USER MOD reduce.3.24.130724 H: found=0, std=0, add=541, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 543 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 920 GLN : amide:sc= -0.257 K(o=-0.4,f=-1.8) USER MOD Set 1.2: A 956 LYS NZ :NH3+ 161:sc= -0.141 (180deg=0) USER MOD Set 2.1: A 894 THR OG1 : rot 33:sc= 0.0469 USER MOD Set 2.2: A 940 THR OG1 : rot 180:sc= 0 USER MOD Single : A 898 SER OG : rot 180:sc= -0.0144 USER MOD Single : A 919 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 923 SER OG : rot 180:sc= 0 USER MOD Single : A 936 LYS NZ :NH3+ 140:sc= -0.793 (180deg=-2.69!) USER MOD Single : A 937 MET CE :methyl 150:sc= -0.0645 (180deg=-0.498) USER MOD Single : A 945 SER OG : rot 180:sc= -0.227 USER MOD Single : A 946 SER OG : rot 180:sc= 0 USER MOD Single : A 949 ASN : amide:sc= -0.156 K(o=-0.16,f=-1.5!) USER MOD Single : A 952 SER OG : rot 78:sc= 0.728 USER MOD Single : A 954 ASN : amide:sc= -1.18 K(o=-1.2,f=-0.61) USER MOD Single : A 960 ASN : amide:sc= -4.74! C(o=-4.7!,f=-3.5!) USER MOD Single : A 962 THR OG1 : rot -3:sc= 0.48 USER MOD Single : A 964 THR OG1 : rot 180:sc= 0 USER MOD Single : A 968 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 73 N THR A 894 0.320 13.697 3.578 1.00 0.00 N ATOM 74 CA THR A 894 0.407 12.482 4.379 1.00 0.00 C ATOM 75 C THR A 894 -0.858 11.643 4.242 1.00 0.00 C ATOM 76 O THR A 894 -1.959 12.109 4.536 1.00 0.00 O ATOM 77 CB THR A 894 0.637 12.805 5.867 1.00 0.00 C ATOM 78 OG1 THR A 894 1.867 13.519 6.029 1.00 0.00 O ATOM 79 CG2 THR A 894 0.671 11.532 6.699 1.00 0.00 C ATOM 0 HA THR A 894 1.259 11.915 4.003 1.00 0.00 H new ATOM 0 HB THR A 894 -0.191 13.424 6.213 1.00 0.00 H new ATOM 0 HG1 THR A 894 2.026 14.079 5.241 1.00 0.00 H new ATOM 0 HG21 THR A 894 0.835 11.786 7.746 1.00 0.00 H new ATOM 0 HG22 THR A 894 -0.278 11.005 6.597 1.00 0.00 H new ATOM 0 HG23 THR A 894 1.481 10.891 6.350 1.00 0.00 H new ATOM 87 N VAL A 895 -0.694 10.401 3.796 1.00 0.00 N ATOM 88 CA VAL A 895 -1.823 9.496 3.622 1.00 0.00 C ATOM 89 C VAL A 895 -1.728 8.310 4.575 1.00 0.00 C ATOM 90 O VAL A 895 -0.640 7.795 4.837 1.00 0.00 O ATOM 91 CB VAL A 895 -1.906 8.973 2.176 1.00 0.00 C ATOM 92 CG1 VAL A 895 -1.952 10.131 1.191 1.00 0.00 C ATOM 93 CG2 VAL A 895 -0.733 8.052 1.875 1.00 0.00 C ATOM 0 H VAL A 895 0.210 9.999 3.549 1.00 0.00 H new ATOM 0 HA VAL A 895 -2.724 10.067 3.846 1.00 0.00 H new ATOM 0 HB VAL A 895 -2.826 8.399 2.068 1.00 0.00 H new ATOM 0 HG11 VAL A 895 -2.010 9.742 0.174 1.00 0.00 H new ATOM 0 HG12 VAL A 895 -2.828 10.747 1.395 1.00 0.00 H new ATOM 0 HG13 VAL A 895 -1.051 10.735 1.297 1.00 0.00 H new ATOM 0 HG21 VAL A 895 -0.807 7.691 0.849 1.00 0.00 H new ATOM 0 HG22 VAL A 895 0.201 8.600 2.000 1.00 0.00 H new ATOM 0 HG23 VAL A 895 -0.751 7.204 2.560 1.00 0.00 H new ATOM 103 N LEU A 896 -2.874 7.879 5.092 1.00 0.00 N ATOM 104 CA LEU A 896 -2.920 6.752 6.017 1.00 0.00 C ATOM 105 C LEU A 896 -3.135 5.441 5.267 1.00 0.00 C ATOM 106 O LEU A 896 -3.876 5.389 4.285 1.00 0.00 O ATOM 107 CB LEU A 896 -4.037 6.954 7.042 1.00 0.00 C ATOM 108 CG LEU A 896 -3.714 7.885 8.212 1.00 0.00 C ATOM 109 CD1 LEU A 896 -2.947 9.105 7.726 1.00 0.00 C ATOM 110 CD2 LEU A 896 -4.989 8.304 8.928 1.00 0.00 C ATOM 0 H LEU A 896 -3.783 8.293 4.886 1.00 0.00 H new ATOM 0 HA LEU A 896 -1.963 6.700 6.536 1.00 0.00 H new ATOM 0 HB2 LEU A 896 -4.912 7.345 6.523 1.00 0.00 H new ATOM 0 HB3 LEU A 896 -4.314 5.980 7.445 1.00 0.00 H new ATOM 0 HG LEU A 896 -3.086 7.344 8.920 1.00 0.00 H new ATOM 0 HD11 LEU A 896 -2.726 9.756 8.572 1.00 0.00 H new ATOM 0 HD12 LEU A 896 -2.015 8.787 7.259 1.00 0.00 H new ATOM 0 HD13 LEU A 896 -3.550 9.648 6.998 1.00 0.00 H new ATOM 0 HD21 LEU A 896 -4.740 8.966 9.757 1.00 0.00 H new ATOM 0 HD22 LEU A 896 -5.643 8.827 8.230 1.00 0.00 H new ATOM 0 HD23 LEU A 896 -5.499 7.420 9.310 1.00 0.00 H new ATOM 122 N VAL A 897 -2.482 4.383 5.737 1.00 0.00 N ATOM 123 CA VAL A 897 -2.603 3.070 5.113 1.00 0.00 C ATOM 124 C VAL A 897 -2.675 1.967 6.163 1.00 0.00 C ATOM 125 O VAL A 897 -1.865 1.924 7.089 1.00 0.00 O ATOM 126 CB VAL A 897 -1.422 2.787 4.167 1.00 0.00 C ATOM 127 CG1 VAL A 897 -1.543 1.397 3.562 1.00 0.00 C ATOM 128 CG2 VAL A 897 -1.346 3.847 3.078 1.00 0.00 C ATOM 0 H VAL A 897 -1.864 4.409 6.548 1.00 0.00 H new ATOM 0 HA VAL A 897 -3.527 3.078 4.535 1.00 0.00 H new ATOM 0 HB VAL A 897 -0.499 2.826 4.745 1.00 0.00 H new ATOM 0 HG11 VAL A 897 -0.699 1.215 2.896 1.00 0.00 H new ATOM 0 HG12 VAL A 897 -1.544 0.652 4.358 1.00 0.00 H new ATOM 0 HG13 VAL A 897 -2.473 1.326 2.997 1.00 0.00 H new ATOM 0 HG21 VAL A 897 -0.505 3.631 2.418 1.00 0.00 H new ATOM 0 HG22 VAL A 897 -2.271 3.843 2.501 1.00 0.00 H new ATOM 0 HG23 VAL A 897 -1.207 4.827 3.534 1.00 0.00 H new ATOM 138 N SER A 898 -3.649 1.076 6.012 1.00 0.00 N ATOM 139 CA SER A 898 -3.829 -0.026 6.950 1.00 0.00 C ATOM 140 C SER A 898 -4.016 -1.346 6.207 1.00 0.00 C ATOM 141 O SER A 898 -4.508 -1.371 5.078 1.00 0.00 O ATOM 142 CB SER A 898 -5.034 0.237 7.855 1.00 0.00 C ATOM 143 OG SER A 898 -5.426 -0.941 8.538 1.00 0.00 O ATOM 0 H SER A 898 -4.326 1.095 5.249 1.00 0.00 H new ATOM 0 HA SER A 898 -2.931 -0.098 7.564 1.00 0.00 H new ATOM 0 HB2 SER A 898 -4.787 1.015 8.578 1.00 0.00 H new ATOM 0 HB3 SER A 898 -5.867 0.609 7.258 1.00 0.00 H new ATOM 0 HG SER A 898 -6.197 -0.746 9.111 1.00 0.00 H new ATOM 149 N ILE A 899 -3.619 -2.440 6.848 1.00 0.00 N ATOM 150 CA ILE A 899 -3.744 -3.763 6.250 1.00 0.00 C ATOM 151 C ILE A 899 -4.627 -4.670 7.100 1.00 0.00 C ATOM 152 O ILE A 899 -4.336 -4.920 8.270 1.00 0.00 O ATOM 153 CB ILE A 899 -2.367 -4.430 6.067 1.00 0.00 C ATOM 154 CG1 ILE A 899 -1.547 -4.316 7.353 1.00 0.00 C ATOM 155 CG2 ILE A 899 -1.624 -3.798 4.900 1.00 0.00 C ATOM 156 CD1 ILE A 899 -0.580 -5.462 7.557 1.00 0.00 C ATOM 0 H ILE A 899 -3.208 -2.436 7.782 1.00 0.00 H new ATOM 0 HA ILE A 899 -4.205 -3.625 5.272 1.00 0.00 H new ATOM 0 HB ILE A 899 -2.517 -5.487 5.847 1.00 0.00 H new ATOM 0 HG12 ILE A 899 -0.990 -3.379 7.337 1.00 0.00 H new ATOM 0 HG13 ILE A 899 -2.226 -4.268 8.204 1.00 0.00 H new ATOM 0 HG21 ILE A 899 -0.653 -4.280 4.783 1.00 0.00 H new ATOM 0 HG22 ILE A 899 -2.205 -3.926 3.987 1.00 0.00 H new ATOM 0 HG23 ILE A 899 -1.481 -2.735 5.093 1.00 0.00 H new ATOM 0 HD11 ILE A 899 -0.033 -5.315 8.488 1.00 0.00 H new ATOM 0 HD12 ILE A 899 -1.133 -6.400 7.605 1.00 0.00 H new ATOM 0 HD13 ILE A 899 0.123 -5.497 6.725 1.00 0.00 H new ATOM 308 N PHE A 909 3.550 -3.864 9.095 1.00 0.00 N ATOM 309 CA PHE A 909 3.892 -4.052 7.689 1.00 0.00 C ATOM 310 C PHE A 909 5.288 -4.649 7.544 1.00 0.00 C ATOM 311 O PHE A 909 6.246 -4.172 8.153 1.00 0.00 O ATOM 312 CB PHE A 909 3.814 -2.720 6.941 1.00 0.00 C ATOM 313 CG PHE A 909 2.473 -2.052 7.043 1.00 0.00 C ATOM 314 CD1 PHE A 909 2.076 -1.442 8.222 1.00 0.00 C ATOM 315 CD2 PHE A 909 1.609 -2.034 5.960 1.00 0.00 C ATOM 316 CE1 PHE A 909 0.842 -0.827 8.320 1.00 0.00 C ATOM 317 CE2 PHE A 909 0.374 -1.420 6.052 1.00 0.00 C ATOM 318 CZ PHE A 909 -0.010 -0.816 7.233 1.00 0.00 C ATOM 0 HA PHE A 909 3.173 -4.747 7.256 1.00 0.00 H new ATOM 0 HB2 PHE A 909 4.577 -2.047 7.333 1.00 0.00 H new ATOM 0 HB3 PHE A 909 4.048 -2.889 5.890 1.00 0.00 H new ATOM 0 HD1 PHE A 909 2.739 -1.447 9.075 1.00 0.00 H new ATOM 0 HD2 PHE A 909 1.904 -2.505 5.034 1.00 0.00 H new ATOM 0 HE1 PHE A 909 0.545 -0.356 9.245 1.00 0.00 H new ATOM 0 HE2 PHE A 909 -0.290 -1.413 5.201 1.00 0.00 H new ATOM 0 HZ PHE A 909 -0.975 -0.336 7.306 1.00 0.00 H new ATOM 328 N ASP A 910 5.396 -5.697 6.734 1.00 0.00 N ATOM 329 CA ASP A 910 6.675 -6.360 6.508 1.00 0.00 C ATOM 330 C ASP A 910 7.412 -5.731 5.329 1.00 0.00 C ATOM 331 O ASP A 910 6.840 -4.942 4.576 1.00 0.00 O ATOM 332 CB ASP A 910 6.461 -7.853 6.253 1.00 0.00 C ATOM 333 CG ASP A 910 7.743 -8.564 5.868 1.00 0.00 C ATOM 334 OD1 ASP A 910 8.674 -8.599 6.699 1.00 0.00 O ATOM 335 OD2 ASP A 910 7.816 -9.085 4.735 1.00 0.00 O ATOM 0 H ASP A 910 4.613 -6.105 6.223 1.00 0.00 H new ATOM 0 HA ASP A 910 7.284 -6.235 7.403 1.00 0.00 H new ATOM 0 HB2 ASP A 910 6.047 -8.316 7.149 1.00 0.00 H new ATOM 0 HB3 ASP A 910 5.725 -7.981 5.459 1.00 0.00 H new ATOM 340 N ASP A 911 8.683 -6.085 5.177 1.00 0.00 N ATOM 341 CA ASP A 911 9.499 -5.556 4.090 1.00 0.00 C ATOM 342 C ASP A 911 8.772 -5.678 2.755 1.00 0.00 C ATOM 343 O ASP A 911 8.739 -4.735 1.966 1.00 0.00 O ATOM 344 CB ASP A 911 10.839 -6.291 4.025 1.00 0.00 C ATOM 345 CG ASP A 911 11.422 -6.554 5.399 1.00 0.00 C ATOM 346 OD1 ASP A 911 10.779 -7.277 6.188 1.00 0.00 O ATOM 347 OD2 ASP A 911 12.522 -6.036 5.686 1.00 0.00 O ATOM 0 H ASP A 911 9.171 -6.736 5.792 1.00 0.00 H new ATOM 0 HA ASP A 911 9.682 -4.500 4.287 1.00 0.00 H new ATOM 0 HB2 ASP A 911 10.705 -7.238 3.503 1.00 0.00 H new ATOM 0 HB3 ASP A 911 11.545 -5.702 3.440 1.00 0.00 H new ATOM 352 N ALA A 912 8.190 -6.847 2.509 1.00 0.00 N ATOM 353 CA ALA A 912 7.463 -7.093 1.270 1.00 0.00 C ATOM 354 C ALA A 912 6.278 -6.143 1.131 1.00 0.00 C ATOM 355 O ALA A 912 6.183 -5.391 0.160 1.00 0.00 O ATOM 356 CB ALA A 912 6.991 -8.539 1.213 1.00 0.00 C ATOM 0 H ALA A 912 8.208 -7.639 3.152 1.00 0.00 H new ATOM 0 HA ALA A 912 8.142 -6.910 0.437 1.00 0.00 H new ATOM 0 HB1 ALA A 912 6.450 -8.709 0.282 1.00 0.00 H new ATOM 0 HB2 ALA A 912 7.853 -9.205 1.258 1.00 0.00 H new ATOM 0 HB3 ALA A 912 6.332 -8.740 2.058 1.00 0.00 H new ATOM 362 N LEU A 913 5.377 -6.181 2.106 1.00 0.00 N ATOM 363 CA LEU A 913 4.197 -5.323 2.092 1.00 0.00 C ATOM 364 C LEU A 913 4.578 -3.880 1.780 1.00 0.00 C ATOM 365 O LEU A 913 3.953 -3.231 0.941 1.00 0.00 O ATOM 366 CB LEU A 913 3.476 -5.392 3.440 1.00 0.00 C ATOM 367 CG LEU A 913 2.801 -6.723 3.772 1.00 0.00 C ATOM 368 CD1 LEU A 913 2.381 -6.758 5.233 1.00 0.00 C ATOM 369 CD2 LEU A 913 1.601 -6.954 2.865 1.00 0.00 C ATOM 0 H LEU A 913 5.441 -6.797 2.917 1.00 0.00 H new ATOM 0 HA LEU A 913 3.527 -5.680 1.310 1.00 0.00 H new ATOM 0 HB2 LEU A 913 4.196 -5.166 4.227 1.00 0.00 H new ATOM 0 HB3 LEU A 913 2.720 -4.607 3.466 1.00 0.00 H new ATOM 0 HG LEU A 913 3.519 -7.525 3.602 1.00 0.00 H new ATOM 0 HD11 LEU A 913 1.902 -7.713 5.451 1.00 0.00 H new ATOM 0 HD12 LEU A 913 3.260 -6.639 5.867 1.00 0.00 H new ATOM 0 HD13 LEU A 913 1.680 -5.947 5.429 1.00 0.00 H new ATOM 0 HD21 LEU A 913 1.133 -7.906 3.116 1.00 0.00 H new ATOM 0 HD22 LEU A 913 0.880 -6.148 3.003 1.00 0.00 H new ATOM 0 HD23 LEU A 913 1.929 -6.974 1.826 1.00 0.00 H new ATOM 381 N ILE A 914 5.607 -3.384 2.458 1.00 0.00 N ATOM 382 CA ILE A 914 6.073 -2.019 2.250 1.00 0.00 C ATOM 383 C ILE A 914 6.658 -1.845 0.852 1.00 0.00 C ATOM 384 O ILE A 914 6.129 -1.089 0.037 1.00 0.00 O ATOM 385 CB ILE A 914 7.135 -1.621 3.292 1.00 0.00 C ATOM 386 CG1 ILE A 914 6.566 -1.749 4.706 1.00 0.00 C ATOM 387 CG2 ILE A 914 7.622 -0.202 3.037 1.00 0.00 C ATOM 388 CD1 ILE A 914 7.627 -1.798 5.783 1.00 0.00 C ATOM 0 H ILE A 914 6.134 -3.908 3.157 1.00 0.00 H new ATOM 0 HA ILE A 914 5.205 -1.369 2.362 1.00 0.00 H new ATOM 0 HB ILE A 914 7.985 -2.297 3.200 1.00 0.00 H new ATOM 0 HG12 ILE A 914 5.902 -0.906 4.899 1.00 0.00 H new ATOM 0 HG13 ILE A 914 5.959 -2.652 4.764 1.00 0.00 H new ATOM 0 HG21 ILE A 914 8.372 0.065 3.782 1.00 0.00 H new ATOM 0 HG22 ILE A 914 8.062 -0.142 2.041 1.00 0.00 H new ATOM 0 HG23 ILE A 914 6.782 0.489 3.105 1.00 0.00 H new ATOM 0 HD11 ILE A 914 7.151 -1.889 6.759 1.00 0.00 H new ATOM 0 HD12 ILE A 914 8.277 -2.657 5.615 1.00 0.00 H new ATOM 0 HD13 ILE A 914 8.219 -0.883 5.752 1.00 0.00 H new ATOM 400 N ASP A 915 7.751 -2.549 0.583 1.00 0.00 N ATOM 401 CA ASP A 915 8.407 -2.475 -0.718 1.00 0.00 C ATOM 402 C ASP A 915 7.378 -2.409 -1.842 1.00 0.00 C ATOM 403 O ASP A 915 7.323 -1.433 -2.589 1.00 0.00 O ATOM 404 CB ASP A 915 9.325 -3.682 -0.919 1.00 0.00 C ATOM 405 CG ASP A 915 10.341 -3.458 -2.022 1.00 0.00 C ATOM 406 OD1 ASP A 915 9.924 -3.278 -3.185 1.00 0.00 O ATOM 407 OD2 ASP A 915 11.554 -3.465 -1.721 1.00 0.00 O ATOM 0 H ASP A 915 8.202 -3.178 1.248 1.00 0.00 H new ATOM 0 HA ASP A 915 9.006 -1.565 -0.745 1.00 0.00 H new ATOM 0 HB2 ASP A 915 9.847 -3.898 0.013 1.00 0.00 H new ATOM 0 HB3 ASP A 915 8.722 -4.558 -1.157 1.00 0.00 H new ATOM 412 N GLU A 916 6.566 -3.456 -1.957 1.00 0.00 N ATOM 413 CA GLU A 916 5.541 -3.516 -2.992 1.00 0.00 C ATOM 414 C GLU A 916 4.742 -2.217 -3.044 1.00 0.00 C ATOM 415 O GLU A 916 4.673 -1.559 -4.083 1.00 0.00 O ATOM 416 CB GLU A 916 4.599 -4.696 -2.740 1.00 0.00 C ATOM 417 CG GLU A 916 5.249 -6.051 -2.961 1.00 0.00 C ATOM 418 CD GLU A 916 5.676 -6.265 -4.400 1.00 0.00 C ATOM 419 OE1 GLU A 916 4.806 -6.589 -5.235 1.00 0.00 O ATOM 420 OE2 GLU A 916 6.880 -6.110 -4.692 1.00 0.00 O ATOM 0 H GLU A 916 6.598 -4.273 -1.347 1.00 0.00 H new ATOM 0 HA GLU A 916 6.039 -3.655 -3.952 1.00 0.00 H new ATOM 0 HB2 GLU A 916 4.229 -4.643 -1.716 1.00 0.00 H new ATOM 0 HB3 GLU A 916 3.734 -4.606 -3.397 1.00 0.00 H new ATOM 0 HG2 GLU A 916 6.119 -6.143 -2.310 1.00 0.00 H new ATOM 0 HG3 GLU A 916 4.550 -6.836 -2.673 1.00 0.00 H new ATOM 427 N LEU A 917 4.141 -1.853 -1.916 1.00 0.00 N ATOM 428 CA LEU A 917 3.347 -0.632 -1.832 1.00 0.00 C ATOM 429 C LEU A 917 4.032 0.515 -2.567 1.00 0.00 C ATOM 430 O LEU A 917 3.458 1.116 -3.476 1.00 0.00 O ATOM 431 CB LEU A 917 3.116 -0.250 -0.369 1.00 0.00 C ATOM 432 CG LEU A 917 2.079 -1.082 0.386 1.00 0.00 C ATOM 433 CD1 LEU A 917 2.260 -0.926 1.888 1.00 0.00 C ATOM 434 CD2 LEU A 917 0.671 -0.682 -0.027 1.00 0.00 C ATOM 0 H LEU A 917 4.188 -2.386 -1.047 1.00 0.00 H new ATOM 0 HA LEU A 917 2.385 -0.820 -2.308 1.00 0.00 H new ATOM 0 HB2 LEU A 917 4.066 -0.324 0.159 1.00 0.00 H new ATOM 0 HB3 LEU A 917 2.811 0.796 -0.331 1.00 0.00 H new ATOM 0 HG LEU A 917 2.227 -2.131 0.130 1.00 0.00 H new ATOM 0 HD11 LEU A 917 1.513 -1.525 2.409 1.00 0.00 H new ATOM 0 HD12 LEU A 917 3.257 -1.263 2.171 1.00 0.00 H new ATOM 0 HD13 LEU A 917 2.140 0.122 2.162 1.00 0.00 H new ATOM 0 HD21 LEU A 917 -0.054 -1.285 0.520 1.00 0.00 H new ATOM 0 HD22 LEU A 917 0.511 0.372 0.199 1.00 0.00 H new ATOM 0 HD23 LEU A 917 0.545 -0.847 -1.097 1.00 0.00 H new ATOM 446 N LEU A 918 5.264 0.813 -2.170 1.00 0.00 N ATOM 447 CA LEU A 918 6.030 1.888 -2.792 1.00 0.00 C ATOM 448 C LEU A 918 5.745 1.963 -4.289 1.00 0.00 C ATOM 449 O LEU A 918 5.314 2.999 -4.796 1.00 0.00 O ATOM 450 CB LEU A 918 7.527 1.676 -2.557 1.00 0.00 C ATOM 451 CG LEU A 918 7.945 1.382 -1.116 1.00 0.00 C ATOM 452 CD1 LEU A 918 9.444 1.143 -1.033 1.00 0.00 C ATOM 453 CD2 LEU A 918 7.533 2.524 -0.198 1.00 0.00 C ATOM 0 H LEU A 918 5.754 0.325 -1.420 1.00 0.00 H new ATOM 0 HA LEU A 918 5.726 2.830 -2.335 1.00 0.00 H new ATOM 0 HB2 LEU A 918 7.860 0.851 -3.186 1.00 0.00 H new ATOM 0 HB3 LEU A 918 8.057 2.567 -2.893 1.00 0.00 H new ATOM 0 HG LEU A 918 7.435 0.476 -0.788 1.00 0.00 H new ATOM 0 HD11 LEU A 918 9.723 0.935 0.000 1.00 0.00 H new ATOM 0 HD12 LEU A 918 9.712 0.292 -1.659 1.00 0.00 H new ATOM 0 HD13 LEU A 918 9.974 2.030 -1.380 1.00 0.00 H new ATOM 0 HD21 LEU A 918 7.838 2.298 0.824 1.00 0.00 H new ATOM 0 HD22 LEU A 918 8.014 3.446 -0.525 1.00 0.00 H new ATOM 0 HD23 LEU A 918 6.451 2.648 -0.234 1.00 0.00 H new ATOM 465 N GLN A 919 5.986 0.859 -4.988 1.00 0.00 N ATOM 466 CA GLN A 919 5.753 0.801 -6.427 1.00 0.00 C ATOM 467 C GLN A 919 4.320 1.200 -6.763 1.00 0.00 C ATOM 468 O GLN A 919 4.079 1.940 -7.716 1.00 0.00 O ATOM 469 CB GLN A 919 6.040 -0.605 -6.955 1.00 0.00 C ATOM 470 CG GLN A 919 7.515 -0.871 -7.207 1.00 0.00 C ATOM 471 CD GLN A 919 7.774 -2.266 -7.740 1.00 0.00 C ATOM 472 OE1 GLN A 919 8.214 -3.152 -7.006 1.00 0.00 O ATOM 473 NE2 GLN A 919 7.503 -2.470 -9.024 1.00 0.00 N ATOM 0 H GLN A 919 6.342 -0.007 -4.583 1.00 0.00 H new ATOM 0 HA GLN A 919 6.430 1.507 -6.908 1.00 0.00 H new ATOM 0 HB2 GLN A 919 5.665 -1.336 -6.239 1.00 0.00 H new ATOM 0 HB3 GLN A 919 5.489 -0.755 -7.883 1.00 0.00 H new ATOM 0 HG2 GLN A 919 7.896 -0.138 -7.918 1.00 0.00 H new ATOM 0 HG3 GLN A 919 8.069 -0.732 -6.279 1.00 0.00 H new ATOM 0 HE21 GLN A 919 7.140 -1.708 -9.596 1.00 0.00 H new ATOM 0 HE22 GLN A 919 7.658 -3.389 -9.438 1.00 0.00 H new ATOM 482 N GLN A 920 3.372 0.705 -5.973 1.00 0.00 N ATOM 483 CA GLN A 920 1.962 1.010 -6.188 1.00 0.00 C ATOM 484 C GLN A 920 1.704 2.508 -6.064 1.00 0.00 C ATOM 485 O GLN A 920 0.916 3.077 -6.819 1.00 0.00 O ATOM 486 CB GLN A 920 1.095 0.245 -5.187 1.00 0.00 C ATOM 487 CG GLN A 920 1.079 -1.257 -5.419 1.00 0.00 C ATOM 488 CD GLN A 920 0.400 -1.640 -6.719 1.00 0.00 C ATOM 489 OE1 GLN A 920 -0.287 -0.826 -7.337 1.00 0.00 O ATOM 490 NE2 GLN A 920 0.590 -2.884 -7.143 1.00 0.00 N ATOM 0 H GLN A 920 3.555 0.091 -5.179 1.00 0.00 H new ATOM 0 HA GLN A 920 1.698 0.698 -7.198 1.00 0.00 H new ATOM 0 HB2 GLN A 920 1.457 0.445 -4.178 1.00 0.00 H new ATOM 0 HB3 GLN A 920 0.074 0.623 -5.240 1.00 0.00 H new ATOM 0 HG2 GLN A 920 2.103 -1.631 -5.425 1.00 0.00 H new ATOM 0 HG3 GLN A 920 0.567 -1.743 -4.589 1.00 0.00 H new ATOM 0 HE21 GLN A 920 1.167 -3.526 -6.599 1.00 0.00 H new ATOM 0 HE22 GLN A 920 0.159 -3.198 -8.012 1.00 0.00 H new ATOM 499 N PHE A 921 2.372 3.140 -5.105 1.00 0.00 N ATOM 500 CA PHE A 921 2.214 4.572 -4.880 1.00 0.00 C ATOM 501 C PHE A 921 2.863 5.374 -6.004 1.00 0.00 C ATOM 502 O PHE A 921 2.373 6.437 -6.386 1.00 0.00 O ATOM 503 CB PHE A 921 2.827 4.970 -3.536 1.00 0.00 C ATOM 504 CG PHE A 921 2.222 4.249 -2.365 1.00 0.00 C ATOM 505 CD1 PHE A 921 0.859 4.009 -2.311 1.00 0.00 C ATOM 506 CD2 PHE A 921 3.017 3.811 -1.318 1.00 0.00 C ATOM 507 CE1 PHE A 921 0.300 3.347 -1.234 1.00 0.00 C ATOM 508 CE2 PHE A 921 2.464 3.148 -0.239 1.00 0.00 C ATOM 509 CZ PHE A 921 1.103 2.915 -0.198 1.00 0.00 C ATOM 0 H PHE A 921 3.028 2.683 -4.471 1.00 0.00 H new ATOM 0 HA PHE A 921 1.147 4.796 -4.866 1.00 0.00 H new ATOM 0 HB2 PHE A 921 3.898 4.771 -3.561 1.00 0.00 H new ATOM 0 HB3 PHE A 921 2.705 6.044 -3.394 1.00 0.00 H new ATOM 0 HD1 PHE A 921 0.226 4.343 -3.120 1.00 0.00 H new ATOM 0 HD2 PHE A 921 4.082 3.990 -1.346 1.00 0.00 H new ATOM 0 HE1 PHE A 921 -0.765 3.168 -1.203 1.00 0.00 H new ATOM 0 HE2 PHE A 921 3.095 2.813 0.571 1.00 0.00 H new ATOM 0 HZ PHE A 921 0.668 2.396 0.643 1.00 0.00 H new ATOM 519 N ALA A 922 3.968 4.857 -6.530 1.00 0.00 N ATOM 520 CA ALA A 922 4.684 5.524 -7.612 1.00 0.00 C ATOM 521 C ALA A 922 3.799 5.675 -8.844 1.00 0.00 C ATOM 522 O ALA A 922 3.897 6.662 -9.573 1.00 0.00 O ATOM 523 CB ALA A 922 5.949 4.754 -7.959 1.00 0.00 C ATOM 0 H ALA A 922 4.387 3.979 -6.225 1.00 0.00 H new ATOM 0 HA ALA A 922 4.961 6.522 -7.272 1.00 0.00 H new ATOM 0 HB1 ALA A 922 6.474 5.262 -8.768 1.00 0.00 H new ATOM 0 HB2 ALA A 922 6.595 4.702 -7.083 1.00 0.00 H new ATOM 0 HB3 ALA A 922 5.685 3.745 -8.275 1.00 0.00 H new ATOM 529 N SER A 923 2.935 4.690 -9.072 1.00 0.00 N ATOM 530 CA SER A 923 2.036 4.712 -10.219 1.00 0.00 C ATOM 531 C SER A 923 1.352 6.070 -10.347 1.00 0.00 C ATOM 532 O SER A 923 0.913 6.457 -11.431 1.00 0.00 O ATOM 533 CB SER A 923 0.984 3.609 -10.090 1.00 0.00 C ATOM 534 OG SER A 923 1.430 2.406 -10.692 1.00 0.00 O ATOM 0 H SER A 923 2.839 3.867 -8.477 1.00 0.00 H new ATOM 0 HA SER A 923 2.628 4.537 -11.117 1.00 0.00 H new ATOM 0 HB2 SER A 923 0.765 3.433 -9.037 1.00 0.00 H new ATOM 0 HB3 SER A 923 0.055 3.932 -10.560 1.00 0.00 H new ATOM 0 HG SER A 923 0.741 1.716 -10.595 1.00 0.00 H new ATOM 540 N PHE A 924 1.265 6.789 -9.233 1.00 0.00 N ATOM 541 CA PHE A 924 0.634 8.104 -9.219 1.00 0.00 C ATOM 542 C PHE A 924 1.579 9.155 -8.644 1.00 0.00 C ATOM 543 O PHE A 924 1.869 10.163 -9.286 1.00 0.00 O ATOM 544 CB PHE A 924 -0.660 8.063 -8.403 1.00 0.00 C ATOM 545 CG PHE A 924 -1.487 6.835 -8.652 1.00 0.00 C ATOM 546 CD1 PHE A 924 -1.013 5.581 -8.301 1.00 0.00 C ATOM 547 CD2 PHE A 924 -2.740 6.934 -9.236 1.00 0.00 C ATOM 548 CE1 PHE A 924 -1.772 4.449 -8.530 1.00 0.00 C ATOM 549 CE2 PHE A 924 -3.504 5.805 -9.467 1.00 0.00 C ATOM 550 CZ PHE A 924 -3.020 4.561 -9.113 1.00 0.00 C ATOM 0 H PHE A 924 1.623 6.484 -8.328 1.00 0.00 H new ATOM 0 HA PHE A 924 0.398 8.378 -10.247 1.00 0.00 H new ATOM 0 HB2 PHE A 924 -0.413 8.116 -7.343 1.00 0.00 H new ATOM 0 HB3 PHE A 924 -1.255 8.946 -8.636 1.00 0.00 H new ATOM 0 HD1 PHE A 924 -0.039 5.487 -7.843 1.00 0.00 H new ATOM 0 HD2 PHE A 924 -3.124 7.904 -9.514 1.00 0.00 H new ATOM 0 HE1 PHE A 924 -1.390 3.477 -8.254 1.00 0.00 H new ATOM 0 HE2 PHE A 924 -4.478 5.896 -9.924 1.00 0.00 H new ATOM 0 HZ PHE A 924 -3.615 3.678 -9.291 1.00 0.00 H new ATOM 560 N GLY A 925 2.056 8.910 -7.427 1.00 0.00 N ATOM 561 CA GLY A 925 2.962 9.844 -6.784 1.00 0.00 C ATOM 562 C GLY A 925 4.229 9.175 -6.290 1.00 0.00 C ATOM 563 O GLY A 925 4.190 8.052 -5.788 1.00 0.00 O ATOM 0 H GLY A 925 1.831 8.082 -6.875 1.00 0.00 H new ATOM 0 HA2 GLY A 925 3.223 10.635 -7.487 1.00 0.00 H new ATOM 0 HA3 GLY A 925 2.454 10.319 -5.944 1.00 0.00 H new ATOM 567 N GLU A 926 5.356 9.865 -6.434 1.00 0.00 N ATOM 568 CA GLU A 926 6.641 9.328 -6.000 1.00 0.00 C ATOM 569 C GLU A 926 6.857 9.572 -4.509 1.00 0.00 C ATOM 570 O GLU A 926 7.231 10.670 -4.096 1.00 0.00 O ATOM 571 CB GLU A 926 7.780 9.961 -6.801 1.00 0.00 C ATOM 572 CG GLU A 926 9.132 9.315 -6.551 1.00 0.00 C ATOM 573 CD GLU A 926 10.103 9.530 -7.697 1.00 0.00 C ATOM 574 OE1 GLU A 926 9.986 10.563 -8.387 1.00 0.00 O ATOM 575 OE2 GLU A 926 10.979 8.664 -7.902 1.00 0.00 O ATOM 0 H GLU A 926 5.406 10.796 -6.847 1.00 0.00 H new ATOM 0 HA GLU A 926 6.635 8.253 -6.178 1.00 0.00 H new ATOM 0 HB2 GLU A 926 7.546 9.895 -7.864 1.00 0.00 H new ATOM 0 HB3 GLU A 926 7.842 11.021 -6.554 1.00 0.00 H new ATOM 0 HG2 GLU A 926 9.561 9.722 -5.635 1.00 0.00 H new ATOM 0 HG3 GLU A 926 8.995 8.245 -6.391 1.00 0.00 H new ATOM 582 N VAL A 927 6.617 8.540 -3.706 1.00 0.00 N ATOM 583 CA VAL A 927 6.785 8.641 -2.261 1.00 0.00 C ATOM 584 C VAL A 927 8.173 9.161 -1.904 1.00 0.00 C ATOM 585 O VAL A 927 9.151 8.875 -2.597 1.00 0.00 O ATOM 586 CB VAL A 927 6.566 7.280 -1.574 1.00 0.00 C ATOM 587 CG1 VAL A 927 6.715 7.412 -0.066 1.00 0.00 C ATOM 588 CG2 VAL A 927 5.202 6.714 -1.936 1.00 0.00 C ATOM 0 H VAL A 927 6.306 7.625 -4.032 1.00 0.00 H new ATOM 0 HA VAL A 927 6.034 9.345 -1.903 1.00 0.00 H new ATOM 0 HB VAL A 927 7.328 6.586 -1.930 1.00 0.00 H new ATOM 0 HG11 VAL A 927 6.557 6.440 0.402 1.00 0.00 H new ATOM 0 HG12 VAL A 927 7.717 7.770 0.171 1.00 0.00 H new ATOM 0 HG13 VAL A 927 5.978 8.121 0.312 1.00 0.00 H new ATOM 0 HG21 VAL A 927 5.064 5.752 -1.442 1.00 0.00 H new ATOM 0 HG22 VAL A 927 4.424 7.404 -1.610 1.00 0.00 H new ATOM 0 HG23 VAL A 927 5.139 6.579 -3.016 1.00 0.00 H new ATOM 598 N ILE A 928 8.253 9.924 -0.820 1.00 0.00 N ATOM 599 CA ILE A 928 9.522 10.482 -0.370 1.00 0.00 C ATOM 600 C ILE A 928 9.808 10.101 1.078 1.00 0.00 C ATOM 601 O ILE A 928 10.953 9.838 1.448 1.00 0.00 O ATOM 602 CB ILE A 928 9.539 12.017 -0.498 1.00 0.00 C ATOM 603 CG1 ILE A 928 8.373 12.628 0.283 1.00 0.00 C ATOM 604 CG2 ILE A 928 9.476 12.428 -1.961 1.00 0.00 C ATOM 605 CD1 ILE A 928 8.340 14.140 0.235 1.00 0.00 C ATOM 0 H ILE A 928 7.454 10.170 -0.236 1.00 0.00 H new ATOM 0 HA ILE A 928 10.296 10.063 -1.013 1.00 0.00 H new ATOM 0 HB ILE A 928 10.472 12.392 -0.076 1.00 0.00 H new ATOM 0 HG12 ILE A 928 7.436 12.239 -0.116 1.00 0.00 H new ATOM 0 HG13 ILE A 928 8.435 12.307 1.323 1.00 0.00 H new ATOM 0 HG21 ILE A 928 9.489 13.515 -2.034 1.00 0.00 H new ATOM 0 HG22 ILE A 928 10.336 12.018 -2.491 1.00 0.00 H new ATOM 0 HG23 ILE A 928 8.558 12.045 -2.407 1.00 0.00 H new ATOM 0 HD11 ILE A 928 7.488 14.504 0.809 1.00 0.00 H new ATOM 0 HD12 ILE A 928 9.261 14.538 0.661 1.00 0.00 H new ATOM 0 HD13 ILE A 928 8.247 14.469 -0.800 1.00 0.00 H new ATOM 617 N LEU A 929 8.760 10.071 1.894 1.00 0.00 N ATOM 618 CA LEU A 929 8.897 9.719 3.303 1.00 0.00 C ATOM 619 C LEU A 929 7.742 8.833 3.759 1.00 0.00 C ATOM 620 O LEU A 929 6.616 8.969 3.279 1.00 0.00 O ATOM 621 CB LEU A 929 8.954 10.984 4.162 1.00 0.00 C ATOM 622 CG LEU A 929 9.039 10.766 5.673 1.00 0.00 C ATOM 623 CD1 LEU A 929 10.440 10.330 6.072 1.00 0.00 C ATOM 624 CD2 LEU A 929 8.640 12.032 6.418 1.00 0.00 C ATOM 0 H LEU A 929 7.806 10.286 1.604 1.00 0.00 H new ATOM 0 HA LEU A 929 9.826 9.163 3.424 1.00 0.00 H new ATOM 0 HB2 LEU A 929 9.818 11.572 3.851 1.00 0.00 H new ATOM 0 HB3 LEU A 929 8.068 11.583 3.951 1.00 0.00 H new ATOM 0 HG LEU A 929 8.343 9.973 5.946 1.00 0.00 H new ATOM 0 HD11 LEU A 929 10.481 10.180 7.151 1.00 0.00 H new ATOM 0 HD12 LEU A 929 10.689 9.397 5.566 1.00 0.00 H new ATOM 0 HD13 LEU A 929 11.156 11.100 5.786 1.00 0.00 H new ATOM 0 HD21 LEU A 929 8.706 11.858 7.492 1.00 0.00 H new ATOM 0 HD22 LEU A 929 9.311 12.845 6.140 1.00 0.00 H new ATOM 0 HD23 LEU A 929 7.617 12.301 6.157 1.00 0.00 H new ATOM 636 N ILE A 930 8.029 7.927 4.687 1.00 0.00 N ATOM 637 CA ILE A 930 7.013 7.021 5.209 1.00 0.00 C ATOM 638 C ILE A 930 7.111 6.901 6.726 1.00 0.00 C ATOM 639 O ILE A 930 8.185 6.647 7.271 1.00 0.00 O ATOM 640 CB ILE A 930 7.135 5.618 4.585 1.00 0.00 C ATOM 641 CG1 ILE A 930 7.024 5.703 3.062 1.00 0.00 C ATOM 642 CG2 ILE A 930 6.067 4.693 5.150 1.00 0.00 C ATOM 643 CD1 ILE A 930 7.482 4.448 2.352 1.00 0.00 C ATOM 0 H ILE A 930 8.956 7.801 5.093 1.00 0.00 H new ATOM 0 HA ILE A 930 6.045 7.445 4.942 1.00 0.00 H new ATOM 0 HB ILE A 930 8.113 5.207 4.836 1.00 0.00 H new ATOM 0 HG12 ILE A 930 5.988 5.906 2.792 1.00 0.00 H new ATOM 0 HG13 ILE A 930 7.616 6.547 2.709 1.00 0.00 H new ATOM 0 HG21 ILE A 930 6.166 3.705 4.700 1.00 0.00 H new ATOM 0 HG22 ILE A 930 6.189 4.613 6.230 1.00 0.00 H new ATOM 0 HG23 ILE A 930 5.080 5.097 4.925 1.00 0.00 H new ATOM 0 HD11 ILE A 930 7.375 4.580 1.275 1.00 0.00 H new ATOM 0 HD12 ILE A 930 8.528 4.255 2.592 1.00 0.00 H new ATOM 0 HD13 ILE A 930 6.874 3.604 2.676 1.00 0.00 H new ATOM 655 N ARG A 931 5.982 7.084 7.403 1.00 0.00 N ATOM 656 CA ARG A 931 5.940 6.995 8.858 1.00 0.00 C ATOM 657 C ARG A 931 5.004 5.877 9.308 1.00 0.00 C ATOM 658 O ARG A 931 3.831 5.847 8.933 1.00 0.00 O ATOM 659 CB ARG A 931 5.487 8.327 9.458 1.00 0.00 C ATOM 660 CG ARG A 931 5.794 8.463 10.941 1.00 0.00 C ATOM 661 CD ARG A 931 7.178 9.050 11.171 1.00 0.00 C ATOM 662 NE ARG A 931 8.230 8.051 11.007 1.00 0.00 N ATOM 663 CZ ARG A 931 9.517 8.354 10.876 1.00 0.00 C ATOM 664 NH1 ARG A 931 9.908 9.620 10.891 1.00 0.00 N ATOM 665 NH2 ARG A 931 10.416 7.388 10.731 1.00 0.00 N ATOM 0 H ARG A 931 5.084 7.295 6.967 1.00 0.00 H new ATOM 0 HA ARG A 931 6.945 6.768 9.212 1.00 0.00 H new ATOM 0 HB2 ARG A 931 5.971 9.142 8.919 1.00 0.00 H new ATOM 0 HB3 ARG A 931 4.413 8.438 9.306 1.00 0.00 H new ATOM 0 HG2 ARG A 931 5.045 9.099 11.412 1.00 0.00 H new ATOM 0 HG3 ARG A 931 5.728 7.485 11.419 1.00 0.00 H new ATOM 0 HD2 ARG A 931 7.345 9.870 10.472 1.00 0.00 H new ATOM 0 HD3 ARG A 931 7.231 9.471 12.175 1.00 0.00 H new ATOM 0 HE ARG A 931 7.962 7.067 10.992 1.00 0.00 H new ATOM 0 HH11 ARG A 931 9.220 10.365 11.003 1.00 0.00 H new ATOM 0 HH12 ARG A 931 10.897 9.850 10.790 1.00 0.00 H new ATOM 0 HH21 ARG A 931 10.119 6.412 10.720 1.00 0.00 H new ATOM 0 HH22 ARG A 931 11.404 7.622 10.630 1.00 0.00 H new ATOM 679 N PHE A 932 5.530 4.960 10.112 1.00 0.00 N ATOM 680 CA PHE A 932 4.742 3.839 10.612 1.00 0.00 C ATOM 681 C PHE A 932 4.085 4.188 11.944 1.00 0.00 C ATOM 682 O PHE A 932 4.765 4.487 12.926 1.00 0.00 O ATOM 683 CB PHE A 932 5.625 2.600 10.775 1.00 0.00 C ATOM 684 CG PHE A 932 6.356 2.216 9.521 1.00 0.00 C ATOM 685 CD1 PHE A 932 5.728 1.467 8.539 1.00 0.00 C ATOM 686 CD2 PHE A 932 7.672 2.602 9.324 1.00 0.00 C ATOM 687 CE1 PHE A 932 6.397 1.112 7.383 1.00 0.00 C ATOM 688 CE2 PHE A 932 8.347 2.250 8.170 1.00 0.00 C ATOM 689 CZ PHE A 932 7.709 1.503 7.199 1.00 0.00 C ATOM 0 H PHE A 932 6.499 4.971 10.432 1.00 0.00 H new ATOM 0 HA PHE A 932 3.958 3.625 9.885 1.00 0.00 H new ATOM 0 HB2 PHE A 932 6.351 2.783 11.568 1.00 0.00 H new ATOM 0 HB3 PHE A 932 5.006 1.762 11.096 1.00 0.00 H new ATOM 0 HD1 PHE A 932 4.703 1.157 8.679 1.00 0.00 H new ATOM 0 HD2 PHE A 932 8.176 3.185 10.081 1.00 0.00 H new ATOM 0 HE1 PHE A 932 5.895 0.530 6.625 1.00 0.00 H new ATOM 0 HE2 PHE A 932 9.372 2.559 8.028 1.00 0.00 H new ATOM 0 HZ PHE A 932 8.235 1.225 6.298 1.00 0.00 H new ATOM 699 N VAL A 933 2.756 4.147 11.970 1.00 0.00 N ATOM 700 CA VAL A 933 2.005 4.457 13.181 1.00 0.00 C ATOM 701 C VAL A 933 1.864 3.228 14.070 1.00 0.00 C ATOM 702 O VAL A 933 1.960 2.095 13.599 1.00 0.00 O ATOM 703 CB VAL A 933 0.603 5.001 12.847 1.00 0.00 C ATOM 704 CG1 VAL A 933 -0.041 5.611 14.083 1.00 0.00 C ATOM 705 CG2 VAL A 933 0.681 6.018 11.719 1.00 0.00 C ATOM 0 H VAL A 933 2.178 3.902 11.166 1.00 0.00 H new ATOM 0 HA VAL A 933 2.566 5.224 13.715 1.00 0.00 H new ATOM 0 HB VAL A 933 -0.020 4.171 12.514 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -1.031 5.990 13.828 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -0.132 4.851 14.859 1.00 0.00 H new ATOM 0 HG13 VAL A 933 0.578 6.430 14.449 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -0.318 6.392 11.496 1.00 0.00 H new ATOM 0 HG22 VAL A 933 1.320 6.848 12.021 1.00 0.00 H new ATOM 0 HG23 VAL A 933 1.098 5.544 10.830 1.00 0.00 H new ATOM 715 N GLU A 934 1.634 3.459 15.359 1.00 0.00 N ATOM 716 CA GLU A 934 1.479 2.369 16.315 1.00 0.00 C ATOM 717 C GLU A 934 0.804 1.166 15.663 1.00 0.00 C ATOM 718 O GLU A 934 1.289 0.039 15.762 1.00 0.00 O ATOM 719 CB GLU A 934 0.664 2.833 17.524 1.00 0.00 C ATOM 720 CG GLU A 934 1.335 3.937 18.323 1.00 0.00 C ATOM 721 CD GLU A 934 0.624 4.225 19.631 1.00 0.00 C ATOM 722 OE1 GLU A 934 -0.625 4.242 19.636 1.00 0.00 O ATOM 723 OE2 GLU A 934 1.315 4.434 20.649 1.00 0.00 O ATOM 0 H GLU A 934 1.551 4.391 15.765 1.00 0.00 H new ATOM 0 HA GLU A 934 2.472 2.069 16.650 1.00 0.00 H new ATOM 0 HB2 GLU A 934 -0.310 3.184 17.182 1.00 0.00 H new ATOM 0 HB3 GLU A 934 0.484 1.980 18.179 1.00 0.00 H new ATOM 0 HG2 GLU A 934 2.367 3.655 18.529 1.00 0.00 H new ATOM 0 HG3 GLU A 934 1.367 4.847 17.723 1.00 0.00 H new ATOM 730 N ASP A 935 -0.319 1.414 14.997 1.00 0.00 N ATOM 731 CA ASP A 935 -1.062 0.352 14.329 1.00 0.00 C ATOM 732 C ASP A 935 -1.292 0.692 12.859 1.00 0.00 C ATOM 733 O ASP A 935 -1.450 -0.196 12.022 1.00 0.00 O ATOM 734 CB ASP A 935 -2.402 0.120 15.027 1.00 0.00 C ATOM 735 CG ASP A 935 -3.476 1.080 14.553 1.00 0.00 C ATOM 736 OD1 ASP A 935 -4.115 0.792 13.519 1.00 0.00 O ATOM 737 OD2 ASP A 935 -3.678 2.119 15.216 1.00 0.00 O ATOM 0 H ASP A 935 -0.734 2.341 14.906 1.00 0.00 H new ATOM 0 HA ASP A 935 -0.470 -0.562 14.384 1.00 0.00 H new ATOM 0 HB2 ASP A 935 -2.729 -0.904 14.847 1.00 0.00 H new ATOM 0 HB3 ASP A 935 -2.271 0.229 16.104 1.00 0.00 H new ATOM 742 N LYS A 936 -1.311 1.985 12.553 1.00 0.00 N ATOM 743 CA LYS A 936 -1.522 2.445 11.185 1.00 0.00 C ATOM 744 C LYS A 936 -0.191 2.736 10.498 1.00 0.00 C ATOM 745 O LYS A 936 0.865 2.699 11.129 1.00 0.00 O ATOM 746 CB LYS A 936 -2.399 3.699 11.176 1.00 0.00 C ATOM 747 CG LYS A 936 -3.256 3.832 9.929 1.00 0.00 C ATOM 748 CD LYS A 936 -4.423 4.780 10.154 1.00 0.00 C ATOM 749 CE LYS A 936 -5.544 4.109 10.931 1.00 0.00 C ATOM 750 NZ LYS A 936 -5.374 4.271 12.402 1.00 0.00 N ATOM 0 H LYS A 936 -1.183 2.733 13.234 1.00 0.00 H new ATOM 0 HA LYS A 936 -2.029 1.652 10.635 1.00 0.00 H new ATOM 0 HB2 LYS A 936 -3.047 3.685 12.052 1.00 0.00 H new ATOM 0 HB3 LYS A 936 -1.762 4.579 11.264 1.00 0.00 H new ATOM 0 HG2 LYS A 936 -2.645 4.195 9.103 1.00 0.00 H new ATOM 0 HG3 LYS A 936 -3.633 2.851 9.639 1.00 0.00 H new ATOM 0 HD2 LYS A 936 -4.079 5.660 10.697 1.00 0.00 H new ATOM 0 HD3 LYS A 936 -4.802 5.127 9.193 1.00 0.00 H new ATOM 0 HE2 LYS A 936 -6.501 4.533 10.627 1.00 0.00 H new ATOM 0 HE3 LYS A 936 -5.573 3.048 10.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 936 -6.299 4.453 12.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 936 -4.966 3.402 12.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 936 -4.738 5.071 12.592 1.00 0.00 H new ATOM 764 N MET A 937 -0.251 3.028 9.203 1.00 0.00 N ATOM 765 CA MET A 937 0.950 3.329 8.432 1.00 0.00 C ATOM 766 C MET A 937 0.735 4.554 7.548 1.00 0.00 C ATOM 767 O MET A 937 -0.021 4.506 6.578 1.00 0.00 O ATOM 768 CB MET A 937 1.343 2.128 7.571 1.00 0.00 C ATOM 769 CG MET A 937 2.404 2.447 6.530 1.00 0.00 C ATOM 770 SD MET A 937 2.988 0.980 5.661 1.00 0.00 S ATOM 771 CE MET A 937 3.743 1.721 4.215 1.00 0.00 C ATOM 0 H MET A 937 -1.117 3.063 8.666 1.00 0.00 H new ATOM 0 HA MET A 937 1.757 3.545 9.132 1.00 0.00 H new ATOM 0 HB2 MET A 937 1.709 1.331 8.219 1.00 0.00 H new ATOM 0 HB3 MET A 937 0.455 1.746 7.067 1.00 0.00 H new ATOM 0 HG2 MET A 937 1.997 3.155 5.807 1.00 0.00 H new ATOM 0 HG3 MET A 937 3.248 2.937 7.016 1.00 0.00 H new ATOM 0 HE1 MET A 937 4.566 1.094 3.872 1.00 0.00 H new ATOM 0 HE2 MET A 937 3.000 1.811 3.422 1.00 0.00 H new ATOM 0 HE3 MET A 937 4.123 2.710 4.470 1.00 0.00 H new ATOM 781 N TRP A 938 1.405 5.649 7.890 1.00 0.00 N ATOM 782 CA TRP A 938 1.287 6.886 7.128 1.00 0.00 C ATOM 783 C TRP A 938 2.321 6.937 6.008 1.00 0.00 C ATOM 784 O TRP A 938 3.391 6.337 6.111 1.00 0.00 O ATOM 785 CB TRP A 938 1.455 8.096 8.049 1.00 0.00 C ATOM 786 CG TRP A 938 0.402 8.183 9.112 1.00 0.00 C ATOM 787 CD1 TRP A 938 -0.663 7.346 9.281 1.00 0.00 C ATOM 788 CD2 TRP A 938 0.313 9.164 10.151 1.00 0.00 C ATOM 789 NE1 TRP A 938 -1.409 7.747 10.363 1.00 0.00 N ATOM 790 CE2 TRP A 938 -0.831 8.860 10.915 1.00 0.00 C ATOM 791 CE3 TRP A 938 1.089 10.269 10.512 1.00 0.00 C ATOM 792 CZ2 TRP A 938 -1.215 9.621 12.015 1.00 0.00 C ATOM 793 CZ3 TRP A 938 0.706 11.024 11.605 1.00 0.00 C ATOM 794 CH2 TRP A 938 -0.437 10.697 12.346 1.00 0.00 C ATOM 0 H TRP A 938 2.035 5.705 8.690 1.00 0.00 H new ATOM 0 HA TRP A 938 0.293 6.914 6.681 1.00 0.00 H new ATOM 0 HB2 TRP A 938 2.436 8.050 8.522 1.00 0.00 H new ATOM 0 HB3 TRP A 938 1.432 9.006 7.450 1.00 0.00 H new ATOM 0 HD1 TRP A 938 -0.886 6.494 8.656 1.00 0.00 H new ATOM 0 HE1 TRP A 938 -2.256 7.290 10.701 1.00 0.00 H new ATOM 0 HE3 TRP A 938 1.972 10.528 9.947 1.00 0.00 H new ATOM 0 HZ2 TRP A 938 -2.096 9.371 12.587 1.00 0.00 H new ATOM 0 HZ3 TRP A 938 1.298 11.880 11.892 1.00 0.00 H new ATOM 0 HH2 TRP A 938 -0.710 11.306 13.195 1.00 0.00 H new ATOM 805 N VAL A 939 1.995 7.657 4.939 1.00 0.00 N ATOM 806 CA VAL A 939 2.897 7.787 3.801 1.00 0.00 C ATOM 807 C VAL A 939 2.867 9.202 3.235 1.00 0.00 C ATOM 808 O VAL A 939 1.811 9.711 2.860 1.00 0.00 O ATOM 809 CB VAL A 939 2.537 6.791 2.683 1.00 0.00 C ATOM 810 CG1 VAL A 939 3.458 6.974 1.487 1.00 0.00 C ATOM 811 CG2 VAL A 939 2.601 5.362 3.202 1.00 0.00 C ATOM 0 H VAL A 939 1.113 8.159 4.838 1.00 0.00 H new ATOM 0 HA VAL A 939 3.900 7.566 4.165 1.00 0.00 H new ATOM 0 HB VAL A 939 1.516 6.990 2.358 1.00 0.00 H new ATOM 0 HG11 VAL A 939 3.188 6.261 0.708 1.00 0.00 H new ATOM 0 HG12 VAL A 939 3.357 7.989 1.102 1.00 0.00 H new ATOM 0 HG13 VAL A 939 4.490 6.803 1.793 1.00 0.00 H new ATOM 0 HG21 VAL A 939 2.344 4.671 2.399 1.00 0.00 H new ATOM 0 HG22 VAL A 939 3.610 5.148 3.555 1.00 0.00 H new ATOM 0 HG23 VAL A 939 1.895 5.242 4.024 1.00 0.00 H new ATOM 821 N THR A 940 4.036 9.834 3.174 1.00 0.00 N ATOM 822 CA THR A 940 4.144 11.191 2.654 1.00 0.00 C ATOM 823 C THR A 940 4.406 11.185 1.153 1.00 0.00 C ATOM 824 O THR A 940 5.024 10.261 0.624 1.00 0.00 O ATOM 825 CB THR A 940 5.269 11.974 3.357 1.00 0.00 C ATOM 826 OG1 THR A 940 4.893 12.266 4.708 1.00 0.00 O ATOM 827 CG2 THR A 940 5.571 13.269 2.618 1.00 0.00 C ATOM 0 H THR A 940 4.920 9.427 3.478 1.00 0.00 H new ATOM 0 HA THR A 940 3.191 11.682 2.852 1.00 0.00 H new ATOM 0 HB THR A 940 6.167 11.356 3.356 1.00 0.00 H new ATOM 0 HG1 THR A 940 5.614 12.762 5.148 1.00 0.00 H new ATOM 0 HG21 THR A 940 6.368 13.804 3.133 1.00 0.00 H new ATOM 0 HG22 THR A 940 5.886 13.042 1.599 1.00 0.00 H new ATOM 0 HG23 THR A 940 4.676 13.890 2.591 1.00 0.00 H new ATOM 835 N PHE A 941 3.934 12.223 0.470 1.00 0.00 N ATOM 836 CA PHE A 941 4.117 12.337 -0.972 1.00 0.00 C ATOM 837 C PHE A 941 4.685 13.704 -1.342 1.00 0.00 C ATOM 838 O PHE A 941 4.445 14.696 -0.652 1.00 0.00 O ATOM 839 CB PHE A 941 2.788 12.111 -1.696 1.00 0.00 C ATOM 840 CG PHE A 941 2.403 10.664 -1.805 1.00 0.00 C ATOM 841 CD1 PHE A 941 2.190 9.902 -0.668 1.00 0.00 C ATOM 842 CD2 PHE A 941 2.254 10.064 -3.046 1.00 0.00 C ATOM 843 CE1 PHE A 941 1.835 8.570 -0.765 1.00 0.00 C ATOM 844 CE2 PHE A 941 1.899 8.733 -3.149 1.00 0.00 C ATOM 845 CZ PHE A 941 1.690 7.984 -2.007 1.00 0.00 C ATOM 0 H PHE A 941 3.422 12.997 0.892 1.00 0.00 H new ATOM 0 HA PHE A 941 4.827 11.572 -1.284 1.00 0.00 H new ATOM 0 HB2 PHE A 941 2.000 12.649 -1.169 1.00 0.00 H new ATOM 0 HB3 PHE A 941 2.852 12.538 -2.697 1.00 0.00 H new ATOM 0 HD1 PHE A 941 2.303 10.354 0.306 1.00 0.00 H new ATOM 0 HD2 PHE A 941 2.417 10.644 -3.942 1.00 0.00 H new ATOM 0 HE1 PHE A 941 1.671 7.988 0.130 1.00 0.00 H new ATOM 0 HE2 PHE A 941 1.785 8.278 -4.122 1.00 0.00 H new ATOM 0 HZ PHE A 941 1.414 6.943 -2.085 1.00 0.00 H new ATOM 855 N LEU A 942 5.440 13.748 -2.434 1.00 0.00 N ATOM 856 CA LEU A 942 6.044 14.993 -2.897 1.00 0.00 C ATOM 857 C LEU A 942 5.103 16.172 -2.670 1.00 0.00 C ATOM 858 O LEU A 942 5.440 17.119 -1.961 1.00 0.00 O ATOM 859 CB LEU A 942 6.402 14.889 -4.380 1.00 0.00 C ATOM 860 CG LEU A 942 6.751 16.203 -5.080 1.00 0.00 C ATOM 861 CD1 LEU A 942 7.914 16.888 -4.380 1.00 0.00 C ATOM 862 CD2 LEU A 942 7.079 15.955 -6.545 1.00 0.00 C ATOM 0 H LEU A 942 5.649 12.936 -3.015 1.00 0.00 H new ATOM 0 HA LEU A 942 6.954 15.162 -2.322 1.00 0.00 H new ATOM 0 HB2 LEU A 942 7.249 14.210 -4.482 1.00 0.00 H new ATOM 0 HB3 LEU A 942 5.563 14.433 -4.905 1.00 0.00 H new ATOM 0 HG LEU A 942 5.884 16.862 -5.029 1.00 0.00 H new ATOM 0 HD11 LEU A 942 8.148 17.821 -4.892 1.00 0.00 H new ATOM 0 HD12 LEU A 942 7.642 17.100 -3.346 1.00 0.00 H new ATOM 0 HD13 LEU A 942 8.786 16.235 -4.400 1.00 0.00 H new ATOM 0 HD21 LEU A 942 7.325 16.901 -7.028 1.00 0.00 H new ATOM 0 HD22 LEU A 942 7.930 15.278 -6.618 1.00 0.00 H new ATOM 0 HD23 LEU A 942 6.217 15.508 -7.040 1.00 0.00 H new ATOM 874 N GLU A 943 3.922 16.104 -3.276 1.00 0.00 N ATOM 875 CA GLU A 943 2.932 17.166 -3.139 1.00 0.00 C ATOM 876 C GLU A 943 1.567 16.592 -2.767 1.00 0.00 C ATOM 877 O GLU A 943 1.323 15.396 -2.914 1.00 0.00 O ATOM 878 CB GLU A 943 2.824 17.964 -4.440 1.00 0.00 C ATOM 879 CG GLU A 943 4.004 18.889 -4.686 1.00 0.00 C ATOM 880 CD GLU A 943 3.801 20.266 -4.085 1.00 0.00 C ATOM 881 OE1 GLU A 943 2.636 20.638 -3.834 1.00 0.00 O ATOM 882 OE2 GLU A 943 4.808 20.972 -3.867 1.00 0.00 O ATOM 0 H GLU A 943 3.628 15.326 -3.866 1.00 0.00 H new ATOM 0 HA GLU A 943 3.258 17.831 -2.339 1.00 0.00 H new ATOM 0 HB2 GLU A 943 2.737 17.270 -5.276 1.00 0.00 H new ATOM 0 HB3 GLU A 943 1.908 18.555 -4.419 1.00 0.00 H new ATOM 0 HG2 GLU A 943 4.905 18.442 -4.265 1.00 0.00 H new ATOM 0 HG3 GLU A 943 4.167 18.986 -5.759 1.00 0.00 H new ATOM 889 N GLY A 944 0.681 17.457 -2.282 1.00 0.00 N ATOM 890 CA GLY A 944 -0.647 17.019 -1.895 1.00 0.00 C ATOM 891 C GLY A 944 -1.375 16.311 -3.020 1.00 0.00 C ATOM 892 O GLY A 944 -1.802 15.167 -2.869 1.00 0.00 O ATOM 0 H GLY A 944 0.859 18.453 -2.150 1.00 0.00 H new ATOM 0 HA2 GLY A 944 -0.570 16.350 -1.038 1.00 0.00 H new ATOM 0 HA3 GLY A 944 -1.231 17.881 -1.574 1.00 0.00 H new ATOM 896 N SER A 945 -1.519 16.994 -4.152 1.00 0.00 N ATOM 897 CA SER A 945 -2.206 16.425 -5.306 1.00 0.00 C ATOM 898 C SER A 945 -1.853 14.951 -5.475 1.00 0.00 C ATOM 899 O SER A 945 -2.732 14.106 -5.643 1.00 0.00 O ATOM 900 CB SER A 945 -1.840 17.198 -6.574 1.00 0.00 C ATOM 901 OG SER A 945 -0.500 16.944 -6.959 1.00 0.00 O ATOM 0 H SER A 945 -1.169 17.942 -4.294 1.00 0.00 H new ATOM 0 HA SER A 945 -3.280 16.506 -5.137 1.00 0.00 H new ATOM 0 HB2 SER A 945 -2.514 16.915 -7.383 1.00 0.00 H new ATOM 0 HB3 SER A 945 -1.976 18.266 -6.404 1.00 0.00 H new ATOM 0 HG SER A 945 -0.292 17.449 -7.773 1.00 0.00 H new ATOM 907 N SER A 946 -0.559 14.649 -5.430 1.00 0.00 N ATOM 908 CA SER A 946 -0.088 13.278 -5.583 1.00 0.00 C ATOM 909 C SER A 946 -0.777 12.352 -4.584 1.00 0.00 C ATOM 910 O SER A 946 -1.103 11.210 -4.903 1.00 0.00 O ATOM 911 CB SER A 946 1.429 13.213 -5.393 1.00 0.00 C ATOM 912 OG SER A 946 2.089 14.137 -6.241 1.00 0.00 O ATOM 0 H SER A 946 0.182 15.336 -5.289 1.00 0.00 H new ATOM 0 HA SER A 946 -0.335 12.945 -6.591 1.00 0.00 H new ATOM 0 HB2 SER A 946 1.678 13.427 -4.354 1.00 0.00 H new ATOM 0 HB3 SER A 946 1.782 12.204 -5.605 1.00 0.00 H new ATOM 0 HG SER A 946 3.057 14.077 -6.099 1.00 0.00 H new ATOM 918 N ALA A 947 -0.995 12.856 -3.374 1.00 0.00 N ATOM 919 CA ALA A 947 -1.647 12.077 -2.328 1.00 0.00 C ATOM 920 C ALA A 947 -3.145 11.957 -2.586 1.00 0.00 C ATOM 921 O ALA A 947 -3.828 11.140 -1.968 1.00 0.00 O ATOM 922 CB ALA A 947 -1.392 12.704 -0.966 1.00 0.00 C ATOM 0 H ALA A 947 -0.730 13.800 -3.094 1.00 0.00 H new ATOM 0 HA ALA A 947 -1.222 11.073 -2.338 1.00 0.00 H new ATOM 0 HB1 ALA A 947 -1.885 12.112 -0.195 1.00 0.00 H new ATOM 0 HB2 ALA A 947 -0.320 12.731 -0.773 1.00 0.00 H new ATOM 0 HB3 ALA A 947 -1.789 13.719 -0.953 1.00 0.00 H new ATOM 928 N LEU A 948 -3.650 12.776 -3.501 1.00 0.00 N ATOM 929 CA LEU A 948 -5.069 12.763 -3.841 1.00 0.00 C ATOM 930 C LEU A 948 -5.351 11.772 -4.966 1.00 0.00 C ATOM 931 O LEU A 948 -6.479 11.312 -5.133 1.00 0.00 O ATOM 932 CB LEU A 948 -5.529 14.163 -4.252 1.00 0.00 C ATOM 933 CG LEU A 948 -5.111 15.305 -3.325 1.00 0.00 C ATOM 934 CD1 LEU A 948 -5.521 16.646 -3.914 1.00 0.00 C ATOM 935 CD2 LEU A 948 -5.718 15.120 -1.942 1.00 0.00 C ATOM 0 H LEU A 948 -3.098 13.458 -4.021 1.00 0.00 H new ATOM 0 HA LEU A 948 -5.625 12.449 -2.958 1.00 0.00 H new ATOM 0 HB2 LEU A 948 -5.144 14.372 -5.250 1.00 0.00 H new ATOM 0 HB3 LEU A 948 -6.617 14.160 -4.324 1.00 0.00 H new ATOM 0 HG LEU A 948 -4.025 15.290 -3.228 1.00 0.00 H new ATOM 0 HD11 LEU A 948 -5.216 17.447 -3.241 1.00 0.00 H new ATOM 0 HD12 LEU A 948 -5.038 16.781 -4.882 1.00 0.00 H new ATOM 0 HD13 LEU A 948 -6.603 16.672 -4.042 1.00 0.00 H new ATOM 0 HD21 LEU A 948 -5.409 15.942 -1.296 1.00 0.00 H new ATOM 0 HD22 LEU A 948 -6.805 15.108 -2.020 1.00 0.00 H new ATOM 0 HD23 LEU A 948 -5.375 14.177 -1.517 1.00 0.00 H new ATOM 947 N ASN A 949 -4.316 11.447 -5.734 1.00 0.00 N ATOM 948 CA ASN A 949 -4.451 10.509 -6.842 1.00 0.00 C ATOM 949 C ASN A 949 -4.220 9.075 -6.373 1.00 0.00 C ATOM 950 O ASN A 949 -4.970 8.166 -6.729 1.00 0.00 O ATOM 951 CB ASN A 949 -3.463 10.858 -7.957 1.00 0.00 C ATOM 952 CG ASN A 949 -4.043 11.838 -8.958 1.00 0.00 C ATOM 953 OD1 ASN A 949 -5.246 11.836 -9.220 1.00 0.00 O ATOM 954 ND2 ASN A 949 -3.188 12.683 -9.522 1.00 0.00 N ATOM 0 H ASN A 949 -3.375 11.820 -5.609 1.00 0.00 H new ATOM 0 HA ASN A 949 -5.467 10.587 -7.229 1.00 0.00 H new ATOM 0 HB2 ASN A 949 -2.560 11.283 -7.519 1.00 0.00 H new ATOM 0 HB3 ASN A 949 -3.167 9.946 -8.475 1.00 0.00 H new ATOM 0 HD21 ASN A 949 -3.520 13.366 -10.203 1.00 0.00 H new ATOM 0 HD22 ASN A 949 -2.199 12.649 -9.275 1.00 0.00 H new ATOM 961 N VAL A 950 -3.178 8.881 -5.572 1.00 0.00 N ATOM 962 CA VAL A 950 -2.848 7.560 -5.052 1.00 0.00 C ATOM 963 C VAL A 950 -4.057 6.916 -4.381 1.00 0.00 C ATOM 964 O VAL A 950 -4.131 5.693 -4.253 1.00 0.00 O ATOM 965 CB VAL A 950 -1.688 7.627 -4.041 1.00 0.00 C ATOM 966 CG1 VAL A 950 -2.134 8.321 -2.763 1.00 0.00 C ATOM 967 CG2 VAL A 950 -1.160 6.232 -3.743 1.00 0.00 C ATOM 0 H VAL A 950 -2.547 9.623 -5.269 1.00 0.00 H new ATOM 0 HA VAL A 950 -2.542 6.952 -5.904 1.00 0.00 H new ATOM 0 HB VAL A 950 -0.879 8.211 -4.480 1.00 0.00 H new ATOM 0 HG11 VAL A 950 -1.302 8.359 -2.060 1.00 0.00 H new ATOM 0 HG12 VAL A 950 -2.460 9.335 -2.994 1.00 0.00 H new ATOM 0 HG13 VAL A 950 -2.960 7.767 -2.317 1.00 0.00 H new ATOM 0 HG21 VAL A 950 -0.341 6.298 -3.027 1.00 0.00 H new ATOM 0 HG22 VAL A 950 -1.960 5.622 -3.324 1.00 0.00 H new ATOM 0 HG23 VAL A 950 -0.800 5.775 -4.665 1.00 0.00 H new ATOM 977 N LEU A 951 -5.001 7.747 -3.955 1.00 0.00 N ATOM 978 CA LEU A 951 -6.208 7.259 -3.296 1.00 0.00 C ATOM 979 C LEU A 951 -6.841 6.123 -4.092 1.00 0.00 C ATOM 980 O LEU A 951 -7.529 5.268 -3.534 1.00 0.00 O ATOM 981 CB LEU A 951 -7.215 8.399 -3.124 1.00 0.00 C ATOM 982 CG LEU A 951 -6.966 9.342 -1.947 1.00 0.00 C ATOM 983 CD1 LEU A 951 -7.885 10.550 -2.027 1.00 0.00 C ATOM 984 CD2 LEU A 951 -7.159 8.609 -0.627 1.00 0.00 C ATOM 0 H LEU A 951 -4.955 8.761 -4.054 1.00 0.00 H new ATOM 0 HA LEU A 951 -5.928 6.878 -2.314 1.00 0.00 H new ATOM 0 HB2 LEU A 951 -7.226 8.989 -4.040 1.00 0.00 H new ATOM 0 HB3 LEU A 951 -8.209 7.965 -3.012 1.00 0.00 H new ATOM 0 HG LEU A 951 -5.935 9.692 -1.998 1.00 0.00 H new ATOM 0 HD11 LEU A 951 -7.693 11.210 -1.181 1.00 0.00 H new ATOM 0 HD12 LEU A 951 -7.698 11.088 -2.956 1.00 0.00 H new ATOM 0 HD13 LEU A 951 -8.923 10.220 -2.001 1.00 0.00 H new ATOM 0 HD21 LEU A 951 -6.978 9.295 0.200 1.00 0.00 H new ATOM 0 HD22 LEU A 951 -8.179 8.230 -0.567 1.00 0.00 H new ATOM 0 HD23 LEU A 951 -6.458 7.776 -0.568 1.00 0.00 H new ATOM 996 N SER A 952 -6.603 6.118 -5.400 1.00 0.00 N ATOM 997 CA SER A 952 -7.151 5.087 -6.273 1.00 0.00 C ATOM 998 C SER A 952 -6.812 3.695 -5.750 1.00 0.00 C ATOM 999 O SER A 952 -7.414 2.701 -6.158 1.00 0.00 O ATOM 1000 CB SER A 952 -6.612 5.254 -7.696 1.00 0.00 C ATOM 1001 OG SER A 952 -6.876 6.555 -8.191 1.00 0.00 O ATOM 0 H SER A 952 -6.034 6.817 -5.878 1.00 0.00 H new ATOM 0 HA SER A 952 -8.235 5.197 -6.287 1.00 0.00 H new ATOM 0 HB2 SER A 952 -5.538 5.069 -7.706 1.00 0.00 H new ATOM 0 HB3 SER A 952 -7.069 4.512 -8.351 1.00 0.00 H new ATOM 0 HG SER A 952 -6.236 7.188 -7.804 1.00 0.00 H new ATOM 1007 N LEU A 953 -5.843 3.631 -4.842 1.00 0.00 N ATOM 1008 CA LEU A 953 -5.422 2.360 -4.261 1.00 0.00 C ATOM 1009 C LEU A 953 -6.192 2.068 -2.977 1.00 0.00 C ATOM 1010 O LEU A 953 -5.793 1.217 -2.183 1.00 0.00 O ATOM 1011 CB LEU A 953 -3.920 2.381 -3.975 1.00 0.00 C ATOM 1012 CG LEU A 953 -3.004 2.168 -5.181 1.00 0.00 C ATOM 1013 CD1 LEU A 953 -1.569 2.533 -4.833 1.00 0.00 C ATOM 1014 CD2 LEU A 953 -3.087 0.728 -5.667 1.00 0.00 C ATOM 0 H LEU A 953 -5.335 4.443 -4.493 1.00 0.00 H new ATOM 0 HA LEU A 953 -5.638 1.570 -4.980 1.00 0.00 H new ATOM 0 HB2 LEU A 953 -3.671 3.339 -3.519 1.00 0.00 H new ATOM 0 HB3 LEU A 953 -3.700 1.610 -3.236 1.00 0.00 H new ATOM 0 HG LEU A 953 -3.339 2.822 -5.986 1.00 0.00 H new ATOM 0 HD11 LEU A 953 -0.932 2.375 -5.703 1.00 0.00 H new ATOM 0 HD12 LEU A 953 -1.522 3.580 -4.534 1.00 0.00 H new ATOM 0 HD13 LEU A 953 -1.223 1.906 -4.012 1.00 0.00 H new ATOM 0 HD21 LEU A 953 -2.429 0.595 -6.526 1.00 0.00 H new ATOM 0 HD22 LEU A 953 -2.779 0.055 -4.866 1.00 0.00 H new ATOM 0 HD23 LEU A 953 -4.113 0.501 -5.958 1.00 0.00 H new ATOM 1026 N ASN A 954 -7.299 2.777 -2.782 1.00 0.00 N ATOM 1027 CA ASN A 954 -8.126 2.592 -1.595 1.00 0.00 C ATOM 1028 C ASN A 954 -8.848 1.248 -1.639 1.00 0.00 C ATOM 1029 O ASN A 954 -9.640 0.987 -2.543 1.00 0.00 O ATOM 1030 CB ASN A 954 -9.145 3.727 -1.476 1.00 0.00 C ATOM 1031 CG ASN A 954 -10.359 3.509 -2.358 1.00 0.00 C ATOM 1032 OD1 ASN A 954 -11.465 3.284 -1.866 1.00 0.00 O ATOM 1033 ND2 ASN A 954 -10.157 3.576 -3.669 1.00 0.00 N ATOM 0 H ASN A 954 -7.644 3.485 -3.430 1.00 0.00 H new ATOM 0 HA ASN A 954 -7.473 2.606 -0.722 1.00 0.00 H new ATOM 0 HB2 ASN A 954 -9.465 3.817 -0.438 1.00 0.00 H new ATOM 0 HB3 ASN A 954 -8.668 4.669 -1.745 1.00 0.00 H new ATOM 0 HD21 ASN A 954 -10.936 3.439 -4.313 1.00 0.00 H new ATOM 0 HD22 ASN A 954 -9.223 3.765 -4.032 1.00 0.00 H new ATOM 1040 N GLY A 955 -8.567 0.400 -0.655 1.00 0.00 N ATOM 1041 CA GLY A 955 -9.198 -0.906 -0.599 1.00 0.00 C ATOM 1042 C GLY A 955 -8.433 -1.954 -1.383 1.00 0.00 C ATOM 1043 O GLY A 955 -8.488 -3.142 -1.065 1.00 0.00 O ATOM 0 H GLY A 955 -7.914 0.594 0.104 1.00 0.00 H new ATOM 0 HA2 GLY A 955 -9.279 -1.222 0.441 1.00 0.00 H new ATOM 0 HA3 GLY A 955 -10.213 -0.833 -0.990 1.00 0.00 H new ATOM 1047 N LYS A 956 -7.717 -1.514 -2.413 1.00 0.00 N ATOM 1048 CA LYS A 956 -6.936 -2.421 -3.246 1.00 0.00 C ATOM 1049 C LYS A 956 -6.280 -3.508 -2.400 1.00 0.00 C ATOM 1050 O LYS A 956 -5.597 -3.215 -1.419 1.00 0.00 O ATOM 1051 CB LYS A 956 -5.867 -1.645 -4.018 1.00 0.00 C ATOM 1052 CG LYS A 956 -5.438 -2.321 -5.308 1.00 0.00 C ATOM 1053 CD LYS A 956 -4.302 -3.303 -5.073 1.00 0.00 C ATOM 1054 CE LYS A 956 -3.641 -3.714 -6.380 1.00 0.00 C ATOM 1055 NZ LYS A 956 -2.515 -2.809 -6.741 1.00 0.00 N ATOM 0 H LYS A 956 -7.662 -0.534 -2.691 1.00 0.00 H new ATOM 0 HA LYS A 956 -7.613 -2.897 -3.955 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -6.248 -0.650 -4.248 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -4.994 -1.512 -3.379 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -6.288 -2.845 -5.745 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -5.124 -1.566 -6.028 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -3.560 -2.851 -4.415 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -4.684 -4.188 -4.563 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -3.272 -4.736 -6.295 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -4.382 -3.708 -7.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -1.898 -3.281 -7.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -2.893 -1.933 -7.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -1.967 -2.579 -5.888 1.00 0.00 H new ATOM 1069 N GLU A 957 -6.491 -4.762 -2.787 1.00 0.00 N ATOM 1070 CA GLU A 957 -5.919 -5.891 -2.064 1.00 0.00 C ATOM 1071 C GLU A 957 -4.630 -6.366 -2.728 1.00 0.00 C ATOM 1072 O GLU A 957 -4.619 -6.715 -3.910 1.00 0.00 O ATOM 1073 CB GLU A 957 -6.924 -7.043 -1.993 1.00 0.00 C ATOM 1074 CG GLU A 957 -6.314 -8.354 -1.528 1.00 0.00 C ATOM 1075 CD GLU A 957 -7.307 -9.228 -0.787 1.00 0.00 C ATOM 1076 OE1 GLU A 957 -8.283 -9.685 -1.418 1.00 0.00 O ATOM 1077 OE2 GLU A 957 -7.108 -9.456 0.425 1.00 0.00 O ATOM 0 H GLU A 957 -7.054 -5.021 -3.597 1.00 0.00 H new ATOM 0 HA GLU A 957 -5.685 -5.560 -1.052 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -7.732 -6.768 -1.316 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -7.368 -7.188 -2.978 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -5.930 -8.898 -2.391 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -5.464 -8.145 -0.879 1.00 0.00 H new ATOM 1084 N LEU A 958 -3.545 -6.376 -1.962 1.00 0.00 N ATOM 1085 CA LEU A 958 -2.249 -6.807 -2.475 1.00 0.00 C ATOM 1086 C LEU A 958 -1.578 -7.780 -1.511 1.00 0.00 C ATOM 1087 O LEU A 958 -1.876 -7.792 -0.316 1.00 0.00 O ATOM 1088 CB LEU A 958 -1.343 -5.597 -2.709 1.00 0.00 C ATOM 1089 CG LEU A 958 -0.168 -5.814 -3.664 1.00 0.00 C ATOM 1090 CD1 LEU A 958 -0.668 -6.057 -5.079 1.00 0.00 C ATOM 1091 CD2 LEU A 958 0.775 -4.620 -3.628 1.00 0.00 C ATOM 0 H LEU A 958 -3.537 -6.090 -0.983 1.00 0.00 H new ATOM 0 HA LEU A 958 -2.413 -7.319 -3.423 1.00 0.00 H new ATOM 0 HB2 LEU A 958 -1.953 -4.780 -3.095 1.00 0.00 H new ATOM 0 HB3 LEU A 958 -0.948 -5.272 -1.746 1.00 0.00 H new ATOM 0 HG LEU A 958 0.382 -6.697 -3.338 1.00 0.00 H new ATOM 0 HD11 LEU A 958 0.182 -6.209 -5.744 1.00 0.00 H new ATOM 0 HD12 LEU A 958 -1.303 -6.943 -5.093 1.00 0.00 H new ATOM 0 HD13 LEU A 958 -1.242 -5.194 -5.415 1.00 0.00 H new ATOM 0 HD21 LEU A 958 1.605 -4.791 -4.313 1.00 0.00 H new ATOM 0 HD22 LEU A 958 0.236 -3.721 -3.928 1.00 0.00 H new ATOM 0 HD23 LEU A 958 1.160 -4.491 -2.617 1.00 0.00 H new ATOM 1103 N LEU A 959 -0.670 -8.594 -2.037 1.00 0.00 N ATOM 1104 CA LEU A 959 0.046 -9.570 -1.223 1.00 0.00 C ATOM 1105 C LEU A 959 -0.897 -10.257 -0.241 1.00 0.00 C ATOM 1106 O LEU A 959 -0.607 -10.352 0.950 1.00 0.00 O ATOM 1107 CB LEU A 959 1.186 -8.891 -0.462 1.00 0.00 C ATOM 1108 CG LEU A 959 2.462 -8.624 -1.262 1.00 0.00 C ATOM 1109 CD1 LEU A 959 3.501 -7.932 -0.394 1.00 0.00 C ATOM 1110 CD2 LEU A 959 3.017 -9.922 -1.829 1.00 0.00 C ATOM 0 H LEU A 959 -0.412 -8.598 -3.024 1.00 0.00 H new ATOM 0 HA LEU A 959 0.461 -10.326 -1.889 1.00 0.00 H new ATOM 0 HB2 LEU A 959 0.820 -7.941 -0.072 1.00 0.00 H new ATOM 0 HB3 LEU A 959 1.443 -9.511 0.397 1.00 0.00 H new ATOM 0 HG LEU A 959 2.215 -7.964 -2.093 1.00 0.00 H new ATOM 0 HD11 LEU A 959 4.402 -7.750 -0.980 1.00 0.00 H new ATOM 0 HD12 LEU A 959 3.103 -6.982 -0.037 1.00 0.00 H new ATOM 0 HD13 LEU A 959 3.744 -8.567 0.458 1.00 0.00 H new ATOM 0 HD21 LEU A 959 3.925 -9.713 -2.395 1.00 0.00 H new ATOM 0 HD22 LEU A 959 3.248 -10.606 -1.013 1.00 0.00 H new ATOM 0 HD23 LEU A 959 2.276 -10.378 -2.486 1.00 0.00 H new ATOM 1122 N ASN A 960 -2.027 -10.737 -0.751 1.00 0.00 N ATOM 1123 CA ASN A 960 -3.013 -11.417 0.080 1.00 0.00 C ATOM 1124 C ASN A 960 -3.296 -10.620 1.350 1.00 0.00 C ATOM 1125 O ASN A 960 -3.464 -11.190 2.428 1.00 0.00 O ATOM 1126 CB ASN A 960 -2.522 -12.820 0.445 1.00 0.00 C ATOM 1127 CG ASN A 960 -1.264 -12.791 1.290 1.00 0.00 C ATOM 1128 OD1 ASN A 960 -1.305 -12.453 2.474 1.00 0.00 O ATOM 1129 ND2 ASN A 960 -0.136 -13.146 0.685 1.00 0.00 N ATOM 0 H ASN A 960 -2.282 -10.667 -1.736 1.00 0.00 H new ATOM 0 HA ASN A 960 -3.938 -11.499 -0.491 1.00 0.00 H new ATOM 0 HB2 ASN A 960 -3.308 -13.347 0.986 1.00 0.00 H new ATOM 0 HB3 ASN A 960 -2.330 -13.384 -0.468 1.00 0.00 H new ATOM 0 HD21 ASN A 960 0.743 -13.146 1.203 1.00 0.00 H new ATOM 0 HD22 ASN A 960 -0.148 -13.419 -0.298 1.00 0.00 H new ATOM 1136 N ARG A 961 -3.349 -9.299 1.213 1.00 0.00 N ATOM 1137 CA ARG A 961 -3.612 -8.423 2.349 1.00 0.00 C ATOM 1138 C ARG A 961 -4.398 -7.190 1.914 1.00 0.00 C ATOM 1139 O ARG A 961 -3.885 -6.337 1.188 1.00 0.00 O ATOM 1140 CB ARG A 961 -2.298 -7.998 3.007 1.00 0.00 C ATOM 1141 CG ARG A 961 -1.779 -8.995 4.030 1.00 0.00 C ATOM 1142 CD ARG A 961 -0.577 -8.447 4.782 1.00 0.00 C ATOM 1143 NE ARG A 961 -0.332 -9.172 6.026 1.00 0.00 N ATOM 1144 CZ ARG A 961 0.293 -10.342 6.084 1.00 0.00 C ATOM 1145 NH1 ARG A 961 0.734 -10.917 4.974 1.00 0.00 N ATOM 1146 NH2 ARG A 961 0.478 -10.940 7.254 1.00 0.00 N ATOM 0 H ARG A 961 -3.213 -8.812 0.327 1.00 0.00 H new ATOM 0 HA ARG A 961 -4.210 -8.977 3.072 1.00 0.00 H new ATOM 0 HB2 ARG A 961 -1.543 -7.858 2.234 1.00 0.00 H new ATOM 0 HB3 ARG A 961 -2.440 -7.033 3.493 1.00 0.00 H new ATOM 0 HG2 ARG A 961 -2.572 -9.238 4.737 1.00 0.00 H new ATOM 0 HG3 ARG A 961 -1.504 -9.923 3.528 1.00 0.00 H new ATOM 0 HD2 ARG A 961 0.307 -8.508 4.147 1.00 0.00 H new ATOM 0 HD3 ARG A 961 -0.738 -7.392 5.003 1.00 0.00 H new ATOM 0 HE ARG A 961 -0.659 -8.757 6.898 1.00 0.00 H new ATOM 0 HH11 ARG A 961 0.594 -10.461 4.073 1.00 0.00 H new ATOM 0 HH12 ARG A 961 1.214 -11.816 5.021 1.00 0.00 H new ATOM 0 HH21 ARG A 961 0.140 -10.501 8.110 1.00 0.00 H new ATOM 0 HH22 ARG A 961 0.958 -11.839 7.297 1.00 0.00 H new ATOM 1160 N THR A 962 -5.647 -7.101 2.361 1.00 0.00 N ATOM 1161 CA THR A 962 -6.504 -5.974 2.017 1.00 0.00 C ATOM 1162 C THR A 962 -5.963 -4.674 2.601 1.00 0.00 C ATOM 1163 O THR A 962 -5.832 -4.536 3.818 1.00 0.00 O ATOM 1164 CB THR A 962 -7.944 -6.189 2.520 1.00 0.00 C ATOM 1165 OG1 THR A 962 -8.461 -7.424 2.011 1.00 0.00 O ATOM 1166 CG2 THR A 962 -8.845 -5.041 2.090 1.00 0.00 C ATOM 0 H THR A 962 -6.087 -7.797 2.963 1.00 0.00 H new ATOM 0 HA THR A 962 -6.514 -5.905 0.929 1.00 0.00 H new ATOM 0 HB THR A 962 -7.923 -6.225 3.609 1.00 0.00 H new ATOM 0 HG1 THR A 962 -7.798 -7.838 1.420 1.00 0.00 H new ATOM 0 HG21 THR A 962 -9.857 -5.215 2.457 1.00 0.00 H new ATOM 0 HG22 THR A 962 -8.465 -4.106 2.503 1.00 0.00 H new ATOM 0 HG23 THR A 962 -8.860 -4.978 1.002 1.00 0.00 H new ATOM 1174 N ILE A 963 -5.652 -3.722 1.727 1.00 0.00 N ATOM 1175 CA ILE A 963 -5.127 -2.433 2.158 1.00 0.00 C ATOM 1176 C ILE A 963 -6.209 -1.358 2.119 1.00 0.00 C ATOM 1177 O ILE A 963 -7.085 -1.374 1.253 1.00 0.00 O ATOM 1178 CB ILE A 963 -3.943 -1.985 1.280 1.00 0.00 C ATOM 1179 CG1 ILE A 963 -2.792 -2.987 1.389 1.00 0.00 C ATOM 1180 CG2 ILE A 963 -3.481 -0.593 1.684 1.00 0.00 C ATOM 1181 CD1 ILE A 963 -1.643 -2.692 0.451 1.00 0.00 C ATOM 0 H ILE A 963 -5.755 -3.820 0.717 1.00 0.00 H new ATOM 0 HA ILE A 963 -4.781 -2.560 3.184 1.00 0.00 H new ATOM 0 HB ILE A 963 -4.272 -1.950 0.242 1.00 0.00 H new ATOM 0 HG12 ILE A 963 -2.421 -2.992 2.414 1.00 0.00 H new ATOM 0 HG13 ILE A 963 -3.171 -3.988 1.182 1.00 0.00 H new ATOM 0 HG21 ILE A 963 -2.644 -0.291 1.055 1.00 0.00 H new ATOM 0 HG22 ILE A 963 -4.302 0.113 1.560 1.00 0.00 H new ATOM 0 HG23 ILE A 963 -3.165 -0.603 2.727 1.00 0.00 H new ATOM 0 HD11 ILE A 963 -0.864 -3.442 0.583 1.00 0.00 H new ATOM 0 HD12 ILE A 963 -1.999 -2.716 -0.579 1.00 0.00 H new ATOM 0 HD13 ILE A 963 -1.237 -1.705 0.672 1.00 0.00 H new ATOM 1193 N THR A 964 -6.141 -0.424 3.062 1.00 0.00 N ATOM 1194 CA THR A 964 -7.114 0.659 3.136 1.00 0.00 C ATOM 1195 C THR A 964 -6.422 2.012 3.259 1.00 0.00 C ATOM 1196 O THR A 964 -5.826 2.323 4.290 1.00 0.00 O ATOM 1197 CB THR A 964 -8.071 0.475 4.329 1.00 0.00 C ATOM 1198 OG1 THR A 964 -8.529 -0.881 4.384 1.00 0.00 O ATOM 1199 CG2 THR A 964 -9.262 1.414 4.217 1.00 0.00 C ATOM 0 H THR A 964 -5.422 -0.396 3.785 1.00 0.00 H new ATOM 0 HA THR A 964 -7.689 0.630 2.211 1.00 0.00 H new ATOM 0 HB THR A 964 -7.527 0.712 5.243 1.00 0.00 H new ATOM 0 HG1 THR A 964 -9.136 -0.991 5.146 1.00 0.00 H new ATOM 0 HG21 THR A 964 -9.924 1.266 5.070 1.00 0.00 H new ATOM 0 HG22 THR A 964 -8.912 2.446 4.204 1.00 0.00 H new ATOM 0 HG23 THR A 964 -9.806 1.204 3.296 1.00 0.00 H new ATOM 1207 N ILE A 965 -6.506 2.812 2.201 1.00 0.00 N ATOM 1208 CA ILE A 965 -5.889 4.133 2.193 1.00 0.00 C ATOM 1209 C ILE A 965 -6.901 5.215 2.554 1.00 0.00 C ATOM 1210 O ILE A 965 -8.035 5.203 2.074 1.00 0.00 O ATOM 1211 CB ILE A 965 -5.275 4.458 0.819 1.00 0.00 C ATOM 1212 CG1 ILE A 965 -4.296 3.359 0.400 1.00 0.00 C ATOM 1213 CG2 ILE A 965 -4.577 5.810 0.857 1.00 0.00 C ATOM 1214 CD1 ILE A 965 -3.764 3.527 -1.006 1.00 0.00 C ATOM 0 H ILE A 965 -6.995 2.569 1.339 1.00 0.00 H new ATOM 0 HA ILE A 965 -5.097 4.116 2.942 1.00 0.00 H new ATOM 0 HB ILE A 965 -6.076 4.505 0.082 1.00 0.00 H new ATOM 0 HG12 ILE A 965 -3.458 3.345 1.097 1.00 0.00 H new ATOM 0 HG13 ILE A 965 -4.793 2.392 0.479 1.00 0.00 H new ATOM 0 HG21 ILE A 965 -4.148 6.026 -0.122 1.00 0.00 H new ATOM 0 HG22 ILE A 965 -5.299 6.585 1.116 1.00 0.00 H new ATOM 0 HG23 ILE A 965 -3.784 5.789 1.604 1.00 0.00 H new ATOM 0 HD11 ILE A 965 -3.076 2.713 -1.235 1.00 0.00 H new ATOM 0 HD12 ILE A 965 -4.593 3.511 -1.713 1.00 0.00 H new ATOM 0 HD13 ILE A 965 -3.238 4.479 -1.085 1.00 0.00 H new ATOM 1226 N ALA A 966 -6.483 6.150 3.400 1.00 0.00 N ATOM 1227 CA ALA A 966 -7.351 7.242 3.822 1.00 0.00 C ATOM 1228 C ALA A 966 -6.549 8.513 4.082 1.00 0.00 C ATOM 1229 O ALA A 966 -5.502 8.476 4.729 1.00 0.00 O ATOM 1230 CB ALA A 966 -8.132 6.845 5.066 1.00 0.00 C ATOM 0 H ALA A 966 -5.548 6.173 3.807 1.00 0.00 H new ATOM 0 HA ALA A 966 -8.054 7.446 3.015 1.00 0.00 H new ATOM 0 HB1 ALA A 966 -8.776 7.670 5.370 1.00 0.00 H new ATOM 0 HB2 ALA A 966 -8.743 5.969 4.848 1.00 0.00 H new ATOM 0 HB3 ALA A 966 -7.437 6.611 5.873 1.00 0.00 H new ATOM 1236 N LEU A 967 -7.046 9.635 3.575 1.00 0.00 N ATOM 1237 CA LEU A 967 -6.375 10.918 3.752 1.00 0.00 C ATOM 1238 C LEU A 967 -6.344 11.318 5.223 1.00 0.00 C ATOM 1239 O LEU A 967 -7.178 10.878 6.015 1.00 0.00 O ATOM 1240 CB LEU A 967 -7.078 12.001 2.932 1.00 0.00 C ATOM 1241 CG LEU A 967 -6.741 12.040 1.441 1.00 0.00 C ATOM 1242 CD1 LEU A 967 -7.559 13.112 0.737 1.00 0.00 C ATOM 1243 CD2 LEU A 967 -5.252 12.283 1.238 1.00 0.00 C ATOM 0 H LEU A 967 -7.912 9.683 3.038 1.00 0.00 H new ATOM 0 HA LEU A 967 -5.348 10.814 3.401 1.00 0.00 H new ATOM 0 HB2 LEU A 967 -8.155 11.866 3.037 1.00 0.00 H new ATOM 0 HB3 LEU A 967 -6.834 12.971 3.364 1.00 0.00 H new ATOM 0 HG LEU A 967 -6.994 11.074 1.005 1.00 0.00 H new ATOM 0 HD11 LEU A 967 -7.306 13.125 -0.323 1.00 0.00 H new ATOM 0 HD12 LEU A 967 -8.621 12.895 0.854 1.00 0.00 H new ATOM 0 HD13 LEU A 967 -7.337 14.085 1.175 1.00 0.00 H new ATOM 0 HD21 LEU A 967 -5.030 12.308 0.171 1.00 0.00 H new ATOM 0 HD22 LEU A 967 -4.974 13.236 1.689 1.00 0.00 H new ATOM 0 HD23 LEU A 967 -4.685 11.480 1.708 1.00 0.00 H new ATOM 1255 N LYS A 968 -5.377 12.155 5.583 1.00 0.00 N ATOM 1256 CA LYS A 968 -5.238 12.618 6.959 1.00 0.00 C ATOM 1257 C LYS A 968 -5.949 13.953 7.158 1.00 0.00 C ATOM 1258 O LYS A 968 -6.981 14.024 7.825 1.00 0.00 O ATOM 1259 CB LYS A 968 -3.759 12.756 7.325 1.00 0.00 C ATOM 1260 CG LYS A 968 -3.523 13.109 8.783 1.00 0.00 C ATOM 1261 CD LYS A 968 -3.641 11.887 9.679 1.00 0.00 C ATOM 1262 CE LYS A 968 -4.119 12.262 11.073 1.00 0.00 C ATOM 1263 NZ LYS A 968 -5.602 12.384 11.137 1.00 0.00 N ATOM 0 H LYS A 968 -4.677 12.527 4.941 1.00 0.00 H new ATOM 0 HA LYS A 968 -5.700 11.879 7.613 1.00 0.00 H new ATOM 0 HB2 LYS A 968 -3.249 11.820 7.100 1.00 0.00 H new ATOM 0 HB3 LYS A 968 -3.308 13.524 6.696 1.00 0.00 H new ATOM 0 HG2 LYS A 968 -2.532 13.550 8.896 1.00 0.00 H new ATOM 0 HG3 LYS A 968 -4.245 13.863 9.097 1.00 0.00 H new ATOM 0 HD2 LYS A 968 -4.336 11.174 9.234 1.00 0.00 H new ATOM 0 HD3 LYS A 968 -2.674 11.389 9.747 1.00 0.00 H new ATOM 0 HE2 LYS A 968 -3.786 11.508 11.786 1.00 0.00 H new ATOM 0 HE3 LYS A 968 -3.664 13.206 11.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 968 -5.888 12.641 12.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 968 -5.919 13.121 10.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 968 -6.037 11.476 10.877 1.00 0.00 H new