USER MOD reduce.3.24.130724 H: found=0, std=0, add=575, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 576 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 91 THR OG1 : rot -160:sc= -0.0203 USER MOD Set 1.2: A 132 GLN : amide:sc= -0.0828 K(o=-0.1,f=-1.9) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=-0.00045) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= -0.0254 USER MOD Single : A 122 HIS : no HD1:sc= -0.306 K(o=-0.31,f=-1.8!) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot -8:sc= 0.666 USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot -18:sc= 0.53 USER MOD Single : A 135 SER OG : rot -104:sc= 0.128 USER MOD Single : A 140 GLN : amide:sc= -0.975 K(o=-0.97,f=-7.2!) USER MOD Single : A 143 CYS SG : rot 162:sc= -0.6! USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 MET CE :methyl -153:sc= -1.83 (180deg=-2.37!) USER MOD ----------------------------------------------------------------- ATOM 174 N ASN A 88 -8.084 13.648 -3.978 1.00 0.00 N ATOM 175 CA ASN A 88 -7.553 13.648 -5.336 1.00 0.00 C ATOM 176 C ASN A 88 -6.373 12.689 -5.459 1.00 0.00 C ATOM 177 O ASN A 88 -5.564 12.540 -4.543 1.00 0.00 O ATOM 178 CB ASN A 88 -7.120 15.060 -5.737 1.00 0.00 C ATOM 179 CG ASN A 88 -8.302 15.979 -5.984 1.00 0.00 C ATOM 180 OD1 ASN A 88 -9.114 15.737 -6.877 1.00 0.00 O ATOM 181 ND2 ASN A 88 -8.402 17.039 -5.191 1.00 0.00 N ATOM 0 HA ASN A 88 -8.343 13.312 -6.008 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -6.493 15.482 -4.951 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -6.509 15.008 -6.638 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -9.176 17.693 -5.309 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -7.705 17.199 -4.464 1.00 0.00 H new ATOM 188 N PRO A 89 -6.271 12.022 -6.618 1.00 0.00 N ATOM 189 CA PRO A 89 -5.194 11.066 -6.889 1.00 0.00 C ATOM 190 C PRO A 89 -3.840 11.749 -7.050 1.00 0.00 C ATOM 191 O PRO A 89 -3.656 12.586 -7.935 1.00 0.00 O ATOM 192 CB PRO A 89 -5.622 10.412 -8.205 1.00 0.00 C ATOM 193 CG PRO A 89 -6.494 11.424 -8.865 1.00 0.00 C ATOM 194 CD PRO A 89 -7.200 12.150 -7.754 1.00 0.00 C ATOM 0 HA PRO A 89 -5.061 10.360 -6.070 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -4.759 10.168 -8.825 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -6.160 9.481 -8.028 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -5.904 12.114 -9.468 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -7.209 10.946 -9.535 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -7.382 13.194 -8.008 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -8.169 11.702 -7.533 1.00 0.00 H new ATOM 202 N THR A 90 -2.893 11.387 -6.190 1.00 0.00 N ATOM 203 CA THR A 90 -1.556 11.965 -6.236 1.00 0.00 C ATOM 204 C THR A 90 -0.486 10.880 -6.207 1.00 0.00 C ATOM 205 O THR A 90 -0.662 9.836 -5.578 1.00 0.00 O ATOM 206 CB THR A 90 -1.322 12.934 -5.062 1.00 0.00 C ATOM 207 OG1 THR A 90 -0.003 13.487 -5.138 1.00 0.00 O ATOM 208 CG2 THR A 90 -1.502 12.222 -3.729 1.00 0.00 C ATOM 0 H THR A 90 -3.028 10.695 -5.453 1.00 0.00 H new ATOM 0 HA THR A 90 -1.483 12.517 -7.173 1.00 0.00 H new ATOM 0 HB THR A 90 -2.057 13.736 -5.130 1.00 0.00 H new ATOM 0 HG1 THR A 90 0.137 14.103 -4.389 1.00 0.00 H new ATOM 0 HG21 THR A 90 -1.332 12.926 -2.915 1.00 0.00 H new ATOM 0 HG22 THR A 90 -2.516 11.827 -3.661 1.00 0.00 H new ATOM 0 HG23 THR A 90 -0.788 11.402 -3.655 1.00 0.00 H new ATOM 216 N THR A 91 0.625 11.133 -6.891 1.00 0.00 N ATOM 217 CA THR A 91 1.724 10.177 -6.943 1.00 0.00 C ATOM 218 C THR A 91 1.995 9.574 -5.569 1.00 0.00 C ATOM 219 O THR A 91 2.327 8.394 -5.453 1.00 0.00 O ATOM 220 CB THR A 91 3.016 10.834 -7.466 1.00 0.00 C ATOM 221 OG1 THR A 91 3.331 11.988 -6.680 1.00 0.00 O ATOM 222 CG2 THR A 91 2.867 11.233 -8.926 1.00 0.00 C ATOM 0 H THR A 91 0.788 11.992 -7.417 1.00 0.00 H new ATOM 0 HA THR A 91 1.422 9.387 -7.630 1.00 0.00 H new ATOM 0 HB THR A 91 3.825 10.108 -7.385 1.00 0.00 H new ATOM 0 HG1 THR A 91 3.939 12.570 -7.182 1.00 0.00 H new ATOM 0 HG21 THR A 91 3.791 11.695 -9.273 1.00 0.00 H new ATOM 0 HG22 THR A 91 2.656 10.347 -9.526 1.00 0.00 H new ATOM 0 HG23 THR A 91 2.046 11.943 -9.027 1.00 0.00 H new ATOM 230 N ARG A 92 1.850 10.391 -4.531 1.00 0.00 N ATOM 231 CA ARG A 92 2.079 9.937 -3.165 1.00 0.00 C ATOM 232 C ARG A 92 0.927 9.059 -2.683 1.00 0.00 C ATOM 233 O ARG A 92 -0.242 9.369 -2.912 1.00 0.00 O ATOM 234 CB ARG A 92 2.247 11.135 -2.228 1.00 0.00 C ATOM 235 CG ARG A 92 2.976 10.802 -0.937 1.00 0.00 C ATOM 236 CD ARG A 92 2.634 11.789 0.167 1.00 0.00 C ATOM 237 NE ARG A 92 3.392 13.032 0.044 1.00 0.00 N ATOM 238 CZ ARG A 92 3.006 14.184 0.581 1.00 0.00 C ATOM 239 NH1 ARG A 92 1.878 14.252 1.273 1.00 0.00 N ATOM 240 NH2 ARG A 92 3.750 15.272 0.426 1.00 0.00 N ATOM 0 H ARG A 92 1.575 11.370 -4.610 1.00 0.00 H new ATOM 0 HA ARG A 92 2.994 9.345 -3.155 1.00 0.00 H new ATOM 0 HB2 ARG A 92 2.793 11.921 -2.751 1.00 0.00 H new ATOM 0 HB3 ARG A 92 1.263 11.537 -1.986 1.00 0.00 H new ATOM 0 HG2 ARG A 92 2.712 9.793 -0.619 1.00 0.00 H new ATOM 0 HG3 ARG A 92 4.052 10.810 -1.113 1.00 0.00 H new ATOM 0 HD2 ARG A 92 1.567 12.011 0.138 1.00 0.00 H new ATOM 0 HD3 ARG A 92 2.838 11.334 1.136 1.00 0.00 H new ATOM 0 HE ARG A 92 4.265 13.014 -0.483 1.00 0.00 H new ATOM 0 HH11 ARG A 92 1.303 13.418 1.395 1.00 0.00 H new ATOM 0 HH12 ARG A 92 1.584 15.138 1.684 1.00 0.00 H new ATOM 0 HH21 ARG A 92 4.619 15.224 -0.106 1.00 0.00 H new ATOM 0 HH22 ARG A 92 3.453 16.156 0.839 1.00 0.00 H new ATOM 254 N LEU A 93 1.267 7.962 -2.015 1.00 0.00 N ATOM 255 CA LEU A 93 0.262 7.038 -1.501 1.00 0.00 C ATOM 256 C LEU A 93 0.543 6.682 -0.045 1.00 0.00 C ATOM 257 O LEU A 93 1.639 6.235 0.294 1.00 0.00 O ATOM 258 CB LEU A 93 0.227 5.766 -2.351 1.00 0.00 C ATOM 259 CG LEU A 93 0.041 5.969 -3.855 1.00 0.00 C ATOM 260 CD1 LEU A 93 -0.027 4.629 -4.570 1.00 0.00 C ATOM 261 CD2 LEU A 93 -1.213 6.787 -4.132 1.00 0.00 C ATOM 0 H LEU A 93 2.230 7.691 -1.817 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.709 7.530 -1.555 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.157 5.220 -2.191 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -0.582 5.132 -1.987 1.00 0.00 H new ATOM 0 HG LEU A 93 0.901 6.519 -4.237 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.160 4.793 -5.639 1.00 0.00 H new ATOM 0 HD12 LEU A 93 0.898 4.078 -4.399 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.868 4.053 -4.184 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.329 6.922 -5.207 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -2.083 6.264 -3.735 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -1.125 7.762 -3.652 1.00 0.00 H new ATOM 273 N TRP A 94 -0.453 6.882 0.811 1.00 0.00 N ATOM 274 CA TRP A 94 -0.313 6.580 2.231 1.00 0.00 C ATOM 275 C TRP A 94 -0.635 5.116 2.510 1.00 0.00 C ATOM 276 O TRP A 94 -1.563 4.553 1.930 1.00 0.00 O ATOM 277 CB TRP A 94 -1.228 7.484 3.058 1.00 0.00 C ATOM 278 CG TRP A 94 -1.234 7.146 4.518 1.00 0.00 C ATOM 279 CD1 TRP A 94 -0.509 7.754 5.503 1.00 0.00 C ATOM 280 CD2 TRP A 94 -2.001 6.120 5.157 1.00 0.00 C ATOM 281 NE1 TRP A 94 -0.779 7.167 6.716 1.00 0.00 N ATOM 282 CE2 TRP A 94 -1.692 6.163 6.531 1.00 0.00 C ATOM 283 CE3 TRP A 94 -2.921 5.170 4.704 1.00 0.00 C ATOM 284 CZ2 TRP A 94 -2.269 5.292 7.451 1.00 0.00 C ATOM 285 CZ3 TRP A 94 -3.492 4.307 5.618 1.00 0.00 C ATOM 286 CH2 TRP A 94 -3.166 4.372 6.979 1.00 0.00 C ATOM 0 H TRP A 94 -1.366 7.252 0.547 1.00 0.00 H new ATOM 0 HA TRP A 94 0.722 6.765 2.517 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -0.913 8.520 2.933 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -2.245 7.412 2.671 1.00 0.00 H new ATOM 0 HD1 TRP A 94 0.176 8.575 5.351 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -0.366 7.436 7.609 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -3.181 5.112 3.657 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -2.018 5.340 8.500 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -4.203 3.569 5.278 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -3.631 3.683 7.669 1.00 0.00 H new ATOM 297 N VAL A 95 0.137 4.504 3.403 1.00 0.00 N ATOM 298 CA VAL A 95 -0.068 3.106 3.760 1.00 0.00 C ATOM 299 C VAL A 95 -0.011 2.911 5.271 1.00 0.00 C ATOM 300 O VAL A 95 0.938 3.337 5.928 1.00 0.00 O ATOM 301 CB VAL A 95 0.984 2.197 3.097 1.00 0.00 C ATOM 302 CG1 VAL A 95 0.632 0.732 3.304 1.00 0.00 C ATOM 303 CG2 VAL A 95 1.107 2.520 1.615 1.00 0.00 C ATOM 0 H VAL A 95 0.910 4.955 3.892 1.00 0.00 H new ATOM 0 HA VAL A 95 -1.058 2.829 3.397 1.00 0.00 H new ATOM 0 HB VAL A 95 1.949 2.383 3.568 1.00 0.00 H new ATOM 0 HG11 VAL A 95 1.387 0.106 2.828 1.00 0.00 H new ATOM 0 HG12 VAL A 95 0.599 0.513 4.371 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.342 0.526 2.861 1.00 0.00 H new ATOM 0 HG21 VAL A 95 1.854 1.869 1.162 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.145 2.363 1.127 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.410 3.560 1.493 1.00 0.00 H new ATOM 313 N GLY A 96 -1.035 2.262 5.818 1.00 0.00 N ATOM 314 CA GLY A 96 -1.083 2.021 7.248 1.00 0.00 C ATOM 315 C GLY A 96 -1.042 0.545 7.589 1.00 0.00 C ATOM 316 O GLY A 96 -0.623 -0.276 6.774 1.00 0.00 O ATOM 0 H GLY A 96 -1.832 1.899 5.296 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -0.243 2.525 7.727 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -1.993 2.460 7.657 1.00 0.00 H new ATOM 320 N GLY A 97 -1.477 0.206 8.799 1.00 0.00 N ATOM 321 CA GLY A 97 -1.478 -1.181 9.225 1.00 0.00 C ATOM 322 C GLY A 97 -0.092 -1.794 9.207 1.00 0.00 C ATOM 323 O GLY A 97 0.095 -2.912 8.724 1.00 0.00 O ATOM 0 H GLY A 97 -1.829 0.867 9.491 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -1.889 -1.248 10.233 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -2.135 -1.757 8.574 1.00 0.00 H new ATOM 327 N LEU A 98 0.884 -1.062 9.732 1.00 0.00 N ATOM 328 CA LEU A 98 2.262 -1.540 9.773 1.00 0.00 C ATOM 329 C LEU A 98 2.699 -1.818 11.208 1.00 0.00 C ATOM 330 O LEU A 98 2.078 -1.346 12.160 1.00 0.00 O ATOM 331 CB LEU A 98 3.198 -0.513 9.133 1.00 0.00 C ATOM 332 CG LEU A 98 2.857 -0.094 7.702 1.00 0.00 C ATOM 333 CD1 LEU A 98 3.762 1.040 7.248 1.00 0.00 C ATOM 334 CD2 LEU A 98 2.972 -1.281 6.758 1.00 0.00 C ATOM 0 H LEU A 98 0.747 -0.135 10.135 1.00 0.00 H new ATOM 0 HA LEU A 98 2.315 -2.471 9.209 1.00 0.00 H new ATOM 0 HB2 LEU A 98 3.208 0.379 9.759 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.210 -0.919 9.140 1.00 0.00 H new ATOM 0 HG LEU A 98 1.827 0.261 7.683 1.00 0.00 H new ATOM 0 HD11 LEU A 98 3.505 1.325 6.228 1.00 0.00 H new ATOM 0 HD12 LEU A 98 3.630 1.897 7.908 1.00 0.00 H new ATOM 0 HD13 LEU A 98 4.801 0.712 7.282 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.726 -0.965 5.744 1.00 0.00 H new ATOM 0 HD22 LEU A 98 3.991 -1.666 6.781 1.00 0.00 H new ATOM 0 HD23 LEU A 98 2.281 -2.064 7.072 1.00 0.00 H new ATOM 346 N GLY A 99 3.774 -2.586 11.355 1.00 0.00 N ATOM 347 CA GLY A 99 4.278 -2.913 12.676 1.00 0.00 C ATOM 348 C GLY A 99 5.676 -3.496 12.636 1.00 0.00 C ATOM 349 O GLY A 99 6.383 -3.402 11.632 1.00 0.00 O ATOM 0 H GLY A 99 4.305 -2.988 10.582 1.00 0.00 H new ATOM 0 HA2 GLY A 99 4.280 -2.015 13.293 1.00 0.00 H new ATOM 0 HA3 GLY A 99 3.604 -3.625 13.152 1.00 0.00 H new ATOM 353 N PRO A 100 6.096 -4.115 13.750 1.00 0.00 N ATOM 354 CA PRO A 100 7.423 -4.727 13.864 1.00 0.00 C ATOM 355 C PRO A 100 7.561 -5.976 13.001 1.00 0.00 C ATOM 356 O PRO A 100 8.618 -6.605 12.966 1.00 0.00 O ATOM 357 CB PRO A 100 7.521 -5.089 15.348 1.00 0.00 C ATOM 358 CG PRO A 100 6.108 -5.246 15.793 1.00 0.00 C ATOM 359 CD PRO A 100 5.307 -4.264 14.984 1.00 0.00 C ATOM 0 HA PRO A 100 8.212 -4.057 13.522 1.00 0.00 H new ATOM 0 HB2 PRO A 100 8.087 -6.009 15.495 1.00 0.00 H new ATOM 0 HB3 PRO A 100 8.030 -4.308 15.913 1.00 0.00 H new ATOM 0 HG2 PRO A 100 5.758 -6.265 15.628 1.00 0.00 H new ATOM 0 HG3 PRO A 100 6.010 -5.044 16.860 1.00 0.00 H new ATOM 0 HD2 PRO A 100 4.304 -4.637 14.777 1.00 0.00 H new ATOM 0 HD3 PRO A 100 5.192 -3.313 15.505 1.00 0.00 H new ATOM 367 N ASN A 101 6.485 -6.330 12.304 1.00 0.00 N ATOM 368 CA ASN A 101 6.487 -7.506 11.441 1.00 0.00 C ATOM 369 C ASN A 101 6.634 -7.104 9.976 1.00 0.00 C ATOM 370 O ASN A 101 7.515 -7.596 9.271 1.00 0.00 O ATOM 371 CB ASN A 101 5.199 -8.308 11.634 1.00 0.00 C ATOM 372 CG ASN A 101 5.315 -9.327 12.752 1.00 0.00 C ATOM 373 OD1 ASN A 101 5.378 -8.970 13.928 1.00 0.00 O ATOM 374 ND2 ASN A 101 5.345 -10.604 12.387 1.00 0.00 N ATOM 0 H ASN A 101 5.602 -5.820 12.320 1.00 0.00 H new ATOM 0 HA ASN A 101 7.339 -8.128 11.717 1.00 0.00 H new ATOM 0 HB2 ASN A 101 4.378 -7.625 11.852 1.00 0.00 H new ATOM 0 HB3 ASN A 101 4.950 -8.819 10.704 1.00 0.00 H new ATOM 0 HD21 ASN A 101 5.423 -11.335 13.094 1.00 0.00 H new ATOM 0 HD22 ASN A 101 5.290 -10.854 11.400 1.00 0.00 H new ATOM 381 N THR A 102 5.764 -6.206 9.524 1.00 0.00 N ATOM 382 CA THR A 102 5.796 -5.738 8.144 1.00 0.00 C ATOM 383 C THR A 102 7.137 -5.095 7.812 1.00 0.00 C ATOM 384 O THR A 102 7.433 -3.987 8.260 1.00 0.00 O ATOM 385 CB THR A 102 4.671 -4.723 7.869 1.00 0.00 C ATOM 386 OG1 THR A 102 3.413 -5.258 8.295 1.00 0.00 O ATOM 387 CG2 THR A 102 4.605 -4.376 6.389 1.00 0.00 C ATOM 0 H THR A 102 5.028 -5.788 10.094 1.00 0.00 H new ATOM 0 HA THR A 102 5.649 -6.613 7.511 1.00 0.00 H new ATOM 0 HB THR A 102 4.887 -3.814 8.430 1.00 0.00 H new ATOM 0 HG1 THR A 102 2.703 -4.606 8.118 1.00 0.00 H new ATOM 0 HG21 THR A 102 3.803 -3.658 6.219 1.00 0.00 H new ATOM 0 HG22 THR A 102 5.554 -3.942 6.074 1.00 0.00 H new ATOM 0 HG23 THR A 102 4.411 -5.280 5.812 1.00 0.00 H new ATOM 395 N SER A 103 7.946 -5.797 7.024 1.00 0.00 N ATOM 396 CA SER A 103 9.259 -5.295 6.635 1.00 0.00 C ATOM 397 C SER A 103 9.162 -4.442 5.374 1.00 0.00 C ATOM 398 O SER A 103 8.739 -4.918 4.319 1.00 0.00 O ATOM 399 CB SER A 103 10.225 -6.459 6.405 1.00 0.00 C ATOM 400 OG SER A 103 10.495 -7.144 7.615 1.00 0.00 O ATOM 0 H SER A 103 7.715 -6.714 6.643 1.00 0.00 H new ATOM 0 HA SER A 103 9.638 -4.672 7.445 1.00 0.00 H new ATOM 0 HB2 SER A 103 9.799 -7.151 5.679 1.00 0.00 H new ATOM 0 HB3 SER A 103 11.156 -6.084 5.980 1.00 0.00 H new ATOM 0 HG SER A 103 11.113 -7.884 7.441 1.00 0.00 H new ATOM 406 N LEU A 104 9.556 -3.179 5.490 1.00 0.00 N ATOM 407 CA LEU A 104 9.514 -2.257 4.360 1.00 0.00 C ATOM 408 C LEU A 104 9.964 -2.949 3.077 1.00 0.00 C ATOM 409 O LEU A 104 9.274 -2.899 2.059 1.00 0.00 O ATOM 410 CB LEU A 104 10.401 -1.041 4.635 1.00 0.00 C ATOM 411 CG LEU A 104 10.125 0.197 3.782 1.00 0.00 C ATOM 412 CD1 LEU A 104 10.512 1.461 4.534 1.00 0.00 C ATOM 413 CD2 LEU A 104 10.873 0.111 2.459 1.00 0.00 C ATOM 0 H LEU A 104 9.908 -2.769 6.355 1.00 0.00 H new ATOM 0 HA LEU A 104 8.484 -1.925 4.231 1.00 0.00 H new ATOM 0 HB2 LEU A 104 10.292 -0.766 5.684 1.00 0.00 H new ATOM 0 HB3 LEU A 104 11.441 -1.334 4.489 1.00 0.00 H new ATOM 0 HG LEU A 104 9.056 0.238 3.570 1.00 0.00 H new ATOM 0 HD11 LEU A 104 10.308 2.332 3.911 1.00 0.00 H new ATOM 0 HD12 LEU A 104 9.931 1.529 5.454 1.00 0.00 H new ATOM 0 HD13 LEU A 104 11.574 1.429 4.777 1.00 0.00 H new ATOM 0 HD21 LEU A 104 10.665 1.001 1.865 1.00 0.00 H new ATOM 0 HD22 LEU A 104 11.944 0.045 2.650 1.00 0.00 H new ATOM 0 HD23 LEU A 104 10.547 -0.774 1.913 1.00 0.00 H new ATOM 425 N ALA A 105 11.124 -3.595 3.134 1.00 0.00 N ATOM 426 CA ALA A 105 11.663 -4.300 1.978 1.00 0.00 C ATOM 427 C ALA A 105 10.559 -5.017 1.208 1.00 0.00 C ATOM 428 O ALA A 105 10.472 -4.910 -0.015 1.00 0.00 O ATOM 429 CB ALA A 105 12.733 -5.289 2.415 1.00 0.00 C ATOM 0 H ALA A 105 11.708 -3.645 3.969 1.00 0.00 H new ATOM 0 HA ALA A 105 12.114 -3.564 1.313 1.00 0.00 H new ATOM 0 HB1 ALA A 105 13.127 -5.809 1.541 1.00 0.00 H new ATOM 0 HB2 ALA A 105 13.541 -4.754 2.914 1.00 0.00 H new ATOM 0 HB3 ALA A 105 12.299 -6.014 3.103 1.00 0.00 H new ATOM 435 N ALA A 106 9.719 -5.750 1.932 1.00 0.00 N ATOM 436 CA ALA A 106 8.621 -6.484 1.318 1.00 0.00 C ATOM 437 C ALA A 106 7.684 -5.543 0.566 1.00 0.00 C ATOM 438 O ALA A 106 7.546 -5.633 -0.654 1.00 0.00 O ATOM 439 CB ALA A 106 7.852 -7.265 2.373 1.00 0.00 C ATOM 0 H ALA A 106 9.779 -5.851 2.945 1.00 0.00 H new ATOM 0 HA ALA A 106 9.044 -7.186 0.599 1.00 0.00 H new ATOM 0 HB1 ALA A 106 7.034 -7.809 1.899 1.00 0.00 H new ATOM 0 HB2 ALA A 106 8.522 -7.972 2.863 1.00 0.00 H new ATOM 0 HB3 ALA A 106 7.448 -6.575 3.114 1.00 0.00 H new ATOM 445 N LEU A 107 7.043 -4.642 1.302 1.00 0.00 N ATOM 446 CA LEU A 107 6.118 -3.685 0.705 1.00 0.00 C ATOM 447 C LEU A 107 6.747 -3.003 -0.506 1.00 0.00 C ATOM 448 O LEU A 107 6.242 -3.110 -1.623 1.00 0.00 O ATOM 449 CB LEU A 107 5.704 -2.635 1.737 1.00 0.00 C ATOM 450 CG LEU A 107 4.906 -3.150 2.936 1.00 0.00 C ATOM 451 CD1 LEU A 107 4.544 -2.005 3.869 1.00 0.00 C ATOM 452 CD2 LEU A 107 3.653 -3.877 2.470 1.00 0.00 C ATOM 0 H LEU A 107 7.147 -4.554 2.313 1.00 0.00 H new ATOM 0 HA LEU A 107 5.234 -4.229 0.374 1.00 0.00 H new ATOM 0 HB2 LEU A 107 6.604 -2.145 2.108 1.00 0.00 H new ATOM 0 HB3 LEU A 107 5.111 -1.872 1.232 1.00 0.00 H new ATOM 0 HG LEU A 107 5.529 -3.856 3.486 1.00 0.00 H new ATOM 0 HD11 LEU A 107 3.977 -2.391 4.716 1.00 0.00 H new ATOM 0 HD12 LEU A 107 5.455 -1.528 4.230 1.00 0.00 H new ATOM 0 HD13 LEU A 107 3.940 -1.274 3.331 1.00 0.00 H new ATOM 0 HD21 LEU A 107 3.098 -4.237 3.336 1.00 0.00 H new ATOM 0 HD22 LEU A 107 3.028 -3.193 1.896 1.00 0.00 H new ATOM 0 HD23 LEU A 107 3.935 -4.723 1.843 1.00 0.00 H new ATOM 464 N ALA A 108 7.854 -2.304 -0.277 1.00 0.00 N ATOM 465 CA ALA A 108 8.554 -1.609 -1.349 1.00 0.00 C ATOM 466 C ALA A 108 8.599 -2.457 -2.616 1.00 0.00 C ATOM 467 O ALA A 108 8.304 -1.974 -3.709 1.00 0.00 O ATOM 468 CB ALA A 108 9.963 -1.240 -0.908 1.00 0.00 C ATOM 0 H ALA A 108 8.285 -2.204 0.642 1.00 0.00 H new ATOM 0 HA ALA A 108 8.005 -0.695 -1.574 1.00 0.00 H new ATOM 0 HB1 ALA A 108 10.474 -0.721 -1.719 1.00 0.00 H new ATOM 0 HB2 ALA A 108 9.912 -0.588 -0.036 1.00 0.00 H new ATOM 0 HB3 ALA A 108 10.513 -2.146 -0.653 1.00 0.00 H new ATOM 474 N ARG A 109 8.972 -3.724 -2.461 1.00 0.00 N ATOM 475 CA ARG A 109 9.057 -4.639 -3.593 1.00 0.00 C ATOM 476 C ARG A 109 7.701 -4.788 -4.275 1.00 0.00 C ATOM 477 O ARG A 109 7.601 -4.719 -5.500 1.00 0.00 O ATOM 478 CB ARG A 109 9.561 -6.008 -3.132 1.00 0.00 C ATOM 479 CG ARG A 109 10.003 -6.909 -4.273 1.00 0.00 C ATOM 480 CD ARG A 109 9.890 -8.379 -3.898 1.00 0.00 C ATOM 481 NE ARG A 109 10.601 -9.240 -4.838 1.00 0.00 N ATOM 482 CZ ARG A 109 10.646 -10.564 -4.733 1.00 0.00 C ATOM 483 NH1 ARG A 109 10.023 -11.174 -3.734 1.00 0.00 N ATOM 484 NH2 ARG A 109 11.314 -11.279 -5.628 1.00 0.00 N ATOM 0 H ARG A 109 9.220 -4.139 -1.563 1.00 0.00 H new ATOM 0 HA ARG A 109 9.762 -4.223 -4.312 1.00 0.00 H new ATOM 0 HB2 ARG A 109 10.397 -5.866 -2.447 1.00 0.00 H new ATOM 0 HB3 ARG A 109 8.771 -6.507 -2.571 1.00 0.00 H new ATOM 0 HG2 ARG A 109 9.392 -6.709 -5.153 1.00 0.00 H new ATOM 0 HG3 ARG A 109 11.034 -6.679 -4.541 1.00 0.00 H new ATOM 0 HD2 ARG A 109 10.290 -8.529 -2.895 1.00 0.00 H new ATOM 0 HD3 ARG A 109 8.839 -8.666 -3.868 1.00 0.00 H new ATOM 0 HE ARG A 109 11.090 -8.801 -5.618 1.00 0.00 H new ATOM 0 HH11 ARG A 109 9.508 -10.627 -3.044 1.00 0.00 H new ATOM 0 HH12 ARG A 109 10.059 -12.190 -3.655 1.00 0.00 H new ATOM 0 HH21 ARG A 109 11.794 -10.813 -6.398 1.00 0.00 H new ATOM 0 HH22 ARG A 109 11.348 -12.295 -5.546 1.00 0.00 H new ATOM 498 N GLU A 110 6.660 -4.992 -3.474 1.00 0.00 N ATOM 499 CA GLU A 110 5.310 -5.152 -4.002 1.00 0.00 C ATOM 500 C GLU A 110 4.889 -3.921 -4.800 1.00 0.00 C ATOM 501 O GLU A 110 4.576 -4.014 -5.987 1.00 0.00 O ATOM 502 CB GLU A 110 4.319 -5.400 -2.863 1.00 0.00 C ATOM 503 CG GLU A 110 4.633 -6.638 -2.042 1.00 0.00 C ATOM 504 CD GLU A 110 4.297 -7.924 -2.772 1.00 0.00 C ATOM 505 OE1 GLU A 110 3.109 -8.129 -3.097 1.00 0.00 O ATOM 506 OE2 GLU A 110 5.223 -8.725 -3.020 1.00 0.00 O ATOM 0 H GLU A 110 6.725 -5.050 -2.458 1.00 0.00 H new ATOM 0 HA GLU A 110 5.308 -6.014 -4.669 1.00 0.00 H new ATOM 0 HB2 GLU A 110 4.310 -4.531 -2.205 1.00 0.00 H new ATOM 0 HB3 GLU A 110 3.316 -5.495 -3.280 1.00 0.00 H new ATOM 0 HG2 GLU A 110 5.692 -6.638 -1.782 1.00 0.00 H new ATOM 0 HG3 GLU A 110 4.075 -6.600 -1.106 1.00 0.00 H new ATOM 513 N PHE A 111 4.882 -2.769 -4.138 1.00 0.00 N ATOM 514 CA PHE A 111 4.497 -1.519 -4.783 1.00 0.00 C ATOM 515 C PHE A 111 5.328 -1.278 -6.040 1.00 0.00 C ATOM 516 O PHE A 111 4.797 -0.899 -7.084 1.00 0.00 O ATOM 517 CB PHE A 111 4.666 -0.347 -3.814 1.00 0.00 C ATOM 518 CG PHE A 111 3.532 -0.208 -2.838 1.00 0.00 C ATOM 519 CD1 PHE A 111 3.498 -0.972 -1.683 1.00 0.00 C ATOM 520 CD2 PHE A 111 2.502 0.687 -3.077 1.00 0.00 C ATOM 521 CE1 PHE A 111 2.455 -0.846 -0.784 1.00 0.00 C ATOM 522 CE2 PHE A 111 1.457 0.817 -2.181 1.00 0.00 C ATOM 523 CZ PHE A 111 1.434 0.050 -1.033 1.00 0.00 C ATOM 0 H PHE A 111 5.139 -2.675 -3.155 1.00 0.00 H new ATOM 0 HA PHE A 111 3.448 -1.595 -5.070 1.00 0.00 H new ATOM 0 HB2 PHE A 111 5.597 -0.474 -3.261 1.00 0.00 H new ATOM 0 HB3 PHE A 111 4.758 0.576 -4.386 1.00 0.00 H new ATOM 0 HD1 PHE A 111 4.294 -1.673 -1.483 1.00 0.00 H new ATOM 0 HD2 PHE A 111 2.515 1.290 -3.973 1.00 0.00 H new ATOM 0 HE1 PHE A 111 2.439 -1.448 0.113 1.00 0.00 H new ATOM 0 HE2 PHE A 111 0.659 1.518 -2.379 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.619 0.151 -0.331 1.00 0.00 H new ATOM 533 N ASP A 112 6.633 -1.499 -5.931 1.00 0.00 N ATOM 534 CA ASP A 112 7.538 -1.307 -7.058 1.00 0.00 C ATOM 535 C ASP A 112 7.012 -2.011 -8.304 1.00 0.00 C ATOM 536 O ASP A 112 7.024 -1.448 -9.399 1.00 0.00 O ATOM 537 CB ASP A 112 8.934 -1.829 -6.713 1.00 0.00 C ATOM 538 CG ASP A 112 9.998 -1.306 -7.659 1.00 0.00 C ATOM 539 OD1 ASP A 112 10.457 -0.162 -7.461 1.00 0.00 O ATOM 540 OD2 ASP A 112 10.371 -2.042 -8.596 1.00 0.00 O ATOM 0 H ASP A 112 7.088 -1.811 -5.073 1.00 0.00 H new ATOM 0 HA ASP A 112 7.599 -0.239 -7.265 1.00 0.00 H new ATOM 0 HB2 ASP A 112 9.185 -1.539 -5.693 1.00 0.00 H new ATOM 0 HB3 ASP A 112 8.929 -2.919 -6.743 1.00 0.00 H new ATOM 545 N ARG A 113 6.552 -3.246 -8.130 1.00 0.00 N ATOM 546 CA ARG A 113 6.023 -4.028 -9.241 1.00 0.00 C ATOM 547 C ARG A 113 5.261 -3.138 -10.218 1.00 0.00 C ATOM 548 O ARG A 113 5.523 -3.152 -11.421 1.00 0.00 O ATOM 549 CB ARG A 113 5.105 -5.136 -8.721 1.00 0.00 C ATOM 550 CG ARG A 113 5.837 -6.222 -7.951 1.00 0.00 C ATOM 551 CD ARG A 113 6.672 -7.095 -8.876 1.00 0.00 C ATOM 552 NE ARG A 113 7.206 -8.267 -8.188 1.00 0.00 N ATOM 553 CZ ARG A 113 8.220 -8.991 -8.649 1.00 0.00 C ATOM 554 NH1 ARG A 113 8.807 -8.663 -9.791 1.00 0.00 N ATOM 555 NH2 ARG A 113 8.649 -10.044 -7.965 1.00 0.00 N ATOM 0 H ARG A 113 6.535 -3.726 -7.230 1.00 0.00 H new ATOM 0 HA ARG A 113 6.864 -4.479 -9.768 1.00 0.00 H new ATOM 0 HB2 ARG A 113 4.346 -4.694 -8.076 1.00 0.00 H new ATOM 0 HB3 ARG A 113 4.583 -5.589 -9.564 1.00 0.00 H new ATOM 0 HG2 ARG A 113 6.482 -5.765 -7.200 1.00 0.00 H new ATOM 0 HG3 ARG A 113 5.115 -6.841 -7.418 1.00 0.00 H new ATOM 0 HD2 ARG A 113 6.061 -7.417 -9.720 1.00 0.00 H new ATOM 0 HD3 ARG A 113 7.495 -6.508 -9.284 1.00 0.00 H new ATOM 0 HE ARG A 113 6.777 -8.545 -7.305 1.00 0.00 H new ATOM 0 HH11 ARG A 113 8.480 -7.853 -10.318 1.00 0.00 H new ATOM 0 HH12 ARG A 113 9.585 -9.220 -10.143 1.00 0.00 H new ATOM 0 HH21 ARG A 113 8.200 -10.298 -7.085 1.00 0.00 H new ATOM 0 HH22 ARG A 113 9.428 -10.600 -8.319 1.00 0.00 H new ATOM 569 N PHE A 114 4.316 -2.365 -9.693 1.00 0.00 N ATOM 570 CA PHE A 114 3.515 -1.469 -10.519 1.00 0.00 C ATOM 571 C PHE A 114 4.395 -0.432 -11.210 1.00 0.00 C ATOM 572 O PHE A 114 4.430 -0.350 -12.437 1.00 0.00 O ATOM 573 CB PHE A 114 2.454 -0.768 -9.668 1.00 0.00 C ATOM 574 CG PHE A 114 1.523 -1.717 -8.970 1.00 0.00 C ATOM 575 CD1 PHE A 114 0.571 -2.427 -9.685 1.00 0.00 C ATOM 576 CD2 PHE A 114 1.598 -1.900 -7.598 1.00 0.00 C ATOM 577 CE1 PHE A 114 -0.288 -3.300 -9.044 1.00 0.00 C ATOM 578 CE2 PHE A 114 0.742 -2.772 -6.952 1.00 0.00 C ATOM 579 CZ PHE A 114 -0.201 -3.474 -7.677 1.00 0.00 C ATOM 0 H PHE A 114 4.086 -2.341 -8.700 1.00 0.00 H new ATOM 0 HA PHE A 114 3.020 -2.067 -11.284 1.00 0.00 H new ATOM 0 HB2 PHE A 114 2.950 -0.145 -8.924 1.00 0.00 H new ATOM 0 HB3 PHE A 114 1.871 -0.102 -10.304 1.00 0.00 H new ATOM 0 HD1 PHE A 114 0.500 -2.297 -10.755 1.00 0.00 H new ATOM 0 HD2 PHE A 114 2.334 -1.354 -7.027 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -1.027 -3.846 -9.612 1.00 0.00 H new ATOM 0 HE2 PHE A 114 0.810 -2.904 -5.882 1.00 0.00 H new ATOM 0 HZ PHE A 114 -0.869 -4.158 -7.175 1.00 0.00 H new ATOM 589 N GLY A 115 5.106 0.358 -10.411 1.00 0.00 N ATOM 590 CA GLY A 115 5.977 1.380 -10.963 1.00 0.00 C ATOM 591 C GLY A 115 7.208 1.614 -10.110 1.00 0.00 C ATOM 592 O GLY A 115 7.421 0.925 -9.113 1.00 0.00 O ATOM 0 H GLY A 115 5.095 0.309 -9.392 1.00 0.00 H new ATOM 0 HA2 GLY A 115 6.285 1.088 -11.967 1.00 0.00 H new ATOM 0 HA3 GLY A 115 5.422 2.313 -11.059 1.00 0.00 H new ATOM 596 N SER A 116 8.021 2.589 -10.503 1.00 0.00 N ATOM 597 CA SER A 116 9.241 2.909 -9.771 1.00 0.00 C ATOM 598 C SER A 116 8.939 3.817 -8.583 1.00 0.00 C ATOM 599 O SER A 116 8.298 4.858 -8.731 1.00 0.00 O ATOM 600 CB SER A 116 10.256 3.582 -10.697 1.00 0.00 C ATOM 601 OG SER A 116 10.799 2.653 -11.619 1.00 0.00 O ATOM 0 H SER A 116 7.857 3.171 -11.324 1.00 0.00 H new ATOM 0 HA SER A 116 9.665 1.977 -9.396 1.00 0.00 H new ATOM 0 HB2 SER A 116 9.775 4.397 -11.238 1.00 0.00 H new ATOM 0 HB3 SER A 116 11.058 4.022 -10.104 1.00 0.00 H new ATOM 0 HG SER A 116 11.443 3.108 -12.201 1.00 0.00 H new ATOM 607 N ILE A 117 9.405 3.416 -7.405 1.00 0.00 N ATOM 608 CA ILE A 117 9.187 4.193 -6.192 1.00 0.00 C ATOM 609 C ILE A 117 10.318 5.190 -5.966 1.00 0.00 C ATOM 610 O ILE A 117 11.453 4.803 -5.688 1.00 0.00 O ATOM 611 CB ILE A 117 9.064 3.284 -4.955 1.00 0.00 C ATOM 612 CG1 ILE A 117 7.811 2.413 -5.057 1.00 0.00 C ATOM 613 CG2 ILE A 117 9.033 4.120 -3.684 1.00 0.00 C ATOM 614 CD1 ILE A 117 7.899 1.131 -4.259 1.00 0.00 C ATOM 0 H ILE A 117 9.936 2.557 -7.265 1.00 0.00 H new ATOM 0 HA ILE A 117 8.251 4.735 -6.329 1.00 0.00 H new ATOM 0 HB ILE A 117 9.935 2.630 -4.915 1.00 0.00 H new ATOM 0 HG12 ILE A 117 6.951 2.987 -4.713 1.00 0.00 H new ATOM 0 HG13 ILE A 117 7.633 2.168 -6.104 1.00 0.00 H new ATOM 0 HG21 ILE A 117 8.946 3.463 -2.819 1.00 0.00 H new ATOM 0 HG22 ILE A 117 9.952 4.701 -3.608 1.00 0.00 H new ATOM 0 HG23 ILE A 117 8.179 4.796 -3.714 1.00 0.00 H new ATOM 0 HD11 ILE A 117 6.976 0.564 -4.378 1.00 0.00 H new ATOM 0 HD12 ILE A 117 8.739 0.536 -4.618 1.00 0.00 H new ATOM 0 HD13 ILE A 117 8.046 1.368 -3.205 1.00 0.00 H new ATOM 626 N ARG A 118 10.000 6.475 -6.087 1.00 0.00 N ATOM 627 CA ARG A 118 10.990 7.528 -5.895 1.00 0.00 C ATOM 628 C ARG A 118 11.704 7.366 -4.556 1.00 0.00 C ATOM 629 O ARG A 118 12.920 7.172 -4.507 1.00 0.00 O ATOM 630 CB ARG A 118 10.324 8.903 -5.966 1.00 0.00 C ATOM 631 CG ARG A 118 11.268 10.016 -6.391 1.00 0.00 C ATOM 632 CD ARG A 118 10.557 11.360 -6.442 1.00 0.00 C ATOM 633 NE ARG A 118 11.252 12.314 -7.302 1.00 0.00 N ATOM 634 CZ ARG A 118 11.164 12.309 -8.627 1.00 0.00 C ATOM 635 NH1 ARG A 118 10.414 11.405 -9.241 1.00 0.00 N ATOM 636 NH2 ARG A 118 11.827 13.210 -9.340 1.00 0.00 N ATOM 0 H ARG A 118 9.065 6.812 -6.317 1.00 0.00 H new ATOM 0 HA ARG A 118 11.728 7.447 -6.693 1.00 0.00 H new ATOM 0 HB2 ARG A 118 9.490 8.858 -6.667 1.00 0.00 H new ATOM 0 HB3 ARG A 118 9.906 9.146 -4.989 1.00 0.00 H new ATOM 0 HG2 ARG A 118 12.104 10.072 -5.694 1.00 0.00 H new ATOM 0 HG3 ARG A 118 11.685 9.786 -7.371 1.00 0.00 H new ATOM 0 HD2 ARG A 118 9.539 11.218 -6.806 1.00 0.00 H new ATOM 0 HD3 ARG A 118 10.481 11.769 -5.434 1.00 0.00 H new ATOM 0 HE ARG A 118 11.837 13.023 -6.861 1.00 0.00 H new ATOM 0 HH11 ARG A 118 9.903 10.711 -8.696 1.00 0.00 H new ATOM 0 HH12 ARG A 118 10.348 11.403 -10.259 1.00 0.00 H new ATOM 0 HH21 ARG A 118 12.405 13.907 -8.871 1.00 0.00 H new ATOM 0 HH22 ARG A 118 11.759 13.206 -10.358 1.00 0.00 H new ATOM 650 N THR A 119 10.941 7.447 -3.471 1.00 0.00 N ATOM 651 CA THR A 119 11.501 7.312 -2.132 1.00 0.00 C ATOM 652 C THR A 119 10.413 6.997 -1.111 1.00 0.00 C ATOM 653 O THR A 119 9.233 7.256 -1.348 1.00 0.00 O ATOM 654 CB THR A 119 12.239 8.592 -1.699 1.00 0.00 C ATOM 655 OG1 THR A 119 12.934 8.365 -0.468 1.00 0.00 O ATOM 656 CG2 THR A 119 11.265 9.748 -1.531 1.00 0.00 C ATOM 0 H THR A 119 9.934 7.605 -3.493 1.00 0.00 H new ATOM 0 HA THR A 119 12.212 6.487 -2.169 1.00 0.00 H new ATOM 0 HB THR A 119 12.956 8.852 -2.478 1.00 0.00 H new ATOM 0 HG1 THR A 119 13.402 9.184 -0.201 1.00 0.00 H new ATOM 0 HG21 THR A 119 11.810 10.641 -1.225 1.00 0.00 H new ATOM 0 HG22 THR A 119 10.759 9.938 -2.478 1.00 0.00 H new ATOM 0 HG23 THR A 119 10.527 9.494 -0.770 1.00 0.00 H new ATOM 664 N ILE A 120 10.818 6.438 0.024 1.00 0.00 N ATOM 665 CA ILE A 120 9.877 6.090 1.082 1.00 0.00 C ATOM 666 C ILE A 120 10.419 6.484 2.452 1.00 0.00 C ATOM 667 O ILE A 120 11.614 6.357 2.718 1.00 0.00 O ATOM 668 CB ILE A 120 9.562 4.582 1.081 1.00 0.00 C ATOM 669 CG1 ILE A 120 9.037 4.149 -0.289 1.00 0.00 C ATOM 670 CG2 ILE A 120 8.552 4.251 2.170 1.00 0.00 C ATOM 671 CD1 ILE A 120 9.339 2.705 -0.623 1.00 0.00 C ATOM 0 H ILE A 120 11.791 6.216 0.235 1.00 0.00 H new ATOM 0 HA ILE A 120 8.960 6.645 0.884 1.00 0.00 H new ATOM 0 HB ILE A 120 10.482 4.034 1.286 1.00 0.00 H new ATOM 0 HG12 ILE A 120 7.958 4.303 -0.321 1.00 0.00 H new ATOM 0 HG13 ILE A 120 9.473 4.790 -1.055 1.00 0.00 H new ATOM 0 HG21 ILE A 120 8.340 3.182 2.157 1.00 0.00 H new ATOM 0 HG22 ILE A 120 8.961 4.528 3.142 1.00 0.00 H new ATOM 0 HG23 ILE A 120 7.631 4.806 1.993 1.00 0.00 H new ATOM 0 HD11 ILE A 120 8.938 2.468 -1.608 1.00 0.00 H new ATOM 0 HD12 ILE A 120 10.418 2.550 -0.624 1.00 0.00 H new ATOM 0 HD13 ILE A 120 8.879 2.055 0.122 1.00 0.00 H new ATOM 683 N ASP A 121 9.531 6.960 3.318 1.00 0.00 N ATOM 684 CA ASP A 121 9.919 7.370 4.662 1.00 0.00 C ATOM 685 C ASP A 121 10.018 6.164 5.591 1.00 0.00 C ATOM 686 O ASP A 121 9.259 5.203 5.461 1.00 0.00 O ATOM 687 CB ASP A 121 8.914 8.379 5.221 1.00 0.00 C ATOM 688 CG ASP A 121 7.700 7.708 5.832 1.00 0.00 C ATOM 689 OD1 ASP A 121 7.290 6.643 5.323 1.00 0.00 O ATOM 690 OD2 ASP A 121 7.159 8.247 6.820 1.00 0.00 O ATOM 0 H ASP A 121 8.538 7.071 3.113 1.00 0.00 H new ATOM 0 HA ASP A 121 10.900 7.841 4.602 1.00 0.00 H new ATOM 0 HB2 ASP A 121 9.403 8.995 5.975 1.00 0.00 H new ATOM 0 HB3 ASP A 121 8.593 9.048 4.423 1.00 0.00 H new ATOM 695 N HIS A 122 10.959 6.221 6.529 1.00 0.00 N ATOM 696 CA HIS A 122 11.157 5.133 7.479 1.00 0.00 C ATOM 697 C HIS A 122 10.795 5.574 8.894 1.00 0.00 C ATOM 698 O HIS A 122 11.487 6.396 9.495 1.00 0.00 O ATOM 699 CB HIS A 122 12.607 4.650 7.439 1.00 0.00 C ATOM 700 CG HIS A 122 13.165 4.545 6.053 1.00 0.00 C ATOM 701 ND1 HIS A 122 13.103 3.391 5.301 1.00 0.00 N ATOM 702 CD2 HIS A 122 13.797 5.461 5.281 1.00 0.00 C ATOM 703 CE1 HIS A 122 13.674 3.600 4.129 1.00 0.00 C ATOM 704 NE2 HIS A 122 14.103 4.848 4.091 1.00 0.00 N ATOM 0 H HIS A 122 11.595 7.009 6.651 1.00 0.00 H new ATOM 0 HA HIS A 122 10.500 4.311 7.194 1.00 0.00 H new ATOM 0 HB2 HIS A 122 13.225 5.334 8.020 1.00 0.00 H new ATOM 0 HB3 HIS A 122 12.670 3.675 7.922 1.00 0.00 H new ATOM 0 HD2 HIS A 122 14.019 6.483 5.551 1.00 0.00 H new ATOM 0 HE1 HIS A 122 13.773 2.873 3.336 1.00 0.00 H new ATOM 0 HE2 HIS A 122 14.584 5.286 3.305 1.00 0.00 H new ATOM 713 N VAL A 123 9.706 5.024 9.420 1.00 0.00 N ATOM 714 CA VAL A 123 9.252 5.361 10.764 1.00 0.00 C ATOM 715 C VAL A 123 8.257 4.329 11.283 1.00 0.00 C ATOM 716 O VAL A 123 7.242 4.051 10.644 1.00 0.00 O ATOM 717 CB VAL A 123 8.596 6.754 10.802 1.00 0.00 C ATOM 718 CG1 VAL A 123 7.541 6.878 9.714 1.00 0.00 C ATOM 719 CG2 VAL A 123 7.993 7.022 12.173 1.00 0.00 C ATOM 0 H VAL A 123 9.121 4.343 8.936 1.00 0.00 H new ATOM 0 HA VAL A 123 10.134 5.365 11.404 1.00 0.00 H new ATOM 0 HB VAL A 123 9.365 7.503 10.616 1.00 0.00 H new ATOM 0 HG11 VAL A 123 7.089 7.869 9.757 1.00 0.00 H new ATOM 0 HG12 VAL A 123 8.005 6.733 8.739 1.00 0.00 H new ATOM 0 HG13 VAL A 123 6.771 6.121 9.866 1.00 0.00 H new ATOM 0 HG21 VAL A 123 7.534 8.011 12.182 1.00 0.00 H new ATOM 0 HG22 VAL A 123 7.236 6.269 12.391 1.00 0.00 H new ATOM 0 HG23 VAL A 123 8.776 6.979 12.930 1.00 0.00 H new ATOM 729 N LYS A 124 8.555 3.763 12.448 1.00 0.00 N ATOM 730 CA LYS A 124 7.687 2.761 13.056 1.00 0.00 C ATOM 731 C LYS A 124 6.632 3.420 13.939 1.00 0.00 C ATOM 732 O LYS A 124 5.467 3.025 13.931 1.00 0.00 O ATOM 733 CB LYS A 124 8.514 1.773 13.882 1.00 0.00 C ATOM 734 CG LYS A 124 7.709 0.599 14.410 1.00 0.00 C ATOM 735 CD LYS A 124 8.522 -0.245 15.378 1.00 0.00 C ATOM 736 CE LYS A 124 7.651 -1.262 16.099 1.00 0.00 C ATOM 737 NZ LYS A 124 8.248 -1.681 17.397 1.00 0.00 N ATOM 0 H LYS A 124 9.391 3.981 12.990 1.00 0.00 H new ATOM 0 HA LYS A 124 7.181 2.221 12.256 1.00 0.00 H new ATOM 0 HB2 LYS A 124 9.332 1.395 13.269 1.00 0.00 H new ATOM 0 HB3 LYS A 124 8.963 2.302 14.722 1.00 0.00 H new ATOM 0 HG2 LYS A 124 6.813 0.967 14.910 1.00 0.00 H new ATOM 0 HG3 LYS A 124 7.377 -0.020 13.576 1.00 0.00 H new ATOM 0 HD2 LYS A 124 9.313 -0.762 14.835 1.00 0.00 H new ATOM 0 HD3 LYS A 124 9.007 0.403 16.108 1.00 0.00 H new ATOM 0 HE2 LYS A 124 6.663 -0.835 16.274 1.00 0.00 H new ATOM 0 HE3 LYS A 124 7.512 -2.137 15.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 7.625 -2.374 17.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 9.180 -2.111 17.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 8.357 -0.850 18.013 1.00 0.00 H new ATOM 751 N GLY A 125 7.048 4.428 14.700 1.00 0.00 N ATOM 752 CA GLY A 125 6.126 5.126 15.576 1.00 0.00 C ATOM 753 C GLY A 125 4.888 5.611 14.848 1.00 0.00 C ATOM 754 O GLY A 125 3.777 5.168 15.137 1.00 0.00 O ATOM 0 H GLY A 125 8.007 4.773 14.725 1.00 0.00 H new ATOM 0 HA2 GLY A 125 5.829 4.463 16.389 1.00 0.00 H new ATOM 0 HA3 GLY A 125 6.634 5.977 16.029 1.00 0.00 H new ATOM 758 N ASP A 126 5.080 6.524 13.903 1.00 0.00 N ATOM 759 CA ASP A 126 3.970 7.071 13.132 1.00 0.00 C ATOM 760 C ASP A 126 2.970 5.978 12.769 1.00 0.00 C ATOM 761 O ASP A 126 1.762 6.214 12.733 1.00 0.00 O ATOM 762 CB ASP A 126 4.488 7.747 11.861 1.00 0.00 C ATOM 763 CG ASP A 126 5.413 8.910 12.160 1.00 0.00 C ATOM 764 OD1 ASP A 126 5.334 9.459 13.279 1.00 0.00 O ATOM 765 OD2 ASP A 126 6.218 9.270 11.276 1.00 0.00 O ATOM 0 H ASP A 126 5.994 6.901 13.652 1.00 0.00 H new ATOM 0 HA ASP A 126 3.463 7.813 13.749 1.00 0.00 H new ATOM 0 HB2 ASP A 126 5.017 7.013 11.252 1.00 0.00 H new ATOM 0 HB3 ASP A 126 3.643 8.101 11.271 1.00 0.00 H new ATOM 770 N SER A 127 3.481 4.780 12.501 1.00 0.00 N ATOM 771 CA SER A 127 2.633 3.651 12.136 1.00 0.00 C ATOM 772 C SER A 127 2.118 3.798 10.707 1.00 0.00 C ATOM 773 O SER A 127 1.067 3.260 10.356 1.00 0.00 O ATOM 774 CB SER A 127 1.455 3.537 13.106 1.00 0.00 C ATOM 775 OG SER A 127 1.869 3.769 14.441 1.00 0.00 O ATOM 0 H SER A 127 4.478 4.566 12.530 1.00 0.00 H new ATOM 0 HA SER A 127 3.233 2.743 12.196 1.00 0.00 H new ATOM 0 HB2 SER A 127 0.683 4.256 12.831 1.00 0.00 H new ATOM 0 HB3 SER A 127 1.010 2.545 13.027 1.00 0.00 H new ATOM 0 HG SER A 127 2.847 3.823 14.476 1.00 0.00 H new ATOM 781 N PHE A 128 2.865 4.530 9.888 1.00 0.00 N ATOM 782 CA PHE A 128 2.484 4.750 8.497 1.00 0.00 C ATOM 783 C PHE A 128 3.712 5.029 7.635 1.00 0.00 C ATOM 784 O PHE A 128 4.719 5.545 8.119 1.00 0.00 O ATOM 785 CB PHE A 128 1.499 5.915 8.394 1.00 0.00 C ATOM 786 CG PHE A 128 2.157 7.264 8.453 1.00 0.00 C ATOM 787 CD1 PHE A 128 2.980 7.694 7.425 1.00 0.00 C ATOM 788 CD2 PHE A 128 1.953 8.102 9.538 1.00 0.00 C ATOM 789 CE1 PHE A 128 3.587 8.934 7.477 1.00 0.00 C ATOM 790 CE2 PHE A 128 2.557 9.344 9.595 1.00 0.00 C ATOM 791 CZ PHE A 128 3.376 9.760 8.563 1.00 0.00 C ATOM 0 H PHE A 128 3.738 4.981 10.163 1.00 0.00 H new ATOM 0 HA PHE A 128 2.003 3.843 8.130 1.00 0.00 H new ATOM 0 HB2 PHE A 128 0.945 5.830 7.459 1.00 0.00 H new ATOM 0 HB3 PHE A 128 0.772 5.838 9.203 1.00 0.00 H new ATOM 0 HD1 PHE A 128 3.149 7.052 6.573 1.00 0.00 H new ATOM 0 HD2 PHE A 128 1.315 7.781 10.348 1.00 0.00 H new ATOM 0 HE1 PHE A 128 4.226 9.257 6.669 1.00 0.00 H new ATOM 0 HE2 PHE A 128 2.389 9.988 10.445 1.00 0.00 H new ATOM 0 HZ PHE A 128 3.850 10.729 8.606 1.00 0.00 H new ATOM 801 N ALA A 129 3.620 4.683 6.355 1.00 0.00 N ATOM 802 CA ALA A 129 4.721 4.897 5.425 1.00 0.00 C ATOM 803 C ALA A 129 4.250 5.638 4.178 1.00 0.00 C ATOM 804 O ALA A 129 3.117 5.461 3.730 1.00 0.00 O ATOM 805 CB ALA A 129 5.356 3.568 5.044 1.00 0.00 C ATOM 0 H ALA A 129 2.794 4.253 5.939 1.00 0.00 H new ATOM 0 HA ALA A 129 5.469 5.515 5.922 1.00 0.00 H new ATOM 0 HB1 ALA A 129 6.177 3.743 4.349 1.00 0.00 H new ATOM 0 HB2 ALA A 129 5.737 3.077 5.939 1.00 0.00 H new ATOM 0 HB3 ALA A 129 4.609 2.930 4.570 1.00 0.00 H new ATOM 811 N TYR A 130 5.127 6.467 3.622 1.00 0.00 N ATOM 812 CA TYR A 130 4.799 7.237 2.428 1.00 0.00 C ATOM 813 C TYR A 130 5.500 6.663 1.200 1.00 0.00 C ATOM 814 O TYR A 130 6.704 6.405 1.223 1.00 0.00 O ATOM 815 CB TYR A 130 5.194 8.702 2.616 1.00 0.00 C ATOM 816 CG TYR A 130 4.165 9.515 3.369 1.00 0.00 C ATOM 817 CD1 TYR A 130 2.838 9.544 2.958 1.00 0.00 C ATOM 818 CD2 TYR A 130 4.519 10.252 4.492 1.00 0.00 C ATOM 819 CE1 TYR A 130 1.894 10.286 3.642 1.00 0.00 C ATOM 820 CE2 TYR A 130 3.582 10.996 5.183 1.00 0.00 C ATOM 821 CZ TYR A 130 2.271 11.010 4.754 1.00 0.00 C ATOM 822 OH TYR A 130 1.334 11.748 5.439 1.00 0.00 O ATOM 0 H TYR A 130 6.070 6.623 3.979 1.00 0.00 H new ATOM 0 HA TYR A 130 3.722 7.175 2.271 1.00 0.00 H new ATOM 0 HB2 TYR A 130 6.143 8.748 3.150 1.00 0.00 H new ATOM 0 HB3 TYR A 130 5.357 9.154 1.638 1.00 0.00 H new ATOM 0 HD1 TYR A 130 2.539 8.977 2.089 1.00 0.00 H new ATOM 0 HD2 TYR A 130 5.544 10.243 4.831 1.00 0.00 H new ATOM 0 HE1 TYR A 130 0.867 10.299 3.308 1.00 0.00 H new ATOM 0 HE2 TYR A 130 3.874 11.563 6.054 1.00 0.00 H new ATOM 0 HH TYR A 130 1.762 12.197 6.197 1.00 0.00 H new ATOM 832 N ILE A 131 4.738 6.467 0.130 1.00 0.00 N ATOM 833 CA ILE A 131 5.286 5.926 -1.108 1.00 0.00 C ATOM 834 C ILE A 131 5.067 6.886 -2.272 1.00 0.00 C ATOM 835 O ILE A 131 3.933 7.253 -2.582 1.00 0.00 O ATOM 836 CB ILE A 131 4.655 4.564 -1.455 1.00 0.00 C ATOM 837 CG1 ILE A 131 4.965 3.540 -0.361 1.00 0.00 C ATOM 838 CG2 ILE A 131 5.159 4.075 -2.805 1.00 0.00 C ATOM 839 CD1 ILE A 131 4.665 2.114 -0.766 1.00 0.00 C ATOM 0 H ILE A 131 3.740 6.674 0.095 1.00 0.00 H new ATOM 0 HA ILE A 131 6.356 5.792 -0.947 1.00 0.00 H new ATOM 0 HB ILE A 131 3.574 4.686 -1.516 1.00 0.00 H new ATOM 0 HG12 ILE A 131 6.018 3.618 -0.089 1.00 0.00 H new ATOM 0 HG13 ILE A 131 4.387 3.786 0.530 1.00 0.00 H new ATOM 0 HG21 ILE A 131 4.704 3.112 -3.036 1.00 0.00 H new ATOM 0 HG22 ILE A 131 4.891 4.797 -3.577 1.00 0.00 H new ATOM 0 HG23 ILE A 131 6.243 3.966 -2.771 1.00 0.00 H new ATOM 0 HD11 ILE A 131 4.909 1.443 0.058 1.00 0.00 H new ATOM 0 HD12 ILE A 131 3.607 2.020 -1.010 1.00 0.00 H new ATOM 0 HD13 ILE A 131 5.263 1.850 -1.638 1.00 0.00 H new ATOM 851 N GLN A 132 6.159 7.288 -2.914 1.00 0.00 N ATOM 852 CA GLN A 132 6.086 8.205 -4.045 1.00 0.00 C ATOM 853 C GLN A 132 6.389 7.482 -5.353 1.00 0.00 C ATOM 854 O GLN A 132 7.360 6.731 -5.448 1.00 0.00 O ATOM 855 CB GLN A 132 7.063 9.366 -3.852 1.00 0.00 C ATOM 856 CG GLN A 132 6.930 10.455 -4.904 1.00 0.00 C ATOM 857 CD GLN A 132 5.896 11.500 -4.535 1.00 0.00 C ATOM 858 OE1 GLN A 132 5.163 11.346 -3.557 1.00 0.00 O ATOM 859 NE2 GLN A 132 5.830 12.571 -5.317 1.00 0.00 N ATOM 0 H GLN A 132 7.105 6.993 -2.670 1.00 0.00 H new ATOM 0 HA GLN A 132 5.071 8.599 -4.096 1.00 0.00 H new ATOM 0 HB2 GLN A 132 6.904 9.803 -2.866 1.00 0.00 H new ATOM 0 HB3 GLN A 132 8.082 8.979 -3.869 1.00 0.00 H new ATOM 0 HG2 GLN A 132 7.896 10.939 -5.044 1.00 0.00 H new ATOM 0 HG3 GLN A 132 6.659 10.002 -5.858 1.00 0.00 H new ATOM 0 HE21 GLN A 132 6.457 12.658 -6.117 1.00 0.00 H new ATOM 0 HE22 GLN A 132 5.153 13.307 -5.118 1.00 0.00 H new ATOM 868 N TYR A 133 5.552 7.713 -6.359 1.00 0.00 N ATOM 869 CA TYR A 133 5.729 7.081 -7.661 1.00 0.00 C ATOM 870 C TYR A 133 6.233 8.087 -8.691 1.00 0.00 C ATOM 871 O TYR A 133 5.880 9.265 -8.647 1.00 0.00 O ATOM 872 CB TYR A 133 4.412 6.465 -8.135 1.00 0.00 C ATOM 873 CG TYR A 133 4.195 5.049 -7.650 1.00 0.00 C ATOM 874 CD1 TYR A 133 4.879 3.985 -8.225 1.00 0.00 C ATOM 875 CD2 TYR A 133 3.307 4.776 -6.617 1.00 0.00 C ATOM 876 CE1 TYR A 133 4.684 2.690 -7.785 1.00 0.00 C ATOM 877 CE2 TYR A 133 3.107 3.485 -6.170 1.00 0.00 C ATOM 878 CZ TYR A 133 3.798 2.445 -6.757 1.00 0.00 C ATOM 879 OH TYR A 133 3.600 1.157 -6.315 1.00 0.00 O ATOM 0 H TYR A 133 4.745 8.333 -6.297 1.00 0.00 H new ATOM 0 HA TYR A 133 6.474 6.293 -7.556 1.00 0.00 H new ATOM 0 HB2 TYR A 133 3.586 7.088 -7.793 1.00 0.00 H new ATOM 0 HB3 TYR A 133 4.388 6.474 -9.225 1.00 0.00 H new ATOM 0 HD1 TYR A 133 5.575 4.173 -9.029 1.00 0.00 H new ATOM 0 HD2 TYR A 133 2.764 5.588 -6.156 1.00 0.00 H new ATOM 0 HE1 TYR A 133 5.223 1.874 -8.244 1.00 0.00 H new ATOM 0 HE2 TYR A 133 2.413 3.290 -5.365 1.00 0.00 H new ATOM 0 HH TYR A 133 3.919 0.526 -6.993 1.00 0.00 H new ATOM 889 N GLU A 134 7.060 7.612 -9.617 1.00 0.00 N ATOM 890 CA GLU A 134 7.613 8.470 -10.658 1.00 0.00 C ATOM 891 C GLU A 134 6.503 9.198 -11.410 1.00 0.00 C ATOM 892 O GLU A 134 6.651 10.362 -11.783 1.00 0.00 O ATOM 893 CB GLU A 134 8.451 7.645 -11.638 1.00 0.00 C ATOM 894 CG GLU A 134 9.837 7.304 -11.116 1.00 0.00 C ATOM 895 CD GLU A 134 10.855 8.389 -11.411 1.00 0.00 C ATOM 896 OE1 GLU A 134 10.615 9.189 -12.340 1.00 0.00 O ATOM 897 OE2 GLU A 134 11.889 8.439 -10.714 1.00 0.00 O ATOM 0 H GLU A 134 7.361 6.639 -9.667 1.00 0.00 H new ATOM 0 HA GLU A 134 8.252 9.212 -10.180 1.00 0.00 H new ATOM 0 HB2 GLU A 134 7.921 6.721 -11.868 1.00 0.00 H new ATOM 0 HB3 GLU A 134 8.550 8.197 -12.573 1.00 0.00 H new ATOM 0 HG2 GLU A 134 9.786 7.142 -10.039 1.00 0.00 H new ATOM 0 HG3 GLU A 134 10.170 6.368 -11.564 1.00 0.00 H new ATOM 904 N SER A 135 5.391 8.503 -11.630 1.00 0.00 N ATOM 905 CA SER A 135 4.256 9.081 -12.341 1.00 0.00 C ATOM 906 C SER A 135 2.990 9.008 -11.493 1.00 0.00 C ATOM 907 O SER A 135 2.949 8.317 -10.474 1.00 0.00 O ATOM 908 CB SER A 135 4.037 8.356 -13.670 1.00 0.00 C ATOM 909 OG SER A 135 3.417 9.207 -14.619 1.00 0.00 O ATOM 0 H SER A 135 5.252 7.539 -11.326 1.00 0.00 H new ATOM 0 HA SER A 135 4.479 10.129 -12.540 1.00 0.00 H new ATOM 0 HB2 SER A 135 4.993 8.007 -14.060 1.00 0.00 H new ATOM 0 HB3 SER A 135 3.418 7.474 -13.509 1.00 0.00 H new ATOM 0 HG SER A 135 2.473 8.960 -14.713 1.00 0.00 H new ATOM 915 N LEU A 136 1.957 9.725 -11.922 1.00 0.00 N ATOM 916 CA LEU A 136 0.687 9.742 -11.204 1.00 0.00 C ATOM 917 C LEU A 136 -0.154 8.519 -11.555 1.00 0.00 C ATOM 918 O LEU A 136 -0.774 7.909 -10.684 1.00 0.00 O ATOM 919 CB LEU A 136 -0.089 11.019 -11.532 1.00 0.00 C ATOM 920 CG LEU A 136 -1.213 11.389 -10.562 1.00 0.00 C ATOM 921 CD1 LEU A 136 -1.655 12.827 -10.782 1.00 0.00 C ATOM 922 CD2 LEU A 136 -2.389 10.436 -10.721 1.00 0.00 C ATOM 0 H LEU A 136 1.974 10.302 -12.763 1.00 0.00 H new ATOM 0 HA LEU A 136 0.902 9.718 -10.136 1.00 0.00 H new ATOM 0 HB2 LEU A 136 0.617 11.849 -11.573 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -0.516 10.915 -12.529 1.00 0.00 H new ATOM 0 HG LEU A 136 -0.834 11.299 -9.544 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -2.455 13.073 -10.084 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -0.811 13.496 -10.617 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -2.017 12.944 -11.804 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -3.179 10.714 -10.024 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -2.769 10.494 -11.741 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -2.062 9.417 -10.512 1.00 0.00 H new ATOM 934 N ASP A 137 -0.168 8.164 -12.835 1.00 0.00 N ATOM 935 CA ASP A 137 -0.929 7.011 -13.301 1.00 0.00 C ATOM 936 C ASP A 137 -0.541 5.755 -12.527 1.00 0.00 C ATOM 937 O ASP A 137 -1.391 5.095 -11.930 1.00 0.00 O ATOM 938 CB ASP A 137 -0.702 6.794 -14.798 1.00 0.00 C ATOM 939 CG ASP A 137 -0.614 8.098 -15.566 1.00 0.00 C ATOM 940 OD1 ASP A 137 0.367 8.842 -15.360 1.00 0.00 O ATOM 941 OD2 ASP A 137 -1.527 8.374 -16.372 1.00 0.00 O ATOM 0 H ASP A 137 0.339 8.659 -13.569 1.00 0.00 H new ATOM 0 HA ASP A 137 -1.986 7.210 -13.128 1.00 0.00 H new ATOM 0 HB2 ASP A 137 0.217 6.227 -14.944 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -1.516 6.192 -15.202 1.00 0.00 H new ATOM 946 N ALA A 138 0.747 5.431 -12.543 1.00 0.00 N ATOM 947 CA ALA A 138 1.248 4.255 -11.842 1.00 0.00 C ATOM 948 C ALA A 138 0.768 4.233 -10.394 1.00 0.00 C ATOM 949 O ALA A 138 0.401 3.183 -9.868 1.00 0.00 O ATOM 950 CB ALA A 138 2.768 4.215 -11.896 1.00 0.00 C ATOM 0 H ALA A 138 1.463 5.966 -13.034 1.00 0.00 H new ATOM 0 HA ALA A 138 0.854 3.370 -12.342 1.00 0.00 H new ATOM 0 HB1 ALA A 138 3.128 3.332 -11.368 1.00 0.00 H new ATOM 0 HB2 ALA A 138 3.094 4.175 -12.935 1.00 0.00 H new ATOM 0 HB3 ALA A 138 3.173 5.110 -11.423 1.00 0.00 H new ATOM 956 N ALA A 139 0.773 5.399 -9.756 1.00 0.00 N ATOM 957 CA ALA A 139 0.337 5.513 -8.370 1.00 0.00 C ATOM 958 C ALA A 139 -1.111 5.064 -8.212 1.00 0.00 C ATOM 959 O ALA A 139 -1.423 4.232 -7.360 1.00 0.00 O ATOM 960 CB ALA A 139 0.506 6.943 -7.880 1.00 0.00 C ATOM 0 H ALA A 139 1.074 6.278 -10.177 1.00 0.00 H new ATOM 0 HA ALA A 139 0.961 4.857 -7.763 1.00 0.00 H new ATOM 0 HB1 ALA A 139 0.177 7.014 -6.843 1.00 0.00 H new ATOM 0 HB2 ALA A 139 1.556 7.229 -7.947 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -0.093 7.612 -8.498 1.00 0.00 H new ATOM 966 N GLN A 140 -1.992 5.622 -9.036 1.00 0.00 N ATOM 967 CA GLN A 140 -3.409 5.280 -8.985 1.00 0.00 C ATOM 968 C GLN A 140 -3.606 3.769 -9.041 1.00 0.00 C ATOM 969 O GLN A 140 -4.511 3.227 -8.406 1.00 0.00 O ATOM 970 CB GLN A 140 -4.158 5.947 -10.140 1.00 0.00 C ATOM 971 CG GLN A 140 -4.265 7.457 -10.005 1.00 0.00 C ATOM 972 CD GLN A 140 -5.229 8.066 -11.005 1.00 0.00 C ATOM 973 OE1 GLN A 140 -5.963 9.001 -10.686 1.00 0.00 O ATOM 974 NE2 GLN A 140 -5.230 7.537 -12.223 1.00 0.00 N ATOM 0 H GLN A 140 -1.750 6.313 -9.747 1.00 0.00 H new ATOM 0 HA GLN A 140 -3.812 5.646 -8.041 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -3.652 5.709 -11.076 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -5.161 5.524 -10.204 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -4.590 7.705 -8.995 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -3.279 7.901 -10.140 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -4.604 6.762 -12.443 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -5.857 7.905 -12.939 1.00 0.00 H new ATOM 983 N ALA A 141 -2.753 3.093 -9.804 1.00 0.00 N ATOM 984 CA ALA A 141 -2.832 1.644 -9.941 1.00 0.00 C ATOM 985 C ALA A 141 -2.581 0.952 -8.605 1.00 0.00 C ATOM 986 O ALA A 141 -3.463 0.287 -8.064 1.00 0.00 O ATOM 987 CB ALA A 141 -1.839 1.157 -10.985 1.00 0.00 C ATOM 0 H ALA A 141 -1.999 3.526 -10.337 1.00 0.00 H new ATOM 0 HA ALA A 141 -3.840 1.389 -10.269 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -1.909 0.073 -11.076 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -2.066 1.618 -11.946 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.828 1.431 -10.682 1.00 0.00 H new ATOM 993 N ALA A 142 -1.371 1.113 -8.080 1.00 0.00 N ATOM 994 CA ALA A 142 -1.004 0.504 -6.807 1.00 0.00 C ATOM 995 C ALA A 142 -1.936 0.963 -5.690 1.00 0.00 C ATOM 996 O ALA A 142 -2.255 0.195 -4.782 1.00 0.00 O ATOM 997 CB ALA A 142 0.441 0.835 -6.461 1.00 0.00 C ATOM 0 H ALA A 142 -0.628 1.660 -8.516 1.00 0.00 H new ATOM 0 HA ALA A 142 -1.104 -0.577 -6.907 1.00 0.00 H new ATOM 0 HB1 ALA A 142 0.702 0.374 -5.508 1.00 0.00 H new ATOM 0 HB2 ALA A 142 1.099 0.452 -7.241 1.00 0.00 H new ATOM 0 HB3 ALA A 142 0.559 1.916 -6.385 1.00 0.00 H new ATOM 1003 N CYS A 143 -2.367 2.217 -5.764 1.00 0.00 N ATOM 1004 CA CYS A 143 -3.262 2.778 -4.758 1.00 0.00 C ATOM 1005 C CYS A 143 -4.482 1.885 -4.556 1.00 0.00 C ATOM 1006 O CYS A 143 -4.790 1.482 -3.435 1.00 0.00 O ATOM 1007 CB CYS A 143 -3.705 4.183 -5.167 1.00 0.00 C ATOM 1008 SG CYS A 143 -4.321 5.190 -3.797 1.00 0.00 S ATOM 0 H CYS A 143 -2.112 2.864 -6.510 1.00 0.00 H new ATOM 0 HA CYS A 143 -2.718 2.836 -3.815 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -2.864 4.697 -5.632 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -4.486 4.101 -5.923 1.00 0.00 H new ATOM 0 HG CYS A 143 -4.306 6.444 -4.139 1.00 0.00 H new ATOM 1014 N ALA A 144 -5.173 1.581 -5.650 1.00 0.00 N ATOM 1015 CA ALA A 144 -6.359 0.736 -5.593 1.00 0.00 C ATOM 1016 C ALA A 144 -5.980 -0.732 -5.431 1.00 0.00 C ATOM 1017 O ALA A 144 -6.462 -1.413 -4.525 1.00 0.00 O ATOM 1018 CB ALA A 144 -7.205 0.929 -6.843 1.00 0.00 C ATOM 0 H ALA A 144 -4.932 1.907 -6.586 1.00 0.00 H new ATOM 0 HA ALA A 144 -6.944 1.032 -4.722 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -8.088 0.292 -6.787 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -7.514 1.972 -6.916 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -6.620 0.662 -7.723 1.00 0.00 H new ATOM 1024 N LYS A 145 -5.114 -1.216 -6.315 1.00 0.00 N ATOM 1025 CA LYS A 145 -4.669 -2.604 -6.270 1.00 0.00 C ATOM 1026 C LYS A 145 -4.318 -3.017 -4.844 1.00 0.00 C ATOM 1027 O LYS A 145 -4.917 -3.938 -4.290 1.00 0.00 O ATOM 1028 CB LYS A 145 -3.456 -2.801 -7.183 1.00 0.00 C ATOM 1029 CG LYS A 145 -3.822 -3.170 -8.610 1.00 0.00 C ATOM 1030 CD LYS A 145 -4.282 -1.956 -9.399 1.00 0.00 C ATOM 1031 CE LYS A 145 -5.037 -2.362 -10.656 1.00 0.00 C ATOM 1032 NZ LYS A 145 -5.646 -1.188 -11.340 1.00 0.00 N ATOM 0 H LYS A 145 -4.706 -0.667 -7.072 1.00 0.00 H new ATOM 0 HA LYS A 145 -5.487 -3.234 -6.621 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -2.867 -1.884 -7.194 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -2.821 -3.583 -6.766 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -2.960 -3.620 -9.103 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -4.612 -3.920 -8.601 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -4.923 -1.335 -8.773 1.00 0.00 H new ATOM 0 HD3 LYS A 145 -3.418 -1.349 -9.672 1.00 0.00 H new ATOM 0 HE2 LYS A 145 -4.357 -2.869 -11.341 1.00 0.00 H new ATOM 0 HE3 LYS A 145 -5.818 -3.076 -10.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -6.151 -1.506 -12.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -6.314 -0.719 -10.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -4.898 -0.518 -11.611 1.00 0.00 H new ATOM 1046 N MET A 146 -3.345 -2.329 -4.256 1.00 0.00 N ATOM 1047 CA MET A 146 -2.917 -2.623 -2.893 1.00 0.00 C ATOM 1048 C MET A 146 -4.091 -2.531 -1.923 1.00 0.00 C ATOM 1049 O MET A 146 -4.290 -3.415 -1.090 1.00 0.00 O ATOM 1050 CB MET A 146 -1.809 -1.660 -2.464 1.00 0.00 C ATOM 1051 CG MET A 146 -0.539 -1.788 -3.290 1.00 0.00 C ATOM 1052 SD MET A 146 0.123 -3.465 -3.290 1.00 0.00 S ATOM 1053 CE MET A 146 0.473 -3.691 -1.548 1.00 0.00 C ATOM 0 H MET A 146 -2.838 -1.564 -4.702 1.00 0.00 H new ATOM 0 HA MET A 146 -2.530 -3.642 -2.872 1.00 0.00 H new ATOM 0 HB2 MET A 146 -2.179 -0.637 -2.538 1.00 0.00 H new ATOM 0 HB3 MET A 146 -1.570 -1.838 -1.415 1.00 0.00 H new ATOM 0 HG2 MET A 146 -0.745 -1.483 -4.316 1.00 0.00 H new ATOM 0 HG3 MET A 146 0.214 -1.104 -2.899 1.00 0.00 H new ATOM 0 HE1 MET A 146 1.282 -4.412 -1.430 1.00 0.00 H new ATOM 0 HE2 MET A 146 0.770 -2.738 -1.110 1.00 0.00 H new ATOM 0 HE3 MET A 146 -0.419 -4.061 -1.043 1.00 0.00 H new ATOM 1063 N ARG A 147 -4.864 -1.457 -2.037 1.00 0.00 N ATOM 1064 CA ARG A 147 -6.017 -1.249 -1.169 1.00 0.00 C ATOM 1065 C ARG A 147 -6.687 -2.577 -0.828 1.00 0.00 C ATOM 1066 O ARG A 147 -7.406 -3.150 -1.646 1.00 0.00 O ATOM 1067 CB ARG A 147 -7.026 -0.314 -1.839 1.00 0.00 C ATOM 1068 CG ARG A 147 -8.017 0.308 -0.870 1.00 0.00 C ATOM 1069 CD ARG A 147 -9.259 -0.555 -0.712 1.00 0.00 C ATOM 1070 NE ARG A 147 -10.093 -0.115 0.403 1.00 0.00 N ATOM 1071 CZ ARG A 147 -9.897 -0.493 1.661 1.00 0.00 C ATOM 1072 NH1 ARG A 147 -8.900 -1.314 1.963 1.00 0.00 N ATOM 1073 NH2 ARG A 147 -10.699 -0.050 2.621 1.00 0.00 N ATOM 0 H ARG A 147 -4.713 -0.717 -2.722 1.00 0.00 H new ATOM 0 HA ARG A 147 -5.666 -0.790 -0.245 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -6.486 0.481 -2.353 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -7.575 -0.870 -2.599 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -7.541 0.444 0.101 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -8.303 1.298 -1.226 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -9.841 -0.525 -1.633 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -8.962 -1.592 -0.556 1.00 0.00 H new ATOM 0 HE ARG A 147 -10.869 0.517 0.205 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -8.281 -1.657 1.228 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -8.752 -1.602 2.930 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -11.467 0.581 2.393 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -10.548 -0.341 3.587 1.00 0.00 H new ATOM 1087 N GLY A 148 -6.445 -3.062 0.386 1.00 0.00 N ATOM 1088 CA GLY A 148 -7.031 -4.319 0.814 1.00 0.00 C ATOM 1089 C GLY A 148 -6.168 -5.512 0.456 1.00 0.00 C ATOM 1090 O GLY A 148 -6.635 -6.458 -0.179 1.00 0.00 O ATOM 0 H GLY A 148 -5.853 -2.607 1.081 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -7.184 -4.296 1.893 1.00 0.00 H new ATOM 0 HA3 GLY A 148 -8.013 -4.434 0.355 1.00 0.00 H new ATOM 1094 N PHE A 149 -4.903 -5.469 0.862 1.00 0.00 N ATOM 1095 CA PHE A 149 -3.972 -6.555 0.579 1.00 0.00 C ATOM 1096 C PHE A 149 -4.162 -7.706 1.562 1.00 0.00 C ATOM 1097 O PHE A 149 -4.392 -7.505 2.755 1.00 0.00 O ATOM 1098 CB PHE A 149 -2.530 -6.047 0.642 1.00 0.00 C ATOM 1099 CG PHE A 149 -1.596 -6.775 -0.283 1.00 0.00 C ATOM 1100 CD1 PHE A 149 -1.550 -6.458 -1.631 1.00 0.00 C ATOM 1101 CD2 PHE A 149 -0.765 -7.775 0.195 1.00 0.00 C ATOM 1102 CE1 PHE A 149 -0.693 -7.126 -2.484 1.00 0.00 C ATOM 1103 CE2 PHE A 149 0.094 -8.447 -0.653 1.00 0.00 C ATOM 1104 CZ PHE A 149 0.131 -8.121 -1.995 1.00 0.00 C ATOM 0 H PHE A 149 -4.499 -4.694 1.388 1.00 0.00 H new ATOM 0 HA PHE A 149 -4.177 -6.923 -0.426 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -2.516 -4.985 0.397 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -2.164 -6.143 1.664 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -2.191 -5.680 -2.019 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -0.789 -8.032 1.244 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -0.667 -6.870 -3.533 1.00 0.00 H new ATOM 0 HE2 PHE A 149 0.735 -9.226 -0.268 1.00 0.00 H new ATOM 0 HZ PHE A 149 0.803 -8.643 -2.660 1.00 0.00 H new ATOM 1114 N PRO A 150 -4.065 -8.942 1.051 1.00 0.00 N ATOM 1115 CA PRO A 150 -4.222 -10.150 1.866 1.00 0.00 C ATOM 1116 C PRO A 150 -3.061 -10.353 2.833 1.00 0.00 C ATOM 1117 O PRO A 150 -2.984 -11.372 3.521 1.00 0.00 O ATOM 1118 CB PRO A 150 -4.257 -11.276 0.828 1.00 0.00 C ATOM 1119 CG PRO A 150 -3.515 -10.733 -0.344 1.00 0.00 C ATOM 1120 CD PRO A 150 -3.792 -9.256 -0.362 1.00 0.00 C ATOM 0 HA PRO A 150 -5.111 -10.104 2.496 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -3.786 -12.182 1.210 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -5.281 -11.538 0.562 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -2.446 -10.928 -0.254 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -3.848 -11.204 -1.269 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -2.940 -8.692 -0.741 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -4.643 -9.015 -0.999 1.00 0.00 H new ATOM 1128 N LEU A 151 -2.160 -9.378 2.881 1.00 0.00 N ATOM 1129 CA LEU A 151 -1.002 -9.449 3.765 1.00 0.00 C ATOM 1130 C LEU A 151 -1.356 -10.156 5.069 1.00 0.00 C ATOM 1131 O LEU A 151 -2.502 -10.125 5.513 1.00 0.00 O ATOM 1132 CB LEU A 151 -0.474 -8.044 4.060 1.00 0.00 C ATOM 1133 CG LEU A 151 0.957 -7.963 4.593 1.00 0.00 C ATOM 1134 CD1 LEU A 151 1.909 -8.726 3.685 1.00 0.00 C ATOM 1135 CD2 LEU A 151 1.394 -6.512 4.730 1.00 0.00 C ATOM 0 H LEU A 151 -2.209 -8.529 2.318 1.00 0.00 H new ATOM 0 HA LEU A 151 -0.225 -10.024 3.261 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -0.533 -7.456 3.144 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -1.138 -7.573 4.785 1.00 0.00 H new ATOM 0 HG LEU A 151 0.983 -8.424 5.581 1.00 0.00 H new ATOM 0 HD11 LEU A 151 2.922 -8.657 4.080 1.00 0.00 H new ATOM 0 HD12 LEU A 151 1.608 -9.773 3.639 1.00 0.00 H new ATOM 0 HD13 LEU A 151 1.880 -8.296 2.684 1.00 0.00 H new ATOM 0 HD21 LEU A 151 2.415 -6.474 5.111 1.00 0.00 H new ATOM 0 HD22 LEU A 151 1.352 -6.026 3.755 1.00 0.00 H new ATOM 0 HD23 LEU A 151 0.729 -5.996 5.422 1.00 0.00 H new ATOM 1147 N GLY A 152 -0.361 -10.793 5.680 1.00 0.00 N ATOM 1148 CA GLY A 152 -0.586 -11.497 6.929 1.00 0.00 C ATOM 1149 C GLY A 152 -1.666 -12.554 6.812 1.00 0.00 C ATOM 1150 O GLY A 152 -1.487 -13.561 6.128 1.00 0.00 O ATOM 0 H GLY A 152 0.597 -10.834 5.332 1.00 0.00 H new ATOM 0 HA2 GLY A 152 0.344 -11.966 7.251 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -0.865 -10.780 7.701 1.00 0.00 H new ATOM 1154 N GLY A 153 -2.792 -12.325 7.482 1.00 0.00 N ATOM 1155 CA GLY A 153 -3.887 -13.276 7.438 1.00 0.00 C ATOM 1156 C GLY A 153 -5.111 -12.718 6.739 1.00 0.00 C ATOM 1157 O GLY A 153 -5.104 -11.596 6.230 1.00 0.00 O ATOM 0 H GLY A 153 -2.965 -11.498 8.054 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -3.559 -14.180 6.924 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -4.153 -13.566 8.454 1.00 0.00 H new ATOM 1161 N PRO A 154 -6.191 -13.512 6.705 1.00 0.00 N ATOM 1162 CA PRO A 154 -7.447 -13.112 6.063 1.00 0.00 C ATOM 1163 C PRO A 154 -8.164 -12.006 6.830 1.00 0.00 C ATOM 1164 O PRO A 154 -9.222 -11.534 6.414 1.00 0.00 O ATOM 1165 CB PRO A 154 -8.278 -14.398 6.079 1.00 0.00 C ATOM 1166 CG PRO A 154 -7.737 -15.185 7.222 1.00 0.00 C ATOM 1167 CD PRO A 154 -6.270 -14.861 7.290 1.00 0.00 C ATOM 0 HA PRO A 154 -7.283 -12.706 5.065 1.00 0.00 H new ATOM 0 HB2 PRO A 154 -9.338 -14.183 6.213 1.00 0.00 H new ATOM 0 HB3 PRO A 154 -8.180 -14.944 5.141 1.00 0.00 H new ATOM 0 HG2 PRO A 154 -8.239 -14.918 8.152 1.00 0.00 H new ATOM 0 HG3 PRO A 154 -7.894 -16.253 7.070 1.00 0.00 H new ATOM 0 HD2 PRO A 154 -5.902 -14.876 8.316 1.00 0.00 H new ATOM 0 HD3 PRO A 154 -5.673 -15.579 6.727 1.00 0.00 H new ATOM 1175 N ASP A 155 -7.580 -11.597 7.952 1.00 0.00 N ATOM 1176 CA ASP A 155 -8.163 -10.545 8.776 1.00 0.00 C ATOM 1177 C ASP A 155 -7.395 -9.237 8.610 1.00 0.00 C ATOM 1178 O ASP A 155 -7.989 -8.177 8.411 1.00 0.00 O ATOM 1179 CB ASP A 155 -8.168 -10.964 10.247 1.00 0.00 C ATOM 1180 CG ASP A 155 -8.883 -9.962 11.132 1.00 0.00 C ATOM 1181 OD1 ASP A 155 -8.262 -8.941 11.495 1.00 0.00 O ATOM 1182 OD2 ASP A 155 -10.064 -10.199 11.461 1.00 0.00 O ATOM 0 H ASP A 155 -6.704 -11.978 8.311 1.00 0.00 H new ATOM 0 HA ASP A 155 -9.190 -10.387 8.448 1.00 0.00 H new ATOM 0 HB2 ASP A 155 -8.649 -11.937 10.343 1.00 0.00 H new ATOM 0 HB3 ASP A 155 -7.141 -11.081 10.592 1.00 0.00 H new ATOM 1187 N ARG A 156 -6.071 -9.319 8.695 1.00 0.00 N ATOM 1188 CA ARG A 156 -5.222 -8.142 8.556 1.00 0.00 C ATOM 1189 C ARG A 156 -5.068 -7.752 7.089 1.00 0.00 C ATOM 1190 O ARG A 156 -4.503 -8.503 6.293 1.00 0.00 O ATOM 1191 CB ARG A 156 -3.847 -8.403 9.173 1.00 0.00 C ATOM 1192 CG ARG A 156 -3.838 -8.341 10.691 1.00 0.00 C ATOM 1193 CD ARG A 156 -2.432 -8.137 11.233 1.00 0.00 C ATOM 1194 NE ARG A 156 -2.291 -8.646 12.594 1.00 0.00 N ATOM 1195 CZ ARG A 156 -1.198 -8.481 13.331 1.00 0.00 C ATOM 1196 NH1 ARG A 156 -0.156 -7.824 12.839 1.00 0.00 N ATOM 1197 NH2 ARG A 156 -1.145 -8.973 14.562 1.00 0.00 N ATOM 0 H ARG A 156 -5.563 -10.188 8.859 1.00 0.00 H new ATOM 0 HA ARG A 156 -5.699 -7.317 9.085 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -3.497 -9.385 8.856 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -3.139 -7.671 8.784 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -4.480 -7.527 11.027 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -4.255 -9.263 11.096 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -1.716 -8.639 10.582 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -2.188 -7.075 11.216 1.00 0.00 H new ATOM 0 HE ARG A 156 -3.075 -9.156 13.001 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -0.193 -7.444 11.893 1.00 0.00 H new ATOM 0 HH12 ARG A 156 0.682 -7.699 13.407 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -1.944 -9.479 14.944 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -0.305 -8.845 15.126 1.00 0.00 H new ATOM 1211 N ARG A 157 -5.574 -6.575 6.738 1.00 0.00 N ATOM 1212 CA ARG A 157 -5.494 -6.087 5.367 1.00 0.00 C ATOM 1213 C ARG A 157 -4.875 -4.693 5.321 1.00 0.00 C ATOM 1214 O ARG A 157 -5.062 -3.888 6.235 1.00 0.00 O ATOM 1215 CB ARG A 157 -6.885 -6.060 4.730 1.00 0.00 C ATOM 1216 CG ARG A 157 -7.492 -7.439 4.534 1.00 0.00 C ATOM 1217 CD ARG A 157 -8.986 -7.357 4.263 1.00 0.00 C ATOM 1218 NE ARG A 157 -9.665 -8.618 4.549 1.00 0.00 N ATOM 1219 CZ ARG A 157 -10.908 -8.887 4.168 1.00 0.00 C ATOM 1220 NH1 ARG A 157 -11.606 -7.987 3.488 1.00 0.00 N ATOM 1221 NH2 ARG A 157 -11.457 -10.058 4.466 1.00 0.00 N ATOM 0 H ARG A 157 -6.044 -5.941 7.384 1.00 0.00 H new ATOM 0 HA ARG A 157 -4.857 -6.768 4.803 1.00 0.00 H new ATOM 0 HB2 ARG A 157 -7.550 -5.465 5.356 1.00 0.00 H new ATOM 0 HB3 ARG A 157 -6.823 -5.559 3.764 1.00 0.00 H new ATOM 0 HG2 ARG A 157 -6.997 -7.941 3.702 1.00 0.00 H new ATOM 0 HG3 ARG A 157 -7.315 -8.045 5.422 1.00 0.00 H new ATOM 0 HD2 ARG A 157 -9.422 -6.565 4.872 1.00 0.00 H new ATOM 0 HD3 ARG A 157 -9.151 -7.085 3.220 1.00 0.00 H new ATOM 0 HE ARG A 157 -9.156 -9.332 5.070 1.00 0.00 H new ATOM 0 HH11 ARG A 157 -11.188 -7.086 3.257 1.00 0.00 H new ATOM 0 HH12 ARG A 157 -12.561 -8.196 3.196 1.00 0.00 H new ATOM 0 HH21 ARG A 157 -10.924 -10.753 4.989 1.00 0.00 H new ATOM 0 HH22 ARG A 157 -12.412 -10.263 4.172 1.00 0.00 H new ATOM 1235 N LEU A 158 -4.137 -4.414 4.252 1.00 0.00 N ATOM 1236 CA LEU A 158 -3.489 -3.118 4.087 1.00 0.00 C ATOM 1237 C LEU A 158 -4.508 -2.042 3.725 1.00 0.00 C ATOM 1238 O LEU A 158 -5.438 -2.287 2.956 1.00 0.00 O ATOM 1239 CB LEU A 158 -2.411 -3.199 3.005 1.00 0.00 C ATOM 1240 CG LEU A 158 -1.250 -4.154 3.284 1.00 0.00 C ATOM 1241 CD1 LEU A 158 -0.284 -4.179 2.110 1.00 0.00 C ATOM 1242 CD2 LEU A 158 -0.528 -3.757 4.564 1.00 0.00 C ATOM 0 H LEU A 158 -3.973 -5.068 3.487 1.00 0.00 H new ATOM 0 HA LEU A 158 -3.024 -2.848 5.035 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -2.885 -3.498 2.070 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -2.004 -2.200 2.850 1.00 0.00 H new ATOM 0 HG LEU A 158 -1.655 -5.158 3.415 1.00 0.00 H new ATOM 0 HD11 LEU A 158 0.535 -4.864 2.328 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -0.808 -4.513 1.215 1.00 0.00 H new ATOM 0 HD13 LEU A 158 0.114 -3.178 1.945 1.00 0.00 H new ATOM 0 HD21 LEU A 158 0.295 -4.448 4.747 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -0.137 -2.745 4.462 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -1.225 -3.794 5.401 1.00 0.00 H new ATOM 1254 N ARG A 159 -4.326 -0.850 4.283 1.00 0.00 N ATOM 1255 CA ARG A 159 -5.229 0.264 4.019 1.00 0.00 C ATOM 1256 C ARG A 159 -4.530 1.348 3.204 1.00 0.00 C ATOM 1257 O ARG A 159 -3.702 2.095 3.725 1.00 0.00 O ATOM 1258 CB ARG A 159 -5.746 0.852 5.333 1.00 0.00 C ATOM 1259 CG ARG A 159 -7.137 1.455 5.225 1.00 0.00 C ATOM 1260 CD ARG A 159 -7.091 2.865 4.657 1.00 0.00 C ATOM 1261 NE ARG A 159 -8.240 3.662 5.076 1.00 0.00 N ATOM 1262 CZ ARG A 159 -9.480 3.444 4.652 1.00 0.00 C ATOM 1263 NH1 ARG A 159 -9.729 2.459 3.800 1.00 0.00 N ATOM 1264 NH2 ARG A 159 -10.474 4.213 5.079 1.00 0.00 N ATOM 0 H ARG A 159 -3.561 -0.631 4.921 1.00 0.00 H new ATOM 0 HA ARG A 159 -6.073 -0.114 3.442 1.00 0.00 H new ATOM 0 HB2 ARG A 159 -5.756 0.070 6.092 1.00 0.00 H new ATOM 0 HB3 ARG A 159 -5.052 1.620 5.676 1.00 0.00 H new ATOM 0 HG2 ARG A 159 -7.759 0.826 4.589 1.00 0.00 H new ATOM 0 HG3 ARG A 159 -7.604 1.473 6.210 1.00 0.00 H new ATOM 0 HD2 ARG A 159 -6.173 3.356 4.979 1.00 0.00 H new ATOM 0 HD3 ARG A 159 -7.061 2.816 3.568 1.00 0.00 H new ATOM 0 HE ARG A 159 -8.082 4.428 5.730 1.00 0.00 H new ATOM 0 HH11 ARG A 159 -8.968 1.867 3.469 1.00 0.00 H new ATOM 0 HH12 ARG A 159 -10.682 2.294 3.476 1.00 0.00 H new ATOM 0 HH21 ARG A 159 -10.286 4.972 5.733 1.00 0.00 H new ATOM 0 HH22 ARG A 159 -11.426 4.044 4.753 1.00 0.00 H new ATOM 1278 N VAL A 160 -4.870 1.429 1.921 1.00 0.00 N ATOM 1279 CA VAL A 160 -4.277 2.422 1.034 1.00 0.00 C ATOM 1280 C VAL A 160 -5.274 3.525 0.698 1.00 0.00 C ATOM 1281 O VAL A 160 -6.382 3.254 0.235 1.00 0.00 O ATOM 1282 CB VAL A 160 -3.780 1.779 -0.275 1.00 0.00 C ATOM 1283 CG1 VAL A 160 -3.073 2.810 -1.141 1.00 0.00 C ATOM 1284 CG2 VAL A 160 -2.862 0.603 0.025 1.00 0.00 C ATOM 0 H VAL A 160 -5.553 0.818 1.473 1.00 0.00 H new ATOM 0 HA VAL A 160 -3.428 2.853 1.565 1.00 0.00 H new ATOM 0 HB VAL A 160 -4.643 1.406 -0.827 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -2.729 2.338 -2.061 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -3.764 3.617 -1.384 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -2.218 3.215 -0.600 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -2.520 0.160 -0.911 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -2.002 0.950 0.598 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -3.405 -0.145 0.603 1.00 0.00 H new ATOM 1294 N ASP A 161 -4.873 4.769 0.935 1.00 0.00 N ATOM 1295 CA ASP A 161 -5.731 5.915 0.657 1.00 0.00 C ATOM 1296 C ASP A 161 -4.919 7.078 0.095 1.00 0.00 C ATOM 1297 O ASP A 161 -3.875 7.439 0.639 1.00 0.00 O ATOM 1298 CB ASP A 161 -6.461 6.353 1.927 1.00 0.00 C ATOM 1299 CG ASP A 161 -7.606 7.304 1.638 1.00 0.00 C ATOM 1300 OD1 ASP A 161 -7.337 8.502 1.410 1.00 0.00 O ATOM 1301 OD2 ASP A 161 -8.770 6.851 1.641 1.00 0.00 O ATOM 0 H ASP A 161 -3.959 5.010 1.319 1.00 0.00 H new ATOM 0 HA ASP A 161 -6.466 5.614 -0.089 1.00 0.00 H new ATOM 0 HB2 ASP A 161 -6.845 5.473 2.444 1.00 0.00 H new ATOM 0 HB3 ASP A 161 -5.753 6.835 2.601 1.00 0.00 H new ATOM 1306 N PHE A 162 -5.404 7.660 -0.996 1.00 0.00 N ATOM 1307 CA PHE A 162 -4.723 8.781 -1.633 1.00 0.00 C ATOM 1308 C PHE A 162 -4.300 9.819 -0.597 1.00 0.00 C ATOM 1309 O PHE A 162 -5.134 10.375 0.116 1.00 0.00 O ATOM 1310 CB PHE A 162 -5.630 9.429 -2.680 1.00 0.00 C ATOM 1311 CG PHE A 162 -5.620 8.719 -4.004 1.00 0.00 C ATOM 1312 CD1 PHE A 162 -4.424 8.365 -4.606 1.00 0.00 C ATOM 1313 CD2 PHE A 162 -6.807 8.404 -4.645 1.00 0.00 C ATOM 1314 CE1 PHE A 162 -4.412 7.712 -5.824 1.00 0.00 C ATOM 1315 CE2 PHE A 162 -6.802 7.751 -5.864 1.00 0.00 C ATOM 1316 CZ PHE A 162 -5.602 7.404 -6.453 1.00 0.00 C ATOM 0 H PHE A 162 -6.267 7.374 -1.458 1.00 0.00 H new ATOM 0 HA PHE A 162 -3.829 8.398 -2.125 1.00 0.00 H new ATOM 0 HB2 PHE A 162 -6.651 9.455 -2.299 1.00 0.00 H new ATOM 0 HB3 PHE A 162 -5.319 10.463 -2.829 1.00 0.00 H new ATOM 0 HD1 PHE A 162 -3.490 8.602 -4.118 1.00 0.00 H new ATOM 0 HD2 PHE A 162 -7.748 8.672 -4.187 1.00 0.00 H new ATOM 0 HE1 PHE A 162 -3.472 7.443 -6.284 1.00 0.00 H new ATOM 0 HE2 PHE A 162 -7.734 7.513 -6.354 1.00 0.00 H new ATOM 0 HZ PHE A 162 -5.594 6.893 -7.404 1.00 0.00 H new ATOM 1326 N ALA A 163 -2.998 10.075 -0.522 1.00 0.00 N ATOM 1327 CA ALA A 163 -2.464 11.047 0.424 1.00 0.00 C ATOM 1328 C ALA A 163 -2.395 12.437 -0.198 1.00 0.00 C ATOM 1329 O ALA A 163 -1.311 12.950 -0.479 1.00 0.00 O ATOM 1330 CB ALA A 163 -1.088 10.613 0.906 1.00 0.00 C ATOM 0 H ALA A 163 -2.294 9.623 -1.105 1.00 0.00 H new ATOM 0 HA ALA A 163 -3.138 11.094 1.279 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -0.701 11.348 1.612 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -1.164 9.643 1.397 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -0.412 10.537 0.055 1.00 0.00 H new