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+ -174:sc= 0.596 (180deg=0.375) USER MOD Set 1.2: A 88 THR OG1 : rot -93:sc= 0.568 USER MOD Single : A 25 SER OG : rot 180:sc= 0 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+ 169:sc= 0 (180deg=-0.139) USER MOD Single : A 46 THR OG1 : rot 73:sc= -0.564! USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= -1.5 K(o=-1.5,f=-9!) USER MOD Single : A 60 GLN : amide:sc= -0.519 K(o=-0.52,f=-3.1!) USER MOD Single : A 62 ASN : amide:sc= -2.82! X(o=-2.8!,f=-3.1) USER MOD Single : A 64 GLN : amide:sc= 0 K(o=0,f=-0.66) 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 X(o=0,f=-0.035) USER MOD Single : A 79 ASN : amide:sc= -0.0022 X(o=-0.0022,f=-0.03) USER MOD Single : A 83 THR OG1 : rot 82:sc= 0.0931 USER MOD Single : A 87 ASN : amide:sc= -0.408 X(o=-0.41,f=-0.086) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -0.0434 X(o=-0.043,f=-0.0029) USER MOD ----------------------------------------------------------------- ATOM 85 N GLU A 9 -10.386 4.378 7.514 1.00 0.00 N ATOM 86 CA GLU A 9 -9.757 4.632 8.799 1.00 0.00 C ATOM 87 C GLU A 9 -8.239 4.733 8.635 1.00 0.00 C ATOM 88 O GLU A 9 -7.542 3.719 8.628 1.00 0.00 O ATOM 89 CB GLU A 9 -10.128 3.549 9.815 1.00 0.00 C ATOM 90 CG GLU A 9 -8.972 3.287 10.782 1.00 0.00 C ATOM 91 CD GLU A 9 -9.488 2.751 12.120 1.00 0.00 C ATOM 92 OE1 GLU A 9 -10.421 3.382 12.662 1.00 0.00 O ATOM 93 OE2 GLU A 9 -8.937 1.723 12.570 1.00 0.00 O ATOM 0 HA GLU A 9 -10.126 5.584 9.181 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -11.012 3.857 10.374 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -10.386 2.628 9.292 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -8.280 2.570 10.341 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -8.414 4.209 10.946 1.00 0.00 H new ATOM 100 N LEU A 10 -7.770 5.966 8.508 1.00 0.00 N ATOM 101 CA LEU A 10 -6.348 6.213 8.345 1.00 0.00 C ATOM 102 C LEU A 10 -5.722 6.484 9.714 1.00 0.00 C ATOM 103 O LEU A 10 -5.988 7.516 10.329 1.00 0.00 O ATOM 104 CB LEU A 10 -6.111 7.331 7.328 1.00 0.00 C ATOM 105 CG LEU A 10 -6.760 7.138 5.955 1.00 0.00 C ATOM 106 CD1 LEU A 10 -6.575 5.703 5.459 1.00 0.00 C ATOM 107 CD2 LEU A 10 -8.233 7.550 5.982 1.00 0.00 C ATOM 0 H LEU A 10 -8.350 6.805 8.515 1.00 0.00 H new ATOM 0 HA LEU A 10 -5.853 5.332 7.936 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -6.478 8.265 7.753 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -5.036 7.445 7.187 1.00 0.00 H new ATOM 0 HG LEU A 10 -6.256 7.792 5.244 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -7.045 5.592 4.482 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -5.511 5.481 5.377 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -7.037 5.012 6.164 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -8.670 7.403 4.994 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -8.768 6.940 6.710 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -8.312 8.601 6.261 1.00 0.00 H new ATOM 119 N PHE A 11 -4.901 5.541 10.152 1.00 0.00 N ATOM 120 CA PHE A 11 -4.235 5.665 11.437 1.00 0.00 C ATOM 121 C PHE A 11 -2.742 5.351 11.313 1.00 0.00 C ATOM 122 O PHE A 11 -2.361 4.376 10.669 1.00 0.00 O ATOM 123 CB PHE A 11 -4.882 4.647 12.377 1.00 0.00 C ATOM 124 CG PHE A 11 -4.900 3.218 11.829 1.00 0.00 C ATOM 125 CD1 PHE A 11 -5.829 2.856 10.904 1.00 0.00 C ATOM 126 CD2 PHE A 11 -3.987 2.310 12.268 1.00 0.00 C ATOM 127 CE1 PHE A 11 -5.845 1.530 10.396 1.00 0.00 C ATOM 128 CE2 PHE A 11 -4.004 0.984 11.759 1.00 0.00 C ATOM 129 CZ PHE A 11 -4.933 0.622 10.834 1.00 0.00 C ATOM 0 H PHE A 11 -4.682 4.687 9.639 1.00 0.00 H new ATOM 0 HA PHE A 11 -4.335 6.684 11.811 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -4.348 4.654 13.327 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -5.906 4.959 12.585 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -6.554 3.577 10.556 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -3.250 2.597 13.003 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -6.582 1.243 9.661 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -3.279 0.263 12.107 1.00 0.00 H new ATOM 0 HZ PHE A 11 -4.946 -0.386 10.448 1.00 0.00 H new ATOM 139 N PRO A 12 -1.917 6.219 11.959 1.00 0.00 N ATOM 140 CA PRO A 12 -0.475 6.044 11.927 1.00 0.00 C ATOM 141 C PRO A 12 -0.042 4.897 12.843 1.00 0.00 C ATOM 142 O PRO A 12 -0.505 4.795 13.978 1.00 0.00 O ATOM 143 CB PRO A 12 0.094 7.388 12.350 1.00 0.00 C ATOM 144 CG PRO A 12 -1.041 8.120 13.047 1.00 0.00 C ATOM 145 CD PRO A 12 -2.334 7.385 12.732 1.00 0.00 C ATOM 0 HA PRO A 12 -0.107 5.764 10.940 1.00 0.00 H new ATOM 0 HB2 PRO A 12 0.945 7.259 13.019 1.00 0.00 H new ATOM 0 HB3 PRO A 12 0.450 7.951 11.487 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -0.872 8.150 14.123 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -1.096 9.153 12.704 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -2.855 7.091 13.643 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -3.019 8.014 12.163 1.00 0.00 H new ATOM 153 N VAL A 13 0.841 4.062 12.315 1.00 0.00 N ATOM 154 CA VAL A 13 1.342 2.927 13.071 1.00 0.00 C ATOM 155 C VAL A 13 2.872 2.960 13.080 1.00 0.00 C ATOM 156 O VAL A 13 3.501 3.024 12.025 1.00 0.00 O ATOM 157 CB VAL A 13 0.776 1.626 12.498 1.00 0.00 C ATOM 158 CG1 VAL A 13 1.544 0.413 13.027 1.00 0.00 C ATOM 159 CG2 VAL A 13 -0.720 1.500 12.796 1.00 0.00 C ATOM 0 H VAL A 13 1.222 4.149 11.373 1.00 0.00 H new ATOM 0 HA VAL A 13 1.010 2.982 14.108 1.00 0.00 H new ATOM 0 HB VAL A 13 0.901 1.655 11.416 1.00 0.00 H new ATOM 0 HG11 VAL A 13 1.121 -0.498 12.604 1.00 0.00 H new ATOM 0 HG12 VAL A 13 2.593 0.493 12.741 1.00 0.00 H new ATOM 0 HG13 VAL A 13 1.466 0.379 14.114 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -1.097 0.567 12.378 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -0.878 1.504 13.875 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.252 2.339 12.348 1.00 0.00 H new ATOM 169 N GLU A 14 3.426 2.915 14.283 1.00 0.00 N ATOM 170 CA GLU A 14 4.870 2.939 14.443 1.00 0.00 C ATOM 171 C GLU A 14 5.441 1.525 14.321 1.00 0.00 C ATOM 172 O GLU A 14 4.790 0.553 14.702 1.00 0.00 O ATOM 173 CB GLU A 14 5.262 3.575 15.778 1.00 0.00 C ATOM 174 CG GLU A 14 4.970 5.077 15.776 1.00 0.00 C ATOM 175 CD GLU A 14 4.230 5.493 17.049 1.00 0.00 C ATOM 176 OE1 GLU A 14 3.101 4.992 17.238 1.00 0.00 O ATOM 177 OE2 GLU A 14 4.811 6.302 17.805 1.00 0.00 O ATOM 0 H GLU A 14 2.901 2.862 15.156 1.00 0.00 H new ATOM 0 HA GLU A 14 5.295 3.551 13.647 1.00 0.00 H new ATOM 0 HB2 GLU A 14 4.713 3.095 16.589 1.00 0.00 H new ATOM 0 HB3 GLU A 14 6.322 3.407 15.968 1.00 0.00 H new ATOM 0 HG2 GLU A 14 5.904 5.633 15.696 1.00 0.00 H new ATOM 0 HG3 GLU A 14 4.371 5.334 14.902 1.00 0.00 H new ATOM 184 N LEU A 15 6.652 1.454 13.787 1.00 0.00 N ATOM 185 CA LEU A 15 7.318 0.176 13.610 1.00 0.00 C ATOM 186 C LEU A 15 8.832 0.377 13.702 1.00 0.00 C ATOM 187 O LEU A 15 9.377 1.301 13.100 1.00 0.00 O ATOM 188 CB LEU A 15 6.865 -0.489 12.308 1.00 0.00 C ATOM 189 CG LEU A 15 5.900 -1.667 12.457 1.00 0.00 C ATOM 190 CD1 LEU A 15 5.632 -2.331 11.105 1.00 0.00 C ATOM 191 CD2 LEU A 15 6.413 -2.668 13.495 1.00 0.00 C ATOM 0 H LEU A 15 7.189 2.262 13.471 1.00 0.00 H new ATOM 0 HA LEU A 15 7.038 -0.512 14.407 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.390 0.267 11.683 1.00 0.00 H new ATOM 0 HB3 LEU A 15 7.749 -0.835 11.773 1.00 0.00 H new ATOM 0 HG LEU A 15 4.947 -1.284 12.822 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.943 -3.165 11.239 1.00 0.00 H new ATOM 0 HD12 LEU A 15 5.192 -1.603 10.423 1.00 0.00 H new ATOM 0 HD13 LEU A 15 6.570 -2.698 10.688 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.709 -3.495 13.582 1.00 0.00 H new ATOM 0 HD22 LEU A 15 7.385 -3.050 13.183 1.00 0.00 H new ATOM 0 HD23 LEU A 15 6.511 -2.172 14.461 1.00 0.00 H new ATOM 203 N GLU A 16 9.469 -0.503 14.461 1.00 0.00 N ATOM 204 CA GLU A 16 10.909 -0.434 14.640 1.00 0.00 C ATOM 205 C GLU A 16 11.600 -1.515 13.807 1.00 0.00 C ATOM 206 O GLU A 16 11.513 -2.700 14.126 1.00 0.00 O ATOM 207 CB GLU A 16 11.284 -0.557 16.118 1.00 0.00 C ATOM 208 CG GLU A 16 11.760 0.786 16.676 1.00 0.00 C ATOM 209 CD GLU A 16 12.742 0.582 17.832 1.00 0.00 C ATOM 210 OE1 GLU A 16 13.890 0.185 17.537 1.00 0.00 O ATOM 211 OE2 GLU A 16 12.323 0.828 18.983 1.00 0.00 O ATOM 0 H GLU A 16 9.014 -1.268 14.959 1.00 0.00 H new ATOM 0 HA GLU A 16 11.253 0.540 14.292 1.00 0.00 H new ATOM 0 HB2 GLU A 16 10.423 -0.907 16.688 1.00 0.00 H new ATOM 0 HB3 GLU A 16 12.070 -1.303 16.237 1.00 0.00 H new ATOM 0 HG2 GLU A 16 12.239 1.363 15.885 1.00 0.00 H new ATOM 0 HG3 GLU A 16 10.903 1.365 17.020 1.00 0.00 H new ATOM 218 N LYS A 17 12.271 -1.068 12.755 1.00 0.00 N ATOM 219 CA LYS A 17 12.977 -1.983 11.874 1.00 0.00 C ATOM 220 C LYS A 17 13.688 -3.046 12.714 1.00 0.00 C ATOM 221 O LYS A 17 14.150 -2.764 13.818 1.00 0.00 O ATOM 222 CB LYS A 17 13.911 -1.212 10.939 1.00 0.00 C ATOM 223 CG LYS A 17 13.150 -0.672 9.727 1.00 0.00 C ATOM 224 CD LYS A 17 14.108 -0.046 8.711 1.00 0.00 C ATOM 225 CE LYS A 17 13.512 -0.078 7.303 1.00 0.00 C ATOM 226 NZ LYS A 17 14.388 0.643 6.353 1.00 0.00 N ATOM 0 H LYS A 17 12.341 -0.085 12.493 1.00 0.00 H new ATOM 0 HA LYS A 17 12.274 -2.506 11.225 1.00 0.00 H new ATOM 0 HB2 LYS A 17 14.373 -0.386 11.480 1.00 0.00 H new ATOM 0 HB3 LYS A 17 14.717 -1.865 10.605 1.00 0.00 H new ATOM 0 HG2 LYS A 17 12.591 -1.480 9.255 1.00 0.00 H new ATOM 0 HG3 LYS A 17 12.422 0.072 10.052 1.00 0.00 H new ATOM 0 HD2 LYS A 17 14.323 0.984 8.995 1.00 0.00 H new ATOM 0 HD3 LYS A 17 15.056 -0.584 8.721 1.00 0.00 H new ATOM 0 HE2 LYS A 17 13.386 -1.111 6.978 1.00 0.00 H new ATOM 0 HE3 LYS A 17 12.521 0.377 7.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 13.921 0.700 5.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 14.570 1.603 6.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 15.289 0.133 6.257 1.00 0.00 H new ATOM 240 N ASP A 18 13.752 -4.247 12.158 1.00 0.00 N ATOM 241 CA ASP A 18 14.399 -5.355 12.841 1.00 0.00 C ATOM 242 C ASP A 18 15.580 -5.846 12.003 1.00 0.00 C ATOM 243 O ASP A 18 15.801 -5.364 10.893 1.00 0.00 O ATOM 244 CB ASP A 18 13.432 -6.526 13.029 1.00 0.00 C ATOM 245 CG ASP A 18 11.950 -6.167 12.905 1.00 0.00 C ATOM 246 OD1 ASP A 18 11.531 -5.230 13.617 1.00 0.00 O ATOM 247 OD2 ASP A 18 11.270 -6.839 12.099 1.00 0.00 O ATOM 0 H ASP A 18 13.366 -4.477 11.242 1.00 0.00 H new ATOM 0 HA ASP A 18 14.731 -5.002 13.817 1.00 0.00 H new ATOM 0 HB2 ASP A 18 13.667 -7.294 12.292 1.00 0.00 H new ATOM 0 HB3 ASP A 18 13.603 -6.965 14.012 1.00 0.00 H new ATOM 252 N GLU A 19 16.307 -6.800 12.565 1.00 0.00 N ATOM 253 CA GLU A 19 17.460 -7.363 11.883 1.00 0.00 C ATOM 254 C GLU A 19 17.148 -7.575 10.400 1.00 0.00 C ATOM 255 O GLU A 19 18.048 -7.546 9.562 1.00 0.00 O ATOM 256 CB GLU A 19 17.904 -8.670 12.542 1.00 0.00 C ATOM 257 CG GLU A 19 16.726 -9.633 12.699 1.00 0.00 C ATOM 258 CD GLU A 19 17.180 -10.961 13.308 1.00 0.00 C ATOM 259 OE1 GLU A 19 17.641 -10.925 14.469 1.00 0.00 O ATOM 260 OE2 GLU A 19 17.056 -11.982 12.598 1.00 0.00 O ATOM 0 H GLU A 19 16.120 -7.198 13.485 1.00 0.00 H new ATOM 0 HA GLU A 19 18.286 -6.656 11.964 1.00 0.00 H new ATOM 0 HB2 GLU A 19 18.683 -9.138 11.941 1.00 0.00 H new ATOM 0 HB3 GLU A 19 18.339 -8.459 13.519 1.00 0.00 H new ATOM 0 HG2 GLU A 19 15.964 -9.180 13.333 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.267 -9.813 11.727 1.00 0.00 H new ATOM 267 N ASP A 20 15.870 -7.785 10.121 1.00 0.00 N ATOM 268 CA ASP A 20 15.428 -8.002 8.754 1.00 0.00 C ATOM 269 C ASP A 20 14.449 -6.895 8.357 1.00 0.00 C ATOM 270 O ASP A 20 13.364 -7.174 7.848 1.00 0.00 O ATOM 271 CB ASP A 20 14.705 -9.344 8.616 1.00 0.00 C ATOM 272 CG ASP A 20 14.678 -9.920 7.199 1.00 0.00 C ATOM 273 OD1 ASP A 20 13.970 -9.326 6.358 1.00 0.00 O ATOM 274 OD2 ASP A 20 15.366 -10.943 6.989 1.00 0.00 O ATOM 0 H ASP A 20 15.126 -7.809 10.819 1.00 0.00 H new ATOM 0 HA ASP A 20 16.308 -7.998 8.110 1.00 0.00 H new ATOM 0 HB2 ASP A 20 15.183 -10.067 9.277 1.00 0.00 H new ATOM 0 HB3 ASP A 20 13.679 -9.224 8.963 1.00 0.00 H new ATOM 279 N GLY A 21 14.867 -5.663 8.605 1.00 0.00 N ATOM 280 CA GLY A 21 14.041 -4.513 8.279 1.00 0.00 C ATOM 281 C GLY A 21 12.693 -4.584 9.000 1.00 0.00 C ATOM 282 O GLY A 21 12.605 -5.110 10.108 1.00 0.00 O ATOM 0 H GLY A 21 15.767 -5.436 9.028 1.00 0.00 H new ATOM 0 HA2 GLY A 21 14.560 -3.597 8.560 1.00 0.00 H new ATOM 0 HA3 GLY A 21 13.880 -4.470 7.202 1.00 0.00 H new ATOM 286 N LEU A 22 11.677 -4.047 8.341 1.00 0.00 N ATOM 287 CA LEU A 22 10.338 -4.043 8.905 1.00 0.00 C ATOM 288 C LEU A 22 9.869 -5.486 9.104 1.00 0.00 C ATOM 289 O LEU A 22 9.546 -5.889 10.220 1.00 0.00 O ATOM 290 CB LEU A 22 9.395 -3.204 8.041 1.00 0.00 C ATOM 291 CG LEU A 22 9.894 -1.806 7.667 1.00 0.00 C ATOM 292 CD1 LEU A 22 9.336 -1.370 6.311 1.00 0.00 C ATOM 293 CD2 LEU A 22 9.573 -0.796 8.771 1.00 0.00 C ATOM 0 H LEU A 22 11.754 -3.612 7.422 1.00 0.00 H new ATOM 0 HA LEU A 22 10.340 -3.569 9.887 1.00 0.00 H new ATOM 0 HB2 LEU A 22 9.191 -3.753 7.122 1.00 0.00 H new ATOM 0 HB3 LEU A 22 8.446 -3.101 8.568 1.00 0.00 H new ATOM 0 HG LEU A 22 10.979 -1.844 7.571 1.00 0.00 H new ATOM 0 HD11 LEU A 22 9.706 -0.374 6.069 1.00 0.00 H new ATOM 0 HD12 LEU A 22 9.657 -2.073 5.542 1.00 0.00 H new ATOM 0 HD13 LEU A 22 8.247 -1.352 6.354 1.00 0.00 H new ATOM 0 HD21 LEU A 22 9.938 0.189 8.480 1.00 0.00 H new ATOM 0 HD22 LEU A 22 8.494 -0.753 8.922 1.00 0.00 H new ATOM 0 HD23 LEU A 22 10.058 -1.104 9.698 1.00 0.00 H new ATOM 305 N GLY A 23 9.846 -6.224 8.004 1.00 0.00 N ATOM 306 CA GLY A 23 9.422 -7.613 8.043 1.00 0.00 C ATOM 307 C GLY A 23 7.972 -7.757 7.575 1.00 0.00 C ATOM 308 O GLY A 23 7.148 -8.351 8.269 1.00 0.00 O ATOM 0 H GLY A 23 10.114 -5.886 7.080 1.00 0.00 H new ATOM 0 HA2 GLY A 23 10.074 -8.214 7.409 1.00 0.00 H new ATOM 0 HA3 GLY A 23 9.520 -7.999 9.058 1.00 0.00 H new ATOM 312 N ILE A 24 7.705 -7.204 6.401 1.00 0.00 N ATOM 313 CA ILE A 24 6.369 -7.263 5.832 1.00 0.00 C ATOM 314 C ILE A 24 6.469 -7.242 4.306 1.00 0.00 C ATOM 315 O ILE A 24 7.472 -6.797 3.751 1.00 0.00 O ATOM 316 CB ILE A 24 5.492 -6.149 6.407 1.00 0.00 C ATOM 317 CG1 ILE A 24 6.325 -4.907 6.730 1.00 0.00 C ATOM 318 CG2 ILE A 24 4.705 -6.643 7.622 1.00 0.00 C ATOM 319 CD1 ILE A 24 5.448 -3.654 6.775 1.00 0.00 C ATOM 0 H ILE A 24 8.391 -6.713 5.828 1.00 0.00 H new ATOM 0 HA ILE A 24 5.878 -8.197 6.107 1.00 0.00 H new ATOM 0 HB ILE A 24 4.765 -5.861 5.648 1.00 0.00 H new ATOM 0 HG12 ILE A 24 6.825 -5.040 7.689 1.00 0.00 H new ATOM 0 HG13 ILE A 24 7.105 -4.782 5.979 1.00 0.00 H new ATOM 0 HG21 ILE A 24 4.090 -5.832 8.011 1.00 0.00 H new ATOM 0 HG22 ILE A 24 4.065 -7.475 7.327 1.00 0.00 H new ATOM 0 HG23 ILE A 24 5.399 -6.975 8.394 1.00 0.00 H new ATOM 0 HD11 ILE A 24 6.065 -2.786 7.007 1.00 0.00 H new ATOM 0 HD12 ILE A 24 4.969 -3.510 5.807 1.00 0.00 H new ATOM 0 HD13 ILE A 24 4.684 -3.772 7.544 1.00 0.00 H new ATOM 331 N SER A 25 5.414 -7.729 3.669 1.00 0.00 N ATOM 332 CA SER A 25 5.369 -7.772 2.217 1.00 0.00 C ATOM 333 C SER A 25 4.246 -6.870 1.701 1.00 0.00 C ATOM 334 O SER A 25 3.209 -6.733 2.348 1.00 0.00 O ATOM 335 CB SER A 25 5.174 -9.204 1.714 1.00 0.00 C ATOM 336 OG SER A 25 6.052 -10.121 2.360 1.00 0.00 O ATOM 0 H SER A 25 4.583 -8.097 4.132 1.00 0.00 H new ATOM 0 HA SER A 25 6.323 -7.408 1.834 1.00 0.00 H new ATOM 0 HB2 SER A 25 4.142 -9.510 1.883 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.344 -9.236 0.638 1.00 0.00 H new ATOM 0 HG SER A 25 5.895 -11.024 2.013 1.00 0.00 H new ATOM 342 N ILE A 26 4.491 -6.279 0.541 1.00 0.00 N ATOM 343 CA ILE A 26 3.513 -5.395 -0.069 1.00 0.00 C ATOM 344 C ILE A 26 3.153 -5.922 -1.459 1.00 0.00 C ATOM 345 O ILE A 26 3.879 -6.737 -2.026 1.00 0.00 O ATOM 346 CB ILE A 26 4.024 -3.952 -0.072 1.00 0.00 C ATOM 347 CG1 ILE A 26 5.286 -3.819 -0.925 1.00 0.00 C ATOM 348 CG2 ILE A 26 4.240 -3.445 1.355 1.00 0.00 C ATOM 349 CD1 ILE A 26 5.166 -2.649 -1.904 1.00 0.00 C ATOM 0 H ILE A 26 5.353 -6.395 0.008 1.00 0.00 H new ATOM 0 HA ILE A 26 2.593 -5.383 0.516 1.00 0.00 H new ATOM 0 HB ILE A 26 3.261 -3.320 -0.526 1.00 0.00 H new ATOM 0 HG12 ILE A 26 6.151 -3.670 -0.279 1.00 0.00 H new ATOM 0 HG13 ILE A 26 5.455 -4.744 -1.477 1.00 0.00 H new ATOM 0 HG21 ILE A 26 4.603 -2.418 1.325 1.00 0.00 H new ATOM 0 HG22 ILE A 26 3.297 -3.481 1.901 1.00 0.00 H new ATOM 0 HG23 ILE A 26 4.974 -4.075 1.858 1.00 0.00 H new ATOM 0 HD11 ILE A 26 6.077 -2.577 -2.498 1.00 0.00 H new ATOM 0 HD12 ILE A 26 4.314 -2.813 -2.564 1.00 0.00 H new ATOM 0 HD13 ILE A 26 5.021 -1.723 -1.348 1.00 0.00 H new ATOM 361 N ILE A 27 2.031 -5.434 -1.970 1.00 0.00 N ATOM 362 CA ILE A 27 1.565 -5.846 -3.283 1.00 0.00 C ATOM 363 C ILE A 27 1.084 -4.617 -4.057 1.00 0.00 C ATOM 364 O ILE A 27 0.439 -3.736 -3.491 1.00 0.00 O ATOM 365 CB ILE A 27 0.509 -6.946 -3.156 1.00 0.00 C ATOM 366 CG1 ILE A 27 -0.379 -7.000 -4.401 1.00 0.00 C ATOM 367 CG2 ILE A 27 -0.310 -6.775 -1.875 1.00 0.00 C ATOM 368 CD1 ILE A 27 -0.979 -8.395 -4.587 1.00 0.00 C ATOM 0 H ILE A 27 1.432 -4.757 -1.498 1.00 0.00 H new ATOM 0 HA ILE A 27 2.381 -6.285 -3.857 1.00 0.00 H new ATOM 0 HB ILE A 27 1.022 -7.905 -3.084 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -1.179 -6.265 -4.313 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.206 -6.732 -5.281 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -1.053 -7.570 -1.809 1.00 0.00 H new ATOM 0 HG22 ILE A 27 0.352 -6.825 -1.011 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -0.813 -5.808 -1.891 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.606 -8.406 -5.479 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -0.177 -9.124 -4.699 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.583 -8.650 -3.716 1.00 0.00 H new ATOM 380 N GLY A 28 1.416 -4.598 -5.339 1.00 0.00 N ATOM 381 CA GLY A 28 1.026 -3.492 -6.197 1.00 0.00 C ATOM 382 C GLY A 28 -0.267 -3.812 -6.951 1.00 0.00 C ATOM 383 O GLY A 28 -0.294 -4.713 -7.787 1.00 0.00 O ATOM 0 H GLY A 28 1.951 -5.331 -5.805 1.00 0.00 H new ATOM 0 HA2 GLY A 28 0.888 -2.593 -5.597 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.824 -3.281 -6.909 1.00 0.00 H new ATOM 387 N MET A 29 -1.306 -3.056 -6.627 1.00 0.00 N ATOM 388 CA MET A 29 -2.598 -3.248 -7.263 1.00 0.00 C ATOM 389 C MET A 29 -3.183 -1.914 -7.730 1.00 0.00 C ATOM 390 O MET A 29 -2.882 -0.866 -7.160 1.00 0.00 O ATOM 391 CB MET A 29 -3.560 -3.910 -6.275 1.00 0.00 C ATOM 392 CG MET A 29 -3.020 -5.263 -5.806 1.00 0.00 C ATOM 393 SD MET A 29 -3.893 -6.586 -6.627 1.00 0.00 S ATOM 394 CE MET A 29 -4.794 -7.267 -5.245 1.00 0.00 C ATOM 0 H MET A 29 -1.279 -2.310 -5.932 1.00 0.00 H new ATOM 0 HA MET A 29 -2.461 -3.888 -8.135 1.00 0.00 H new ATOM 0 HB2 MET A 29 -3.710 -3.257 -5.415 1.00 0.00 H new ATOM 0 HB3 MET A 29 -4.534 -4.046 -6.746 1.00 0.00 H new ATOM 0 HG2 MET A 29 -1.953 -5.332 -6.020 1.00 0.00 H new ATOM 0 HG3 MET A 29 -3.135 -5.355 -4.726 1.00 0.00 H new ATOM 0 HE1 MET A 29 -5.397 -8.110 -5.583 1.00 0.00 H new ATOM 0 HE2 MET A 29 -4.091 -7.606 -4.484 1.00 0.00 H new ATOM 0 HE3 MET A 29 -5.445 -6.502 -4.823 1.00 0.00 H new ATOM 404 N GLY A 30 -4.009 -1.995 -8.763 1.00 0.00 N ATOM 405 CA GLY A 30 -4.639 -0.807 -9.313 1.00 0.00 C ATOM 406 C GLY A 30 -6.015 -0.576 -8.686 1.00 0.00 C ATOM 407 O GLY A 30 -6.958 -1.315 -8.960 1.00 0.00 O ATOM 0 H GLY A 30 -4.256 -2.865 -9.234 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -4.004 0.061 -9.135 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -4.741 -0.912 -10.393 1.00 0.00 H new ATOM 411 N VAL A 31 -6.085 0.454 -7.855 1.00 0.00 N ATOM 412 CA VAL A 31 -7.330 0.792 -7.186 1.00 0.00 C ATOM 413 C VAL A 31 -8.156 1.710 -8.089 1.00 0.00 C ATOM 414 O VAL A 31 -7.635 2.681 -8.636 1.00 0.00 O ATOM 415 CB VAL A 31 -7.038 1.406 -5.815 1.00 0.00 C ATOM 416 CG1 VAL A 31 -8.126 1.036 -4.806 1.00 0.00 C ATOM 417 CG2 VAL A 31 -5.656 0.988 -5.310 1.00 0.00 C ATOM 0 H VAL A 31 -5.300 1.065 -7.630 1.00 0.00 H new ATOM 0 HA VAL A 31 -7.922 -0.105 -7.005 1.00 0.00 H new ATOM 0 HB VAL A 31 -7.039 2.490 -5.926 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -7.894 1.485 -3.840 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -9.089 1.407 -5.157 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -8.171 -0.048 -4.701 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.474 1.438 -4.334 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.614 -0.098 -5.223 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.894 1.325 -6.013 1.00 0.00 H new ATOM 492 N GLU A 38 -6.842 6.065 -12.527 1.00 0.00 N ATOM 493 CA GLU A 38 -6.353 4.857 -11.884 1.00 0.00 C ATOM 494 C GLU A 38 -5.276 5.203 -10.854 1.00 0.00 C ATOM 495 O GLU A 38 -4.357 5.967 -11.145 1.00 0.00 O ATOM 496 CB GLU A 38 -5.823 3.862 -12.918 1.00 0.00 C ATOM 497 CG GLU A 38 -4.483 4.327 -13.490 1.00 0.00 C ATOM 498 CD GLU A 38 -4.077 3.477 -14.696 1.00 0.00 C ATOM 499 OE1 GLU A 38 -4.623 3.743 -15.788 1.00 0.00 O ATOM 500 OE2 GLU A 38 -3.229 2.580 -14.498 1.00 0.00 O ATOM 0 HA GLU A 38 -7.186 4.382 -11.365 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -5.705 2.881 -12.457 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -6.547 3.750 -13.725 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -4.553 5.374 -13.786 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -3.714 4.264 -12.721 1.00 0.00 H new ATOM 507 N LYS A 39 -5.426 4.625 -9.672 1.00 0.00 N ATOM 508 CA LYS A 39 -4.477 4.863 -8.597 1.00 0.00 C ATOM 509 C LYS A 39 -3.981 3.521 -8.054 1.00 0.00 C ATOM 510 O LYS A 39 -4.771 2.715 -7.565 1.00 0.00 O ATOM 511 CB LYS A 39 -5.094 5.768 -7.529 1.00 0.00 C ATOM 512 CG LYS A 39 -6.333 5.120 -6.909 1.00 0.00 C ATOM 513 CD LYS A 39 -6.108 4.811 -5.428 1.00 0.00 C ATOM 514 CE LYS A 39 -7.422 4.884 -4.647 1.00 0.00 C ATOM 515 NZ LYS A 39 -7.209 4.489 -3.236 1.00 0.00 N ATOM 0 H LYS A 39 -6.190 3.992 -9.434 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.604 5.398 -8.971 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -4.358 5.972 -6.751 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -5.364 6.727 -7.972 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -7.189 5.785 -7.019 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -6.573 4.201 -7.443 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -5.673 3.817 -5.322 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -5.392 5.519 -5.010 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -7.822 5.897 -4.691 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -8.162 4.229 -5.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -8.110 4.544 -2.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -6.848 3.514 -3.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -6.519 5.131 -2.796 1.00 0.00 H new ATOM 529 N LEU A 40 -2.675 3.323 -8.159 1.00 0.00 N ATOM 530 CA LEU A 40 -2.065 2.093 -7.685 1.00 0.00 C ATOM 531 C LEU A 40 -2.073 2.081 -6.155 1.00 0.00 C ATOM 532 O LEU A 40 -1.646 3.045 -5.521 1.00 0.00 O ATOM 533 CB LEU A 40 -0.672 1.917 -8.293 1.00 0.00 C ATOM 534 CG LEU A 40 -0.296 0.493 -8.707 1.00 0.00 C ATOM 535 CD1 LEU A 40 -0.123 -0.407 -7.481 1.00 0.00 C ATOM 536 CD2 LEU A 40 -1.313 -0.077 -9.698 1.00 0.00 C ATOM 0 H LEU A 40 -2.023 3.994 -8.565 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.643 1.230 -8.014 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.596 2.561 -9.169 1.00 0.00 H new ATOM 0 HB3 LEU A 40 0.065 2.271 -7.572 1.00 0.00 H new ATOM 0 HG LEU A 40 0.666 0.529 -9.218 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.144 -1.413 -7.803 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.667 -0.008 -6.845 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -1.057 -0.441 -6.920 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.022 -1.090 -9.976 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.300 -0.097 -9.236 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.343 0.549 -10.590 1.00 0.00 H new ATOM 548 N GLY A 41 -2.564 0.980 -5.606 1.00 0.00 N ATOM 549 CA GLY A 41 -2.634 0.830 -4.163 1.00 0.00 C ATOM 550 C GLY A 41 -1.556 -0.132 -3.659 1.00 0.00 C ATOM 551 O GLY A 41 -1.311 -1.171 -4.270 1.00 0.00 O ATOM 0 H GLY A 41 -2.917 0.183 -6.135 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.510 1.802 -3.686 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.619 0.459 -3.880 1.00 0.00 H new ATOM 555 N ILE A 42 -0.942 0.248 -2.548 1.00 0.00 N ATOM 556 CA ILE A 42 0.104 -0.568 -1.955 1.00 0.00 C ATOM 557 C ILE A 42 -0.466 -1.327 -0.755 1.00 0.00 C ATOM 558 O ILE A 42 -0.547 -0.784 0.346 1.00 0.00 O ATOM 559 CB ILE A 42 1.325 0.289 -1.617 1.00 0.00 C ATOM 560 CG1 ILE A 42 1.690 1.208 -2.784 1.00 0.00 C ATOM 561 CG2 ILE A 42 2.505 -0.585 -1.185 1.00 0.00 C ATOM 562 CD1 ILE A 42 1.917 0.404 -4.066 1.00 0.00 C ATOM 0 H ILE A 42 -1.149 1.110 -2.043 1.00 0.00 H new ATOM 0 HA ILE A 42 0.455 -1.315 -2.667 1.00 0.00 H new ATOM 0 HB ILE A 42 1.070 0.928 -0.772 1.00 0.00 H new ATOM 0 HG12 ILE A 42 0.893 1.934 -2.943 1.00 0.00 H new ATOM 0 HG13 ILE A 42 2.591 1.771 -2.540 1.00 0.00 H new ATOM 0 HG21 ILE A 42 3.360 0.049 -0.950 1.00 0.00 H new ATOM 0 HG22 ILE A 42 2.227 -1.161 -0.302 1.00 0.00 H new ATOM 0 HG23 ILE A 42 2.769 -1.266 -1.994 1.00 0.00 H new ATOM 0 HD11 ILE A 42 2.175 1.082 -4.880 1.00 0.00 H new ATOM 0 HD12 ILE A 42 2.731 -0.304 -3.912 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.007 -0.139 -4.321 1.00 0.00 H new ATOM 574 N PHE A 43 -0.848 -2.570 -1.008 1.00 0.00 N ATOM 575 CA PHE A 43 -1.408 -3.409 0.038 1.00 0.00 C ATOM 576 C PHE A 43 -0.359 -4.382 0.582 1.00 0.00 C ATOM 577 O PHE A 43 0.673 -4.604 -0.049 1.00 0.00 O ATOM 578 CB PHE A 43 -2.550 -4.208 -0.593 1.00 0.00 C ATOM 579 CG PHE A 43 -3.651 -3.342 -1.206 1.00 0.00 C ATOM 580 CD1 PHE A 43 -4.647 -2.851 -0.421 1.00 0.00 C ATOM 581 CD2 PHE A 43 -3.634 -3.063 -2.537 1.00 0.00 C ATOM 582 CE1 PHE A 43 -5.669 -2.047 -0.991 1.00 0.00 C ATOM 583 CE2 PHE A 43 -4.657 -2.258 -3.107 1.00 0.00 C ATOM 584 CZ PHE A 43 -5.652 -1.767 -2.322 1.00 0.00 C ATOM 0 H PHE A 43 -0.781 -3.017 -1.923 1.00 0.00 H new ATOM 0 HA PHE A 43 -1.754 -2.790 0.866 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -2.141 -4.858 -1.366 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -2.991 -4.854 0.166 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -4.661 -3.073 0.636 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -2.843 -3.453 -3.161 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -6.460 -1.658 -0.368 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -4.644 -2.036 -4.164 1.00 0.00 H new ATOM 0 HZ PHE A 43 -6.429 -1.155 -2.755 1.00 0.00 H new ATOM 594 N VAL A 44 -0.661 -4.936 1.747 1.00 0.00 N ATOM 595 CA VAL A 44 0.243 -5.879 2.383 1.00 0.00 C ATOM 596 C VAL A 44 -0.117 -7.300 1.942 1.00 0.00 C ATOM 597 O VAL A 44 -1.129 -7.849 2.372 1.00 0.00 O ATOM 598 CB VAL A 44 0.206 -5.698 3.902 1.00 0.00 C ATOM 599 CG1 VAL A 44 0.807 -6.911 4.614 1.00 0.00 C ATOM 600 CG2 VAL A 44 0.919 -4.409 4.317 1.00 0.00 C ATOM 0 H VAL A 44 -1.519 -4.750 2.267 1.00 0.00 H new ATOM 0 HA VAL A 44 1.271 -5.691 2.072 1.00 0.00 H new ATOM 0 HB VAL A 44 -0.838 -5.616 4.205 1.00 0.00 H new ATOM 0 HG11 VAL A 44 0.768 -6.756 5.692 1.00 0.00 H new ATOM 0 HG12 VAL A 44 0.238 -7.804 4.355 1.00 0.00 H new ATOM 0 HG13 VAL A 44 1.844 -7.039 4.303 1.00 0.00 H new ATOM 0 HG21 VAL A 44 0.879 -4.304 5.401 1.00 0.00 H new ATOM 0 HG22 VAL A 44 1.960 -4.449 3.995 1.00 0.00 H new ATOM 0 HG23 VAL A 44 0.427 -3.555 3.851 1.00 0.00 H new ATOM 610 N LYS A 45 0.732 -7.853 1.088 1.00 0.00 N ATOM 611 CA LYS A 45 0.517 -9.199 0.584 1.00 0.00 C ATOM 612 C LYS A 45 0.506 -10.182 1.756 1.00 0.00 C ATOM 613 O LYS A 45 -0.310 -11.102 1.792 1.00 0.00 O ATOM 614 CB LYS A 45 1.547 -9.538 -0.495 1.00 0.00 C ATOM 615 CG LYS A 45 1.294 -10.931 -1.076 1.00 0.00 C ATOM 616 CD LYS A 45 1.733 -11.002 -2.539 1.00 0.00 C ATOM 617 CE LYS A 45 2.025 -12.446 -2.954 1.00 0.00 C ATOM 618 NZ LYS A 45 0.829 -13.294 -2.755 1.00 0.00 N ATOM 0 H LYS A 45 1.570 -7.393 0.732 1.00 0.00 H new ATOM 0 HA LYS A 45 -0.455 -9.273 0.097 1.00 0.00 H new ATOM 0 HB2 LYS A 45 1.503 -8.795 -1.291 1.00 0.00 H new ATOM 0 HB3 LYS A 45 2.551 -9.493 -0.072 1.00 0.00 H new ATOM 0 HG2 LYS A 45 1.836 -11.676 -0.493 1.00 0.00 H new ATOM 0 HG3 LYS A 45 0.234 -11.175 -0.998 1.00 0.00 H new ATOM 0 HD2 LYS A 45 0.953 -10.587 -3.177 1.00 0.00 H new ATOM 0 HD3 LYS A 45 2.623 -10.391 -2.685 1.00 0.00 H new ATOM 0 HE2 LYS A 45 2.329 -12.476 -4.000 1.00 0.00 H new ATOM 0 HE3 LYS A 45 2.857 -12.838 -2.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 0.979 -14.217 -3.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 0.666 -13.431 -1.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 0.000 -12.830 -3.179 1.00 0.00 H new ATOM 632 N THR A 46 1.422 -9.955 2.686 1.00 0.00 N ATOM 633 CA THR A 46 1.529 -10.810 3.856 1.00 0.00 C ATOM 634 C THR A 46 2.493 -10.200 4.876 1.00 0.00 C ATOM 635 O THR A 46 3.129 -9.183 4.603 1.00 0.00 O ATOM 636 CB THR A 46 1.944 -12.205 3.386 1.00 0.00 C ATOM 637 OG1 THR A 46 2.231 -12.907 4.593 1.00 0.00 O ATOM 638 CG2 THR A 46 3.277 -12.197 2.634 1.00 0.00 C ATOM 0 H THR A 46 2.097 -9.191 2.653 1.00 0.00 H new ATOM 0 HA THR A 46 0.572 -10.897 4.371 1.00 0.00 H new ATOM 0 HB THR A 46 1.167 -12.617 2.743 1.00 0.00 H new ATOM 0 HG1 THR A 46 1.394 -13.112 5.059 1.00 0.00 H new ATOM 0 HG21 THR A 46 3.525 -13.212 2.323 1.00 0.00 H new ATOM 0 HG22 THR A 46 3.195 -11.557 1.755 1.00 0.00 H new ATOM 0 HG23 THR A 46 4.061 -11.816 3.288 1.00 0.00 H new ATOM 646 N VAL A 47 2.571 -10.847 6.029 1.00 0.00 N ATOM 647 CA VAL A 47 3.446 -10.381 7.091 1.00 0.00 C ATOM 648 C VAL A 47 4.403 -11.508 7.488 1.00 0.00 C ATOM 649 O VAL A 47 3.968 -12.616 7.797 1.00 0.00 O ATOM 650 CB VAL A 47 2.614 -9.861 8.265 1.00 0.00 C ATOM 651 CG1 VAL A 47 3.510 -9.489 9.449 1.00 0.00 C ATOM 652 CG2 VAL A 47 1.747 -8.675 7.840 1.00 0.00 C ATOM 0 H VAL A 47 2.042 -11.691 6.251 1.00 0.00 H new ATOM 0 HA VAL A 47 4.054 -9.544 6.746 1.00 0.00 H new ATOM 0 HB VAL A 47 1.949 -10.663 8.586 1.00 0.00 H new ATOM 0 HG11 VAL A 47 2.894 -9.122 10.270 1.00 0.00 H new ATOM 0 HG12 VAL A 47 4.065 -10.369 9.776 1.00 0.00 H new ATOM 0 HG13 VAL A 47 4.210 -8.711 9.145 1.00 0.00 H new ATOM 0 HG21 VAL A 47 1.166 -8.325 8.693 1.00 0.00 H new ATOM 0 HG22 VAL A 47 2.385 -7.868 7.480 1.00 0.00 H new ATOM 0 HG23 VAL A 47 1.071 -8.986 7.043 1.00 0.00 H new ATOM 662 N THR A 48 5.688 -11.185 7.468 1.00 0.00 N ATOM 663 CA THR A 48 6.709 -12.155 7.822 1.00 0.00 C ATOM 664 C THR A 48 6.422 -12.752 9.201 1.00 0.00 C ATOM 665 O THR A 48 5.859 -12.083 10.066 1.00 0.00 O ATOM 666 CB THR A 48 8.071 -11.464 7.730 1.00 0.00 C ATOM 667 OG1 THR A 48 8.457 -11.637 6.370 1.00 0.00 O ATOM 668 CG2 THR A 48 9.155 -12.198 8.522 1.00 0.00 C ATOM 0 H THR A 48 6.045 -10.264 7.212 1.00 0.00 H new ATOM 0 HA THR A 48 6.710 -12.998 7.131 1.00 0.00 H new ATOM 0 HB THR A 48 7.984 -10.441 8.096 1.00 0.00 H new ATOM 0 HG1 THR A 48 9.330 -11.217 6.222 1.00 0.00 H new ATOM 0 HG21 THR A 48 10.101 -11.666 8.423 1.00 0.00 H new ATOM 0 HG22 THR A 48 8.871 -12.241 9.574 1.00 0.00 H new ATOM 0 HG23 THR A 48 9.266 -13.211 8.134 1.00 0.00 H new ATOM 676 N GLU A 49 6.823 -14.004 9.364 1.00 0.00 N ATOM 677 CA GLU A 49 6.617 -14.698 10.624 1.00 0.00 C ATOM 678 C GLU A 49 7.707 -14.315 11.627 1.00 0.00 C ATOM 679 O GLU A 49 8.835 -14.796 11.537 1.00 0.00 O ATOM 680 CB GLU A 49 6.573 -16.213 10.414 1.00 0.00 C ATOM 681 CG GLU A 49 5.357 -16.828 11.109 1.00 0.00 C ATOM 682 CD GLU A 49 5.277 -18.333 10.845 1.00 0.00 C ATOM 683 OE1 GLU A 49 5.229 -18.698 9.650 1.00 0.00 O ATOM 684 OE2 GLU A 49 5.267 -19.085 11.844 1.00 0.00 O ATOM 0 H GLU A 49 7.290 -14.556 8.644 1.00 0.00 H new ATOM 0 HA GLU A 49 5.653 -14.392 11.031 1.00 0.00 H new ATOM 0 HB2 GLU A 49 6.537 -16.435 9.347 1.00 0.00 H new ATOM 0 HB3 GLU A 49 7.486 -16.664 10.803 1.00 0.00 H new ATOM 0 HG2 GLU A 49 5.417 -16.646 12.182 1.00 0.00 H new ATOM 0 HG3 GLU A 49 4.447 -16.344 10.754 1.00 0.00 H new ATOM 691 N GLY A 50 7.331 -13.451 12.559 1.00 0.00 N ATOM 692 CA GLY A 50 8.263 -12.997 13.577 1.00 0.00 C ATOM 693 C GLY A 50 8.820 -11.614 13.234 1.00 0.00 C ATOM 694 O GLY A 50 9.730 -11.125 13.901 1.00 0.00 O ATOM 0 H GLY A 50 6.394 -13.054 12.630 1.00 0.00 H new ATOM 0 HA2 GLY A 50 7.761 -12.961 14.544 1.00 0.00 H new ATOM 0 HA3 GLY A 50 9.082 -13.710 13.669 1.00 0.00 H new ATOM 698 N GLY A 51 8.250 -11.024 12.193 1.00 0.00 N ATOM 699 CA GLY A 51 8.679 -9.707 11.753 1.00 0.00 C ATOM 700 C GLY A 51 8.205 -8.624 12.723 1.00 0.00 C ATOM 701 O GLY A 51 7.634 -8.928 13.770 1.00 0.00 O ATOM 0 H GLY A 51 7.496 -11.433 11.642 1.00 0.00 H new ATOM 0 HA2 GLY A 51 9.766 -9.681 11.677 1.00 0.00 H new ATOM 0 HA3 GLY A 51 8.285 -9.506 10.757 1.00 0.00 H new ATOM 705 N ALA A 52 8.458 -7.380 12.342 1.00 0.00 N ATOM 706 CA ALA A 52 8.064 -6.250 13.165 1.00 0.00 C ATOM 707 C ALA A 52 6.542 -6.103 13.128 1.00 0.00 C ATOM 708 O ALA A 52 5.878 -6.219 14.157 1.00 0.00 O ATOM 709 CB ALA A 52 8.784 -4.990 12.680 1.00 0.00 C ATOM 0 H ALA A 52 8.931 -7.130 11.474 1.00 0.00 H new ATOM 0 HA ALA A 52 8.354 -6.412 14.203 1.00 0.00 H new ATOM 0 HB1 ALA A 52 8.489 -4.142 13.297 1.00 0.00 H new ATOM 0 HB2 ALA A 52 9.862 -5.135 12.755 1.00 0.00 H new ATOM 0 HB3 ALA A 52 8.515 -4.794 11.642 1.00 0.00 H new ATOM 715 N ALA A 53 6.033 -5.849 11.931 1.00 0.00 N ATOM 716 CA ALA A 53 4.601 -5.685 11.746 1.00 0.00 C ATOM 717 C ALA A 53 3.874 -6.899 12.329 1.00 0.00 C ATOM 718 O ALA A 53 2.733 -6.788 12.774 1.00 0.00 O ATOM 719 CB ALA A 53 4.298 -5.482 10.260 1.00 0.00 C ATOM 0 H ALA A 53 6.587 -5.753 11.080 1.00 0.00 H new ATOM 0 HA ALA A 53 4.244 -4.801 12.275 1.00 0.00 H new ATOM 0 HB1 ALA A 53 3.224 -5.359 10.121 1.00 0.00 H new ATOM 0 HB2 ALA A 53 4.815 -4.592 9.902 1.00 0.00 H new ATOM 0 HB3 ALA A 53 4.639 -6.351 9.697 1.00 0.00 H new ATOM 725 N GLN A 54 4.564 -8.029 12.307 1.00 0.00 N ATOM 726 CA GLN A 54 3.998 -9.262 12.827 1.00 0.00 C ATOM 727 C GLN A 54 3.898 -9.197 14.353 1.00 0.00 C ATOM 728 O GLN A 54 2.802 -9.251 14.909 1.00 0.00 O ATOM 729 CB GLN A 54 4.820 -10.474 12.383 1.00 0.00 C ATOM 730 CG GLN A 54 3.975 -11.749 12.409 1.00 0.00 C ATOM 731 CD GLN A 54 4.123 -12.477 13.746 1.00 0.00 C ATOM 732 OE1 GLN A 54 4.289 -11.876 14.795 1.00 0.00 O ATOM 733 NE2 GLN A 54 4.053 -13.802 13.651 1.00 0.00 N ATOM 0 H GLN A 54 5.510 -8.117 11.937 1.00 0.00 H new ATOM 0 HA GLN A 54 2.993 -9.378 12.420 1.00 0.00 H new ATOM 0 HB2 GLN A 54 5.204 -10.308 11.376 1.00 0.00 H new ATOM 0 HB3 GLN A 54 5.683 -10.592 13.038 1.00 0.00 H new ATOM 0 HG2 GLN A 54 2.927 -11.499 12.241 1.00 0.00 H new ATOM 0 HG3 GLN A 54 4.280 -12.408 11.596 1.00 0.00 H new ATOM 0 HE21 GLN A 54 3.913 -14.241 12.741 1.00 0.00 H new ATOM 0 HE22 GLN A 54 4.140 -14.379 14.488 1.00 0.00 H new ATOM 742 N ARG A 55 5.056 -9.083 14.986 1.00 0.00 N ATOM 743 CA ARG A 55 5.112 -9.010 16.436 1.00 0.00 C ATOM 744 C ARG A 55 4.252 -7.851 16.943 1.00 0.00 C ATOM 745 O ARG A 55 3.703 -7.915 18.042 1.00 0.00 O ATOM 746 CB ARG A 55 6.550 -8.819 16.922 1.00 0.00 C ATOM 747 CG ARG A 55 7.372 -10.094 16.717 1.00 0.00 C ATOM 748 CD ARG A 55 8.783 -9.933 17.285 1.00 0.00 C ATOM 749 NE ARG A 55 9.702 -9.452 16.229 1.00 0.00 N ATOM 750 CZ ARG A 55 11.006 -9.208 16.421 1.00 0.00 C ATOM 751 NH1 ARG A 55 11.552 -9.398 17.630 1.00 0.00 N ATOM 752 NH2 ARG A 55 11.763 -8.774 15.405 1.00 0.00 N ATOM 0 H ARG A 55 5.963 -9.039 14.521 1.00 0.00 H new ATOM 0 HA ARG A 55 4.729 -9.951 16.830 1.00 0.00 H new ATOM 0 HB2 ARG A 55 7.013 -7.993 16.383 1.00 0.00 H new ATOM 0 HB3 ARG A 55 6.548 -8.549 17.978 1.00 0.00 H new ATOM 0 HG2 ARG A 55 6.874 -10.934 17.202 1.00 0.00 H new ATOM 0 HG3 ARG A 55 7.428 -10.328 15.654 1.00 0.00 H new ATOM 0 HD2 ARG A 55 8.771 -9.228 18.117 1.00 0.00 H new ATOM 0 HD3 ARG A 55 9.136 -10.886 17.680 1.00 0.00 H new ATOM 0 HE ARG A 55 9.319 -9.296 15.297 1.00 0.00 H new ATOM 0 HH11 ARG A 55 10.975 -9.728 18.404 1.00 0.00 H new ATOM 0 HH12 ARG A 55 12.544 -9.212 17.776 1.00 0.00 H new ATOM 0 HH21 ARG A 55 11.347 -8.629 14.485 1.00 0.00 H new ATOM 0 HH22 ARG A 55 12.755 -8.588 15.551 1.00 0.00 H new ATOM 766 N ASP A 56 4.160 -6.818 16.118 1.00 0.00 N ATOM 767 CA ASP A 56 3.376 -5.647 16.469 1.00 0.00 C ATOM 768 C ASP A 56 1.898 -6.034 16.552 1.00 0.00 C ATOM 769 O ASP A 56 1.236 -5.757 17.551 1.00 0.00 O ATOM 770 CB ASP A 56 3.518 -4.551 15.410 1.00 0.00 C ATOM 771 CG ASP A 56 2.970 -3.183 15.819 1.00 0.00 C ATOM 772 OD1 ASP A 56 2.844 -2.964 17.043 1.00 0.00 O ATOM 773 OD2 ASP A 56 2.688 -2.386 14.897 1.00 0.00 O ATOM 0 H ASP A 56 4.616 -6.768 15.207 1.00 0.00 H new ATOM 0 HA ASP A 56 3.739 -5.273 17.426 1.00 0.00 H new ATOM 0 HB2 ASP A 56 4.573 -4.443 15.160 1.00 0.00 H new ATOM 0 HB3 ASP A 56 3.007 -4.874 14.503 1.00 0.00 H new ATOM 778 N GLY A 57 1.424 -6.669 15.490 1.00 0.00 N ATOM 779 CA GLY A 57 0.037 -7.097 15.431 1.00 0.00 C ATOM 780 C GLY A 57 -0.837 -6.031 14.767 1.00 0.00 C ATOM 781 O GLY A 57 -1.790 -6.357 14.060 1.00 0.00 O ATOM 0 H GLY A 57 1.976 -6.897 14.663 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -0.036 -8.031 14.874 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -0.329 -7.297 16.438 1.00 0.00 H new ATOM 785 N ARG A 58 -0.483 -4.780 15.017 1.00 0.00 N ATOM 786 CA ARG A 58 -1.223 -3.664 14.453 1.00 0.00 C ATOM 787 C ARG A 58 -1.492 -3.904 12.966 1.00 0.00 C ATOM 788 O ARG A 58 -2.631 -4.147 12.569 1.00 0.00 O ATOM 789 CB ARG A 58 -0.455 -2.352 14.620 1.00 0.00 C ATOM 790 CG ARG A 58 -1.287 -1.324 15.389 1.00 0.00 C ATOM 791 CD ARG A 58 -2.741 -1.329 14.914 1.00 0.00 C ATOM 792 NE ARG A 58 -2.799 -1.613 13.463 1.00 0.00 N ATOM 793 CZ ARG A 58 -3.919 -1.946 12.807 1.00 0.00 C ATOM 794 NH1 ARG A 58 -5.080 -2.038 13.468 1.00 0.00 N ATOM 795 NH2 ARG A 58 -3.876 -2.187 11.489 1.00 0.00 N ATOM 0 H ARG A 58 0.308 -4.514 15.604 1.00 0.00 H new ATOM 0 HA ARG A 58 -2.169 -3.588 14.990 1.00 0.00 H new ATOM 0 HB2 ARG A 58 0.479 -2.538 15.149 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -0.192 -1.953 13.640 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -1.249 -1.545 16.456 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -0.860 -0.330 15.253 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -3.309 -2.080 15.463 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -3.204 -0.364 15.123 1.00 0.00 H new ATOM 0 HE ARG A 58 -1.932 -1.551 12.929 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -5.112 -1.855 14.471 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -5.932 -2.291 12.969 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -2.991 -2.117 10.986 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -4.728 -2.441 10.989 1.00 0.00 H new ATOM 809 N ILE A 59 -0.425 -3.828 12.184 1.00 0.00 N ATOM 810 CA ILE A 59 -0.532 -4.034 10.750 1.00 0.00 C ATOM 811 C ILE A 59 -0.893 -5.495 10.474 1.00 0.00 C ATOM 812 O ILE A 59 -0.303 -6.404 11.055 1.00 0.00 O ATOM 813 CB ILE A 59 0.746 -3.573 10.046 1.00 0.00 C ATOM 814 CG1 ILE A 59 0.895 -2.052 10.119 1.00 0.00 C ATOM 815 CG2 ILE A 59 0.794 -4.085 8.605 1.00 0.00 C ATOM 816 CD1 ILE A 59 2.370 -1.648 10.175 1.00 0.00 C ATOM 0 H ILE A 59 0.518 -3.627 12.517 1.00 0.00 H new ATOM 0 HA ILE A 59 -1.335 -3.423 10.336 1.00 0.00 H new ATOM 0 HB ILE A 59 1.599 -4.005 10.570 1.00 0.00 H new ATOM 0 HG12 ILE A 59 0.422 -1.594 9.250 1.00 0.00 H new ATOM 0 HG13 ILE A 59 0.377 -1.674 11.000 1.00 0.00 H new ATOM 0 HG21 ILE A 59 1.712 -3.743 8.128 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.769 -5.175 8.605 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -0.065 -3.703 8.054 1.00 0.00 H new ATOM 0 HD11 ILE A 59 2.448 -0.562 10.226 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.834 -2.087 11.058 1.00 0.00 H new ATOM 0 HD13 ILE A 59 2.880 -2.006 9.281 1.00 0.00 H new ATOM 828 N GLN A 60 -1.862 -5.674 9.588 1.00 0.00 N ATOM 829 CA GLN A 60 -2.309 -7.009 9.228 1.00 0.00 C ATOM 830 C GLN A 60 -2.364 -7.158 7.706 1.00 0.00 C ATOM 831 O GLN A 60 -2.635 -6.192 6.994 1.00 0.00 O ATOM 832 CB GLN A 60 -3.667 -7.320 9.859 1.00 0.00 C ATOM 833 CG GLN A 60 -3.788 -6.682 11.244 1.00 0.00 C ATOM 834 CD GLN A 60 -5.236 -6.714 11.738 1.00 0.00 C ATOM 835 OE1 GLN A 60 -6.057 -7.493 11.283 1.00 0.00 O ATOM 836 NE2 GLN A 60 -5.501 -5.826 12.692 1.00 0.00 N ATOM 0 H GLN A 60 -2.350 -4.917 9.109 1.00 0.00 H new ATOM 0 HA GLN A 60 -1.590 -7.730 9.618 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -4.465 -6.951 9.214 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -3.796 -8.399 9.940 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -3.148 -7.211 11.949 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -3.436 -5.651 11.205 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -4.766 -5.203 13.027 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -6.439 -5.768 13.088 1.00 0.00 H new ATOM 845 N VAL A 61 -2.103 -8.376 7.253 1.00 0.00 N ATOM 846 CA VAL A 61 -2.120 -8.663 5.829 1.00 0.00 C ATOM 847 C VAL A 61 -3.303 -7.942 5.181 1.00 0.00 C ATOM 848 O VAL A 61 -4.327 -7.718 5.825 1.00 0.00 O ATOM 849 CB VAL A 61 -2.145 -10.176 5.601 1.00 0.00 C ATOM 850 CG1 VAL A 61 -2.259 -10.504 4.111 1.00 0.00 C ATOM 851 CG2 VAL A 61 -0.914 -10.844 6.217 1.00 0.00 C ATOM 0 H VAL A 61 -1.879 -9.174 7.847 1.00 0.00 H new ATOM 0 HA VAL A 61 -1.213 -8.290 5.354 1.00 0.00 H new ATOM 0 HB VAL A 61 -3.028 -10.575 6.100 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -2.275 -11.586 3.977 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -3.179 -10.076 3.713 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.405 -10.085 3.580 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -0.957 -11.919 6.041 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -0.012 -10.437 5.760 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -0.895 -10.653 7.290 1.00 0.00 H new ATOM 861 N ASN A 62 -3.123 -7.597 3.914 1.00 0.00 N ATOM 862 CA ASN A 62 -4.163 -6.905 3.172 1.00 0.00 C ATOM 863 C ASN A 62 -4.189 -5.434 3.590 1.00 0.00 C ATOM 864 O ASN A 62 -5.002 -4.657 3.090 1.00 0.00 O ATOM 865 CB ASN A 62 -5.540 -7.504 3.465 1.00 0.00 C ATOM 866 CG ASN A 62 -5.483 -9.033 3.473 1.00 0.00 C ATOM 867 OD1 ASN A 62 -5.382 -9.682 2.445 1.00 0.00 O ATOM 868 ND2 ASN A 62 -5.553 -9.571 4.687 1.00 0.00 N ATOM 0 H ASN A 62 -2.272 -7.784 3.383 1.00 0.00 H new ATOM 0 HA ASN A 62 -3.944 -7.007 2.109 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -5.899 -7.145 4.430 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -6.254 -7.167 2.714 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -5.523 -10.584 4.798 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -5.637 -8.970 5.507 1.00 0.00 H new ATOM 875 N ASP A 63 -3.290 -5.095 4.501 1.00 0.00 N ATOM 876 CA ASP A 63 -3.199 -3.730 4.992 1.00 0.00 C ATOM 877 C ASP A 63 -2.811 -2.803 3.838 1.00 0.00 C ATOM 878 O ASP A 63 -2.014 -3.175 2.979 1.00 0.00 O ATOM 879 CB ASP A 63 -2.130 -3.605 6.079 1.00 0.00 C ATOM 880 CG ASP A 63 -1.170 -2.425 5.910 1.00 0.00 C ATOM 881 OD1 ASP A 63 -1.675 -1.322 5.609 1.00 0.00 O ATOM 882 OD2 ASP A 63 0.046 -2.653 6.085 1.00 0.00 O ATOM 0 H ASP A 63 -2.617 -5.742 4.913 1.00 0.00 H new ATOM 0 HA ASP A 63 -4.169 -3.456 5.408 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -2.625 -3.515 7.046 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -1.548 -4.527 6.103 1.00 0.00 H new ATOM 887 N GLN A 64 -3.395 -1.613 3.856 1.00 0.00 N ATOM 888 CA GLN A 64 -3.120 -0.630 2.822 1.00 0.00 C ATOM 889 C GLN A 64 -2.306 0.531 3.397 1.00 0.00 C ATOM 890 O GLN A 64 -2.840 1.371 4.119 1.00 0.00 O ATOM 891 CB GLN A 64 -4.417 -0.127 2.185 1.00 0.00 C ATOM 892 CG GLN A 64 -4.129 0.680 0.918 1.00 0.00 C ATOM 893 CD GLN A 64 -5.350 1.503 0.503 1.00 0.00 C ATOM 894 OE1 GLN A 64 -6.471 1.248 0.911 1.00 0.00 O ATOM 895 NE2 GLN A 64 -5.071 2.502 -0.330 1.00 0.00 N ATOM 0 H GLN A 64 -4.057 -1.308 4.570 1.00 0.00 H new ATOM 0 HA GLN A 64 -2.531 -1.109 2.040 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -5.059 -0.974 1.943 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -4.961 0.492 2.899 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -3.281 1.343 1.090 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -3.848 0.006 0.109 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -4.110 2.660 -0.633 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -5.818 3.110 -0.666 1.00 0.00 H new ATOM 904 N ILE A 65 -1.026 0.542 3.054 1.00 0.00 N ATOM 905 CA ILE A 65 -0.133 1.586 3.527 1.00 0.00 C ATOM 906 C ILE A 65 -0.381 2.865 2.724 1.00 0.00 C ATOM 907 O ILE A 65 0.300 3.121 1.732 1.00 0.00 O ATOM 908 CB ILE A 65 1.319 1.107 3.487 1.00 0.00 C ATOM 909 CG1 ILE A 65 1.512 -0.134 4.362 1.00 0.00 C ATOM 910 CG2 ILE A 65 2.279 2.234 3.873 1.00 0.00 C ATOM 911 CD1 ILE A 65 2.473 -1.126 3.703 1.00 0.00 C ATOM 0 H ILE A 65 -0.586 -0.156 2.454 1.00 0.00 H new ATOM 0 HA ILE A 65 -0.339 1.820 4.572 1.00 0.00 H new ATOM 0 HB ILE A 65 1.555 0.819 2.463 1.00 0.00 H new ATOM 0 HG12 ILE A 65 1.900 0.161 5.337 1.00 0.00 H new ATOM 0 HG13 ILE A 65 0.549 -0.615 4.535 1.00 0.00 H new ATOM 0 HG21 ILE A 65 3.305 1.867 3.837 1.00 0.00 H new ATOM 0 HG22 ILE A 65 2.166 3.064 3.175 1.00 0.00 H new ATOM 0 HG23 ILE A 65 2.052 2.576 4.883 1.00 0.00 H new ATOM 0 HD11 ILE A 65 2.592 -1.998 4.345 1.00 0.00 H new ATOM 0 HD12 ILE A 65 2.070 -1.437 2.739 1.00 0.00 H new ATOM 0 HD13 ILE A 65 3.442 -0.650 3.554 1.00 0.00 H new ATOM 923 N VAL A 66 -1.357 3.633 3.183 1.00 0.00 N ATOM 924 CA VAL A 66 -1.703 4.879 2.521 1.00 0.00 C ATOM 925 C VAL A 66 -0.513 5.837 2.591 1.00 0.00 C ATOM 926 O VAL A 66 -0.231 6.554 1.632 1.00 0.00 O ATOM 927 CB VAL A 66 -2.977 5.463 3.135 1.00 0.00 C ATOM 928 CG1 VAL A 66 -3.374 6.767 2.440 1.00 0.00 C ATOM 929 CG2 VAL A 66 -4.122 4.448 3.091 1.00 0.00 C ATOM 0 H VAL A 66 -1.920 3.417 4.006 1.00 0.00 H new ATOM 0 HA VAL A 66 -1.917 4.703 1.467 1.00 0.00 H new ATOM 0 HB VAL A 66 -2.770 5.691 4.181 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.283 7.160 2.896 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.570 7.495 2.546 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.553 6.576 1.382 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.016 4.888 3.534 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -4.327 4.175 2.056 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -3.840 3.557 3.652 1.00 0.00 H new ATOM 939 N GLU A 67 0.154 5.818 3.736 1.00 0.00 N ATOM 940 CA GLU A 67 1.308 6.676 3.944 1.00 0.00 C ATOM 941 C GLU A 67 2.362 5.954 4.785 1.00 0.00 C ATOM 942 O GLU A 67 2.037 5.041 5.543 1.00 0.00 O ATOM 943 CB GLU A 67 0.898 7.998 4.596 1.00 0.00 C ATOM 944 CG GLU A 67 2.080 8.639 5.327 1.00 0.00 C ATOM 945 CD GLU A 67 1.660 9.942 6.010 1.00 0.00 C ATOM 946 OE1 GLU A 67 1.474 10.935 5.274 1.00 0.00 O ATOM 947 OE2 GLU A 67 1.535 9.916 7.254 1.00 0.00 O ATOM 0 H GLU A 67 -0.083 5.222 4.529 1.00 0.00 H new ATOM 0 HA GLU A 67 1.743 6.908 2.972 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.522 8.682 3.835 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.083 7.824 5.298 1.00 0.00 H new ATOM 0 HG2 GLU A 67 2.473 7.945 6.070 1.00 0.00 H new ATOM 0 HG3 GLU A 67 2.885 8.838 4.620 1.00 0.00 H new ATOM 954 N VAL A 68 3.603 6.389 4.624 1.00 0.00 N ATOM 955 CA VAL A 68 4.707 5.795 5.359 1.00 0.00 C ATOM 956 C VAL A 68 5.678 6.896 5.789 1.00 0.00 C ATOM 957 O VAL A 68 6.236 7.600 4.949 1.00 0.00 O ATOM 958 CB VAL A 68 5.372 4.707 4.515 1.00 0.00 C ATOM 959 CG1 VAL A 68 6.887 4.911 4.452 1.00 0.00 C ATOM 960 CG2 VAL A 68 5.029 3.314 5.046 1.00 0.00 C ATOM 0 H VAL A 68 3.869 7.147 3.995 1.00 0.00 H new ATOM 0 HA VAL A 68 4.345 5.309 6.265 1.00 0.00 H new ATOM 0 HB VAL A 68 4.981 4.785 3.501 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.335 4.124 3.846 1.00 0.00 H new ATOM 0 HG12 VAL A 68 7.105 5.881 4.006 1.00 0.00 H new ATOM 0 HG13 VAL A 68 7.301 4.873 5.459 1.00 0.00 H new ATOM 0 HG21 VAL A 68 5.515 2.559 4.428 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.378 3.220 6.074 1.00 0.00 H new ATOM 0 HG23 VAL A 68 3.949 3.169 5.015 1.00 0.00 H new ATOM 970 N ASP A 69 5.851 7.010 7.098 1.00 0.00 N ATOM 971 CA ASP A 69 6.746 8.013 7.650 1.00 0.00 C ATOM 972 C ASP A 69 6.398 9.381 7.059 1.00 0.00 C ATOM 973 O ASP A 69 7.229 10.288 7.054 1.00 0.00 O ATOM 974 CB ASP A 69 8.203 7.704 7.301 1.00 0.00 C ATOM 975 CG ASP A 69 9.000 7.013 8.409 1.00 0.00 C ATOM 976 OD1 ASP A 69 8.564 7.122 9.575 1.00 0.00 O ATOM 977 OD2 ASP A 69 10.028 6.390 8.064 1.00 0.00 O ATOM 0 H ASP A 69 5.387 6.424 7.792 1.00 0.00 H new ATOM 0 HA ASP A 69 6.627 8.011 8.733 1.00 0.00 H new ATOM 0 HB2 ASP A 69 8.222 7.073 6.412 1.00 0.00 H new ATOM 0 HB3 ASP A 69 8.704 8.636 7.041 1.00 0.00 H new ATOM 982 N GLY A 70 5.169 9.486 6.575 1.00 0.00 N ATOM 983 CA GLY A 70 4.702 10.728 5.983 1.00 0.00 C ATOM 984 C GLY A 70 4.579 10.598 4.463 1.00 0.00 C ATOM 985 O GLY A 70 3.760 11.275 3.843 1.00 0.00 O ATOM 0 H GLY A 70 4.483 8.731 6.581 1.00 0.00 H new ATOM 0 HA2 GLY A 70 3.735 10.997 6.408 1.00 0.00 H new ATOM 0 HA3 GLY A 70 5.393 11.534 6.228 1.00 0.00 H new ATOM 989 N ILE A 71 5.405 9.724 3.907 1.00 0.00 N ATOM 990 CA ILE A 71 5.399 9.498 2.472 1.00 0.00 C ATOM 991 C ILE A 71 4.067 8.865 2.065 1.00 0.00 C ATOM 992 O ILE A 71 3.575 7.960 2.737 1.00 0.00 O ATOM 993 CB ILE A 71 6.622 8.678 2.054 1.00 0.00 C ATOM 994 CG1 ILE A 71 7.912 9.477 2.254 1.00 0.00 C ATOM 995 CG2 ILE A 71 6.478 8.172 0.618 1.00 0.00 C ATOM 996 CD1 ILE A 71 9.137 8.642 1.878 1.00 0.00 C ATOM 0 H ILE A 71 6.083 9.164 4.424 1.00 0.00 H new ATOM 0 HA ILE A 71 5.479 10.444 1.937 1.00 0.00 H new ATOM 0 HB ILE A 71 6.683 7.802 2.699 1.00 0.00 H new ATOM 0 HG12 ILE A 71 7.882 10.381 1.645 1.00 0.00 H new ATOM 0 HG13 ILE A 71 7.989 9.795 3.294 1.00 0.00 H new ATOM 0 HG21 ILE A 71 7.360 7.593 0.346 1.00 0.00 H new ATOM 0 HG22 ILE A 71 5.592 7.542 0.541 1.00 0.00 H new ATOM 0 HG23 ILE A 71 6.379 9.021 -0.059 1.00 0.00 H new ATOM 0 HD11 ILE A 71 10.040 9.233 2.029 1.00 0.00 H new ATOM 0 HD12 ILE A 71 9.177 7.751 2.505 1.00 0.00 H new ATOM 0 HD13 ILE A 71 9.068 8.346 0.831 1.00 0.00 H new ATOM 1008 N SER A 72 3.521 9.367 0.967 1.00 0.00 N ATOM 1009 CA SER A 72 2.255 8.863 0.463 1.00 0.00 C ATOM 1010 C SER A 72 2.504 7.745 -0.551 1.00 0.00 C ATOM 1011 O SER A 72 3.198 7.947 -1.546 1.00 0.00 O ATOM 1012 CB SER A 72 1.430 9.983 -0.174 1.00 0.00 C ATOM 1013 OG SER A 72 0.497 9.483 -1.128 1.00 0.00 O ATOM 0 H SER A 72 3.932 10.118 0.412 1.00 0.00 H new ATOM 0 HA SER A 72 1.687 8.464 1.303 1.00 0.00 H new ATOM 0 HB2 SER A 72 0.896 10.527 0.605 1.00 0.00 H new ATOM 0 HB3 SER A 72 2.098 10.695 -0.659 1.00 0.00 H new ATOM 0 HG SER A 72 -0.011 10.229 -1.511 1.00 0.00 H new ATOM 1019 N LEU A 73 1.924 6.588 -0.263 1.00 0.00 N ATOM 1020 CA LEU A 73 2.074 5.438 -1.138 1.00 0.00 C ATOM 1021 C LEU A 73 0.757 5.188 -1.875 1.00 0.00 C ATOM 1022 O LEU A 73 0.387 4.040 -2.119 1.00 0.00 O ATOM 1023 CB LEU A 73 2.577 4.227 -0.349 1.00 0.00 C ATOM 1024 CG LEU A 73 3.828 4.454 0.503 1.00 0.00 C ATOM 1025 CD1 LEU A 73 4.272 3.156 1.181 1.00 0.00 C ATOM 1026 CD2 LEU A 73 4.950 5.080 -0.327 1.00 0.00 C ATOM 0 H LEU A 73 1.350 6.423 0.564 1.00 0.00 H new ATOM 0 HA LEU A 73 2.832 5.633 -1.897 1.00 0.00 H new ATOM 0 HB2 LEU A 73 1.774 3.885 0.304 1.00 0.00 H new ATOM 0 HB3 LEU A 73 2.782 3.420 -1.052 1.00 0.00 H new ATOM 0 HG LEU A 73 3.579 5.162 1.294 1.00 0.00 H new ATOM 0 HD11 LEU A 73 5.163 3.345 1.780 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.472 2.790 1.825 1.00 0.00 H new ATOM 0 HD13 LEU A 73 4.498 2.407 0.421 1.00 0.00 H new ATOM 0 HD21 LEU A 73 5.827 5.231 0.302 1.00 0.00 H new ATOM 0 HD22 LEU A 73 5.206 4.416 -1.153 1.00 0.00 H new ATOM 0 HD23 LEU A 73 4.618 6.040 -0.723 1.00 0.00 H new ATOM 1038 N VAL A 74 0.086 6.280 -2.209 1.00 0.00 N ATOM 1039 CA VAL A 74 -1.182 6.193 -2.914 1.00 0.00 C ATOM 1040 C VAL A 74 -0.982 6.621 -4.369 1.00 0.00 C ATOM 1041 O VAL A 74 -0.280 7.594 -4.643 1.00 0.00 O ATOM 1042 CB VAL A 74 -2.242 7.023 -2.187 1.00 0.00 C ATOM 1043 CG1 VAL A 74 -3.496 7.185 -3.048 1.00 0.00 C ATOM 1044 CG2 VAL A 74 -2.584 6.407 -0.829 1.00 0.00 C ATOM 0 H VAL A 74 0.396 7.230 -2.005 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.544 5.165 -2.925 1.00 0.00 H new ATOM 0 HB VAL A 74 -1.828 8.015 -2.009 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -4.234 7.779 -2.508 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -3.236 7.689 -3.979 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.913 6.203 -3.271 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -3.340 7.016 -0.333 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.969 5.398 -0.974 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -1.687 6.368 -0.211 1.00 0.00 H new ATOM 1054 N GLY A 75 -1.611 5.874 -5.264 1.00 0.00 N ATOM 1055 CA GLY A 75 -1.511 6.164 -6.684 1.00 0.00 C ATOM 1056 C GLY A 75 -0.050 6.187 -7.138 1.00 0.00 C ATOM 1057 O GLY A 75 0.350 7.056 -7.912 1.00 0.00 O ATOM 0 H GLY A 75 -2.192 5.068 -5.033 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -2.060 5.413 -7.252 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.976 7.127 -6.896 1.00 0.00 H new ATOM 1061 N VAL A 76 0.708 5.223 -6.636 1.00 0.00 N ATOM 1062 CA VAL A 76 2.116 5.122 -6.979 1.00 0.00 C ATOM 1063 C VAL A 76 2.459 3.663 -7.286 1.00 0.00 C ATOM 1064 O VAL A 76 1.915 2.750 -6.665 1.00 0.00 O ATOM 1065 CB VAL A 76 2.972 5.714 -5.858 1.00 0.00 C ATOM 1066 CG1 VAL A 76 2.527 7.139 -5.523 1.00 0.00 C ATOM 1067 CG2 VAL A 76 2.940 4.823 -4.615 1.00 0.00 C ATOM 0 H VAL A 76 0.373 4.505 -5.994 1.00 0.00 H new ATOM 0 HA VAL A 76 2.332 5.702 -7.876 1.00 0.00 H new ATOM 0 HB VAL A 76 4.002 5.759 -6.211 1.00 0.00 H new ATOM 0 HG11 VAL A 76 3.152 7.537 -4.723 1.00 0.00 H new ATOM 0 HG12 VAL A 76 2.626 7.768 -6.407 1.00 0.00 H new ATOM 0 HG13 VAL A 76 1.486 7.129 -5.199 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.557 5.267 -3.833 1.00 0.00 H new ATOM 0 HG22 VAL A 76 1.914 4.731 -4.259 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.327 3.835 -4.865 1.00 0.00 H new ATOM 1077 N THR A 77 3.358 3.487 -8.242 1.00 0.00 N ATOM 1078 CA THR A 77 3.780 2.154 -8.638 1.00 0.00 C ATOM 1079 C THR A 77 4.547 1.478 -7.500 1.00 0.00 C ATOM 1080 O THR A 77 5.368 2.110 -6.838 1.00 0.00 O ATOM 1081 CB THR A 77 4.592 2.279 -9.929 1.00 0.00 C ATOM 1082 OG1 THR A 77 4.912 0.933 -10.269 1.00 0.00 O ATOM 1083 CG2 THR A 77 5.954 2.940 -9.702 1.00 0.00 C ATOM 0 H THR A 77 3.807 4.246 -8.755 1.00 0.00 H new ATOM 0 HA THR A 77 2.923 1.510 -8.838 1.00 0.00 H new ATOM 0 HB THR A 77 4.026 2.856 -10.660 1.00 0.00 H new ATOM 0 HG1 THR A 77 5.437 0.921 -11.096 1.00 0.00 H new ATOM 0 HG21 THR A 77 6.490 3.004 -10.649 1.00 0.00 H new ATOM 0 HG22 THR A 77 5.809 3.942 -9.298 1.00 0.00 H new ATOM 0 HG23 THR A 77 6.534 2.345 -8.997 1.00 0.00 H new ATOM 1091 N GLN A 78 4.252 0.200 -7.308 1.00 0.00 N ATOM 1092 CA GLN A 78 4.903 -0.569 -6.262 1.00 0.00 C ATOM 1093 C GLN A 78 6.364 -0.137 -6.117 1.00 0.00 C ATOM 1094 O GLN A 78 6.846 0.070 -5.005 1.00 0.00 O ATOM 1095 CB GLN A 78 4.800 -2.070 -6.540 1.00 0.00 C ATOM 1096 CG GLN A 78 4.829 -2.872 -5.238 1.00 0.00 C ATOM 1097 CD GLN A 78 5.174 -4.339 -5.505 1.00 0.00 C ATOM 1098 OE1 GLN A 78 4.683 -4.960 -6.432 1.00 0.00 O ATOM 1099 NE2 GLN A 78 6.045 -4.855 -4.642 1.00 0.00 N ATOM 0 H GLN A 78 3.571 -0.322 -7.860 1.00 0.00 H new ATOM 0 HA GLN A 78 4.391 -0.372 -5.320 1.00 0.00 H new ATOM 0 HB2 GLN A 78 3.877 -2.281 -7.081 1.00 0.00 H new ATOM 0 HB3 GLN A 78 5.624 -2.382 -7.182 1.00 0.00 H new ATOM 0 HG2 GLN A 78 5.563 -2.440 -4.557 1.00 0.00 H new ATOM 0 HG3 GLN A 78 3.859 -2.807 -4.745 1.00 0.00 H new ATOM 0 HE21 GLN A 78 6.418 -4.279 -3.888 1.00 0.00 H new ATOM 0 HE22 GLN A 78 6.340 -5.827 -4.735 1.00 0.00 H new ATOM 1108 N ASN A 79 7.027 -0.014 -7.257 1.00 0.00 N ATOM 1109 CA ASN A 79 8.423 0.389 -7.271 1.00 0.00 C ATOM 1110 C ASN A 79 8.627 1.541 -6.285 1.00 0.00 C ATOM 1111 O ASN A 79 9.516 1.487 -5.437 1.00 0.00 O ATOM 1112 CB ASN A 79 8.842 0.876 -8.660 1.00 0.00 C ATOM 1113 CG ASN A 79 10.013 0.052 -9.200 1.00 0.00 C ATOM 1114 OD1 ASN A 79 11.046 -0.095 -8.568 1.00 0.00 O ATOM 1115 ND2 ASN A 79 9.795 -0.475 -10.401 1.00 0.00 N ATOM 0 H ASN A 79 6.624 -0.186 -8.178 1.00 0.00 H new ATOM 0 HA ASN A 79 9.026 -0.476 -6.995 1.00 0.00 H new ATOM 0 HB2 ASN A 79 7.997 0.805 -9.344 1.00 0.00 H new ATOM 0 HB3 ASN A 79 9.125 1.928 -8.611 1.00 0.00 H new ATOM 0 HD21 ASN A 79 10.516 -1.042 -10.848 1.00 0.00 H new ATOM 0 HD22 ASN A 79 8.907 -0.313 -10.876 1.00 0.00 H new ATOM 1122 N PHE A 80 7.787 2.556 -6.429 1.00 0.00 N ATOM 1123 CA PHE A 80 7.864 3.719 -5.561 1.00 0.00 C ATOM 1124 C PHE A 80 7.725 3.316 -4.091 1.00 0.00 C ATOM 1125 O PHE A 80 8.569 3.663 -3.267 1.00 0.00 O ATOM 1126 CB PHE A 80 6.699 4.636 -5.939 1.00 0.00 C ATOM 1127 CG PHE A 80 6.510 5.823 -4.992 1.00 0.00 C ATOM 1128 CD1 PHE A 80 5.723 5.695 -3.890 1.00 0.00 C ATOM 1129 CD2 PHE A 80 7.129 7.006 -5.252 1.00 0.00 C ATOM 1130 CE1 PHE A 80 5.547 6.797 -3.012 1.00 0.00 C ATOM 1131 CE2 PHE A 80 6.953 8.107 -4.373 1.00 0.00 C ATOM 1132 CZ PHE A 80 6.166 7.980 -3.272 1.00 0.00 C ATOM 0 H PHE A 80 7.050 2.597 -7.133 1.00 0.00 H new ATOM 0 HA PHE A 80 8.828 4.213 -5.685 1.00 0.00 H new ATOM 0 HB2 PHE A 80 6.859 5.012 -6.949 1.00 0.00 H new ATOM 0 HB3 PHE A 80 5.780 4.050 -5.959 1.00 0.00 H new ATOM 0 HD1 PHE A 80 5.232 4.756 -3.683 1.00 0.00 H new ATOM 0 HD2 PHE A 80 7.754 7.108 -6.127 1.00 0.00 H new ATOM 0 HE1 PHE A 80 4.921 6.696 -2.137 1.00 0.00 H new ATOM 0 HE2 PHE A 80 7.445 9.046 -4.579 1.00 0.00 H new ATOM 0 HZ PHE A 80 6.032 8.818 -2.604 1.00 0.00 H new ATOM 1142 N ALA A 81 6.654 2.590 -3.809 1.00 0.00 N ATOM 1143 CA ALA A 81 6.394 2.137 -2.453 1.00 0.00 C ATOM 1144 C ALA A 81 7.598 1.340 -1.946 1.00 0.00 C ATOM 1145 O ALA A 81 8.048 1.539 -0.819 1.00 0.00 O ATOM 1146 CB ALA A 81 5.101 1.319 -2.427 1.00 0.00 C ATOM 0 H ALA A 81 5.956 2.304 -4.496 1.00 0.00 H new ATOM 0 HA ALA A 81 6.256 2.987 -1.785 1.00 0.00 H new ATOM 0 HB1 ALA A 81 4.906 0.979 -1.410 1.00 0.00 H new ATOM 0 HB2 ALA A 81 4.272 1.939 -2.768 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.203 0.456 -3.085 1.00 0.00 H new ATOM 1152 N ALA A 82 8.084 0.455 -2.803 1.00 0.00 N ATOM 1153 CA ALA A 82 9.227 -0.373 -2.457 1.00 0.00 C ATOM 1154 C ALA A 82 10.388 0.524 -2.024 1.00 0.00 C ATOM 1155 O ALA A 82 11.061 0.240 -1.034 1.00 0.00 O ATOM 1156 CB ALA A 82 9.591 -1.265 -3.646 1.00 0.00 C ATOM 0 H ALA A 82 7.707 0.293 -3.737 1.00 0.00 H new ATOM 0 HA ALA A 82 8.987 -1.029 -1.620 1.00 0.00 H new ATOM 0 HB1 ALA A 82 10.448 -1.886 -3.386 1.00 0.00 H new ATOM 0 HB2 ALA A 82 8.743 -1.903 -3.895 1.00 0.00 H new ATOM 0 HB3 ALA A 82 9.841 -0.642 -4.505 1.00 0.00 H new ATOM 1162 N THR A 83 10.588 1.589 -2.786 1.00 0.00 N ATOM 1163 CA THR A 83 11.656 2.530 -2.494 1.00 0.00 C ATOM 1164 C THR A 83 11.431 3.185 -1.130 1.00 0.00 C ATOM 1165 O THR A 83 12.329 3.202 -0.289 1.00 0.00 O ATOM 1166 CB THR A 83 11.730 3.534 -3.646 1.00 0.00 C ATOM 1167 OG1 THR A 83 12.294 2.788 -4.721 1.00 0.00 O ATOM 1168 CG2 THR A 83 12.750 4.646 -3.388 1.00 0.00 C ATOM 0 H THR A 83 10.028 1.821 -3.606 1.00 0.00 H new ATOM 0 HA THR A 83 12.619 2.025 -2.422 1.00 0.00 H new ATOM 0 HB THR A 83 10.746 3.974 -3.808 1.00 0.00 H new ATOM 0 HG1 THR A 83 11.591 2.265 -5.160 1.00 0.00 H new ATOM 0 HG21 THR A 83 12.763 5.331 -4.235 1.00 0.00 H new ATOM 0 HG22 THR A 83 12.474 5.191 -2.485 1.00 0.00 H new ATOM 0 HG23 THR A 83 13.740 4.209 -3.259 1.00 0.00 H new ATOM 1176 N VAL A 84 10.227 3.709 -0.952 1.00 0.00 N ATOM 1177 CA VAL A 84 9.872 4.364 0.295 1.00 0.00 C ATOM 1178 C VAL A 84 10.150 3.414 1.462 1.00 0.00 C ATOM 1179 O VAL A 84 10.899 3.751 2.377 1.00 0.00 O ATOM 1180 CB VAL A 84 8.418 4.838 0.243 1.00 0.00 C ATOM 1181 CG1 VAL A 84 7.977 5.402 1.595 1.00 0.00 C ATOM 1182 CG2 VAL A 84 8.216 5.865 -0.873 1.00 0.00 C ATOM 0 H VAL A 84 9.485 3.693 -1.651 1.00 0.00 H new ATOM 0 HA VAL A 84 10.484 5.253 0.447 1.00 0.00 H new ATOM 0 HB VAL A 84 7.791 3.974 0.020 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.940 5.732 1.531 1.00 0.00 H new ATOM 0 HG12 VAL A 84 8.065 4.629 2.358 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.611 6.248 1.861 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.174 6.186 -0.888 1.00 0.00 H new ATOM 0 HG22 VAL A 84 8.858 6.727 -0.695 1.00 0.00 H new ATOM 0 HG23 VAL A 84 8.471 5.415 -1.832 1.00 0.00 H new ATOM 1192 N LEU A 85 9.530 2.244 1.391 1.00 0.00 N ATOM 1193 CA LEU A 85 9.701 1.243 2.430 1.00 0.00 C ATOM 1194 C LEU A 85 11.194 0.990 2.648 1.00 0.00 C ATOM 1195 O LEU A 85 11.609 0.604 3.740 1.00 0.00 O ATOM 1196 CB LEU A 85 8.906 -0.020 2.093 1.00 0.00 C ATOM 1197 CG LEU A 85 7.392 0.156 1.960 1.00 0.00 C ATOM 1198 CD1 LEU A 85 6.744 -1.101 1.376 1.00 0.00 C ATOM 1199 CD2 LEU A 85 6.767 0.554 3.298 1.00 0.00 C ATOM 0 H LEU A 85 8.909 1.968 0.630 1.00 0.00 H new ATOM 0 HA LEU A 85 9.297 1.603 3.376 1.00 0.00 H new ATOM 0 HB2 LEU A 85 9.288 -0.427 1.157 1.00 0.00 H new ATOM 0 HB3 LEU A 85 9.099 -0.764 2.866 1.00 0.00 H new ATOM 0 HG LEU A 85 7.202 0.971 1.261 1.00 0.00 H new ATOM 0 HD11 LEU A 85 5.668 -0.950 1.292 1.00 0.00 H new ATOM 0 HD12 LEU A 85 7.161 -1.300 0.389 1.00 0.00 H new ATOM 0 HD13 LEU A 85 6.941 -1.950 2.031 1.00 0.00 H new ATOM 0 HD21 LEU A 85 5.690 0.673 3.176 1.00 0.00 H new ATOM 0 HD22 LEU A 85 6.965 -0.222 4.037 1.00 0.00 H new ATOM 0 HD23 LEU A 85 7.200 1.496 3.636 1.00 0.00 H new ATOM 1211 N ARG A 86 11.961 1.219 1.592 1.00 0.00 N ATOM 1212 CA ARG A 86 13.399 1.020 1.654 1.00 0.00 C ATOM 1213 C ARG A 86 14.084 2.271 2.210 1.00 0.00 C ATOM 1214 O ARG A 86 15.188 2.192 2.746 1.00 0.00 O ATOM 1215 CB ARG A 86 13.972 0.706 0.271 1.00 0.00 C ATOM 1216 CG ARG A 86 13.741 -0.760 -0.098 1.00 0.00 C ATOM 1217 CD ARG A 86 13.504 -0.917 -1.602 1.00 0.00 C ATOM 1218 NE ARG A 86 14.485 -1.866 -2.173 1.00 0.00 N ATOM 1219 CZ ARG A 86 14.464 -2.295 -3.442 1.00 0.00 C ATOM 1220 NH1 ARG A 86 13.513 -1.862 -4.280 1.00 0.00 N ATOM 1221 NH2 ARG A 86 15.395 -3.158 -3.873 1.00 0.00 N ATOM 0 H ARG A 86 11.614 1.541 0.689 1.00 0.00 H new ATOM 0 HA ARG A 86 13.588 0.173 2.314 1.00 0.00 H new ATOM 0 HB2 ARG A 86 13.506 1.350 -0.475 1.00 0.00 H new ATOM 0 HB3 ARG A 86 15.040 0.924 0.258 1.00 0.00 H new ATOM 0 HG2 ARG A 86 14.604 -1.354 0.202 1.00 0.00 H new ATOM 0 HG3 ARG A 86 12.882 -1.146 0.451 1.00 0.00 H new ATOM 0 HD2 ARG A 86 12.491 -1.276 -1.783 1.00 0.00 H new ATOM 0 HD3 ARG A 86 13.592 0.051 -2.095 1.00 0.00 H new ATOM 0 HE ARG A 86 15.223 -2.215 -1.562 1.00 0.00 H new ATOM 0 HH11 ARG A 86 12.805 -1.205 -3.952 1.00 0.00 H new ATOM 0 HH12 ARG A 86 13.497 -2.189 -5.246 1.00 0.00 H new ATOM 0 HH21 ARG A 86 16.119 -3.488 -3.235 1.00 0.00 H new ATOM 0 HH22 ARG A 86 15.379 -3.485 -4.839 1.00 0.00 H new ATOM 1235 N ASN A 87 13.399 3.396 2.064 1.00 0.00 N ATOM 1236 CA ASN A 87 13.928 4.661 2.545 1.00 0.00 C ATOM 1237 C ASN A 87 13.788 4.721 4.068 1.00 0.00 C ATOM 1238 O ASN A 87 14.700 5.169 4.761 1.00 0.00 O ATOM 1239 CB ASN A 87 13.156 5.841 1.952 1.00 0.00 C ATOM 1240 CG ASN A 87 13.892 6.428 0.747 1.00 0.00 C ATOM 1241 OD1 ASN A 87 15.027 6.869 0.834 1.00 0.00 O ATOM 1242 ND2 ASN A 87 13.186 6.410 -0.380 1.00 0.00 N ATOM 0 H ASN A 87 12.483 3.458 1.620 1.00 0.00 H new ATOM 0 HA ASN A 87 14.974 4.726 2.244 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.161 5.514 1.651 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.022 6.611 2.712 1.00 0.00 H new ATOM 0 HD21 ASN A 87 13.590 6.780 -1.241 1.00 0.00 H new ATOM 0 HD22 ASN A 87 12.241 6.026 -0.384 1.00 0.00 H new ATOM 1249 N THR A 88 12.639 4.264 4.543 1.00 0.00 N ATOM 1250 CA THR A 88 12.368 4.260 5.970 1.00 0.00 C ATOM 1251 C THR A 88 13.591 3.764 6.744 1.00 0.00 C ATOM 1252 O THR A 88 14.493 3.161 6.166 1.00 0.00 O ATOM 1253 CB THR A 88 11.113 3.418 6.211 1.00 0.00 C ATOM 1254 OG1 THR A 88 11.478 2.116 5.762 1.00 0.00 O ATOM 1255 CG2 THR A 88 9.955 3.817 5.295 1.00 0.00 C ATOM 0 H THR A 88 11.885 3.894 3.965 1.00 0.00 H new ATOM 0 HA THR A 88 12.176 5.268 6.339 1.00 0.00 H new ATOM 0 HB THR A 88 10.803 3.518 7.251 1.00 0.00 H new ATOM 0 HG1 THR A 88 11.211 2.006 4.826 1.00 0.00 H new ATOM 0 HG21 THR A 88 9.090 3.189 5.507 1.00 0.00 H new ATOM 0 HG22 THR A 88 9.696 4.861 5.469 1.00 0.00 H new ATOM 0 HG23 THR A 88 10.252 3.686 4.255 1.00 0.00 H new ATOM 1263 N LYS A 89 13.582 4.037 8.041 1.00 0.00 N ATOM 1264 CA LYS A 89 14.679 3.626 8.900 1.00 0.00 C ATOM 1265 C LYS A 89 14.115 3.005 10.179 1.00 0.00 C ATOM 1266 O LYS A 89 12.917 2.739 10.268 1.00 0.00 O ATOM 1267 CB LYS A 89 15.629 4.798 9.153 1.00 0.00 C ATOM 1268 CG LYS A 89 16.255 5.289 7.845 1.00 0.00 C ATOM 1269 CD LYS A 89 17.738 4.921 7.774 1.00 0.00 C ATOM 1270 CE LYS A 89 18.118 4.446 6.371 1.00 0.00 C ATOM 1271 NZ LYS A 89 19.360 3.641 6.415 1.00 0.00 N ATOM 0 H LYS A 89 12.832 4.538 8.517 1.00 0.00 H new ATOM 0 HA LYS A 89 15.279 2.859 8.411 1.00 0.00 H new ATOM 0 HB2 LYS A 89 15.086 5.614 9.629 1.00 0.00 H new ATOM 0 HB3 LYS A 89 16.415 4.491 9.844 1.00 0.00 H new ATOM 0 HG2 LYS A 89 15.727 4.851 6.998 1.00 0.00 H new ATOM 0 HG3 LYS A 89 16.141 6.370 7.767 1.00 0.00 H new ATOM 0 HD2 LYS A 89 18.344 5.785 8.046 1.00 0.00 H new ATOM 0 HD3 LYS A 89 17.957 4.137 8.499 1.00 0.00 H new ATOM 0 HE2 LYS A 89 17.307 3.852 5.950 1.00 0.00 H new ATOM 0 HE3 LYS A 89 18.258 5.305 5.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 19.604 3.326 5.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 20.135 4.219 6.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 19.214 2.811 7.025 1.00 0.00 H new ATOM 1285 N GLY A 90 15.004 2.792 11.138 1.00 0.00 N ATOM 1286 CA GLY A 90 14.610 2.207 12.408 1.00 0.00 C ATOM 1287 C GLY A 90 13.102 2.345 12.631 1.00 0.00 C ATOM 1288 O GLY A 90 12.347 1.402 12.398 1.00 0.00 O ATOM 0 H GLY A 90 15.996 3.014 11.061 1.00 0.00 H new ATOM 0 HA2 GLY A 90 14.890 1.154 12.430 1.00 0.00 H new ATOM 0 HA3 GLY A 90 15.148 2.696 13.220 1.00 0.00 H new ATOM 1292 N ASN A 91 12.709 3.528 13.079 1.00 0.00 N ATOM 1293 CA ASN A 91 11.305 3.802 13.335 1.00 0.00 C ATOM 1294 C ASN A 91 10.612 4.167 12.021 1.00 0.00 C ATOM 1295 O ASN A 91 11.165 4.907 11.208 1.00 0.00 O ATOM 1296 CB ASN A 91 11.141 4.979 14.299 1.00 0.00 C ATOM 1297 CG ASN A 91 9.668 5.197 14.653 1.00 0.00 C ATOM 1298 OD1 ASN A 91 9.026 6.130 14.201 1.00 0.00 O ATOM 1299 ND2 ASN A 91 9.171 4.285 15.484 1.00 0.00 N ATOM 0 H ASN A 91 13.338 4.308 13.271 1.00 0.00 H new ATOM 0 HA ASN A 91 10.863 2.909 13.777 1.00 0.00 H new ATOM 0 HB2 ASN A 91 11.713 4.792 15.208 1.00 0.00 H new ATOM 0 HB3 ASN A 91 11.548 5.884 13.847 1.00 0.00 H new ATOM 0 HD21 ASN A 91 8.197 4.342 15.780 1.00 0.00 H new ATOM 0 HD22 ASN A 91 9.764 3.529 15.825 1.00 0.00 H new ATOM 1306 N VAL A 92 9.412 3.631 11.853 1.00 0.00 N ATOM 1307 CA VAL A 92 8.638 3.891 10.651 1.00 0.00 C ATOM 1308 C VAL A 92 7.163 4.047 11.023 1.00 0.00 C ATOM 1309 O VAL A 92 6.622 3.243 11.781 1.00 0.00 O ATOM 1310 CB VAL A 92 8.881 2.784 9.622 1.00 0.00 C ATOM 1311 CG1 VAL A 92 8.187 3.105 8.297 1.00 0.00 C ATOM 1312 CG2 VAL A 92 10.379 2.548 9.414 1.00 0.00 C ATOM 0 H VAL A 92 8.957 3.018 12.529 1.00 0.00 H new ATOM 0 HA VAL A 92 8.957 4.824 10.186 1.00 0.00 H new ATOM 0 HB VAL A 92 8.448 1.863 10.012 1.00 0.00 H new ATOM 0 HG11 VAL A 92 8.376 2.303 7.584 1.00 0.00 H new ATOM 0 HG12 VAL A 92 7.114 3.199 8.462 1.00 0.00 H new ATOM 0 HG13 VAL A 92 8.577 4.042 7.900 1.00 0.00 H new ATOM 0 HG21 VAL A 92 10.524 1.757 8.678 1.00 0.00 H new ATOM 0 HG22 VAL A 92 10.846 3.466 9.057 1.00 0.00 H new ATOM 0 HG23 VAL A 92 10.835 2.253 10.359 1.00 0.00 H new ATOM 1322 N ARG A 93 6.554 5.088 10.474 1.00 0.00 N ATOM 1323 CA ARG A 93 5.151 5.360 10.739 1.00 0.00 C ATOM 1324 C ARG A 93 4.297 4.968 9.532 1.00 0.00 C ATOM 1325 O ARG A 93 4.312 5.650 8.508 1.00 0.00 O ATOM 1326 CB ARG A 93 4.928 6.840 11.055 1.00 0.00 C ATOM 1327 CG ARG A 93 4.096 7.010 12.328 1.00 0.00 C ATOM 1328 CD ARG A 93 3.382 8.363 12.340 1.00 0.00 C ATOM 1329 NE ARG A 93 3.356 8.909 13.716 1.00 0.00 N ATOM 1330 CZ ARG A 93 2.899 10.128 14.032 1.00 0.00 C ATOM 1331 NH1 ARG A 93 2.426 10.935 13.072 1.00 0.00 N ATOM 1332 NH2 ARG A 93 2.914 10.540 15.307 1.00 0.00 N ATOM 0 H ARG A 93 7.006 5.753 9.847 1.00 0.00 H new ATOM 0 HA ARG A 93 4.855 4.767 11.604 1.00 0.00 H new ATOM 0 HB2 ARG A 93 5.890 7.339 11.176 1.00 0.00 H new ATOM 0 HB3 ARG A 93 4.422 7.322 10.218 1.00 0.00 H new ATOM 0 HG2 ARG A 93 3.362 6.207 12.397 1.00 0.00 H new ATOM 0 HG3 ARG A 93 4.742 6.928 13.202 1.00 0.00 H new ATOM 0 HD2 ARG A 93 3.892 9.059 11.673 1.00 0.00 H new ATOM 0 HD3 ARG A 93 2.365 8.250 11.965 1.00 0.00 H new ATOM 0 HE ARG A 93 3.708 8.320 14.471 1.00 0.00 H new ATOM 0 HH11 ARG A 93 2.414 10.621 12.102 1.00 0.00 H new ATOM 0 HH12 ARG A 93 2.078 11.863 13.312 1.00 0.00 H new ATOM 0 HH21 ARG A 93 3.273 9.925 16.037 1.00 0.00 H new ATOM 0 HH22 ARG A 93 2.566 11.468 15.547 1.00 0.00 H new ATOM 1346 N PHE A 94 3.572 3.870 9.691 1.00 0.00 N ATOM 1347 CA PHE A 94 2.713 3.380 8.627 1.00 0.00 C ATOM 1348 C PHE A 94 1.253 3.760 8.882 1.00 0.00 C ATOM 1349 O PHE A 94 0.693 3.424 9.925 1.00 0.00 O ATOM 1350 CB PHE A 94 2.837 1.855 8.619 1.00 0.00 C ATOM 1351 CG PHE A 94 4.240 1.346 8.281 1.00 0.00 C ATOM 1352 CD1 PHE A 94 4.631 1.244 6.983 1.00 0.00 C ATOM 1353 CD2 PHE A 94 5.095 0.997 9.279 1.00 0.00 C ATOM 1354 CE1 PHE A 94 5.933 0.772 6.669 1.00 0.00 C ATOM 1355 CE2 PHE A 94 6.397 0.525 8.965 1.00 0.00 C ATOM 1356 CZ PHE A 94 6.789 0.422 7.667 1.00 0.00 C ATOM 0 H PHE A 94 3.562 3.306 10.541 1.00 0.00 H new ATOM 0 HA PHE A 94 3.013 3.818 7.675 1.00 0.00 H new ATOM 0 HB2 PHE A 94 2.549 1.472 9.598 1.00 0.00 H new ATOM 0 HB3 PHE A 94 2.130 1.447 7.897 1.00 0.00 H new ATOM 0 HD1 PHE A 94 3.952 1.522 6.191 1.00 0.00 H new ATOM 0 HD2 PHE A 94 4.784 1.079 10.310 1.00 0.00 H new ATOM 0 HE1 PHE A 94 6.244 0.691 5.638 1.00 0.00 H new ATOM 0 HE2 PHE A 94 7.076 0.248 9.758 1.00 0.00 H new ATOM 0 HZ PHE A 94 7.779 0.063 7.428 1.00 0.00 H new ATOM 1366 N VAL A 95 0.678 4.454 7.911 1.00 0.00 N ATOM 1367 CA VAL A 95 -0.706 4.883 8.017 1.00 0.00 C ATOM 1368 C VAL A 95 -1.594 3.931 7.214 1.00 0.00 C ATOM 1369 O VAL A 95 -1.770 4.107 6.009 1.00 0.00 O ATOM 1370 CB VAL A 95 -0.838 6.341 7.572 1.00 0.00 C ATOM 1371 CG1 VAL A 95 -2.242 6.626 7.036 1.00 0.00 C ATOM 1372 CG2 VAL A 95 -0.482 7.297 8.712 1.00 0.00 C ATOM 0 H VAL A 95 1.145 4.730 7.047 1.00 0.00 H new ATOM 0 HA VAL A 95 -1.039 4.842 9.054 1.00 0.00 H new ATOM 0 HB VAL A 95 -0.129 6.509 6.761 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.309 7.669 6.727 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.443 5.980 6.181 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.976 6.432 7.818 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -0.584 8.327 8.369 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -1.154 7.127 9.553 1.00 0.00 H new ATOM 0 HG23 VAL A 95 0.546 7.120 9.028 1.00 0.00 H new ATOM 1382 N ILE A 96 -2.130 2.941 7.914 1.00 0.00 N ATOM 1383 CA ILE A 96 -2.995 1.961 7.281 1.00 0.00 C ATOM 1384 C ILE A 96 -4.400 2.548 7.129 1.00 0.00 C ATOM 1385 O ILE A 96 -4.780 3.456 7.867 1.00 0.00 O ATOM 1386 CB ILE A 96 -2.961 0.639 8.051 1.00 0.00 C ATOM 1387 CG1 ILE A 96 -1.547 0.331 8.549 1.00 0.00 C ATOM 1388 CG2 ILE A 96 -3.533 -0.502 7.208 1.00 0.00 C ATOM 1389 CD1 ILE A 96 -0.514 0.570 7.446 1.00 0.00 C ATOM 0 H ILE A 96 -1.982 2.797 8.913 1.00 0.00 H new ATOM 0 HA ILE A 96 -2.636 1.729 6.278 1.00 0.00 H new ATOM 0 HB ILE A 96 -3.598 0.739 8.930 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -1.316 0.958 9.410 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -1.493 -0.705 8.885 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.497 -1.430 7.779 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -4.567 -0.278 6.945 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -2.943 -0.613 6.298 1.00 0.00 H new ATOM 0 HD11 ILE A 96 0.482 0.344 7.826 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -0.734 -0.076 6.596 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -0.554 1.612 7.130 1.00 0.00 H new ATOM 1401 N GLY A 97 -5.133 2.006 6.168 1.00 0.00 N ATOM 1402 CA GLY A 97 -6.488 2.465 5.911 1.00 0.00 C ATOM 1403 C GLY A 97 -7.481 1.303 5.971 1.00 0.00 C ATOM 1404 O GLY A 97 -7.576 0.513 5.032 1.00 0.00 O ATOM 0 H GLY A 97 -4.815 1.253 5.558 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -6.764 3.222 6.644 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -6.536 2.938 4.930 1.00 0.00 H new ATOM 1408 N ARG A 98 -8.197 1.235 7.084 1.00 0.00 N ATOM 1409 CA ARG A 98 -9.179 0.182 7.279 1.00 0.00 C ATOM 1410 C ARG A 98 -10.594 0.737 7.096 1.00 0.00 C ATOM 1411 O ARG A 98 -10.826 1.929 7.288 1.00 0.00 O ATOM 1412 CB ARG A 98 -9.057 -0.434 8.674 1.00 0.00 C ATOM 1413 CG ARG A 98 -8.742 -1.929 8.587 1.00 0.00 C ATOM 1414 CD ARG A 98 -7.275 -2.201 8.924 1.00 0.00 C ATOM 1415 NE ARG A 98 -7.122 -3.577 9.447 1.00 0.00 N ATOM 1416 CZ ARG A 98 -7.224 -4.682 8.694 1.00 0.00 C ATOM 1417 NH1 ARG A 98 -7.479 -4.578 7.383 1.00 0.00 N ATOM 1418 NH2 ARG A 98 -7.071 -5.890 9.254 1.00 0.00 N ATOM 0 H ARG A 98 -8.117 1.892 7.860 1.00 0.00 H new ATOM 0 HA ARG A 98 -8.988 -0.592 6.535 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -8.272 0.075 9.233 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -9.987 -0.286 9.224 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -9.385 -2.480 9.273 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -8.962 -2.293 7.583 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -6.659 -2.071 8.034 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -6.924 -1.481 9.663 1.00 0.00 H new ATOM 0 HE ARG A 98 -6.927 -3.692 10.442 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -7.596 -3.658 6.958 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -7.557 -5.418 6.810 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -6.877 -5.968 10.252 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -7.148 -6.731 8.682 1.00 0.00 H new ATOM 1432 N GLU A 99 -11.501 -0.155 6.728 1.00 0.00 N ATOM 1433 CA GLU A 99 -12.887 0.230 6.518 1.00 0.00 C ATOM 1434 C GLU A 99 -13.541 0.606 7.849 1.00 0.00 C ATOM 1435 O GLU A 99 -13.544 -0.187 8.789 1.00 0.00 O ATOM 1436 CB GLU A 99 -13.666 -0.887 5.820 1.00 0.00 C ATOM 1437 CG GLU A 99 -14.257 -0.397 4.496 1.00 0.00 C ATOM 1438 CD GLU A 99 -14.436 -1.557 3.514 1.00 0.00 C ATOM 1439 OE1 GLU A 99 -14.852 -2.639 3.982 1.00 0.00 O ATOM 1440 OE2 GLU A 99 -14.153 -1.336 2.316 1.00 0.00 O ATOM 0 H GLU A 99 -11.304 -1.143 6.570 1.00 0.00 H new ATOM 0 HA GLU A 99 -12.907 1.104 5.867 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -13.007 -1.735 5.637 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -14.466 -1.240 6.471 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -15.219 0.082 4.678 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -13.603 0.357 4.058 1.00 0.00 H new