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 894 THR OG1 : rot 34:sc= 0.00576 USER MOD Set 1.2: A 940 THR OG1 : rot -170:sc= 0 USER MOD Single : A 898 SER OG : rot 180:sc= -0.0617 USER MOD Single : A 919 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 920 GLN : amide:sc= -0.878 K(o=-0.88,f=-2.4!) USER MOD Single : A 923 SER OG : rot 180:sc= 0 USER MOD Single : A 936 LYS NZ :NH3+ -151:sc= -1.96 (180deg=-3.39!) USER MOD Single : A 937 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 945 SER OG : rot 180:sc= -0.0594 USER MOD Single : A 946 SER OG : rot 180:sc= 0 USER MOD Single : A 949 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 952 SER OG : rot 77:sc= 0.704 USER MOD Single : A 954 ASN : amide:sc= -0.609 K(o=-0.61,f=-1.3) USER MOD Single : A 956 LYS NZ :NH3+ -171:sc=-0.00924 (180deg=-0.127) USER MOD Single : A 960 ASN : amide:sc= -5.11! C(o=-5.1!,f=-3.8!) USER MOD Single : A 962 THR OG1 : rot -19:sc= 1.25 USER MOD Single : A 964 THR OG1 : rot 180:sc= 0 USER MOD Single : A 968 LYS NZ :NH3+ 165:sc=-0.00236 (180deg=-0.123) USER MOD ----------------------------------------------------------------- ATOM 73 N THR A 894 0.439 13.660 3.759 1.00 0.00 N ATOM 74 CA THR A 894 0.444 12.459 4.583 1.00 0.00 C ATOM 75 C THR A 894 -0.835 11.653 4.389 1.00 0.00 C ATOM 76 O THR A 894 -1.938 12.160 4.593 1.00 0.00 O ATOM 77 CB THR A 894 0.598 12.803 6.077 1.00 0.00 C ATOM 78 OG1 THR A 894 1.897 13.354 6.321 1.00 0.00 O ATOM 79 CG2 THR A 894 0.395 11.567 6.941 1.00 0.00 C ATOM 0 HA THR A 894 1.298 11.862 4.265 1.00 0.00 H new ATOM 0 HB THR A 894 -0.163 13.538 6.338 1.00 0.00 H new ATOM 0 HG1 THR A 894 2.179 13.883 5.546 1.00 0.00 H new ATOM 0 HG21 THR A 894 0.509 11.835 7.991 1.00 0.00 H new ATOM 0 HG22 THR A 894 -0.605 11.167 6.775 1.00 0.00 H new ATOM 0 HG23 THR A 894 1.136 10.813 6.677 1.00 0.00 H new ATOM 87 N VAL A 895 -0.681 10.393 3.993 1.00 0.00 N ATOM 88 CA VAL A 895 -1.824 9.516 3.773 1.00 0.00 C ATOM 89 C VAL A 895 -1.796 8.326 4.725 1.00 0.00 C ATOM 90 O VAL A 895 -0.729 7.802 5.051 1.00 0.00 O ATOM 91 CB VAL A 895 -1.863 8.998 2.323 1.00 0.00 C ATOM 92 CG1 VAL A 895 -1.851 10.159 1.340 1.00 0.00 C ATOM 93 CG2 VAL A 895 -0.697 8.056 2.063 1.00 0.00 C ATOM 0 H VAL A 895 0.225 9.957 3.818 1.00 0.00 H new ATOM 0 HA VAL A 895 -2.718 10.109 3.964 1.00 0.00 H new ATOM 0 HB VAL A 895 -2.789 8.442 2.179 1.00 0.00 H new ATOM 0 HG11 VAL A 895 -1.879 9.773 0.321 1.00 0.00 H new ATOM 0 HG12 VAL A 895 -2.722 10.791 1.513 1.00 0.00 H new ATOM 0 HG13 VAL A 895 -0.943 10.746 1.481 1.00 0.00 H new ATOM 0 HG21 VAL A 895 -0.740 7.699 1.034 1.00 0.00 H new ATOM 0 HG22 VAL A 895 0.242 8.586 2.225 1.00 0.00 H new ATOM 0 HG23 VAL A 895 -0.756 7.207 2.744 1.00 0.00 H new ATOM 103 N LEU A 896 -2.974 7.902 5.169 1.00 0.00 N ATOM 104 CA LEU A 896 -3.085 6.771 6.085 1.00 0.00 C ATOM 105 C LEU A 896 -3.296 5.469 5.319 1.00 0.00 C ATOM 106 O LEU A 896 -4.065 5.419 4.359 1.00 0.00 O ATOM 107 CB LEU A 896 -4.239 6.994 7.064 1.00 0.00 C ATOM 108 CG LEU A 896 -3.942 7.907 8.254 1.00 0.00 C ATOM 109 CD1 LEU A 896 -3.281 9.195 7.788 1.00 0.00 C ATOM 110 CD2 LEU A 896 -5.219 8.209 9.026 1.00 0.00 C ATOM 0 H LEU A 896 -3.866 8.324 4.910 1.00 0.00 H new ATOM 0 HA LEU A 896 -2.153 6.694 6.644 1.00 0.00 H new ATOM 0 HB2 LEU A 896 -5.081 7.412 6.513 1.00 0.00 H new ATOM 0 HB3 LEU A 896 -4.557 6.024 7.446 1.00 0.00 H new ATOM 0 HG LEU A 896 -3.252 7.390 8.920 1.00 0.00 H new ATOM 0 HD11 LEU A 896 -3.077 9.832 8.649 1.00 0.00 H new ATOM 0 HD12 LEU A 896 -2.345 8.961 7.281 1.00 0.00 H new ATOM 0 HD13 LEU A 896 -3.946 9.717 7.100 1.00 0.00 H new ATOM 0 HD21 LEU A 896 -4.989 8.860 9.869 1.00 0.00 H new ATOM 0 HD22 LEU A 896 -5.933 8.705 8.369 1.00 0.00 H new ATOM 0 HD23 LEU A 896 -5.651 7.278 9.393 1.00 0.00 H new ATOM 122 N VAL A 897 -2.611 4.416 5.753 1.00 0.00 N ATOM 123 CA VAL A 897 -2.726 3.112 5.111 1.00 0.00 C ATOM 124 C VAL A 897 -2.742 1.990 6.143 1.00 0.00 C ATOM 125 O VAL A 897 -1.901 1.947 7.041 1.00 0.00 O ATOM 126 CB VAL A 897 -1.570 2.869 4.123 1.00 0.00 C ATOM 127 CG1 VAL A 897 -1.730 1.522 3.434 1.00 0.00 C ATOM 128 CG2 VAL A 897 -1.497 3.994 3.101 1.00 0.00 C ATOM 0 H VAL A 897 -1.971 4.440 6.547 1.00 0.00 H new ATOM 0 HA VAL A 897 -3.669 3.111 4.564 1.00 0.00 H new ATOM 0 HB VAL A 897 -0.634 2.855 4.682 1.00 0.00 H new ATOM 0 HG11 VAL A 897 -0.904 1.368 2.740 1.00 0.00 H new ATOM 0 HG12 VAL A 897 -1.729 0.729 4.181 1.00 0.00 H new ATOM 0 HG13 VAL A 897 -2.672 1.503 2.887 1.00 0.00 H new ATOM 0 HG21 VAL A 897 -0.675 3.806 2.411 1.00 0.00 H new ATOM 0 HG22 VAL A 897 -2.433 4.042 2.545 1.00 0.00 H new ATOM 0 HG23 VAL A 897 -1.331 4.941 3.614 1.00 0.00 H new ATOM 138 N SER A 898 -3.705 1.084 6.010 1.00 0.00 N ATOM 139 CA SER A 898 -3.833 -0.037 6.933 1.00 0.00 C ATOM 140 C SER A 898 -3.974 -1.353 6.174 1.00 0.00 C ATOM 141 O SER A 898 -4.398 -1.373 5.018 1.00 0.00 O ATOM 142 CB SER A 898 -5.039 0.167 7.852 1.00 0.00 C ATOM 143 OG SER A 898 -5.492 -1.067 8.381 1.00 0.00 O ATOM 0 H SER A 898 -4.408 1.104 5.272 1.00 0.00 H new ATOM 0 HA SER A 898 -2.928 -0.082 7.538 1.00 0.00 H new ATOM 0 HB2 SER A 898 -4.769 0.839 8.667 1.00 0.00 H new ATOM 0 HB3 SER A 898 -5.846 0.647 7.297 1.00 0.00 H new ATOM 0 HG SER A 898 -6.262 -0.909 8.966 1.00 0.00 H new ATOM 149 N ILE A 899 -3.616 -2.450 6.833 1.00 0.00 N ATOM 150 CA ILE A 899 -3.704 -3.770 6.222 1.00 0.00 C ATOM 151 C ILE A 899 -4.591 -4.699 7.043 1.00 0.00 C ATOM 152 O ILE A 899 -4.493 -4.746 8.270 1.00 0.00 O ATOM 153 CB ILE A 899 -2.312 -4.412 6.067 1.00 0.00 C ATOM 154 CG1 ILE A 899 -1.506 -4.252 7.357 1.00 0.00 C ATOM 155 CG2 ILE A 899 -1.571 -3.793 4.892 1.00 0.00 C ATOM 156 CD1 ILE A 899 -0.518 -5.372 7.596 1.00 0.00 C ATOM 0 H ILE A 899 -3.262 -2.450 7.790 1.00 0.00 H new ATOM 0 HA ILE A 899 -4.144 -3.631 5.234 1.00 0.00 H new ATOM 0 HB ILE A 899 -2.439 -5.477 5.870 1.00 0.00 H new ATOM 0 HG12 ILE A 899 -0.968 -3.305 7.324 1.00 0.00 H new ATOM 0 HG13 ILE A 899 -2.194 -4.199 8.201 1.00 0.00 H new ATOM 0 HG21 ILE A 899 -0.589 -4.257 4.796 1.00 0.00 H new ATOM 0 HG22 ILE A 899 -2.140 -3.955 3.977 1.00 0.00 H new ATOM 0 HG23 ILE A 899 -1.451 -2.723 5.060 1.00 0.00 H new ATOM 0 HD11 ILE A 899 0.018 -5.192 8.528 1.00 0.00 H new ATOM 0 HD12 ILE A 899 -1.052 -6.320 7.661 1.00 0.00 H new ATOM 0 HD13 ILE A 899 0.193 -5.412 6.771 1.00 0.00 H new ATOM 308 N PHE A 909 3.312 -3.884 9.175 1.00 0.00 N ATOM 309 CA PHE A 909 3.715 -3.953 7.775 1.00 0.00 C ATOM 310 C PHE A 909 5.087 -4.607 7.635 1.00 0.00 C ATOM 311 O PHE A 909 6.029 -4.256 8.345 1.00 0.00 O ATOM 312 CB PHE A 909 3.741 -2.552 7.160 1.00 0.00 C ATOM 313 CG PHE A 909 2.381 -1.926 7.039 1.00 0.00 C ATOM 314 CD1 PHE A 909 1.805 -1.274 8.117 1.00 0.00 C ATOM 315 CD2 PHE A 909 1.679 -1.989 5.846 1.00 0.00 C ATOM 316 CE1 PHE A 909 0.554 -0.696 8.009 1.00 0.00 C ATOM 317 CE2 PHE A 909 0.428 -1.413 5.732 1.00 0.00 C ATOM 318 CZ PHE A 909 -0.136 -0.766 6.815 1.00 0.00 C ATOM 0 HA PHE A 909 2.985 -4.563 7.243 1.00 0.00 H new ATOM 0 HB2 PHE A 909 4.376 -1.908 7.769 1.00 0.00 H new ATOM 0 HB3 PHE A 909 4.197 -2.606 6.171 1.00 0.00 H new ATOM 0 HD1 PHE A 909 2.340 -1.217 9.053 1.00 0.00 H new ATOM 0 HD2 PHE A 909 2.114 -2.494 4.996 1.00 0.00 H new ATOM 0 HE1 PHE A 909 0.117 -0.190 8.857 1.00 0.00 H new ATOM 0 HE2 PHE A 909 -0.109 -1.469 4.797 1.00 0.00 H new ATOM 0 HZ PHE A 909 -1.114 -0.316 6.728 1.00 0.00 H new ATOM 328 N ASP A 910 5.190 -5.560 6.716 1.00 0.00 N ATOM 329 CA ASP A 910 6.445 -6.264 6.482 1.00 0.00 C ATOM 330 C ASP A 910 7.190 -5.666 5.293 1.00 0.00 C ATOM 331 O ASP A 910 6.623 -4.901 4.513 1.00 0.00 O ATOM 332 CB ASP A 910 6.183 -7.751 6.239 1.00 0.00 C ATOM 333 CG ASP A 910 7.456 -8.524 5.953 1.00 0.00 C ATOM 334 OD1 ASP A 910 8.153 -8.897 6.920 1.00 0.00 O ATOM 335 OD2 ASP A 910 7.755 -8.756 4.763 1.00 0.00 O ATOM 0 H ASP A 910 4.419 -5.863 6.121 1.00 0.00 H new ATOM 0 HA ASP A 910 7.066 -6.153 7.371 1.00 0.00 H new ATOM 0 HB2 ASP A 910 5.691 -8.178 7.113 1.00 0.00 H new ATOM 0 HB3 ASP A 910 5.497 -7.864 5.400 1.00 0.00 H new ATOM 340 N ASP A 911 8.464 -6.018 5.162 1.00 0.00 N ATOM 341 CA ASP A 911 9.288 -5.516 4.068 1.00 0.00 C ATOM 342 C ASP A 911 8.568 -5.667 2.732 1.00 0.00 C ATOM 343 O ASP A 911 8.477 -4.717 1.954 1.00 0.00 O ATOM 344 CB ASP A 911 10.626 -6.256 4.027 1.00 0.00 C ATOM 345 CG ASP A 911 11.715 -5.446 3.353 1.00 0.00 C ATOM 346 OD1 ASP A 911 11.806 -4.231 3.627 1.00 0.00 O ATOM 347 OD2 ASP A 911 12.478 -6.026 2.552 1.00 0.00 O ATOM 0 H ASP A 911 8.949 -6.649 5.800 1.00 0.00 H new ATOM 0 HA ASP A 911 9.473 -4.456 4.243 1.00 0.00 H new ATOM 0 HB2 ASP A 911 10.935 -6.499 5.044 1.00 0.00 H new ATOM 0 HB3 ASP A 911 10.499 -7.200 3.498 1.00 0.00 H new ATOM 352 N ALA A 912 8.058 -6.866 2.472 1.00 0.00 N ATOM 353 CA ALA A 912 7.345 -7.141 1.231 1.00 0.00 C ATOM 354 C ALA A 912 6.169 -6.187 1.050 1.00 0.00 C ATOM 355 O ALA A 912 5.999 -5.589 -0.013 1.00 0.00 O ATOM 356 CB ALA A 912 6.864 -8.584 1.207 1.00 0.00 C ATOM 0 H ALA A 912 8.125 -7.663 3.105 1.00 0.00 H new ATOM 0 HA ALA A 912 8.036 -6.986 0.402 1.00 0.00 H new ATOM 0 HB1 ALA A 912 6.333 -8.775 0.274 1.00 0.00 H new ATOM 0 HB2 ALA A 912 7.720 -9.254 1.281 1.00 0.00 H new ATOM 0 HB3 ALA A 912 6.193 -8.758 2.048 1.00 0.00 H new ATOM 362 N LEU A 913 5.360 -6.049 2.094 1.00 0.00 N ATOM 363 CA LEU A 913 4.198 -5.167 2.051 1.00 0.00 C ATOM 364 C LEU A 913 4.610 -3.741 1.698 1.00 0.00 C ATOM 365 O LEU A 913 4.040 -3.125 0.797 1.00 0.00 O ATOM 366 CB LEU A 913 3.472 -5.182 3.397 1.00 0.00 C ATOM 367 CG LEU A 913 2.717 -6.467 3.738 1.00 0.00 C ATOM 368 CD1 LEU A 913 2.324 -6.481 5.207 1.00 0.00 C ATOM 369 CD2 LEU A 913 1.487 -6.615 2.854 1.00 0.00 C ATOM 0 H LEU A 913 5.487 -6.536 2.981 1.00 0.00 H new ATOM 0 HA LEU A 913 3.523 -5.533 1.277 1.00 0.00 H new ATOM 0 HB2 LEU A 913 4.203 -4.994 4.183 1.00 0.00 H new ATOM 0 HB3 LEU A 913 2.764 -4.353 3.415 1.00 0.00 H new ATOM 0 HG LEU A 913 3.378 -7.314 3.551 1.00 0.00 H new ATOM 0 HD11 LEU A 913 1.788 -7.403 5.431 1.00 0.00 H new ATOM 0 HD12 LEU A 913 3.221 -6.423 5.824 1.00 0.00 H new ATOM 0 HD13 LEU A 913 1.682 -5.627 5.420 1.00 0.00 H new ATOM 0 HD21 LEU A 913 0.963 -7.535 3.111 1.00 0.00 H new ATOM 0 HD22 LEU A 913 0.824 -5.764 3.008 1.00 0.00 H new ATOM 0 HD23 LEU A 913 1.793 -6.652 1.808 1.00 0.00 H new ATOM 381 N ILE A 914 5.604 -3.224 2.412 1.00 0.00 N ATOM 382 CA ILE A 914 6.094 -1.872 2.172 1.00 0.00 C ATOM 383 C ILE A 914 6.704 -1.748 0.780 1.00 0.00 C ATOM 384 O ILE A 914 6.204 -1.004 -0.064 1.00 0.00 O ATOM 385 CB ILE A 914 7.145 -1.460 3.219 1.00 0.00 C ATOM 386 CG1 ILE A 914 6.563 -1.574 4.630 1.00 0.00 C ATOM 387 CG2 ILE A 914 7.630 -0.042 2.953 1.00 0.00 C ATOM 388 CD1 ILE A 914 7.615 -1.616 5.716 1.00 0.00 C ATOM 0 H ILE A 914 6.086 -3.721 3.161 1.00 0.00 H new ATOM 0 HA ILE A 914 5.235 -1.206 2.251 1.00 0.00 H new ATOM 0 HB ILE A 914 7.997 -2.135 3.142 1.00 0.00 H new ATOM 0 HG12 ILE A 914 5.900 -0.728 4.810 1.00 0.00 H new ATOM 0 HG13 ILE A 914 5.953 -2.475 4.691 1.00 0.00 H new ATOM 0 HG21 ILE A 914 8.373 0.235 3.701 1.00 0.00 H new ATOM 0 HG22 ILE A 914 8.078 0.009 1.961 1.00 0.00 H new ATOM 0 HG23 ILE A 914 6.787 0.647 3.006 1.00 0.00 H new ATOM 0 HD11 ILE A 914 7.130 -1.697 6.689 1.00 0.00 H new ATOM 0 HD12 ILE A 914 8.264 -2.478 5.561 1.00 0.00 H new ATOM 0 HD13 ILE A 914 8.210 -0.703 5.682 1.00 0.00 H new ATOM 400 N ASP A 915 7.785 -2.483 0.546 1.00 0.00 N ATOM 401 CA ASP A 915 8.463 -2.458 -0.745 1.00 0.00 C ATOM 402 C ASP A 915 7.453 -2.466 -1.888 1.00 0.00 C ATOM 403 O ASP A 915 7.459 -1.577 -2.739 1.00 0.00 O ATOM 404 CB ASP A 915 9.407 -3.655 -0.873 1.00 0.00 C ATOM 405 CG ASP A 915 10.334 -3.535 -2.066 1.00 0.00 C ATOM 406 OD1 ASP A 915 10.966 -2.469 -2.223 1.00 0.00 O ATOM 407 OD2 ASP A 915 10.430 -4.508 -2.843 1.00 0.00 O ATOM 0 H ASP A 915 8.211 -3.104 1.234 1.00 0.00 H new ATOM 0 HA ASP A 915 9.046 -1.539 -0.805 1.00 0.00 H new ATOM 0 HB2 ASP A 915 10.000 -3.745 0.037 1.00 0.00 H new ATOM 0 HB3 ASP A 915 8.820 -4.569 -0.963 1.00 0.00 H new ATOM 412 N GLU A 916 6.589 -3.476 -1.902 1.00 0.00 N ATOM 413 CA GLU A 916 5.575 -3.600 -2.942 1.00 0.00 C ATOM 414 C GLU A 916 4.739 -2.327 -3.041 1.00 0.00 C ATOM 415 O GLU A 916 4.499 -1.811 -4.133 1.00 0.00 O ATOM 416 CB GLU A 916 4.668 -4.799 -2.661 1.00 0.00 C ATOM 417 CG GLU A 916 5.199 -6.109 -3.220 1.00 0.00 C ATOM 418 CD GLU A 916 5.243 -6.121 -4.736 1.00 0.00 C ATOM 419 OE1 GLU A 916 4.194 -5.858 -5.361 1.00 0.00 O ATOM 420 OE2 GLU A 916 6.324 -6.394 -5.297 1.00 0.00 O ATOM 0 H GLU A 916 6.571 -4.220 -1.205 1.00 0.00 H new ATOM 0 HA GLU A 916 6.084 -3.755 -3.893 1.00 0.00 H new ATOM 0 HB2 GLU A 916 4.537 -4.900 -1.584 1.00 0.00 H new ATOM 0 HB3 GLU A 916 3.683 -4.606 -3.085 1.00 0.00 H new ATOM 0 HG2 GLU A 916 6.201 -6.287 -2.830 1.00 0.00 H new ATOM 0 HG3 GLU A 916 4.571 -6.929 -2.872 1.00 0.00 H new ATOM 427 N LEU A 917 4.297 -1.827 -1.892 1.00 0.00 N ATOM 428 CA LEU A 917 3.486 -0.615 -1.848 1.00 0.00 C ATOM 429 C LEU A 917 4.182 0.533 -2.572 1.00 0.00 C ATOM 430 O LEU A 917 3.625 1.126 -3.497 1.00 0.00 O ATOM 431 CB LEU A 917 3.203 -0.221 -0.397 1.00 0.00 C ATOM 432 CG LEU A 917 2.114 -1.023 0.316 1.00 0.00 C ATOM 433 CD1 LEU A 917 2.251 -0.886 1.824 1.00 0.00 C ATOM 434 CD2 LEU A 917 0.734 -0.571 -0.139 1.00 0.00 C ATOM 0 H LEU A 917 4.486 -2.242 -0.979 1.00 0.00 H new ATOM 0 HA LEU A 917 2.542 -0.820 -2.354 1.00 0.00 H new ATOM 0 HB2 LEU A 917 4.128 -0.317 0.172 1.00 0.00 H new ATOM 0 HB3 LEU A 917 2.923 0.832 -0.375 1.00 0.00 H new ATOM 0 HG LEU A 917 2.234 -2.074 0.055 1.00 0.00 H new ATOM 0 HD11 LEU A 917 1.467 -1.464 2.314 1.00 0.00 H new ATOM 0 HD12 LEU A 917 3.226 -1.259 2.136 1.00 0.00 H new ATOM 0 HD13 LEU A 917 2.158 0.163 2.104 1.00 0.00 H new ATOM 0 HD21 LEU A 917 -0.029 -1.153 0.379 1.00 0.00 H new ATOM 0 HD22 LEU A 917 0.603 0.486 0.092 1.00 0.00 H new ATOM 0 HD23 LEU A 917 0.638 -0.722 -1.214 1.00 0.00 H new ATOM 446 N LEU A 918 5.403 0.839 -2.148 1.00 0.00 N ATOM 447 CA LEU A 918 6.177 1.915 -2.757 1.00 0.00 C ATOM 448 C LEU A 918 5.894 2.009 -4.253 1.00 0.00 C ATOM 449 O LEU A 918 5.420 3.035 -4.741 1.00 0.00 O ATOM 450 CB LEU A 918 7.672 1.691 -2.522 1.00 0.00 C ATOM 451 CG LEU A 918 8.104 1.518 -1.066 1.00 0.00 C ATOM 452 CD1 LEU A 918 9.591 1.211 -0.983 1.00 0.00 C ATOM 453 CD2 LEU A 918 7.769 2.765 -0.259 1.00 0.00 C ATOM 0 H LEU A 918 5.878 0.357 -1.385 1.00 0.00 H new ATOM 0 HA LEU A 918 5.879 2.854 -2.290 1.00 0.00 H new ATOM 0 HB2 LEU A 918 7.978 0.805 -3.079 1.00 0.00 H new ATOM 0 HB3 LEU A 918 8.216 2.536 -2.944 1.00 0.00 H new ATOM 0 HG LEU A 918 7.556 0.676 -0.642 1.00 0.00 H new ATOM 0 HD11 LEU A 918 9.880 1.091 0.061 1.00 0.00 H new ATOM 0 HD12 LEU A 918 9.803 0.290 -1.526 1.00 0.00 H new ATOM 0 HD13 LEU A 918 10.157 2.031 -1.424 1.00 0.00 H new ATOM 0 HD21 LEU A 918 8.083 2.624 0.775 1.00 0.00 H new ATOM 0 HD22 LEU A 918 8.290 3.624 -0.683 1.00 0.00 H new ATOM 0 HD23 LEU A 918 6.694 2.941 -0.291 1.00 0.00 H new ATOM 465 N GLN A 919 6.187 0.932 -4.974 1.00 0.00 N ATOM 466 CA GLN A 919 5.962 0.893 -6.415 1.00 0.00 C ATOM 467 C GLN A 919 4.530 1.294 -6.753 1.00 0.00 C ATOM 468 O GLN A 919 4.302 2.159 -7.598 1.00 0.00 O ATOM 469 CB GLN A 919 6.256 -0.505 -6.961 1.00 0.00 C ATOM 470 CG GLN A 919 7.724 -0.739 -7.276 1.00 0.00 C ATOM 471 CD GLN A 919 7.974 -2.084 -7.929 1.00 0.00 C ATOM 472 OE1 GLN A 919 7.809 -3.132 -7.303 1.00 0.00 O ATOM 473 NE2 GLN A 919 8.374 -2.063 -9.195 1.00 0.00 N ATOM 0 H GLN A 919 6.580 0.075 -4.585 1.00 0.00 H new ATOM 0 HA GLN A 919 6.640 1.607 -6.883 1.00 0.00 H new ATOM 0 HB2 GLN A 919 5.926 -1.247 -6.233 1.00 0.00 H new ATOM 0 HB3 GLN A 919 5.669 -0.663 -7.866 1.00 0.00 H new ATOM 0 HG2 GLN A 919 8.081 0.052 -7.935 1.00 0.00 H new ATOM 0 HG3 GLN A 919 8.304 -0.673 -6.356 1.00 0.00 H new ATOM 0 HE21 GLN A 919 8.498 -1.172 -9.676 1.00 0.00 H new ATOM 0 HE22 GLN A 919 8.557 -2.938 -9.687 1.00 0.00 H new ATOM 482 N GLN A 920 3.570 0.658 -6.089 1.00 0.00 N ATOM 483 CA GLN A 920 2.160 0.948 -6.321 1.00 0.00 C ATOM 484 C GLN A 920 1.884 2.443 -6.197 1.00 0.00 C ATOM 485 O GLN A 920 1.114 3.008 -6.973 1.00 0.00 O ATOM 486 CB GLN A 920 1.289 0.172 -5.332 1.00 0.00 C ATOM 487 CG GLN A 920 0.979 -1.248 -5.777 1.00 0.00 C ATOM 488 CD GLN A 920 -0.155 -1.311 -6.780 1.00 0.00 C ATOM 489 OE1 GLN A 920 -0.367 -0.378 -7.555 1.00 0.00 O ATOM 490 NE2 GLN A 920 -0.894 -2.415 -6.770 1.00 0.00 N ATOM 0 H GLN A 920 3.743 -0.061 -5.387 1.00 0.00 H new ATOM 0 HA GLN A 920 1.912 0.635 -7.335 1.00 0.00 H new ATOM 0 HB2 GLN A 920 1.792 0.139 -4.366 1.00 0.00 H new ATOM 0 HB3 GLN A 920 0.353 0.710 -5.185 1.00 0.00 H new ATOM 0 HG2 GLN A 920 1.873 -1.690 -6.217 1.00 0.00 H new ATOM 0 HG3 GLN A 920 0.722 -1.850 -4.905 1.00 0.00 H new ATOM 0 HE21 GLN A 920 -0.683 -3.164 -6.111 1.00 0.00 H new ATOM 0 HE22 GLN A 920 -1.672 -2.514 -7.422 1.00 0.00 H new ATOM 499 N PHE A 921 2.518 3.077 -5.217 1.00 0.00 N ATOM 500 CA PHE A 921 2.340 4.507 -4.990 1.00 0.00 C ATOM 501 C PHE A 921 2.916 5.317 -6.148 1.00 0.00 C ATOM 502 O PHE A 921 2.291 6.262 -6.629 1.00 0.00 O ATOM 503 CB PHE A 921 3.009 4.924 -3.679 1.00 0.00 C ATOM 504 CG PHE A 921 2.446 4.231 -2.471 1.00 0.00 C ATOM 505 CD1 PHE A 921 1.084 4.001 -2.361 1.00 0.00 C ATOM 506 CD2 PHE A 921 3.277 3.810 -1.446 1.00 0.00 C ATOM 507 CE1 PHE A 921 0.563 3.365 -1.251 1.00 0.00 C ATOM 508 CE2 PHE A 921 2.762 3.173 -0.333 1.00 0.00 C ATOM 509 CZ PHE A 921 1.403 2.949 -0.236 1.00 0.00 C ATOM 0 H PHE A 921 3.160 2.624 -4.567 1.00 0.00 H new ATOM 0 HA PHE A 921 1.271 4.709 -4.924 1.00 0.00 H new ATOM 0 HB2 PHE A 921 4.077 4.715 -3.743 1.00 0.00 H new ATOM 0 HB3 PHE A 921 2.902 6.001 -3.553 1.00 0.00 H new ATOM 0 HD1 PHE A 921 0.423 4.323 -3.152 1.00 0.00 H new ATOM 0 HD2 PHE A 921 4.341 3.982 -1.517 1.00 0.00 H new ATOM 0 HE1 PHE A 921 -0.501 3.193 -1.177 1.00 0.00 H new ATOM 0 HE2 PHE A 921 3.421 2.851 0.459 1.00 0.00 H new ATOM 0 HZ PHE A 921 0.997 2.450 0.632 1.00 0.00 H new ATOM 519 N ALA A 922 4.111 4.939 -6.590 1.00 0.00 N ATOM 520 CA ALA A 922 4.770 5.628 -7.692 1.00 0.00 C ATOM 521 C ALA A 922 3.836 5.769 -8.889 1.00 0.00 C ATOM 522 O ALA A 922 3.897 6.756 -9.623 1.00 0.00 O ATOM 523 CB ALA A 922 6.038 4.890 -8.094 1.00 0.00 C ATOM 0 H ALA A 922 4.642 4.160 -6.202 1.00 0.00 H new ATOM 0 HA ALA A 922 5.037 6.629 -7.353 1.00 0.00 H new ATOM 0 HB1 ALA A 922 6.519 5.416 -8.918 1.00 0.00 H new ATOM 0 HB2 ALA A 922 6.719 4.847 -7.244 1.00 0.00 H new ATOM 0 HB3 ALA A 922 5.785 3.877 -8.408 1.00 0.00 H new ATOM 529 N SER A 923 2.973 4.776 -9.081 1.00 0.00 N ATOM 530 CA SER A 923 2.030 4.788 -10.193 1.00 0.00 C ATOM 531 C SER A 923 1.428 6.177 -10.380 1.00 0.00 C ATOM 532 O SER A 923 1.154 6.602 -11.503 1.00 0.00 O ATOM 533 CB SER A 923 0.916 3.766 -9.954 1.00 0.00 C ATOM 534 OG SER A 923 0.150 3.563 -11.129 1.00 0.00 O ATOM 0 H SER A 923 2.908 3.954 -8.481 1.00 0.00 H new ATOM 0 HA SER A 923 2.572 4.521 -11.100 1.00 0.00 H new ATOM 0 HB2 SER A 923 1.350 2.820 -9.631 1.00 0.00 H new ATOM 0 HB3 SER A 923 0.268 4.111 -9.149 1.00 0.00 H new ATOM 0 HG SER A 923 -0.554 2.905 -10.951 1.00 0.00 H new ATOM 540 N PHE A 924 1.225 6.882 -9.272 1.00 0.00 N ATOM 541 CA PHE A 924 0.654 8.223 -9.312 1.00 0.00 C ATOM 542 C PHE A 924 1.618 9.242 -8.710 1.00 0.00 C ATOM 543 O PHE A 924 1.922 10.263 -9.324 1.00 0.00 O ATOM 544 CB PHE A 924 -0.677 8.257 -8.560 1.00 0.00 C ATOM 545 CG PHE A 924 -1.528 7.041 -8.791 1.00 0.00 C ATOM 546 CD1 PHE A 924 -1.157 5.811 -8.273 1.00 0.00 C ATOM 547 CD2 PHE A 924 -2.699 7.128 -9.527 1.00 0.00 C ATOM 548 CE1 PHE A 924 -1.937 4.690 -8.485 1.00 0.00 C ATOM 549 CE2 PHE A 924 -3.483 6.011 -9.743 1.00 0.00 C ATOM 550 CZ PHE A 924 -3.103 4.790 -9.220 1.00 0.00 C ATOM 0 H PHE A 924 1.448 6.547 -8.335 1.00 0.00 H new ATOM 0 HA PHE A 924 0.480 8.486 -10.355 1.00 0.00 H new ATOM 0 HB2 PHE A 924 -0.479 8.355 -7.493 1.00 0.00 H new ATOM 0 HB3 PHE A 924 -1.234 9.143 -8.864 1.00 0.00 H new ATOM 0 HD1 PHE A 924 -0.247 5.727 -7.697 1.00 0.00 H new ATOM 0 HD2 PHE A 924 -3.002 8.080 -9.937 1.00 0.00 H new ATOM 0 HE1 PHE A 924 -1.636 3.737 -8.077 1.00 0.00 H new ATOM 0 HE2 PHE A 924 -4.392 6.092 -10.320 1.00 0.00 H new ATOM 0 HZ PHE A 924 -3.716 3.916 -9.385 1.00 0.00 H new ATOM 560 N GLY A 925 2.094 8.955 -7.502 1.00 0.00 N ATOM 561 CA GLY A 925 3.017 9.856 -6.835 1.00 0.00 C ATOM 562 C GLY A 925 4.266 9.149 -6.349 1.00 0.00 C ATOM 563 O GLY A 925 4.200 8.015 -5.875 1.00 0.00 O ATOM 0 H GLY A 925 1.857 8.115 -6.973 1.00 0.00 H new ATOM 0 HA2 GLY A 925 3.299 10.655 -7.520 1.00 0.00 H new ATOM 0 HA3 GLY A 925 2.515 10.324 -5.988 1.00 0.00 H new ATOM 567 N GLU A 926 5.408 9.820 -6.467 1.00 0.00 N ATOM 568 CA GLU A 926 6.678 9.247 -6.037 1.00 0.00 C ATOM 569 C GLU A 926 6.910 9.493 -4.549 1.00 0.00 C ATOM 570 O GLU A 926 7.334 10.576 -4.146 1.00 0.00 O ATOM 571 CB GLU A 926 7.831 9.839 -6.849 1.00 0.00 C ATOM 572 CG GLU A 926 9.204 9.414 -6.356 1.00 0.00 C ATOM 573 CD GLU A 926 10.318 9.838 -7.294 1.00 0.00 C ATOM 574 OE1 GLU A 926 10.830 10.966 -7.137 1.00 0.00 O ATOM 575 OE2 GLU A 926 10.677 9.040 -8.185 1.00 0.00 O ATOM 0 H GLU A 926 5.479 10.760 -6.856 1.00 0.00 H new ATOM 0 HA GLU A 926 6.638 8.171 -6.208 1.00 0.00 H new ATOM 0 HB2 GLU A 926 7.720 9.541 -7.892 1.00 0.00 H new ATOM 0 HB3 GLU A 926 7.764 10.927 -6.819 1.00 0.00 H new ATOM 0 HG2 GLU A 926 9.381 9.844 -5.370 1.00 0.00 H new ATOM 0 HG3 GLU A 926 9.225 8.330 -6.240 1.00 0.00 H new ATOM 582 N VAL A 927 6.628 8.479 -3.736 1.00 0.00 N ATOM 583 CA VAL A 927 6.806 8.584 -2.293 1.00 0.00 C ATOM 584 C VAL A 927 8.202 9.090 -1.947 1.00 0.00 C ATOM 585 O VAL A 927 9.178 8.754 -2.618 1.00 0.00 O ATOM 586 CB VAL A 927 6.576 7.228 -1.599 1.00 0.00 C ATOM 587 CG1 VAL A 927 6.648 7.383 -0.087 1.00 0.00 C ATOM 588 CG2 VAL A 927 5.240 6.635 -2.019 1.00 0.00 C ATOM 0 H VAL A 927 6.275 7.576 -4.053 1.00 0.00 H new ATOM 0 HA VAL A 927 6.065 9.298 -1.933 1.00 0.00 H new ATOM 0 HB VAL A 927 7.365 6.543 -1.908 1.00 0.00 H new ATOM 0 HG11 VAL A 927 6.483 6.415 0.386 1.00 0.00 H new ATOM 0 HG12 VAL A 927 7.631 7.761 0.194 1.00 0.00 H new ATOM 0 HG13 VAL A 927 5.881 8.084 0.244 1.00 0.00 H new ATOM 0 HG21 VAL A 927 5.094 5.677 -1.519 1.00 0.00 H new ATOM 0 HG22 VAL A 927 4.436 7.316 -1.740 1.00 0.00 H new ATOM 0 HG23 VAL A 927 5.231 6.486 -3.099 1.00 0.00 H new ATOM 598 N ILE A 928 8.289 9.897 -0.895 1.00 0.00 N ATOM 599 CA ILE A 928 9.566 10.448 -0.459 1.00 0.00 C ATOM 600 C ILE A 928 9.888 10.023 0.970 1.00 0.00 C ATOM 601 O ILE A 928 11.014 9.626 1.272 1.00 0.00 O ATOM 602 CB ILE A 928 9.573 11.986 -0.539 1.00 0.00 C ATOM 603 CG1 ILE A 928 8.420 12.566 0.283 1.00 0.00 C ATOM 604 CG2 ILE A 928 9.480 12.441 -1.988 1.00 0.00 C ATOM 605 CD1 ILE A 928 8.333 14.075 0.219 1.00 0.00 C ATOM 0 H ILE A 928 7.490 10.184 -0.329 1.00 0.00 H new ATOM 0 HA ILE A 928 10.326 10.054 -1.133 1.00 0.00 H new ATOM 0 HB ILE A 928 10.511 12.353 -0.123 1.00 0.00 H new ATOM 0 HG12 ILE A 928 7.481 12.140 -0.072 1.00 0.00 H new ATOM 0 HG13 ILE A 928 8.536 12.260 1.323 1.00 0.00 H new ATOM 0 HG21 ILE A 928 9.486 13.530 -2.028 1.00 0.00 H new ATOM 0 HG22 ILE A 928 10.331 12.052 -2.547 1.00 0.00 H new ATOM 0 HG23 ILE A 928 8.556 12.067 -2.428 1.00 0.00 H new ATOM 0 HD11 ILE A 928 7.494 14.417 0.824 1.00 0.00 H new ATOM 0 HD12 ILE A 928 9.257 14.509 0.601 1.00 0.00 H new ATOM 0 HD13 ILE A 928 8.186 14.387 -0.815 1.00 0.00 H new ATOM 617 N LEU A 929 8.893 10.108 1.845 1.00 0.00 N ATOM 618 CA LEU A 929 9.069 9.730 3.243 1.00 0.00 C ATOM 619 C LEU A 929 7.892 8.893 3.734 1.00 0.00 C ATOM 620 O LEU A 929 6.754 9.094 3.307 1.00 0.00 O ATOM 621 CB LEU A 929 9.220 10.979 4.114 1.00 0.00 C ATOM 622 CG LEU A 929 9.064 10.769 5.621 1.00 0.00 C ATOM 623 CD1 LEU A 929 10.340 10.193 6.214 1.00 0.00 C ATOM 624 CD2 LEU A 929 8.698 12.077 6.306 1.00 0.00 C ATOM 0 H LEU A 929 7.956 10.435 1.612 1.00 0.00 H new ATOM 0 HA LEU A 929 9.975 9.129 3.320 1.00 0.00 H new ATOM 0 HB2 LEU A 929 10.203 11.411 3.927 1.00 0.00 H new ATOM 0 HB3 LEU A 929 8.482 11.714 3.791 1.00 0.00 H new ATOM 0 HG LEU A 929 8.256 10.056 5.788 1.00 0.00 H new ATOM 0 HD11 LEU A 929 10.211 10.050 7.287 1.00 0.00 H new ATOM 0 HD12 LEU A 929 10.559 9.234 5.744 1.00 0.00 H new ATOM 0 HD13 LEU A 929 11.167 10.881 6.037 1.00 0.00 H new ATOM 0 HD21 LEU A 929 8.591 11.909 7.378 1.00 0.00 H new ATOM 0 HD22 LEU A 929 9.484 12.812 6.131 1.00 0.00 H new ATOM 0 HD23 LEU A 929 7.757 12.449 5.901 1.00 0.00 H new ATOM 636 N ILE A 930 8.173 7.956 4.633 1.00 0.00 N ATOM 637 CA ILE A 930 7.136 7.092 5.184 1.00 0.00 C ATOM 638 C ILE A 930 7.200 7.059 6.707 1.00 0.00 C ATOM 639 O ILE A 930 8.280 6.979 7.292 1.00 0.00 O ATOM 640 CB ILE A 930 7.258 5.654 4.646 1.00 0.00 C ATOM 641 CG1 ILE A 930 7.181 5.650 3.117 1.00 0.00 C ATOM 642 CG2 ILE A 930 6.169 4.773 5.239 1.00 0.00 C ATOM 643 CD1 ILE A 930 7.696 4.374 2.490 1.00 0.00 C ATOM 0 H ILE A 930 9.109 7.776 4.995 1.00 0.00 H new ATOM 0 HA ILE A 930 6.179 7.509 4.872 1.00 0.00 H new ATOM 0 HB ILE A 930 8.226 5.251 4.943 1.00 0.00 H new ATOM 0 HG12 ILE A 930 6.145 5.803 2.813 1.00 0.00 H new ATOM 0 HG13 ILE A 930 7.754 6.493 2.730 1.00 0.00 H new ATOM 0 HG21 ILE A 930 6.268 3.760 4.849 1.00 0.00 H new ATOM 0 HG22 ILE A 930 6.266 4.755 6.325 1.00 0.00 H new ATOM 0 HG23 ILE A 930 5.191 5.172 4.969 1.00 0.00 H new ATOM 0 HD11 ILE A 930 7.611 4.442 1.405 1.00 0.00 H new ATOM 0 HD12 ILE A 930 8.741 4.230 2.764 1.00 0.00 H new ATOM 0 HD13 ILE A 930 7.107 3.529 2.848 1.00 0.00 H new ATOM 655 N ARG A 931 6.035 7.121 7.344 1.00 0.00 N ATOM 656 CA ARG A 931 5.958 7.097 8.800 1.00 0.00 C ATOM 657 C ARG A 931 5.023 5.990 9.277 1.00 0.00 C ATOM 658 O ARG A 931 3.848 5.954 8.911 1.00 0.00 O ATOM 659 CB ARG A 931 5.475 8.450 9.328 1.00 0.00 C ATOM 660 CG ARG A 931 5.722 8.646 10.814 1.00 0.00 C ATOM 661 CD ARG A 931 7.139 9.128 11.085 1.00 0.00 C ATOM 662 NE ARG A 931 8.066 8.017 11.284 1.00 0.00 N ATOM 663 CZ ARG A 931 8.131 7.305 12.404 1.00 0.00 C ATOM 664 NH1 ARG A 931 7.328 7.587 13.420 1.00 0.00 N ATOM 665 NH2 ARG A 931 9.001 6.309 12.508 1.00 0.00 N ATOM 0 H ARG A 931 5.132 7.188 6.875 1.00 0.00 H new ATOM 0 HA ARG A 931 6.957 6.898 9.189 1.00 0.00 H new ATOM 0 HB2 ARG A 931 5.976 9.246 8.777 1.00 0.00 H new ATOM 0 HB3 ARG A 931 4.408 8.548 9.129 1.00 0.00 H new ATOM 0 HG2 ARG A 931 5.009 9.369 11.210 1.00 0.00 H new ATOM 0 HG3 ARG A 931 5.549 7.707 11.340 1.00 0.00 H new ATOM 0 HD2 ARG A 931 7.480 9.739 10.250 1.00 0.00 H new ATOM 0 HD3 ARG A 931 7.142 9.766 11.969 1.00 0.00 H new ATOM 0 HE ARG A 931 8.698 7.774 10.521 1.00 0.00 H new ATOM 0 HH11 ARG A 931 6.658 8.352 13.343 1.00 0.00 H new ATOM 0 HH12 ARG A 931 7.380 7.039 14.279 1.00 0.00 H new ATOM 0 HH21 ARG A 931 9.620 6.089 11.728 1.00 0.00 H new ATOM 0 HH22 ARG A 931 9.050 5.763 13.368 1.00 0.00 H new ATOM 679 N PHE A 932 5.554 5.087 10.096 1.00 0.00 N ATOM 680 CA PHE A 932 4.768 3.977 10.622 1.00 0.00 C ATOM 681 C PHE A 932 4.070 4.373 11.921 1.00 0.00 C ATOM 682 O PHE A 932 4.713 4.802 12.879 1.00 0.00 O ATOM 683 CB PHE A 932 5.662 2.759 10.861 1.00 0.00 C ATOM 684 CG PHE A 932 6.480 2.372 9.662 1.00 0.00 C ATOM 685 CD1 PHE A 932 5.872 1.847 8.533 1.00 0.00 C ATOM 686 CD2 PHE A 932 7.856 2.531 9.665 1.00 0.00 C ATOM 687 CE1 PHE A 932 6.621 1.490 7.428 1.00 0.00 C ATOM 688 CE2 PHE A 932 8.610 2.176 8.563 1.00 0.00 C ATOM 689 CZ PHE A 932 7.992 1.654 7.443 1.00 0.00 C ATOM 0 H PHE A 932 6.525 5.103 10.409 1.00 0.00 H new ATOM 0 HA PHE A 932 4.007 3.721 9.884 1.00 0.00 H new ATOM 0 HB2 PHE A 932 6.331 2.968 11.696 1.00 0.00 H new ATOM 0 HB3 PHE A 932 5.040 1.914 11.155 1.00 0.00 H new ATOM 0 HD1 PHE A 932 4.800 1.715 8.516 1.00 0.00 H new ATOM 0 HD2 PHE A 932 8.345 2.937 10.538 1.00 0.00 H new ATOM 0 HE1 PHE A 932 6.135 1.083 6.554 1.00 0.00 H new ATOM 0 HE2 PHE A 932 9.682 2.306 8.577 1.00 0.00 H new ATOM 0 HZ PHE A 932 8.580 1.375 6.581 1.00 0.00 H new ATOM 699 N VAL A 933 2.749 4.225 11.945 1.00 0.00 N ATOM 700 CA VAL A 933 1.963 4.566 13.124 1.00 0.00 C ATOM 701 C VAL A 933 1.770 3.351 14.025 1.00 0.00 C ATOM 702 O VAL A 933 1.868 2.210 13.575 1.00 0.00 O ATOM 703 CB VAL A 933 0.583 5.127 12.736 1.00 0.00 C ATOM 704 CG1 VAL A 933 -0.111 5.726 13.950 1.00 0.00 C ATOM 705 CG2 VAL A 933 0.721 6.160 11.627 1.00 0.00 C ATOM 0 H VAL A 933 2.201 3.871 11.161 1.00 0.00 H new ATOM 0 HA VAL A 933 2.519 5.332 13.664 1.00 0.00 H new ATOM 0 HB VAL A 933 -0.032 4.307 12.364 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -1.085 6.117 13.656 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -0.244 4.956 14.710 1.00 0.00 H new ATOM 0 HG13 VAL A 933 0.498 6.534 14.355 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -0.264 6.546 11.365 1.00 0.00 H new ATOM 0 HG22 VAL A 933 1.353 6.979 11.970 1.00 0.00 H new ATOM 0 HG23 VAL A 933 1.173 5.695 10.751 1.00 0.00 H new ATOM 715 N GLU A 934 1.495 3.605 15.301 1.00 0.00 N ATOM 716 CA GLU A 934 1.289 2.532 16.266 1.00 0.00 C ATOM 717 C GLU A 934 0.679 1.305 15.593 1.00 0.00 C ATOM 718 O GLU A 934 1.231 0.207 15.663 1.00 0.00 O ATOM 719 CB GLU A 934 0.382 3.006 17.404 1.00 0.00 C ATOM 720 CG GLU A 934 0.943 4.187 18.177 1.00 0.00 C ATOM 721 CD GLU A 934 2.411 4.016 18.520 1.00 0.00 C ATOM 722 OE1 GLU A 934 2.710 3.315 19.509 1.00 0.00 O ATOM 723 OE2 GLU A 934 3.259 4.583 17.800 1.00 0.00 O ATOM 0 H GLU A 934 1.410 4.544 15.690 1.00 0.00 H new ATOM 0 HA GLU A 934 2.260 2.256 16.676 1.00 0.00 H new ATOM 0 HB2 GLU A 934 -0.590 3.280 16.993 1.00 0.00 H new ATOM 0 HB3 GLU A 934 0.215 2.178 18.093 1.00 0.00 H new ATOM 0 HG2 GLU A 934 0.815 5.096 17.589 1.00 0.00 H new ATOM 0 HG3 GLU A 934 0.372 4.319 19.096 1.00 0.00 H new ATOM 730 N ASP A 935 -0.462 1.501 14.942 1.00 0.00 N ATOM 731 CA ASP A 935 -1.147 0.412 14.256 1.00 0.00 C ATOM 732 C ASP A 935 -1.325 0.730 12.774 1.00 0.00 C ATOM 733 O ASP A 935 -1.426 -0.172 11.942 1.00 0.00 O ATOM 734 CB ASP A 935 -2.509 0.151 14.901 1.00 0.00 C ATOM 735 CG ASP A 935 -3.344 1.411 15.022 1.00 0.00 C ATOM 736 OD1 ASP A 935 -3.762 1.948 13.975 1.00 0.00 O ATOM 737 OD2 ASP A 935 -3.579 1.859 16.163 1.00 0.00 O ATOM 0 H ASP A 935 -0.932 2.404 14.875 1.00 0.00 H new ATOM 0 HA ASP A 935 -0.533 -0.484 14.346 1.00 0.00 H new ATOM 0 HB2 ASP A 935 -3.052 -0.586 14.310 1.00 0.00 H new ATOM 0 HB3 ASP A 935 -2.362 -0.280 15.891 1.00 0.00 H new ATOM 742 N LYS A 936 -1.363 2.018 12.451 1.00 0.00 N ATOM 743 CA LYS A 936 -1.529 2.456 11.070 1.00 0.00 C ATOM 744 C LYS A 936 -0.178 2.763 10.432 1.00 0.00 C ATOM 745 O LYS A 936 0.853 2.753 11.103 1.00 0.00 O ATOM 746 CB LYS A 936 -2.426 3.694 11.011 1.00 0.00 C ATOM 747 CG LYS A 936 -3.251 3.787 9.739 1.00 0.00 C ATOM 748 CD LYS A 936 -4.553 4.535 9.972 1.00 0.00 C ATOM 749 CE LYS A 936 -5.659 4.027 9.060 1.00 0.00 C ATOM 750 NZ LYS A 936 -5.133 3.608 7.731 1.00 0.00 N ATOM 0 H LYS A 936 -1.281 2.777 13.127 1.00 0.00 H new ATOM 0 HA LYS A 936 -2.000 1.647 10.512 1.00 0.00 H new ATOM 0 HB2 LYS A 936 -3.097 3.687 11.870 1.00 0.00 H new ATOM 0 HB3 LYS A 936 -1.806 4.586 11.098 1.00 0.00 H new ATOM 0 HG2 LYS A 936 -2.673 4.293 8.966 1.00 0.00 H new ATOM 0 HG3 LYS A 936 -3.467 2.784 9.370 1.00 0.00 H new ATOM 0 HD2 LYS A 936 -4.857 4.422 11.013 1.00 0.00 H new ATOM 0 HD3 LYS A 936 -4.398 5.600 9.799 1.00 0.00 H new ATOM 0 HE2 LYS A 936 -6.162 3.184 9.534 1.00 0.00 H new ATOM 0 HE3 LYS A 936 -6.406 4.809 8.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 936 -5.870 3.739 7.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 936 -4.303 4.186 7.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 936 -4.858 2.606 7.767 1.00 0.00 H new ATOM 764 N MET A 937 -0.192 3.038 9.132 1.00 0.00 N ATOM 765 CA MET A 937 1.032 3.351 8.404 1.00 0.00 C ATOM 766 C MET A 937 0.849 4.596 7.541 1.00 0.00 C ATOM 767 O MET A 937 0.187 4.551 6.504 1.00 0.00 O ATOM 768 CB MET A 937 1.448 2.167 7.529 1.00 0.00 C ATOM 769 CG MET A 937 2.572 2.493 6.559 1.00 0.00 C ATOM 770 SD MET A 937 3.293 1.019 5.811 1.00 0.00 S ATOM 771 CE MET A 937 3.666 1.622 4.166 1.00 0.00 C ATOM 0 H MET A 937 -1.037 3.050 8.561 1.00 0.00 H new ATOM 0 HA MET A 937 1.818 3.548 9.133 1.00 0.00 H new ATOM 0 HB2 MET A 937 1.761 1.344 8.171 1.00 0.00 H new ATOM 0 HB3 MET A 937 0.582 1.820 6.965 1.00 0.00 H new ATOM 0 HG2 MET A 937 2.191 3.145 5.773 1.00 0.00 H new ATOM 0 HG3 MET A 937 3.350 3.047 7.084 1.00 0.00 H new ATOM 0 HE1 MET A 937 4.119 0.823 3.579 1.00 0.00 H new ATOM 0 HE2 MET A 937 2.746 1.951 3.682 1.00 0.00 H new ATOM 0 HE3 MET A 937 4.360 2.460 4.234 1.00 0.00 H new ATOM 781 N TRP A 938 1.438 5.704 7.976 1.00 0.00 N ATOM 782 CA TRP A 938 1.339 6.961 7.243 1.00 0.00 C ATOM 783 C TRP A 938 2.405 7.043 6.156 1.00 0.00 C ATOM 784 O TRP A 938 3.536 6.596 6.348 1.00 0.00 O ATOM 785 CB TRP A 938 1.476 8.146 8.200 1.00 0.00 C ATOM 786 CG TRP A 938 0.346 8.252 9.180 1.00 0.00 C ATOM 787 CD1 TRP A 938 -0.712 7.398 9.306 1.00 0.00 C ATOM 788 CD2 TRP A 938 0.162 9.272 10.167 1.00 0.00 C ATOM 789 NE1 TRP A 938 -1.543 7.825 10.314 1.00 0.00 N ATOM 790 CE2 TRP A 938 -1.029 8.972 10.858 1.00 0.00 C ATOM 791 CE3 TRP A 938 0.887 10.407 10.537 1.00 0.00 C ATOM 792 CZ2 TRP A 938 -1.508 9.768 11.895 1.00 0.00 C ATOM 793 CZ3 TRP A 938 0.410 11.197 11.566 1.00 0.00 C ATOM 794 CH2 TRP A 938 -0.778 10.874 12.236 1.00 0.00 C ATOM 0 H TRP A 938 1.989 5.758 8.833 1.00 0.00 H new ATOM 0 HA TRP A 938 0.359 6.999 6.768 1.00 0.00 H new ATOM 0 HB2 TRP A 938 2.415 8.056 8.747 1.00 0.00 H new ATOM 0 HB3 TRP A 938 1.532 9.067 7.620 1.00 0.00 H new ATOM 0 HD1 TRP A 938 -0.872 6.517 8.702 1.00 0.00 H new ATOM 0 HE1 TRP A 938 -2.403 7.363 10.609 1.00 0.00 H new ATOM 0 HE3 TRP A 938 1.804 10.663 10.028 1.00 0.00 H new ATOM 0 HZ2 TRP A 938 -2.424 9.521 12.412 1.00 0.00 H new ATOM 0 HZ3 TRP A 938 0.962 12.078 11.859 1.00 0.00 H new ATOM 0 HH2 TRP A 938 -1.124 11.510 13.037 1.00 0.00 H new ATOM 805 N VAL A 939 2.038 7.617 5.015 1.00 0.00 N ATOM 806 CA VAL A 939 2.964 7.758 3.898 1.00 0.00 C ATOM 807 C VAL A 939 2.930 9.173 3.331 1.00 0.00 C ATOM 808 O VAL A 939 1.861 9.711 3.037 1.00 0.00 O ATOM 809 CB VAL A 939 2.643 6.758 2.772 1.00 0.00 C ATOM 810 CG1 VAL A 939 3.678 6.854 1.661 1.00 0.00 C ATOM 811 CG2 VAL A 939 2.569 5.342 3.322 1.00 0.00 C ATOM 0 H VAL A 939 1.106 7.992 4.840 1.00 0.00 H new ATOM 0 HA VAL A 939 3.961 7.549 4.286 1.00 0.00 H new ATOM 0 HB VAL A 939 1.670 7.011 2.352 1.00 0.00 H new ATOM 0 HG11 VAL A 939 3.435 6.140 0.874 1.00 0.00 H new ATOM 0 HG12 VAL A 939 3.676 7.863 1.248 1.00 0.00 H new ATOM 0 HG13 VAL A 939 4.666 6.628 2.063 1.00 0.00 H new ATOM 0 HG21 VAL A 939 2.341 4.649 2.512 1.00 0.00 H new ATOM 0 HG22 VAL A 939 3.526 5.075 3.770 1.00 0.00 H new ATOM 0 HG23 VAL A 939 1.786 5.286 4.079 1.00 0.00 H new ATOM 821 N THR A 940 4.106 9.773 3.180 1.00 0.00 N ATOM 822 CA THR A 940 4.212 11.126 2.649 1.00 0.00 C ATOM 823 C THR A 940 4.413 11.110 1.138 1.00 0.00 C ATOM 824 O THR A 940 4.928 10.140 0.581 1.00 0.00 O ATOM 825 CB THR A 940 5.374 11.898 3.302 1.00 0.00 C ATOM 826 OG1 THR A 940 5.086 12.139 4.684 1.00 0.00 O ATOM 827 CG2 THR A 940 5.614 13.220 2.590 1.00 0.00 C ATOM 0 H THR A 940 5.000 9.343 3.418 1.00 0.00 H new ATOM 0 HA THR A 940 3.274 11.630 2.883 1.00 0.00 H new ATOM 0 HB THR A 940 6.276 11.291 3.220 1.00 0.00 H new ATOM 0 HG1 THR A 940 5.748 12.761 5.052 1.00 0.00 H new ATOM 0 HG21 THR A 940 6.439 13.747 3.069 1.00 0.00 H new ATOM 0 HG22 THR A 940 5.862 13.031 1.546 1.00 0.00 H new ATOM 0 HG23 THR A 940 4.713 13.831 2.644 1.00 0.00 H new ATOM 835 N PHE A 941 4.006 12.190 0.479 1.00 0.00 N ATOM 836 CA PHE A 941 4.142 12.299 -0.968 1.00 0.00 C ATOM 837 C PHE A 941 4.703 13.663 -1.360 1.00 0.00 C ATOM 838 O PHE A 941 4.435 14.670 -0.702 1.00 0.00 O ATOM 839 CB PHE A 941 2.789 12.077 -1.647 1.00 0.00 C ATOM 840 CG PHE A 941 2.407 10.629 -1.764 1.00 0.00 C ATOM 841 CD1 PHE A 941 2.223 9.854 -0.631 1.00 0.00 C ATOM 842 CD2 PHE A 941 2.232 10.044 -3.008 1.00 0.00 C ATOM 843 CE1 PHE A 941 1.872 8.521 -0.735 1.00 0.00 C ATOM 844 CE2 PHE A 941 1.880 8.712 -3.118 1.00 0.00 C ATOM 845 CZ PHE A 941 1.701 7.949 -1.980 1.00 0.00 C ATOM 0 H PHE A 941 3.579 13.002 0.925 1.00 0.00 H new ATOM 0 HA PHE A 941 4.838 11.530 -1.302 1.00 0.00 H new ATOM 0 HB2 PHE A 941 2.018 12.603 -1.084 1.00 0.00 H new ATOM 0 HB3 PHE A 941 2.814 12.519 -2.643 1.00 0.00 H new ATOM 0 HD1 PHE A 941 2.355 10.296 0.345 1.00 0.00 H new ATOM 0 HD2 PHE A 941 2.372 10.635 -3.901 1.00 0.00 H new ATOM 0 HE1 PHE A 941 1.732 7.928 0.156 1.00 0.00 H new ATOM 0 HE2 PHE A 941 1.745 8.268 -4.093 1.00 0.00 H new ATOM 0 HZ PHE A 941 1.428 6.907 -2.064 1.00 0.00 H new ATOM 855 N LEU A 942 5.482 13.689 -2.436 1.00 0.00 N ATOM 856 CA LEU A 942 6.082 14.928 -2.917 1.00 0.00 C ATOM 857 C LEU A 942 5.125 16.102 -2.737 1.00 0.00 C ATOM 858 O LEU A 942 5.424 17.054 -2.018 1.00 0.00 O ATOM 859 CB LEU A 942 6.470 14.792 -4.390 1.00 0.00 C ATOM 860 CG LEU A 942 7.103 16.026 -5.034 1.00 0.00 C ATOM 861 CD1 LEU A 942 8.542 16.192 -4.568 1.00 0.00 C ATOM 862 CD2 LEU A 942 7.040 15.928 -6.551 1.00 0.00 C ATOM 0 H LEU A 942 5.713 12.866 -2.992 1.00 0.00 H new ATOM 0 HA LEU A 942 6.979 15.121 -2.328 1.00 0.00 H new ATOM 0 HB2 LEU A 942 7.166 13.959 -4.486 1.00 0.00 H new ATOM 0 HB3 LEU A 942 5.577 14.528 -4.957 1.00 0.00 H new ATOM 0 HG LEU A 942 6.538 16.905 -4.723 1.00 0.00 H new ATOM 0 HD11 LEU A 942 8.977 17.075 -5.036 1.00 0.00 H new ATOM 0 HD12 LEU A 942 8.562 16.309 -3.484 1.00 0.00 H new ATOM 0 HD13 LEU A 942 9.119 15.311 -4.849 1.00 0.00 H new ATOM 0 HD21 LEU A 942 7.495 16.815 -6.992 1.00 0.00 H new ATOM 0 HD22 LEU A 942 7.580 15.041 -6.881 1.00 0.00 H new ATOM 0 HD23 LEU A 942 6.000 15.858 -6.868 1.00 0.00 H new ATOM 874 N GLU A 943 3.972 16.025 -3.395 1.00 0.00 N ATOM 875 CA GLU A 943 2.970 17.081 -3.306 1.00 0.00 C ATOM 876 C GLU A 943 1.619 16.515 -2.878 1.00 0.00 C ATOM 877 O GLU A 943 1.322 15.345 -3.113 1.00 0.00 O ATOM 878 CB GLU A 943 2.832 17.798 -4.651 1.00 0.00 C ATOM 879 CG GLU A 943 4.064 18.596 -5.044 1.00 0.00 C ATOM 880 CD GLU A 943 3.737 19.764 -5.953 1.00 0.00 C ATOM 881 OE1 GLU A 943 2.801 20.524 -5.627 1.00 0.00 O ATOM 882 OE2 GLU A 943 4.416 19.919 -6.989 1.00 0.00 O ATOM 0 H GLU A 943 3.709 15.243 -3.995 1.00 0.00 H new ATOM 0 HA GLU A 943 3.300 17.797 -2.553 1.00 0.00 H new ATOM 0 HB2 GLU A 943 2.624 17.061 -5.427 1.00 0.00 H new ATOM 0 HB3 GLU A 943 1.973 18.468 -4.610 1.00 0.00 H new ATOM 0 HG2 GLU A 943 4.554 18.967 -4.144 1.00 0.00 H new ATOM 0 HG3 GLU A 943 4.774 17.938 -5.545 1.00 0.00 H new ATOM 889 N GLY A 944 0.804 17.356 -2.248 1.00 0.00 N ATOM 890 CA GLY A 944 -0.505 16.922 -1.797 1.00 0.00 C ATOM 891 C GLY A 944 -1.296 16.233 -2.890 1.00 0.00 C ATOM 892 O GLY A 944 -1.813 15.133 -2.693 1.00 0.00 O ATOM 0 H GLY A 944 1.027 18.330 -2.042 1.00 0.00 H new ATOM 0 HA2 GLY A 944 -0.388 16.242 -0.954 1.00 0.00 H new ATOM 0 HA3 GLY A 944 -1.066 17.784 -1.436 1.00 0.00 H new ATOM 896 N SER A 945 -1.393 16.880 -4.047 1.00 0.00 N ATOM 897 CA SER A 945 -2.132 16.325 -5.175 1.00 0.00 C ATOM 898 C SER A 945 -1.766 14.861 -5.396 1.00 0.00 C ATOM 899 O SER A 945 -2.633 14.023 -5.642 1.00 0.00 O ATOM 900 CB SER A 945 -1.848 17.131 -6.444 1.00 0.00 C ATOM 901 OG SER A 945 -0.516 16.935 -6.885 1.00 0.00 O ATOM 0 H SER A 945 -0.969 17.790 -4.228 1.00 0.00 H new ATOM 0 HA SER A 945 -3.196 16.385 -4.946 1.00 0.00 H new ATOM 0 HB2 SER A 945 -2.542 16.834 -7.230 1.00 0.00 H new ATOM 0 HB3 SER A 945 -2.019 18.190 -6.252 1.00 0.00 H new ATOM 0 HG SER A 945 -0.360 17.459 -7.698 1.00 0.00 H new ATOM 907 N SER A 946 -0.474 14.560 -5.307 1.00 0.00 N ATOM 908 CA SER A 946 0.009 13.198 -5.501 1.00 0.00 C ATOM 909 C SER A 946 -0.681 12.235 -4.540 1.00 0.00 C ATOM 910 O SER A 946 -0.879 11.062 -4.855 1.00 0.00 O ATOM 911 CB SER A 946 1.525 13.138 -5.300 1.00 0.00 C ATOM 912 OG SER A 946 2.180 14.133 -6.067 1.00 0.00 O ATOM 0 H SER A 946 0.257 15.241 -5.102 1.00 0.00 H new ATOM 0 HA SER A 946 -0.227 12.897 -6.522 1.00 0.00 H new ATOM 0 HB2 SER A 946 1.761 13.274 -4.245 1.00 0.00 H new ATOM 0 HB3 SER A 946 1.894 12.153 -5.585 1.00 0.00 H new ATOM 0 HG SER A 946 3.147 14.075 -5.920 1.00 0.00 H new ATOM 918 N ALA A 947 -1.045 12.740 -3.366 1.00 0.00 N ATOM 919 CA ALA A 947 -1.715 11.926 -2.359 1.00 0.00 C ATOM 920 C ALA A 947 -3.211 11.831 -2.636 1.00 0.00 C ATOM 921 O ALA A 947 -3.899 10.961 -2.100 1.00 0.00 O ATOM 922 CB ALA A 947 -1.469 12.497 -0.970 1.00 0.00 C ATOM 0 H ALA A 947 -0.887 13.709 -3.089 1.00 0.00 H new ATOM 0 HA ALA A 947 -1.299 10.920 -2.406 1.00 0.00 H new ATOM 0 HB1 ALA A 947 -1.975 11.879 -0.228 1.00 0.00 H new ATOM 0 HB2 ALA A 947 -0.399 12.507 -0.765 1.00 0.00 H new ATOM 0 HB3 ALA A 947 -1.857 13.514 -0.921 1.00 0.00 H new ATOM 928 N LEU A 948 -3.711 12.730 -3.477 1.00 0.00 N ATOM 929 CA LEU A 948 -5.127 12.748 -3.826 1.00 0.00 C ATOM 930 C LEU A 948 -5.426 11.751 -4.940 1.00 0.00 C ATOM 931 O LEU A 948 -6.558 11.292 -5.088 1.00 0.00 O ATOM 932 CB LEU A 948 -5.548 14.154 -4.257 1.00 0.00 C ATOM 933 CG LEU A 948 -5.103 15.298 -3.346 1.00 0.00 C ATOM 934 CD1 LEU A 948 -5.430 16.642 -3.977 1.00 0.00 C ATOM 935 CD2 LEU A 948 -5.757 15.176 -1.978 1.00 0.00 C ATOM 0 H LEU A 948 -3.156 13.456 -3.930 1.00 0.00 H new ATOM 0 HA LEU A 948 -5.697 12.459 -2.943 1.00 0.00 H new ATOM 0 HB2 LEU A 948 -5.155 14.339 -5.257 1.00 0.00 H new ATOM 0 HB3 LEU A 948 -6.635 14.179 -4.333 1.00 0.00 H new ATOM 0 HG LEU A 948 -4.023 15.234 -3.217 1.00 0.00 H new ATOM 0 HD11 LEU A 948 -5.106 17.444 -3.314 1.00 0.00 H new ATOM 0 HD12 LEU A 948 -4.914 16.731 -4.933 1.00 0.00 H new ATOM 0 HD13 LEU A 948 -6.506 16.717 -4.138 1.00 0.00 H new ATOM 0 HD21 LEU A 948 -5.429 15.999 -1.343 1.00 0.00 H new ATOM 0 HD22 LEU A 948 -6.841 15.213 -2.088 1.00 0.00 H new ATOM 0 HD23 LEU A 948 -5.471 14.229 -1.521 1.00 0.00 H new ATOM 947 N ASN A 949 -4.403 11.418 -5.720 1.00 0.00 N ATOM 948 CA ASN A 949 -4.556 10.473 -6.820 1.00 0.00 C ATOM 949 C ASN A 949 -4.333 9.041 -6.343 1.00 0.00 C ATOM 950 O ASN A 949 -5.111 8.141 -6.660 1.00 0.00 O ATOM 951 CB ASN A 949 -3.574 10.806 -7.946 1.00 0.00 C ATOM 952 CG ASN A 949 -4.160 11.773 -8.956 1.00 0.00 C ATOM 953 OD1 ASN A 949 -5.236 11.538 -9.506 1.00 0.00 O ATOM 954 ND2 ASN A 949 -3.452 12.869 -9.206 1.00 0.00 N ATOM 0 H ASN A 949 -3.459 11.789 -5.611 1.00 0.00 H new ATOM 0 HA ASN A 949 -5.575 10.556 -7.198 1.00 0.00 H new ATOM 0 HB2 ASN A 949 -2.668 11.236 -7.519 1.00 0.00 H new ATOM 0 HB3 ASN A 949 -3.282 9.887 -8.454 1.00 0.00 H new ATOM 0 HD21 ASN A 949 -3.796 13.556 -9.877 1.00 0.00 H new ATOM 0 HD22 ASN A 949 -2.565 13.023 -8.727 1.00 0.00 H new ATOM 961 N VAL A 950 -3.266 8.838 -5.577 1.00 0.00 N ATOM 962 CA VAL A 950 -2.941 7.517 -5.053 1.00 0.00 C ATOM 963 C VAL A 950 -4.143 6.891 -4.356 1.00 0.00 C ATOM 964 O VAL A 950 -4.224 5.671 -4.208 1.00 0.00 O ATOM 965 CB VAL A 950 -1.762 7.579 -4.064 1.00 0.00 C ATOM 966 CG1 VAL A 950 -2.177 8.285 -2.782 1.00 0.00 C ATOM 967 CG2 VAL A 950 -1.241 6.181 -3.768 1.00 0.00 C ATOM 0 H VAL A 950 -2.612 9.572 -5.305 1.00 0.00 H new ATOM 0 HA VAL A 950 -2.657 6.900 -5.906 1.00 0.00 H new ATOM 0 HB VAL A 950 -0.956 8.153 -4.522 1.00 0.00 H new ATOM 0 HG11 VAL A 950 -1.331 8.319 -2.095 1.00 0.00 H new ATOM 0 HG12 VAL A 950 -2.498 9.301 -3.013 1.00 0.00 H new ATOM 0 HG13 VAL A 950 -3.000 7.742 -2.317 1.00 0.00 H new ATOM 0 HG21 VAL A 950 -0.408 6.244 -3.068 1.00 0.00 H new ATOM 0 HG22 VAL A 950 -2.039 5.581 -3.331 1.00 0.00 H new ATOM 0 HG23 VAL A 950 -0.902 5.715 -4.694 1.00 0.00 H new ATOM 977 N LEU A 951 -5.076 7.734 -3.928 1.00 0.00 N ATOM 978 CA LEU A 951 -6.277 7.264 -3.245 1.00 0.00 C ATOM 979 C LEU A 951 -6.953 6.150 -4.037 1.00 0.00 C ATOM 980 O LEU A 951 -7.672 5.324 -3.476 1.00 0.00 O ATOM 981 CB LEU A 951 -7.254 8.422 -3.035 1.00 0.00 C ATOM 982 CG LEU A 951 -6.929 9.375 -1.884 1.00 0.00 C ATOM 983 CD1 LEU A 951 -7.811 10.612 -1.949 1.00 0.00 C ATOM 984 CD2 LEU A 951 -7.093 8.670 -0.545 1.00 0.00 C ATOM 0 H LEU A 951 -5.024 8.746 -4.042 1.00 0.00 H new ATOM 0 HA LEU A 951 -5.981 6.866 -2.274 1.00 0.00 H new ATOM 0 HB2 LEU A 951 -7.303 9.001 -3.957 1.00 0.00 H new ATOM 0 HB3 LEU A 951 -8.248 8.007 -2.867 1.00 0.00 H new ATOM 0 HG LEU A 951 -5.890 9.690 -1.981 1.00 0.00 H new ATOM 0 HD11 LEU A 951 -7.565 11.278 -1.122 1.00 0.00 H new ATOM 0 HD12 LEU A 951 -7.643 11.129 -2.894 1.00 0.00 H new ATOM 0 HD13 LEU A 951 -8.858 10.317 -1.878 1.00 0.00 H new ATOM 0 HD21 LEU A 951 -6.858 9.363 0.262 1.00 0.00 H new ATOM 0 HD22 LEU A 951 -8.122 8.325 -0.439 1.00 0.00 H new ATOM 0 HD23 LEU A 951 -6.417 7.816 -0.498 1.00 0.00 H new ATOM 996 N SER A 952 -6.716 6.133 -5.345 1.00 0.00 N ATOM 997 CA SER A 952 -7.303 5.121 -6.215 1.00 0.00 C ATOM 998 C SER A 952 -6.965 3.718 -5.723 1.00 0.00 C ATOM 999 O SER A 952 -7.583 2.736 -6.135 1.00 0.00 O ATOM 1000 CB SER A 952 -6.808 5.303 -7.651 1.00 0.00 C ATOM 1001 OG SER A 952 -7.084 6.610 -8.124 1.00 0.00 O ATOM 0 H SER A 952 -6.122 6.809 -5.825 1.00 0.00 H new ATOM 0 HA SER A 952 -8.386 5.243 -6.193 1.00 0.00 H new ATOM 0 HB2 SER A 952 -5.735 5.116 -7.696 1.00 0.00 H new ATOM 0 HB3 SER A 952 -7.287 4.569 -8.300 1.00 0.00 H new ATOM 0 HG SER A 952 -6.443 7.241 -7.735 1.00 0.00 H new ATOM 1007 N LEU A 953 -5.978 3.631 -4.837 1.00 0.00 N ATOM 1008 CA LEU A 953 -5.555 2.348 -4.286 1.00 0.00 C ATOM 1009 C LEU A 953 -6.310 2.033 -2.999 1.00 0.00 C ATOM 1010 O LEU A 953 -5.897 1.173 -2.221 1.00 0.00 O ATOM 1011 CB LEU A 953 -4.049 2.356 -4.020 1.00 0.00 C ATOM 1012 CG LEU A 953 -3.148 2.283 -5.253 1.00 0.00 C ATOM 1013 CD1 LEU A 953 -1.747 2.770 -4.920 1.00 0.00 C ATOM 1014 CD2 LEU A 953 -3.107 0.863 -5.799 1.00 0.00 C ATOM 0 H LEU A 953 -5.456 4.434 -4.485 1.00 0.00 H new ATOM 0 HA LEU A 953 -5.783 1.573 -5.018 1.00 0.00 H new ATOM 0 HB2 LEU A 953 -3.803 3.263 -3.468 1.00 0.00 H new ATOM 0 HB3 LEU A 953 -3.811 1.514 -3.371 1.00 0.00 H new ATOM 0 HG LEU A 953 -3.562 2.935 -6.022 1.00 0.00 H new ATOM 0 HD11 LEU A 953 -1.120 2.711 -5.810 1.00 0.00 H new ATOM 0 HD12 LEU A 953 -1.793 3.804 -4.577 1.00 0.00 H new ATOM 0 HD13 LEU A 953 -1.322 2.145 -4.134 1.00 0.00 H new ATOM 0 HD21 LEU A 953 -2.461 0.829 -6.676 1.00 0.00 H new ATOM 0 HD22 LEU A 953 -2.717 0.191 -5.035 1.00 0.00 H new ATOM 0 HD23 LEU A 953 -4.114 0.551 -6.077 1.00 0.00 H new ATOM 1026 N ASN A 954 -7.418 2.734 -2.782 1.00 0.00 N ATOM 1027 CA ASN A 954 -8.231 2.527 -1.589 1.00 0.00 C ATOM 1028 C ASN A 954 -8.921 1.167 -1.629 1.00 0.00 C ATOM 1029 O ASN A 954 -9.689 0.876 -2.545 1.00 0.00 O ATOM 1030 CB ASN A 954 -9.275 3.638 -1.460 1.00 0.00 C ATOM 1031 CG ASN A 954 -10.407 3.487 -2.458 1.00 0.00 C ATOM 1032 OD1 ASN A 954 -10.210 3.639 -3.664 1.00 0.00 O ATOM 1033 ND2 ASN A 954 -11.600 3.185 -1.959 1.00 0.00 N ATOM 0 H ASN A 954 -7.773 3.450 -3.416 1.00 0.00 H new ATOM 0 HA ASN A 954 -7.572 2.554 -0.721 1.00 0.00 H new ATOM 0 HB2 ASN A 954 -9.683 3.634 -0.449 1.00 0.00 H new ATOM 0 HB3 ASN A 954 -8.793 4.605 -1.605 1.00 0.00 H new ATOM 0 HD21 ASN A 954 -12.399 3.070 -2.582 1.00 0.00 H new ATOM 0 HD22 ASN A 954 -11.717 3.068 -0.952 1.00 0.00 H new ATOM 1040 N GLY A 955 -8.642 0.338 -0.628 1.00 0.00 N ATOM 1041 CA GLY A 955 -9.245 -0.981 -0.568 1.00 0.00 C ATOM 1042 C GLY A 955 -8.468 -2.010 -1.366 1.00 0.00 C ATOM 1043 O GLY A 955 -8.504 -3.201 -1.059 1.00 0.00 O ATOM 0 H GLY A 955 -8.010 0.556 0.142 1.00 0.00 H new ATOM 0 HA2 GLY A 955 -9.306 -1.302 0.472 1.00 0.00 H new ATOM 0 HA3 GLY A 955 -10.266 -0.928 -0.946 1.00 0.00 H new ATOM 1047 N LYS A 956 -7.766 -1.550 -2.395 1.00 0.00 N ATOM 1048 CA LYS A 956 -6.977 -2.438 -3.242 1.00 0.00 C ATOM 1049 C LYS A 956 -6.308 -3.529 -2.412 1.00 0.00 C ATOM 1050 O LYS A 956 -5.624 -3.242 -1.430 1.00 0.00 O ATOM 1051 CB LYS A 956 -5.917 -1.640 -4.004 1.00 0.00 C ATOM 1052 CG LYS A 956 -5.474 -2.300 -5.299 1.00 0.00 C ATOM 1053 CD LYS A 956 -4.330 -3.272 -5.067 1.00 0.00 C ATOM 1054 CE LYS A 956 -3.795 -3.827 -6.379 1.00 0.00 C ATOM 1055 NZ LYS A 956 -4.850 -4.543 -7.148 1.00 0.00 N ATOM 0 H LYS A 956 -7.727 -0.567 -2.663 1.00 0.00 H new ATOM 0 HA LYS A 956 -7.650 -2.911 -3.957 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -6.311 -0.649 -4.227 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -5.048 -1.500 -3.361 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -6.316 -2.828 -5.746 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -5.164 -1.535 -6.011 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -3.527 -2.768 -4.529 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -4.671 -4.093 -4.436 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -3.395 -3.012 -6.982 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -2.968 -4.508 -6.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -4.417 -5.035 -7.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -5.319 -5.237 -6.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -5.552 -3.858 -7.495 1.00 0.00 H new ATOM 1069 N GLU A 957 -6.510 -4.780 -2.814 1.00 0.00 N ATOM 1070 CA GLU A 957 -5.925 -5.913 -2.106 1.00 0.00 C ATOM 1071 C GLU A 957 -4.612 -6.340 -2.755 1.00 0.00 C ATOM 1072 O GLU A 957 -4.559 -6.614 -3.954 1.00 0.00 O ATOM 1073 CB GLU A 957 -6.903 -7.089 -2.085 1.00 0.00 C ATOM 1074 CG GLU A 957 -6.281 -8.390 -1.605 1.00 0.00 C ATOM 1075 CD GLU A 957 -7.281 -9.293 -0.910 1.00 0.00 C ATOM 1076 OE1 GLU A 957 -7.640 -8.998 0.249 1.00 0.00 O ATOM 1077 OE2 GLU A 957 -7.703 -10.295 -1.525 1.00 0.00 O ATOM 0 H GLU A 957 -7.074 -5.034 -3.625 1.00 0.00 H new ATOM 0 HA GLU A 957 -5.720 -5.603 -1.082 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -7.745 -6.839 -1.440 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -7.303 -7.236 -3.088 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -5.850 -8.918 -2.456 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -5.462 -8.166 -0.921 1.00 0.00 H new ATOM 1084 N LEU A 958 -3.554 -6.394 -1.954 1.00 0.00 N ATOM 1085 CA LEU A 958 -2.239 -6.788 -2.448 1.00 0.00 C ATOM 1086 C LEU A 958 -1.579 -7.788 -1.505 1.00 0.00 C ATOM 1087 O LEU A 958 -1.864 -7.809 -0.307 1.00 0.00 O ATOM 1088 CB LEU A 958 -1.345 -5.557 -2.612 1.00 0.00 C ATOM 1089 CG LEU A 958 -0.142 -5.721 -3.541 1.00 0.00 C ATOM 1090 CD1 LEU A 958 -0.600 -5.950 -4.973 1.00 0.00 C ATOM 1091 CD2 LEU A 958 0.766 -4.502 -3.459 1.00 0.00 C ATOM 0 H LEU A 958 -3.581 -6.170 -0.959 1.00 0.00 H new ATOM 0 HA LEU A 958 -2.371 -7.266 -3.419 1.00 0.00 H new ATOM 0 HB2 LEU A 958 -1.957 -4.735 -2.984 1.00 0.00 H new ATOM 0 HB3 LEU A 958 -0.981 -5.263 -1.627 1.00 0.00 H new ATOM 0 HG LEU A 958 0.425 -6.594 -3.218 1.00 0.00 H new ATOM 0 HD11 LEU A 958 0.270 -6.064 -5.619 1.00 0.00 H new ATOM 0 HD12 LEU A 958 -1.209 -6.853 -5.020 1.00 0.00 H new ATOM 0 HD13 LEU A 958 -1.190 -5.097 -5.307 1.00 0.00 H new ATOM 0 HD21 LEU A 958 1.617 -4.637 -4.127 1.00 0.00 H new ATOM 0 HD22 LEU A 958 0.209 -3.613 -3.755 1.00 0.00 H new ATOM 0 HD23 LEU A 958 1.123 -4.382 -2.436 1.00 0.00 H new ATOM 1103 N LEU A 959 -0.695 -8.615 -2.052 1.00 0.00 N ATOM 1104 CA LEU A 959 0.008 -9.618 -1.259 1.00 0.00 C ATOM 1105 C LEU A 959 -0.937 -10.286 -0.265 1.00 0.00 C ATOM 1106 O LEU A 959 -0.627 -10.401 0.920 1.00 0.00 O ATOM 1107 CB LEU A 959 1.180 -8.977 -0.514 1.00 0.00 C ATOM 1108 CG LEU A 959 2.442 -8.725 -1.339 1.00 0.00 C ATOM 1109 CD1 LEU A 959 3.461 -7.936 -0.530 1.00 0.00 C ATOM 1110 CD2 LEU A 959 3.040 -10.041 -1.815 1.00 0.00 C ATOM 0 H LEU A 959 -0.448 -8.611 -3.042 1.00 0.00 H new ATOM 0 HA LEU A 959 0.390 -10.381 -1.938 1.00 0.00 H new ATOM 0 HB2 LEU A 959 0.845 -8.026 -0.100 1.00 0.00 H new ATOM 0 HB3 LEU A 959 1.443 -9.617 0.329 1.00 0.00 H new ATOM 0 HG LEU A 959 2.169 -8.135 -2.214 1.00 0.00 H new ATOM 0 HD11 LEU A 959 4.352 -7.766 -1.134 1.00 0.00 H new ATOM 0 HD12 LEU A 959 3.031 -6.977 -0.240 1.00 0.00 H new ATOM 0 HD13 LEU A 959 3.730 -8.498 0.364 1.00 0.00 H new ATOM 0 HD21 LEU A 959 3.938 -9.842 -2.401 1.00 0.00 H new ATOM 0 HD22 LEU A 959 3.298 -10.656 -0.953 1.00 0.00 H new ATOM 0 HD23 LEU A 959 2.313 -10.569 -2.433 1.00 0.00 H new ATOM 1122 N ASN A 960 -2.090 -10.728 -0.758 1.00 0.00 N ATOM 1123 CA ASN A 960 -3.079 -11.387 0.087 1.00 0.00 C ATOM 1124 C ASN A 960 -3.318 -10.591 1.367 1.00 0.00 C ATOM 1125 O ASN A 960 -3.457 -11.163 2.448 1.00 0.00 O ATOM 1126 CB ASN A 960 -2.621 -12.805 0.433 1.00 0.00 C ATOM 1127 CG ASN A 960 -1.380 -12.815 1.305 1.00 0.00 C ATOM 1128 OD1 ASN A 960 -1.459 -12.626 2.519 1.00 0.00 O ATOM 1129 ND2 ASN A 960 -0.225 -13.037 0.687 1.00 0.00 N ATOM 0 H ASN A 960 -2.362 -10.642 -1.737 1.00 0.00 H new ATOM 0 HA ASN A 960 -4.016 -11.440 -0.467 1.00 0.00 H new ATOM 0 HB2 ASN A 960 -3.427 -13.329 0.947 1.00 0.00 H new ATOM 0 HB3 ASN A 960 -2.420 -13.354 -0.487 1.00 0.00 H new ATOM 0 HD21 ASN A 960 0.644 -13.056 1.221 1.00 0.00 H new ATOM 0 HD22 ASN A 960 -0.207 -13.189 -0.322 1.00 0.00 H new ATOM 1136 N ARG A 961 -3.366 -9.270 1.235 1.00 0.00 N ATOM 1137 CA ARG A 961 -3.588 -8.395 2.380 1.00 0.00 C ATOM 1138 C ARG A 961 -4.364 -7.147 1.969 1.00 0.00 C ATOM 1139 O ARG A 961 -3.815 -6.240 1.343 1.00 0.00 O ATOM 1140 CB ARG A 961 -2.252 -7.994 3.009 1.00 0.00 C ATOM 1141 CG ARG A 961 -1.767 -8.961 4.077 1.00 0.00 C ATOM 1142 CD ARG A 961 -0.495 -8.463 4.744 1.00 0.00 C ATOM 1143 NE ARG A 961 -0.230 -9.153 6.004 1.00 0.00 N ATOM 1144 CZ ARG A 961 0.346 -10.347 6.080 1.00 0.00 C ATOM 1145 NH1 ARG A 961 0.717 -10.980 4.976 1.00 0.00 N ATOM 1146 NH2 ARG A 961 0.553 -10.910 7.264 1.00 0.00 N ATOM 0 H ARG A 961 -3.254 -8.782 0.346 1.00 0.00 H new ATOM 0 HA ARG A 961 -4.178 -8.943 3.115 1.00 0.00 H new ATOM 0 HB2 ARG A 961 -1.498 -7.923 2.225 1.00 0.00 H new ATOM 0 HB3 ARG A 961 -2.350 -7.001 3.447 1.00 0.00 H new ATOM 0 HG2 ARG A 961 -2.545 -9.094 4.829 1.00 0.00 H new ATOM 0 HG3 ARG A 961 -1.586 -9.938 3.629 1.00 0.00 H new ATOM 0 HD2 ARG A 961 0.348 -8.606 4.068 1.00 0.00 H new ATOM 0 HD3 ARG A 961 -0.578 -7.392 4.928 1.00 0.00 H new ATOM 0 HE ARG A 961 -0.502 -8.693 6.873 1.00 0.00 H new ATOM 0 HH11 ARG A 961 0.560 -10.550 4.064 1.00 0.00 H new ATOM 0 HH12 ARG A 961 1.159 -11.897 5.038 1.00 0.00 H new ATOM 0 HH21 ARG A 961 0.270 -10.425 8.116 1.00 0.00 H new ATOM 0 HH22 ARG A 961 0.995 -11.827 7.322 1.00 0.00 H new ATOM 1160 N THR A 962 -5.644 -7.109 2.325 1.00 0.00 N ATOM 1161 CA THR A 962 -6.496 -5.974 1.992 1.00 0.00 C ATOM 1162 C THR A 962 -5.944 -4.681 2.581 1.00 0.00 C ATOM 1163 O THR A 962 -5.782 -4.561 3.796 1.00 0.00 O ATOM 1164 CB THR A 962 -7.935 -6.183 2.501 1.00 0.00 C ATOM 1165 OG1 THR A 962 -8.432 -7.450 2.056 1.00 0.00 O ATOM 1166 CG2 THR A 962 -8.850 -5.072 2.008 1.00 0.00 C ATOM 0 H THR A 962 -6.114 -7.851 2.844 1.00 0.00 H new ATOM 0 HA THR A 962 -6.510 -5.898 0.905 1.00 0.00 H new ATOM 0 HB THR A 962 -7.919 -6.162 3.591 1.00 0.00 H new ATOM 0 HG1 THR A 962 -7.895 -7.764 1.299 1.00 0.00 H new ATOM 0 HG21 THR A 962 -9.861 -5.241 2.380 1.00 0.00 H new ATOM 0 HG22 THR A 962 -8.485 -4.112 2.372 1.00 0.00 H new ATOM 0 HG23 THR A 962 -8.861 -5.066 0.918 1.00 0.00 H new ATOM 1174 N ILE A 963 -5.658 -3.716 1.713 1.00 0.00 N ATOM 1175 CA ILE A 963 -5.126 -2.431 2.149 1.00 0.00 C ATOM 1176 C ILE A 963 -6.200 -1.349 2.109 1.00 0.00 C ATOM 1177 O ILE A 963 -7.048 -1.333 1.216 1.00 0.00 O ATOM 1178 CB ILE A 963 -3.936 -1.989 1.276 1.00 0.00 C ATOM 1179 CG1 ILE A 963 -2.804 -3.016 1.362 1.00 0.00 C ATOM 1180 CG2 ILE A 963 -3.445 -0.615 1.706 1.00 0.00 C ATOM 1181 CD1 ILE A 963 -1.701 -2.784 0.354 1.00 0.00 C ATOM 0 H ILE A 963 -5.786 -3.800 0.705 1.00 0.00 H new ATOM 0 HA ILE A 963 -4.784 -2.563 3.176 1.00 0.00 H new ATOM 0 HB ILE A 963 -4.268 -1.927 0.240 1.00 0.00 H new ATOM 0 HG12 ILE A 963 -2.379 -2.993 2.365 1.00 0.00 H new ATOM 0 HG13 ILE A 963 -3.217 -4.014 1.213 1.00 0.00 H new ATOM 0 HG21 ILE A 963 -2.604 -0.317 1.080 1.00 0.00 H new ATOM 0 HG22 ILE A 963 -4.252 0.110 1.599 1.00 0.00 H new ATOM 0 HG23 ILE A 963 -3.126 -0.652 2.748 1.00 0.00 H new ATOM 0 HD11 ILE A 963 -0.933 -3.548 0.472 1.00 0.00 H new ATOM 0 HD12 ILE A 963 -2.112 -2.836 -0.654 1.00 0.00 H new ATOM 0 HD13 ILE A 963 -1.261 -1.800 0.516 1.00 0.00 H new ATOM 1193 N THR A 964 -6.157 -0.444 3.081 1.00 0.00 N ATOM 1194 CA THR A 964 -7.126 0.643 3.157 1.00 0.00 C ATOM 1195 C THR A 964 -6.429 1.994 3.263 1.00 0.00 C ATOM 1196 O THR A 964 -5.677 2.243 4.206 1.00 0.00 O ATOM 1197 CB THR A 964 -8.071 0.469 4.361 1.00 0.00 C ATOM 1198 OG1 THR A 964 -8.543 -0.881 4.423 1.00 0.00 O ATOM 1199 CG2 THR A 964 -9.253 1.422 4.263 1.00 0.00 C ATOM 0 H THR A 964 -5.461 -0.442 3.827 1.00 0.00 H new ATOM 0 HA THR A 964 -7.711 0.611 2.238 1.00 0.00 H new ATOM 0 HB THR A 964 -7.513 0.699 5.269 1.00 0.00 H new ATOM 0 HG1 THR A 964 -9.142 -0.983 5.192 1.00 0.00 H new ATOM 0 HG21 THR A 964 -9.906 1.281 5.124 1.00 0.00 H new ATOM 0 HG22 THR A 964 -8.891 2.450 4.247 1.00 0.00 H new ATOM 0 HG23 THR A 964 -9.809 1.219 3.348 1.00 0.00 H new ATOM 1207 N ILE A 965 -6.683 2.864 2.291 1.00 0.00 N ATOM 1208 CA ILE A 965 -6.081 4.191 2.277 1.00 0.00 C ATOM 1209 C ILE A 965 -7.086 5.255 2.704 1.00 0.00 C ATOM 1210 O ILE A 965 -8.258 5.202 2.332 1.00 0.00 O ATOM 1211 CB ILE A 965 -5.535 4.547 0.882 1.00 0.00 C ATOM 1212 CG1 ILE A 965 -4.556 3.473 0.404 1.00 0.00 C ATOM 1213 CG2 ILE A 965 -4.862 5.911 0.908 1.00 0.00 C ATOM 1214 CD1 ILE A 965 -4.075 3.681 -1.015 1.00 0.00 C ATOM 0 H ILE A 965 -7.302 2.673 1.503 1.00 0.00 H new ATOM 0 HA ILE A 965 -5.254 4.170 2.987 1.00 0.00 H new ATOM 0 HB ILE A 965 -6.369 4.589 0.182 1.00 0.00 H new ATOM 0 HG12 ILE A 965 -3.695 3.455 1.072 1.00 0.00 H new ATOM 0 HG13 ILE A 965 -5.036 2.497 0.477 1.00 0.00 H new ATOM 0 HG21 ILE A 965 -4.481 6.148 -0.086 1.00 0.00 H new ATOM 0 HG22 ILE A 965 -5.586 6.668 1.209 1.00 0.00 H new ATOM 0 HG23 ILE A 965 -4.036 5.896 1.619 1.00 0.00 H new ATOM 0 HD11 ILE A 965 -3.384 2.882 -1.286 1.00 0.00 H new ATOM 0 HD12 ILE A 965 -4.928 3.669 -1.694 1.00 0.00 H new ATOM 0 HD13 ILE A 965 -3.566 4.642 -1.089 1.00 0.00 H new ATOM 1226 N ALA A 966 -6.618 6.223 3.486 1.00 0.00 N ATOM 1227 CA ALA A 966 -7.475 7.302 3.961 1.00 0.00 C ATOM 1228 C ALA A 966 -6.678 8.586 4.165 1.00 0.00 C ATOM 1229 O ALA A 966 -5.568 8.562 4.698 1.00 0.00 O ATOM 1230 CB ALA A 966 -8.167 6.897 5.254 1.00 0.00 C ATOM 0 H ALA A 966 -5.650 6.282 3.804 1.00 0.00 H new ATOM 0 HA ALA A 966 -8.233 7.492 3.201 1.00 0.00 H new ATOM 0 HB1 ALA A 966 -8.804 7.713 5.597 1.00 0.00 H new ATOM 0 HB2 ALA A 966 -8.776 6.010 5.078 1.00 0.00 H new ATOM 0 HB3 ALA A 966 -7.418 6.677 6.014 1.00 0.00 H new ATOM 1236 N LEU A 967 -7.250 9.706 3.737 1.00 0.00 N ATOM 1237 CA LEU A 967 -6.593 11.001 3.872 1.00 0.00 C ATOM 1238 C LEU A 967 -6.620 11.478 5.321 1.00 0.00 C ATOM 1239 O LEU A 967 -7.507 11.107 6.091 1.00 0.00 O ATOM 1240 CB LEU A 967 -7.269 12.036 2.970 1.00 0.00 C ATOM 1241 CG LEU A 967 -6.874 11.999 1.493 1.00 0.00 C ATOM 1242 CD1 LEU A 967 -7.642 13.051 0.709 1.00 0.00 C ATOM 1243 CD2 LEU A 967 -5.374 12.203 1.337 1.00 0.00 C ATOM 0 H LEU A 967 -8.168 9.743 3.293 1.00 0.00 H new ATOM 0 HA LEU A 967 -5.553 10.886 3.566 1.00 0.00 H new ATOM 0 HB2 LEU A 967 -8.348 11.900 3.040 1.00 0.00 H new ATOM 0 HB3 LEU A 967 -7.047 13.029 3.360 1.00 0.00 H new ATOM 0 HG LEU A 967 -7.130 11.018 1.092 1.00 0.00 H new ATOM 0 HD11 LEU A 967 -7.348 13.010 -0.340 1.00 0.00 H new ATOM 0 HD12 LEU A 967 -8.712 12.859 0.794 1.00 0.00 H new ATOM 0 HD13 LEU A 967 -7.418 14.039 1.110 1.00 0.00 H new ATOM 0 HD21 LEU A 967 -5.111 12.174 0.280 1.00 0.00 H new ATOM 0 HD22 LEU A 967 -5.093 13.170 1.754 1.00 0.00 H new ATOM 0 HD23 LEU A 967 -4.842 11.412 1.865 1.00 0.00 H new ATOM 1255 N LYS A 968 -5.645 12.303 5.686 1.00 0.00 N ATOM 1256 CA LYS A 968 -5.558 12.834 7.041 1.00 0.00 C ATOM 1257 C LYS A 968 -6.391 14.104 7.182 1.00 0.00 C ATOM 1258 O LYS A 968 -6.554 14.860 6.225 1.00 0.00 O ATOM 1259 CB LYS A 968 -4.100 13.125 7.404 1.00 0.00 C ATOM 1260 CG LYS A 968 -3.880 13.367 8.887 1.00 0.00 C ATOM 1261 CD LYS A 968 -3.921 12.069 9.677 1.00 0.00 C ATOM 1262 CE LYS A 968 -4.119 12.327 11.163 1.00 0.00 C ATOM 1263 NZ LYS A 968 -5.509 12.764 11.469 1.00 0.00 N ATOM 0 H LYS A 968 -4.903 12.619 5.061 1.00 0.00 H new ATOM 0 HA LYS A 968 -5.954 12.083 7.725 1.00 0.00 H new ATOM 0 HB2 LYS A 968 -3.481 12.287 7.085 1.00 0.00 H new ATOM 0 HB3 LYS A 968 -3.763 14.000 6.848 1.00 0.00 H new ATOM 0 HG2 LYS A 968 -2.917 13.855 9.038 1.00 0.00 H new ATOM 0 HG3 LYS A 968 -4.645 14.047 9.263 1.00 0.00 H new ATOM 0 HD2 LYS A 968 -4.730 11.441 9.305 1.00 0.00 H new ATOM 0 HD3 LYS A 968 -2.993 11.518 9.523 1.00 0.00 H new ATOM 0 HE2 LYS A 968 -3.892 11.420 11.723 1.00 0.00 H new ATOM 0 HE3 LYS A 968 -3.416 13.091 11.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 968 -5.680 12.686 12.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 968 -5.636 13.752 11.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 968 -6.183 12.160 10.958 1.00 0.00 H new