USER MOD reduce.3.24.130724 H: found=0, std=0, add=276, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 277 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A2963 SER OG : rot 180:sc= 0 USER MOD Single : A2971 SER OG : rot 93:sc= 0.211 USER MOD Single : A2986 GLN : amide:sc= -0.782 K(o=-0.78,f=-0.036) USER MOD Single : A2987 ASN : amide:sc= -0.224 K(o=-0.22,f=-0.75) USER MOD Single : A2988 GLN : amide:sc= -0.709 X(o=-0.71,f=-0.91) USER MOD ----------------------------------------------------------------- ATOM 81 N ASP A2957 -6.652 5.094 -13.004 1.00 0.00 N ATOM 82 CA ASP A2957 -6.537 5.752 -14.314 1.00 0.00 C ATOM 83 C ASP A2957 -7.917 6.327 -14.726 1.00 0.00 C ATOM 84 O ASP A2957 -8.925 5.664 -14.491 1.00 0.00 O ATOM 85 CB ASP A2957 -6.013 4.720 -15.355 1.00 0.00 C ATOM 86 CG ASP A2957 -5.697 5.342 -16.718 1.00 0.00 C ATOM 87 OD1 ASP A2957 -4.622 5.964 -16.866 1.00 0.00 O ATOM 88 OD2 ASP A2957 -6.517 5.222 -17.641 1.00 0.00 O ATOM 0 HA ASP A2957 -5.830 6.580 -14.265 1.00 0.00 H new ATOM 0 HB2 ASP A2957 -5.114 4.244 -14.963 1.00 0.00 H new ATOM 0 HB3 ASP A2957 -6.758 3.935 -15.485 1.00 0.00 H new ATOM 93 N PRO A2958 -7.999 7.562 -15.341 1.00 0.00 N ATOM 94 CA PRO A2958 -9.293 8.176 -15.792 1.00 0.00 C ATOM 95 C PRO A2958 -10.084 7.296 -16.798 1.00 0.00 C ATOM 96 O PRO A2958 -11.316 7.296 -16.783 1.00 0.00 O ATOM 97 CB PRO A2958 -8.853 9.515 -16.454 1.00 0.00 C ATOM 98 CG PRO A2958 -7.404 9.297 -16.782 1.00 0.00 C ATOM 99 CD PRO A2958 -6.861 8.471 -15.639 1.00 0.00 C ATOM 0 HA PRO A2958 -9.981 8.301 -14.956 1.00 0.00 H new ATOM 0 HB2 PRO A2958 -9.437 9.729 -17.349 1.00 0.00 H new ATOM 0 HB3 PRO A2958 -8.987 10.358 -15.777 1.00 0.00 H new ATOM 0 HG2 PRO A2958 -7.289 8.777 -17.733 1.00 0.00 H new ATOM 0 HG3 PRO A2958 -6.873 10.245 -16.870 1.00 0.00 H new ATOM 0 HD2 PRO A2958 -5.964 7.921 -15.924 1.00 0.00 H new ATOM 0 HD3 PRO A2958 -6.597 9.088 -14.780 1.00 0.00 H new ATOM 107 N LEU A2959 -9.357 6.540 -17.652 1.00 0.00 N ATOM 108 CA LEU A2959 -9.970 5.684 -18.704 1.00 0.00 C ATOM 109 C LEU A2959 -10.635 4.431 -18.066 1.00 0.00 C ATOM 110 O LEU A2959 -11.467 3.776 -18.701 1.00 0.00 O ATOM 111 CB LEU A2959 -8.879 5.337 -19.782 1.00 0.00 C ATOM 112 CG LEU A2959 -9.323 4.723 -21.173 1.00 0.00 C ATOM 113 CD1 LEU A2959 -9.529 3.183 -21.125 1.00 0.00 C ATOM 114 CD2 LEU A2959 -10.584 5.441 -21.718 1.00 0.00 C ATOM 0 H LEU A2959 -8.338 6.503 -17.636 1.00 0.00 H new ATOM 0 HA LEU A2959 -10.772 6.217 -19.214 1.00 0.00 H new ATOM 0 HB2 LEU A2959 -8.324 6.252 -19.991 1.00 0.00 H new ATOM 0 HB3 LEU A2959 -8.179 4.637 -19.325 1.00 0.00 H new ATOM 0 HG LEU A2959 -8.498 4.896 -21.864 1.00 0.00 H new ATOM 0 HD11 LEU A2959 -9.832 2.826 -22.109 1.00 0.00 H new ATOM 0 HD12 LEU A2959 -8.596 2.700 -20.835 1.00 0.00 H new ATOM 0 HD13 LEU A2959 -10.304 2.942 -20.397 1.00 0.00 H new ATOM 0 HD21 LEU A2959 -10.869 5.001 -22.674 1.00 0.00 H new ATOM 0 HD22 LEU A2959 -11.403 5.327 -21.008 1.00 0.00 H new ATOM 0 HD23 LEU A2959 -10.368 6.500 -21.856 1.00 0.00 H new ATOM 126 N ALA A2960 -10.304 4.145 -16.782 1.00 0.00 N ATOM 127 CA ALA A2960 -10.999 3.101 -15.979 1.00 0.00 C ATOM 128 C ALA A2960 -12.497 3.430 -15.789 1.00 0.00 C ATOM 129 O ALA A2960 -13.313 2.535 -15.525 1.00 0.00 O ATOM 130 CB ALA A2960 -10.323 2.917 -14.614 1.00 0.00 C ATOM 0 H ALA A2960 -9.558 4.623 -16.277 1.00 0.00 H new ATOM 0 HA ALA A2960 -10.926 2.167 -16.536 1.00 0.00 H new ATOM 0 HB1 ALA A2960 -10.850 2.149 -14.048 1.00 0.00 H new ATOM 0 HB2 ALA A2960 -9.286 2.613 -14.759 1.00 0.00 H new ATOM 0 HB3 ALA A2960 -10.352 3.858 -14.064 1.00 0.00 H new ATOM 136 N GLY A2961 -12.840 4.725 -15.944 1.00 0.00 N ATOM 137 CA GLY A2961 -14.218 5.216 -15.851 1.00 0.00 C ATOM 138 C GLY A2961 -14.441 6.139 -14.668 1.00 0.00 C ATOM 139 O GLY A2961 -15.578 6.548 -14.403 1.00 0.00 O ATOM 0 H GLY A2961 -12.159 5.459 -16.138 1.00 0.00 H new ATOM 0 HA2 GLY A2961 -14.472 5.745 -16.770 1.00 0.00 H new ATOM 0 HA3 GLY A2961 -14.896 4.366 -15.774 1.00 0.00 H new ATOM 143 N ILE A2962 -13.351 6.473 -13.951 1.00 0.00 N ATOM 144 CA ILE A2962 -13.396 7.366 -12.779 1.00 0.00 C ATOM 145 C ILE A2962 -13.131 8.826 -13.187 1.00 0.00 C ATOM 146 O ILE A2962 -12.367 9.093 -14.122 1.00 0.00 O ATOM 147 CB ILE A2962 -12.383 6.922 -11.657 1.00 0.00 C ATOM 148 CG1 ILE A2962 -10.964 6.662 -12.260 1.00 0.00 C ATOM 149 CG2 ILE A2962 -12.914 5.685 -10.892 1.00 0.00 C ATOM 150 CD1 ILE A2962 -9.890 6.267 -11.267 1.00 0.00 C ATOM 0 H ILE A2962 -12.415 6.131 -14.169 1.00 0.00 H new ATOM 0 HA ILE A2962 -14.402 7.293 -12.365 1.00 0.00 H new ATOM 0 HB ILE A2962 -12.290 7.736 -10.938 1.00 0.00 H new ATOM 0 HG12 ILE A2962 -11.047 5.875 -13.010 1.00 0.00 H new ATOM 0 HG13 ILE A2962 -10.639 7.564 -12.779 1.00 0.00 H new ATOM 0 HG21 ILE A2962 -12.197 5.398 -10.123 1.00 0.00 H new ATOM 0 HG22 ILE A2962 -13.869 5.928 -10.426 1.00 0.00 H new ATOM 0 HG23 ILE A2962 -13.050 4.857 -11.588 1.00 0.00 H new ATOM 0 HD11 ILE A2962 -8.948 6.111 -11.793 1.00 0.00 H new ATOM 0 HD12 ILE A2962 -9.767 7.060 -10.529 1.00 0.00 H new ATOM 0 HD13 ILE A2962 -10.181 5.345 -10.764 1.00 0.00 H new ATOM 162 N SER A2963 -13.766 9.750 -12.458 1.00 0.00 N ATOM 163 CA SER A2963 -13.721 11.194 -12.735 1.00 0.00 C ATOM 164 C SER A2963 -12.739 11.884 -11.772 1.00 0.00 C ATOM 165 O SER A2963 -13.090 12.185 -10.622 1.00 0.00 O ATOM 166 CB SER A2963 -15.150 11.780 -12.587 1.00 0.00 C ATOM 167 OG SER A2963 -15.184 13.181 -12.839 1.00 0.00 O ATOM 0 H SER A2963 -14.335 9.514 -11.645 1.00 0.00 H new ATOM 0 HA SER A2963 -13.370 11.368 -13.752 1.00 0.00 H new ATOM 0 HB2 SER A2963 -15.823 11.272 -13.278 1.00 0.00 H new ATOM 0 HB3 SER A2963 -15.519 11.584 -11.580 1.00 0.00 H new ATOM 0 HG SER A2963 -16.102 13.510 -12.737 1.00 0.00 H new ATOM 173 N LEU A2964 -11.489 12.076 -12.230 1.00 0.00 N ATOM 174 CA LEU A2964 -10.490 12.879 -11.497 1.00 0.00 C ATOM 175 C LEU A2964 -10.678 14.372 -11.834 1.00 0.00 C ATOM 176 O LEU A2964 -10.888 14.706 -13.010 1.00 0.00 O ATOM 177 CB LEU A2964 -9.027 12.450 -11.825 1.00 0.00 C ATOM 178 CG LEU A2964 -8.571 11.048 -11.287 1.00 0.00 C ATOM 179 CD1 LEU A2964 -9.068 9.889 -12.175 1.00 0.00 C ATOM 180 CD2 LEU A2964 -7.040 10.991 -11.074 1.00 0.00 C ATOM 0 H LEU A2964 -11.145 11.685 -13.107 1.00 0.00 H new ATOM 0 HA LEU A2964 -10.651 12.707 -10.433 1.00 0.00 H new ATOM 0 HB2 LEU A2964 -8.904 12.456 -12.908 1.00 0.00 H new ATOM 0 HB3 LEU A2964 -8.352 13.206 -11.423 1.00 0.00 H new ATOM 0 HG LEU A2964 -9.041 10.917 -10.313 1.00 0.00 H new ATOM 0 HD11 LEU A2964 -8.726 8.941 -11.760 1.00 0.00 H new ATOM 0 HD12 LEU A2964 -10.157 9.898 -12.210 1.00 0.00 H new ATOM 0 HD13 LEU A2964 -8.672 10.008 -13.184 1.00 0.00 H new ATOM 0 HD21 LEU A2964 -6.761 10.006 -10.701 1.00 0.00 H new ATOM 0 HD22 LEU A2964 -6.534 11.177 -12.021 1.00 0.00 H new ATOM 0 HD23 LEU A2964 -6.745 11.750 -10.349 1.00 0.00 H new ATOM 192 N PRO A2965 -10.613 15.292 -10.812 1.00 0.00 N ATOM 193 CA PRO A2965 -10.733 16.755 -11.040 1.00 0.00 C ATOM 194 C PRO A2965 -9.532 17.319 -11.848 1.00 0.00 C ATOM 195 O PRO A2965 -8.390 16.896 -11.647 1.00 0.00 O ATOM 196 CB PRO A2965 -10.788 17.341 -9.601 1.00 0.00 C ATOM 197 CG PRO A2965 -10.086 16.320 -8.753 1.00 0.00 C ATOM 198 CD PRO A2965 -10.419 14.977 -9.363 1.00 0.00 C ATOM 0 HA PRO A2965 -11.607 17.016 -11.637 1.00 0.00 H new ATOM 0 HB2 PRO A2965 -10.292 18.310 -9.548 1.00 0.00 H new ATOM 0 HB3 PRO A2965 -11.816 17.491 -9.272 1.00 0.00 H new ATOM 0 HG2 PRO A2965 -9.009 16.490 -8.747 1.00 0.00 H new ATOM 0 HG3 PRO A2965 -10.423 16.373 -7.718 1.00 0.00 H new ATOM 0 HD2 PRO A2965 -9.615 14.257 -9.213 1.00 0.00 H new ATOM 0 HD3 PRO A2965 -11.318 14.547 -8.922 1.00 0.00 H new ATOM 206 N GLU A2966 -9.818 18.275 -12.752 1.00 0.00 N ATOM 207 CA GLU A2966 -8.810 18.862 -13.653 1.00 0.00 C ATOM 208 C GLU A2966 -7.712 19.603 -12.868 1.00 0.00 C ATOM 209 O GLU A2966 -8.005 20.538 -12.119 1.00 0.00 O ATOM 210 CB GLU A2966 -9.491 19.805 -14.679 1.00 0.00 C ATOM 211 CG GLU A2966 -8.533 20.452 -15.712 1.00 0.00 C ATOM 212 CD GLU A2966 -7.682 19.425 -16.486 1.00 0.00 C ATOM 213 OE1 GLU A2966 -8.214 18.760 -17.403 1.00 0.00 O ATOM 214 OE2 GLU A2966 -6.482 19.261 -16.172 1.00 0.00 O ATOM 0 H GLU A2966 -10.754 18.661 -12.878 1.00 0.00 H new ATOM 0 HA GLU A2966 -8.327 18.048 -14.194 1.00 0.00 H new ATOM 0 HB2 GLU A2966 -10.254 19.242 -15.217 1.00 0.00 H new ATOM 0 HB3 GLU A2966 -10.004 20.598 -14.136 1.00 0.00 H new ATOM 0 HG2 GLU A2966 -9.118 21.037 -16.422 1.00 0.00 H new ATOM 0 HG3 GLU A2966 -7.870 21.147 -15.196 1.00 0.00 H new ATOM 221 N GLY A2967 -6.452 19.180 -13.077 1.00 0.00 N ATOM 222 CA GLY A2967 -5.305 19.724 -12.350 1.00 0.00 C ATOM 223 C GLY A2967 -4.595 18.681 -11.492 1.00 0.00 C ATOM 224 O GLY A2967 -3.451 18.905 -11.087 1.00 0.00 O ATOM 0 H GLY A2967 -6.208 18.455 -13.752 1.00 0.00 H new ATOM 0 HA2 GLY A2967 -4.596 20.144 -13.063 1.00 0.00 H new ATOM 0 HA3 GLY A2967 -5.640 20.543 -11.714 1.00 0.00 H new ATOM 228 N VAL A2968 -5.276 17.557 -11.159 1.00 0.00 N ATOM 229 CA VAL A2968 -4.628 16.404 -10.483 1.00 0.00 C ATOM 230 C VAL A2968 -4.234 15.357 -11.541 1.00 0.00 C ATOM 231 O VAL A2968 -4.830 15.297 -12.628 1.00 0.00 O ATOM 232 CB VAL A2968 -5.544 15.748 -9.359 1.00 0.00 C ATOM 233 CG1 VAL A2968 -6.669 14.855 -9.934 1.00 0.00 C ATOM 234 CG2 VAL A2968 -4.707 14.980 -8.299 1.00 0.00 C ATOM 0 H VAL A2968 -6.270 17.424 -11.346 1.00 0.00 H new ATOM 0 HA VAL A2968 -3.740 16.775 -9.971 1.00 0.00 H new ATOM 0 HB VAL A2968 -6.034 16.583 -8.858 1.00 0.00 H new ATOM 0 HG11 VAL A2968 -7.257 14.438 -9.116 1.00 0.00 H new ATOM 0 HG12 VAL A2968 -7.315 15.453 -10.577 1.00 0.00 H new ATOM 0 HG13 VAL A2968 -6.229 14.044 -10.514 1.00 0.00 H new ATOM 0 HG21 VAL A2968 -5.373 14.549 -7.552 1.00 0.00 H new ATOM 0 HG22 VAL A2968 -4.145 14.183 -8.787 1.00 0.00 H new ATOM 0 HG23 VAL A2968 -4.015 15.668 -7.814 1.00 0.00 H new ATOM 244 N ASP A2969 -3.232 14.539 -11.215 1.00 0.00 N ATOM 245 CA ASP A2969 -2.714 13.493 -12.112 1.00 0.00 C ATOM 246 C ASP A2969 -2.632 12.169 -11.314 1.00 0.00 C ATOM 247 O ASP A2969 -2.073 12.155 -10.206 1.00 0.00 O ATOM 248 CB ASP A2969 -1.327 13.931 -12.664 1.00 0.00 C ATOM 249 CG ASP A2969 -0.715 12.936 -13.653 1.00 0.00 C ATOM 250 OD1 ASP A2969 0.013 12.028 -13.218 1.00 0.00 O ATOM 251 OD2 ASP A2969 -0.968 13.053 -14.869 1.00 0.00 O ATOM 0 H ASP A2969 -2.751 14.580 -10.317 1.00 0.00 H new ATOM 0 HA ASP A2969 -3.372 13.341 -12.967 1.00 0.00 H new ATOM 0 HB2 ASP A2969 -1.430 14.899 -13.154 1.00 0.00 H new ATOM 0 HB3 ASP A2969 -0.640 14.068 -11.829 1.00 0.00 H new ATOM 256 N PRO A2970 -3.192 11.033 -11.864 1.00 0.00 N ATOM 257 CA PRO A2970 -3.334 9.748 -11.115 1.00 0.00 C ATOM 258 C PRO A2970 -1.997 9.057 -10.762 1.00 0.00 C ATOM 259 O PRO A2970 -1.984 8.186 -9.888 1.00 0.00 O ATOM 260 CB PRO A2970 -4.189 8.868 -12.069 1.00 0.00 C ATOM 261 CG PRO A2970 -3.890 9.408 -13.432 1.00 0.00 C ATOM 262 CD PRO A2970 -3.743 10.907 -13.246 1.00 0.00 C ATOM 0 HA PRO A2970 -3.786 9.917 -10.137 1.00 0.00 H new ATOM 0 HB2 PRO A2970 -3.918 7.815 -11.989 1.00 0.00 H new ATOM 0 HB3 PRO A2970 -5.251 8.943 -11.835 1.00 0.00 H new ATOM 0 HG2 PRO A2970 -2.977 8.971 -13.837 1.00 0.00 H new ATOM 0 HG3 PRO A2970 -4.693 9.175 -14.132 1.00 0.00 H new ATOM 0 HD2 PRO A2970 -3.071 11.340 -13.987 1.00 0.00 H new ATOM 0 HD3 PRO A2970 -4.700 11.420 -13.345 1.00 0.00 H new ATOM 270 N SER A2971 -0.879 9.458 -11.422 1.00 0.00 N ATOM 271 CA SER A2971 0.441 8.817 -11.224 1.00 0.00 C ATOM 272 C SER A2971 0.928 8.991 -9.779 1.00 0.00 C ATOM 273 O SER A2971 1.186 7.999 -9.096 1.00 0.00 O ATOM 274 CB SER A2971 1.491 9.365 -12.215 1.00 0.00 C ATOM 275 OG SER A2971 1.047 9.229 -13.550 1.00 0.00 O ATOM 0 H SER A2971 -0.869 10.224 -12.096 1.00 0.00 H new ATOM 0 HA SER A2971 0.316 7.752 -11.420 1.00 0.00 H new ATOM 0 HB2 SER A2971 1.687 10.415 -11.999 1.00 0.00 H new ATOM 0 HB3 SER A2971 2.432 8.831 -12.085 1.00 0.00 H new ATOM 0 HG SER A2971 0.598 10.054 -13.831 1.00 0.00 H new ATOM 281 N PHE A2972 1.002 10.256 -9.304 1.00 0.00 N ATOM 282 CA PHE A2972 1.460 10.549 -7.927 1.00 0.00 C ATOM 283 C PHE A2972 0.361 10.192 -6.918 1.00 0.00 C ATOM 284 O PHE A2972 0.645 9.791 -5.794 1.00 0.00 O ATOM 285 CB PHE A2972 1.925 12.038 -7.763 1.00 0.00 C ATOM 286 CG PHE A2972 0.890 13.131 -8.090 1.00 0.00 C ATOM 287 CD1 PHE A2972 -0.166 13.426 -7.217 1.00 0.00 C ATOM 288 CD2 PHE A2972 0.982 13.882 -9.265 1.00 0.00 C ATOM 289 CE1 PHE A2972 -1.084 14.409 -7.507 1.00 0.00 C ATOM 290 CE2 PHE A2972 0.062 14.870 -9.548 1.00 0.00 C ATOM 291 CZ PHE A2972 -0.972 15.133 -8.673 1.00 0.00 C ATOM 0 H PHE A2972 0.753 11.082 -9.848 1.00 0.00 H new ATOM 0 HA PHE A2972 2.333 9.928 -7.726 1.00 0.00 H new ATOM 0 HB2 PHE A2972 2.254 12.179 -6.733 1.00 0.00 H new ATOM 0 HB3 PHE A2972 2.796 12.194 -8.400 1.00 0.00 H new ATOM 0 HD1 PHE A2972 -0.261 12.869 -6.296 1.00 0.00 H new ATOM 0 HD2 PHE A2972 1.784 13.686 -9.961 1.00 0.00 H new ATOM 0 HE1 PHE A2972 -1.892 14.613 -6.820 1.00 0.00 H new ATOM 0 HE2 PHE A2972 0.152 15.441 -10.460 1.00 0.00 H new ATOM 0 HZ PHE A2972 -1.692 15.905 -8.902 1.00 0.00 H new ATOM 301 N LEU A2973 -0.898 10.321 -7.361 1.00 0.00 N ATOM 302 CA LEU A2973 -2.079 10.128 -6.519 1.00 0.00 C ATOM 303 C LEU A2973 -2.170 8.664 -6.031 1.00 0.00 C ATOM 304 O LEU A2973 -2.440 8.403 -4.857 1.00 0.00 O ATOM 305 CB LEU A2973 -3.346 10.539 -7.324 1.00 0.00 C ATOM 306 CG LEU A2973 -4.631 10.851 -6.495 1.00 0.00 C ATOM 307 CD1 LEU A2973 -4.400 12.051 -5.543 1.00 0.00 C ATOM 308 CD2 LEU A2973 -5.845 11.103 -7.420 1.00 0.00 C ATOM 0 H LEU A2973 -1.123 10.565 -8.325 1.00 0.00 H new ATOM 0 HA LEU A2973 -2.004 10.757 -5.632 1.00 0.00 H new ATOM 0 HB2 LEU A2973 -3.101 11.420 -7.917 1.00 0.00 H new ATOM 0 HB3 LEU A2973 -3.579 9.737 -8.025 1.00 0.00 H new ATOM 0 HG LEU A2973 -4.854 9.976 -5.885 1.00 0.00 H new ATOM 0 HD11 LEU A2973 -5.311 12.247 -4.977 1.00 0.00 H new ATOM 0 HD12 LEU A2973 -3.588 11.818 -4.854 1.00 0.00 H new ATOM 0 HD13 LEU A2973 -4.138 12.933 -6.127 1.00 0.00 H new ATOM 0 HD21 LEU A2973 -6.725 11.318 -6.814 1.00 0.00 H new ATOM 0 HD22 LEU A2973 -5.636 11.952 -8.071 1.00 0.00 H new ATOM 0 HD23 LEU A2973 -6.030 10.217 -8.027 1.00 0.00 H new ATOM 320 N ALA A2974 -1.884 7.724 -6.952 1.00 0.00 N ATOM 321 CA ALA A2974 -2.024 6.273 -6.714 1.00 0.00 C ATOM 322 C ALA A2974 -0.708 5.622 -6.237 1.00 0.00 C ATOM 323 O ALA A2974 -0.750 4.613 -5.528 1.00 0.00 O ATOM 324 CB ALA A2974 -2.530 5.594 -7.991 1.00 0.00 C ATOM 0 H ALA A2974 -1.547 7.950 -7.888 1.00 0.00 H new ATOM 0 HA ALA A2974 -2.747 6.135 -5.910 1.00 0.00 H new ATOM 0 HB1 ALA A2974 -2.634 4.523 -7.817 1.00 0.00 H new ATOM 0 HB2 ALA A2974 -3.498 6.012 -8.266 1.00 0.00 H new ATOM 0 HB3 ALA A2974 -1.819 5.763 -8.799 1.00 0.00 H new ATOM 330 N ALA A2975 0.450 6.191 -6.640 1.00 0.00 N ATOM 331 CA ALA A2975 1.782 5.631 -6.292 1.00 0.00 C ATOM 332 C ALA A2975 2.181 5.985 -4.848 1.00 0.00 C ATOM 333 O ALA A2975 2.696 5.140 -4.108 1.00 0.00 O ATOM 334 CB ALA A2975 2.862 6.125 -7.273 1.00 0.00 C ATOM 0 H ALA A2975 0.493 7.038 -7.207 1.00 0.00 H new ATOM 0 HA ALA A2975 1.707 4.546 -6.370 1.00 0.00 H new ATOM 0 HB1 ALA A2975 3.827 5.701 -6.996 1.00 0.00 H new ATOM 0 HB2 ALA A2975 2.605 5.812 -8.285 1.00 0.00 H new ATOM 0 HB3 ALA A2975 2.919 7.213 -7.233 1.00 0.00 H new ATOM 340 N LEU A2976 1.945 7.255 -4.476 1.00 0.00 N ATOM 341 CA LEU A2976 2.280 7.810 -3.145 1.00 0.00 C ATOM 342 C LEU A2976 1.195 7.419 -2.094 1.00 0.00 C ATOM 343 O LEU A2976 0.067 7.093 -2.486 1.00 0.00 O ATOM 344 CB LEU A2976 2.423 9.351 -3.276 1.00 0.00 C ATOM 345 CG LEU A2976 3.547 9.869 -4.227 1.00 0.00 C ATOM 346 CD1 LEU A2976 3.538 11.414 -4.321 1.00 0.00 C ATOM 347 CD2 LEU A2976 4.931 9.342 -3.792 1.00 0.00 C ATOM 0 H LEU A2976 1.510 7.937 -5.097 1.00 0.00 H new ATOM 0 HA LEU A2976 3.223 7.393 -2.793 1.00 0.00 H new ATOM 0 HB2 LEU A2976 1.471 9.753 -3.622 1.00 0.00 H new ATOM 0 HB3 LEU A2976 2.601 9.763 -2.282 1.00 0.00 H new ATOM 0 HG LEU A2976 3.342 9.479 -5.224 1.00 0.00 H new ATOM 0 HD11 LEU A2976 4.333 11.742 -4.991 1.00 0.00 H new ATOM 0 HD12 LEU A2976 2.576 11.749 -4.708 1.00 0.00 H new ATOM 0 HD13 LEU A2976 3.699 11.840 -3.331 1.00 0.00 H new ATOM 0 HD21 LEU A2976 5.694 9.719 -4.473 1.00 0.00 H new ATOM 0 HD22 LEU A2976 5.148 9.682 -2.779 1.00 0.00 H new ATOM 0 HD23 LEU A2976 4.929 8.252 -3.816 1.00 0.00 H new ATOM 359 N PRO A2977 1.522 7.427 -0.739 1.00 0.00 N ATOM 360 CA PRO A2977 0.557 7.019 0.336 1.00 0.00 C ATOM 361 C PRO A2977 -0.711 7.913 0.433 1.00 0.00 C ATOM 362 O PRO A2977 -0.875 8.879 -0.322 1.00 0.00 O ATOM 363 CB PRO A2977 1.410 7.077 1.638 1.00 0.00 C ATOM 364 CG PRO A2977 2.535 8.016 1.315 1.00 0.00 C ATOM 365 CD PRO A2977 2.848 7.797 -0.153 1.00 0.00 C ATOM 0 HA PRO A2977 0.139 6.033 0.133 1.00 0.00 H new ATOM 0 HB2 PRO A2977 0.822 7.439 2.481 1.00 0.00 H new ATOM 0 HB3 PRO A2977 1.784 6.090 1.911 1.00 0.00 H new ATOM 0 HG2 PRO A2977 2.247 9.050 1.503 1.00 0.00 H new ATOM 0 HG3 PRO A2977 3.407 7.810 1.936 1.00 0.00 H new ATOM 0 HD2 PRO A2977 3.255 8.696 -0.616 1.00 0.00 H new ATOM 0 HD3 PRO A2977 3.584 7.005 -0.293 1.00 0.00 H new ATOM 373 N ASP A2978 -1.600 7.590 1.392 1.00 0.00 N ATOM 374 CA ASP A2978 -2.927 8.233 1.502 1.00 0.00 C ATOM 375 C ASP A2978 -2.824 9.691 2.006 1.00 0.00 C ATOM 376 O ASP A2978 -3.665 10.524 1.653 1.00 0.00 O ATOM 377 CB ASP A2978 -3.863 7.405 2.423 1.00 0.00 C ATOM 378 CG ASP A2978 -3.450 7.457 3.904 1.00 0.00 C ATOM 379 OD1 ASP A2978 -2.421 6.845 4.261 1.00 0.00 O ATOM 380 OD2 ASP A2978 -4.144 8.112 4.711 1.00 0.00 O ATOM 0 H ASP A2978 -1.423 6.884 2.106 1.00 0.00 H new ATOM 0 HA ASP A2978 -3.355 8.263 0.500 1.00 0.00 H new ATOM 0 HB2 ASP A2978 -4.883 7.776 2.323 1.00 0.00 H new ATOM 0 HB3 ASP A2978 -3.867 6.367 2.089 1.00 0.00 H new ATOM 385 N ASP A2979 -1.776 9.980 2.802 1.00 0.00 N ATOM 386 CA ASP A2979 -1.640 11.258 3.535 1.00 0.00 C ATOM 387 C ASP A2979 -1.482 12.457 2.592 1.00 0.00 C ATOM 388 O ASP A2979 -2.275 13.409 2.641 1.00 0.00 O ATOM 389 CB ASP A2979 -0.428 11.185 4.491 1.00 0.00 C ATOM 390 CG ASP A2979 -0.519 10.011 5.473 1.00 0.00 C ATOM 391 OD1 ASP A2979 -1.079 10.181 6.576 1.00 0.00 O ATOM 392 OD2 ASP A2979 -0.031 8.910 5.138 1.00 0.00 O ATOM 0 H ASP A2979 -1.000 9.336 2.956 1.00 0.00 H new ATOM 0 HA ASP A2979 -2.558 11.407 4.103 1.00 0.00 H new ATOM 0 HB2 ASP A2979 0.487 11.093 3.905 1.00 0.00 H new ATOM 0 HB3 ASP A2979 -0.356 12.117 5.051 1.00 0.00 H new ATOM 397 N ILE A2980 -0.475 12.387 1.705 1.00 0.00 N ATOM 398 CA ILE A2980 -0.174 13.490 0.767 1.00 0.00 C ATOM 399 C ILE A2980 -1.136 13.486 -0.438 1.00 0.00 C ATOM 400 O ILE A2980 -1.239 14.489 -1.125 1.00 0.00 O ATOM 401 CB ILE A2980 1.322 13.530 0.250 1.00 0.00 C ATOM 402 CG1 ILE A2980 1.590 12.466 -0.855 1.00 0.00 C ATOM 403 CG2 ILE A2980 2.323 13.364 1.416 1.00 0.00 C ATOM 404 CD1 ILE A2980 1.406 11.052 -0.386 1.00 0.00 C ATOM 0 H ILE A2980 0.145 11.582 1.615 1.00 0.00 H new ATOM 0 HA ILE A2980 -0.321 14.393 1.359 1.00 0.00 H new ATOM 0 HB ILE A2980 1.473 14.513 -0.197 1.00 0.00 H new ATOM 0 HG12 ILE A2980 0.921 12.651 -1.695 1.00 0.00 H new ATOM 0 HG13 ILE A2980 2.608 12.587 -1.225 1.00 0.00 H new ATOM 0 HG21 ILE A2980 3.341 13.396 1.029 1.00 0.00 H new ATOM 0 HG22 ILE A2980 2.183 14.172 2.134 1.00 0.00 H new ATOM 0 HG23 ILE A2980 2.152 12.407 1.909 1.00 0.00 H new ATOM 0 HD11 ILE A2980 1.609 10.366 -1.209 1.00 0.00 H new ATOM 0 HD12 ILE A2980 2.094 10.848 0.435 1.00 0.00 H new ATOM 0 HD13 ILE A2980 0.381 10.913 -0.043 1.00 0.00 H new ATOM 416 N ARG A2981 -1.817 12.344 -0.700 1.00 0.00 N ATOM 417 CA ARG A2981 -2.714 12.224 -1.865 1.00 0.00 C ATOM 418 C ARG A2981 -4.027 13.005 -1.611 1.00 0.00 C ATOM 419 O ARG A2981 -4.559 13.633 -2.525 1.00 0.00 O ATOM 420 CB ARG A2981 -2.979 10.725 -2.256 1.00 0.00 C ATOM 421 CG ARG A2981 -4.126 9.994 -1.480 1.00 0.00 C ATOM 422 CD ARG A2981 -5.259 9.490 -2.382 1.00 0.00 C ATOM 423 NE ARG A2981 -4.815 8.376 -3.235 1.00 0.00 N ATOM 424 CZ ARG A2981 -5.513 7.834 -4.241 1.00 0.00 C ATOM 425 NH1 ARG A2981 -6.691 8.329 -4.601 1.00 0.00 N ATOM 426 NH2 ARG A2981 -5.008 6.802 -4.901 1.00 0.00 N ATOM 0 H ARG A2981 -1.761 11.504 -0.125 1.00 0.00 H new ATOM 0 HA ARG A2981 -2.216 12.673 -2.724 1.00 0.00 H new ATOM 0 HB2 ARG A2981 -3.208 10.685 -3.321 1.00 0.00 H new ATOM 0 HB3 ARG A2981 -2.056 10.165 -2.108 1.00 0.00 H new ATOM 0 HG2 ARG A2981 -3.703 9.149 -0.937 1.00 0.00 H new ATOM 0 HG3 ARG A2981 -4.541 10.675 -0.737 1.00 0.00 H new ATOM 0 HD2 ARG A2981 -6.098 9.166 -1.767 1.00 0.00 H new ATOM 0 HD3 ARG A2981 -5.619 10.307 -3.007 1.00 0.00 H new ATOM 0 HE ARG A2981 -3.894 7.982 -3.043 1.00 0.00 H new ATOM 0 HH11 ARG A2981 -7.078 9.134 -4.109 1.00 0.00 H new ATOM 0 HH12 ARG A2981 -7.209 7.904 -5.370 1.00 0.00 H new ATOM 0 HH21 ARG A2981 -4.095 6.428 -4.641 1.00 0.00 H new ATOM 0 HH22 ARG A2981 -5.532 6.382 -5.669 1.00 0.00 H new ATOM 440 N ARG A2982 -4.542 12.959 -0.356 1.00 0.00 N ATOM 441 CA ARG A2982 -5.713 13.777 0.060 1.00 0.00 C ATOM 442 C ARG A2982 -5.282 15.243 0.275 1.00 0.00 C ATOM 443 O ARG A2982 -6.051 16.163 0.000 1.00 0.00 O ATOM 444 CB ARG A2982 -6.402 13.206 1.339 1.00 0.00 C ATOM 445 CG ARG A2982 -5.471 13.016 2.555 1.00 0.00 C ATOM 446 CD ARG A2982 -6.224 12.642 3.843 1.00 0.00 C ATOM 447 NE ARG A2982 -7.007 13.785 4.363 1.00 0.00 N ATOM 448 CZ ARG A2982 -8.275 13.735 4.806 1.00 0.00 C ATOM 449 NH1 ARG A2982 -8.979 12.609 4.754 1.00 0.00 N ATOM 450 NH2 ARG A2982 -8.835 14.823 5.308 1.00 0.00 N ATOM 0 H ARG A2982 -4.167 12.366 0.384 1.00 0.00 H new ATOM 0 HA ARG A2982 -6.451 13.736 -0.741 1.00 0.00 H new ATOM 0 HB2 ARG A2982 -7.215 13.874 1.624 1.00 0.00 H new ATOM 0 HB3 ARG A2982 -6.852 12.244 1.092 1.00 0.00 H new ATOM 0 HG2 ARG A2982 -4.743 12.237 2.329 1.00 0.00 H new ATOM 0 HG3 ARG A2982 -4.912 13.936 2.723 1.00 0.00 H new ATOM 0 HD2 ARG A2982 -6.891 11.802 3.646 1.00 0.00 H new ATOM 0 HD3 ARG A2982 -5.512 12.313 4.600 1.00 0.00 H new ATOM 0 HE ARG A2982 -6.542 14.693 4.387 1.00 0.00 H new ATOM 0 HH11 ARG A2982 -8.558 11.762 4.373 1.00 0.00 H new ATOM 0 HH12 ARG A2982 -9.940 12.592 5.095 1.00 0.00 H new ATOM 0 HH21 ARG A2982 -8.305 15.693 5.357 1.00 0.00 H new ATOM 0 HH22 ARG A2982 -9.797 14.792 5.646 1.00 0.00 H new ATOM 464 N GLU A2983 -4.040 15.422 0.768 1.00 0.00 N ATOM 465 CA GLU A2983 -3.367 16.736 0.908 1.00 0.00 C ATOM 466 C GLU A2983 -3.383 17.501 -0.435 1.00 0.00 C ATOM 467 O GLU A2983 -3.874 18.631 -0.503 1.00 0.00 O ATOM 468 CB GLU A2983 -1.915 16.470 1.390 1.00 0.00 C ATOM 469 CG GLU A2983 -0.908 17.638 1.424 1.00 0.00 C ATOM 470 CD GLU A2983 -1.052 18.561 2.645 1.00 0.00 C ATOM 471 OE1 GLU A2983 -0.832 18.088 3.779 1.00 0.00 O ATOM 472 OE2 GLU A2983 -1.370 19.759 2.484 1.00 0.00 O ATOM 0 H GLU A2983 -3.463 14.644 1.087 1.00 0.00 H new ATOM 0 HA GLU A2983 -3.890 17.360 1.633 1.00 0.00 H new ATOM 0 HB2 GLU A2983 -1.974 16.058 2.397 1.00 0.00 H new ATOM 0 HB3 GLU A2983 -1.495 15.693 0.752 1.00 0.00 H new ATOM 0 HG2 GLU A2983 0.103 17.231 1.408 1.00 0.00 H new ATOM 0 HG3 GLU A2983 -1.027 18.232 0.518 1.00 0.00 H new ATOM 479 N VAL A2984 -2.921 16.835 -1.514 1.00 0.00 N ATOM 480 CA VAL A2984 -2.797 17.466 -2.842 1.00 0.00 C ATOM 481 C VAL A2984 -4.167 17.570 -3.544 1.00 0.00 C ATOM 482 O VAL A2984 -4.407 18.510 -4.278 1.00 0.00 O ATOM 483 CB VAL A2984 -1.751 16.722 -3.771 1.00 0.00 C ATOM 484 CG1 VAL A2984 -0.331 16.756 -3.151 1.00 0.00 C ATOM 485 CG2 VAL A2984 -2.190 15.276 -4.115 1.00 0.00 C ATOM 0 H VAL A2984 -2.628 15.858 -1.490 1.00 0.00 H new ATOM 0 HA VAL A2984 -2.418 18.474 -2.670 1.00 0.00 H new ATOM 0 HB VAL A2984 -1.717 17.267 -4.714 1.00 0.00 H new ATOM 0 HG11 VAL A2984 0.366 16.238 -3.810 1.00 0.00 H new ATOM 0 HG12 VAL A2984 -0.013 17.791 -3.027 1.00 0.00 H new ATOM 0 HG13 VAL A2984 -0.346 16.263 -2.179 1.00 0.00 H new ATOM 0 HG21 VAL A2984 -1.439 14.810 -4.753 1.00 0.00 H new ATOM 0 HG22 VAL A2984 -2.294 14.699 -3.196 1.00 0.00 H new ATOM 0 HG23 VAL A2984 -3.146 15.301 -4.638 1.00 0.00 H new ATOM 495 N LEU A2985 -5.072 16.615 -3.285 1.00 0.00 N ATOM 496 CA LEU A2985 -6.392 16.581 -3.946 1.00 0.00 C ATOM 497 C LEU A2985 -7.292 17.739 -3.451 1.00 0.00 C ATOM 498 O LEU A2985 -7.802 18.550 -4.246 1.00 0.00 O ATOM 499 CB LEU A2985 -7.070 15.215 -3.696 1.00 0.00 C ATOM 500 CG LEU A2985 -8.329 14.892 -4.565 1.00 0.00 C ATOM 501 CD1 LEU A2985 -7.969 14.785 -6.068 1.00 0.00 C ATOM 502 CD2 LEU A2985 -9.042 13.615 -4.071 1.00 0.00 C ATOM 0 H LEU A2985 -4.917 15.854 -2.623 1.00 0.00 H new ATOM 0 HA LEU A2985 -6.246 16.711 -5.018 1.00 0.00 H new ATOM 0 HB2 LEU A2985 -6.331 14.432 -3.862 1.00 0.00 H new ATOM 0 HB3 LEU A2985 -7.358 15.164 -2.646 1.00 0.00 H new ATOM 0 HG LEU A2985 -9.024 15.724 -4.451 1.00 0.00 H new ATOM 0 HD11 LEU A2985 -8.868 14.560 -6.642 1.00 0.00 H new ATOM 0 HD12 LEU A2985 -7.548 15.731 -6.409 1.00 0.00 H new ATOM 0 HD13 LEU A2985 -7.238 13.989 -6.211 1.00 0.00 H new ATOM 0 HD21 LEU A2985 -9.913 13.419 -4.697 1.00 0.00 H new ATOM 0 HD22 LEU A2985 -8.356 12.770 -4.129 1.00 0.00 H new ATOM 0 HD23 LEU A2985 -9.361 13.753 -3.038 1.00 0.00 H new ATOM 514 N GLN A2986 -7.433 17.824 -2.121 1.00 0.00 N ATOM 515 CA GLN A2986 -8.326 18.792 -1.462 1.00 0.00 C ATOM 516 C GLN A2986 -7.784 20.226 -1.596 1.00 0.00 C ATOM 517 O GLN A2986 -8.535 21.144 -1.903 1.00 0.00 O ATOM 518 CB GLN A2986 -8.510 18.423 0.034 1.00 0.00 C ATOM 519 CG GLN A2986 -9.123 17.033 0.275 1.00 0.00 C ATOM 520 CD GLN A2986 -9.225 16.660 1.758 1.00 0.00 C ATOM 521 OE1 GLN A2986 -10.239 16.910 2.412 1.00 0.00 O ATOM 522 NE2 GLN A2986 -8.165 16.092 2.306 1.00 0.00 N ATOM 0 H GLN A2986 -6.930 17.222 -1.468 1.00 0.00 H new ATOM 0 HA GLN A2986 -9.296 18.750 -1.958 1.00 0.00 H new ATOM 0 HB2 GLN A2986 -7.540 18.470 0.529 1.00 0.00 H new ATOM 0 HB3 GLN A2986 -9.145 19.173 0.505 1.00 0.00 H new ATOM 0 HG2 GLN A2986 -10.118 17.001 -0.169 1.00 0.00 H new ATOM 0 HG3 GLN A2986 -8.520 16.284 -0.239 1.00 0.00 H new ATOM 0 HE21 GLN A2986 -7.340 15.897 1.739 1.00 0.00 H new ATOM 0 HE22 GLN A2986 -8.172 15.848 3.296 1.00 0.00 H new ATOM 531 N ASN A2987 -6.473 20.398 -1.374 1.00 0.00 N ATOM 532 CA ASN A2987 -5.842 21.736 -1.332 1.00 0.00 C ATOM 533 C ASN A2987 -5.629 22.345 -2.730 1.00 0.00 C ATOM 534 O ASN A2987 -5.822 23.556 -2.903 1.00 0.00 O ATOM 535 CB ASN A2987 -4.521 21.662 -0.547 1.00 0.00 C ATOM 536 CG ASN A2987 -4.731 21.405 0.954 1.00 0.00 C ATOM 537 OD1 ASN A2987 -5.728 21.830 1.540 1.00 0.00 O ATOM 538 ND2 ASN A2987 -3.820 20.685 1.583 1.00 0.00 N ATOM 0 H ASN A2987 -5.822 19.628 -1.220 1.00 0.00 H new ATOM 0 HA ASN A2987 -6.530 22.407 -0.818 1.00 0.00 H new ATOM 0 HB2 ASN A2987 -3.901 20.868 -0.963 1.00 0.00 H new ATOM 0 HB3 ASN A2987 -3.974 22.596 -0.678 1.00 0.00 H new ATOM 0 HD21 ASN A2987 -3.934 20.471 2.574 1.00 0.00 H new ATOM 0 HD22 ASN A2987 -3.002 20.343 1.078 1.00 0.00 H new ATOM 545 N GLN A2988 -5.227 21.524 -3.719 1.00 0.00 N ATOM 546 CA GLN A2988 -4.961 22.019 -5.091 1.00 0.00 C ATOM 547 C GLN A2988 -6.264 22.331 -5.836 1.00 0.00 C ATOM 548 O GLN A2988 -6.442 23.450 -6.329 1.00 0.00 O ATOM 549 CB GLN A2988 -4.116 21.011 -5.912 1.00 0.00 C ATOM 550 CG GLN A2988 -2.645 20.896 -5.470 1.00 0.00 C ATOM 551 CD GLN A2988 -1.828 19.867 -6.269 1.00 0.00 C ATOM 552 OE1 GLN A2988 -0.890 19.272 -5.743 1.00 0.00 O ATOM 553 NE2 GLN A2988 -2.162 19.654 -7.542 1.00 0.00 N ATOM 0 H GLN A2988 -5.079 20.522 -3.599 1.00 0.00 H new ATOM 0 HA GLN A2988 -4.389 22.941 -4.985 1.00 0.00 H new ATOM 0 HB2 GLN A2988 -4.580 20.027 -5.843 1.00 0.00 H new ATOM 0 HB3 GLN A2988 -4.144 21.304 -6.962 1.00 0.00 H new ATOM 0 HG2 GLN A2988 -2.171 21.873 -5.565 1.00 0.00 H new ATOM 0 HG3 GLN A2988 -2.614 20.628 -4.414 1.00 0.00 H new ATOM 0 HE21 GLN A2988 -2.945 20.161 -7.955 1.00 0.00 H new ATOM 0 HE22 GLN A2988 -1.635 18.984 -8.102 1.00 0.00 H new ATOM 562 N LEU A2989 -7.165 21.338 -5.922 1.00 0.00 N ATOM 563 CA LEU A2989 -8.386 21.446 -6.748 1.00 0.00 C ATOM 564 C LEU A2989 -9.501 22.143 -5.972 1.00 0.00 C ATOM 565 O LEU A2989 -10.356 22.813 -6.566 1.00 0.00 O ATOM 566 CB LEU A2989 -8.870 20.050 -7.229 1.00 0.00 C ATOM 567 CG LEU A2989 -7.854 19.199 -8.072 1.00 0.00 C ATOM 568 CD1 LEU A2989 -7.145 20.047 -9.135 1.00 0.00 C ATOM 569 CD2 LEU A2989 -6.842 18.448 -7.184 1.00 0.00 C ATOM 0 H LEU A2989 -7.073 20.449 -5.430 1.00 0.00 H new ATOM 0 HA LEU A2989 -8.136 22.042 -7.625 1.00 0.00 H new ATOM 0 HB2 LEU A2989 -9.154 19.468 -6.352 1.00 0.00 H new ATOM 0 HB3 LEU A2989 -9.772 20.190 -7.825 1.00 0.00 H new ATOM 0 HG LEU A2989 -8.441 18.443 -8.594 1.00 0.00 H new ATOM 0 HD11 LEU A2989 -6.451 19.421 -9.696 1.00 0.00 H new ATOM 0 HD12 LEU A2989 -7.884 20.470 -9.816 1.00 0.00 H new ATOM 0 HD13 LEU A2989 -6.595 20.854 -8.650 1.00 0.00 H new ATOM 0 HD21 LEU A2989 -6.161 17.874 -7.813 1.00 0.00 H new ATOM 0 HD22 LEU A2989 -6.272 19.166 -6.594 1.00 0.00 H new ATOM 0 HD23 LEU A2989 -7.376 17.772 -6.516 1.00 0.00 H new ATOM 581 N GLY A2990 -9.480 21.975 -4.636 1.00 0.00 N ATOM 582 CA GLY A2990 -10.545 22.471 -3.768 1.00 0.00 C ATOM 583 C GLY A2990 -11.719 21.513 -3.674 1.00 0.00 C ATOM 584 O GLY A2990 -12.733 21.838 -3.048 1.00 0.00 O ATOM 0 H GLY A2990 -8.729 21.496 -4.140 1.00 0.00 H new ATOM 0 HA2 GLY A2990 -10.143 22.645 -2.770 1.00 0.00 H new ATOM 0 HA3 GLY A2990 -10.895 23.433 -4.143 1.00 0.00 H new ATOM 588 N ILE A2991 -11.575 20.322 -4.289 1.00 0.00 N ATOM 589 CA ILE A2991 -12.628 19.294 -4.334 1.00 0.00 C ATOM 590 C ILE A2991 -12.770 18.656 -2.937 1.00 0.00 C ATOM 591 O ILE A2991 -11.772 18.235 -2.334 1.00 0.00 O ATOM 592 CB ILE A2991 -12.322 18.220 -5.475 1.00 0.00 C ATOM 593 CG1 ILE A2991 -13.509 17.189 -5.697 1.00 0.00 C ATOM 594 CG2 ILE A2991 -10.973 17.487 -5.237 1.00 0.00 C ATOM 595 CD1 ILE A2991 -13.561 15.968 -4.766 1.00 0.00 C ATOM 0 H ILE A2991 -10.719 20.047 -4.771 1.00 0.00 H new ATOM 0 HA ILE A2991 -13.584 19.749 -4.594 1.00 0.00 H new ATOM 0 HB ILE A2991 -12.232 18.790 -6.400 1.00 0.00 H new ATOM 0 HG12 ILE A2991 -14.450 17.730 -5.597 1.00 0.00 H new ATOM 0 HG13 ILE A2991 -13.456 16.829 -6.724 1.00 0.00 H new ATOM 0 HG21 ILE A2991 -10.805 16.766 -6.037 1.00 0.00 H new ATOM 0 HG22 ILE A2991 -10.161 18.214 -5.227 1.00 0.00 H new ATOM 0 HG23 ILE A2991 -11.006 16.967 -4.280 1.00 0.00 H new ATOM 0 HD11 ILE A2991 -14.419 15.348 -5.027 1.00 0.00 H new ATOM 0 HD12 ILE A2991 -12.646 15.386 -4.877 1.00 0.00 H new ATOM 0 HD13 ILE A2991 -13.655 16.302 -3.733 1.00 0.00 H new ATOM 607 N ARG A2992 -14.013 18.622 -2.409 1.00 0.00 N ATOM 608 CA ARG A2992 -14.301 18.084 -1.072 1.00 0.00 C ATOM 609 C ARG A2992 -14.786 16.613 -1.187 1.00 0.00 C ATOM 610 O ARG A2992 -15.751 16.334 -1.907 1.00 0.00 O ATOM 611 CB ARG A2992 -15.330 19.003 -0.322 1.00 0.00 C ATOM 612 CG ARG A2992 -16.770 19.026 -0.895 1.00 0.00 C ATOM 613 CD ARG A2992 -17.670 20.093 -0.235 1.00 0.00 C ATOM 614 NE ARG A2992 -17.229 21.465 -0.554 1.00 0.00 N ATOM 615 CZ ARG A2992 -17.984 22.579 -0.465 1.00 0.00 C ATOM 616 NH1 ARG A2992 -19.251 22.523 -0.072 1.00 0.00 N ATOM 617 NH2 ARG A2992 -17.467 23.748 -0.793 1.00 0.00 N ATOM 0 H ARG A2992 -14.838 18.967 -2.900 1.00 0.00 H new ATOM 0 HA ARG A2992 -13.390 18.079 -0.474 1.00 0.00 H new ATOM 0 HB2 ARG A2992 -15.380 18.683 0.719 1.00 0.00 H new ATOM 0 HB3 ARG A2992 -14.944 20.022 -0.324 1.00 0.00 H new ATOM 0 HG2 ARG A2992 -16.724 19.212 -1.968 1.00 0.00 H new ATOM 0 HG3 ARG A2992 -17.223 18.044 -0.761 1.00 0.00 H new ATOM 0 HD2 ARG A2992 -18.698 19.956 -0.569 1.00 0.00 H new ATOM 0 HD3 ARG A2992 -17.665 19.953 0.846 1.00 0.00 H new ATOM 0 HE ARG A2992 -16.266 21.581 -0.870 1.00 0.00 H new ATOM 0 HH11 ARG A2992 -19.671 21.625 0.169 1.00 0.00 H new ATOM 0 HH12 ARG A2992 -19.804 23.378 -0.012 1.00 0.00 H new ATOM 0 HH21 ARG A2992 -16.500 23.806 -1.112 1.00 0.00 H new ATOM 0 HH22 ARG A2992 -18.034 24.593 -0.727 1.00 0.00 H new