87 3.732 -16.809 -4.028 1.00 0.00 H new ATOM 432 N GLU A 88 5.056 -11.878 -4.101 1.00 0.00 N ATOM 433 CA GLU A 88 6.047 -10.809 -4.149 1.00 0.00 C ATOM 434 C GLU A 88 5.630 -9.640 -3.262 1.00 0.00 C ATOM 435 O GLU A 88 6.388 -9.202 -2.398 1.00 0.00 O ATOM 436 CB GLU A 88 6.242 -10.328 -5.588 1.00 0.00 C ATOM 437 CG GLU A 88 7.283 -11.121 -6.360 1.00 0.00 C ATOM 438 CD GLU A 88 7.848 -10.351 -7.538 1.00 0.00 C ATOM 439 OE1 GLU A 88 7.095 -9.562 -8.146 1.00 0.00 O ATOM 440 OE2 GLU A 88 9.042 -10.537 -7.852 1.00 0.00 O ATOM 0 H GLU A 88 4.706 -12.170 -5.013 1.00 0.00 H new ATOM 0 HA GLU A 88 6.991 -11.207 -3.776 1.00 0.00 H new ATOM 0 HB2 GLU A 88 5.289 -10.387 -6.114 1.00 0.00 H new ATOM 0 HB3 GLU A 88 6.534 -9.278 -5.575 1.00 0.00 H new ATOM 0 HG2 GLU A 88 8.096 -11.397 -5.688 1.00 0.00 H new ATOM 0 HG3 GLU A 88 6.836 -12.048 -6.718 1.00 0.00 H new ATOM 447 N MET A 89 4.419 -9.140 -3.484 1.00 0.00 N ATOM 448 CA MET A 89 3.900 -8.022 -2.704 1.00 0.00 C ATOM 449 C MET A 89 4.123 -8.249 -1.213 1.00 0.00 C ATOM 450 O MET A 89 4.691 -7.401 -0.524 1.00 0.00 O ATOM 451 CB MET A 89 2.409 -7.825 -2.985 1.00 0.00 C ATOM 452 CG MET A 89 1.941 -6.389 -2.810 1.00 0.00 C ATOM 453 SD MET A 89 2.147 -5.404 -4.306 1.00 0.00 S ATOM 454 CE MET A 89 1.211 -3.939 -3.878 1.00 0.00 C ATOM 0 H MET A 89 3.779 -9.491 -4.197 1.00 0.00 H new ATOM 0 HA MET A 89 4.440 -7.123 -3.001 1.00 0.00 H new ATOM 0 HB2 MET A 89 2.194 -8.147 -4.004 1.00 0.00 H new ATOM 0 HB3 MET A 89 1.834 -8.469 -2.320 1.00 0.00 H new ATOM 0 HG2 MET A 89 0.890 -6.386 -2.520 1.00 0.00 H new ATOM 0 HG3 MET A 89 2.498 -5.926 -1.995 1.00 0.00 H new ATOM 0 HE1 MET A 89 1.244 -3.231 -4.706 1.00 0.00 H new ATOM 0 HE2 MET A 89 0.176 -4.215 -3.677 1.00 0.00 H new ATOM 0 HE3 MET A 89 1.643 -3.478 -2.990 1.00 0.00 H new ATOM 464 N ARG A 90 3.672 -9.398 -0.720 1.00 0.00 N ATOM 465 CA ARG A 90 3.821 -9.735 0.691 1.00 0.00 C ATOM 466 C ARG A 90 5.262 -9.530 1.149 1.00 0.00 C ATOM 467 O ARG A 90 5.534 -8.719 2.035 1.00 0.00 O ATOM 468 CB ARG A 90 3.397 -11.184 0.939 1.00 0.00 C ATOM 469 CG ARG A 90 2.831 -11.423 2.329 1.00 0.00 C ATOM 470 CD ARG A 90 2.548 -12.898 2.568 1.00 0.00 C ATOM 471 NE ARG A 90 3.771 -13.696 2.573 1.00 0.00 N ATOM 472 CZ ARG A 90 3.864 -14.895 3.137 1.00 0.00 C ATOM 473 NH1 ARG A 90 2.811 -15.432 3.739 1.00 0.00 N ATOM 474 NH2 ARG A 90 5.011 -15.560 3.100 1.00 0.00 N ATOM 0 H ARG A 90 3.201 -10.111 -1.277 1.00 0.00 H new ATOM 0 HA ARG A 90 3.176 -9.071 1.267 1.00 0.00 H new ATOM 0 HB2 ARG A 90 2.649 -11.467 0.198 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.257 -11.836 0.789 1.00 0.00 H new ATOM 0 HG2 ARG A 90 3.536 -11.060 3.077 1.00 0.00 H new ATOM 0 HG3 ARG A 90 1.912 -10.850 2.452 1.00 0.00 H new ATOM 0 HD2 ARG A 90 2.033 -13.018 3.521 1.00 0.00 H new ATOM 0 HD3 ARG A 90 1.877 -13.268 1.793 1.00 0.00 H new ATOM 0 HE ARG A 90 4.599 -13.312 2.118 1.00 0.00 H new ATOM 0 HH11 ARG A 90 1.927 -14.924 3.770 1.00 0.00 H new ATOM 0 HH12 ARG A 90 2.885 -16.353 4.171 1.00 0.00 H new ATOM 0 HH21 ARG A 90 5.823 -15.151 2.638 1.00 0.00 H new ATOM 0 HH22 ARG A 90 5.081 -16.481 3.534 1.00 0.00 H new ATOM 488 N LYS A 91 6.182 -10.270 0.541 1.00 0.00 N ATOM 489 CA LYS A 91 7.595 -10.170 0.884 1.00 0.00 C ATOM 490 C LYS A 91 8.059 -8.717 0.864 1.00 0.00 C ATOM 491 O LYS A 91 8.894 -8.310 1.673 1.00 0.00 O ATOM 492 CB LYS A 91 8.438 -10.999 -0.088 1.00 0.00 C ATOM 493 CG LYS A 91 9.788 -11.408 0.474 1.00 0.00 C ATOM 494 CD LYS A 91 10.733 -11.866 -0.625 1.00 0.00 C ATOM 495 CE LYS A 91 11.799 -12.808 -0.086 1.00 0.00 C ATOM 496 NZ LYS A 91 11.218 -14.099 0.375 1.00 0.00 N ATOM 0 H LYS A 91 5.974 -10.947 -0.193 1.00 0.00 H new ATOM 0 HA LYS A 91 7.726 -10.561 1.893 1.00 0.00 H new ATOM 0 HB2 LYS A 91 7.882 -11.895 -0.365 1.00 0.00 H new ATOM 0 HB3 LYS A 91 8.593 -10.425 -1.002 1.00 0.00 H new ATOM 0 HG2 LYS A 91 10.230 -10.568 1.009 1.00 0.00 H new ATOM 0 HG3 LYS A 91 9.654 -12.212 1.198 1.00 0.00 H new ATOM 0 HD2 LYS A 91 10.165 -12.367 -1.409 1.00 0.00 H new ATOM 0 HD3 LYS A 91 11.210 -10.999 -1.082 1.00 0.00 H new ATOM 0 HE2 LYS A 91 12.540 -13.000 -0.862 1.00 0.00 H new ATOM 0 HE3 LYS A 91 12.322 -12.329 0.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 11.949 -14.838 0.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 10.868 -13.994 1.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 10.431 -14.368 -0.249 1.00 0.00 H new ATOM 510 N LEU A 92 7.512 -7.940 -0.064 1.00 0.00 N ATOM 511 CA LEU A 92 7.869 -6.531 -0.189 1.00 0.00 C ATOM 512 C LEU A 92 7.359 -5.732 1.006 1.00 0.00 C ATOM 513 O LEU A 92 7.922 -4.696 1.360 1.00 0.00 O ATOM 514 CB LEU A 92 7.298 -5.953 -1.485 1.00 0.00 C ATOM 515 CG LEU A 92 8.061 -6.293 -2.765 1.00 0.00 C ATOM 516 CD1 LEU A 92 7.318 -5.769 -3.985 1.00 0.00 C ATOM 517 CD2 LEU A 92 9.471 -5.724 -2.713 1.00 0.00 C ATOM 0 H LEU A 92 6.820 -8.261 -0.741 1.00 0.00 H new ATOM 0 HA LEU A 92 8.956 -6.458 -0.214 1.00 0.00 H new ATOM 0 HB2 LEU A 92 6.271 -6.303 -1.594 1.00 0.00 H new ATOM 0 HB3 LEU A 92 7.256 -4.868 -1.388 1.00 0.00 H new ATOM 0 HG LEU A 92 8.131 -7.378 -2.845 1.00 0.00 H new ATOM 0 HD11 LEU A 92 7.876 -6.020 -4.887 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.329 -6.224 -4.032 1.00 0.00 H new ATOM 0 HD13 LEU A 92 7.216 -4.686 -3.912 1.00 0.00 H new ATOM 0 HD21 LEU A 92 9.999 -5.976 -3.633 1.00 0.00 H new ATOM 0 HD22 LEU A 92 9.422 -4.640 -2.608 1.00 0.00 H new ATOM 0 HD23 LEU A 92 10.003 -6.148 -1.861 1.00 0.00 H new ATOM 529 N PHE A 93 6.290 -6.222 1.626 1.00 0.00 N ATOM 530 CA PHE A 93 5.704 -5.555 2.782 1.00 0.00 C ATOM 531 C PHE A 93 5.727 -6.467 4.006 1.00 0.00 C ATOM 532 O PHE A 93 4.914 -6.318 4.918 1.00 0.00 O ATOM 533 CB PHE A 93 4.267 -5.127 2.477 1.00 0.00 C ATOM 534 CG PHE A 93 4.173 -4.012 1.476 1.00 0.00 C ATOM 535 CD1 PHE A 93 4.456 -4.238 0.139 1.00 0.00 C ATOM 536 CD2 PHE A 93 3.801 -2.737 1.872 1.00 0.00 C ATOM 537 CE1 PHE A 93 4.371 -3.213 -0.784 1.00 0.00 C ATOM 538 CE2 PHE A 93 3.714 -1.708 0.953 1.00 0.00 C ATOM 539 CZ PHE A 93 3.998 -1.947 -0.377 1.00 0.00 C ATOM 0 H PHE A 93 5.812 -7.079 1.347 1.00 0.00 H new ATOM 0 HA PHE A 93 6.301 -4.669 3.000 1.00 0.00 H new ATOM 0 HB2 PHE A 93 3.712 -5.987 2.104 1.00 0.00 H new ATOM 0 HB3 PHE A 93 3.785 -4.814 3.403 1.00 0.00 H new ATOM 0 HD1 PHE A 93 4.746 -5.226 -0.186 1.00 0.00 H new ATOM 0 HD2 PHE A 93 3.576 -2.545 2.911 1.00 0.00 H new ATOM 0 HE1 PHE A 93 4.596 -3.402 -1.823 1.00 0.00 H new ATOM 0 HE2 PHE A 93 3.424 -0.719 1.275 1.00 0.00 H new ATOM 0 HZ PHE A 93 3.929 -1.146 -1.098 1.00 0.00 H new ATOM 549 N GLU A 94 6.663 -7.410 4.016 1.00 0.00 N ATOM 550 CA GLU A 94 6.791 -8.347 5.126 1.00 0.00 C ATOM 551 C GLU A 94 7.535 -7.708 6.294 1.00 0.00 C ATOM 552 O GLU A 94 7.061 -7.721 7.430 1.00 0.00 O ATOM 553 CB GLU A 94 7.521 -9.613 4.673 1.00 0.00 C ATOM 554 CG GLU A 94 6.591 -10.711 4.185 1.00 0.00 C ATOM 555 CD GLU A 94 7.276 -12.061 4.100 1.00 0.00 C ATOM 556 OE1 GLU A 94 8.187 -12.212 3.259 1.00 0.00 O ATOM 557 OE2 GLU A 94 6.903 -12.966 4.875 1.00 0.00 O ATOM 0 H GLU A 94 7.344 -7.546 3.269 1.00 0.00 H new ATOM 0 HA GLU A 94 5.788 -8.615 5.459 1.00 0.00 H new ATOM 0 HB2 GLU A 94 8.216 -9.355 3.874 1.00 0.00 H new ATOM 0 HB3 GLU A 94 8.117 -9.995 5.502 1.00 0.00 H new ATOM 0 HG2 GLU A 94 5.736 -10.783 4.857 1.00 0.00 H new ATOM 0 HG3 GLU A 94 6.202 -10.443 3.203 1.00 0.00 H new ATOM 564 N LYS A 95 8.706 -7.148 6.007 1.00 0.00 N ATOM 565 CA LYS A 95 9.518 -6.502 7.032 1.00 0.00 C ATOM 566 C LYS A 95 8.650 -5.661 7.963 1.00 0.00 C ATOM 567 O LYS A 95 8.995 -5.450 9.126 1.00 0.00 O ATOM 568 CB LYS A 95 10.590 -5.624 6.384 1.00 0.00 C ATOM 569 CG LYS A 95 11.687 -5.195 7.343 1.00 0.00 C ATOM 570 CD LYS A 95 12.367 -3.919 6.878 1.00 0.00 C ATOM 571 CE LYS A 95 12.883 -3.102 8.053 1.00 0.00 C ATOM 572 NZ LYS A 95 11.772 -2.567 8.888 1.00 0.00 N ATOM 0 H LYS A 95 9.114 -7.129 5.072 1.00 0.00 H new ATOM 0 HA LYS A 95 10.003 -7.281 7.621 1.00 0.00 H new ATOM 0 HB2 LYS A 95 11.038 -6.167 5.552 1.00 0.00 H new ATOM 0 HB3 LYS A 95 10.116 -4.736 5.966 1.00 0.00 H new ATOM 0 HG2 LYS A 95 11.264 -5.042 8.336 1.00 0.00 H new ATOM 0 HG3 LYS A 95 12.426 -5.991 7.431 1.00 0.00 H new ATOM 0 HD2 LYS A 95 13.195 -4.168 6.215 1.00 0.00 H new ATOM 0 HD3 LYS A 95 11.664 -3.321 6.299 1.00 0.00 H new ATOM 0 HE2 LYS A 95 13.534 -3.723 8.669 1.00 0.00 H new ATOM 0 HE3 LYS A 95 13.489 -2.275 7.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 12.094 -1.714 9.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 10.964 -2.327 8.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 11.481 -3.286 9.581 1.00 0.00 H new ATOM 586 N TYR A 96 7.524 -5.185 7.445 1.00 0.00 N ATOM 587 CA TYR A 96 6.608 -4.365 8.230 1.00 0.00 C ATOM 588 C TYR A 96 5.363 -5.158 8.616 1.00 0.00 C ATOM 589 O TYR A 96 4.259 -4.618 8.662 1.00 0.00 O ATOM 590 CB TYR A 96 6.207 -3.116 7.444 1.00 0.00 C ATOM 591 CG TYR A 96 7.276 -2.631 6.491 1.00 0.00 C ATOM 592 CD1 TYR A 96 8.269 -1.757 6.916 1.00 0.00 C ATOM 593 CD2 TYR A 96 7.294 -3.048 5.166 1.00 0.00 C ATOM 594 CE1 TYR A 96 9.247 -1.311 6.048 1.00 0.00 C ATOM 595 CE2 TYR A 96 8.269 -2.608 4.292 1.00 0.00 C ATOM 596 CZ TYR A 96 9.243 -1.739 4.737 1.00 0.00 C ATOM 597 OH TYR A 96 10.216 -1.298 3.870 1.00 0.00 O ATOM 0 H TYR A 96 7.223 -5.352 6.485 1.00 0.00 H new ATOM 0 HA TYR A 96 7.122 -4.062 9.142 1.00 0.00 H new ATOM 0 HB2 TYR A 96 5.299 -3.328 6.880 1.00 0.00 H new ATOM 0 HB3 TYR A 96 5.968 -2.317 8.145 1.00 0.00 H new ATOM 0 HD1 TYR A 96 8.276 -1.421 7.942 1.00 0.00 H new ATOM 0 HD2 TYR A 96 6.533 -3.728 4.813 1.00 0.00 H new ATOM 0 HE1 TYR A 96 10.011 -0.631 6.394 1.00 0.00 H new ATOM 0 HE2 TYR A 96 8.269 -2.943 3.265 1.00 0.00 H new ATOM 0 HH TYR A 96 10.070 -1.694 2.986 1.00 0.00 H new ATOM 607 N GLY A 97 5.551 -6.445 8.894 1.00 0.00 N ATOM 608 CA GLY A 97 4.436 -7.292 9.274 1.00 0.00 C ATOM 609 C GLY A 97 3.638 -7.772 8.077 1.00 0.00 C ATOM 610 O GLY A 97 4.087 -7.658 6.936 1.00 0.00 O ATOM 0 H GLY A 97 6.455 -6.916 8.863 1.00 0.00 H new ATOM 0 HA2 GLY A 97 4.810 -8.154 9.827 1.00 0.00 H new ATOM 0 HA3 GLY A 97 3.779 -6.742 9.948 1.00 0.00 H new ATOM 614 N LYS A 98 2.452 -8.311 8.336 1.00 0.00 N ATOM 615 CA LYS A 98 1.589 -8.810 7.272 1.00 0.00 C ATOM 616 C LYS A 98 0.537 -7.773 6.893 1.00 0.00 C ATOM 617 O LYS A 98 -0.073 -7.148 7.760 1.00 0.00 O ATOM 618 CB LYS A 98 0.906 -10.108 7.708 1.00 0.00 C ATOM 619 CG LYS A 98 1.873 -11.257 7.937 1.00 0.00 C ATOM 620 CD LYS A 98 1.177 -12.603 7.827 1.00 0.00 C ATOM 621 CE LYS A 98 2.136 -13.751 8.101 1.00 0.00 C ATOM 622 NZ LYS A 98 1.712 -15.004 7.416 1.00 0.00 N ATOM 0 H LYS A 98 2.066 -8.414 9.275 1.00 0.00 H new ATOM 0 HA LYS A 98 2.210 -9.008 6.398 1.00 0.00 H new ATOM 0 HB2 LYS A 98 0.349 -9.925 8.627 1.00 0.00 H new ATOM 0 HB3 LYS A 98 0.181 -10.400 6.948 1.00 0.00 H new ATOM 0 HG2 LYS A 98 2.681 -11.204 7.208 1.00 0.00 H new ATOM 0 HG3 LYS A 98 2.327 -11.161 8.923 1.00 0.00 H new ATOM 0 HD2 LYS A 98 0.348 -12.644 8.533 1.00 0.00 H new ATOM 0 HD3 LYS A 98 0.752 -12.713 6.830 1.00 0.00 H new ATOM 0 HE2 LYS A 98 3.137 -13.476 7.768 1.00 0.00 H new ATOM 0 HE3 LYS A 98 2.195 -13.926 9.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 2.391 -15.762 7.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 0.768 -15.281 7.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 1.680 -14.844 6.389 1.00 0.00 H new ATOM 636 N ALA A 99 0.329 -7.596 5.592 1.00 0.00 N ATOM 637 CA ALA A 99 -0.652 -6.637 5.099 1.00 0.00 C ATOM 638 C ALA A 99 -2.072 -7.159 5.287 1.00 0.00 C ATOM 639 O ALA A 99 -2.385 -8.287 4.908 1.00 0.00 O ATOM 640 CB ALA A 99 -0.392 -6.324 3.633 1.00 0.00 C ATOM 0 H ALA A 99 0.827 -8.104 4.861 1.00 0.00 H new ATOM 0 HA ALA A 99 -0.551 -5.720 5.679 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -1.132 -5.607 3.277 1.00 0.00 H new ATOM 0 HB2 ALA A 99 0.606 -5.901 3.523 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -0.464 -7.240 3.047 1.00 0.00 H new ATOM 646 N GLY A 100 -2.929 -6.330 5.875 1.00 0.00 N ATOM 647 CA GLY A 100 -4.307 -6.726 6.104 1.00 0.00 C ATOM 648 C GLY A 100 -5.060 -6.976 4.812 1.00 0.00 C ATOM 649 O GLY A 100 -5.817 -7.940 4.705 1.00 0.00 O ATOM 0 H GLY A 100 -2.694 -5.391 6.197 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -4.326 -7.630 6.713 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -4.816 -5.948 6.673 1.00 0.00 H new ATOM 653 N GLU A 101 -4.854 -6.104 3.830 1.00 0.00 N ATOM 654 CA GLU A 101 -5.522 -6.235 2.541 1.00 0.00 C ATOM 655 C GLU A 101 -4.520 -6.127 1.395 1.00 0.00 C ATOM 656 O GLU A 101 -3.702 -5.208 1.355 1.00 0.00 O ATOM 657 CB GLU A 101 -6.603 -5.161 2.390 1.00 0.00 C ATOM 658 CG GLU A 101 -7.641 -5.487 1.329 1.00 0.00 C ATOM 659 CD GLU A 101 -8.915 -4.681 1.493 1.00 0.00 C ATOM 660 OE1 GLU A 101 -9.669 -4.951 2.451 1.00 0.00 O ATOM 661 OE2 GLU A 101 -9.157 -3.781 0.662 1.00 0.00 O ATOM 0 H GLU A 101 -4.230 -5.300 3.903 1.00 0.00 H new ATOM 0 HA GLU A 101 -5.989 -7.219 2.501 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -7.105 -5.026 3.348 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -6.128 -4.212 2.142 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -7.219 -5.296 0.342 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -7.879 -6.550 1.374 1.00 0.00 H new ATOM 668 N VAL A 102 -4.590 -7.074 0.465 1.00 0.00 N ATOM 669 CA VAL A 102 -3.690 -7.086 -0.682 1.00 0.00 C ATOM 670 C VAL A 102 -4.464 -7.244 -1.986 1.00 0.00 C ATOM 671 O VAL A 102 -5.159 -8.240 -2.192 1.00 0.00 O ATOM 672 CB VAL A 102 -2.655 -8.222 -0.571 1.00 0.00 C ATOM 673 CG1 VAL A 102 -1.877 -8.364 -1.871 1.00 0.00 C ATOM 674 CG2 VAL A 102 -1.715 -7.973 0.598 1.00 0.00 C ATOM 0 H VAL A 102 -5.260 -7.843 0.483 1.00 0.00 H new ATOM 0 HA VAL A 102 -3.169 -6.129 -0.686 1.00 0.00 H new ATOM 0 HB VAL A 102 -3.185 -9.157 -0.389 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -1.151 -9.171 -1.774 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -2.566 -8.592 -2.684 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -1.356 -7.431 -2.087 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.991 -8.785 0.662 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -1.190 -7.029 0.448 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -2.289 -7.926 1.523 1.00 0.00 H new ATOM 684 N PHE A 103 -4.338 -6.256 -2.866 1.00 0.00 N ATOM 685 CA PHE A 103 -5.027 -6.284 -4.151 1.00 0.00 C ATOM 686 C PHE A 103 -4.090 -5.861 -5.279 1.00 0.00 C ATOM 687 O PHE A 103 -3.526 -4.767 -5.253 1.00 0.00 O ATOM 688 CB PHE A 103 -6.251 -5.368 -4.118 1.00 0.00 C ATOM 689 CG PHE A 103 -7.442 -5.982 -3.439 1.00 0.00 C ATOM 690 CD1 PHE A 103 -8.109 -7.051 -4.014 1.00 0.00 C ATOM 691 CD2 PHE A 103 -7.893 -5.489 -2.225 1.00 0.00 C ATOM 692 CE1 PHE A 103 -9.205 -7.619 -3.391 1.00 0.00 C ATOM 693 CE2 PHE A 103 -8.988 -6.053 -1.597 1.00 0.00 C ATOM 694 CZ PHE A 103 -9.645 -7.118 -2.182 1.00 0.00 C ATOM 0 H PHE A 103 -3.765 -5.426 -2.713 1.00 0.00 H new ATOM 0 HA PHE A 103 -5.354 -7.307 -4.338 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -5.988 -4.442 -3.606 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -6.523 -5.101 -5.139 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -7.769 -7.446 -4.960 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -7.384 -4.655 -1.765 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -9.716 -8.453 -3.849 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -9.329 -5.661 -0.650 1.00 0.00 H new ATOM 0 HZ PHE A 103 -10.502 -7.558 -1.694 1.00 0.00 H new ATOM 704 N ILE A 104 -3.930 -6.735 -6.266 1.00 0.00 N ATOM 705 CA ILE A 104 -3.063 -6.452 -7.403 1.00 0.00 C ATOM 706 C ILE A 104 -3.817 -6.601 -8.720 1.00 0.00 C ATOM 707 O ILE A 104 -4.224 -7.702 -9.094 1.00 0.00 O ATOM 708 CB ILE A 104 -1.835 -7.381 -7.420 1.00 0.00 C ATOM 709 CG1 ILE A 104 -1.054 -7.254 -6.110 1.00 0.00 C ATOM 710 CG2 ILE A 104 -0.942 -7.058 -8.608 1.00 0.00 C ATOM 711 CD1 ILE A 104 -0.064 -8.375 -5.885 1.00 0.00 C ATOM 0 H ILE A 104 -4.389 -7.645 -6.302 1.00 0.00 H new ATOM 0 HA ILE A 104 -2.727 -5.421 -7.294 1.00 0.00 H new ATOM 0 HB ILE A 104 -2.179 -8.411 -7.518 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -0.521 -6.303 -6.105 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -1.758 -7.229 -5.278 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -0.079 -7.723 -8.606 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -1.503 -7.195 -9.533 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -0.604 -6.024 -8.538 1.00 0.00 H new ATOM 0 HD11 ILE A 104 0.453 -8.219 -4.938 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -0.593 -9.328 -5.857 1.00 0.00 H new ATOM 0 HD13 ILE A 104 0.663 -8.387 -6.697 1.00 0.00 H new ATOM 723 N HIS A 105 -3.999 -5.487 -9.421 1.00 0.00 N ATOM 724 CA HIS A 105 -4.702 -5.493 -10.699 1.00 0.00 C ATOM 725 C HIS A 105 -3.720 -5.370 -11.860 1.00 0.00 C ATOM 726 O HIS A 105 -3.031 -4.359 -12.000 1.00 0.00 O ATOM 727 CB HIS A 105 -5.719 -4.353 -10.752 1.00 0.00 C ATOM 728 CG HIS A 105 -6.898 -4.641 -11.629 1.00 0.00 C ATOM 729 ND1 HIS A 105 -7.595 -3.659 -12.301 1.00 0.00 N ATOM 730 CD2 HIS A 105 -7.502 -5.811 -11.943 1.00 0.00 C ATOM 731 CE1 HIS A 105 -8.577 -4.212 -12.989 1.00 0.00 C ATOM 732 NE2 HIS A 105 -8.543 -5.517 -12.789 1.00 0.00 N ATOM 0 H HIS A 105 -3.669 -4.568 -9.126 1.00 0.00 H new ATOM 0 HA HIS A 105 -5.229 -6.443 -10.791 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -6.071 -4.144 -9.742 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -5.223 -3.451 -11.110 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -7.218 -6.793 -11.593 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -9.287 -3.686 -13.610 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -9.186 -6.196 -13.197 1.00 0.00 H new ATOM 740 N LYS A 106 -3.661 -6.405 -12.692 1.00 0.00 N ATOM 741 CA LYS A 106 -2.765 -6.413 -13.841 1.00 0.00 C ATOM 742 C LYS A 106 -3.439 -5.794 -15.062 1.00 0.00 C ATOM 743 O LYS A 106 -2.774 -5.425 -16.030 1.00 0.00 O ATOM 744 CB LYS A 106 -2.323 -7.843 -14.160 1.00 0.00 C ATOM 745 CG LYS A 106 -3.432 -8.708 -14.734 1.00 0.00 C ATOM 746 CD LYS A 106 -2.873 -9.896 -15.500 1.00 0.00 C ATOM 747 CE LYS A 106 -2.648 -9.557 -16.966 1.00 0.00 C ATOM 748 NZ LYS A 106 -3.932 -9.399 -17.702 1.00 0.00 N ATOM 0 H LYS A 106 -4.224 -7.249 -12.591 1.00 0.00 H new ATOM 0 HA LYS A 106 -1.889 -5.816 -13.590 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -1.496 -7.809 -14.869 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -1.944 -8.309 -13.250 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -4.072 -9.063 -13.927 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -4.057 -8.108 -15.396 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -1.932 -10.211 -15.049 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -3.561 -10.738 -15.421 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -2.071 -8.636 -17.041 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -2.056 -10.343 -17.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -3.766 -9.524 -18.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -4.612 -10.114 -17.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -4.317 -8.449 -17.528 1.00 0.00 H new ATOM 762 N ASP A 107 -4.762 -5.683 -15.008 1.00 0.00 N ATOM 763 CA ASP A 107 -5.526 -5.106 -16.108 1.00 0.00 C ATOM 764 C ASP A 107 -5.187 -3.630 -16.290 1.00 0.00 C ATOM 765 O ASP A 107 -4.753 -3.209 -17.362 1.00 0.00 O ATOM 766 CB ASP A 107 -7.025 -5.271 -15.857 1.00 0.00 C ATOM 767 CG ASP A 107 -7.867 -4.499 -16.854 1.00 0.00 C ATOM 768 OD1 ASP A 107 -8.086 -5.015 -17.970 1.00 0.00 O ATOM 769 OD2 ASP A 107 -8.307 -3.380 -16.518 1.00 0.00 O ATOM 0 H ASP A 107 -5.327 -5.985 -14.214 1.00 0.00 H new ATOM 0 HA ASP A 107 -5.258 -5.637 -17.022 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -7.285 -6.328 -15.908 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -7.261 -4.933 -14.848 1.00 0.00 H new ATOM 774 N LYS A 108 -5.390 -2.848 -15.235 1.00 0.00 N ATOM 775 CA LYS A 108 -5.106 -1.418 -15.277 1.00 0.00 C ATOM 776 C LYS A 108 -3.635 -1.146 -14.981 1.00 0.00 C ATOM 777 O LYS A 108 -3.074 -0.150 -15.435 1.00 0.00 O ATOM 778 CB LYS A 108 -5.986 -0.673 -14.270 1.00 0.00 C ATOM 779 CG LYS A 108 -7.417 -0.478 -14.741 1.00 0.00 C ATOM 780 CD LYS A 108 -7.571 0.807 -15.538 1.00 0.00 C ATOM 781 CE LYS A 108 -9.005 1.005 -16.004 1.00 0.00 C ATOM 782 NZ LYS A 108 -9.871 1.545 -14.919 1.00 0.00 N ATOM 0 H LYS A 108 -5.750 -3.180 -14.340 1.00 0.00 H new ATOM 0 HA LYS A 108 -5.328 -1.058 -16.282 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -5.994 -1.224 -13.329 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -5.544 0.302 -14.065 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -7.718 -1.327 -15.355 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -8.085 -0.455 -13.880 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -7.266 1.655 -14.925 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -6.907 0.783 -16.402 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -9.020 1.687 -16.854 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -9.409 0.054 -16.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -10.840 1.666 -15.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -9.877 0.882 -14.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -9.501 2.465 -14.605 1.00 0.00 H new ATOM 796 N GLY A 109 -3.014 -2.040 -14.217 1.00 0.00 N ATOM 797 CA GLY A 109 -1.613 -1.879 -13.875 1.00 0.00 C ATOM 798 C GLY A 109 -1.417 -1.131 -12.571 1.00 0.00 C ATOM 799 O GLY A 109 -0.484 -0.340 -12.435 1.00 0.00 O ATOM 0 H GLY A 109 -3.457 -2.873 -13.829 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -1.145 -2.861 -13.801 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -1.105 -1.344 -14.677 1.00 0.00 H new ATOM 803 N PHE A 110 -2.299 -1.381 -11.609 1.00 0.00 N ATOM 804 CA PHE A 110 -2.221 -0.723 -10.310 1.00 0.00 C ATOM 805 C PHE A 110 -2.499 -1.712 -9.182 1.00 0.00 C ATOM 806 O PHE A 110 -3.103 -2.761 -9.396 1.00 0.00 O ATOM 807 CB PHE A 110 -3.214 0.439 -10.241 1.00 0.00 C ATOM 808 CG PHE A 110 -2.826 1.611 -11.096 1.00 0.00 C ATOM 809 CD1 PHE A 110 -1.795 2.454 -10.712 1.00 0.00 C ATOM 810 CD2 PHE A 110 -3.491 1.870 -12.284 1.00 0.00 C ATOM 811 CE1 PHE A 110 -1.436 3.534 -11.496 1.00 0.00 C ATOM 812 CE2 PHE A 110 -3.136 2.949 -13.072 1.00 0.00 C ATOM 813 CZ PHE A 110 -2.106 3.781 -12.678 1.00 0.00 C ATOM 0 H PHE A 110 -3.076 -2.035 -11.705 1.00 0.00 H new ATOM 0 HA PHE A 110 -1.210 -0.334 -10.188 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -4.198 0.085 -10.549 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -3.304 0.769 -9.206 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -1.266 2.265 -9.790 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -4.296 1.222 -12.598 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -0.632 4.184 -11.184 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -3.663 3.141 -13.995 1.00 0.00 H new ATOM 0 HZ PHE A 110 -1.825 4.623 -13.293 1.00 0.00 H new ATOM 823 N GLY A 111 -2.051 -1.368 -7.978 1.00 0.00 N ATOM 824 CA GLY A 111 -2.260 -2.236 -6.833 1.00 0.00 C ATOM 825 C GLY A 111 -2.502 -1.460 -5.554 1.00 0.00 C ATOM 826 O GLY A 111 -2.080 -0.310 -5.427 1.00 0.00 O ATOM 0 H GLY A 111 -1.547 -0.504 -7.775 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -3.112 -2.888 -7.026 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -1.389 -2.879 -6.705 1.00 0.00 H new ATOM 830 N PHE A 112 -3.185 -2.088 -4.603 1.00 0.00 N ATOM 831 CA PHE A 112 -3.485 -1.448 -3.327 1.00 0.00 C ATOM 832 C PHE A 112 -3.174 -2.383 -2.163 1.00 0.00 C ATOM 833 O PHE A 112 -3.654 -3.516 -2.118 1.00 0.00 O ATOM 834 CB PHE A 112 -4.955 -1.025 -3.278 1.00 0.00 C ATOM 835 CG PHE A 112 -5.377 -0.186 -4.450 1.00 0.00 C ATOM 836 CD1 PHE A 112 -5.383 -0.713 -5.731 1.00 0.00 C ATOM 837 CD2 PHE A 112 -5.767 1.132 -4.270 1.00 0.00 C ATOM 838 CE1 PHE A 112 -5.771 0.057 -6.812 1.00 0.00 C ATOM 839 CE2 PHE A 112 -6.157 1.906 -5.347 1.00 0.00 C ATOM 840 CZ PHE A 112 -6.157 1.368 -6.619 1.00 0.00 C ATOM 0 H PHE A 112 -3.541 -3.040 -4.691 1.00 0.00 H new ATOM 0 HA PHE A 112 -2.856 -0.563 -3.236 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -5.580 -1.917 -3.236 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -5.134 -0.467 -2.359 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -5.081 -1.738 -5.887 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -5.766 1.559 -3.278 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -5.772 -0.367 -7.805 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -6.462 2.931 -5.194 1.00 0.00 H new ATOM 0 HZ PHE A 112 -6.459 1.972 -7.462 1.00 0.00 H new ATOM 850 N ILE A 113 -2.368 -1.901 -1.223 1.00 0.00 N ATOM 851 CA ILE A 113 -1.993 -2.693 -0.059 1.00 0.00 C ATOM 852 C ILE A 113 -2.391 -1.990 1.235 1.00 0.00 C ATOM 853 O ILE A 113 -2.305 -0.767 1.341 1.00 0.00 O ATOM 854 CB ILE A 113 -0.479 -2.974 -0.032 1.00 0.00 C ATOM 855 CG1 ILE A 113 -0.163 -4.096 0.959 1.00 0.00 C ATOM 856 CG2 ILE A 113 0.288 -1.710 0.328 1.00 0.00 C ATOM 857 CD1 ILE A 113 1.086 -4.875 0.612 1.00 0.00 C ATOM 0 H ILE A 113 -1.962 -0.965 -1.245 1.00 0.00 H new ATOM 0 HA ILE A 113 -2.528 -3.639 -0.136 1.00 0.00 H new ATOM 0 HB ILE A 113 -0.167 -3.295 -1.026 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -0.050 -3.668 1.955 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -1.009 -4.782 1.001 1.00 0.00 H new ATOM 0 HG21 ILE A 113 1.357 -1.925 0.343 1.00 0.00 H new ATOM 0 HG22 ILE A 113 0.084 -0.937 -0.413 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -0.026 -1.362 1.312 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.248 -5.654 1.357 1.00 0.00 H new ATOM 0 HD12 ILE A 113 0.969 -5.332 -0.371 1.00 0.00 H new ATOM 0 HD13 ILE A 113 1.943 -4.202 0.599 1.00 0.00 H new ATOM 869 N ARG A 114 -2.825 -2.773 2.218 1.00 0.00 N ATOM 870 CA ARG A 114 -3.236 -2.226 3.505 1.00 0.00 C ATOM 871 C ARG A 114 -2.504 -2.922 4.650 1.00 0.00 C ATOM 872 O ARG A 114 -2.618 -4.135 4.827 1.00 0.00 O ATOM 873 CB ARG A 114 -4.747 -2.374 3.688 1.00 0.00 C ATOM 874 CG ARG A 114 -5.247 -1.894 5.040 1.00 0.00 C ATOM 875 CD ARG A 114 -5.242 -3.016 6.067 1.00 0.00 C ATOM 876 NE ARG A 114 -5.715 -2.564 7.373 1.00 0.00 N ATOM 877 CZ ARG A 114 -6.997 -2.382 7.668 1.00 0.00 C ATOM 878 NH1 ARG A 114 -7.930 -2.612 6.754 1.00 0.00 N ATOM 879 NH2 ARG A 114 -7.349 -1.970 8.879 1.00 0.00 N ATOM 0 H ARG A 114 -2.901 -3.788 2.147 1.00 0.00 H new ATOM 0 HA ARG A 114 -2.977 -1.167 3.520 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -5.256 -1.815 2.903 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -5.019 -3.422 3.561 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -4.619 -1.075 5.391 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -6.258 -1.499 4.936 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -5.873 -3.832 5.715 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -4.232 -3.414 6.165 1.00 0.00 H new ATOM 0 HE ARG A 114 -5.022 -2.378 8.098 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -7.664 -2.929 5.822 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -8.914 -2.471 6.983 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -6.635 -1.793 9.585 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -8.334 -1.831 9.104 1.00 0.00 H new ATOM 893 N LEU A 115 -1.752 -2.146 5.422 1.00 0.00 N ATOM 894 CA LEU A 115 -1.001 -2.687 6.550 1.00 0.00 C ATOM 895 C LEU A 115 -1.807 -2.583 7.841 1.00 0.00 C ATOM 896 O LEU A 115 -2.910 -2.038 7.853 1.00 0.00 O ATOM 897 CB LEU A 115 0.329 -1.947 6.704 1.00 0.00 C ATOM 898 CG LEU A 115 1.064 -1.610 5.407 1.00 0.00 C ATOM 899 CD1 LEU A 115 2.328 -0.817 5.700 1.00 0.00 C ATOM 900 CD2 LEU A 115 1.395 -2.880 4.636 1.00 0.00 C ATOM 0 H LEU A 115 -1.646 -1.140 5.288 1.00 0.00 H new ATOM 0 HA LEU A 115 -0.803 -3.740 6.351 1.00 0.00 H new ATOM 0 HB2 LEU A 115 0.145 -1.019 7.245 1.00 0.00 H new ATOM 0 HB3 LEU A 115 0.989 -2.553 7.325 1.00 0.00 H new ATOM 0 HG LEU A 115 0.409 -0.995 4.790 1.00 0.00 H new ATOM 0 HD11 LEU A 115 2.838 -0.586 4.765 1.00 0.00 H new ATOM 0 HD12 LEU A 115 2.066 0.111 6.209 1.00 0.00 H new ATOM 0 HD13 LEU A 115 2.988 -1.406 6.337 1.00 0.00 H new ATOM 0 HD21 LEU A 115 1.918 -2.621 3.715 1.00 0.00 H new ATOM 0 HD22 LEU A 115 2.031 -3.521 5.247 1.00 0.00 H new ATOM 0 HD23 LEU A 115 0.473 -3.409 4.393 1.00 0.00 H new ATOM 912 N GLU A 116 -1.246 -3.108 8.926 1.00 0.00 N ATOM 913 CA GLU A 116 -1.912 -3.073 10.223 1.00 0.00 C ATOM 914 C GLU A 116 -2.123 -1.635 10.687 1.00 0.00 C ATOM 915 O GLU A 116 -3.250 -1.141 10.728 1.00 0.00 O ATOM 916 CB GLU A 116 -1.095 -3.842 11.262 1.00 0.00 C ATOM 917 CG GLU A 116 -1.904 -4.274 12.474 1.00 0.00 C ATOM 918 CD GLU A 116 -3.180 -5.000 12.095 1.00 0.00 C ATOM 919 OE1 GLU A 116 -3.089 -6.143 11.601 1.00 0.00 O ATOM 920 OE2 GLU A 116 -4.270 -4.423 12.292 1.00 0.00 O ATOM 0 H GLU A 116 -0.333 -3.562 8.933 1.00 0.00 H new ATOM 0 HA GLU A 116 -2.887 -3.548 10.115 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -0.662 -4.725 10.791 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -0.265 -3.218 11.593 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -1.293 -4.924 13.101 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -2.153 -3.397 13.071 1.00 0.00 H new ATOM 927 N THR A 117 -1.028 -0.966 11.038 1.00 0.00 N ATOM 928 CA THR A 117 -1.092 0.414 11.501 1.00 0.00 C ATOM 929 C THR A 117 -0.668 1.383 10.403 1.00 0.00 C ATOM 930 O THR A 117 -0.366 0.972 9.283 1.00 0.00 O ATOM 931 CB THR A 117 -0.198 0.634 12.737 1.00 0.00 C ATOM 932 OG1 THR A 117 1.167 0.348 12.410 1.00 0.00 O ATOM 933 CG2 THR A 117 -0.644 -0.250 13.892 1.00 0.00 C ATOM 0 H THR A 117 -0.087 -1.358 11.010 1.00 0.00 H new ATOM 0 HA THR A 117 -2.130 0.608 11.772 1.00 0.00 H new ATOM 0 HB THR A 117 -0.288 1.676 13.043 1.00 0.00 H new ATOM 0 HG1 THR A 117 1.730 0.492 13.200 1.00 0.00 H new ATOM 0 HG21 THR A 117 0.002 -0.077 14.753 1.00 0.00 H new ATOM 0 HG22 THR A 117 -1.674 -0.010 14.157 1.00 0.00 H new ATOM 0 HG23 THR A 117 -0.580 -1.297 13.595 1.00 0.00 H new ATOM 941 N ARG A 118 -0.648 2.671 10.732 1.00 0.00 N ATOM 942 CA ARG A 118 -0.262 3.698 9.772 1.00 0.00 C ATOM 943 C ARG A 118 1.248 3.918 9.790 1.00 0.00 C ATOM 944 O ARG A 118 1.883 4.026 8.740 1.00 0.00 O ATOM 945 CB ARG A 118 -0.982 5.011 10.082 1.00 0.00 C ATOM 946 CG ARG A 118 -0.717 5.536 11.483 1.00 0.00 C ATOM 947 CD ARG A 118 -1.474 6.829 11.746 1.00 0.00 C ATOM 948 NE ARG A 118 -2.808 6.582 12.286 1.00 0.00 N ATOM 949 CZ ARG A 118 -3.035 6.189 13.534 1.00 0.00 C ATOM 950 NH1 ARG A 118 -2.021 6.000 14.368 1.00 0.00 N ATOM 951 NH2 ARG A 118 -4.278 5.985 13.951 1.00 0.00 N ATOM 0 H ARG A 118 -0.894 3.028 11.655 1.00 0.00 H new ATOM 0 HA ARG A 118 -0.551 3.358 8.778 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -0.674 5.764 9.357 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -2.055 4.866 9.955 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -1.012 4.785 12.216 1.00 0.00 H new ATOM 0 HG3 ARG A 118 0.352 5.706 11.613 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -0.908 7.445 12.445 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -1.558 7.395 10.818 1.00 0.00 H new ATOM 0 HE ARG A 118 -3.610 6.719 11.671 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -1.064 6.157 14.051 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -2.198 5.698 15.326 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -5.060 6.130 13.313 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -4.451 5.683 14.910 1.00 0.00 H new ATOM 965 N THR A 119 1.818 3.983 10.989 1.00 0.00 N ATOM 966 CA THR A 119 3.252 4.191 11.143 1.00 0.00 C ATOM 967 C THR A 119 4.038 3.393 10.110 1.00 0.00 C ATOM 968 O THR A 119 4.862 3.945 9.378 1.00 0.00 O ATOM 969 CB THR A 119 3.729 3.794 12.553 1.00 0.00 C ATOM 970 OG1 THR A 119 3.226 4.722 13.520 1.00 0.00 O ATOM 971 CG2 THR A 119 5.249 3.757 12.620 1.00 0.00 C ATOM 0 H THR A 119 1.308 3.895 11.868 1.00 0.00 H new ATOM 0 HA THR A 119 3.435 5.255 10.991 1.00 0.00 H new ATOM 0 HB THR A 119 3.347 2.797 12.774 1.00 0.00 H new ATOM 0 HG1 THR A 119 3.532 4.461 14.414 1.00 0.00 H new ATOM 0 HG21 THR A 119 5.562 3.474 13.625 1.00 0.00 H new ATOM 0 HG22 THR A 119 5.627 3.028 11.904 1.00 0.00 H new ATOM 0 HG23 THR A 119 5.648 4.742 12.379 1.00 0.00 H new ATOM 979 N LEU A 120 3.780 2.091 10.053 1.00 0.00 N ATOM 980 CA LEU A 120 4.463 1.216 9.107 1.00 0.00 C ATOM 981 C LEU A 120 4.323 1.740 7.681 1.00 0.00 C ATOM 982 O LEU A 120 5.302 1.820 6.940 1.00 0.00 O ATOM 983 CB LEU A 120 3.902 -0.204 9.198 1.00 0.00 C ATOM 984 CG LEU A 120 4.012 -0.883 10.564 1.00 0.00 C ATOM 985 CD1 LEU A 120 3.108 -2.104 10.628 1.00 0.00 C ATOM 986 CD2 LEU A 120 5.456 -1.270 10.852 1.00 0.00 C ATOM 0 H LEU A 120 3.102 1.618 10.651 1.00 0.00 H new ATOM 0 HA LEU A 120 5.522 1.199 9.366 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.851 -0.177 8.912 1.00 0.00 H new ATOM 0 HB3 LEU A 120 4.416 -0.824 8.464 1.00 0.00 H new ATOM 0 HG LEU A 120 3.687 -0.176 11.327 1.00 0.00 H new ATOM 0 HD11 LEU A 120 3.200 -2.574 11.607 1.00 0.00 H new ATOM 0 HD12 LEU A 120 2.074 -1.800 10.467 1.00 0.00 H new ATOM 0 HD13 LEU A 120 3.401 -2.815 9.856 1.00 0.00 H new ATOM 0 HD21 LEU A 120 5.516 -1.752 11.828 1.00 0.00 H new ATOM 0 HD22 LEU A 120 5.808 -1.960 10.085 1.00 0.00 H new ATOM 0 HD23 LEU A 120 6.080 -0.376 10.850 1.00 0.00 H new ATOM 998 N ALA A 121 3.099 2.097 7.305 1.00 0.00 N ATOM 999 CA ALA A 121 2.831 2.617 5.970 1.00 0.00 C ATOM 1000 C ALA A 121 3.724 3.813 5.658 1.00 0.00 C ATOM 1001 O ALA A 121 4.293 3.906 4.571 1.00 0.00 O ATOM 1002 CB ALA A 121 1.365 3.002 5.838 1.00 0.00 C ATOM 0 H ALA A 121 2.277 2.035 7.906 1.00 0.00 H new ATOM 0 HA ALA A 121 3.055 1.831 5.249 1.00 0.00 H new ATOM 0 HB1 ALA A 121 1.179 3.389 4.836 1.00 0.00 H new ATOM 0 HB2 ALA A 121 0.742 2.125 6.010 1.00 0.00 H new ATOM 0 HB3 ALA A 121 1.123 3.769 6.574 1.00 0.00 H new ATOM 1008 N GLU A 122 3.842 4.725 6.618 1.00 0.00 N ATOM 1009 CA GLU A 122 4.665 5.916 6.443 1.00 0.00 C ATOM 1010 C GLU A 122 6.106 5.537 6.115 1.00 0.00 C ATOM 1011 O GLU A 122 6.674 6.008 5.128 1.00 0.00 O ATOM 1012 CB GLU A 122 4.627 6.779 7.706 1.00 0.00 C ATOM 1013 CG GLU A 122 3.507 7.805 7.708 1.00 0.00 C ATOM 1014 CD GLU A 122 3.670 8.844 8.801 1.00 0.00 C ATOM 1015 OE1 GLU A 122 4.322 8.536 9.820 1.00 0.00 O ATOM 1016 OE2 GLU A 122 3.146 9.966 8.635 1.00 0.00 O ATOM 0 H GLU A 122 3.378 4.662 7.524 1.00 0.00 H new ATOM 0 HA GLU A 122 4.259 6.488 5.609 1.00 0.00 H new ATOM 0 HB2 GLU A 122 4.516 6.131 8.575 1.00 0.00 H new ATOM 0 HB3 GLU A 122 5.581 7.295 7.812 1.00 0.00 H new ATOM 0 HG2 GLU A 122 3.475 8.304 6.739 1.00 0.00 H new ATOM 0 HG3 GLU A 122 2.552 7.295 7.836 1.00 0.00 H new ATOM 1023 N ILE A 123 6.692 4.685 6.948 1.00 0.00 N ATOM 1024 CA ILE A 123 8.067 4.243 6.747 1.00 0.00 C ATOM 1025 C ILE A 123 8.214 3.488 5.431 1.00 0.00 C ATOM 1026 O ILE A 123 9.036 3.845 4.587 1.00 0.00 O ATOM 1027 CB ILE A 123 8.542 3.339 7.900 1.00 0.00 C ATOM 1028 CG1 ILE A 123 8.549 4.118 9.218 1.00 0.00 C ATOM 1029 CG2 ILE A 123 9.926 2.782 7.601 1.00 0.00 C ATOM 1030 CD1 ILE A 123 8.551 3.231 10.443 1.00 0.00 C ATOM 0 H ILE A 123 6.237 4.286 7.769 1.00 0.00 H new ATOM 0 HA ILE A 123 8.686 5.140 6.720 1.00 0.00 H new ATOM 0 HB ILE A 123 7.848 2.504 7.996 1.00 0.00 H new ATOM 0 HG12 ILE A 123 9.427 4.763 9.245 1.00 0.00 H new ATOM 0 HG13 ILE A 123 7.675 4.768 9.251 1.00 0.00 H new ATOM 0 HG21 ILE A 123 10.248 2.145 8.425 1.00 0.00 H new ATOM 0 HG22 ILE A 123 9.892 2.197 6.682 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.631 3.605 7.481 1.00 0.00 H new ATOM 0 HD11 ILE A 123 8.556 3.850 11.340 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.659 2.604 10.440 1.00 0.00 H new ATOM 0 HD13 ILE A 123 9.439 2.599 10.433 1.00 0.00 H new ATOM 1042 N ALA A 124 7.411 2.442 5.261 1.00 0.00 N ATOM 1043 CA ALA A 124 7.449 1.639 4.046 1.00 0.00 C ATOM 1044 C ALA A 124 7.105 2.479 2.821 1.00 0.00 C ATOM 1045 O ALA A 124 7.447 2.123 1.693 1.00 0.00 O ATOM 1046 CB ALA A 124 6.496 0.459 4.163 1.00 0.00 C ATOM 0 H ALA A 124 6.726 2.132 5.950 1.00 0.00 H new ATOM 0 HA ALA A 124 8.464 1.262 3.922 1.00 0.00 H new ATOM 0 HB1 ALA A 124 6.535 -0.132 3.248 1.00 0.00 H new ATOM 0 HB2 ALA A 124 6.789 -0.163 5.009 1.00 0.00 H new ATOM 0 HB3 ALA A 124 5.481 0.825 4.316 1.00 0.00 H new ATOM 1052 N LYS A 125 6.424 3.598 3.049 1.00 0.00 N ATOM 1053 CA LYS A 125 6.033 4.491 1.965 1.00 0.00 C ATOM 1054 C LYS A 125 7.235 5.271 1.442 1.00 0.00 C ATOM 1055 O LYS A 125 7.457 5.354 0.234 1.00 0.00 O ATOM 1056 CB LYS A 125 4.950 5.461 2.441 1.00 0.00 C ATOM 1057 CG LYS A 125 4.640 6.564 1.444 1.00 0.00 C ATOM 1058 CD LYS A 125 5.521 7.782 1.670 1.00 0.00 C ATOM 1059 CE LYS A 125 4.886 8.755 2.652 1.00 0.00 C ATOM 1060 NZ LYS A 125 3.896 9.647 1.987 1.00 0.00 N ATOM 0 H LYS A 125 6.132 3.908 3.976 1.00 0.00 H new ATOM 0 HA LYS A 125 5.635 3.883 1.153 1.00 0.00 H new ATOM 0 HB2 LYS A 125 4.037 4.901 2.646 1.00 0.00 H new ATOM 0 HB3 LYS A 125 5.266 5.912 3.382 1.00 0.00 H new ATOM 0 HG2 LYS A 125 4.786 6.191 0.430 1.00 0.00 H new ATOM 0 HG3 LYS A 125 3.592 6.850 1.531 1.00 0.00 H new ATOM 0 HD2 LYS A 125 6.493 7.464 2.048 1.00 0.00 H new ATOM 0 HD3 LYS A 125 5.698 8.286 0.720 1.00 0.00 H new ATOM 0 HE2 LYS A 125 4.394 8.197 3.449 1.00 0.00 H new ATOM 0 HE3 LYS A 125 5.664 9.360 3.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 4.225 10.632 2.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 3.795 9.371 0.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 2.976 9.562 2.465 1.00 0.00 H new ATOM 1074 N VAL A 126 8.009 5.841 2.360 1.00 0.00 N ATOM 1075 CA VAL A 126 9.190 6.613 1.992 1.00 0.00 C ATOM 1076 C VAL A 126 10.267 5.716 1.391 1.00 0.00 C ATOM 1077 O VAL A 126 11.053 6.152 0.551 1.00 0.00 O ATOM 1078 CB VAL A 126 9.776 7.356 3.207 1.00 0.00 C ATOM 1079 CG1 VAL A 126 11.126 7.966 2.860 1.00 0.00 C ATOM 1080 CG2 VAL A 126 8.809 8.424 3.694 1.00 0.00 C ATOM 0 H VAL A 126 7.839 5.783 3.364 1.00 0.00 H new ATOM 0 HA VAL A 126 8.872 7.343 1.248 1.00 0.00 H new ATOM 0 HB VAL A 126 9.925 6.638 4.013 1.00 0.00 H new ATOM 0 HG11 VAL A 126 11.525 8.487 3.731 1.00 0.00 H new ATOM 0 HG12 VAL A 126 11.816 7.177 2.562 1.00 0.00 H new ATOM 0 HG13 VAL A 126 11.006 8.672 2.038 1.00 0.00 H new ATOM 0 HG21 VAL A 126 9.239 8.939 4.553 1.00 0.00 H new ATOM 0 HG22 VAL A 126 8.627 9.142 2.894 1.00 0.00 H new ATOM 0 HG23 VAL A 126 7.868 7.957 3.984 1.00 0.00 H new ATOM 1090 N GLU A 127 10.296 4.461 1.828 1.00 0.00 N ATOM 1091 CA GLU A 127 11.277 3.503 1.332 1.00 0.00 C ATOM 1092 C GLU A 127 10.826 2.898 0.006 1.00 0.00 C ATOM 1093 O GLU A 127 11.555 2.935 -0.986 1.00 0.00 O ATOM 1094 CB GLU A 127 11.503 2.392 2.361 1.00 0.00 C ATOM 1095 CG GLU A 127 12.373 2.816 3.532 1.00 0.00 C ATOM 1096 CD GLU A 127 13.849 2.587 3.274 1.00 0.00 C ATOM 1097 OE1 GLU A 127 14.476 3.444 2.616 1.00 0.00 O ATOM 1098 OE2 GLU A 127 14.379 1.552 3.730 1.00 0.00 O ATOM 0 H GLU A 127 9.652 4.084 2.524 1.00 0.00 H new ATOM 0 HA GLU A 127 12.215 4.034 1.169 1.00 0.00 H new ATOM 0 HB2 GLU A 127 10.537 2.057 2.739 1.00 0.00 H new ATOM 0 HB3 GLU A 127 11.965 1.538 1.866 1.00 0.00 H new ATOM 0 HG2 GLU A 127 12.204 3.872 3.742 1.00 0.00 H new ATOM 0 HG3 GLU A 127 12.073 2.262 4.422 1.00 0.00 H new ATOM 1105 N LEU A 128 9.619 2.343 -0.004 1.00 0.00 N ATOM 1106 CA LEU A 128 9.069 1.729 -1.208 1.00 0.00 C ATOM 1107 C LEU A 128 8.759 2.785 -2.264 1.00 0.00 C ATOM 1108 O LEU A 128 8.620 2.473 -3.447 1.00 0.00 O ATOM 1109 CB LEU A 128 7.802 0.942 -0.870 1.00 0.00 C ATOM 1110 CG LEU A 128 7.961 -0.174 0.163 1.00 0.00 C ATOM 1111 CD1 LEU A 128 6.600 -0.678 0.619 1.00 0.00 C ATOM 1112 CD2 LEU A 128 8.790 -1.315 -0.408 1.00 0.00 C ATOM 0 H LEU A 128 9.002 2.305 0.808 1.00 0.00 H new ATOM 0 HA LEU A 128 9.816 1.046 -1.612 1.00 0.00 H new ATOM 0 HB2 LEU A 128 7.050 1.642 -0.506 1.00 0.00 H new ATOM 0 HB3 LEU A 128 7.413 0.506 -1.790 1.00 0.00 H new ATOM 0 HG LEU A 128 8.484 0.231 1.029 1.00 0.00 H new ATOM 0 HD11 LEU A 128 6.734 -1.472 1.354 1.00 0.00 H new ATOM 0 HD12 LEU A 128 6.040 0.142 1.068 1.00 0.00 H new ATOM 0 HD13 LEU A 128 6.050 -1.066 -0.238 1.00 0.00 H new ATOM 0 HD21 LEU A 128 8.893 -2.100 0.341 1.00 0.00 H new ATOM 0 HD22 LEU A 128 8.294 -1.718 -1.291 1.00 0.00 H new ATOM 0 HD23 LEU A 128 9.778 -0.945 -0.684 1.00 0.00 H new ATOM 1124 N ASP A 129 8.653 4.036 -1.829 1.00 0.00 N ATOM 1125 CA ASP A 129 8.363 5.139 -2.738 1.00 0.00 C ATOM 1126 C ASP A 129 9.418 5.232 -3.835 1.00 0.00 C ATOM 1127 O ASP A 129 10.589 5.493 -3.562 1.00 0.00 O ATOM 1128 CB ASP A 129 8.293 6.458 -1.966 1.00 0.00 C ATOM 1129 CG ASP A 129 8.711 7.645 -2.811 1.00 0.00 C ATOM 1130 OD1 ASP A 129 8.346 7.682 -4.004 1.00 0.00 O ATOM 1131 OD2 ASP A 129 9.404 8.538 -2.279 1.00 0.00 O ATOM 0 H ASP A 129 8.763 4.311 -0.853 1.00 0.00 H new ATOM 0 HA ASP A 129 7.397 4.948 -3.205 1.00 0.00 H new ATOM 0 HB2 ASP A 129 7.276 6.612 -1.606 1.00 0.00 H new ATOM 0 HB3 ASP A 129 8.936 6.396 -1.088 1.00 0.00 H new ATOM 1136 N ASN A 130 8.995 5.016 -5.076 1.00 0.00 N ATOM 1137 CA ASN A 130 9.905 5.074 -6.215 1.00 0.00 C ATOM 1138 C ASN A 130 11.010 4.030 -6.082 1.00 0.00 C ATOM 1139 O ASN A 130 12.181 4.317 -6.326 1.00 0.00 O ATOM 1140 CB ASN A 130 10.519 6.470 -6.333 1.00 0.00 C ATOM 1141 CG ASN A 130 9.655 7.415 -7.146 1.00 0.00 C ATOM 1142 OD1 ASN A 130 9.310 7.127 -8.292 1.00 0.00 O ATOM 1143 ND2 ASN A 130 9.301 8.550 -6.554 1.00 0.00 N ATOM 0 H ASN A 130 8.028 4.799 -5.319 1.00 0.00 H new ATOM 0 HA ASN A 130 9.332 4.859 -7.117 1.00 0.00 H new ATOM 0 HB2 ASN A 130 10.667 6.884 -5.336 1.00 0.00 H new ATOM 0 HB3 ASN A 130 11.503 6.393 -6.795 1.00 0.00 H new ATOM 0 HD21 ASN A 130 8.720 9.225 -7.051 1.00 0.00 H new ATOM 0 HD22 ASN A 130 9.610 8.747 -5.602 1.00 0.00 H new ATOM 1150 N MET A 131 10.627 2.817 -5.695 1.00 0.00 N ATOM 1151 CA MET A 131 11.585 1.730 -5.531 1.00 0.00 C ATOM 1152 C MET A 131 11.750 0.951 -6.833 1.00 0.00 C ATOM 1153 O MET A 131 10.781 0.644 -7.527 1.00 0.00 O ATOM 1154 CB MET A 131 11.134 0.788 -4.413 1.00 0.00 C ATOM 1155 CG MET A 131 11.861 -0.547 -4.414 1.00 0.00 C ATOM 1156 SD MET A 131 11.148 -1.726 -3.250 1.00 0.00 S ATOM 1157 CE MET A 131 9.955 -2.556 -4.298 1.00 0.00 C ATOM 0 H MET A 131 9.661 2.563 -5.489 1.00 0.00 H new ATOM 0 HA MET A 131 12.548 2.165 -5.263 1.00 0.00 H new ATOM 0 HB2 MET A 131 11.291 1.277 -3.452 1.00 0.00 H new ATOM 0 HB3 MET A 131 10.063 0.609 -4.509 1.00 0.00 H new ATOM 0 HG2 MET A 131 11.833 -0.971 -5.418 1.00 0.00 H new ATOM 0 HG3 MET A 131 12.910 -0.386 -4.165 1.00 0.00 H new ATOM 0 HE1 MET A 131 8.951 -2.392 -3.907 1.00 0.00 H new ATOM 0 HE2 MET A 131 10.020 -2.157 -5.310 1.00 0.00 H new ATOM 0 HE3 MET A 131 10.168 -3.625 -4.315 1.00 0.00 H new ATOM 1167 N PRO A 132 13.006 0.624 -7.172 1.00 0.00 N ATOM 1168 CA PRO A 132 13.327 -0.123 -8.392 1.00 0.00 C ATOM 1169 C PRO A 132 12.864 -1.574 -8.322 1.00 0.00 C ATOM 1170 O PRO A 132 13.305 -2.337 -7.461 1.00 0.00 O ATOM 1171 CB PRO A 132 14.854 -0.052 -8.460 1.00 0.00 C ATOM 1172 CG PRO A 132 15.288 0.141 -7.047 1.00 0.00 C ATOM 1173 CD PRO A 132 14.209 0.958 -6.391 1.00 0.00 C ATOM 0 HA PRO A 132 12.828 0.293 -9.267 1.00 0.00 H new ATOM 0 HB2 PRO A 132 15.274 -0.965 -8.882 1.00 0.00 H new ATOM 0 HB3 PRO A 132 15.184 0.773 -9.092 1.00 0.00 H new ATOM 0 HG2 PRO A 132 15.413 -0.817 -6.543 1.00 0.00 H new ATOM 0 HG3 PRO A 132 16.249 0.654 -7.000 1.00 0.00 H new ATOM 0 HD2 PRO A 132 14.091 0.697 -5.339 1.00 0.00 H new ATOM 0 HD3 PRO A 132 14.431 2.024 -6.432 1.00 0.00 H new ATOM 1181 N LEU A 133 11.972 -1.950 -9.232 1.00 0.00 N ATOM 1182 CA LEU A 133 11.449 -3.312 -9.274 1.00 0.00 C ATOM 1183 C LEU A 133 11.453 -3.853 -10.700 1.00 0.00 C ATOM 1184 O LEU A 133 10.818 -3.287 -11.590 1.00 0.00 O ATOM 1185 CB LEU A 133 10.030 -3.351 -8.704 1.00 0.00 C ATOM 1186 CG LEU A 133 9.293 -4.685 -8.833 1.00 0.00 C ATOM 1187 CD1 LEU A 133 9.971 -5.753 -7.990 1.00 0.00 C ATOM 1188 CD2 LEU A 133 7.834 -4.529 -8.426 1.00 0.00 C ATOM 0 H LEU A 133 11.596 -1.331 -9.951 1.00 0.00 H new ATOM 0 HA LEU A 133 12.096 -3.943 -8.665 1.00 0.00 H new ATOM 0 HB2 LEU A 133 10.076 -3.085 -7.648 1.00 0.00 H new ATOM 0 HB3 LEU A 133 9.439 -2.582 -9.201 1.00 0.00 H new ATOM 0 HG LEU A 133 9.328 -4.998 -9.876 1.00 0.00 H new ATOM 0 HD11 LEU A 133 9.433 -6.695 -8.094 1.00 0.00 H new ATOM 0 HD12 LEU A 133 11.000 -5.884 -8.326 1.00 0.00 H new ATOM 0 HD13 LEU A 133 9.968 -5.447 -6.944 1.00 0.00 H new ATOM 0 HD21 LEU A 133 7.324 -5.488 -8.524 1.00 0.00 H new ATOM 0 HD22 LEU A 133 7.779 -4.193 -7.391 1.00 0.00 H new ATOM 0 HD23 LEU A 133 7.353 -3.795 -9.072 1.00 0.00 H new ATOM 1200 N ARG A 134 12.170 -4.952 -10.908 1.00 0.00 N ATOM 1201 CA ARG A 134 12.255 -5.571 -12.225 1.00 0.00 C ATOM 1202 C ARG A 134 12.541 -4.525 -13.299 1.00 0.00 C ATOM 1203 O ARG A 134 11.971 -4.568 -14.389 1.00 0.00 O ATOM 1204 CB ARG A 134 10.955 -6.309 -12.551 1.00 0.00 C ATOM 1205 CG ARG A 134 10.746 -7.568 -11.726 1.00 0.00 C ATOM 1206 CD ARG A 134 11.717 -8.667 -12.131 1.00 0.00 C ATOM 1207 NE ARG A 134 11.360 -9.267 -13.414 1.00 0.00 N ATOM 1208 CZ ARG A 134 11.802 -8.818 -14.583 1.00 0.00 C ATOM 1209 NH1 ARG A 134 12.614 -7.771 -14.632 1.00 0.00 N ATOM 1210 NH2 ARG A 134 11.432 -9.418 -15.708 1.00 0.00 N ATOM 0 H ARG A 134 12.701 -5.432 -10.181 1.00 0.00 H new ATOM 0 HA ARG A 134 13.077 -6.287 -12.210 1.00 0.00 H new ATOM 0 HB2 ARG A 134 10.114 -5.635 -12.389 1.00 0.00 H new ATOM 0 HB3 ARG A 134 10.952 -6.573 -13.608 1.00 0.00 H new ATOM 0 HG2 ARG A 134 10.876 -7.337 -10.669 1.00 0.00 H new ATOM 0 HG3 ARG A 134 9.722 -7.921 -11.852 1.00 0.00 H new ATOM 0 HD2 ARG A 134 12.725 -8.256 -12.191 1.00 0.00 H new ATOM 0 HD3 ARG A 134 11.732 -9.439 -11.362 1.00 0.00 H new ATOM 0 HE ARG A 134 10.737 -10.075 -13.412 1.00 0.00 H new ATOM 0 HH11 ARG A 134 12.901 -7.308 -13.770 1.00 0.00 H new ATOM 0 HH12 ARG A 134 12.951 -7.429 -15.532 1.00 0.00 H new ATOM 0 HH21 ARG A 134 10.808 -10.224 -15.675 1.00 0.00 H new ATOM 0 HH22 ARG A 134 11.772 -9.073 -16.606 1.00 0.00 H new ATOM 1224 N GLY A 135 13.428 -3.587 -12.983 1.00 0.00 N ATOM 1225 CA GLY A 135 13.774 -2.543 -13.930 1.00 0.00 C ATOM 1226 C GLY A 135 12.650 -1.546 -14.130 1.00 0.00 C ATOM 1227 O GLY A 135 12.578 -0.878 -15.162 1.00 0.00 O ATOM 0 H GLY A 135 13.914 -3.531 -12.088 1.00 0.00 H new ATOM 0 HA2 GLY A 135 14.663 -2.018 -13.579 1.00 0.00 H new ATOM 0 HA3 GLY A 135 14.029 -2.996 -14.888 1.00 0.00 H new ATOM 1231 N LYS A 136 11.768 -1.445 -13.142 1.00 0.00 N ATOM 1232 CA LYS A 136 10.641 -0.523 -13.213 1.00 0.00 C ATOM 1233 C LYS A 136 10.584 0.364 -11.973 1.00 0.00 C ATOM 1234 O LYS A 136 11.234 0.080 -10.967 1.00 0.00 O ATOM 1235 CB LYS A 136 9.329 -1.298 -13.359 1.00 0.00 C ATOM 1236 CG LYS A 136 9.372 -2.368 -14.436 1.00 0.00 C ATOM 1237 CD LYS A 136 8.937 -1.820 -15.784 1.00 0.00 C ATOM 1238 CE LYS A 136 8.496 -2.933 -16.722 1.00 0.00 C ATOM 1239 NZ LYS A 136 7.941 -2.397 -17.996 1.00 0.00 N ATOM 0 H LYS A 136 11.812 -1.991 -12.282 1.00 0.00 H new ATOM 0 HA LYS A 136 10.780 0.113 -14.087 1.00 0.00 H new ATOM 0 HB2 LYS A 136 9.084 -1.764 -12.405 1.00 0.00 H new ATOM 0 HB3 LYS A 136 8.526 -0.597 -13.587 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.383 -2.767 -14.514 1.00 0.00 H new ATOM 0 HG3 LYS A 136 8.723 -3.197 -14.153 1.00 0.00 H new ATOM 0 HD2 LYS A 136 8.118 -1.115 -15.644 1.00 0.00 H new ATOM 0 HD3 LYS A 136 9.760 -1.267 -16.236 1.00 0.00 H new ATOM 0 HE2 LYS A 136 9.344 -3.582 -16.940 1.00 0.00 H new ATOM 0 HE3 LYS A 136 7.743 -3.547 -16.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 7.652 -3.187 -18.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 7.116 -1.798 -17.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 8.667 -1.832 -18.480 1.00 0.00 H new ATOM 1253 N GLN A 137 9.803 1.436 -12.052 1.00 0.00 N ATOM 1254 CA GLN A 137 9.662 2.363 -10.936 1.00 0.00 C ATOM 1255 C GLN A 137 8.276 2.251 -10.308 1.00 0.00 C ATOM 1256 O GLN A 137 7.261 2.403 -10.988 1.00 0.00 O ATOM 1257 CB GLN A 137 9.909 3.798 -11.402 1.00 0.00 C ATOM 1258 CG GLN A 137 8.736 4.405 -12.154 1.00 0.00 C ATOM 1259 CD GLN A 137 9.120 5.650 -12.929 1.00 0.00 C ATOM 1260 OE1 GLN A 137 9.646 5.566 -14.039 1.00 0.00 O ATOM 1261 NE2 GLN A 137 8.858 6.814 -12.347 1.00 0.00 N ATOM 0 H GLN A 137 9.258 1.684 -12.878 1.00 0.00 H new ATOM 0 HA GLN A 137 10.405 2.101 -10.183 1.00 0.00 H new ATOM 0 HB2 GLN A 137 10.134 4.419 -10.535 1.00 0.00 H new ATOM 0 HB3 GLN A 137 10.790 3.816 -12.044 1.00 0.00 H new ATOM 0 HG2 GLN A 137 8.329 3.665 -12.842 1.00 0.00 H new ATOM 0 HG3 GLN A 137 7.945 4.652 -11.446 1.00 0.00 H new ATOM 0 HE21 GLN A 137 8.421 6.837 -11.426 1.00 0.00 H new ATOM 0 HE22 GLN A 137 9.094 7.686 -12.821 1.00 0.00 H new ATOM 1270 N LEU A 138 8.242 1.986 -9.006 1.00 0.00 N ATOM 1271 CA LEU A 138 6.980 1.854 -8.286 1.00 0.00 C ATOM 1272 C LEU A 138 6.577 3.179 -7.646 1.00 0.00 C ATOM 1273 O LEU A 138 7.391 3.841 -7.001 1.00 0.00 O ATOM 1274 CB LEU A 138 7.095 0.770 -7.212 1.00 0.00 C ATOM 1275 CG LEU A 138 7.253 -0.663 -7.720 1.00 0.00 C ATOM 1276 CD1 LEU A 138 7.686 -1.585 -6.591 1.00 0.00 C ATOM 1277 CD2 LEU A 138 5.954 -1.154 -8.344 1.00 0.00 C ATOM 0 H LEU A 138 9.073 1.859 -8.428 1.00 0.00 H new ATOM 0 HA LEU A 138 6.209 1.568 -9.002 1.00 0.00 H new ATOM 0 HB2 LEU A 138 7.949 1.005 -6.577 1.00 0.00 H new ATOM 0 HB3 LEU A 138 6.207 0.815 -6.582 1.00 0.00 H new ATOM 0 HG LEU A 138 8.028 -0.673 -8.487 1.00 0.00 H new ATOM 0 HD11 LEU A 138 7.793 -2.601 -6.972 1.00 0.00 H new ATOM 0 HD12 LEU A 138 8.641 -1.245 -6.190 1.00 0.00 H new ATOM 0 HD13 LEU A 138 6.935 -1.571 -5.801 1.00 0.00 H new ATOM 0 HD21 LEU A 138 6.085 -2.176 -8.700 1.00 0.00 H new ATOM 0 HD22 LEU A 138 5.160 -1.129 -7.598 1.00 0.00 H new ATOM 0 HD23 LEU A 138 5.686 -0.509 -9.181 1.00 0.00 H new ATOM 1289 N ARG A 139 5.317 3.559 -7.827 1.00 0.00 N ATOM 1290 CA ARG A 139 4.806 4.804 -7.267 1.00 0.00 C ATOM 1291 C ARG A 139 3.981 4.537 -6.011 1.00 0.00 C ATOM 1292 O ARG A 139 2.929 3.900 -6.070 1.00 0.00 O ATOM 1293 CB ARG A 139 3.954 5.542 -8.302 1.00 0.00 C ATOM 1294 CG ARG A 139 3.983 7.054 -8.148 1.00 0.00 C ATOM 1295 CD ARG A 139 2.950 7.530 -7.138 1.00 0.00 C ATOM 1296 NE ARG A 139 2.836 8.986 -7.117 1.00 0.00 N ATOM 1297 CZ ARG A 139 2.079 9.677 -7.963 1.00 0.00 C ATOM 1298 NH1 ARG A 139 1.372 9.047 -8.891 1.00 0.00 N ATOM 1299 NH2 ARG A 139 2.028 11.000 -7.880 1.00 0.00 N ATOM 0 H ARG A 139 4.631 3.022 -8.357 1.00 0.00 H new ATOM 0 HA ARG A 139 5.658 5.428 -6.996 1.00 0.00 H new ATOM 0 HB2 ARG A 139 4.303 5.280 -9.301 1.00 0.00 H new ATOM 0 HB3 ARG A 139 2.923 5.197 -8.224 1.00 0.00 H new ATOM 0 HG2 ARG A 139 4.977 7.370 -7.830 1.00 0.00 H new ATOM 0 HG3 ARG A 139 3.793 7.523 -9.113 1.00 0.00 H new ATOM 0 HD2 ARG A 139 1.980 7.094 -7.378 1.00 0.00 H new ATOM 0 HD3 ARG A 139 3.223 7.173 -6.145 1.00 0.00 H new ATOM 0 HE ARG A 139 3.367 9.501 -6.414 1.00 0.00 H new ATOM 0 HH11 ARG A 139 1.408 8.030 -8.957 1.00 0.00 H new ATOM 0 HH12 ARG A 139 0.792 9.580 -9.539 1.00 0.00 H new ATOM 0 HH21 ARG A 139 2.570 11.488 -7.167 1.00 0.00 H new ATOM 0 HH22 ARG A 139 1.447 11.530 -8.530 1.00 0.00 H new ATOM 1313 N VAL A 140 4.467 5.028 -4.875 1.00 0.00 N ATOM 1314 CA VAL A 140 3.775 4.843 -3.605 1.00 0.00 C ATOM 1315 C VAL A 140 3.231 6.166 -3.078 1.00 0.00 C ATOM 1316 O VAL A 140 3.993 7.055 -2.698 1.00 0.00 O ATOM 1317 CB VAL A 140 4.705 4.224 -2.545 1.00 0.00 C ATOM 1318 CG1 VAL A 140 3.932 3.913 -1.272 1.00 0.00 C ATOM 1319 CG2 VAL A 140 5.376 2.973 -3.090 1.00 0.00 C ATOM 0 H VAL A 140 5.337 5.557 -4.808 1.00 0.00 H new ATOM 0 HA VAL A 140 2.945 4.161 -3.792 1.00 0.00 H new ATOM 0 HB VAL A 140 5.482 4.948 -2.302 1.00 0.00 H new ATOM 0 HG11 VAL A 140 4.606 3.476 -0.535 1.00 0.00 H new ATOM 0 HG12 VAL A 140 3.504 4.832 -0.873 1.00 0.00 H new ATOM 0 HG13 VAL A 140 3.132 3.207 -1.495 1.00 0.00 H new ATOM 0 HG21 VAL A 140 6.029 2.549 -2.328 1.00 0.00 H new ATOM 0 HG22 VAL A 140 4.615 2.242 -3.363 1.00 0.00 H new ATOM 0 HG23 VAL A 140 5.965 3.230 -3.970 1.00 0.00 H new ATOM 1329 N ARG A 141 1.908 6.289 -3.059 1.00 0.00 N ATOM 1330 CA ARG A 141 1.261 7.504 -2.579 1.00 0.00 C ATOM 1331 C ARG A 141 0.047 7.170 -1.716 1.00 0.00 C ATOM 1332 O ARG A 141 -0.594 6.135 -1.902 1.00 0.00 O ATOM 1333 CB ARG A 141 0.835 8.381 -3.759 1.00 0.00 C ATOM 1334 CG ARG A 141 -0.096 7.679 -4.734 1.00 0.00 C ATOM 1335 CD ARG A 141 -0.543 8.613 -5.848 1.00 0.00 C ATOM 1336 NE ARG A 141 -1.458 7.958 -6.778 1.00 0.00 N ATOM 1337 CZ ARG A 141 -2.763 7.834 -6.560 1.00 0.00 C ATOM 1338 NH1 ARG A 141 -3.302 8.319 -5.450 1.00 0.00 N ATOM 1339 NH2 ARG A 141 -3.531 7.225 -7.454 1.00 0.00 N ATOM 0 H ARG A 141 1.263 5.562 -3.370 1.00 0.00 H new ATOM 0 HA ARG A 141 1.980 8.051 -1.969 1.00 0.00 H new ATOM 0 HB2 ARG A 141 0.341 9.274 -3.377 1.00 0.00 H new ATOM 0 HB3 ARG A 141 1.725 8.713 -4.294 1.00 0.00 H new ATOM 0 HG2 ARG A 141 0.410 6.814 -5.164 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -0.969 7.304 -4.200 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -1.030 9.486 -5.415 1.00 0.00 H new ATOM 0 HD3 ARG A 141 0.331 8.972 -6.392 1.00 0.00 H new ATOM 0 HE ARG A 141 -1.075 7.575 -7.642 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -2.715 8.789 -4.761 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -4.304 8.222 -5.285 1.00 0.00 H new ATOM 0 HH21 ARG A 141 -3.120 6.851 -8.309 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -4.533 7.130 -7.286 1.00 0.00 H new ATOM 1353 N PHE A 142 -0.262 8.052 -0.772 1.00 0.00 N ATOM 1354 CA PHE A 142 -1.397 7.850 0.121 1.00 0.00 C ATOM 1355 C PHE A 142 -2.715 7.976 -0.638 1.00 0.00 C ATOM 1356 O PHE A 142 -3.068 9.054 -1.115 1.00 0.00 O ATOM 1357 CB PHE A 142 -1.357 8.862 1.268 1.00 0.00 C ATOM 1358 CG PHE A 142 -0.402 8.487 2.365 1.00 0.00 C ATOM 1359 CD1 PHE A 142 -0.380 7.198 2.872 1.00 0.00 C ATOM 1360 CD2 PHE A 142 0.474 9.424 2.889 1.00 0.00 C ATOM 1361 CE1 PHE A 142 0.497 6.851 3.882 1.00 0.00 C ATOM 1362 CE2 PHE A 142 1.354 9.082 3.899 1.00 0.00 C ATOM 1363 CZ PHE A 142 1.366 7.794 4.395 1.00 0.00 C ATOM 0 H PHE A 142 0.258 8.914 -0.605 1.00 0.00 H new ATOM 0 HA PHE A 142 -1.329 6.843 0.532 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -1.077 9.838 0.871 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -2.358 8.964 1.687 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -1.056 6.456 2.473 1.00 0.00 H new ATOM 0 HD2 PHE A 142 0.469 10.433 2.504 1.00 0.00 H new ATOM 0 HE1 PHE A 142 0.503 5.843 4.270 1.00 0.00 H new ATOM 0 HE2 PHE A 142 2.031 9.822 4.299 1.00 0.00 H new ATOM 0 HZ PHE A 142 2.054 7.524 5.183 1.00 0.00 H new ATOM 1373 N ALA A 143 -3.437 6.866 -0.745 1.00 0.00 N ATOM 1374 CA ALA A 143 -4.716 6.852 -1.444 1.00 0.00 C ATOM 1375 C ALA A 143 -5.849 7.299 -0.526 1.00 0.00 C ATOM 1376 O ALA A 143 -6.583 6.474 0.017 1.00 0.00 O ATOM 1377 CB ALA A 143 -5.000 5.463 -1.997 1.00 0.00 C ATOM 0 H ALA A 143 -3.158 5.965 -0.357 1.00 0.00 H new ATOM 0 HA ALA A 143 -4.656 7.557 -2.273 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -5.958 5.467 -2.516 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -4.211 5.180 -2.694 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -5.035 4.745 -1.177 1.00 0.00 H new