USER MOD reduce.3.24.130724 H: found=0, std=0, add=654, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 656 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 17 LYS NZ :NH3+ 180:sc= 0.68 (180deg=0.68) USER MOD Set 1.2: A 88 THR OG1 : rot 44:sc= -1.83! USER MOD Single : A 25 SER OG : rot -150:sc= -0.64 USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0403) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.205! USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= -2.38! C(o=-2.4!,f=-11!) USER MOD Single : A 60 GLN : amide:sc= -0.638 K(o=-0.64,f=-4.6!) USER MOD Single : A 62 ASN : amide:sc= -2.51! C(o=-2.5!,f=-2.9!) USER MOD Single : A 64 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= -0.386 K(o=-0.39,f=-2.4!) USER MOD Single : A 79 ASN : amide:sc=-0.00418 X(o=-0.0042,f=0) USER MOD Single : A 83 THR OG1 : rot 78:sc= 0.353 USER MOD Single : A 87 ASN : amide:sc= -0.101 X(o=-0.1,f=-0.45) USER MOD Single : A 89 LYS NZ :NH3+ -146:sc= 0.121 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD ----------------------------------------------------------------- ATOM 85 N GLU A 9 -10.591 4.256 7.282 1.00 0.00 N ATOM 86 CA GLU A 9 -9.961 4.812 8.468 1.00 0.00 C ATOM 87 C GLU A 9 -8.438 4.775 8.325 1.00 0.00 C ATOM 88 O GLU A 9 -7.836 3.702 8.322 1.00 0.00 O ATOM 89 CB GLU A 9 -10.411 4.069 9.727 1.00 0.00 C ATOM 90 CG GLU A 9 -9.652 2.751 9.888 1.00 0.00 C ATOM 91 CD GLU A 9 -10.386 1.807 10.843 1.00 0.00 C ATOM 92 OE1 GLU A 9 -11.412 1.243 10.406 1.00 0.00 O ATOM 93 OE2 GLU A 9 -9.905 1.672 11.988 1.00 0.00 O ATOM 0 HA GLU A 9 -10.273 5.852 8.569 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.246 4.697 10.602 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -11.482 3.872 9.674 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -9.537 2.273 8.915 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -8.649 2.949 10.266 1.00 0.00 H new ATOM 100 N LEU A 10 -7.857 5.961 8.210 1.00 0.00 N ATOM 101 CA LEU A 10 -6.416 6.078 8.067 1.00 0.00 C ATOM 102 C LEU A 10 -5.795 6.372 9.434 1.00 0.00 C ATOM 103 O LEU A 10 -5.970 7.462 9.978 1.00 0.00 O ATOM 104 CB LEU A 10 -6.066 7.114 6.997 1.00 0.00 C ATOM 105 CG LEU A 10 -6.785 6.961 5.655 1.00 0.00 C ATOM 106 CD1 LEU A 10 -6.985 5.485 5.305 1.00 0.00 C ATOM 107 CD2 LEU A 10 -8.105 7.734 5.649 1.00 0.00 C ATOM 0 H LEU A 10 -8.359 6.849 8.213 1.00 0.00 H new ATOM 0 HA LEU A 10 -5.990 5.137 7.718 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -6.286 8.105 7.394 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.992 7.073 6.818 1.00 0.00 H new ATOM 0 HG LEU A 10 -6.154 7.394 4.879 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -7.498 5.405 4.347 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -6.015 4.992 5.240 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -7.584 5.006 6.079 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -8.596 7.609 4.684 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -8.753 7.353 6.438 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -7.908 8.792 5.821 1.00 0.00 H new ATOM 119 N PHE A 11 -5.082 5.382 9.950 1.00 0.00 N ATOM 120 CA PHE A 11 -4.434 5.521 11.243 1.00 0.00 C ATOM 121 C PHE A 11 -2.933 5.244 11.136 1.00 0.00 C ATOM 122 O PHE A 11 -2.520 4.272 10.506 1.00 0.00 O ATOM 123 CB PHE A 11 -5.066 4.485 12.174 1.00 0.00 C ATOM 124 CG PHE A 11 -5.168 3.084 11.568 1.00 0.00 C ATOM 125 CD1 PHE A 11 -6.139 2.806 10.657 1.00 0.00 C ATOM 126 CD2 PHE A 11 -4.288 2.116 11.941 1.00 0.00 C ATOM 127 CE1 PHE A 11 -6.234 1.505 10.095 1.00 0.00 C ATOM 128 CE2 PHE A 11 -4.383 0.816 11.379 1.00 0.00 C ATOM 129 CZ PHE A 11 -5.354 0.538 10.468 1.00 0.00 C ATOM 0 H PHE A 11 -4.939 4.480 9.496 1.00 0.00 H new ATOM 0 HA PHE A 11 -4.564 6.537 11.617 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -4.480 4.431 13.092 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -6.064 4.823 12.452 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -6.838 3.574 10.361 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -3.517 2.337 12.665 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -7.005 1.284 9.372 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -3.684 0.048 11.675 1.00 0.00 H new ATOM 0 HZ PHE A 11 -5.426 -0.451 10.041 1.00 0.00 H new ATOM 139 N PRO A 12 -2.136 6.140 11.779 1.00 0.00 N ATOM 140 CA PRO A 12 -0.690 6.002 11.762 1.00 0.00 C ATOM 141 C PRO A 12 -0.235 4.878 12.695 1.00 0.00 C ATOM 142 O PRO A 12 -0.525 4.902 13.890 1.00 0.00 O ATOM 143 CB PRO A 12 -0.160 7.366 12.175 1.00 0.00 C ATOM 144 CG PRO A 12 -1.320 8.076 12.853 1.00 0.00 C ATOM 145 CD PRO A 12 -2.590 7.304 12.535 1.00 0.00 C ATOM 0 HA PRO A 12 -0.306 5.719 10.782 1.00 0.00 H new ATOM 0 HB2 PRO A 12 0.687 7.267 12.853 1.00 0.00 H new ATOM 0 HB3 PRO A 12 0.189 7.928 11.309 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -1.162 8.123 13.930 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -1.399 9.103 12.498 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -3.111 7.007 13.445 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -3.285 7.908 11.952 1.00 0.00 H new ATOM 153 N VAL A 13 0.469 3.918 12.113 1.00 0.00 N ATOM 154 CA VAL A 13 0.966 2.786 12.877 1.00 0.00 C ATOM 155 C VAL A 13 2.491 2.866 12.964 1.00 0.00 C ATOM 156 O VAL A 13 3.173 2.918 11.942 1.00 0.00 O ATOM 157 CB VAL A 13 0.470 1.478 12.257 1.00 0.00 C ATOM 158 CG1 VAL A 13 1.175 0.273 12.882 1.00 0.00 C ATOM 159 CG2 VAL A 13 -1.050 1.352 12.386 1.00 0.00 C ATOM 0 H VAL A 13 0.707 3.901 11.121 1.00 0.00 H new ATOM 0 HA VAL A 13 0.580 2.814 13.896 1.00 0.00 H new ATOM 0 HB VAL A 13 0.716 1.496 11.195 1.00 0.00 H new ATOM 0 HG11 VAL A 13 0.804 -0.644 12.424 1.00 0.00 H new ATOM 0 HG12 VAL A 13 2.249 0.353 12.715 1.00 0.00 H new ATOM 0 HG13 VAL A 13 0.975 0.250 13.953 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -1.377 0.414 11.938 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -1.328 1.367 13.440 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.529 2.186 11.873 1.00 0.00 H new ATOM 169 N GLU A 14 2.982 2.872 14.195 1.00 0.00 N ATOM 170 CA GLU A 14 4.414 2.945 14.429 1.00 0.00 C ATOM 171 C GLU A 14 5.032 1.546 14.372 1.00 0.00 C ATOM 172 O GLU A 14 4.492 0.601 14.944 1.00 0.00 O ATOM 173 CB GLU A 14 4.718 3.625 15.765 1.00 0.00 C ATOM 174 CG GLU A 14 4.450 5.129 15.687 1.00 0.00 C ATOM 175 CD GLU A 14 3.631 5.603 16.890 1.00 0.00 C ATOM 176 OE1 GLU A 14 4.036 5.261 18.022 1.00 0.00 O ATOM 177 OE2 GLU A 14 2.620 6.297 16.650 1.00 0.00 O ATOM 0 H GLU A 14 2.413 2.827 15.041 1.00 0.00 H new ATOM 0 HA GLU A 14 4.861 3.551 13.641 1.00 0.00 H new ATOM 0 HB2 GLU A 14 4.105 3.183 16.550 1.00 0.00 H new ATOM 0 HB3 GLU A 14 5.759 3.451 16.037 1.00 0.00 H new ATOM 0 HG2 GLU A 14 5.396 5.669 15.651 1.00 0.00 H new ATOM 0 HG3 GLU A 14 3.916 5.360 14.765 1.00 0.00 H new ATOM 184 N LEU A 15 6.157 1.459 13.678 1.00 0.00 N ATOM 185 CA LEU A 15 6.855 0.192 13.539 1.00 0.00 C ATOM 186 C LEU A 15 8.351 0.409 13.776 1.00 0.00 C ATOM 187 O LEU A 15 8.896 1.450 13.411 1.00 0.00 O ATOM 188 CB LEU A 15 6.533 -0.452 12.189 1.00 0.00 C ATOM 189 CG LEU A 15 5.653 -1.703 12.236 1.00 0.00 C ATOM 190 CD1 LEU A 15 5.365 -2.223 10.826 1.00 0.00 C ATOM 191 CD2 LEU A 15 6.276 -2.779 13.128 1.00 0.00 C ATOM 0 H LEU A 15 6.603 2.245 13.206 1.00 0.00 H new ATOM 0 HA LEU A 15 6.512 -0.516 14.294 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.040 0.291 11.562 1.00 0.00 H new ATOM 0 HB3 LEU A 15 7.472 -0.710 11.699 1.00 0.00 H new ATOM 0 HG LEU A 15 4.696 -1.431 12.681 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.738 -3.112 10.887 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.848 -1.453 10.253 1.00 0.00 H new ATOM 0 HD13 LEU A 15 6.304 -2.474 10.332 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.630 -3.657 13.144 1.00 0.00 H new ATOM 0 HD22 LEU A 15 7.255 -3.055 12.736 1.00 0.00 H new ATOM 0 HD23 LEU A 15 6.387 -2.392 14.141 1.00 0.00 H new ATOM 203 N GLU A 16 8.973 -0.589 14.385 1.00 0.00 N ATOM 204 CA GLU A 16 10.395 -0.520 14.675 1.00 0.00 C ATOM 205 C GLU A 16 11.160 -1.534 13.821 1.00 0.00 C ATOM 206 O GLU A 16 11.117 -2.734 14.088 1.00 0.00 O ATOM 207 CB GLU A 16 10.662 -0.745 16.164 1.00 0.00 C ATOM 208 CG GLU A 16 11.218 0.522 16.818 1.00 0.00 C ATOM 209 CD GLU A 16 12.048 0.181 18.057 1.00 0.00 C ATOM 210 OE1 GLU A 16 11.422 -0.044 19.116 1.00 0.00 O ATOM 211 OE2 GLU A 16 13.290 0.152 17.918 1.00 0.00 O ATOM 0 H GLU A 16 8.518 -1.451 14.686 1.00 0.00 H new ATOM 0 HA GLU A 16 10.750 0.479 14.423 1.00 0.00 H new ATOM 0 HB2 GLU A 16 9.739 -1.041 16.662 1.00 0.00 H new ATOM 0 HB3 GLU A 16 11.369 -1.565 16.291 1.00 0.00 H new ATOM 0 HG2 GLU A 16 11.834 1.065 16.101 1.00 0.00 H new ATOM 0 HG3 GLU A 16 10.397 1.182 17.097 1.00 0.00 H new ATOM 218 N LYS A 17 11.843 -1.013 12.813 1.00 0.00 N ATOM 219 CA LYS A 17 12.617 -1.858 11.918 1.00 0.00 C ATOM 220 C LYS A 17 13.284 -2.973 12.727 1.00 0.00 C ATOM 221 O LYS A 17 13.501 -2.828 13.929 1.00 0.00 O ATOM 222 CB LYS A 17 13.602 -1.015 11.104 1.00 0.00 C ATOM 223 CG LYS A 17 13.036 -0.697 9.719 1.00 0.00 C ATOM 224 CD LYS A 17 14.118 -0.118 8.805 1.00 0.00 C ATOM 225 CE LYS A 17 13.681 -0.168 7.339 1.00 0.00 C ATOM 226 NZ LYS A 17 14.678 0.508 6.479 1.00 0.00 N ATOM 0 H LYS A 17 11.877 -0.017 12.596 1.00 0.00 H new ATOM 0 HA LYS A 17 11.965 -2.339 11.188 1.00 0.00 H new ATOM 0 HB2 LYS A 17 13.818 -0.088 11.635 1.00 0.00 H new ATOM 0 HB3 LYS A 17 14.546 -1.550 11.001 1.00 0.00 H new ATOM 0 HG2 LYS A 17 12.625 -1.603 9.273 1.00 0.00 H new ATOM 0 HG3 LYS A 17 12.215 0.014 9.812 1.00 0.00 H new ATOM 0 HD2 LYS A 17 14.327 0.913 9.091 1.00 0.00 H new ATOM 0 HD3 LYS A 17 15.044 -0.678 8.932 1.00 0.00 H new ATOM 0 HE2 LYS A 17 13.563 -1.205 7.024 1.00 0.00 H new ATOM 0 HE3 LYS A 17 12.709 0.312 7.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 14.367 0.465 5.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 14.771 1.502 6.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 15.598 0.032 6.574 1.00 0.00 H new ATOM 240 N ASP A 18 13.590 -4.060 12.034 1.00 0.00 N ATOM 241 CA ASP A 18 14.227 -5.199 12.672 1.00 0.00 C ATOM 242 C ASP A 18 15.540 -5.514 11.952 1.00 0.00 C ATOM 243 O ASP A 18 15.879 -4.867 10.962 1.00 0.00 O ATOM 244 CB ASP A 18 13.337 -6.441 12.598 1.00 0.00 C ATOM 245 CG ASP A 18 11.901 -6.239 13.085 1.00 0.00 C ATOM 246 OD1 ASP A 18 11.716 -5.362 13.956 1.00 0.00 O ATOM 247 OD2 ASP A 18 11.021 -6.965 12.575 1.00 0.00 O ATOM 0 H ASP A 18 13.409 -4.176 11.037 1.00 0.00 H new ATOM 0 HA ASP A 18 14.404 -4.944 13.717 1.00 0.00 H new ATOM 0 HB2 ASP A 18 13.309 -6.788 11.565 1.00 0.00 H new ATOM 0 HB3 ASP A 18 13.796 -7.234 13.188 1.00 0.00 H new ATOM 252 N GLU A 19 16.242 -6.507 12.476 1.00 0.00 N ATOM 253 CA GLU A 19 17.510 -6.915 11.896 1.00 0.00 C ATOM 254 C GLU A 19 17.375 -7.067 10.379 1.00 0.00 C ATOM 255 O GLU A 19 18.363 -6.977 9.652 1.00 0.00 O ATOM 256 CB GLU A 19 18.014 -8.211 12.534 1.00 0.00 C ATOM 257 CG GLU A 19 17.391 -9.433 11.858 1.00 0.00 C ATOM 258 CD GLU A 19 15.869 -9.427 12.008 1.00 0.00 C ATOM 259 OE1 GLU A 19 15.410 -9.102 13.124 1.00 0.00 O ATOM 260 OE2 GLU A 19 15.198 -9.748 11.003 1.00 0.00 O ATOM 0 H GLU A 19 15.957 -7.042 13.297 1.00 0.00 H new ATOM 0 HA GLU A 19 18.247 -6.138 12.100 1.00 0.00 H new ATOM 0 HB2 GLU A 19 19.100 -8.261 12.455 1.00 0.00 H new ATOM 0 HB3 GLU A 19 17.771 -8.216 13.597 1.00 0.00 H new ATOM 0 HG2 GLU A 19 17.656 -9.442 10.801 1.00 0.00 H new ATOM 0 HG3 GLU A 19 17.799 -10.343 12.297 1.00 0.00 H new ATOM 267 N ASP A 20 16.143 -7.295 9.947 1.00 0.00 N ATOM 268 CA ASP A 20 15.866 -7.461 8.531 1.00 0.00 C ATOM 269 C ASP A 20 15.270 -6.165 7.977 1.00 0.00 C ATOM 270 O ASP A 20 15.370 -5.893 6.782 1.00 0.00 O ATOM 271 CB ASP A 20 14.854 -8.585 8.295 1.00 0.00 C ATOM 272 CG ASP A 20 14.244 -8.622 6.893 1.00 0.00 C ATOM 273 OD1 ASP A 20 14.995 -8.322 5.939 1.00 0.00 O ATOM 274 OD2 ASP A 20 13.041 -8.951 6.806 1.00 0.00 O ATOM 0 H ASP A 20 15.326 -7.369 10.553 1.00 0.00 H new ATOM 0 HA ASP A 20 16.803 -7.708 8.031 1.00 0.00 H new ATOM 0 HB2 ASP A 20 15.343 -9.540 8.487 1.00 0.00 H new ATOM 0 HB3 ASP A 20 14.049 -8.487 9.023 1.00 0.00 H new ATOM 279 N GLY A 21 14.663 -5.401 8.873 1.00 0.00 N ATOM 280 CA GLY A 21 14.051 -4.140 8.489 1.00 0.00 C ATOM 281 C GLY A 21 12.572 -4.106 8.880 1.00 0.00 C ATOM 282 O GLY A 21 12.211 -4.503 9.987 1.00 0.00 O ATOM 0 H GLY A 21 14.582 -5.631 9.863 1.00 0.00 H new ATOM 0 HA2 GLY A 21 14.577 -3.315 8.970 1.00 0.00 H new ATOM 0 HA3 GLY A 21 14.150 -3.997 7.413 1.00 0.00 H new ATOM 286 N LEU A 22 11.758 -3.630 7.951 1.00 0.00 N ATOM 287 CA LEU A 22 10.326 -3.539 8.185 1.00 0.00 C ATOM 288 C LEU A 22 9.781 -4.928 8.525 1.00 0.00 C ATOM 289 O LEU A 22 9.155 -5.114 9.568 1.00 0.00 O ATOM 290 CB LEU A 22 9.629 -2.880 6.993 1.00 0.00 C ATOM 291 CG LEU A 22 10.146 -1.496 6.596 1.00 0.00 C ATOM 292 CD1 LEU A 22 9.532 -1.042 5.270 1.00 0.00 C ATOM 293 CD2 LEU A 22 9.908 -0.480 7.715 1.00 0.00 C ATOM 0 H LEU A 22 12.062 -3.303 7.034 1.00 0.00 H new ATOM 0 HA LEU A 22 10.119 -2.896 9.041 1.00 0.00 H new ATOM 0 HB2 LEU A 22 9.722 -3.542 6.132 1.00 0.00 H new ATOM 0 HB3 LEU A 22 8.566 -2.798 7.219 1.00 0.00 H new ATOM 0 HG LEU A 22 11.224 -1.564 6.446 1.00 0.00 H new ATOM 0 HD11 LEU A 22 9.916 -0.055 5.010 1.00 0.00 H new ATOM 0 HD12 LEU A 22 9.795 -1.752 4.485 1.00 0.00 H new ATOM 0 HD13 LEU A 22 8.447 -0.995 5.368 1.00 0.00 H new ATOM 0 HD21 LEU A 22 10.285 0.495 7.407 1.00 0.00 H new ATOM 0 HD22 LEU A 22 8.840 -0.408 7.920 1.00 0.00 H new ATOM 0 HD23 LEU A 22 10.430 -0.802 8.616 1.00 0.00 H new ATOM 305 N GLY A 23 10.038 -5.866 7.626 1.00 0.00 N ATOM 306 CA GLY A 23 9.581 -7.232 7.819 1.00 0.00 C ATOM 307 C GLY A 23 8.117 -7.384 7.402 1.00 0.00 C ATOM 308 O GLY A 23 7.302 -7.906 8.162 1.00 0.00 O ATOM 0 H GLY A 23 10.557 -5.708 6.762 1.00 0.00 H new ATOM 0 HA2 GLY A 23 10.201 -7.913 7.236 1.00 0.00 H new ATOM 0 HA3 GLY A 23 9.696 -7.513 8.866 1.00 0.00 H new ATOM 312 N ILE A 24 7.826 -6.917 6.196 1.00 0.00 N ATOM 313 CA ILE A 24 6.474 -6.994 5.670 1.00 0.00 C ATOM 314 C ILE A 24 6.529 -7.036 4.141 1.00 0.00 C ATOM 315 O ILE A 24 7.505 -6.593 3.539 1.00 0.00 O ATOM 316 CB ILE A 24 5.618 -5.854 6.223 1.00 0.00 C ATOM 317 CG1 ILE A 24 6.430 -4.562 6.335 1.00 0.00 C ATOM 318 CG2 ILE A 24 4.978 -6.246 7.557 1.00 0.00 C ATOM 319 CD1 ILE A 24 5.526 -3.373 6.665 1.00 0.00 C ATOM 0 H ILE A 24 8.504 -6.484 5.569 1.00 0.00 H new ATOM 0 HA ILE A 24 5.989 -7.913 5.998 1.00 0.00 H new ATOM 0 HB ILE A 24 4.807 -5.664 5.520 1.00 0.00 H new ATOM 0 HG12 ILE A 24 7.190 -4.672 7.109 1.00 0.00 H new ATOM 0 HG13 ILE A 24 6.954 -4.376 5.398 1.00 0.00 H new ATOM 0 HG21 ILE A 24 4.375 -5.418 7.928 1.00 0.00 H new ATOM 0 HG22 ILE A 24 4.344 -7.121 7.413 1.00 0.00 H new ATOM 0 HG23 ILE A 24 5.759 -6.479 8.281 1.00 0.00 H new ATOM 0 HD11 ILE A 24 6.128 -2.468 6.739 1.00 0.00 H new ATOM 0 HD12 ILE A 24 4.783 -3.251 5.877 1.00 0.00 H new ATOM 0 HD13 ILE A 24 5.022 -3.552 7.615 1.00 0.00 H new ATOM 331 N SER A 25 5.468 -7.574 3.558 1.00 0.00 N ATOM 332 CA SER A 25 5.382 -7.679 2.111 1.00 0.00 C ATOM 333 C SER A 25 4.321 -6.715 1.578 1.00 0.00 C ATOM 334 O SER A 25 3.288 -6.509 2.213 1.00 0.00 O ATOM 335 CB SER A 25 5.061 -9.112 1.681 1.00 0.00 C ATOM 336 OG SER A 25 5.872 -10.068 2.360 1.00 0.00 O ATOM 0 H SER A 25 4.661 -7.942 4.061 1.00 0.00 H new ATOM 0 HA SER A 25 6.351 -7.410 1.691 1.00 0.00 H new ATOM 0 HB2 SER A 25 4.010 -9.323 1.878 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.209 -9.210 0.606 1.00 0.00 H new ATOM 0 HG SER A 25 6.008 -10.849 1.784 1.00 0.00 H new ATOM 342 N ILE A 26 4.612 -6.148 0.416 1.00 0.00 N ATOM 343 CA ILE A 26 3.696 -5.210 -0.210 1.00 0.00 C ATOM 344 C ILE A 26 3.312 -5.729 -1.597 1.00 0.00 C ATOM 345 O ILE A 26 4.007 -6.569 -2.165 1.00 0.00 O ATOM 346 CB ILE A 26 4.297 -3.803 -0.224 1.00 0.00 C ATOM 347 CG1 ILE A 26 5.627 -3.782 -0.979 1.00 0.00 C ATOM 348 CG2 ILE A 26 4.435 -3.252 1.196 1.00 0.00 C ATOM 349 CD1 ILE A 26 5.682 -2.612 -1.963 1.00 0.00 C ATOM 0 H ILE A 26 5.470 -6.320 -0.108 1.00 0.00 H new ATOM 0 HA ILE A 26 2.775 -5.132 0.368 1.00 0.00 H new ATOM 0 HB ILE A 26 3.613 -3.145 -0.760 1.00 0.00 H new ATOM 0 HG12 ILE A 26 6.451 -3.704 -0.269 1.00 0.00 H new ATOM 0 HG13 ILE A 26 5.758 -4.721 -1.517 1.00 0.00 H new ATOM 0 HG21 ILE A 26 4.865 -2.251 1.158 1.00 0.00 H new ATOM 0 HG22 ILE A 26 3.453 -3.208 1.666 1.00 0.00 H new ATOM 0 HG23 ILE A 26 5.086 -3.904 1.778 1.00 0.00 H new ATOM 0 HD11 ILE A 26 6.638 -2.621 -2.486 1.00 0.00 H new ATOM 0 HD12 ILE A 26 4.872 -2.706 -2.686 1.00 0.00 H new ATOM 0 HD13 ILE A 26 5.575 -1.674 -1.419 1.00 0.00 H new ATOM 361 N ILE A 27 2.205 -5.205 -2.103 1.00 0.00 N ATOM 362 CA ILE A 27 1.719 -5.604 -3.414 1.00 0.00 C ATOM 363 C ILE A 27 1.226 -4.368 -4.168 1.00 0.00 C ATOM 364 O ILE A 27 0.625 -3.474 -3.576 1.00 0.00 O ATOM 365 CB ILE A 27 0.665 -6.705 -3.281 1.00 0.00 C ATOM 366 CG1 ILE A 27 -0.242 -6.747 -4.513 1.00 0.00 C ATOM 367 CG2 ILE A 27 -0.135 -6.547 -1.987 1.00 0.00 C ATOM 368 CD1 ILE A 27 -0.859 -8.135 -4.693 1.00 0.00 C ATOM 0 H ILE A 27 1.631 -4.508 -1.629 1.00 0.00 H new ATOM 0 HA ILE A 27 2.526 -6.037 -4.005 1.00 0.00 H new ATOM 0 HB ILE A 27 1.180 -7.664 -3.226 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -1.033 -6.004 -4.412 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.332 -6.483 -5.401 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -0.877 -7.343 -1.918 1.00 0.00 H new ATOM 0 HG22 ILE A 27 0.540 -6.605 -1.133 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -0.639 -5.580 -1.986 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.499 -8.137 -5.575 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -0.066 -8.872 -4.818 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.452 -8.386 -3.814 1.00 0.00 H new ATOM 380 N GLY A 28 1.499 -4.358 -5.465 1.00 0.00 N ATOM 381 CA GLY A 28 1.091 -3.247 -6.307 1.00 0.00 C ATOM 382 C GLY A 28 -0.201 -3.574 -7.058 1.00 0.00 C ATOM 383 O GLY A 28 -0.223 -4.467 -7.904 1.00 0.00 O ATOM 0 H GLY A 28 1.998 -5.102 -5.953 1.00 0.00 H new ATOM 0 HA2 GLY A 28 0.945 -2.357 -5.695 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.882 -3.017 -7.020 1.00 0.00 H new ATOM 387 N MET A 29 -1.247 -2.832 -6.723 1.00 0.00 N ATOM 388 CA MET A 29 -2.540 -3.032 -7.355 1.00 0.00 C ATOM 389 C MET A 29 -3.152 -1.698 -7.785 1.00 0.00 C ATOM 390 O MET A 29 -2.836 -0.654 -7.216 1.00 0.00 O ATOM 391 CB MET A 29 -3.483 -3.736 -6.377 1.00 0.00 C ATOM 392 CG MET A 29 -2.876 -5.048 -5.878 1.00 0.00 C ATOM 393 SD MET A 29 -3.686 -6.433 -6.661 1.00 0.00 S ATOM 394 CE MET A 29 -4.616 -7.071 -5.277 1.00 0.00 C ATOM 0 H MET A 29 -1.225 -2.091 -6.022 1.00 0.00 H new ATOM 0 HA MET A 29 -2.398 -3.648 -8.243 1.00 0.00 H new ATOM 0 HB2 MET A 29 -3.689 -3.081 -5.530 1.00 0.00 H new ATOM 0 HB3 MET A 29 -4.437 -3.935 -6.866 1.00 0.00 H new ATOM 0 HG2 MET A 29 -1.808 -5.070 -6.096 1.00 0.00 H new ATOM 0 HG3 MET A 29 -2.982 -5.119 -4.795 1.00 0.00 H new ATOM 0 HE1 MET A 29 -5.185 -7.946 -5.593 1.00 0.00 H new ATOM 0 HE2 MET A 29 -3.931 -7.353 -4.477 1.00 0.00 H new ATOM 0 HE3 MET A 29 -5.301 -6.305 -4.915 1.00 0.00 H new ATOM 404 N GLY A 30 -4.017 -1.775 -8.786 1.00 0.00 N ATOM 405 CA GLY A 30 -4.676 -0.586 -9.299 1.00 0.00 C ATOM 406 C GLY A 30 -6.049 -0.397 -8.650 1.00 0.00 C ATOM 407 O GLY A 30 -6.999 -1.105 -8.981 1.00 0.00 O ATOM 0 H GLY A 30 -4.277 -2.643 -9.255 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -4.056 0.289 -9.107 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -4.789 -0.666 -10.380 1.00 0.00 H new ATOM 411 N VAL A 31 -6.110 0.561 -7.737 1.00 0.00 N ATOM 412 CA VAL A 31 -7.351 0.852 -7.039 1.00 0.00 C ATOM 413 C VAL A 31 -8.107 1.950 -7.788 1.00 0.00 C ATOM 414 O VAL A 31 -7.515 2.696 -8.567 1.00 0.00 O ATOM 415 CB VAL A 31 -7.058 1.214 -5.581 1.00 0.00 C ATOM 416 CG1 VAL A 31 -8.218 0.804 -4.671 1.00 0.00 C ATOM 417 CG2 VAL A 31 -5.744 0.586 -5.113 1.00 0.00 C ATOM 0 H VAL A 31 -5.320 1.146 -7.464 1.00 0.00 H new ATOM 0 HA VAL A 31 -7.994 -0.028 -7.019 1.00 0.00 H new ATOM 0 HB VAL A 31 -6.951 2.297 -5.519 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -7.985 1.072 -3.641 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -9.126 1.320 -4.984 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -8.371 -0.273 -4.740 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.560 0.859 -4.074 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.809 -0.499 -5.197 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.925 0.950 -5.734 1.00 0.00 H new ATOM 492 N GLU A 38 -6.602 5.851 -12.621 1.00 0.00 N ATOM 493 CA GLU A 38 -6.442 4.822 -11.607 1.00 0.00 C ATOM 494 C GLU A 38 -5.446 5.280 -10.539 1.00 0.00 C ATOM 495 O GLU A 38 -4.561 6.088 -10.816 1.00 0.00 O ATOM 496 CB GLU A 38 -6.002 3.498 -12.235 1.00 0.00 C ATOM 497 CG GLU A 38 -4.554 3.575 -12.720 1.00 0.00 C ATOM 498 CD GLU A 38 -4.171 2.318 -13.504 1.00 0.00 C ATOM 499 OE1 GLU A 38 -4.178 1.235 -12.880 1.00 0.00 O ATOM 500 OE2 GLU A 38 -3.879 2.469 -14.710 1.00 0.00 O ATOM 0 HA GLU A 38 -7.407 4.657 -11.129 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -6.102 2.694 -11.505 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -6.657 3.253 -13.071 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -4.424 4.455 -13.350 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -3.887 3.693 -11.866 1.00 0.00 H new ATOM 507 N LYS A 39 -5.625 4.744 -9.341 1.00 0.00 N ATOM 508 CA LYS A 39 -4.753 5.087 -8.230 1.00 0.00 C ATOM 509 C LYS A 39 -4.154 3.807 -7.643 1.00 0.00 C ATOM 510 O LYS A 39 -4.789 3.135 -6.832 1.00 0.00 O ATOM 511 CB LYS A 39 -5.503 5.941 -7.205 1.00 0.00 C ATOM 512 CG LYS A 39 -5.494 7.417 -7.610 1.00 0.00 C ATOM 513 CD LYS A 39 -4.843 8.278 -6.526 1.00 0.00 C ATOM 514 CE LYS A 39 -5.500 9.659 -6.456 1.00 0.00 C ATOM 515 NZ LYS A 39 -4.579 10.640 -5.838 1.00 0.00 N ATOM 0 H LYS A 39 -6.361 4.075 -9.115 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.920 5.700 -8.574 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -6.531 5.591 -7.117 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -5.042 5.826 -6.224 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -4.953 7.537 -8.549 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -6.515 7.756 -7.785 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -4.930 7.780 -5.560 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -3.779 8.388 -6.734 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -5.774 9.989 -7.458 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -6.421 9.601 -5.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -5.040 11.571 -5.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -4.338 10.331 -4.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -3.711 10.707 -6.407 1.00 0.00 H new ATOM 529 N LEU A 40 -2.938 3.509 -8.077 1.00 0.00 N ATOM 530 CA LEU A 40 -2.246 2.322 -7.605 1.00 0.00 C ATOM 531 C LEU A 40 -2.268 2.298 -6.075 1.00 0.00 C ATOM 532 O LEU A 40 -1.954 3.297 -5.430 1.00 0.00 O ATOM 533 CB LEU A 40 -0.838 2.250 -8.200 1.00 0.00 C ATOM 534 CG LEU A 40 -0.373 0.865 -8.656 1.00 0.00 C ATOM 535 CD1 LEU A 40 -0.149 -0.060 -7.458 1.00 0.00 C ATOM 536 CD2 LEU A 40 -1.349 0.265 -9.670 1.00 0.00 C ATOM 0 H LEU A 40 -2.415 4.069 -8.750 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.758 1.422 -7.946 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.790 2.927 -9.053 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.132 2.623 -7.458 1.00 0.00 H new ATOM 0 HG LEU A 40 0.587 0.976 -9.161 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.181 -1.038 -7.810 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.613 0.367 -6.806 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -1.081 -0.170 -6.904 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -0.995 -0.719 -9.978 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.335 0.170 -9.214 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.414 0.916 -10.542 1.00 0.00 H new ATOM 548 N GLY A 41 -2.643 1.146 -5.539 1.00 0.00 N ATOM 549 CA GLY A 41 -2.711 0.979 -4.097 1.00 0.00 C ATOM 550 C GLY A 41 -1.675 -0.038 -3.613 1.00 0.00 C ATOM 551 O GLY A 41 -1.580 -1.139 -4.155 1.00 0.00 O ATOM 0 H GLY A 41 -2.903 0.319 -6.077 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.540 1.938 -3.608 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.710 0.649 -3.812 1.00 0.00 H new ATOM 555 N ILE A 42 -0.924 0.367 -2.600 1.00 0.00 N ATOM 556 CA ILE A 42 0.102 -0.495 -2.038 1.00 0.00 C ATOM 557 C ILE A 42 -0.472 -1.246 -0.835 1.00 0.00 C ATOM 558 O ILE A 42 -0.606 -0.680 0.249 1.00 0.00 O ATOM 559 CB ILE A 42 1.362 0.312 -1.715 1.00 0.00 C ATOM 560 CG1 ILE A 42 1.681 1.302 -2.836 1.00 0.00 C ATOM 561 CG2 ILE A 42 2.543 -0.613 -1.413 1.00 0.00 C ATOM 562 CD1 ILE A 42 1.975 0.570 -4.147 1.00 0.00 C ATOM 0 H ILE A 42 -1.005 1.281 -2.154 1.00 0.00 H new ATOM 0 HA ILE A 42 0.410 -1.246 -2.766 1.00 0.00 H new ATOM 0 HB ILE A 42 1.172 0.896 -0.814 1.00 0.00 H new ATOM 0 HG12 ILE A 42 0.841 1.982 -2.976 1.00 0.00 H new ATOM 0 HG13 ILE A 42 2.540 1.911 -2.555 1.00 0.00 H new ATOM 0 HG21 ILE A 42 3.425 -0.014 -1.187 1.00 0.00 H new ATOM 0 HG22 ILE A 42 2.302 -1.243 -0.556 1.00 0.00 H new ATOM 0 HG23 ILE A 42 2.744 -1.242 -2.280 1.00 0.00 H new ATOM 0 HD11 ILE A 42 2.199 1.297 -4.928 1.00 0.00 H new ATOM 0 HD12 ILE A 42 2.831 -0.091 -4.011 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.105 -0.019 -4.438 1.00 0.00 H new ATOM 574 N PHE A 43 -0.796 -2.510 -1.067 1.00 0.00 N ATOM 575 CA PHE A 43 -1.353 -3.345 -0.016 1.00 0.00 C ATOM 576 C PHE A 43 -0.295 -4.296 0.547 1.00 0.00 C ATOM 577 O PHE A 43 0.752 -4.499 -0.066 1.00 0.00 O ATOM 578 CB PHE A 43 -2.478 -4.167 -0.647 1.00 0.00 C ATOM 579 CG PHE A 43 -3.590 -3.323 -1.273 1.00 0.00 C ATOM 580 CD1 PHE A 43 -3.491 -2.921 -2.568 1.00 0.00 C ATOM 581 CD2 PHE A 43 -4.678 -2.976 -0.534 1.00 0.00 C ATOM 582 CE1 PHE A 43 -4.523 -2.138 -3.149 1.00 0.00 C ATOM 583 CE2 PHE A 43 -5.710 -2.193 -1.115 1.00 0.00 C ATOM 584 CZ PHE A 43 -5.611 -1.790 -2.410 1.00 0.00 C ATOM 0 H PHE A 43 -0.683 -2.976 -1.967 1.00 0.00 H new ATOM 0 HA PHE A 43 -1.715 -2.722 0.802 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -2.054 -4.816 -1.413 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -2.912 -4.814 0.115 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -2.627 -3.197 -3.155 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -4.757 -3.296 0.494 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -4.444 -1.819 -4.178 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -6.574 -1.917 -0.528 1.00 0.00 H new ATOM 0 HZ PHE A 43 -6.396 -1.194 -2.852 1.00 0.00 H new ATOM 594 N VAL A 44 -0.605 -4.855 1.707 1.00 0.00 N ATOM 595 CA VAL A 44 0.306 -5.780 2.360 1.00 0.00 C ATOM 596 C VAL A 44 0.022 -7.201 1.866 1.00 0.00 C ATOM 597 O VAL A 44 -0.945 -7.829 2.295 1.00 0.00 O ATOM 598 CB VAL A 44 0.194 -5.642 3.879 1.00 0.00 C ATOM 599 CG1 VAL A 44 0.829 -6.840 4.587 1.00 0.00 C ATOM 600 CG2 VAL A 44 0.817 -4.329 4.357 1.00 0.00 C ATOM 0 H VAL A 44 -1.475 -4.685 2.212 1.00 0.00 H new ATOM 0 HA VAL A 44 1.339 -5.545 2.102 1.00 0.00 H new ATOM 0 HB VAL A 44 -0.865 -5.624 4.137 1.00 0.00 H new ATOM 0 HG11 VAL A 44 0.736 -6.716 5.666 1.00 0.00 H new ATOM 0 HG12 VAL A 44 0.321 -7.755 4.281 1.00 0.00 H new ATOM 0 HG13 VAL A 44 1.884 -6.904 4.319 1.00 0.00 H new ATOM 0 HG21 VAL A 44 0.724 -4.255 5.441 1.00 0.00 H new ATOM 0 HG22 VAL A 44 1.871 -4.305 4.081 1.00 0.00 H new ATOM 0 HG23 VAL A 44 0.300 -3.490 3.891 1.00 0.00 H new ATOM 610 N LYS A 45 0.883 -7.665 0.973 1.00 0.00 N ATOM 611 CA LYS A 45 0.737 -9.000 0.417 1.00 0.00 C ATOM 612 C LYS A 45 0.740 -10.024 1.553 1.00 0.00 C ATOM 613 O LYS A 45 -0.017 -10.994 1.522 1.00 0.00 O ATOM 614 CB LYS A 45 1.808 -9.258 -0.645 1.00 0.00 C ATOM 615 CG LYS A 45 1.586 -10.607 -1.332 1.00 0.00 C ATOM 616 CD LYS A 45 2.006 -10.549 -2.802 1.00 0.00 C ATOM 617 CE LYS A 45 2.594 -11.886 -3.257 1.00 0.00 C ATOM 618 NZ LYS A 45 1.574 -12.956 -3.176 1.00 0.00 N ATOM 0 H LYS A 45 1.684 -7.141 0.620 1.00 0.00 H new ATOM 0 HA LYS A 45 -0.219 -9.096 -0.097 1.00 0.00 H new ATOM 0 HB2 LYS A 45 1.788 -8.460 -1.388 1.00 0.00 H new ATOM 0 HB3 LYS A 45 2.795 -9.239 -0.183 1.00 0.00 H new ATOM 0 HG2 LYS A 45 2.157 -11.380 -0.817 1.00 0.00 H new ATOM 0 HG3 LYS A 45 0.535 -10.887 -1.261 1.00 0.00 H new ATOM 0 HD2 LYS A 45 1.144 -10.297 -3.420 1.00 0.00 H new ATOM 0 HD3 LYS A 45 2.742 -9.757 -2.943 1.00 0.00 H new ATOM 0 HE2 LYS A 45 2.959 -11.800 -4.281 1.00 0.00 H new ATOM 0 HE3 LYS A 45 3.450 -12.144 -2.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 1.964 -13.837 -3.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 1.307 -13.107 -2.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 0.734 -12.677 -3.721 1.00 0.00 H new ATOM 632 N THR A 46 1.598 -9.774 2.531 1.00 0.00 N ATOM 633 CA THR A 46 1.709 -10.663 3.675 1.00 0.00 C ATOM 634 C THR A 46 2.591 -10.034 4.755 1.00 0.00 C ATOM 635 O THR A 46 3.099 -8.927 4.581 1.00 0.00 O ATOM 636 CB THR A 46 2.228 -12.013 3.177 1.00 0.00 C ATOM 637 OG1 THR A 46 2.389 -12.783 4.366 1.00 0.00 O ATOM 638 CG2 THR A 46 3.641 -11.920 2.599 1.00 0.00 C ATOM 0 H THR A 46 2.223 -8.968 2.555 1.00 0.00 H new ATOM 0 HA THR A 46 0.739 -10.825 4.145 1.00 0.00 H new ATOM 0 HB THR A 46 1.551 -12.405 2.418 1.00 0.00 H new ATOM 0 HG1 THR A 46 2.721 -13.676 4.135 1.00 0.00 H new ATOM 0 HG21 THR A 46 3.961 -12.905 2.260 1.00 0.00 H new ATOM 0 HG22 THR A 46 3.645 -11.228 1.757 1.00 0.00 H new ATOM 0 HG23 THR A 46 4.325 -11.560 3.367 1.00 0.00 H new ATOM 646 N VAL A 47 2.746 -10.766 5.848 1.00 0.00 N ATOM 647 CA VAL A 47 3.558 -10.294 6.957 1.00 0.00 C ATOM 648 C VAL A 47 4.540 -11.393 7.368 1.00 0.00 C ATOM 649 O VAL A 47 4.134 -12.519 7.653 1.00 0.00 O ATOM 650 CB VAL A 47 2.659 -9.835 8.106 1.00 0.00 C ATOM 651 CG1 VAL A 47 3.490 -9.438 9.328 1.00 0.00 C ATOM 652 CG2 VAL A 47 1.748 -8.688 7.665 1.00 0.00 C ATOM 0 H VAL A 47 2.323 -11.683 5.990 1.00 0.00 H new ATOM 0 HA VAL A 47 4.147 -9.427 6.657 1.00 0.00 H new ATOM 0 HB VAL A 47 2.025 -10.675 8.391 1.00 0.00 H new ATOM 0 HG11 VAL A 47 2.826 -9.116 10.130 1.00 0.00 H new ATOM 0 HG12 VAL A 47 4.076 -10.294 9.663 1.00 0.00 H new ATOM 0 HG13 VAL A 47 4.161 -8.621 9.062 1.00 0.00 H new ATOM 0 HG21 VAL A 47 1.119 -8.381 8.501 1.00 0.00 H new ATOM 0 HG22 VAL A 47 2.357 -7.844 7.339 1.00 0.00 H new ATOM 0 HG23 VAL A 47 1.118 -9.020 6.840 1.00 0.00 H new ATOM 662 N THR A 48 5.814 -11.027 7.387 1.00 0.00 N ATOM 663 CA THR A 48 6.857 -11.968 7.759 1.00 0.00 C ATOM 664 C THR A 48 6.627 -12.484 9.181 1.00 0.00 C ATOM 665 O THR A 48 6.365 -11.703 10.094 1.00 0.00 O ATOM 666 CB THR A 48 8.207 -11.273 7.576 1.00 0.00 C ATOM 667 OG1 THR A 48 8.461 -11.370 6.178 1.00 0.00 O ATOM 668 CG2 THR A 48 9.358 -12.050 8.219 1.00 0.00 C ATOM 0 H THR A 48 6.147 -10.092 7.151 1.00 0.00 H new ATOM 0 HA THR A 48 6.840 -12.851 7.120 1.00 0.00 H new ATOM 0 HB THR A 48 8.161 -10.272 8.005 1.00 0.00 H new ATOM 0 HG1 THR A 48 9.318 -10.942 5.971 1.00 0.00 H new ATOM 0 HG21 THR A 48 10.293 -11.513 8.060 1.00 0.00 H new ATOM 0 HG22 THR A 48 9.175 -12.152 9.289 1.00 0.00 H new ATOM 0 HG23 THR A 48 9.426 -13.039 7.767 1.00 0.00 H new ATOM 676 N GLU A 49 6.733 -13.797 9.324 1.00 0.00 N ATOM 677 CA GLU A 49 6.540 -14.428 10.618 1.00 0.00 C ATOM 678 C GLU A 49 7.699 -14.081 11.555 1.00 0.00 C ATOM 679 O GLU A 49 8.835 -14.489 11.320 1.00 0.00 O ATOM 680 CB GLU A 49 6.386 -15.943 10.473 1.00 0.00 C ATOM 681 CG GLU A 49 5.271 -16.470 11.379 1.00 0.00 C ATOM 682 CD GLU A 49 5.102 -17.982 11.217 1.00 0.00 C ATOM 683 OE1 GLU A 49 5.148 -18.437 10.053 1.00 0.00 O ATOM 684 OE2 GLU A 49 4.931 -18.649 12.260 1.00 0.00 O ATOM 0 H GLU A 49 6.950 -14.442 8.564 1.00 0.00 H new ATOM 0 HA GLU A 49 5.618 -14.044 11.054 1.00 0.00 H new ATOM 0 HB2 GLU A 49 6.164 -16.192 9.435 1.00 0.00 H new ATOM 0 HB3 GLU A 49 7.326 -16.433 10.725 1.00 0.00 H new ATOM 0 HG2 GLU A 49 5.501 -16.235 12.418 1.00 0.00 H new ATOM 0 HG3 GLU A 49 4.334 -15.968 11.138 1.00 0.00 H new ATOM 691 N GLY A 50 7.371 -13.332 12.598 1.00 0.00 N ATOM 692 CA GLY A 50 8.371 -12.926 13.571 1.00 0.00 C ATOM 693 C GLY A 50 9.041 -11.616 13.155 1.00 0.00 C ATOM 694 O GLY A 50 10.201 -11.375 13.485 1.00 0.00 O ATOM 0 H GLY A 50 6.427 -12.996 12.790 1.00 0.00 H new ATOM 0 HA2 GLY A 50 7.904 -12.805 14.549 1.00 0.00 H new ATOM 0 HA3 GLY A 50 9.124 -13.708 13.672 1.00 0.00 H new ATOM 698 N GLY A 51 8.281 -10.802 12.437 1.00 0.00 N ATOM 699 CA GLY A 51 8.787 -9.522 11.972 1.00 0.00 C ATOM 700 C GLY A 51 8.358 -8.390 12.908 1.00 0.00 C ATOM 701 O GLY A 51 7.929 -8.640 14.034 1.00 0.00 O ATOM 0 H GLY A 51 7.319 -11.004 12.166 1.00 0.00 H new ATOM 0 HA2 GLY A 51 9.875 -9.557 11.912 1.00 0.00 H new ATOM 0 HA3 GLY A 51 8.419 -9.325 10.965 1.00 0.00 H new ATOM 705 N ALA A 52 8.489 -7.170 12.408 1.00 0.00 N ATOM 706 CA ALA A 52 8.120 -5.999 13.186 1.00 0.00 C ATOM 707 C ALA A 52 6.602 -5.814 13.133 1.00 0.00 C ATOM 708 O ALA A 52 5.940 -5.788 14.169 1.00 0.00 O ATOM 709 CB ALA A 52 8.875 -4.777 12.659 1.00 0.00 C ATOM 0 H ALA A 52 8.845 -6.967 11.474 1.00 0.00 H new ATOM 0 HA ALA A 52 8.400 -6.129 14.231 1.00 0.00 H new ATOM 0 HB1 ALA A 52 8.598 -3.899 13.242 1.00 0.00 H new ATOM 0 HB2 ALA A 52 9.948 -4.947 12.746 1.00 0.00 H new ATOM 0 HB3 ALA A 52 8.617 -4.613 11.613 1.00 0.00 H new ATOM 715 N ALA A 53 6.095 -5.691 11.915 1.00 0.00 N ATOM 716 CA ALA A 53 4.668 -5.509 11.713 1.00 0.00 C ATOM 717 C ALA A 53 3.917 -6.701 12.310 1.00 0.00 C ATOM 718 O ALA A 53 2.813 -6.547 12.830 1.00 0.00 O ATOM 719 CB ALA A 53 4.382 -5.328 10.221 1.00 0.00 C ATOM 0 H ALA A 53 6.647 -5.714 11.058 1.00 0.00 H new ATOM 0 HA ALA A 53 4.320 -4.611 12.223 1.00 0.00 H new ATOM 0 HB1 ALA A 53 3.311 -5.191 10.070 1.00 0.00 H new ATOM 0 HB2 ALA A 53 4.915 -4.452 9.852 1.00 0.00 H new ATOM 0 HB3 ALA A 53 4.716 -6.212 9.677 1.00 0.00 H new ATOM 725 N GLN A 54 4.546 -7.864 12.216 1.00 0.00 N ATOM 726 CA GLN A 54 3.951 -9.081 12.740 1.00 0.00 C ATOM 727 C GLN A 54 3.837 -9.003 14.264 1.00 0.00 C ATOM 728 O GLN A 54 2.742 -9.105 14.814 1.00 0.00 O ATOM 729 CB GLN A 54 4.754 -10.312 12.313 1.00 0.00 C ATOM 730 CG GLN A 54 3.887 -11.571 12.347 1.00 0.00 C ATOM 731 CD GLN A 54 3.932 -12.232 13.726 1.00 0.00 C ATOM 732 OE1 GLN A 54 4.047 -11.581 14.751 1.00 0.00 O ATOM 733 NE2 GLN A 54 3.835 -13.558 13.694 1.00 0.00 N ATOM 0 H GLN A 54 5.462 -7.989 11.785 1.00 0.00 H new ATOM 0 HA GLN A 54 2.948 -9.180 12.325 1.00 0.00 H new ATOM 0 HB2 GLN A 54 5.146 -10.164 11.307 1.00 0.00 H new ATOM 0 HB3 GLN A 54 5.611 -10.439 12.974 1.00 0.00 H new ATOM 0 HG2 GLN A 54 2.858 -11.315 12.096 1.00 0.00 H new ATOM 0 HG3 GLN A 54 4.233 -12.276 11.591 1.00 0.00 H new ATOM 0 HE21 GLN A 54 3.741 -14.041 12.801 1.00 0.00 H new ATOM 0 HE22 GLN A 54 3.855 -14.092 14.563 1.00 0.00 H new ATOM 742 N ARG A 55 4.984 -8.821 14.903 1.00 0.00 N ATOM 743 CA ARG A 55 5.026 -8.728 16.352 1.00 0.00 C ATOM 744 C ARG A 55 3.976 -7.733 16.851 1.00 0.00 C ATOM 745 O ARG A 55 3.199 -8.045 17.753 1.00 0.00 O ATOM 746 CB ARG A 55 6.408 -8.284 16.835 1.00 0.00 C ATOM 747 CG ARG A 55 7.313 -9.491 17.092 1.00 0.00 C ATOM 748 CD ARG A 55 8.647 -9.056 17.703 1.00 0.00 C ATOM 749 NE ARG A 55 9.428 -8.281 16.713 1.00 0.00 N ATOM 750 CZ ARG A 55 10.196 -8.833 15.763 1.00 0.00 C ATOM 751 NH1 ARG A 55 10.290 -10.167 15.669 1.00 0.00 N ATOM 752 NH2 ARG A 55 10.870 -8.052 14.908 1.00 0.00 N ATOM 0 H ARG A 55 5.891 -8.736 14.443 1.00 0.00 H new ATOM 0 HA ARG A 55 4.813 -9.719 16.754 1.00 0.00 H new ATOM 0 HB2 ARG A 55 6.866 -7.634 16.090 1.00 0.00 H new ATOM 0 HB3 ARG A 55 6.307 -7.699 17.749 1.00 0.00 H new ATOM 0 HG2 ARG A 55 6.812 -10.189 17.763 1.00 0.00 H new ATOM 0 HG3 ARG A 55 7.493 -10.021 16.157 1.00 0.00 H new ATOM 0 HD2 ARG A 55 8.469 -8.451 18.592 1.00 0.00 H new ATOM 0 HD3 ARG A 55 9.214 -9.931 18.021 1.00 0.00 H new ATOM 0 HE ARG A 55 9.379 -7.263 16.756 1.00 0.00 H new ATOM 0 HH11 ARG A 55 9.777 -10.762 16.320 1.00 0.00 H new ATOM 0 HH12 ARG A 55 10.874 -10.587 14.946 1.00 0.00 H new ATOM 0 HH21 ARG A 55 10.799 -7.037 14.980 1.00 0.00 H new ATOM 0 HH22 ARG A 55 11.454 -8.472 14.185 1.00 0.00 H new ATOM 766 N ASP A 56 3.985 -6.557 16.242 1.00 0.00 N ATOM 767 CA ASP A 56 3.042 -5.515 16.613 1.00 0.00 C ATOM 768 C ASP A 56 1.617 -6.063 16.515 1.00 0.00 C ATOM 769 O ASP A 56 0.849 -5.980 17.472 1.00 0.00 O ATOM 770 CB ASP A 56 3.152 -4.313 15.673 1.00 0.00 C ATOM 771 CG ASP A 56 2.454 -3.043 16.163 1.00 0.00 C ATOM 772 OD1 ASP A 56 1.644 -3.169 17.107 1.00 0.00 O ATOM 773 OD2 ASP A 56 2.746 -1.975 15.583 1.00 0.00 O ATOM 0 H ASP A 56 4.630 -6.302 15.494 1.00 0.00 H new ATOM 0 HA ASP A 56 3.272 -5.200 17.631 1.00 0.00 H new ATOM 0 HB2 ASP A 56 4.207 -4.091 15.513 1.00 0.00 H new ATOM 0 HB3 ASP A 56 2.734 -4.589 14.705 1.00 0.00 H new ATOM 778 N GLY A 57 1.308 -6.612 15.349 1.00 0.00 N ATOM 779 CA GLY A 57 -0.011 -7.174 15.113 1.00 0.00 C ATOM 780 C GLY A 57 -0.935 -6.147 14.455 1.00 0.00 C ATOM 781 O GLY A 57 -1.835 -6.511 13.699 1.00 0.00 O ATOM 0 H GLY A 57 1.948 -6.679 14.558 1.00 0.00 H new ATOM 0 HA2 GLY A 57 0.073 -8.054 14.475 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -0.443 -7.505 16.057 1.00 0.00 H new ATOM 785 N ARG A 58 -0.681 -4.885 14.767 1.00 0.00 N ATOM 786 CA ARG A 58 -1.479 -3.803 14.215 1.00 0.00 C ATOM 787 C ARG A 58 -1.675 -4.002 12.711 1.00 0.00 C ATOM 788 O ARG A 58 -2.792 -4.234 12.252 1.00 0.00 O ATOM 789 CB ARG A 58 -0.814 -2.447 14.461 1.00 0.00 C ATOM 790 CG ARG A 58 -1.745 -1.512 15.234 1.00 0.00 C ATOM 791 CD ARG A 58 -3.176 -1.597 14.698 1.00 0.00 C ATOM 792 NE ARG A 58 -3.156 -1.803 13.233 1.00 0.00 N ATOM 793 CZ ARG A 58 -4.235 -2.116 12.503 1.00 0.00 C ATOM 794 NH1 ARG A 58 -5.427 -2.261 13.099 1.00 0.00 N ATOM 795 NH2 ARG A 58 -4.123 -2.285 11.179 1.00 0.00 N ATOM 0 H ARG A 58 0.066 -4.587 15.395 1.00 0.00 H new ATOM 0 HA ARG A 58 -2.447 -3.816 14.716 1.00 0.00 H new ATOM 0 HB2 ARG A 58 0.111 -2.588 15.020 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -0.545 -1.992 13.508 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -1.733 -1.774 16.292 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -1.384 -0.487 15.155 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -3.706 -2.417 15.182 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -3.718 -0.682 14.938 1.00 0.00 H new ATOM 0 HE ARG A 58 -2.264 -1.700 12.748 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -5.512 -2.133 14.107 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -6.249 -2.499 12.544 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -3.216 -2.175 10.726 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -4.945 -2.523 10.624 1.00 0.00 H new ATOM 809 N ILE A 59 -0.571 -3.903 11.984 1.00 0.00 N ATOM 810 CA ILE A 59 -0.608 -4.069 10.541 1.00 0.00 C ATOM 811 C ILE A 59 -0.944 -5.523 10.208 1.00 0.00 C ATOM 812 O ILE A 59 -0.322 -6.445 10.734 1.00 0.00 O ATOM 813 CB ILE A 59 0.699 -3.580 9.913 1.00 0.00 C ATOM 814 CG1 ILE A 59 0.853 -2.067 10.074 1.00 0.00 C ATOM 815 CG2 ILE A 59 0.799 -4.014 8.449 1.00 0.00 C ATOM 816 CD1 ILE A 59 2.325 -1.678 10.224 1.00 0.00 C ATOM 0 H ILE A 59 0.354 -3.710 12.368 1.00 0.00 H new ATOM 0 HA ILE A 59 -1.395 -3.452 10.106 1.00 0.00 H new ATOM 0 HB ILE A 59 1.529 -4.046 10.445 1.00 0.00 H new ATOM 0 HG12 ILE A 59 0.426 -1.560 9.209 1.00 0.00 H new ATOM 0 HG13 ILE A 59 0.294 -1.732 10.948 1.00 0.00 H new ATOM 0 HG21 ILE A 59 1.737 -3.654 8.026 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.768 -5.102 8.389 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -0.036 -3.596 7.888 1.00 0.00 H new ATOM 0 HD11 ILE A 59 2.406 -0.597 10.337 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.743 -2.167 11.104 1.00 0.00 H new ATOM 0 HD13 ILE A 59 2.877 -1.993 9.338 1.00 0.00 H new ATOM 828 N GLN A 60 -1.928 -5.685 9.335 1.00 0.00 N ATOM 829 CA GLN A 60 -2.355 -7.012 8.925 1.00 0.00 C ATOM 830 C GLN A 60 -2.245 -7.159 7.406 1.00 0.00 C ATOM 831 O GLN A 60 -2.123 -6.167 6.690 1.00 0.00 O ATOM 832 CB GLN A 60 -3.779 -7.301 9.403 1.00 0.00 C ATOM 833 CG GLN A 60 -4.075 -6.577 10.717 1.00 0.00 C ATOM 834 CD GLN A 60 -5.522 -6.808 11.158 1.00 0.00 C ATOM 835 OE1 GLN A 60 -6.244 -7.620 10.603 1.00 0.00 O ATOM 836 NE2 GLN A 60 -5.903 -6.052 12.183 1.00 0.00 N ATOM 0 H GLN A 60 -2.442 -4.919 8.900 1.00 0.00 H new ATOM 0 HA GLN A 60 -1.696 -7.745 9.390 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -4.493 -6.986 8.642 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -3.910 -8.375 9.538 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -3.394 -6.930 11.492 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -3.894 -5.509 10.596 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -5.247 -5.392 12.601 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -6.851 -6.132 12.551 1.00 0.00 H new ATOM 845 N VAL A 61 -2.292 -8.406 6.960 1.00 0.00 N ATOM 846 CA VAL A 61 -2.199 -8.696 5.539 1.00 0.00 C ATOM 847 C VAL A 61 -3.436 -8.142 4.828 1.00 0.00 C ATOM 848 O VAL A 61 -4.507 -8.044 5.424 1.00 0.00 O ATOM 849 CB VAL A 61 -2.009 -10.198 5.323 1.00 0.00 C ATOM 850 CG1 VAL A 61 -2.004 -10.542 3.832 1.00 0.00 C ATOM 851 CG2 VAL A 61 -0.731 -10.692 6.004 1.00 0.00 C ATOM 0 H VAL A 61 -2.393 -9.227 7.557 1.00 0.00 H new ATOM 0 HA VAL A 61 -1.327 -8.206 5.105 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.854 -10.712 5.782 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -1.867 -11.616 3.707 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -2.953 -10.243 3.386 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.188 -10.013 3.339 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -0.619 -11.763 5.835 1.00 0.00 H new ATOM 0 HG22 VAL A 61 0.129 -10.168 5.588 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -0.791 -10.498 7.075 1.00 0.00 H new ATOM 861 N ASN A 62 -3.246 -7.794 3.564 1.00 0.00 N ATOM 862 CA ASN A 62 -4.332 -7.252 2.765 1.00 0.00 C ATOM 863 C ASN A 62 -4.536 -5.779 3.123 1.00 0.00 C ATOM 864 O ASN A 62 -5.391 -5.109 2.545 1.00 0.00 O ATOM 865 CB ASN A 62 -5.642 -7.992 3.043 1.00 0.00 C ATOM 866 CG ASN A 62 -5.420 -9.505 3.079 1.00 0.00 C ATOM 867 OD1 ASN A 62 -5.210 -10.152 2.066 1.00 0.00 O ATOM 868 ND2 ASN A 62 -5.479 -10.032 4.299 1.00 0.00 N ATOM 0 H ASN A 62 -2.356 -7.877 3.073 1.00 0.00 H new ATOM 0 HA ASN A 62 -4.068 -7.368 1.714 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -6.057 -7.659 3.994 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -6.373 -7.746 2.273 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -5.345 -11.035 4.428 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -5.659 -9.433 5.105 1.00 0.00 H new ATOM 875 N ASP A 63 -3.737 -5.317 4.073 1.00 0.00 N ATOM 876 CA ASP A 63 -3.819 -3.935 4.514 1.00 0.00 C ATOM 877 C ASP A 63 -3.433 -3.011 3.357 1.00 0.00 C ATOM 878 O ASP A 63 -2.959 -3.473 2.321 1.00 0.00 O ATOM 879 CB ASP A 63 -2.857 -3.668 5.673 1.00 0.00 C ATOM 880 CG ASP A 63 -3.442 -3.906 7.067 1.00 0.00 C ATOM 881 OD1 ASP A 63 -4.586 -4.407 7.124 1.00 0.00 O ATOM 882 OD2 ASP A 63 -2.733 -3.581 8.043 1.00 0.00 O ATOM 0 H ASP A 63 -3.029 -5.875 4.550 1.00 0.00 H new ATOM 0 HA ASP A 63 -4.841 -3.747 4.843 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -1.979 -4.303 5.551 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -2.515 -2.635 5.611 1.00 0.00 H new ATOM 887 N GLN A 64 -3.650 -1.722 3.574 1.00 0.00 N ATOM 888 CA GLN A 64 -3.331 -0.729 2.562 1.00 0.00 C ATOM 889 C GLN A 64 -2.472 0.385 3.164 1.00 0.00 C ATOM 890 O GLN A 64 -2.923 1.114 4.046 1.00 0.00 O ATOM 891 CB GLN A 64 -4.603 -0.160 1.931 1.00 0.00 C ATOM 892 CG GLN A 64 -4.268 0.766 0.761 1.00 0.00 C ATOM 893 CD GLN A 64 -5.452 1.674 0.423 1.00 0.00 C ATOM 894 OE1 GLN A 64 -6.579 1.444 0.828 1.00 0.00 O ATOM 895 NE2 GLN A 64 -5.134 2.716 -0.340 1.00 0.00 N ATOM 0 H GLN A 64 -4.043 -1.342 4.435 1.00 0.00 H new ATOM 0 HA GLN A 64 -2.759 -1.215 1.771 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -5.237 -0.976 1.584 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -5.172 0.388 2.682 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -3.399 1.374 1.011 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -4.000 0.172 -0.113 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -4.170 2.850 -0.645 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -5.854 3.381 -0.621 1.00 0.00 H new ATOM 904 N ILE A 65 -1.249 0.481 2.664 1.00 0.00 N ATOM 905 CA ILE A 65 -0.322 1.494 3.141 1.00 0.00 C ATOM 906 C ILE A 65 -0.577 2.805 2.394 1.00 0.00 C ATOM 907 O ILE A 65 -0.010 3.036 1.327 1.00 0.00 O ATOM 908 CB ILE A 65 1.120 0.995 3.033 1.00 0.00 C ATOM 909 CG1 ILE A 65 1.312 -0.301 3.824 1.00 0.00 C ATOM 910 CG2 ILE A 65 2.109 2.080 3.461 1.00 0.00 C ATOM 911 CD1 ILE A 65 2.470 -1.124 3.256 1.00 0.00 C ATOM 0 H ILE A 65 -0.878 -0.126 1.933 1.00 0.00 H new ATOM 0 HA ILE A 65 -0.487 1.693 4.200 1.00 0.00 H new ATOM 0 HB ILE A 65 1.326 0.767 1.987 1.00 0.00 H new ATOM 0 HG12 ILE A 65 1.507 -0.067 4.871 1.00 0.00 H new ATOM 0 HG13 ILE A 65 0.395 -0.889 3.794 1.00 0.00 H new ATOM 0 HG21 ILE A 65 3.127 1.699 3.375 1.00 0.00 H new ATOM 0 HG22 ILE A 65 1.992 2.953 2.818 1.00 0.00 H new ATOM 0 HG23 ILE A 65 1.914 2.363 4.495 1.00 0.00 H new ATOM 0 HD11 ILE A 65 2.585 -2.039 3.836 1.00 0.00 H new ATOM 0 HD12 ILE A 65 2.261 -1.377 2.217 1.00 0.00 H new ATOM 0 HD13 ILE A 65 3.390 -0.543 3.310 1.00 0.00 H new ATOM 923 N VAL A 66 -1.431 3.629 2.984 1.00 0.00 N ATOM 924 CA VAL A 66 -1.767 4.910 2.387 1.00 0.00 C ATOM 925 C VAL A 66 -0.569 5.854 2.507 1.00 0.00 C ATOM 926 O VAL A 66 -0.290 6.628 1.592 1.00 0.00 O ATOM 927 CB VAL A 66 -3.037 5.470 3.032 1.00 0.00 C ATOM 928 CG1 VAL A 66 -3.437 6.800 2.390 1.00 0.00 C ATOM 929 CG2 VAL A 66 -4.182 4.459 2.957 1.00 0.00 C ATOM 0 H VAL A 66 -1.900 3.434 3.869 1.00 0.00 H new ATOM 0 HA VAL A 66 -1.982 4.792 1.325 1.00 0.00 H new ATOM 0 HB VAL A 66 -2.824 5.657 4.085 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.342 7.176 2.866 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.632 7.523 2.519 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.623 6.649 1.327 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.072 4.882 3.422 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -4.394 4.226 1.913 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -3.897 3.547 3.482 1.00 0.00 H new ATOM 939 N GLU A 67 0.107 5.760 3.643 1.00 0.00 N ATOM 940 CA GLU A 67 1.268 6.596 3.894 1.00 0.00 C ATOM 941 C GLU A 67 2.313 5.823 4.701 1.00 0.00 C ATOM 942 O GLU A 67 1.992 4.827 5.347 1.00 0.00 O ATOM 943 CB GLU A 67 0.869 7.888 4.609 1.00 0.00 C ATOM 944 CG GLU A 67 2.031 8.436 5.441 1.00 0.00 C ATOM 945 CD GLU A 67 1.604 9.676 6.229 1.00 0.00 C ATOM 946 OE1 GLU A 67 1.493 10.744 5.589 1.00 0.00 O ATOM 947 OE2 GLU A 67 1.399 9.528 7.453 1.00 0.00 O ATOM 0 H GLU A 67 -0.128 5.117 4.400 1.00 0.00 H new ATOM 0 HA GLU A 67 1.708 6.871 2.935 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.559 8.633 3.876 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.011 7.700 5.255 1.00 0.00 H new ATOM 0 HG2 GLU A 67 2.385 7.668 6.129 1.00 0.00 H new ATOM 0 HG3 GLU A 67 2.866 8.686 4.786 1.00 0.00 H new ATOM 954 N VAL A 68 3.543 6.312 4.638 1.00 0.00 N ATOM 955 CA VAL A 68 4.638 5.680 5.355 1.00 0.00 C ATOM 956 C VAL A 68 5.604 6.756 5.854 1.00 0.00 C ATOM 957 O VAL A 68 6.207 7.472 5.056 1.00 0.00 O ATOM 958 CB VAL A 68 5.314 4.637 4.463 1.00 0.00 C ATOM 959 CG1 VAL A 68 6.819 4.893 4.363 1.00 0.00 C ATOM 960 CG2 VAL A 68 5.032 3.220 4.967 1.00 0.00 C ATOM 0 H VAL A 68 3.806 7.139 4.101 1.00 0.00 H new ATOM 0 HA VAL A 68 4.265 5.148 6.230 1.00 0.00 H new ATOM 0 HB VAL A 68 4.892 4.728 3.462 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.275 4.137 3.723 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.992 5.881 3.937 1.00 0.00 H new ATOM 0 HG13 VAL A 68 7.263 4.843 5.357 1.00 0.00 H new ATOM 0 HG21 VAL A 68 5.524 2.498 4.316 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.414 3.112 5.982 1.00 0.00 H new ATOM 0 HG23 VAL A 68 3.957 3.040 4.963 1.00 0.00 H new ATOM 970 N ASP A 69 5.720 6.837 7.171 1.00 0.00 N ATOM 971 CA ASP A 69 6.603 7.814 7.786 1.00 0.00 C ATOM 972 C ASP A 69 6.257 9.208 7.261 1.00 0.00 C ATOM 973 O ASP A 69 7.074 10.125 7.339 1.00 0.00 O ATOM 974 CB ASP A 69 8.066 7.528 7.442 1.00 0.00 C ATOM 975 CG ASP A 69 8.876 6.868 8.559 1.00 0.00 C ATOM 976 OD1 ASP A 69 8.617 7.217 9.731 1.00 0.00 O ATOM 977 OD2 ASP A 69 9.737 6.029 8.216 1.00 0.00 O ATOM 0 H ASP A 69 5.217 6.242 7.830 1.00 0.00 H new ATOM 0 HA ASP A 69 6.469 7.757 8.866 1.00 0.00 H new ATOM 0 HB2 ASP A 69 8.098 6.885 6.562 1.00 0.00 H new ATOM 0 HB3 ASP A 69 8.549 8.466 7.169 1.00 0.00 H new ATOM 982 N GLY A 70 5.046 9.326 6.738 1.00 0.00 N ATOM 983 CA GLY A 70 4.582 10.593 6.201 1.00 0.00 C ATOM 984 C GLY A 70 4.477 10.537 4.675 1.00 0.00 C ATOM 985 O GLY A 70 3.667 11.243 4.079 1.00 0.00 O ATOM 0 H GLY A 70 4.371 8.564 6.675 1.00 0.00 H new ATOM 0 HA2 GLY A 70 3.609 10.838 6.627 1.00 0.00 H new ATOM 0 HA3 GLY A 70 5.268 11.389 6.493 1.00 0.00 H new ATOM 989 N ILE A 71 5.309 9.689 4.088 1.00 0.00 N ATOM 990 CA ILE A 71 5.320 9.530 2.644 1.00 0.00 C ATOM 991 C ILE A 71 3.993 8.919 2.192 1.00 0.00 C ATOM 992 O ILE A 71 3.495 7.979 2.811 1.00 0.00 O ATOM 993 CB ILE A 71 6.548 8.731 2.202 1.00 0.00 C ATOM 994 CG1 ILE A 71 7.829 9.547 2.386 1.00 0.00 C ATOM 995 CG2 ILE A 71 6.388 8.230 0.765 1.00 0.00 C ATOM 996 CD1 ILE A 71 9.059 8.737 1.971 1.00 0.00 C ATOM 0 H ILE A 71 5.980 9.105 4.587 1.00 0.00 H new ATOM 0 HA ILE A 71 5.407 10.500 2.155 1.00 0.00 H new ATOM 0 HB ILE A 71 6.632 7.852 2.842 1.00 0.00 H new ATOM 0 HG12 ILE A 71 7.772 10.459 1.792 1.00 0.00 H new ATOM 0 HG13 ILE A 71 7.924 9.851 3.428 1.00 0.00 H new ATOM 0 HG21 ILE A 71 7.274 7.665 0.476 1.00 0.00 H new ATOM 0 HG22 ILE A 71 5.511 7.587 0.700 1.00 0.00 H new ATOM 0 HG23 ILE A 71 6.265 9.081 0.095 1.00 0.00 H new ATOM 0 HD11 ILE A 71 9.956 9.340 2.112 1.00 0.00 H new ATOM 0 HD12 ILE A 71 9.126 7.838 2.584 1.00 0.00 H new ATOM 0 HD13 ILE A 71 8.972 8.455 0.922 1.00 0.00 H new ATOM 1008 N SER A 72 3.457 9.476 1.116 1.00 0.00 N ATOM 1009 CA SER A 72 2.196 8.997 0.574 1.00 0.00 C ATOM 1010 C SER A 72 2.450 7.846 -0.401 1.00 0.00 C ATOM 1011 O SER A 72 3.275 7.965 -1.306 1.00 0.00 O ATOM 1012 CB SER A 72 1.433 10.125 -0.123 1.00 0.00 C ATOM 1013 OG SER A 72 0.155 9.698 -0.586 1.00 0.00 O ATOM 0 H SER A 72 3.873 10.255 0.605 1.00 0.00 H new ATOM 0 HA SER A 72 1.583 8.636 1.400 1.00 0.00 H new ATOM 0 HB2 SER A 72 1.308 10.959 0.568 1.00 0.00 H new ATOM 0 HB3 SER A 72 2.019 10.493 -0.965 1.00 0.00 H new ATOM 0 HG SER A 72 -0.301 10.447 -1.023 1.00 0.00 H new ATOM 1019 N LEU A 73 1.726 6.758 -0.183 1.00 0.00 N ATOM 1020 CA LEU A 73 1.862 5.586 -1.032 1.00 0.00 C ATOM 1021 C LEU A 73 0.563 5.373 -1.812 1.00 0.00 C ATOM 1022 O LEU A 73 0.098 4.244 -1.953 1.00 0.00 O ATOM 1023 CB LEU A 73 2.288 4.372 -0.204 1.00 0.00 C ATOM 1024 CG LEU A 73 3.720 4.396 0.334 1.00 0.00 C ATOM 1025 CD1 LEU A 73 4.036 3.116 1.109 1.00 0.00 C ATOM 1026 CD2 LEU A 73 4.725 4.646 -0.793 1.00 0.00 C ATOM 0 H LEU A 73 1.043 6.663 0.569 1.00 0.00 H new ATOM 0 HA LEU A 73 2.654 5.737 -1.766 1.00 0.00 H new ATOM 0 HB2 LEU A 73 1.605 4.275 0.640 1.00 0.00 H new ATOM 0 HB3 LEU A 73 2.166 3.479 -0.816 1.00 0.00 H new ATOM 0 HG LEU A 73 3.808 5.227 1.034 1.00 0.00 H new ATOM 0 HD11 LEU A 73 5.060 3.159 1.480 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.349 3.021 1.950 1.00 0.00 H new ATOM 0 HD13 LEU A 73 3.925 2.255 0.450 1.00 0.00 H new ATOM 0 HD21 LEU A 73 5.735 4.658 -0.384 1.00 0.00 H new ATOM 0 HD22 LEU A 73 4.644 3.852 -1.535 1.00 0.00 H new ATOM 0 HD23 LEU A 73 4.513 5.606 -1.264 1.00 0.00 H new ATOM 1038 N VAL A 74 0.015 6.477 -2.299 1.00 0.00 N ATOM 1039 CA VAL A 74 -1.220 6.425 -3.062 1.00 0.00 C ATOM 1040 C VAL A 74 -0.931 6.790 -4.519 1.00 0.00 C ATOM 1041 O VAL A 74 -0.088 7.643 -4.794 1.00 0.00 O ATOM 1042 CB VAL A 74 -2.272 7.331 -2.416 1.00 0.00 C ATOM 1043 CG1 VAL A 74 -3.595 7.266 -3.182 1.00 0.00 C ATOM 1044 CG2 VAL A 74 -2.473 6.973 -0.942 1.00 0.00 C ATOM 0 H VAL A 74 0.404 7.412 -2.180 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.631 5.415 -3.056 1.00 0.00 H new ATOM 0 HB VAL A 74 -1.907 8.357 -2.464 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -4.325 7.918 -2.703 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -3.437 7.592 -4.210 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.967 6.241 -3.179 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -3.225 7.631 -0.507 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.806 5.938 -0.861 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -1.531 7.094 -0.406 1.00 0.00 H new ATOM 1054 N GLY A 75 -1.646 6.126 -5.415 1.00 0.00 N ATOM 1055 CA GLY A 75 -1.476 6.369 -6.837 1.00 0.00 C ATOM 1056 C GLY A 75 0.005 6.372 -7.220 1.00 0.00 C ATOM 1057 O GLY A 75 0.455 7.238 -7.969 1.00 0.00 O ATOM 0 H GLY A 75 -2.345 5.420 -5.184 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -2.001 5.601 -7.406 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.926 7.326 -7.102 1.00 0.00 H new ATOM 1061 N VAL A 76 0.722 5.392 -6.689 1.00 0.00 N ATOM 1062 CA VAL A 76 2.143 5.271 -6.966 1.00 0.00 C ATOM 1063 C VAL A 76 2.466 3.818 -7.323 1.00 0.00 C ATOM 1064 O VAL A 76 1.888 2.892 -6.757 1.00 0.00 O ATOM 1065 CB VAL A 76 2.954 5.788 -5.777 1.00 0.00 C ATOM 1066 CG1 VAL A 76 2.490 7.186 -5.363 1.00 0.00 C ATOM 1067 CG2 VAL A 76 2.881 4.815 -4.598 1.00 0.00 C ATOM 0 H VAL A 76 0.345 4.675 -6.069 1.00 0.00 H new ATOM 0 HA VAL A 76 2.419 5.886 -7.822 1.00 0.00 H new ATOM 0 HB VAL A 76 3.996 5.859 -6.089 1.00 0.00 H new ATOM 0 HG11 VAL A 76 3.083 7.530 -4.516 1.00 0.00 H new ATOM 0 HG12 VAL A 76 2.618 7.874 -6.199 1.00 0.00 H new ATOM 0 HG13 VAL A 76 1.438 7.151 -5.079 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.466 5.207 -3.766 1.00 0.00 H new ATOM 0 HG22 VAL A 76 1.843 4.697 -4.287 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.282 3.847 -4.900 1.00 0.00 H new ATOM 1077 N THR A 77 3.389 3.664 -8.261 1.00 0.00 N ATOM 1078 CA THR A 77 3.796 2.340 -8.701 1.00 0.00 C ATOM 1079 C THR A 77 4.541 1.612 -7.580 1.00 0.00 C ATOM 1080 O THR A 77 5.335 2.217 -6.862 1.00 0.00 O ATOM 1081 CB THR A 77 4.624 2.500 -9.977 1.00 0.00 C ATOM 1082 OG1 THR A 77 4.962 1.164 -10.341 1.00 0.00 O ATOM 1083 CG2 THR A 77 5.976 3.169 -9.719 1.00 0.00 C ATOM 0 H THR A 77 3.867 4.434 -8.729 1.00 0.00 H new ATOM 0 HA THR A 77 2.932 1.717 -8.933 1.00 0.00 H new ATOM 0 HB THR A 77 4.062 3.087 -10.703 1.00 0.00 H new ATOM 0 HG1 THR A 77 5.499 1.174 -11.161 1.00 0.00 H new ATOM 0 HG21 THR A 77 6.523 3.258 -10.658 1.00 0.00 H new ATOM 0 HG22 THR A 77 5.816 4.161 -9.297 1.00 0.00 H new ATOM 0 HG23 THR A 77 6.553 2.565 -9.019 1.00 0.00 H new ATOM 1091 N GLN A 78 4.258 0.323 -7.466 1.00 0.00 N ATOM 1092 CA GLN A 78 4.891 -0.495 -6.445 1.00 0.00 C ATOM 1093 C GLN A 78 6.351 -0.076 -6.260 1.00 0.00 C ATOM 1094 O GLN A 78 6.811 0.104 -5.133 1.00 0.00 O ATOM 1095 CB GLN A 78 4.787 -1.982 -6.790 1.00 0.00 C ATOM 1096 CG GLN A 78 5.135 -2.851 -5.581 1.00 0.00 C ATOM 1097 CD GLN A 78 6.024 -4.028 -5.989 1.00 0.00 C ATOM 1098 OE1 GLN A 78 6.679 -4.016 -7.018 1.00 0.00 O ATOM 1099 NE2 GLN A 78 6.010 -5.041 -5.127 1.00 0.00 N ATOM 0 H GLN A 78 3.599 -0.175 -8.064 1.00 0.00 H new ATOM 0 HA GLN A 78 4.365 -0.337 -5.503 1.00 0.00 H new ATOM 0 HB2 GLN A 78 3.776 -2.211 -7.128 1.00 0.00 H new ATOM 0 HB3 GLN A 78 5.459 -2.215 -7.616 1.00 0.00 H new ATOM 0 HG2 GLN A 78 5.646 -2.248 -4.830 1.00 0.00 H new ATOM 0 HG3 GLN A 78 4.220 -3.224 -5.121 1.00 0.00 H new ATOM 0 HE21 GLN A 78 5.439 -4.985 -4.284 1.00 0.00 H new ATOM 0 HE22 GLN A 78 6.571 -5.873 -5.309 1.00 0.00 H new ATOM 1108 N ASN A 79 7.040 0.066 -7.383 1.00 0.00 N ATOM 1109 CA ASN A 79 8.438 0.460 -7.359 1.00 0.00 C ATOM 1110 C ASN A 79 8.629 1.584 -6.338 1.00 0.00 C ATOM 1111 O ASN A 79 9.481 1.487 -5.456 1.00 0.00 O ATOM 1112 CB ASN A 79 8.887 0.981 -8.725 1.00 0.00 C ATOM 1113 CG ASN A 79 9.999 0.106 -9.308 1.00 0.00 C ATOM 1114 OD1 ASN A 79 9.778 -1.009 -9.753 1.00 0.00 O ATOM 1115 ND2 ASN A 79 11.203 0.670 -9.280 1.00 0.00 N ATOM 0 H ASN A 79 6.656 -0.085 -8.316 1.00 0.00 H new ATOM 0 HA ASN A 79 9.031 -0.416 -7.095 1.00 0.00 H new ATOM 0 HB2 ASN A 79 8.038 0.999 -9.408 1.00 0.00 H new ATOM 0 HB3 ASN A 79 9.240 2.008 -8.628 1.00 0.00 H new ATOM 0 HD21 ASN A 79 12.011 0.166 -9.645 1.00 0.00 H new ATOM 0 HD22 ASN A 79 11.318 1.607 -8.893 1.00 0.00 H new ATOM 1122 N PHE A 80 7.822 2.623 -6.492 1.00 0.00 N ATOM 1123 CA PHE A 80 7.892 3.764 -5.595 1.00 0.00 C ATOM 1124 C PHE A 80 7.807 3.318 -4.133 1.00 0.00 C ATOM 1125 O PHE A 80 8.726 3.560 -3.352 1.00 0.00 O ATOM 1126 CB PHE A 80 6.692 4.657 -5.913 1.00 0.00 C ATOM 1127 CG PHE A 80 6.606 5.916 -5.048 1.00 0.00 C ATOM 1128 CD1 PHE A 80 6.280 5.815 -3.731 1.00 0.00 C ATOM 1129 CD2 PHE A 80 6.856 7.136 -5.595 1.00 0.00 C ATOM 1130 CE1 PHE A 80 6.200 6.984 -2.928 1.00 0.00 C ATOM 1131 CE2 PHE A 80 6.777 8.304 -4.792 1.00 0.00 C ATOM 1132 CZ PHE A 80 6.450 8.203 -3.475 1.00 0.00 C ATOM 0 H PHE A 80 7.116 2.699 -7.224 1.00 0.00 H new ATOM 0 HA PHE A 80 8.838 4.288 -5.733 1.00 0.00 H new ATOM 0 HB2 PHE A 80 6.739 4.952 -6.961 1.00 0.00 H new ATOM 0 HB3 PHE A 80 5.777 4.078 -5.785 1.00 0.00 H new ATOM 0 HD1 PHE A 80 6.082 4.846 -3.296 1.00 0.00 H new ATOM 0 HD2 PHE A 80 7.115 7.216 -6.640 1.00 0.00 H new ATOM 0 HE1 PHE A 80 5.940 6.904 -1.883 1.00 0.00 H new ATOM 0 HE2 PHE A 80 6.976 9.273 -5.226 1.00 0.00 H new ATOM 0 HZ PHE A 80 6.389 9.092 -2.864 1.00 0.00 H new ATOM 1142 N ALA A 81 6.696 2.674 -3.808 1.00 0.00 N ATOM 1143 CA ALA A 81 6.479 2.192 -2.454 1.00 0.00 C ATOM 1144 C ALA A 81 7.689 1.366 -2.012 1.00 0.00 C ATOM 1145 O ALA A 81 8.216 1.567 -0.919 1.00 0.00 O ATOM 1146 CB ALA A 81 5.176 1.393 -2.399 1.00 0.00 C ATOM 0 H ALA A 81 5.936 2.475 -4.459 1.00 0.00 H new ATOM 0 HA ALA A 81 6.378 3.027 -1.761 1.00 0.00 H new ATOM 0 HB1 ALA A 81 5.013 1.032 -1.384 1.00 0.00 H new ATOM 0 HB2 ALA A 81 4.344 2.033 -2.694 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.240 0.544 -3.080 1.00 0.00 H new ATOM 1152 N ALA A 82 8.094 0.455 -2.884 1.00 0.00 N ATOM 1153 CA ALA A 82 9.231 -0.403 -2.597 1.00 0.00 C ATOM 1154 C ALA A 82 10.419 0.461 -2.168 1.00 0.00 C ATOM 1155 O ALA A 82 11.110 0.138 -1.202 1.00 0.00 O ATOM 1156 CB ALA A 82 9.547 -1.261 -3.824 1.00 0.00 C ATOM 0 H ALA A 82 7.655 0.292 -3.790 1.00 0.00 H new ATOM 0 HA ALA A 82 9.002 -1.082 -1.776 1.00 0.00 H new ATOM 0 HB1 ALA A 82 10.400 -1.904 -3.608 1.00 0.00 H new ATOM 0 HB2 ALA A 82 8.682 -1.876 -4.070 1.00 0.00 H new ATOM 0 HB3 ALA A 82 9.785 -0.614 -4.669 1.00 0.00 H new ATOM 1162 N THR A 83 10.621 1.542 -2.907 1.00 0.00 N ATOM 1163 CA THR A 83 11.714 2.454 -2.615 1.00 0.00 C ATOM 1164 C THR A 83 11.538 3.070 -1.225 1.00 0.00 C ATOM 1165 O THR A 83 12.484 3.120 -0.440 1.00 0.00 O ATOM 1166 CB THR A 83 11.775 3.493 -3.737 1.00 0.00 C ATOM 1167 OG1 THR A 83 12.171 2.744 -4.882 1.00 0.00 O ATOM 1168 CG2 THR A 83 12.910 4.501 -3.540 1.00 0.00 C ATOM 0 H THR A 83 10.047 1.807 -3.707 1.00 0.00 H new ATOM 0 HA THR A 83 12.669 1.930 -2.585 1.00 0.00 H new ATOM 0 HB THR A 83 10.824 4.023 -3.793 1.00 0.00 H new ATOM 0 HG1 THR A 83 11.399 2.257 -5.237 1.00 0.00 H new ATOM 0 HG21 THR A 83 12.909 5.216 -4.363 1.00 0.00 H new ATOM 0 HG22 THR A 83 12.766 5.031 -2.599 1.00 0.00 H new ATOM 0 HG23 THR A 83 13.864 3.975 -3.518 1.00 0.00 H new ATOM 1176 N VAL A 84 10.321 3.524 -0.964 1.00 0.00 N ATOM 1177 CA VAL A 84 10.009 4.134 0.317 1.00 0.00 C ATOM 1178 C VAL A 84 10.313 3.140 1.439 1.00 0.00 C ATOM 1179 O VAL A 84 11.078 3.444 2.353 1.00 0.00 O ATOM 1180 CB VAL A 84 8.558 4.620 0.326 1.00 0.00 C ATOM 1181 CG1 VAL A 84 8.156 5.122 1.714 1.00 0.00 C ATOM 1182 CG2 VAL A 84 8.335 5.700 -0.735 1.00 0.00 C ATOM 0 H VAL A 84 9.539 3.482 -1.618 1.00 0.00 H new ATOM 0 HA VAL A 84 10.633 5.012 0.483 1.00 0.00 H new ATOM 0 HB VAL A 84 7.919 3.772 0.080 1.00 0.00 H new ATOM 0 HG11 VAL A 84 7.120 5.461 1.692 1.00 0.00 H new ATOM 0 HG12 VAL A 84 8.258 4.313 2.437 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.803 5.950 2.003 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.296 6.028 -0.707 1.00 0.00 H new ATOM 0 HG22 VAL A 84 8.989 6.549 -0.534 1.00 0.00 H new ATOM 0 HG23 VAL A 84 8.561 5.294 -1.721 1.00 0.00 H new ATOM 1192 N LEU A 85 9.698 1.971 1.333 1.00 0.00 N ATOM 1193 CA LEU A 85 9.894 0.929 2.327 1.00 0.00 C ATOM 1194 C LEU A 85 11.392 0.663 2.492 1.00 0.00 C ATOM 1195 O LEU A 85 11.826 0.160 3.528 1.00 0.00 O ATOM 1196 CB LEU A 85 9.084 -0.317 1.964 1.00 0.00 C ATOM 1197 CG LEU A 85 7.578 -0.110 1.787 1.00 0.00 C ATOM 1198 CD1 LEU A 85 6.923 -1.350 1.174 1.00 0.00 C ATOM 1199 CD2 LEU A 85 6.921 0.290 3.109 1.00 0.00 C ATOM 0 H LEU A 85 9.064 1.722 0.574 1.00 0.00 H new ATOM 0 HA LEU A 85 9.519 1.253 3.298 1.00 0.00 H new ATOM 0 HB2 LEU A 85 9.485 -0.730 1.038 1.00 0.00 H new ATOM 0 HB3 LEU A 85 9.239 -1.066 2.741 1.00 0.00 H new ATOM 0 HG LEU A 85 7.426 0.713 1.089 1.00 0.00 H new ATOM 0 HD11 LEU A 85 5.853 -1.177 1.059 1.00 0.00 H new ATOM 0 HD12 LEU A 85 7.365 -1.550 0.198 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.083 -2.207 1.828 1.00 0.00 H new ATOM 0 HD21 LEU A 85 5.851 0.431 2.956 1.00 0.00 H new ATOM 0 HD22 LEU A 85 7.081 -0.496 3.847 1.00 0.00 H new ATOM 0 HD23 LEU A 85 7.362 1.220 3.468 1.00 0.00 H new ATOM 1211 N ARG A 86 12.140 1.012 1.456 1.00 0.00 N ATOM 1212 CA ARG A 86 13.580 0.817 1.474 1.00 0.00 C ATOM 1213 C ARG A 86 14.273 2.031 2.095 1.00 0.00 C ATOM 1214 O ARG A 86 15.376 1.917 2.626 1.00 0.00 O ATOM 1215 CB ARG A 86 14.123 0.596 0.061 1.00 0.00 C ATOM 1216 CG ARG A 86 13.952 -0.862 -0.370 1.00 0.00 C ATOM 1217 CD ARG A 86 15.197 -1.367 -1.103 1.00 0.00 C ATOM 1218 NE ARG A 86 16.203 -1.839 -0.125 1.00 0.00 N ATOM 1219 CZ ARG A 86 16.197 -3.058 0.431 1.00 0.00 C ATOM 1220 NH1 ARG A 86 15.237 -3.936 0.108 1.00 0.00 N ATOM 1221 NH2 ARG A 86 17.150 -3.399 1.309 1.00 0.00 N ATOM 0 H ARG A 86 11.776 1.429 0.599 1.00 0.00 H new ATOM 0 HA ARG A 86 13.787 -0.069 2.074 1.00 0.00 H new ATOM 0 HB2 ARG A 86 13.602 1.249 -0.639 1.00 0.00 H new ATOM 0 HB3 ARG A 86 15.178 0.868 0.026 1.00 0.00 H new ATOM 0 HG2 ARG A 86 13.764 -1.484 0.505 1.00 0.00 H new ATOM 0 HG3 ARG A 86 13.081 -0.953 -1.019 1.00 0.00 H new ATOM 0 HD2 ARG A 86 14.927 -2.178 -1.780 1.00 0.00 H new ATOM 0 HD3 ARG A 86 15.618 -0.569 -1.714 1.00 0.00 H new ATOM 0 HE ARG A 86 16.948 -1.196 0.143 1.00 0.00 H new ATOM 0 HH11 ARG A 86 14.512 -3.676 -0.561 1.00 0.00 H new ATOM 0 HH12 ARG A 86 15.232 -4.864 0.531 1.00 0.00 H new ATOM 0 HH21 ARG A 86 17.880 -2.730 1.554 1.00 0.00 H new ATOM 0 HH22 ARG A 86 17.145 -4.327 1.732 1.00 0.00 H new ATOM 1235 N ASN A 87 13.596 3.167 2.008 1.00 0.00 N ATOM 1236 CA ASN A 87 14.132 4.402 2.555 1.00 0.00 C ATOM 1237 C ASN A 87 13.890 4.433 4.065 1.00 0.00 C ATOM 1238 O ASN A 87 14.738 4.901 4.824 1.00 0.00 O ATOM 1239 CB ASN A 87 13.444 5.622 1.940 1.00 0.00 C ATOM 1240 CG ASN A 87 14.227 6.143 0.733 1.00 0.00 C ATOM 1241 OD1 ASN A 87 15.438 6.285 0.761 1.00 0.00 O ATOM 1242 ND2 ASN A 87 13.470 6.421 -0.324 1.00 0.00 N ATOM 0 H ASN A 87 12.681 3.258 1.567 1.00 0.00 H new ATOM 0 HA ASN A 87 15.197 4.437 2.327 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.432 5.357 1.635 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.356 6.410 2.688 1.00 0.00 H new ATOM 0 HD21 ASN A 87 13.898 6.776 -1.179 1.00 0.00 H new ATOM 0 HD22 ASN A 87 12.461 6.279 -0.280 1.00 0.00 H new ATOM 1249 N THR A 88 12.729 3.930 4.457 1.00 0.00 N ATOM 1250 CA THR A 88 12.364 3.895 5.863 1.00 0.00 C ATOM 1251 C THR A 88 13.586 3.566 6.722 1.00 0.00 C ATOM 1252 O THR A 88 14.555 2.985 6.234 1.00 0.00 O ATOM 1253 CB THR A 88 11.217 2.896 6.029 1.00 0.00 C ATOM 1254 OG1 THR A 88 11.636 1.759 5.280 1.00 0.00 O ATOM 1255 CG2 THR A 88 9.936 3.353 5.328 1.00 0.00 C ATOM 0 H THR A 88 12.028 3.543 3.825 1.00 0.00 H new ATOM 0 HA THR A 88 12.017 4.869 6.207 1.00 0.00 H new ATOM 0 HB THR A 88 11.016 2.747 7.090 1.00 0.00 H new ATOM 0 HG1 THR A 88 12.580 1.573 5.468 1.00 0.00 H new ATOM 0 HG21 THR A 88 9.154 2.608 5.477 1.00 0.00 H new ATOM 0 HG22 THR A 88 9.613 4.307 5.746 1.00 0.00 H new ATOM 0 HG23 THR A 88 10.127 3.470 4.261 1.00 0.00 H new ATOM 1263 N LYS A 89 13.501 3.951 7.987 1.00 0.00 N ATOM 1264 CA LYS A 89 14.588 3.704 8.919 1.00 0.00 C ATOM 1265 C LYS A 89 14.040 2.990 10.157 1.00 0.00 C ATOM 1266 O LYS A 89 12.910 2.506 10.149 1.00 0.00 O ATOM 1267 CB LYS A 89 15.328 5.005 9.237 1.00 0.00 C ATOM 1268 CG LYS A 89 15.564 5.825 7.967 1.00 0.00 C ATOM 1269 CD LYS A 89 14.654 7.054 7.930 1.00 0.00 C ATOM 1270 CE LYS A 89 15.311 8.200 7.158 1.00 0.00 C ATOM 1271 NZ LYS A 89 15.144 8.004 5.700 1.00 0.00 N ATOM 0 H LYS A 89 12.696 4.432 8.388 1.00 0.00 H new ATOM 0 HA LYS A 89 15.331 3.043 8.471 1.00 0.00 H new ATOM 0 HB2 LYS A 89 14.750 5.592 9.951 1.00 0.00 H new ATOM 0 HB3 LYS A 89 16.283 4.778 9.711 1.00 0.00 H new ATOM 0 HG2 LYS A 89 16.607 6.139 7.921 1.00 0.00 H new ATOM 0 HG3 LYS A 89 15.379 5.205 7.090 1.00 0.00 H new ATOM 0 HD2 LYS A 89 13.704 6.794 7.463 1.00 0.00 H new ATOM 0 HD3 LYS A 89 14.431 7.377 8.947 1.00 0.00 H new ATOM 0 HE2 LYS A 89 14.867 9.150 7.457 1.00 0.00 H new ATOM 0 HE3 LYS A 89 16.371 8.252 7.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 15.982 8.367 5.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 15.033 6.990 5.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 14.300 8.517 5.375 1.00 0.00 H new ATOM 1285 N GLY A 90 14.867 2.949 11.191 1.00 0.00 N ATOM 1286 CA GLY A 90 14.480 2.303 12.434 1.00 0.00 C ATOM 1287 C GLY A 90 12.962 2.339 12.621 1.00 0.00 C ATOM 1288 O GLY A 90 12.276 1.354 12.352 1.00 0.00 O ATOM 0 H GLY A 90 15.804 3.353 11.194 1.00 0.00 H new ATOM 0 HA2 GLY A 90 14.826 1.269 12.434 1.00 0.00 H new ATOM 0 HA3 GLY A 90 14.965 2.801 13.273 1.00 0.00 H new ATOM 1292 N ASN A 91 12.481 3.485 13.080 1.00 0.00 N ATOM 1293 CA ASN A 91 11.057 3.663 13.306 1.00 0.00 C ATOM 1294 C ASN A 91 10.381 4.049 11.989 1.00 0.00 C ATOM 1295 O ASN A 91 10.932 4.822 11.207 1.00 0.00 O ATOM 1296 CB ASN A 91 10.795 4.781 14.317 1.00 0.00 C ATOM 1297 CG ASN A 91 9.308 4.867 14.667 1.00 0.00 C ATOM 1298 OD1 ASN A 91 8.573 5.702 14.166 1.00 0.00 O ATOM 1299 ND2 ASN A 91 8.907 3.959 15.552 1.00 0.00 N ATOM 0 H ASN A 91 13.053 4.300 13.302 1.00 0.00 H new ATOM 0 HA ASN A 91 10.657 2.726 13.693 1.00 0.00 H new ATOM 0 HB2 ASN A 91 11.375 4.601 15.222 1.00 0.00 H new ATOM 0 HB3 ASN A 91 11.131 5.733 13.907 1.00 0.00 H new ATOM 0 HD21 ASN A 91 7.932 3.933 15.850 1.00 0.00 H new ATOM 0 HD22 ASN A 91 9.575 3.288 15.933 1.00 0.00 H new ATOM 1306 N VAL A 92 9.196 3.492 11.784 1.00 0.00 N ATOM 1307 CA VAL A 92 8.438 3.768 10.576 1.00 0.00 C ATOM 1308 C VAL A 92 6.952 3.877 10.924 1.00 0.00 C ATOM 1309 O VAL A 92 6.397 2.994 11.576 1.00 0.00 O ATOM 1310 CB VAL A 92 8.728 2.699 9.521 1.00 0.00 C ATOM 1311 CG1 VAL A 92 8.036 3.032 8.198 1.00 0.00 C ATOM 1312 CG2 VAL A 92 10.234 2.519 9.321 1.00 0.00 C ATOM 0 H VAL A 92 8.742 2.851 12.435 1.00 0.00 H new ATOM 0 HA VAL A 92 8.741 4.722 10.145 1.00 0.00 H new ATOM 0 HB VAL A 92 8.323 1.754 9.883 1.00 0.00 H new ATOM 0 HG11 VAL A 92 8.259 2.256 7.466 1.00 0.00 H new ATOM 0 HG12 VAL A 92 6.959 3.085 8.354 1.00 0.00 H new ATOM 0 HG13 VAL A 92 8.397 3.992 7.830 1.00 0.00 H new ATOM 0 HG21 VAL A 92 10.412 1.753 8.566 1.00 0.00 H new ATOM 0 HG22 VAL A 92 10.673 3.461 8.993 1.00 0.00 H new ATOM 0 HG23 VAL A 92 10.692 2.214 10.262 1.00 0.00 H new ATOM 1322 N ARG A 93 6.350 4.968 10.474 1.00 0.00 N ATOM 1323 CA ARG A 93 4.939 5.204 10.730 1.00 0.00 C ATOM 1324 C ARG A 93 4.107 4.828 9.502 1.00 0.00 C ATOM 1325 O ARG A 93 4.081 5.564 8.517 1.00 0.00 O ATOM 1326 CB ARG A 93 4.681 6.670 11.083 1.00 0.00 C ATOM 1327 CG ARG A 93 4.055 6.797 12.474 1.00 0.00 C ATOM 1328 CD ARG A 93 5.108 7.177 13.517 1.00 0.00 C ATOM 1329 NE ARG A 93 4.447 7.657 14.751 1.00 0.00 N ATOM 1330 CZ ARG A 93 5.074 8.328 15.726 1.00 0.00 C ATOM 1331 NH1 ARG A 93 6.381 8.604 15.617 1.00 0.00 N ATOM 1332 NH2 ARG A 93 4.395 8.725 16.811 1.00 0.00 N ATOM 0 H ARG A 93 6.813 5.698 9.934 1.00 0.00 H new ATOM 0 HA ARG A 93 4.647 4.582 11.576 1.00 0.00 H new ATOM 0 HB2 ARG A 93 5.618 7.226 11.050 1.00 0.00 H new ATOM 0 HB3 ARG A 93 4.019 7.116 10.340 1.00 0.00 H new ATOM 0 HG2 ARG A 93 3.268 7.551 12.455 1.00 0.00 H new ATOM 0 HG3 ARG A 93 3.586 5.854 12.753 1.00 0.00 H new ATOM 0 HD2 ARG A 93 5.736 6.315 13.743 1.00 0.00 H new ATOM 0 HD3 ARG A 93 5.762 7.953 13.120 1.00 0.00 H new ATOM 0 HE ARG A 93 3.452 7.465 14.866 1.00 0.00 H new ATOM 0 HH11 ARG A 93 6.899 8.303 14.791 1.00 0.00 H new ATOM 0 HH12 ARG A 93 6.858 9.115 16.360 1.00 0.00 H new ATOM 0 HH21 ARG A 93 3.400 8.516 16.895 1.00 0.00 H new ATOM 0 HH22 ARG A 93 4.873 9.236 17.553 1.00 0.00 H new ATOM 1346 N PHE A 94 3.447 3.684 9.602 1.00 0.00 N ATOM 1347 CA PHE A 94 2.616 3.202 8.512 1.00 0.00 C ATOM 1348 C PHE A 94 1.146 3.554 8.746 1.00 0.00 C ATOM 1349 O PHE A 94 0.543 3.104 9.719 1.00 0.00 O ATOM 1350 CB PHE A 94 2.764 1.679 8.476 1.00 0.00 C ATOM 1351 CG PHE A 94 4.156 1.199 8.060 1.00 0.00 C ATOM 1352 CD1 PHE A 94 4.478 1.109 6.741 1.00 0.00 C ATOM 1353 CD2 PHE A 94 5.071 0.862 9.008 1.00 0.00 C ATOM 1354 CE1 PHE A 94 5.770 0.663 6.355 1.00 0.00 C ATOM 1355 CE2 PHE A 94 6.362 0.416 8.621 1.00 0.00 C ATOM 1356 CZ PHE A 94 6.684 0.326 7.303 1.00 0.00 C ATOM 0 H PHE A 94 3.471 3.077 10.421 1.00 0.00 H new ATOM 0 HA PHE A 94 2.928 3.663 7.575 1.00 0.00 H new ATOM 0 HB2 PHE A 94 2.533 1.278 9.463 1.00 0.00 H new ATOM 0 HB3 PHE A 94 2.028 1.269 7.785 1.00 0.00 H new ATOM 0 HD1 PHE A 94 3.751 1.377 5.988 1.00 0.00 H new ATOM 0 HD2 PHE A 94 4.816 0.934 10.055 1.00 0.00 H new ATOM 0 HE1 PHE A 94 6.026 0.592 5.308 1.00 0.00 H new ATOM 0 HE2 PHE A 94 7.089 0.148 9.374 1.00 0.00 H new ATOM 0 HZ PHE A 94 7.666 -0.013 7.009 1.00 0.00 H new ATOM 1366 N VAL A 95 0.611 4.356 7.837 1.00 0.00 N ATOM 1367 CA VAL A 95 -0.777 4.774 7.932 1.00 0.00 C ATOM 1368 C VAL A 95 -1.649 3.826 7.107 1.00 0.00 C ATOM 1369 O VAL A 95 -1.818 4.020 5.904 1.00 0.00 O ATOM 1370 CB VAL A 95 -0.914 6.237 7.504 1.00 0.00 C ATOM 1371 CG1 VAL A 95 -2.284 6.498 6.874 1.00 0.00 C ATOM 1372 CG2 VAL A 95 -0.664 7.179 8.683 1.00 0.00 C ATOM 0 H VAL A 95 1.114 4.727 7.031 1.00 0.00 H new ATOM 0 HA VAL A 95 -1.122 4.717 8.964 1.00 0.00 H new ATOM 0 HB VAL A 95 -0.154 6.438 6.749 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.355 7.545 6.579 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.407 5.864 5.996 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -3.067 6.271 7.598 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -0.768 8.212 8.352 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -1.389 6.976 9.471 1.00 0.00 H new ATOM 0 HG23 VAL A 95 0.343 7.021 9.068 1.00 0.00 H new ATOM 1382 N ILE A 96 -2.179 2.819 7.786 1.00 0.00 N ATOM 1383 CA ILE A 96 -3.029 1.840 7.131 1.00 0.00 C ATOM 1384 C ILE A 96 -4.439 2.415 6.978 1.00 0.00 C ATOM 1385 O ILE A 96 -4.835 3.304 7.730 1.00 0.00 O ATOM 1386 CB ILE A 96 -2.987 0.507 7.881 1.00 0.00 C ATOM 1387 CG1 ILE A 96 -1.583 0.226 8.421 1.00 0.00 C ATOM 1388 CG2 ILE A 96 -3.501 -0.634 7.000 1.00 0.00 C ATOM 1389 CD1 ILE A 96 -0.524 0.458 7.342 1.00 0.00 C ATOM 0 H ILE A 96 -2.036 2.660 8.783 1.00 0.00 H new ATOM 0 HA ILE A 96 -2.661 1.627 6.127 1.00 0.00 H new ATOM 0 HB ILE A 96 -3.655 0.577 8.740 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -1.383 0.871 9.277 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -1.525 -0.803 8.777 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.461 -1.570 7.557 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -4.531 -0.431 6.706 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -2.878 -0.715 6.109 1.00 0.00 H new ATOM 0 HD11 ILE A 96 0.465 0.251 7.752 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -0.713 -0.206 6.498 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -0.568 1.494 7.006 1.00 0.00 H new ATOM 1401 N GLY A 97 -5.157 1.884 6.000 1.00 0.00 N ATOM 1402 CA GLY A 97 -6.514 2.333 5.739 1.00 0.00 C ATOM 1403 C GLY A 97 -7.491 1.155 5.738 1.00 0.00 C ATOM 1404 O GLY A 97 -7.447 0.309 4.847 1.00 0.00 O ATOM 0 H GLY A 97 -4.825 1.147 5.378 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -6.813 3.057 6.496 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -6.553 2.843 4.777 1.00 0.00 H new ATOM 1408 N ARG A 98 -8.350 1.139 6.747 1.00 0.00 N ATOM 1409 CA ARG A 98 -9.336 0.080 6.873 1.00 0.00 C ATOM 1410 C ARG A 98 -10.749 0.667 6.882 1.00 0.00 C ATOM 1411 O ARG A 98 -10.947 1.809 7.294 1.00 0.00 O ATOM 1412 CB ARG A 98 -9.118 -0.725 8.156 1.00 0.00 C ATOM 1413 CG ARG A 98 -8.757 -2.178 7.837 1.00 0.00 C ATOM 1414 CD ARG A 98 -7.354 -2.517 8.344 1.00 0.00 C ATOM 1415 NE ARG A 98 -7.336 -3.888 8.902 1.00 0.00 N ATOM 1416 CZ ARG A 98 -7.541 -4.997 8.179 1.00 0.00 C ATOM 1417 NH1 ARG A 98 -7.781 -4.903 6.864 1.00 0.00 N ATOM 1418 NH2 ARG A 98 -7.506 -6.199 8.770 1.00 0.00 N ATOM 0 H ARG A 98 -8.383 1.843 7.485 1.00 0.00 H new ATOM 0 HA ARG A 98 -9.220 -0.584 6.016 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -8.322 -0.269 8.745 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -10.021 -0.696 8.766 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -9.485 -2.847 8.296 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -8.808 -2.342 6.761 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -6.635 -2.438 7.529 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -7.051 -1.801 9.108 1.00 0.00 H new ATOM 0 HE ARG A 98 -7.156 -3.995 9.900 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -7.807 -3.988 6.415 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -7.937 -5.747 6.313 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -7.323 -6.270 9.771 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -7.662 -7.043 8.219 1.00 0.00 H new ATOM 1432 N GLU A 99 -11.694 -0.140 6.423 1.00 0.00 N ATOM 1433 CA GLU A 99 -13.082 0.286 6.373 1.00 0.00 C ATOM 1434 C GLU A 99 -13.605 0.559 7.785 1.00 0.00 C ATOM 1435 O GLU A 99 -13.273 -0.163 8.724 1.00 0.00 O ATOM 1436 CB GLU A 99 -13.949 -0.753 5.659 1.00 0.00 C ATOM 1437 CG GLU A 99 -14.562 -0.172 4.383 1.00 0.00 C ATOM 1438 CD GLU A 99 -15.292 -1.254 3.584 1.00 0.00 C ATOM 1439 OE1 GLU A 99 -16.155 -1.923 4.192 1.00 0.00 O ATOM 1440 OE2 GLU A 99 -14.971 -1.386 2.383 1.00 0.00 O ATOM 0 H GLU A 99 -11.526 -1.087 6.082 1.00 0.00 H new ATOM 0 HA GLU A 99 -13.137 1.212 5.801 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -13.346 -1.627 5.412 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -14.742 -1.091 6.326 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -15.258 0.627 4.640 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -13.779 0.273 3.769 1.00 0.00 H new