USER MOD reduce.3.24.130724 H: found=0, std=0, add=575, rem=0, adj=13 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 180:sc= 0 USER MOD Set 1.2: A 132 GLN : amide:sc= -0.103 K(o=-0.1,f=-1.9!) USER MOD Single : A 88 ASN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -0.0316 K(o=-0.032,f=-0.92) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0.00152 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= -0.0241 USER MOD Single : A 122 HIS : no HD1:sc= -0.364 X(o=-0.36,f=-0.0071) USER MOD Single : A 124 LYS NZ :NH3+ -127:sc= 0 (180deg=-0.69) USER MOD Single : A 127 SER OG : rot -62:sc= 0.7 USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot -11:sc= 1.26 USER MOD Single : A 135 SER OG : rot 180:sc= 0.328 USER MOD Single : A 140 GLN : amide:sc= -3.82 K(o=-3.8,f=-5.1!) USER MOD Single : A 143 CYS SG : rot 178:sc= 1.05 USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 MET CE :methyl -135:sc= -1.08 (180deg=-2.35!) USER MOD ----------------------------------------------------------------- ATOM 174 N ASN A 88 -8.649 13.567 -4.340 1.00 0.00 N ATOM 175 CA ASN A 88 -8.010 13.510 -5.650 1.00 0.00 C ATOM 176 C ASN A 88 -6.763 12.633 -5.609 1.00 0.00 C ATOM 177 O ASN A 88 -6.027 12.603 -4.623 1.00 0.00 O ATOM 178 CB ASN A 88 -7.642 14.918 -6.123 1.00 0.00 C ATOM 179 CG ASN A 88 -8.813 15.637 -6.765 1.00 0.00 C ATOM 180 OD1 ASN A 88 -9.965 15.230 -6.613 1.00 0.00 O ATOM 181 ND2 ASN A 88 -8.522 16.712 -7.488 1.00 0.00 N ATOM 0 HA ASN A 88 -8.718 13.071 -6.353 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -7.282 15.501 -5.275 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -6.822 14.855 -6.838 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -9.268 17.237 -7.945 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -7.552 17.013 -7.587 1.00 0.00 H new ATOM 188 N PRO A 89 -6.518 11.901 -6.706 1.00 0.00 N ATOM 189 CA PRO A 89 -5.360 11.010 -6.822 1.00 0.00 C ATOM 190 C PRO A 89 -4.046 11.778 -6.921 1.00 0.00 C ATOM 191 O PRO A 89 -3.989 12.858 -7.509 1.00 0.00 O ATOM 192 CB PRO A 89 -5.630 10.242 -8.118 1.00 0.00 C ATOM 193 CG PRO A 89 -6.508 11.143 -8.916 1.00 0.00 C ATOM 194 CD PRO A 89 -7.354 11.887 -7.919 1.00 0.00 C ATOM 0 HA PRO A 89 -5.250 10.369 -5.947 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -4.703 10.021 -8.648 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -6.118 9.288 -7.919 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -5.916 11.833 -9.517 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -7.129 10.572 -9.606 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -7.584 12.896 -8.261 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -8.306 11.385 -7.745 1.00 0.00 H new ATOM 202 N THR A 90 -2.990 11.213 -6.344 1.00 0.00 N ATOM 203 CA THR A 90 -1.677 11.844 -6.367 1.00 0.00 C ATOM 204 C THR A 90 -0.565 10.802 -6.329 1.00 0.00 C ATOM 205 O THR A 90 -0.738 9.714 -5.779 1.00 0.00 O ATOM 206 CB THR A 90 -1.498 12.813 -5.183 1.00 0.00 C ATOM 207 OG1 THR A 90 -0.263 13.524 -5.314 1.00 0.00 O ATOM 208 CG2 THR A 90 -1.518 12.060 -3.861 1.00 0.00 C ATOM 0 H THR A 90 -3.019 10.319 -5.855 1.00 0.00 H new ATOM 0 HA THR A 90 -1.613 12.406 -7.299 1.00 0.00 H new ATOM 0 HB THR A 90 -2.327 13.521 -5.193 1.00 0.00 H new ATOM 0 HG1 THR A 90 -0.158 14.139 -4.558 1.00 0.00 H new ATOM 0 HG21 THR A 90 -1.390 12.764 -3.039 1.00 0.00 H new ATOM 0 HG22 THR A 90 -2.471 11.543 -3.751 1.00 0.00 H new ATOM 0 HG23 THR A 90 -0.707 11.332 -3.845 1.00 0.00 H new ATOM 216 N THR A 91 0.578 11.141 -6.917 1.00 0.00 N ATOM 217 CA THR A 91 1.719 10.235 -6.950 1.00 0.00 C ATOM 218 C THR A 91 2.008 9.664 -5.566 1.00 0.00 C ATOM 219 O THR A 91 2.477 8.533 -5.437 1.00 0.00 O ATOM 220 CB THR A 91 2.982 10.941 -7.477 1.00 0.00 C ATOM 221 OG1 THR A 91 3.168 12.186 -6.795 1.00 0.00 O ATOM 222 CG2 THR A 91 2.880 11.187 -8.974 1.00 0.00 C ATOM 0 H THR A 91 0.738 12.037 -7.377 1.00 0.00 H new ATOM 0 HA THR A 91 1.458 9.422 -7.627 1.00 0.00 H new ATOM 0 HB THR A 91 3.838 10.293 -7.289 1.00 0.00 H new ATOM 0 HG1 THR A 91 3.974 12.628 -7.135 1.00 0.00 H new ATOM 0 HG21 THR A 91 3.784 11.687 -9.323 1.00 0.00 H new ATOM 0 HG22 THR A 91 2.769 10.235 -9.492 1.00 0.00 H new ATOM 0 HG23 THR A 91 2.014 11.816 -9.181 1.00 0.00 H new ATOM 230 N ARG A 92 1.727 10.454 -4.535 1.00 0.00 N ATOM 231 CA ARG A 92 1.958 10.027 -3.160 1.00 0.00 C ATOM 232 C ARG A 92 0.798 9.175 -2.654 1.00 0.00 C ATOM 233 O ARG A 92 -0.367 9.460 -2.937 1.00 0.00 O ATOM 234 CB ARG A 92 2.147 11.242 -2.251 1.00 0.00 C ATOM 235 CG ARG A 92 2.602 10.886 -0.846 1.00 0.00 C ATOM 236 CD ARG A 92 3.422 12.007 -0.225 1.00 0.00 C ATOM 237 NE ARG A 92 2.581 13.110 0.234 1.00 0.00 N ATOM 238 CZ ARG A 92 3.033 14.123 0.965 1.00 0.00 C ATOM 239 NH1 ARG A 92 4.310 14.173 1.318 1.00 0.00 N ATOM 240 NH2 ARG A 92 2.206 15.089 1.344 1.00 0.00 N ATOM 0 H ARG A 92 1.339 11.393 -4.626 1.00 0.00 H new ATOM 0 HA ARG A 92 2.865 9.423 -3.141 1.00 0.00 H new ATOM 0 HB2 ARG A 92 2.879 11.912 -2.702 1.00 0.00 H new ATOM 0 HB3 ARG A 92 1.207 11.790 -2.191 1.00 0.00 H new ATOM 0 HG2 ARG A 92 1.732 10.681 -0.222 1.00 0.00 H new ATOM 0 HG3 ARG A 92 3.196 9.972 -0.875 1.00 0.00 H new ATOM 0 HD2 ARG A 92 3.995 11.614 0.615 1.00 0.00 H new ATOM 0 HD3 ARG A 92 4.140 12.378 -0.956 1.00 0.00 H new ATOM 0 HE ARG A 92 1.593 13.102 -0.021 1.00 0.00 H new ATOM 0 HH11 ARG A 92 4.949 13.432 1.028 1.00 0.00 H new ATOM 0 HH12 ARG A 92 4.654 14.952 1.879 1.00 0.00 H new ATOM 0 HH21 ARG A 92 1.223 15.054 1.074 1.00 0.00 H new ATOM 0 HH22 ARG A 92 2.553 15.867 1.905 1.00 0.00 H new ATOM 254 N LEU A 93 1.123 8.128 -1.903 1.00 0.00 N ATOM 255 CA LEU A 93 0.108 7.234 -1.356 1.00 0.00 C ATOM 256 C LEU A 93 0.364 6.959 0.122 1.00 0.00 C ATOM 257 O LEU A 93 1.500 6.718 0.531 1.00 0.00 O ATOM 258 CB LEU A 93 0.088 5.917 -2.135 1.00 0.00 C ATOM 259 CG LEU A 93 0.073 6.039 -3.659 1.00 0.00 C ATOM 260 CD1 LEU A 93 0.463 4.718 -4.304 1.00 0.00 C ATOM 261 CD2 LEU A 93 -1.298 6.488 -4.145 1.00 0.00 C ATOM 0 H LEU A 93 2.081 7.877 -1.659 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.862 7.722 -1.453 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.962 5.334 -1.846 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -0.790 5.349 -1.827 1.00 0.00 H new ATOM 0 HG LEU A 93 0.804 6.792 -3.951 1.00 0.00 H new ATOM 0 HD11 LEU A 93 0.447 4.824 -5.389 1.00 0.00 H new ATOM 0 HD12 LEU A 93 1.466 4.438 -3.982 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.244 3.944 -4.004 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.290 6.569 -5.232 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -2.049 5.758 -3.841 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -1.538 7.458 -3.710 1.00 0.00 H new ATOM 273 N TRP A 94 -0.699 6.996 0.918 1.00 0.00 N ATOM 274 CA TRP A 94 -0.590 6.749 2.351 1.00 0.00 C ATOM 275 C TRP A 94 -0.808 5.274 2.667 1.00 0.00 C ATOM 276 O TRP A 94 -1.863 4.714 2.366 1.00 0.00 O ATOM 277 CB TRP A 94 -1.603 7.603 3.115 1.00 0.00 C ATOM 278 CG TRP A 94 -1.566 7.384 4.597 1.00 0.00 C ATOM 279 CD1 TRP A 94 -0.682 7.928 5.484 1.00 0.00 C ATOM 280 CD2 TRP A 94 -2.451 6.560 5.364 1.00 0.00 C ATOM 281 NE1 TRP A 94 -0.964 7.492 6.757 1.00 0.00 N ATOM 282 CE2 TRP A 94 -2.045 6.653 6.710 1.00 0.00 C ATOM 283 CE3 TRP A 94 -3.548 5.756 5.046 1.00 0.00 C ATOM 284 CZ2 TRP A 94 -2.698 5.970 7.733 1.00 0.00 C ATOM 285 CZ3 TRP A 94 -4.195 5.078 6.062 1.00 0.00 C ATOM 286 CH2 TRP A 94 -3.769 5.189 7.392 1.00 0.00 C ATOM 0 H TRP A 94 -1.646 7.195 0.595 1.00 0.00 H new ATOM 0 HA TRP A 94 0.417 7.023 2.666 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -1.412 8.655 2.906 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -2.605 7.382 2.747 1.00 0.00 H new ATOM 0 HD1 TRP A 94 0.121 8.602 5.224 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -0.451 7.751 7.600 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -3.885 5.666 4.024 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -2.371 6.054 8.759 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -5.043 4.452 5.827 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -4.296 4.648 8.164 1.00 0.00 H new ATOM 297 N VAL A 95 0.194 4.648 3.276 1.00 0.00 N ATOM 298 CA VAL A 95 0.110 3.238 3.634 1.00 0.00 C ATOM 299 C VAL A 95 0.271 3.042 5.138 1.00 0.00 C ATOM 300 O VAL A 95 1.312 3.365 5.709 1.00 0.00 O ATOM 301 CB VAL A 95 1.182 2.408 2.902 1.00 0.00 C ATOM 302 CG1 VAL A 95 1.108 0.949 3.325 1.00 0.00 C ATOM 303 CG2 VAL A 95 1.023 2.544 1.396 1.00 0.00 C ATOM 0 H VAL A 95 1.074 5.096 3.532 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.878 2.893 3.329 1.00 0.00 H new ATOM 0 HB VAL A 95 2.165 2.791 3.177 1.00 0.00 H new ATOM 0 HG11 VAL A 95 1.872 0.378 2.798 1.00 0.00 H new ATOM 0 HG12 VAL A 95 1.275 0.873 4.399 1.00 0.00 H new ATOM 0 HG13 VAL A 95 0.124 0.549 3.081 1.00 0.00 H new ATOM 0 HG21 VAL A 95 1.788 1.951 0.894 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.036 2.187 1.101 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.131 3.591 1.112 1.00 0.00 H new ATOM 313 N GLY A 96 -0.768 2.510 5.774 1.00 0.00 N ATOM 314 CA GLY A 96 -0.722 2.279 7.207 1.00 0.00 C ATOM 315 C GLY A 96 -0.988 0.832 7.570 1.00 0.00 C ATOM 316 O GLY A 96 -1.019 -0.038 6.701 1.00 0.00 O ATOM 0 H GLY A 96 -1.641 2.235 5.323 1.00 0.00 H new ATOM 0 HA2 GLY A 96 0.256 2.572 7.588 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -1.459 2.915 7.698 1.00 0.00 H new ATOM 320 N GLY A 97 -1.178 0.572 8.860 1.00 0.00 N ATOM 321 CA GLY A 97 -1.438 -0.781 9.314 1.00 0.00 C ATOM 322 C GLY A 97 -0.205 -1.660 9.251 1.00 0.00 C ATOM 323 O GLY A 97 -0.288 -2.834 8.886 1.00 0.00 O ATOM 0 H GLY A 97 -1.156 1.275 9.599 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -1.808 -0.752 10.339 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -2.226 -1.221 8.703 1.00 0.00 H new ATOM 327 N LEU A 98 0.942 -1.093 9.607 1.00 0.00 N ATOM 328 CA LEU A 98 2.200 -1.833 9.588 1.00 0.00 C ATOM 329 C LEU A 98 2.492 -2.444 10.955 1.00 0.00 C ATOM 330 O LEU A 98 1.867 -2.088 11.952 1.00 0.00 O ATOM 331 CB LEU A 98 3.349 -0.914 9.171 1.00 0.00 C ATOM 332 CG LEU A 98 3.176 -0.186 7.838 1.00 0.00 C ATOM 333 CD1 LEU A 98 4.410 0.645 7.519 1.00 0.00 C ATOM 334 CD2 LEU A 98 2.896 -1.179 6.720 1.00 0.00 C ATOM 0 H LEU A 98 1.028 -0.124 9.912 1.00 0.00 H new ATOM 0 HA LEU A 98 2.108 -2.640 8.862 1.00 0.00 H new ATOM 0 HB2 LEU A 98 3.494 -0.169 9.953 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.263 -1.507 9.123 1.00 0.00 H new ATOM 0 HG LEU A 98 2.322 0.486 7.922 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.268 1.156 6.567 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.566 1.382 8.307 1.00 0.00 H new ATOM 0 HD13 LEU A 98 5.281 -0.007 7.455 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.776 -0.643 5.779 1.00 0.00 H new ATOM 0 HD22 LEU A 98 3.729 -1.877 6.636 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.982 -1.730 6.943 1.00 0.00 H new ATOM 346 N GLY A 99 3.450 -3.366 10.993 1.00 0.00 N ATOM 347 CA GLY A 99 3.810 -4.010 12.242 1.00 0.00 C ATOM 348 C GLY A 99 5.300 -4.263 12.355 1.00 0.00 C ATOM 349 O GLY A 99 6.090 -3.834 11.514 1.00 0.00 O ATOM 0 H GLY A 99 3.983 -3.678 10.181 1.00 0.00 H new ATOM 0 HA2 GLY A 99 3.486 -3.386 13.075 1.00 0.00 H new ATOM 0 HA3 GLY A 99 3.276 -4.957 12.326 1.00 0.00 H new ATOM 353 N PRO A 100 5.705 -4.975 13.418 1.00 0.00 N ATOM 354 CA PRO A 100 7.113 -5.300 13.664 1.00 0.00 C ATOM 355 C PRO A 100 7.660 -6.307 12.658 1.00 0.00 C ATOM 356 O PRO A 100 8.782 -6.168 12.173 1.00 0.00 O ATOM 357 CB PRO A 100 7.097 -5.903 15.070 1.00 0.00 C ATOM 358 CG PRO A 100 5.718 -6.440 15.237 1.00 0.00 C ATOM 359 CD PRO A 100 4.818 -5.518 14.461 1.00 0.00 C ATOM 0 HA PRO A 100 7.756 -4.425 13.568 1.00 0.00 H new ATOM 0 HB2 PRO A 100 7.843 -6.691 15.171 1.00 0.00 H new ATOM 0 HB3 PRO A 100 7.323 -5.151 15.826 1.00 0.00 H new ATOM 0 HG2 PRO A 100 5.649 -7.461 14.861 1.00 0.00 H new ATOM 0 HG3 PRO A 100 5.435 -6.468 16.289 1.00 0.00 H new ATOM 0 HD2 PRO A 100 3.971 -6.052 14.030 1.00 0.00 H new ATOM 0 HD3 PRO A 100 4.410 -4.729 15.093 1.00 0.00 H new ATOM 367 N ASN A 101 6.859 -7.321 12.348 1.00 0.00 N ATOM 368 CA ASN A 101 7.263 -8.353 11.399 1.00 0.00 C ATOM 369 C ASN A 101 7.481 -7.759 10.011 1.00 0.00 C ATOM 370 O ASN A 101 8.459 -8.076 9.333 1.00 0.00 O ATOM 371 CB ASN A 101 6.207 -9.458 11.334 1.00 0.00 C ATOM 372 CG ASN A 101 6.238 -10.360 12.553 1.00 0.00 C ATOM 373 OD1 ASN A 101 7.304 -10.657 13.092 1.00 0.00 O ATOM 374 ND2 ASN A 101 5.065 -10.800 12.993 1.00 0.00 N ATOM 0 H ASN A 101 5.926 -7.451 12.740 1.00 0.00 H new ATOM 0 HA ASN A 101 8.204 -8.781 11.744 1.00 0.00 H new ATOM 0 HB2 ASN A 101 5.219 -9.007 11.244 1.00 0.00 H new ATOM 0 HB3 ASN A 101 6.367 -10.057 10.438 1.00 0.00 H new ATOM 0 HD21 ASN A 101 5.023 -11.410 13.809 1.00 0.00 H new ATOM 0 HD22 ASN A 101 4.206 -10.528 12.515 1.00 0.00 H new ATOM 381 N THR A 102 6.561 -6.894 9.592 1.00 0.00 N ATOM 382 CA THR A 102 6.651 -6.257 8.285 1.00 0.00 C ATOM 383 C THR A 102 8.065 -5.753 8.015 1.00 0.00 C ATOM 384 O THR A 102 8.762 -5.314 8.929 1.00 0.00 O ATOM 385 CB THR A 102 5.667 -5.077 8.166 1.00 0.00 C ATOM 386 OG1 THR A 102 4.363 -5.483 8.596 1.00 0.00 O ATOM 387 CG2 THR A 102 5.600 -4.571 6.733 1.00 0.00 C ATOM 0 H THR A 102 5.746 -6.619 10.140 1.00 0.00 H new ATOM 0 HA THR A 102 6.390 -7.014 7.546 1.00 0.00 H new ATOM 0 HB THR A 102 6.024 -4.268 8.803 1.00 0.00 H new ATOM 0 HG1 THR A 102 3.743 -4.728 8.519 1.00 0.00 H new ATOM 0 HG21 THR A 102 4.899 -3.738 6.674 1.00 0.00 H new ATOM 0 HG22 THR A 102 6.589 -4.236 6.419 1.00 0.00 H new ATOM 0 HG23 THR A 102 5.264 -5.375 6.078 1.00 0.00 H new ATOM 395 N SER A 103 8.481 -5.820 6.754 1.00 0.00 N ATOM 396 CA SER A 103 9.813 -5.373 6.365 1.00 0.00 C ATOM 397 C SER A 103 9.736 -4.363 5.224 1.00 0.00 C ATOM 398 O SER A 103 8.841 -4.430 4.379 1.00 0.00 O ATOM 399 CB SER A 103 10.672 -6.568 5.946 1.00 0.00 C ATOM 400 OG SER A 103 11.219 -7.224 7.076 1.00 0.00 O ATOM 0 H SER A 103 7.915 -6.179 5.985 1.00 0.00 H new ATOM 0 HA SER A 103 10.272 -4.888 7.226 1.00 0.00 H new ATOM 0 HB2 SER A 103 10.068 -7.270 5.371 1.00 0.00 H new ATOM 0 HB3 SER A 103 11.477 -6.230 5.293 1.00 0.00 H new ATOM 0 HG SER A 103 11.762 -7.985 6.782 1.00 0.00 H new ATOM 406 N LEU A 104 10.679 -3.428 5.205 1.00 0.00 N ATOM 407 CA LEU A 104 10.719 -2.402 4.169 1.00 0.00 C ATOM 408 C LEU A 104 10.660 -3.030 2.779 1.00 0.00 C ATOM 409 O LEU A 104 9.712 -2.807 2.027 1.00 0.00 O ATOM 410 CB LEU A 104 11.988 -1.559 4.306 1.00 0.00 C ATOM 411 CG LEU A 104 12.013 -0.250 3.517 1.00 0.00 C ATOM 412 CD1 LEU A 104 12.400 -0.507 2.069 1.00 0.00 C ATOM 413 CD2 LEU A 104 10.662 0.445 3.594 1.00 0.00 C ATOM 0 H LEU A 104 11.427 -3.359 5.895 1.00 0.00 H new ATOM 0 HA LEU A 104 9.848 -1.759 4.295 1.00 0.00 H new ATOM 0 HB2 LEU A 104 12.134 -1.327 5.361 1.00 0.00 H new ATOM 0 HB3 LEU A 104 12.838 -2.165 3.993 1.00 0.00 H new ATOM 0 HG LEU A 104 12.762 0.405 3.961 1.00 0.00 H new ATOM 0 HD11 LEU A 104 12.413 0.436 1.523 1.00 0.00 H new ATOM 0 HD12 LEU A 104 13.390 -0.961 2.032 1.00 0.00 H new ATOM 0 HD13 LEU A 104 11.675 -1.181 1.613 1.00 0.00 H new ATOM 0 HD21 LEU A 104 10.698 1.375 3.027 1.00 0.00 H new ATOM 0 HD22 LEU A 104 9.894 -0.205 3.176 1.00 0.00 H new ATOM 0 HD23 LEU A 104 10.424 0.664 4.635 1.00 0.00 H new ATOM 425 N ALA A 105 11.678 -3.817 2.447 1.00 0.00 N ATOM 426 CA ALA A 105 11.740 -4.480 1.151 1.00 0.00 C ATOM 427 C ALA A 105 10.415 -5.157 0.817 1.00 0.00 C ATOM 428 O ALA A 105 9.852 -4.944 -0.257 1.00 0.00 O ATOM 429 CB ALA A 105 12.874 -5.495 1.131 1.00 0.00 C ATOM 0 H ALA A 105 12.471 -4.011 3.058 1.00 0.00 H new ATOM 0 HA ALA A 105 11.932 -3.722 0.391 1.00 0.00 H new ATOM 0 HB1 ALA A 105 12.909 -5.983 0.157 1.00 0.00 H new ATOM 0 HB2 ALA A 105 13.820 -4.987 1.316 1.00 0.00 H new ATOM 0 HB3 ALA A 105 12.706 -6.243 1.906 1.00 0.00 H new ATOM 435 N ALA A 106 9.923 -5.973 1.743 1.00 0.00 N ATOM 436 CA ALA A 106 8.664 -6.680 1.547 1.00 0.00 C ATOM 437 C ALA A 106 7.627 -5.781 0.883 1.00 0.00 C ATOM 438 O ALA A 106 7.129 -6.085 -0.202 1.00 0.00 O ATOM 439 CB ALA A 106 8.139 -7.202 2.876 1.00 0.00 C ATOM 0 H ALA A 106 10.377 -6.161 2.637 1.00 0.00 H new ATOM 0 HA ALA A 106 8.850 -7.526 0.885 1.00 0.00 H new ATOM 0 HB1 ALA A 106 7.198 -7.728 2.714 1.00 0.00 H new ATOM 0 HB2 ALA A 106 8.867 -7.886 3.311 1.00 0.00 H new ATOM 0 HB3 ALA A 106 7.975 -6.366 3.556 1.00 0.00 H new ATOM 445 N LEU A 107 7.305 -4.672 1.540 1.00 0.00 N ATOM 446 CA LEU A 107 6.326 -3.727 1.014 1.00 0.00 C ATOM 447 C LEU A 107 6.799 -3.133 -0.309 1.00 0.00 C ATOM 448 O LEU A 107 6.102 -3.210 -1.320 1.00 0.00 O ATOM 449 CB LEU A 107 6.071 -2.609 2.026 1.00 0.00 C ATOM 450 CG LEU A 107 5.413 -3.031 3.341 1.00 0.00 C ATOM 451 CD1 LEU A 107 5.389 -1.871 4.323 1.00 0.00 C ATOM 452 CD2 LEU A 107 4.004 -3.549 3.090 1.00 0.00 C ATOM 0 H LEU A 107 7.708 -4.405 2.438 1.00 0.00 H new ATOM 0 HA LEU A 107 5.396 -4.267 0.837 1.00 0.00 H new ATOM 0 HB2 LEU A 107 7.023 -2.131 2.256 1.00 0.00 H new ATOM 0 HB3 LEU A 107 5.441 -1.855 1.553 1.00 0.00 H new ATOM 0 HG LEU A 107 6.003 -3.837 3.778 1.00 0.00 H new ATOM 0 HD11 LEU A 107 4.917 -2.191 5.252 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.409 -1.546 4.527 1.00 0.00 H new ATOM 0 HD13 LEU A 107 4.823 -1.043 3.895 1.00 0.00 H new ATOM 0 HD21 LEU A 107 3.551 -3.845 4.036 1.00 0.00 H new ATOM 0 HD22 LEU A 107 3.404 -2.764 2.630 1.00 0.00 H new ATOM 0 HD23 LEU A 107 4.046 -4.410 2.423 1.00 0.00 H new ATOM 464 N ALA A 108 7.989 -2.541 -0.293 1.00 0.00 N ATOM 465 CA ALA A 108 8.557 -1.937 -1.492 1.00 0.00 C ATOM 466 C ALA A 108 8.467 -2.888 -2.681 1.00 0.00 C ATOM 467 O ALA A 108 7.715 -2.646 -3.625 1.00 0.00 O ATOM 468 CB ALA A 108 10.003 -1.533 -1.245 1.00 0.00 C ATOM 0 H ALA A 108 8.578 -2.467 0.537 1.00 0.00 H new ATOM 0 HA ALA A 108 7.977 -1.045 -1.729 1.00 0.00 H new ATOM 0 HB1 ALA A 108 10.415 -1.083 -2.149 1.00 0.00 H new ATOM 0 HB2 ALA A 108 10.045 -0.811 -0.429 1.00 0.00 H new ATOM 0 HB3 ALA A 108 10.587 -2.414 -0.980 1.00 0.00 H new ATOM 474 N ARG A 109 9.239 -3.968 -2.629 1.00 0.00 N ATOM 475 CA ARG A 109 9.248 -4.954 -3.703 1.00 0.00 C ATOM 476 C ARG A 109 7.860 -5.095 -4.322 1.00 0.00 C ATOM 477 O ARG A 109 7.722 -5.203 -5.540 1.00 0.00 O ATOM 478 CB ARG A 109 9.724 -6.309 -3.176 1.00 0.00 C ATOM 479 CG ARG A 109 10.219 -7.246 -4.265 1.00 0.00 C ATOM 480 CD ARG A 109 11.616 -6.868 -4.733 1.00 0.00 C ATOM 481 NE ARG A 109 11.959 -7.503 -6.002 1.00 0.00 N ATOM 482 CZ ARG A 109 12.970 -7.112 -6.770 1.00 0.00 C ATOM 483 NH1 ARG A 109 13.733 -6.093 -6.399 1.00 0.00 N ATOM 484 NH2 ARG A 109 13.219 -7.740 -7.912 1.00 0.00 N ATOM 0 H ARG A 109 9.867 -4.183 -1.854 1.00 0.00 H new ATOM 0 HA ARG A 109 9.938 -4.610 -4.474 1.00 0.00 H new ATOM 0 HB2 ARG A 109 10.526 -6.148 -2.455 1.00 0.00 H new ATOM 0 HB3 ARG A 109 8.905 -6.789 -2.640 1.00 0.00 H new ATOM 0 HG2 ARG A 109 10.224 -8.270 -3.891 1.00 0.00 H new ATOM 0 HG3 ARG A 109 9.531 -7.219 -5.110 1.00 0.00 H new ATOM 0 HD2 ARG A 109 11.682 -5.785 -4.840 1.00 0.00 H new ATOM 0 HD3 ARG A 109 12.343 -7.158 -3.974 1.00 0.00 H new ATOM 0 HE ARG A 109 11.391 -8.290 -6.316 1.00 0.00 H new ATOM 0 HH11 ARG A 109 13.544 -5.607 -5.522 1.00 0.00 H new ATOM 0 HH12 ARG A 109 14.509 -5.795 -6.990 1.00 0.00 H new ATOM 0 HH21 ARG A 109 12.634 -8.524 -8.201 1.00 0.00 H new ATOM 0 HH22 ARG A 109 13.996 -7.439 -8.501 1.00 0.00 H new ATOM 498 N GLU A 110 6.837 -5.095 -3.474 1.00 0.00 N ATOM 499 CA GLU A 110 5.461 -5.225 -3.939 1.00 0.00 C ATOM 500 C GLU A 110 5.022 -3.974 -4.696 1.00 0.00 C ATOM 501 O GLU A 110 4.645 -4.044 -5.866 1.00 0.00 O ATOM 502 CB GLU A 110 4.521 -5.475 -2.757 1.00 0.00 C ATOM 503 CG GLU A 110 4.334 -6.946 -2.430 1.00 0.00 C ATOM 504 CD GLU A 110 3.482 -7.669 -3.456 1.00 0.00 C ATOM 505 OE1 GLU A 110 2.570 -7.033 -4.024 1.00 0.00 O ATOM 506 OE2 GLU A 110 3.730 -8.870 -3.691 1.00 0.00 O ATOM 0 H GLU A 110 6.934 -5.007 -2.463 1.00 0.00 H new ATOM 0 HA GLU A 110 5.413 -6.076 -4.619 1.00 0.00 H new ATOM 0 HB2 GLU A 110 4.912 -4.963 -1.878 1.00 0.00 H new ATOM 0 HB3 GLU A 110 3.549 -5.034 -2.977 1.00 0.00 H new ATOM 0 HG2 GLU A 110 5.310 -7.428 -2.370 1.00 0.00 H new ATOM 0 HG3 GLU A 110 3.871 -7.040 -1.448 1.00 0.00 H new ATOM 513 N PHE A 111 5.073 -2.832 -4.019 1.00 0.00 N ATOM 514 CA PHE A 111 4.680 -1.566 -4.626 1.00 0.00 C ATOM 515 C PHE A 111 5.447 -1.322 -5.922 1.00 0.00 C ATOM 516 O PHE A 111 4.851 -1.095 -6.975 1.00 0.00 O ATOM 517 CB PHE A 111 4.924 -0.411 -3.652 1.00 0.00 C ATOM 518 CG PHE A 111 3.782 -0.175 -2.704 1.00 0.00 C ATOM 519 CD1 PHE A 111 2.744 0.675 -3.047 1.00 0.00 C ATOM 520 CD2 PHE A 111 3.749 -0.803 -1.469 1.00 0.00 C ATOM 521 CE1 PHE A 111 1.692 0.894 -2.178 1.00 0.00 C ATOM 522 CE2 PHE A 111 2.700 -0.589 -0.596 1.00 0.00 C ATOM 523 CZ PHE A 111 1.670 0.262 -0.950 1.00 0.00 C ATOM 0 H PHE A 111 5.383 -2.757 -3.050 1.00 0.00 H new ATOM 0 HA PHE A 111 3.616 -1.619 -4.858 1.00 0.00 H new ATOM 0 HB2 PHE A 111 5.827 -0.616 -3.077 1.00 0.00 H new ATOM 0 HB3 PHE A 111 5.108 0.501 -4.221 1.00 0.00 H new ATOM 0 HD1 PHE A 111 2.757 1.173 -4.005 1.00 0.00 H new ATOM 0 HD2 PHE A 111 4.552 -1.467 -1.186 1.00 0.00 H new ATOM 0 HE1 PHE A 111 0.888 1.558 -2.459 1.00 0.00 H new ATOM 0 HE2 PHE A 111 2.685 -1.086 0.363 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.850 0.432 -0.268 1.00 0.00 H new ATOM 533 N ASP A 112 6.771 -1.372 -5.837 1.00 0.00 N ATOM 534 CA ASP A 112 7.621 -1.158 -7.003 1.00 0.00 C ATOM 535 C ASP A 112 7.017 -1.810 -8.243 1.00 0.00 C ATOM 536 O ASP A 112 7.043 -1.237 -9.332 1.00 0.00 O ATOM 537 CB ASP A 112 9.022 -1.716 -6.748 1.00 0.00 C ATOM 538 CG ASP A 112 9.770 -2.012 -8.034 1.00 0.00 C ATOM 539 OD1 ASP A 112 9.323 -2.902 -8.788 1.00 0.00 O ATOM 540 OD2 ASP A 112 10.801 -1.354 -8.286 1.00 0.00 O ATOM 0 H ASP A 112 7.280 -1.559 -4.973 1.00 0.00 H new ATOM 0 HA ASP A 112 7.693 -0.085 -7.178 1.00 0.00 H new ATOM 0 HB2 ASP A 112 9.593 -1.001 -6.156 1.00 0.00 H new ATOM 0 HB3 ASP A 112 8.944 -2.629 -6.158 1.00 0.00 H new ATOM 545 N ARG A 113 6.476 -3.011 -8.069 1.00 0.00 N ATOM 546 CA ARG A 113 5.868 -3.742 -9.174 1.00 0.00 C ATOM 547 C ARG A 113 5.190 -2.786 -10.151 1.00 0.00 C ATOM 548 O ARG A 113 5.619 -2.644 -11.296 1.00 0.00 O ATOM 549 CB ARG A 113 4.850 -4.754 -8.645 1.00 0.00 C ATOM 550 CG ARG A 113 5.476 -5.892 -7.855 1.00 0.00 C ATOM 551 CD ARG A 113 4.442 -6.937 -7.469 1.00 0.00 C ATOM 552 NE ARG A 113 4.241 -7.925 -8.526 1.00 0.00 N ATOM 553 CZ ARG A 113 5.146 -8.836 -8.862 1.00 0.00 C ATOM 554 NH1 ARG A 113 6.309 -8.886 -8.228 1.00 0.00 N ATOM 555 NH2 ARG A 113 4.889 -9.701 -9.835 1.00 0.00 N ATOM 0 H ARG A 113 6.446 -3.498 -7.174 1.00 0.00 H new ATOM 0 HA ARG A 113 6.659 -4.274 -9.703 1.00 0.00 H new ATOM 0 HB2 ARG A 113 4.131 -4.235 -8.011 1.00 0.00 H new ATOM 0 HB3 ARG A 113 4.293 -5.169 -9.485 1.00 0.00 H new ATOM 0 HG2 ARG A 113 6.262 -6.359 -8.448 1.00 0.00 H new ATOM 0 HG3 ARG A 113 5.948 -5.496 -6.956 1.00 0.00 H new ATOM 0 HD2 ARG A 113 4.760 -7.442 -6.557 1.00 0.00 H new ATOM 0 HD3 ARG A 113 3.495 -6.445 -7.248 1.00 0.00 H new ATOM 0 HE ARG A 113 3.356 -7.914 -9.034 1.00 0.00 H new ATOM 0 HH11 ARG A 113 6.511 -8.223 -7.479 1.00 0.00 H new ATOM 0 HH12 ARG A 113 7.002 -9.587 -8.489 1.00 0.00 H new ATOM 0 HH21 ARG A 113 3.995 -9.666 -10.325 1.00 0.00 H new ATOM 0 HH22 ARG A 113 5.585 -10.401 -10.092 1.00 0.00 H new ATOM 569 N PHE A 114 4.128 -2.132 -9.690 1.00 0.00 N ATOM 570 CA PHE A 114 3.390 -1.190 -10.523 1.00 0.00 C ATOM 571 C PHE A 114 4.338 -0.213 -11.211 1.00 0.00 C ATOM 572 O PHE A 114 4.299 -0.046 -12.430 1.00 0.00 O ATOM 573 CB PHE A 114 2.370 -0.421 -9.680 1.00 0.00 C ATOM 574 CG PHE A 114 1.352 -1.305 -9.018 1.00 0.00 C ATOM 575 CD1 PHE A 114 0.200 -1.681 -9.691 1.00 0.00 C ATOM 576 CD2 PHE A 114 1.545 -1.759 -7.724 1.00 0.00 C ATOM 577 CE1 PHE A 114 -0.739 -2.493 -9.085 1.00 0.00 C ATOM 578 CE2 PHE A 114 0.609 -2.571 -7.112 1.00 0.00 C ATOM 579 CZ PHE A 114 -0.534 -2.940 -7.794 1.00 0.00 C ATOM 0 H PHE A 114 3.760 -2.237 -8.745 1.00 0.00 H new ATOM 0 HA PHE A 114 2.863 -1.758 -11.290 1.00 0.00 H new ATOM 0 HB2 PHE A 114 2.898 0.148 -8.915 1.00 0.00 H new ATOM 0 HB3 PHE A 114 1.855 0.300 -10.315 1.00 0.00 H new ATOM 0 HD1 PHE A 114 0.035 -1.335 -10.701 1.00 0.00 H new ATOM 0 HD2 PHE A 114 2.438 -1.475 -7.187 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -1.633 -2.778 -9.620 1.00 0.00 H new ATOM 0 HE2 PHE A 114 0.771 -2.917 -6.102 1.00 0.00 H new ATOM 0 HZ PHE A 114 -1.266 -3.577 -7.319 1.00 0.00 H new ATOM 589 N GLY A 115 5.190 0.432 -10.420 1.00 0.00 N ATOM 590 CA GLY A 115 6.136 1.385 -10.970 1.00 0.00 C ATOM 591 C GLY A 115 7.309 1.637 -10.043 1.00 0.00 C ATOM 592 O GLY A 115 7.269 1.276 -8.867 1.00 0.00 O ATOM 0 H GLY A 115 5.242 0.312 -9.408 1.00 0.00 H new ATOM 0 HA2 GLY A 115 6.505 1.015 -11.926 1.00 0.00 H new ATOM 0 HA3 GLY A 115 5.625 2.327 -11.169 1.00 0.00 H new ATOM 596 N SER A 116 8.358 2.257 -10.575 1.00 0.00 N ATOM 597 CA SER A 116 9.551 2.552 -9.789 1.00 0.00 C ATOM 598 C SER A 116 9.232 3.534 -8.665 1.00 0.00 C ATOM 599 O SER A 116 8.692 4.614 -8.905 1.00 0.00 O ATOM 600 CB SER A 116 10.649 3.126 -10.686 1.00 0.00 C ATOM 601 OG SER A 116 11.062 2.179 -11.656 1.00 0.00 O ATOM 0 H SER A 116 8.406 2.565 -11.546 1.00 0.00 H new ATOM 0 HA SER A 116 9.903 1.621 -9.346 1.00 0.00 H new ATOM 0 HB2 SER A 116 10.284 4.025 -11.183 1.00 0.00 H new ATOM 0 HB3 SER A 116 11.503 3.423 -10.077 1.00 0.00 H new ATOM 0 HG SER A 116 11.763 2.571 -12.218 1.00 0.00 H new ATOM 607 N ILE A 117 9.570 3.149 -7.439 1.00 0.00 N ATOM 608 CA ILE A 117 9.321 3.994 -6.278 1.00 0.00 C ATOM 609 C ILE A 117 10.463 4.981 -6.061 1.00 0.00 C ATOM 610 O ILE A 117 11.618 4.584 -5.900 1.00 0.00 O ATOM 611 CB ILE A 117 9.133 3.155 -5.000 1.00 0.00 C ATOM 612 CG1 ILE A 117 7.892 2.269 -5.124 1.00 0.00 C ATOM 613 CG2 ILE A 117 9.025 4.061 -3.783 1.00 0.00 C ATOM 614 CD1 ILE A 117 7.766 1.247 -4.015 1.00 0.00 C ATOM 0 H ILE A 117 10.017 2.258 -7.224 1.00 0.00 H new ATOM 0 HA ILE A 117 8.402 4.544 -6.480 1.00 0.00 H new ATOM 0 HB ILE A 117 10.004 2.512 -4.873 1.00 0.00 H new ATOM 0 HG12 ILE A 117 7.004 2.900 -5.128 1.00 0.00 H new ATOM 0 HG13 ILE A 117 7.919 1.751 -6.083 1.00 0.00 H new ATOM 0 HG21 ILE A 117 8.892 3.453 -2.888 1.00 0.00 H new ATOM 0 HG22 ILE A 117 9.935 4.653 -3.688 1.00 0.00 H new ATOM 0 HG23 ILE A 117 8.170 4.727 -3.900 1.00 0.00 H new ATOM 0 HD11 ILE A 117 6.864 0.654 -4.167 1.00 0.00 H new ATOM 0 HD12 ILE A 117 8.637 0.591 -4.024 1.00 0.00 H new ATOM 0 HD13 ILE A 117 7.707 1.758 -3.054 1.00 0.00 H new ATOM 626 N ARG A 118 10.133 6.268 -6.058 1.00 0.00 N ATOM 627 CA ARG A 118 11.132 7.312 -5.860 1.00 0.00 C ATOM 628 C ARG A 118 11.751 7.216 -4.469 1.00 0.00 C ATOM 629 O ARG A 118 12.962 7.043 -4.327 1.00 0.00 O ATOM 630 CB ARG A 118 10.502 8.693 -6.056 1.00 0.00 C ATOM 631 CG ARG A 118 11.521 9.806 -6.237 1.00 0.00 C ATOM 632 CD ARG A 118 10.856 11.174 -6.243 1.00 0.00 C ATOM 633 NE ARG A 118 11.737 12.209 -6.779 1.00 0.00 N ATOM 634 CZ ARG A 118 11.608 13.501 -6.499 1.00 0.00 C ATOM 635 NH1 ARG A 118 10.641 13.914 -5.692 1.00 0.00 N ATOM 636 NH2 ARG A 118 12.449 14.382 -7.025 1.00 0.00 N ATOM 0 H ARG A 118 9.182 6.613 -6.190 1.00 0.00 H new ATOM 0 HA ARG A 118 11.920 7.171 -6.599 1.00 0.00 H new ATOM 0 HB2 ARG A 118 9.848 8.665 -6.928 1.00 0.00 H new ATOM 0 HB3 ARG A 118 9.875 8.923 -5.195 1.00 0.00 H new ATOM 0 HG2 ARG A 118 12.257 9.761 -5.434 1.00 0.00 H new ATOM 0 HG3 ARG A 118 12.061 9.658 -7.172 1.00 0.00 H new ATOM 0 HD2 ARG A 118 9.944 11.131 -6.838 1.00 0.00 H new ATOM 0 HD3 ARG A 118 10.562 11.439 -5.227 1.00 0.00 H new ATOM 0 HE ARG A 118 12.492 11.924 -7.402 1.00 0.00 H new ATOM 0 HH11 ARG A 118 9.994 13.239 -5.284 1.00 0.00 H new ATOM 0 HH12 ARG A 118 10.544 14.907 -5.479 1.00 0.00 H new ATOM 0 HH21 ARG A 118 13.195 14.067 -7.645 1.00 0.00 H new ATOM 0 HH22 ARG A 118 12.349 15.374 -6.809 1.00 0.00 H new ATOM 650 N THR A 119 10.912 7.330 -3.444 1.00 0.00 N ATOM 651 CA THR A 119 11.376 7.258 -2.064 1.00 0.00 C ATOM 652 C THR A 119 10.239 6.884 -1.121 1.00 0.00 C ATOM 653 O THR A 119 9.067 7.099 -1.430 1.00 0.00 O ATOM 654 CB THR A 119 11.989 8.595 -1.607 1.00 0.00 C ATOM 655 OG1 THR A 119 12.511 8.466 -0.280 1.00 0.00 O ATOM 656 CG2 THR A 119 10.951 9.707 -1.643 1.00 0.00 C ATOM 0 H THR A 119 9.907 7.473 -3.544 1.00 0.00 H new ATOM 0 HA THR A 119 12.143 6.484 -2.028 1.00 0.00 H new ATOM 0 HB THR A 119 12.797 8.852 -2.292 1.00 0.00 H new ATOM 0 HG1 THR A 119 12.901 9.320 0.003 1.00 0.00 H new ATOM 0 HG21 THR A 119 11.407 10.641 -1.316 1.00 0.00 H new ATOM 0 HG22 THR A 119 10.577 9.822 -2.660 1.00 0.00 H new ATOM 0 HG23 THR A 119 10.125 9.455 -0.979 1.00 0.00 H new ATOM 664 N ILE A 120 10.593 6.325 0.032 1.00 0.00 N ATOM 665 CA ILE A 120 9.601 5.923 1.021 1.00 0.00 C ATOM 666 C ILE A 120 10.044 6.305 2.430 1.00 0.00 C ATOM 667 O ILE A 120 11.189 6.071 2.816 1.00 0.00 O ATOM 668 CB ILE A 120 9.338 4.407 0.971 1.00 0.00 C ATOM 669 CG1 ILE A 120 8.820 4.002 -0.411 1.00 0.00 C ATOM 670 CG2 ILE A 120 8.346 4.005 2.052 1.00 0.00 C ATOM 671 CD1 ILE A 120 8.906 2.516 -0.677 1.00 0.00 C ATOM 0 H ILE A 120 11.559 6.141 0.304 1.00 0.00 H new ATOM 0 HA ILE A 120 8.679 6.451 0.776 1.00 0.00 H new ATOM 0 HB ILE A 120 10.277 3.885 1.154 1.00 0.00 H new ATOM 0 HG12 ILE A 120 7.782 4.321 -0.509 1.00 0.00 H new ATOM 0 HG13 ILE A 120 9.390 4.533 -1.174 1.00 0.00 H new ATOM 0 HG21 ILE A 120 8.171 2.930 2.003 1.00 0.00 H new ATOM 0 HG22 ILE A 120 8.750 4.263 3.031 1.00 0.00 H new ATOM 0 HG23 ILE A 120 7.405 4.533 1.897 1.00 0.00 H new ATOM 0 HD11 ILE A 120 8.522 2.302 -1.674 1.00 0.00 H new ATOM 0 HD12 ILE A 120 9.945 2.194 -0.612 1.00 0.00 H new ATOM 0 HD13 ILE A 120 8.313 1.979 0.063 1.00 0.00 H new ATOM 683 N ASP A 121 9.128 6.891 3.193 1.00 0.00 N ATOM 684 CA ASP A 121 9.423 7.302 4.561 1.00 0.00 C ATOM 685 C ASP A 121 8.749 6.372 5.565 1.00 0.00 C ATOM 686 O ASP A 121 7.540 6.146 5.504 1.00 0.00 O ATOM 687 CB ASP A 121 8.964 8.743 4.793 1.00 0.00 C ATOM 688 CG ASP A 121 9.577 9.352 6.039 1.00 0.00 C ATOM 689 OD1 ASP A 121 9.466 8.734 7.118 1.00 0.00 O ATOM 690 OD2 ASP A 121 10.168 10.447 5.933 1.00 0.00 O ATOM 0 H ASP A 121 8.176 7.092 2.888 1.00 0.00 H new ATOM 0 HA ASP A 121 10.502 7.244 4.707 1.00 0.00 H new ATOM 0 HB2 ASP A 121 9.229 9.350 3.927 1.00 0.00 H new ATOM 0 HB3 ASP A 121 7.878 8.766 4.877 1.00 0.00 H new ATOM 695 N HIS A 122 9.540 5.835 6.489 1.00 0.00 N ATOM 696 CA HIS A 122 9.020 4.929 7.507 1.00 0.00 C ATOM 697 C HIS A 122 9.090 5.568 8.891 1.00 0.00 C ATOM 698 O HIS A 122 9.988 6.361 9.175 1.00 0.00 O ATOM 699 CB HIS A 122 9.802 3.615 7.498 1.00 0.00 C ATOM 700 CG HIS A 122 9.011 2.444 7.993 1.00 0.00 C ATOM 701 ND1 HIS A 122 8.537 1.451 7.161 1.00 0.00 N ATOM 702 CD2 HIS A 122 8.613 2.108 9.242 1.00 0.00 C ATOM 703 CE1 HIS A 122 7.880 0.556 7.878 1.00 0.00 C ATOM 704 NE2 HIS A 122 7.912 0.931 9.144 1.00 0.00 N ATOM 0 H HIS A 122 10.543 6.011 6.554 1.00 0.00 H new ATOM 0 HA HIS A 122 7.975 4.723 7.275 1.00 0.00 H new ATOM 0 HB2 HIS A 122 10.141 3.411 6.483 1.00 0.00 H new ATOM 0 HB3 HIS A 122 10.693 3.728 8.115 1.00 0.00 H new ATOM 0 HD2 HIS A 122 8.810 2.662 10.148 1.00 0.00 H new ATOM 0 HE1 HIS A 122 7.399 -0.331 7.494 1.00 0.00 H new ATOM 0 HE2 HIS A 122 7.485 0.428 9.922 1.00 0.00 H new ATOM 713 N VAL A 123 8.137 5.218 9.748 1.00 0.00 N ATOM 714 CA VAL A 123 8.091 5.757 11.102 1.00 0.00 C ATOM 715 C VAL A 123 7.738 4.672 12.114 1.00 0.00 C ATOM 716 O VAL A 123 7.044 3.708 11.791 1.00 0.00 O ATOM 717 CB VAL A 123 7.068 6.902 11.216 1.00 0.00 C ATOM 718 CG1 VAL A 123 6.820 7.253 12.675 1.00 0.00 C ATOM 719 CG2 VAL A 123 7.544 8.120 10.439 1.00 0.00 C ATOM 0 H VAL A 123 7.386 4.563 9.529 1.00 0.00 H new ATOM 0 HA VAL A 123 9.086 6.145 11.322 1.00 0.00 H new ATOM 0 HB VAL A 123 6.125 6.569 10.782 1.00 0.00 H new ATOM 0 HG11 VAL A 123 6.094 8.064 12.736 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.432 6.379 13.199 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.755 7.568 13.138 1.00 0.00 H new ATOM 0 HG21 VAL A 123 6.809 8.920 10.530 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.499 8.457 10.841 1.00 0.00 H new ATOM 0 HG23 VAL A 123 7.665 7.857 9.388 1.00 0.00 H new ATOM 729 N LYS A 124 8.221 4.836 13.341 1.00 0.00 N ATOM 730 CA LYS A 124 7.956 3.872 14.403 1.00 0.00 C ATOM 731 C LYS A 124 6.690 4.242 15.170 1.00 0.00 C ATOM 732 O LYS A 124 5.714 3.493 15.174 1.00 0.00 O ATOM 733 CB LYS A 124 9.145 3.801 15.363 1.00 0.00 C ATOM 734 CG LYS A 124 10.225 2.827 14.924 1.00 0.00 C ATOM 735 CD LYS A 124 11.185 2.510 16.058 1.00 0.00 C ATOM 736 CE LYS A 124 12.173 3.645 16.285 1.00 0.00 C ATOM 737 NZ LYS A 124 11.654 4.645 17.258 1.00 0.00 N ATOM 0 H LYS A 124 8.798 5.628 13.625 1.00 0.00 H new ATOM 0 HA LYS A 124 7.809 2.894 13.944 1.00 0.00 H new ATOM 0 HB2 LYS A 124 9.582 4.795 15.461 1.00 0.00 H new ATOM 0 HB3 LYS A 124 8.787 3.512 16.351 1.00 0.00 H new ATOM 0 HG2 LYS A 124 9.763 1.906 14.569 1.00 0.00 H new ATOM 0 HG3 LYS A 124 10.778 3.250 14.085 1.00 0.00 H new ATOM 0 HD2 LYS A 124 10.622 2.328 16.973 1.00 0.00 H new ATOM 0 HD3 LYS A 124 11.728 1.593 15.831 1.00 0.00 H new ATOM 0 HE2 LYS A 124 13.116 3.238 16.650 1.00 0.00 H new ATOM 0 HE3 LYS A 124 12.385 4.138 15.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 11.701 5.595 16.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 10.667 4.420 17.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 12.231 4.620 18.123 1.00 0.00 H new ATOM 751 N GLY A 125 6.714 5.403 15.817 1.00 0.00 N ATOM 752 CA GLY A 125 5.562 5.852 16.577 1.00 0.00 C ATOM 753 C GLY A 125 4.289 5.853 15.754 1.00 0.00 C ATOM 754 O GLY A 125 3.332 5.150 16.079 1.00 0.00 O ATOM 0 H GLY A 125 7.510 6.040 15.829 1.00 0.00 H new ATOM 0 HA2 GLY A 125 5.429 5.206 17.445 1.00 0.00 H new ATOM 0 HA3 GLY A 125 5.748 6.858 16.953 1.00 0.00 H new ATOM 758 N ASP A 126 4.277 6.644 14.688 1.00 0.00 N ATOM 759 CA ASP A 126 3.111 6.735 13.816 1.00 0.00 C ATOM 760 C ASP A 126 2.889 5.423 13.069 1.00 0.00 C ATOM 761 O ASP A 126 1.752 5.039 12.793 1.00 0.00 O ATOM 762 CB ASP A 126 3.280 7.882 12.819 1.00 0.00 C ATOM 763 CG ASP A 126 3.177 9.243 13.480 1.00 0.00 C ATOM 764 OD1 ASP A 126 2.418 9.369 14.463 1.00 0.00 O ATOM 765 OD2 ASP A 126 3.856 10.181 13.014 1.00 0.00 O ATOM 0 H ASP A 126 5.061 7.232 14.406 1.00 0.00 H new ATOM 0 HA ASP A 126 2.237 6.932 14.438 1.00 0.00 H new ATOM 0 HB2 ASP A 126 4.249 7.792 12.327 1.00 0.00 H new ATOM 0 HB3 ASP A 126 2.519 7.800 12.043 1.00 0.00 H new ATOM 770 N SER A 127 3.982 4.741 12.743 1.00 0.00 N ATOM 771 CA SER A 127 3.907 3.476 12.023 1.00 0.00 C ATOM 772 C SER A 127 3.207 3.656 10.679 1.00 0.00 C ATOM 773 O SER A 127 2.321 2.881 10.318 1.00 0.00 O ATOM 774 CB SER A 127 3.166 2.431 12.860 1.00 0.00 C ATOM 775 OG SER A 127 1.762 2.590 12.747 1.00 0.00 O ATOM 0 H SER A 127 4.930 5.044 12.966 1.00 0.00 H new ATOM 0 HA SER A 127 4.924 3.130 11.840 1.00 0.00 H new ATOM 0 HB2 SER A 127 3.449 1.431 12.533 1.00 0.00 H new ATOM 0 HB3 SER A 127 3.462 2.521 13.905 1.00 0.00 H new ATOM 0 HG SER A 127 1.504 3.471 13.091 1.00 0.00 H new ATOM 781 N PHE A 128 3.613 4.684 9.941 1.00 0.00 N ATOM 782 CA PHE A 128 3.026 4.968 8.637 1.00 0.00 C ATOM 783 C PHE A 128 4.052 4.775 7.524 1.00 0.00 C ATOM 784 O PHE A 128 5.240 4.589 7.787 1.00 0.00 O ATOM 785 CB PHE A 128 2.479 6.397 8.600 1.00 0.00 C ATOM 786 CG PHE A 128 3.538 7.438 8.369 1.00 0.00 C ATOM 787 CD1 PHE A 128 4.046 7.658 7.099 1.00 0.00 C ATOM 788 CD2 PHE A 128 4.025 8.195 9.423 1.00 0.00 C ATOM 789 CE1 PHE A 128 5.020 8.615 6.883 1.00 0.00 C ATOM 790 CE2 PHE A 128 4.998 9.154 9.213 1.00 0.00 C ATOM 791 CZ PHE A 128 5.497 9.363 7.942 1.00 0.00 C ATOM 0 H PHE A 128 4.346 5.334 10.224 1.00 0.00 H new ATOM 0 HA PHE A 128 2.206 4.268 8.476 1.00 0.00 H new ATOM 0 HB2 PHE A 128 1.730 6.471 7.811 1.00 0.00 H new ATOM 0 HB3 PHE A 128 1.972 6.608 9.542 1.00 0.00 H new ATOM 0 HD1 PHE A 128 3.677 7.075 6.268 1.00 0.00 H new ATOM 0 HD2 PHE A 128 3.640 8.034 10.419 1.00 0.00 H new ATOM 0 HE1 PHE A 128 5.407 8.778 5.888 1.00 0.00 H new ATOM 0 HE2 PHE A 128 5.368 9.739 10.042 1.00 0.00 H new ATOM 0 HZ PHE A 128 6.259 10.110 7.776 1.00 0.00 H new ATOM 801 N ALA A 129 3.584 4.821 6.281 1.00 0.00 N ATOM 802 CA ALA A 129 4.460 4.653 5.128 1.00 0.00 C ATOM 803 C ALA A 129 3.971 5.478 3.943 1.00 0.00 C ATOM 804 O ALA A 129 2.791 5.440 3.592 1.00 0.00 O ATOM 805 CB ALA A 129 4.556 3.183 4.748 1.00 0.00 C ATOM 0 H ALA A 129 2.603 4.973 6.047 1.00 0.00 H new ATOM 0 HA ALA A 129 5.453 5.011 5.401 1.00 0.00 H new ATOM 0 HB1 ALA A 129 5.213 3.072 3.886 1.00 0.00 H new ATOM 0 HB2 ALA A 129 4.959 2.616 5.587 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.564 2.806 4.499 1.00 0.00 H new ATOM 811 N TYR A 130 4.884 6.222 3.329 1.00 0.00 N ATOM 812 CA TYR A 130 4.545 7.059 2.184 1.00 0.00 C ATOM 813 C TYR A 130 5.192 6.526 0.909 1.00 0.00 C ATOM 814 O TYR A 130 6.414 6.396 0.829 1.00 0.00 O ATOM 815 CB TYR A 130 4.988 8.501 2.430 1.00 0.00 C ATOM 816 CG TYR A 130 3.939 9.349 3.114 1.00 0.00 C ATOM 817 CD1 TYR A 130 2.613 9.316 2.700 1.00 0.00 C ATOM 818 CD2 TYR A 130 4.274 10.182 4.174 1.00 0.00 C ATOM 819 CE1 TYR A 130 1.652 10.090 3.320 1.00 0.00 C ATOM 820 CE2 TYR A 130 3.319 10.958 4.802 1.00 0.00 C ATOM 821 CZ TYR A 130 2.009 10.909 4.371 1.00 0.00 C ATOM 822 OH TYR A 130 1.054 11.680 4.993 1.00 0.00 O ATOM 0 H TYR A 130 5.865 6.263 3.605 1.00 0.00 H new ATOM 0 HA TYR A 130 3.463 7.036 2.058 1.00 0.00 H new ATOM 0 HB2 TYR A 130 5.892 8.496 3.039 1.00 0.00 H new ATOM 0 HB3 TYR A 130 5.249 8.960 1.476 1.00 0.00 H new ATOM 0 HD1 TYR A 130 2.329 8.674 1.879 1.00 0.00 H new ATOM 0 HD2 TYR A 130 5.299 10.224 4.513 1.00 0.00 H new ATOM 0 HE1 TYR A 130 0.626 10.054 2.984 1.00 0.00 H new ATOM 0 HE2 TYR A 130 3.596 11.599 5.626 1.00 0.00 H new ATOM 0 HH TYR A 130 1.470 12.198 5.714 1.00 0.00 H new ATOM 832 N ILE A 131 4.365 6.220 -0.084 1.00 0.00 N ATOM 833 CA ILE A 131 4.856 5.704 -1.355 1.00 0.00 C ATOM 834 C ILE A 131 4.834 6.784 -2.432 1.00 0.00 C ATOM 835 O ILE A 131 3.835 7.479 -2.607 1.00 0.00 O ATOM 836 CB ILE A 131 4.022 4.501 -1.834 1.00 0.00 C ATOM 837 CG1 ILE A 131 3.851 3.488 -0.700 1.00 0.00 C ATOM 838 CG2 ILE A 131 4.679 3.848 -3.041 1.00 0.00 C ATOM 839 CD1 ILE A 131 5.152 2.862 -0.248 1.00 0.00 C ATOM 0 H ILE A 131 3.351 6.321 -0.033 1.00 0.00 H new ATOM 0 HA ILE A 131 5.883 5.381 -1.188 1.00 0.00 H new ATOM 0 HB ILE A 131 3.035 4.856 -2.130 1.00 0.00 H new ATOM 0 HG12 ILE A 131 3.380 3.982 0.150 1.00 0.00 H new ATOM 0 HG13 ILE A 131 3.172 2.700 -1.027 1.00 0.00 H new ATOM 0 HG21 ILE A 131 4.078 3.000 -3.368 1.00 0.00 H new ATOM 0 HG22 ILE A 131 4.754 4.573 -3.851 1.00 0.00 H new ATOM 0 HG23 ILE A 131 5.677 3.503 -2.770 1.00 0.00 H new ATOM 0 HD11 ILE A 131 4.955 2.155 0.558 1.00 0.00 H new ATOM 0 HD12 ILE A 131 5.614 2.339 -1.085 1.00 0.00 H new ATOM 0 HD13 ILE A 131 5.826 3.641 0.110 1.00 0.00 H new ATOM 851 N GLN A 132 5.944 6.916 -3.152 1.00 0.00 N ATOM 852 CA GLN A 132 6.052 7.910 -4.213 1.00 0.00 C ATOM 853 C GLN A 132 6.370 7.248 -5.549 1.00 0.00 C ATOM 854 O GLN A 132 7.428 6.639 -5.716 1.00 0.00 O ATOM 855 CB GLN A 132 7.131 8.938 -3.870 1.00 0.00 C ATOM 856 CG GLN A 132 7.012 10.232 -4.658 1.00 0.00 C ATOM 857 CD GLN A 132 6.031 11.206 -4.035 1.00 0.00 C ATOM 858 OE1 GLN A 132 5.746 11.139 -2.839 1.00 0.00 O ATOM 859 NE2 GLN A 132 5.509 12.120 -4.845 1.00 0.00 N ATOM 0 H GLN A 132 6.780 6.347 -3.020 1.00 0.00 H new ATOM 0 HA GLN A 132 5.091 8.418 -4.300 1.00 0.00 H new ATOM 0 HB2 GLN A 132 7.079 9.165 -2.805 1.00 0.00 H new ATOM 0 HB3 GLN A 132 8.111 8.499 -4.055 1.00 0.00 H new ATOM 0 HG2 GLN A 132 7.993 10.703 -4.726 1.00 0.00 H new ATOM 0 HG3 GLN A 132 6.696 10.005 -5.676 1.00 0.00 H new ATOM 0 HE21 GLN A 132 5.773 12.139 -5.830 1.00 0.00 H new ATOM 0 HE22 GLN A 132 4.844 12.803 -4.482 1.00 0.00 H new ATOM 868 N TYR A 133 5.449 7.370 -6.499 1.00 0.00 N ATOM 869 CA TYR A 133 5.630 6.780 -7.820 1.00 0.00 C ATOM 870 C TYR A 133 6.131 7.821 -8.817 1.00 0.00 C ATOM 871 O TYR A 133 5.699 8.973 -8.797 1.00 0.00 O ATOM 872 CB TYR A 133 4.317 6.174 -8.316 1.00 0.00 C ATOM 873 CG TYR A 133 4.057 4.780 -7.790 1.00 0.00 C ATOM 874 CD1 TYR A 133 4.810 3.699 -8.230 1.00 0.00 C ATOM 875 CD2 TYR A 133 3.057 4.545 -6.854 1.00 0.00 C ATOM 876 CE1 TYR A 133 4.576 2.424 -7.752 1.00 0.00 C ATOM 877 CE2 TYR A 133 2.817 3.273 -6.370 1.00 0.00 C ATOM 878 CZ TYR A 133 3.578 2.216 -6.822 1.00 0.00 C ATOM 879 OH TYR A 133 3.341 0.948 -6.344 1.00 0.00 O ATOM 0 H TYR A 133 4.569 7.872 -6.379 1.00 0.00 H new ATOM 0 HA TYR A 133 6.378 5.991 -7.738 1.00 0.00 H new ATOM 0 HB2 TYR A 133 3.493 6.824 -8.022 1.00 0.00 H new ATOM 0 HB3 TYR A 133 4.328 6.146 -9.406 1.00 0.00 H new ATOM 0 HD1 TYR A 133 5.592 3.858 -8.958 1.00 0.00 H new ATOM 0 HD2 TYR A 133 2.457 5.370 -6.499 1.00 0.00 H new ATOM 0 HE1 TYR A 133 5.171 1.594 -8.104 1.00 0.00 H new ATOM 0 HE2 TYR A 133 2.037 3.108 -5.641 1.00 0.00 H new ATOM 0 HH TYR A 133 3.835 0.297 -6.885 1.00 0.00 H new ATOM 889 N GLU A 134 7.045 7.405 -9.688 1.00 0.00 N ATOM 890 CA GLU A 134 7.605 8.301 -10.693 1.00 0.00 C ATOM 891 C GLU A 134 6.499 8.959 -11.513 1.00 0.00 C ATOM 892 O GLU A 134 6.623 10.109 -11.933 1.00 0.00 O ATOM 893 CB GLU A 134 8.555 7.537 -11.617 1.00 0.00 C ATOM 894 CG GLU A 134 9.994 7.516 -11.129 1.00 0.00 C ATOM 895 CD GLU A 134 10.768 8.752 -11.543 1.00 0.00 C ATOM 896 OE1 GLU A 134 10.396 9.371 -12.563 1.00 0.00 O ATOM 897 OE2 GLU A 134 11.745 9.101 -10.848 1.00 0.00 O ATOM 0 H GLU A 134 7.413 6.454 -9.718 1.00 0.00 H new ATOM 0 HA GLU A 134 8.163 9.082 -10.176 1.00 0.00 H new ATOM 0 HB2 GLU A 134 8.201 6.511 -11.721 1.00 0.00 H new ATOM 0 HB3 GLU A 134 8.523 7.987 -12.609 1.00 0.00 H new ATOM 0 HG2 GLU A 134 10.004 7.433 -10.042 1.00 0.00 H new ATOM 0 HG3 GLU A 134 10.494 6.630 -11.521 1.00 0.00 H new ATOM 904 N SER A 135 5.417 8.219 -11.736 1.00 0.00 N ATOM 905 CA SER A 135 4.290 8.727 -12.510 1.00 0.00 C ATOM 906 C SER A 135 3.015 8.732 -11.672 1.00 0.00 C ATOM 907 O SER A 135 2.937 8.073 -10.635 1.00 0.00 O ATOM 908 CB SER A 135 4.085 7.882 -13.768 1.00 0.00 C ATOM 909 OG SER A 135 3.194 6.808 -13.521 1.00 0.00 O ATOM 0 H SER A 135 5.297 7.266 -11.392 1.00 0.00 H new ATOM 0 HA SER A 135 4.515 9.752 -12.804 1.00 0.00 H new ATOM 0 HB2 SER A 135 3.692 8.507 -14.570 1.00 0.00 H new ATOM 0 HB3 SER A 135 5.044 7.492 -14.108 1.00 0.00 H new ATOM 0 HG SER A 135 3.078 6.284 -14.341 1.00 0.00 H new ATOM 915 N LEU A 136 2.017 9.479 -12.130 1.00 0.00 N ATOM 916 CA LEU A 136 0.743 9.571 -11.425 1.00 0.00 C ATOM 917 C LEU A 136 -0.072 8.294 -11.604 1.00 0.00 C ATOM 918 O LEU A 136 -0.609 7.747 -10.640 1.00 0.00 O ATOM 919 CB LEU A 136 -0.056 10.774 -11.928 1.00 0.00 C ATOM 920 CG LEU A 136 -1.168 11.274 -11.006 1.00 0.00 C ATOM 921 CD1 LEU A 136 -1.559 12.699 -11.366 1.00 0.00 C ATOM 922 CD2 LEU A 136 -2.377 10.353 -11.079 1.00 0.00 C ATOM 0 H LEU A 136 2.065 10.030 -12.987 1.00 0.00 H new ATOM 0 HA LEU A 136 0.953 9.701 -10.363 1.00 0.00 H new ATOM 0 HB2 LEU A 136 0.637 11.596 -12.107 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -0.498 10.515 -12.890 1.00 0.00 H new ATOM 0 HG LEU A 136 -0.794 11.269 -9.982 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -2.352 13.038 -10.699 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -0.692 13.352 -11.261 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -1.913 12.730 -12.396 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -3.158 10.725 -10.416 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -2.752 10.325 -12.102 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -2.088 9.348 -10.771 1.00 0.00 H new ATOM 934 N ASP A 137 -0.158 7.822 -12.843 1.00 0.00 N ATOM 935 CA ASP A 137 -0.904 6.607 -13.149 1.00 0.00 C ATOM 936 C ASP A 137 -0.429 5.445 -12.282 1.00 0.00 C ATOM 937 O ASP A 137 -1.229 4.783 -11.621 1.00 0.00 O ATOM 938 CB ASP A 137 -0.755 6.250 -14.628 1.00 0.00 C ATOM 939 CG ASP A 137 -1.676 5.121 -15.047 1.00 0.00 C ATOM 940 OD1 ASP A 137 -2.908 5.291 -14.941 1.00 0.00 O ATOM 941 OD2 ASP A 137 -1.165 4.067 -15.480 1.00 0.00 O ATOM 0 H ASP A 137 0.280 8.263 -13.652 1.00 0.00 H new ATOM 0 HA ASP A 137 -1.956 6.792 -12.933 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -0.966 7.131 -15.234 1.00 0.00 H new ATOM 0 HB3 ASP A 137 0.278 5.965 -14.828 1.00 0.00 H new ATOM 946 N ALA A 138 0.877 5.203 -12.290 1.00 0.00 N ATOM 947 CA ALA A 138 1.459 4.122 -11.504 1.00 0.00 C ATOM 948 C ALA A 138 0.947 4.150 -10.068 1.00 0.00 C ATOM 949 O ALA A 138 0.741 3.105 -9.452 1.00 0.00 O ATOM 950 CB ALA A 138 2.977 4.210 -11.527 1.00 0.00 C ATOM 0 H ALA A 138 1.553 5.741 -12.832 1.00 0.00 H new ATOM 0 HA ALA A 138 1.155 3.176 -11.952 1.00 0.00 H new ATOM 0 HB1 ALA A 138 3.398 3.396 -10.936 1.00 0.00 H new ATOM 0 HB2 ALA A 138 3.330 4.132 -12.555 1.00 0.00 H new ATOM 0 HB3 ALA A 138 3.293 5.165 -11.106 1.00 0.00 H new ATOM 956 N ALA A 139 0.743 5.353 -9.541 1.00 0.00 N ATOM 957 CA ALA A 139 0.254 5.517 -8.178 1.00 0.00 C ATOM 958 C ALA A 139 -1.219 5.136 -8.074 1.00 0.00 C ATOM 959 O ALA A 139 -1.638 4.500 -7.107 1.00 0.00 O ATOM 960 CB ALA A 139 0.465 6.949 -7.710 1.00 0.00 C ATOM 0 H ALA A 139 0.909 6.228 -10.038 1.00 0.00 H new ATOM 0 HA ALA A 139 0.822 4.848 -7.532 1.00 0.00 H new ATOM 0 HB1 ALA A 139 0.095 7.057 -6.690 1.00 0.00 H new ATOM 0 HB2 ALA A 139 1.528 7.188 -7.737 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -0.077 7.630 -8.366 1.00 0.00 H new ATOM 966 N GLN A 140 -2.000 5.530 -9.075 1.00 0.00 N ATOM 967 CA GLN A 140 -3.427 5.230 -9.094 1.00 0.00 C ATOM 968 C GLN A 140 -3.666 3.731 -9.237 1.00 0.00 C ATOM 969 O GLN A 140 -4.597 3.182 -8.648 1.00 0.00 O ATOM 970 CB GLN A 140 -4.111 5.980 -10.238 1.00 0.00 C ATOM 971 CG GLN A 140 -4.180 7.483 -10.026 1.00 0.00 C ATOM 972 CD GLN A 140 -4.562 8.234 -11.286 1.00 0.00 C ATOM 973 OE1 GLN A 140 -3.991 8.010 -12.353 1.00 0.00 O ATOM 974 NE2 GLN A 140 -5.534 9.132 -11.169 1.00 0.00 N ATOM 0 H GLN A 140 -1.669 6.057 -9.883 1.00 0.00 H new ATOM 0 HA GLN A 140 -3.855 5.558 -8.147 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -3.576 5.777 -11.166 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -5.122 5.592 -10.362 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -4.906 7.702 -9.243 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -3.213 7.841 -9.674 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -5.980 9.286 -10.265 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -5.834 9.668 -11.983 1.00 0.00 H new ATOM 983 N ALA A 141 -2.820 3.074 -10.024 1.00 0.00 N ATOM 984 CA ALA A 141 -2.939 1.638 -10.243 1.00 0.00 C ATOM 985 C ALA A 141 -2.759 0.867 -8.940 1.00 0.00 C ATOM 986 O ALA A 141 -3.582 0.021 -8.590 1.00 0.00 O ATOM 987 CB ALA A 141 -1.923 1.176 -11.277 1.00 0.00 C ATOM 0 H ALA A 141 -2.045 3.514 -10.520 1.00 0.00 H new ATOM 0 HA ALA A 141 -3.942 1.435 -10.619 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -2.023 0.102 -11.431 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -2.100 1.695 -12.219 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.917 1.400 -10.923 1.00 0.00 H new ATOM 993 N ALA A 142 -1.678 1.164 -8.227 1.00 0.00 N ATOM 994 CA ALA A 142 -1.391 0.500 -6.961 1.00 0.00 C ATOM 995 C ALA A 142 -2.369 0.939 -5.877 1.00 0.00 C ATOM 996 O ALA A 142 -2.975 0.107 -5.201 1.00 0.00 O ATOM 997 CB ALA A 142 0.040 0.781 -6.530 1.00 0.00 C ATOM 0 H ALA A 142 -0.986 1.860 -8.504 1.00 0.00 H new ATOM 0 HA ALA A 142 -1.510 -0.574 -7.107 1.00 0.00 H new ATOM 0 HB1 ALA A 142 0.240 0.279 -5.583 1.00 0.00 H new ATOM 0 HB2 ALA A 142 0.728 0.411 -7.290 1.00 0.00 H new ATOM 0 HB3 ALA A 142 0.179 1.855 -6.407 1.00 0.00 H new ATOM 1003 N CYS A 143 -2.517 2.249 -5.715 1.00 0.00 N ATOM 1004 CA CYS A 143 -3.420 2.799 -4.711 1.00 0.00 C ATOM 1005 C CYS A 143 -4.687 1.957 -4.600 1.00 0.00 C ATOM 1006 O CYS A 143 -5.149 1.654 -3.500 1.00 0.00 O ATOM 1007 CB CYS A 143 -3.783 4.244 -5.057 1.00 0.00 C ATOM 1008 SG CYS A 143 -4.785 5.074 -3.802 1.00 0.00 S ATOM 0 H CYS A 143 -2.023 2.950 -6.267 1.00 0.00 H new ATOM 0 HA CYS A 143 -2.908 2.781 -3.749 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -2.865 4.812 -5.207 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -4.323 4.255 -6.004 1.00 0.00 H new ATOM 0 HG CYS A 143 -4.999 6.305 -4.162 1.00 0.00 H new ATOM 1014 N ALA A 144 -5.245 1.582 -5.747 1.00 0.00 N ATOM 1015 CA ALA A 144 -6.458 0.775 -5.778 1.00 0.00 C ATOM 1016 C ALA A 144 -6.163 -0.674 -5.402 1.00 0.00 C ATOM 1017 O ALA A 144 -6.601 -1.156 -4.357 1.00 0.00 O ATOM 1018 CB ALA A 144 -7.102 0.844 -7.155 1.00 0.00 C ATOM 0 H ALA A 144 -4.876 1.824 -6.666 1.00 0.00 H new ATOM 0 HA ALA A 144 -7.153 1.180 -5.043 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -8.007 0.237 -7.164 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -7.357 1.878 -7.386 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -6.404 0.466 -7.902 1.00 0.00 H new ATOM 1024 N LYS A 145 -5.419 -1.363 -6.260 1.00 0.00 N ATOM 1025 CA LYS A 145 -5.065 -2.757 -6.019 1.00 0.00 C ATOM 1026 C LYS A 145 -4.642 -2.967 -4.568 1.00 0.00 C ATOM 1027 O LYS A 145 -5.243 -3.760 -3.845 1.00 0.00 O ATOM 1028 CB LYS A 145 -3.937 -3.188 -6.958 1.00 0.00 C ATOM 1029 CG LYS A 145 -4.428 -3.731 -8.289 1.00 0.00 C ATOM 1030 CD LYS A 145 -4.846 -2.611 -9.228 1.00 0.00 C ATOM 1031 CE LYS A 145 -5.557 -3.151 -10.459 1.00 0.00 C ATOM 1032 NZ LYS A 145 -6.127 -2.059 -11.295 1.00 0.00 N ATOM 0 H LYS A 145 -5.049 -0.979 -7.129 1.00 0.00 H new ATOM 0 HA LYS A 145 -5.945 -3.369 -6.215 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -3.283 -2.336 -7.142 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -3.335 -3.951 -6.464 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -3.640 -4.322 -8.755 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -5.272 -4.400 -8.121 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -5.503 -1.920 -8.701 1.00 0.00 H new ATOM 0 HD3 LYS A 145 -3.967 -2.044 -9.534 1.00 0.00 H new ATOM 0 HE2 LYS A 145 -4.857 -3.737 -11.055 1.00 0.00 H new ATOM 0 HE3 LYS A 145 -6.355 -3.826 -10.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -6.603 -2.469 -12.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -6.814 -1.515 -10.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -5.363 -1.429 -11.611 1.00 0.00 H new ATOM 1046 N MET A 146 -3.604 -2.250 -4.150 1.00 0.00 N ATOM 1047 CA MET A 146 -3.102 -2.357 -2.785 1.00 0.00 C ATOM 1048 C MET A 146 -4.245 -2.275 -1.778 1.00 0.00 C ATOM 1049 O MET A 146 -4.336 -3.092 -0.861 1.00 0.00 O ATOM 1050 CB MET A 146 -2.081 -1.252 -2.506 1.00 0.00 C ATOM 1051 CG MET A 146 -0.817 -1.367 -3.342 1.00 0.00 C ATOM 1052 SD MET A 146 -0.083 -3.013 -3.268 1.00 0.00 S ATOM 1053 CE MET A 146 0.347 -3.113 -1.532 1.00 0.00 C ATOM 0 H MET A 146 -3.094 -1.589 -4.736 1.00 0.00 H new ATOM 0 HA MET A 146 -2.615 -3.327 -2.678 1.00 0.00 H new ATOM 0 HB2 MET A 146 -2.545 -0.284 -2.695 1.00 0.00 H new ATOM 0 HB3 MET A 146 -1.812 -1.276 -1.450 1.00 0.00 H new ATOM 0 HG2 MET A 146 -1.048 -1.123 -4.379 1.00 0.00 H new ATOM 0 HG3 MET A 146 -0.089 -0.633 -2.996 1.00 0.00 H new ATOM 0 HE1 MET A 146 1.355 -3.516 -1.429 1.00 0.00 H new ATOM 0 HE2 MET A 146 0.308 -2.118 -1.089 1.00 0.00 H new ATOM 0 HE3 MET A 146 -0.359 -3.766 -1.019 1.00 0.00 H new ATOM 1063 N ARG A 147 -5.114 -1.285 -1.954 1.00 0.00 N ATOM 1064 CA ARG A 147 -6.249 -1.097 -1.060 1.00 0.00 C ATOM 1065 C ARG A 147 -6.845 -2.440 -0.647 1.00 0.00 C ATOM 1066 O ARG A 147 -7.497 -3.112 -1.445 1.00 0.00 O ATOM 1067 CB ARG A 147 -7.320 -0.237 -1.734 1.00 0.00 C ATOM 1068 CG ARG A 147 -8.155 0.574 -0.757 1.00 0.00 C ATOM 1069 CD ARG A 147 -9.141 1.476 -1.482 1.00 0.00 C ATOM 1070 NE ARG A 147 -10.403 0.796 -1.759 1.00 0.00 N ATOM 1071 CZ ARG A 147 -10.607 0.032 -2.827 1.00 0.00 C ATOM 1072 NH1 ARG A 147 -9.636 -0.149 -3.712 1.00 0.00 N ATOM 1073 NH2 ARG A 147 -11.784 -0.554 -3.010 1.00 0.00 N ATOM 0 H ARG A 147 -5.053 -0.601 -2.708 1.00 0.00 H new ATOM 0 HA ARG A 147 -5.893 -0.587 -0.165 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -6.839 0.442 -2.438 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -7.980 -0.882 -2.314 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -8.697 -0.100 -0.093 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -7.499 1.179 -0.131 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -9.332 2.363 -0.878 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -8.700 1.817 -2.419 1.00 0.00 H new ATOM 0 HE ARG A 147 -11.170 0.914 -1.097 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -8.730 0.299 -3.574 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -9.795 -0.736 -4.531 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -12.533 -0.418 -2.331 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -11.940 -1.140 -3.830 1.00 0.00 H new ATOM 1087 N GLY A 148 -6.615 -2.824 0.605 1.00 0.00 N ATOM 1088 CA GLY A 148 -7.135 -4.085 1.101 1.00 0.00 C ATOM 1089 C GLY A 148 -6.257 -5.262 0.725 1.00 0.00 C ATOM 1090 O GLY A 148 -6.751 -6.291 0.263 1.00 0.00 O ATOM 0 H GLY A 148 -6.078 -2.285 1.284 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -7.226 -4.035 2.186 1.00 0.00 H new ATOM 0 HA3 GLY A 148 -8.138 -4.242 0.704 1.00 0.00 H new ATOM 1094 N PHE A 149 -4.952 -5.111 0.920 1.00 0.00 N ATOM 1095 CA PHE A 149 -4.003 -6.170 0.595 1.00 0.00 C ATOM 1096 C PHE A 149 -4.135 -7.337 1.570 1.00 0.00 C ATOM 1097 O PHE A 149 -4.334 -7.156 2.771 1.00 0.00 O ATOM 1098 CB PHE A 149 -2.572 -5.628 0.623 1.00 0.00 C ATOM 1099 CG PHE A 149 -1.649 -6.322 -0.337 1.00 0.00 C ATOM 1100 CD1 PHE A 149 -1.646 -5.985 -1.681 1.00 0.00 C ATOM 1101 CD2 PHE A 149 -0.784 -7.310 0.104 1.00 0.00 C ATOM 1102 CE1 PHE A 149 -0.798 -6.623 -2.567 1.00 0.00 C ATOM 1103 CE2 PHE A 149 0.066 -7.951 -0.777 1.00 0.00 C ATOM 1104 CZ PHE A 149 0.060 -7.606 -2.114 1.00 0.00 C ATOM 0 H PHE A 149 -4.527 -4.266 1.301 1.00 0.00 H new ATOM 0 HA PHE A 149 -4.229 -6.530 -0.409 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -2.591 -4.563 0.391 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -2.174 -5.727 1.633 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -2.313 -5.216 -2.040 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -0.774 -7.583 1.149 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -0.806 -6.353 -3.613 1.00 0.00 H new ATOM 0 HE2 PHE A 149 0.734 -8.721 -0.420 1.00 0.00 H new ATOM 0 HZ PHE A 149 0.725 -8.104 -2.804 1.00 0.00 H new ATOM 1114 N PRO A 150 -4.023 -8.564 1.040 1.00 0.00 N ATOM 1115 CA PRO A 150 -4.128 -9.786 1.844 1.00 0.00 C ATOM 1116 C PRO A 150 -2.933 -9.971 2.774 1.00 0.00 C ATOM 1117 O PRO A 150 -2.811 -10.995 3.448 1.00 0.00 O ATOM 1118 CB PRO A 150 -4.166 -10.899 0.795 1.00 0.00 C ATOM 1119 CG PRO A 150 -3.473 -10.325 -0.392 1.00 0.00 C ATOM 1120 CD PRO A 150 -3.786 -8.854 -0.384 1.00 0.00 C ATOM 0 HA PRO A 150 -4.999 -9.770 2.499 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -3.662 -11.797 1.152 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -5.191 -11.183 0.556 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -2.398 -10.495 -0.336 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -3.823 -10.793 -1.312 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -2.960 -8.265 -0.782 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -4.662 -8.626 -0.992 1.00 0.00 H new ATOM 1128 N LEU A 151 -2.055 -8.975 2.807 1.00 0.00 N ATOM 1129 CA LEU A 151 -0.869 -9.028 3.655 1.00 0.00 C ATOM 1130 C LEU A 151 -1.163 -9.769 4.956 1.00 0.00 C ATOM 1131 O LEU A 151 -2.254 -9.657 5.513 1.00 0.00 O ATOM 1132 CB LEU A 151 -0.373 -7.614 3.961 1.00 0.00 C ATOM 1133 CG LEU A 151 0.981 -7.515 4.665 1.00 0.00 C ATOM 1134 CD1 LEU A 151 2.108 -7.865 3.705 1.00 0.00 C ATOM 1135 CD2 LEU A 151 1.182 -6.121 5.241 1.00 0.00 C ATOM 0 H LEU A 151 -2.142 -8.121 2.256 1.00 0.00 H new ATOM 0 HA LEU A 151 -0.092 -9.570 3.117 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -0.314 -7.061 3.024 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -1.119 -7.115 4.580 1.00 0.00 H new ATOM 0 HG LEU A 151 0.995 -8.231 5.487 1.00 0.00 H new ATOM 0 HD11 LEU A 151 3.064 -7.789 4.223 1.00 0.00 H new ATOM 0 HD12 LEU A 151 1.972 -8.883 3.341 1.00 0.00 H new ATOM 0 HD13 LEU A 151 2.096 -7.174 2.862 1.00 0.00 H new ATOM 0 HD21 LEU A 151 2.151 -6.069 5.738 1.00 0.00 H new ATOM 0 HD22 LEU A 151 1.147 -5.386 4.436 1.00 0.00 H new ATOM 0 HD23 LEU A 151 0.392 -5.908 5.962 1.00 0.00 H new ATOM 1147 N GLY A 152 -0.180 -10.525 5.435 1.00 0.00 N ATOM 1148 CA GLY A 152 -0.352 -11.272 6.668 1.00 0.00 C ATOM 1149 C GLY A 152 -1.402 -12.359 6.545 1.00 0.00 C ATOM 1150 O GLY A 152 -1.096 -13.486 6.158 1.00 0.00 O ATOM 0 H GLY A 152 0.732 -10.634 4.992 1.00 0.00 H new ATOM 0 HA2 GLY A 152 0.600 -11.721 6.953 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -0.634 -10.587 7.468 1.00 0.00 H new ATOM 1154 N GLY A 153 -2.643 -12.021 6.879 1.00 0.00 N ATOM 1155 CA GLY A 153 -3.722 -12.988 6.800 1.00 0.00 C ATOM 1156 C GLY A 153 -5.003 -12.385 6.258 1.00 0.00 C ATOM 1157 O GLY A 153 -5.032 -11.242 5.802 1.00 0.00 O ATOM 0 H GLY A 153 -2.921 -11.095 7.203 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -3.416 -13.817 6.162 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -3.909 -13.400 7.791 1.00 0.00 H new ATOM 1161 N PRO A 154 -6.094 -13.164 6.303 1.00 0.00 N ATOM 1162 CA PRO A 154 -7.404 -12.721 5.816 1.00 0.00 C ATOM 1163 C PRO A 154 -8.017 -11.642 6.702 1.00 0.00 C ATOM 1164 O PRO A 154 -9.068 -11.086 6.382 1.00 0.00 O ATOM 1165 CB PRO A 154 -8.249 -13.996 5.862 1.00 0.00 C ATOM 1166 CG PRO A 154 -7.604 -14.841 6.906 1.00 0.00 C ATOM 1167 CD PRO A 154 -6.133 -14.537 6.834 1.00 0.00 C ATOM 0 HA PRO A 154 -7.340 -12.272 4.825 1.00 0.00 H new ATOM 0 HB2 PRO A 154 -9.286 -13.775 6.116 1.00 0.00 H new ATOM 0 HB3 PRO A 154 -8.259 -14.500 4.895 1.00 0.00 H new ATOM 0 HG2 PRO A 154 -8.002 -14.612 7.894 1.00 0.00 H new ATOM 0 HG3 PRO A 154 -7.793 -15.899 6.724 1.00 0.00 H new ATOM 0 HD2 PRO A 154 -5.661 -14.602 7.814 1.00 0.00 H new ATOM 0 HD3 PRO A 154 -5.610 -15.235 6.181 1.00 0.00 H new ATOM 1175 N ASP A 155 -7.355 -11.351 7.816 1.00 0.00 N ATOM 1176 CA ASP A 155 -7.835 -10.338 8.748 1.00 0.00 C ATOM 1177 C ASP A 155 -7.071 -9.030 8.569 1.00 0.00 C ATOM 1178 O ASP A 155 -7.668 -7.956 8.493 1.00 0.00 O ATOM 1179 CB ASP A 155 -7.695 -10.831 10.189 1.00 0.00 C ATOM 1180 CG ASP A 155 -6.327 -10.536 10.772 1.00 0.00 C ATOM 1181 OD1 ASP A 155 -6.137 -9.422 11.302 1.00 0.00 O ATOM 1182 OD2 ASP A 155 -5.447 -11.418 10.697 1.00 0.00 O ATOM 0 H ASP A 155 -6.484 -11.802 8.096 1.00 0.00 H new ATOM 0 HA ASP A 155 -8.888 -10.155 8.536 1.00 0.00 H new ATOM 0 HB2 ASP A 155 -8.459 -10.360 10.807 1.00 0.00 H new ATOM 0 HB3 ASP A 155 -7.877 -11.905 10.222 1.00 0.00 H new ATOM 1187 N ARG A 156 -5.747 -9.128 8.503 1.00 0.00 N ATOM 1188 CA ARG A 156 -4.902 -7.952 8.336 1.00 0.00 C ATOM 1189 C ARG A 156 -4.983 -7.423 6.907 1.00 0.00 C ATOM 1190 O ARG A 156 -4.572 -8.095 5.961 1.00 0.00 O ATOM 1191 CB ARG A 156 -3.450 -8.288 8.684 1.00 0.00 C ATOM 1192 CG ARG A 156 -3.253 -8.705 10.133 1.00 0.00 C ATOM 1193 CD ARG A 156 -1.797 -9.035 10.424 1.00 0.00 C ATOM 1194 NE ARG A 156 -0.977 -7.832 10.544 1.00 0.00 N ATOM 1195 CZ ARG A 156 0.280 -7.840 10.974 1.00 0.00 C ATOM 1196 NH1 ARG A 156 0.858 -8.981 11.322 1.00 0.00 N ATOM 1197 NH2 ARG A 156 0.961 -6.704 11.055 1.00 0.00 N ATOM 0 H ARG A 156 -5.237 -10.009 8.563 1.00 0.00 H new ATOM 0 HA ARG A 156 -5.262 -7.178 9.013 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -3.106 -9.092 8.033 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -2.825 -7.420 8.476 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -3.584 -7.903 10.792 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -3.875 -9.573 10.351 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -1.733 -9.611 11.347 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -1.402 -9.665 9.627 1.00 0.00 H new ATOM 0 HE ARG A 156 -1.392 -6.937 10.284 1.00 0.00 H new ATOM 0 HH11 ARG A 156 0.338 -9.856 11.260 1.00 0.00 H new ATOM 0 HH12 ARG A 156 1.823 -8.984 11.652 1.00 0.00 H new ATOM 0 HH21 ARG A 156 0.519 -5.824 10.787 1.00 0.00 H new ATOM 0 HH22 ARG A 156 1.926 -6.710 11.385 1.00 0.00 H new ATOM 1211 N ARG A 157 -5.517 -6.215 6.759 1.00 0.00 N ATOM 1212 CA ARG A 157 -5.655 -5.596 5.446 1.00 0.00 C ATOM 1213 C ARG A 157 -4.889 -4.278 5.383 1.00 0.00 C ATOM 1214 O ARG A 157 -4.953 -3.466 6.308 1.00 0.00 O ATOM 1215 CB ARG A 157 -7.131 -5.357 5.123 1.00 0.00 C ATOM 1216 CG ARG A 157 -7.827 -4.431 6.107 1.00 0.00 C ATOM 1217 CD ARG A 157 -9.288 -4.224 5.739 1.00 0.00 C ATOM 1218 NE ARG A 157 -9.804 -2.953 6.240 1.00 0.00 N ATOM 1219 CZ ARG A 157 -11.092 -2.629 6.234 1.00 0.00 C ATOM 1220 NH1 ARG A 157 -11.990 -3.479 5.756 1.00 0.00 N ATOM 1221 NH2 ARG A 157 -11.484 -1.453 6.708 1.00 0.00 N ATOM 0 H ARG A 157 -5.861 -5.645 7.532 1.00 0.00 H new ATOM 0 HA ARG A 157 -5.234 -6.276 4.706 1.00 0.00 H new ATOM 0 HB2 ARG A 157 -7.211 -4.935 4.121 1.00 0.00 H new ATOM 0 HB3 ARG A 157 -7.651 -6.315 5.108 1.00 0.00 H new ATOM 0 HG2 ARG A 157 -7.759 -4.849 7.112 1.00 0.00 H new ATOM 0 HG3 ARG A 157 -7.316 -3.469 6.127 1.00 0.00 H new ATOM 0 HD2 ARG A 157 -9.397 -4.257 4.655 1.00 0.00 H new ATOM 0 HD3 ARG A 157 -9.883 -5.042 6.145 1.00 0.00 H new ATOM 0 HE ARG A 157 -9.139 -2.277 6.615 1.00 0.00 H new ATOM 0 HH11 ARG A 157 -11.692 -4.384 5.392 1.00 0.00 H new ATOM 0 HH12 ARG A 157 -12.979 -3.228 5.752 1.00 0.00 H new ATOM 0 HH21 ARG A 157 -10.796 -0.797 7.077 1.00 0.00 H new ATOM 0 HH22 ARG A 157 -12.473 -1.205 6.703 1.00 0.00 H new ATOM 1235 N LEU A 158 -4.166 -4.071 4.288 1.00 0.00 N ATOM 1236 CA LEU A 158 -3.387 -2.851 4.105 1.00 0.00 C ATOM 1237 C LEU A 158 -4.297 -1.665 3.804 1.00 0.00 C ATOM 1238 O LEU A 158 -5.191 -1.753 2.962 1.00 0.00 O ATOM 1239 CB LEU A 158 -2.376 -3.034 2.972 1.00 0.00 C ATOM 1240 CG LEU A 158 -1.165 -3.912 3.288 1.00 0.00 C ATOM 1241 CD1 LEU A 158 -0.181 -3.903 2.128 1.00 0.00 C ATOM 1242 CD2 LEU A 158 -0.487 -3.444 4.568 1.00 0.00 C ATOM 0 H LEU A 158 -4.103 -4.732 3.514 1.00 0.00 H new ATOM 0 HA LEU A 158 -2.851 -2.648 5.032 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -2.895 -3.461 2.114 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -2.017 -2.050 2.670 1.00 0.00 H new ATOM 0 HG LEU A 158 -1.511 -4.935 3.436 1.00 0.00 H new ATOM 0 HD11 LEU A 158 0.674 -4.533 2.371 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -0.671 -4.286 1.233 1.00 0.00 H new ATOM 0 HD13 LEU A 158 0.160 -2.883 1.948 1.00 0.00 H new ATOM 0 HD21 LEU A 158 0.373 -4.080 4.778 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -0.155 -2.413 4.448 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -1.193 -3.503 5.396 1.00 0.00 H new ATOM 1254 N ARG A 159 -4.062 -0.555 4.496 1.00 0.00 N ATOM 1255 CA ARG A 159 -4.859 0.650 4.301 1.00 0.00 C ATOM 1256 C ARG A 159 -4.164 1.614 3.344 1.00 0.00 C ATOM 1257 O ARG A 159 -3.147 2.218 3.684 1.00 0.00 O ATOM 1258 CB ARG A 159 -5.112 1.342 5.642 1.00 0.00 C ATOM 1259 CG ARG A 159 -6.423 2.110 5.694 1.00 0.00 C ATOM 1260 CD ARG A 159 -7.572 1.221 6.143 1.00 0.00 C ATOM 1261 NE ARG A 159 -8.767 1.995 6.470 1.00 0.00 N ATOM 1262 CZ ARG A 159 -9.573 2.523 5.557 1.00 0.00 C ATOM 1263 NH1 ARG A 159 -9.315 2.361 4.266 1.00 0.00 N ATOM 1264 NH2 ARG A 159 -10.642 3.214 5.933 1.00 0.00 N ATOM 0 H ARG A 159 -3.326 -0.465 5.197 1.00 0.00 H new ATOM 0 HA ARG A 159 -5.813 0.356 3.864 1.00 0.00 H new ATOM 0 HB2 ARG A 159 -5.108 0.593 6.434 1.00 0.00 H new ATOM 0 HB3 ARG A 159 -4.290 2.028 5.848 1.00 0.00 H new ATOM 0 HG2 ARG A 159 -6.325 2.953 6.378 1.00 0.00 H new ATOM 0 HG3 ARG A 159 -6.644 2.522 4.709 1.00 0.00 H new ATOM 0 HD2 ARG A 159 -7.807 0.507 5.354 1.00 0.00 H new ATOM 0 HD3 ARG A 159 -7.264 0.643 7.015 1.00 0.00 H new ATOM 0 HE ARG A 159 -8.995 2.138 7.454 1.00 0.00 H new ATOM 0 HH11 ARG A 159 -8.495 1.829 3.972 1.00 0.00 H new ATOM 0 HH12 ARG A 159 -9.936 2.768 3.567 1.00 0.00 H new ATOM 0 HH21 ARG A 159 -10.845 3.340 6.925 1.00 0.00 H new ATOM 0 HH22 ARG A 159 -11.260 3.619 5.230 1.00 0.00 H new ATOM 1278 N VAL A 160 -4.721 1.751 2.144 1.00 0.00 N ATOM 1279 CA VAL A 160 -4.155 2.641 1.137 1.00 0.00 C ATOM 1280 C VAL A 160 -5.135 3.750 0.771 1.00 0.00 C ATOM 1281 O VAL A 160 -6.256 3.484 0.337 1.00 0.00 O ATOM 1282 CB VAL A 160 -3.769 1.870 -0.140 1.00 0.00 C ATOM 1283 CG1 VAL A 160 -3.085 2.795 -1.135 1.00 0.00 C ATOM 1284 CG2 VAL A 160 -2.876 0.687 0.202 1.00 0.00 C ATOM 0 H VAL A 160 -5.563 1.258 1.846 1.00 0.00 H new ATOM 0 HA VAL A 160 -3.258 3.082 1.572 1.00 0.00 H new ATOM 0 HB VAL A 160 -4.679 1.487 -0.602 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -2.819 2.233 -2.031 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -3.762 3.606 -1.403 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -2.182 3.209 -0.686 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -2.613 0.154 -0.711 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -1.968 1.045 0.688 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -3.406 0.014 0.875 1.00 0.00 H new ATOM 1294 N ASP A 161 -4.705 4.994 0.949 1.00 0.00 N ATOM 1295 CA ASP A 161 -5.544 6.145 0.636 1.00 0.00 C ATOM 1296 C ASP A 161 -4.709 7.287 0.064 1.00 0.00 C ATOM 1297 O ASP A 161 -3.740 7.730 0.680 1.00 0.00 O ATOM 1298 CB ASP A 161 -6.287 6.617 1.887 1.00 0.00 C ATOM 1299 CG ASP A 161 -7.464 5.726 2.232 1.00 0.00 C ATOM 1300 OD1 ASP A 161 -7.269 4.752 2.989 1.00 0.00 O ATOM 1301 OD2 ASP A 161 -8.580 6.004 1.746 1.00 0.00 O ATOM 0 H ASP A 161 -3.780 5.231 1.308 1.00 0.00 H new ATOM 0 HA ASP A 161 -6.272 5.839 -0.116 1.00 0.00 H new ATOM 0 HB2 ASP A 161 -5.595 6.642 2.729 1.00 0.00 H new ATOM 0 HB3 ASP A 161 -6.640 7.637 1.733 1.00 0.00 H new ATOM 1306 N PHE A 162 -5.092 7.758 -1.119 1.00 0.00 N ATOM 1307 CA PHE A 162 -4.377 8.847 -1.775 1.00 0.00 C ATOM 1308 C PHE A 162 -3.955 9.908 -0.764 1.00 0.00 C ATOM 1309 O PHE A 162 -4.788 10.471 -0.054 1.00 0.00 O ATOM 1310 CB PHE A 162 -5.253 9.479 -2.859 1.00 0.00 C ATOM 1311 CG PHE A 162 -5.285 8.691 -4.138 1.00 0.00 C ATOM 1312 CD1 PHE A 162 -4.113 8.400 -4.818 1.00 0.00 C ATOM 1313 CD2 PHE A 162 -6.487 8.242 -4.660 1.00 0.00 C ATOM 1314 CE1 PHE A 162 -4.140 7.677 -5.995 1.00 0.00 C ATOM 1315 CE2 PHE A 162 -6.520 7.518 -5.837 1.00 0.00 C ATOM 1316 CZ PHE A 162 -5.345 7.234 -6.505 1.00 0.00 C ATOM 0 H PHE A 162 -5.892 7.403 -1.642 1.00 0.00 H new ATOM 0 HA PHE A 162 -3.480 8.434 -2.236 1.00 0.00 H new ATOM 0 HB2 PHE A 162 -6.270 9.582 -2.479 1.00 0.00 H new ATOM 0 HB3 PHE A 162 -4.888 10.484 -3.070 1.00 0.00 H new ATOM 0 HD1 PHE A 162 -3.168 8.742 -4.423 1.00 0.00 H new ATOM 0 HD2 PHE A 162 -7.409 8.460 -4.141 1.00 0.00 H new ATOM 0 HE1 PHE A 162 -3.220 7.458 -6.516 1.00 0.00 H new ATOM 0 HE2 PHE A 162 -7.464 7.175 -6.234 1.00 0.00 H new ATOM 0 HZ PHE A 162 -5.368 6.667 -7.424 1.00 0.00 H new ATOM 1326 N ALA A 163 -2.655 10.176 -0.704 1.00 0.00 N ATOM 1327 CA ALA A 163 -2.121 11.170 0.219 1.00 0.00 C ATOM 1328 C ALA A 163 -2.672 12.558 -0.091 1.00 0.00 C ATOM 1329 O ALA A 163 -3.409 12.743 -1.059 1.00 0.00 O ATOM 1330 CB ALA A 163 -0.601 11.179 0.164 1.00 0.00 C ATOM 0 H ALA A 163 -1.952 9.718 -1.284 1.00 0.00 H new ATOM 0 HA ALA A 163 -2.435 10.900 1.227 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -0.216 11.926 0.858 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -0.221 10.196 0.442 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -0.275 11.422 -0.847 1.00 0.00 H new