USER MOD reduce.3.24.130724 H: found=0, std=0, add=541, rem=0, adj=11 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 28:sc= 0.0157 USER MOD Set 1.2: A 940 THR OG1 : rot 180:sc= 0 USER MOD Single : A 898 SER OG : rot 180:sc= -0.103 USER MOD Single : A 919 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 920 GLN : amide:sc= -0.0985 K(o=-0.099,f=-1.2) USER MOD Single : A 923 SER OG : rot 180:sc= 0 USER MOD Single : A 936 LYS NZ :NH3+ -126:sc= -2.13! (180deg=-5.01!) USER MOD Single : A 937 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 945 SER OG : rot 180:sc= 0 USER MOD Single : A 946 SER OG : rot 180:sc= 0 USER MOD Single : A 949 ASN : amide:sc= -0.15 K(o=-0.15,f=-2.2!) USER MOD Single : A 952 SER OG : rot 81:sc= 0.975 USER MOD Single : A 954 ASN : amide:sc= -0.636 K(o=-0.64,f=-1.5) USER MOD Single : A 956 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 960 ASN : amide:sc=-0.00152 X(o=-0.0015,f=0) USER MOD Single : A 962 THR OG1 : rot -5:sc= 0.538 USER MOD Single : A 964 THR OG1 : rot 180:sc= 0 USER MOD Single : A 968 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0122) USER MOD ----------------------------------------------------------------- ATOM 73 N THR A 894 0.328 13.784 3.501 1.00 0.00 N ATOM 74 CA THR A 894 0.386 12.600 4.349 1.00 0.00 C ATOM 75 C THR A 894 -0.870 11.750 4.193 1.00 0.00 C ATOM 76 O THR A 894 -1.984 12.223 4.420 1.00 0.00 O ATOM 77 CB THR A 894 0.556 12.978 5.832 1.00 0.00 C ATOM 78 OG1 THR A 894 1.812 13.636 6.029 1.00 0.00 O ATOM 79 CG2 THR A 894 0.479 11.744 6.718 1.00 0.00 C ATOM 0 HA THR A 894 1.254 12.024 4.028 1.00 0.00 H new ATOM 0 HB THR A 894 -0.254 13.653 6.107 1.00 0.00 H new ATOM 0 HG1 THR A 894 2.079 14.085 5.200 1.00 0.00 H new ATOM 0 HG21 THR A 894 0.602 12.037 7.761 1.00 0.00 H new ATOM 0 HG22 THR A 894 -0.490 11.263 6.588 1.00 0.00 H new ATOM 0 HG23 THR A 894 1.270 11.047 6.441 1.00 0.00 H new ATOM 87 N VAL A 895 -0.683 10.492 3.806 1.00 0.00 N ATOM 88 CA VAL A 895 -1.802 9.575 3.622 1.00 0.00 C ATOM 89 C VAL A 895 -1.697 8.383 4.568 1.00 0.00 C ATOM 90 O VAL A 895 -0.602 7.890 4.843 1.00 0.00 O ATOM 91 CB VAL A 895 -1.874 9.061 2.172 1.00 0.00 C ATOM 92 CG1 VAL A 895 -1.881 10.224 1.193 1.00 0.00 C ATOM 93 CG2 VAL A 895 -0.716 8.117 1.884 1.00 0.00 C ATOM 0 H VAL A 895 0.232 10.085 3.614 1.00 0.00 H new ATOM 0 HA VAL A 895 -2.710 10.135 3.847 1.00 0.00 H new ATOM 0 HB VAL A 895 -2.804 8.507 2.047 1.00 0.00 H new ATOM 0 HG11 VAL A 895 -1.932 9.841 0.174 1.00 0.00 H new ATOM 0 HG12 VAL A 895 -2.747 10.857 1.387 1.00 0.00 H new ATOM 0 HG13 VAL A 895 -0.969 10.808 1.316 1.00 0.00 H new ATOM 0 HG21 VAL A 895 -0.782 7.763 0.855 1.00 0.00 H new ATOM 0 HG22 VAL A 895 0.227 8.644 2.026 1.00 0.00 H new ATOM 0 HG23 VAL A 895 -0.762 7.266 2.564 1.00 0.00 H new ATOM 103 N LEU A 896 -2.842 7.925 5.062 1.00 0.00 N ATOM 104 CA LEU A 896 -2.879 6.789 5.977 1.00 0.00 C ATOM 105 C LEU A 896 -3.095 5.484 5.217 1.00 0.00 C ATOM 106 O LEU A 896 -3.798 5.451 4.207 1.00 0.00 O ATOM 107 CB LEU A 896 -3.990 6.980 7.011 1.00 0.00 C ATOM 108 CG LEU A 896 -3.664 7.906 8.184 1.00 0.00 C ATOM 109 CD1 LEU A 896 -2.886 9.121 7.703 1.00 0.00 C ATOM 110 CD2 LEU A 896 -4.938 8.333 8.897 1.00 0.00 C ATOM 0 H LEU A 896 -3.756 8.322 4.845 1.00 0.00 H new ATOM 0 HA LEU A 896 -1.918 6.734 6.489 1.00 0.00 H new ATOM 0 HB2 LEU A 896 -4.871 7.370 6.501 1.00 0.00 H new ATOM 0 HB3 LEU A 896 -4.259 6.002 7.410 1.00 0.00 H new ATOM 0 HG LEU A 896 -3.042 7.359 8.893 1.00 0.00 H new ATOM 0 HD11 LEU A 896 -2.663 9.769 8.551 1.00 0.00 H new ATOM 0 HD12 LEU A 896 -1.955 8.796 7.239 1.00 0.00 H new ATOM 0 HD13 LEU A 896 -3.482 9.670 6.974 1.00 0.00 H new ATOM 0 HD21 LEU A 896 -4.686 8.991 9.729 1.00 0.00 H new ATOM 0 HD22 LEU A 896 -5.586 8.862 8.198 1.00 0.00 H new ATOM 0 HD23 LEU A 896 -5.456 7.452 9.276 1.00 0.00 H new ATOM 122 N VAL A 897 -2.487 4.410 5.711 1.00 0.00 N ATOM 123 CA VAL A 897 -2.615 3.102 5.081 1.00 0.00 C ATOM 124 C VAL A 897 -2.599 1.987 6.121 1.00 0.00 C ATOM 125 O VAL A 897 -1.705 1.924 6.965 1.00 0.00 O ATOM 126 CB VAL A 897 -1.484 2.856 4.063 1.00 0.00 C ATOM 127 CG1 VAL A 897 -1.615 1.473 3.443 1.00 0.00 C ATOM 128 CG2 VAL A 897 -1.491 3.934 2.990 1.00 0.00 C ATOM 0 H VAL A 897 -1.901 4.420 6.546 1.00 0.00 H new ATOM 0 HA VAL A 897 -3.572 3.094 4.559 1.00 0.00 H new ATOM 0 HB VAL A 897 -0.529 2.903 4.587 1.00 0.00 H new ATOM 0 HG11 VAL A 897 -0.808 1.317 2.727 1.00 0.00 H new ATOM 0 HG12 VAL A 897 -1.557 0.716 4.226 1.00 0.00 H new ATOM 0 HG13 VAL A 897 -2.574 1.393 2.932 1.00 0.00 H new ATOM 0 HG21 VAL A 897 -0.686 3.745 2.279 1.00 0.00 H new ATOM 0 HG22 VAL A 897 -2.447 3.921 2.467 1.00 0.00 H new ATOM 0 HG23 VAL A 897 -1.344 4.910 3.453 1.00 0.00 H new ATOM 138 N SER A 898 -3.594 1.109 6.053 1.00 0.00 N ATOM 139 CA SER A 898 -3.697 -0.003 6.991 1.00 0.00 C ATOM 140 C SER A 898 -3.985 -1.309 6.257 1.00 0.00 C ATOM 141 O SER A 898 -4.464 -1.303 5.123 1.00 0.00 O ATOM 142 CB SER A 898 -4.796 0.270 8.020 1.00 0.00 C ATOM 143 OG SER A 898 -5.009 -0.858 8.851 1.00 0.00 O ATOM 0 H SER A 898 -4.340 1.146 5.359 1.00 0.00 H new ATOM 0 HA SER A 898 -2.742 -0.100 7.507 1.00 0.00 H new ATOM 0 HB2 SER A 898 -4.520 1.129 8.632 1.00 0.00 H new ATOM 0 HB3 SER A 898 -5.723 0.528 7.507 1.00 0.00 H new ATOM 0 HG SER A 898 -5.715 -0.657 9.501 1.00 0.00 H new ATOM 149 N ILE A 899 -3.690 -2.426 6.912 1.00 0.00 N ATOM 150 CA ILE A 899 -3.917 -3.740 6.323 1.00 0.00 C ATOM 151 C ILE A 899 -4.867 -4.570 7.180 1.00 0.00 C ATOM 152 O ILE A 899 -4.598 -4.826 8.354 1.00 0.00 O ATOM 153 CB ILE A 899 -2.597 -4.513 6.143 1.00 0.00 C ATOM 154 CG1 ILE A 899 -1.626 -4.177 7.276 1.00 0.00 C ATOM 155 CG2 ILE A 899 -1.975 -4.192 4.792 1.00 0.00 C ATOM 156 CD1 ILE A 899 -0.664 -5.299 7.600 1.00 0.00 C ATOM 0 H ILE A 899 -3.293 -2.448 7.851 1.00 0.00 H new ATOM 0 HA ILE A 899 -4.366 -3.573 5.344 1.00 0.00 H new ATOM 0 HB ILE A 899 -2.811 -5.581 6.178 1.00 0.00 H new ATOM 0 HG12 ILE A 899 -1.057 -3.288 7.004 1.00 0.00 H new ATOM 0 HG13 ILE A 899 -2.197 -3.929 8.171 1.00 0.00 H new ATOM 0 HG21 ILE A 899 -1.043 -4.746 4.680 1.00 0.00 H new ATOM 0 HG22 ILE A 899 -2.664 -4.477 3.997 1.00 0.00 H new ATOM 0 HG23 ILE A 899 -1.772 -3.123 4.730 1.00 0.00 H new ATOM 0 HD11 ILE A 899 -0.006 -4.991 8.412 1.00 0.00 H new ATOM 0 HD12 ILE A 899 -1.225 -6.183 7.903 1.00 0.00 H new ATOM 0 HD13 ILE A 899 -0.067 -5.533 6.718 1.00 0.00 H new ATOM 308 N PHE A 909 3.478 -4.758 9.360 1.00 0.00 N ATOM 309 CA PHE A 909 3.908 -4.432 8.005 1.00 0.00 C ATOM 310 C PHE A 909 5.233 -5.114 7.677 1.00 0.00 C ATOM 311 O PHE A 909 6.286 -4.725 8.183 1.00 0.00 O ATOM 312 CB PHE A 909 4.047 -2.917 7.842 1.00 0.00 C ATOM 313 CG PHE A 909 2.733 -2.210 7.670 1.00 0.00 C ATOM 314 CD1 PHE A 909 2.032 -2.303 6.478 1.00 0.00 C ATOM 315 CD2 PHE A 909 2.198 -1.453 8.700 1.00 0.00 C ATOM 316 CE1 PHE A 909 0.823 -1.653 6.317 1.00 0.00 C ATOM 317 CE2 PHE A 909 0.989 -0.801 8.544 1.00 0.00 C ATOM 318 CZ PHE A 909 0.301 -0.902 7.351 1.00 0.00 C ATOM 0 HA PHE A 909 3.150 -4.797 7.312 1.00 0.00 H new ATOM 0 HB2 PHE A 909 4.557 -2.511 8.715 1.00 0.00 H new ATOM 0 HB3 PHE A 909 4.678 -2.709 6.978 1.00 0.00 H new ATOM 0 HD1 PHE A 909 2.435 -2.890 5.666 1.00 0.00 H new ATOM 0 HD2 PHE A 909 2.732 -1.371 9.635 1.00 0.00 H new ATOM 0 HE1 PHE A 909 0.287 -1.733 5.383 1.00 0.00 H new ATOM 0 HE2 PHE A 909 0.583 -0.213 9.354 1.00 0.00 H new ATOM 0 HZ PHE A 909 -0.644 -0.394 7.227 1.00 0.00 H new ATOM 328 N ASP A 910 5.173 -6.133 6.827 1.00 0.00 N ATOM 329 CA ASP A 910 6.367 -6.869 6.429 1.00 0.00 C ATOM 330 C ASP A 910 7.089 -6.159 5.288 1.00 0.00 C ATOM 331 O ASP A 910 6.489 -5.371 4.557 1.00 0.00 O ATOM 332 CB ASP A 910 5.998 -8.293 6.009 1.00 0.00 C ATOM 333 CG ASP A 910 5.166 -9.008 7.055 1.00 0.00 C ATOM 334 OD1 ASP A 910 5.693 -9.267 8.158 1.00 0.00 O ATOM 335 OD2 ASP A 910 3.988 -9.308 6.772 1.00 0.00 O ATOM 0 H ASP A 910 4.309 -6.468 6.400 1.00 0.00 H new ATOM 0 HA ASP A 910 7.038 -6.914 7.286 1.00 0.00 H new ATOM 0 HB2 ASP A 910 5.446 -8.260 5.070 1.00 0.00 H new ATOM 0 HB3 ASP A 910 6.909 -8.861 5.823 1.00 0.00 H new ATOM 340 N ASP A 911 8.378 -6.444 5.142 1.00 0.00 N ATOM 341 CA ASP A 911 9.181 -5.833 4.089 1.00 0.00 C ATOM 342 C ASP A 911 8.424 -5.821 2.765 1.00 0.00 C ATOM 343 O ASP A 911 8.198 -4.763 2.178 1.00 0.00 O ATOM 344 CB ASP A 911 10.504 -6.584 3.927 1.00 0.00 C ATOM 345 CG ASP A 911 11.464 -5.870 2.996 1.00 0.00 C ATOM 346 OD1 ASP A 911 11.465 -4.622 2.988 1.00 0.00 O ATOM 347 OD2 ASP A 911 12.215 -6.561 2.275 1.00 0.00 O ATOM 0 H ASP A 911 8.889 -7.094 5.739 1.00 0.00 H new ATOM 0 HA ASP A 911 9.389 -4.803 4.377 1.00 0.00 H new ATOM 0 HB2 ASP A 911 10.972 -6.705 4.904 1.00 0.00 H new ATOM 0 HB3 ASP A 911 10.306 -7.585 3.543 1.00 0.00 H new ATOM 352 N ALA A 912 8.035 -7.003 2.300 1.00 0.00 N ATOM 353 CA ALA A 912 7.303 -7.128 1.047 1.00 0.00 C ATOM 354 C ALA A 912 6.188 -6.091 0.956 1.00 0.00 C ATOM 355 O ALA A 912 6.150 -5.285 0.025 1.00 0.00 O ATOM 356 CB ALA A 912 6.733 -8.532 0.906 1.00 0.00 C ATOM 0 H ALA A 912 8.215 -7.889 2.773 1.00 0.00 H new ATOM 0 HA ALA A 912 8.000 -6.947 0.229 1.00 0.00 H new ATOM 0 HB1 ALA A 912 6.189 -8.611 -0.035 1.00 0.00 H new ATOM 0 HB2 ALA A 912 7.546 -9.258 0.917 1.00 0.00 H new ATOM 0 HB3 ALA A 912 6.055 -8.735 1.735 1.00 0.00 H new ATOM 362 N LEU A 913 5.282 -6.117 1.927 1.00 0.00 N ATOM 363 CA LEU A 913 4.166 -5.179 1.957 1.00 0.00 C ATOM 364 C LEU A 913 4.635 -3.764 1.635 1.00 0.00 C ATOM 365 O LEU A 913 4.133 -3.129 0.707 1.00 0.00 O ATOM 366 CB LEU A 913 3.489 -5.205 3.328 1.00 0.00 C ATOM 367 CG LEU A 913 2.527 -6.366 3.580 1.00 0.00 C ATOM 368 CD1 LEU A 913 2.272 -6.535 5.070 1.00 0.00 C ATOM 369 CD2 LEU A 913 1.219 -6.147 2.835 1.00 0.00 C ATOM 0 H LEU A 913 5.298 -6.778 2.704 1.00 0.00 H new ATOM 0 HA LEU A 913 3.446 -5.485 1.198 1.00 0.00 H new ATOM 0 HB2 LEU A 913 4.265 -5.230 4.093 1.00 0.00 H new ATOM 0 HB3 LEU A 913 2.942 -4.271 3.458 1.00 0.00 H new ATOM 0 HG LEU A 913 2.987 -7.280 3.205 1.00 0.00 H new ATOM 0 HD11 LEU A 913 1.585 -7.366 5.230 1.00 0.00 H new ATOM 0 HD12 LEU A 913 3.214 -6.740 5.579 1.00 0.00 H new ATOM 0 HD13 LEU A 913 1.834 -5.620 5.470 1.00 0.00 H new ATOM 0 HD21 LEU A 913 0.547 -6.983 3.026 1.00 0.00 H new ATOM 0 HD22 LEU A 913 0.755 -5.223 3.179 1.00 0.00 H new ATOM 0 HD23 LEU A 913 1.417 -6.078 1.765 1.00 0.00 H new ATOM 381 N ILE A 914 5.601 -3.277 2.407 1.00 0.00 N ATOM 382 CA ILE A 914 6.140 -1.938 2.202 1.00 0.00 C ATOM 383 C ILE A 914 6.719 -1.787 0.799 1.00 0.00 C ATOM 384 O ILE A 914 6.247 -0.973 0.006 1.00 0.00 O ATOM 385 CB ILE A 914 7.234 -1.607 3.234 1.00 0.00 C ATOM 386 CG1 ILE A 914 6.671 -1.701 4.654 1.00 0.00 C ATOM 387 CG2 ILE A 914 7.804 -0.221 2.975 1.00 0.00 C ATOM 388 CD1 ILE A 914 7.737 -1.730 5.726 1.00 0.00 C ATOM 0 H ILE A 914 6.026 -3.789 3.180 1.00 0.00 H new ATOM 0 HA ILE A 914 5.311 -1.242 2.328 1.00 0.00 H new ATOM 0 HB ILE A 914 8.040 -2.334 3.134 1.00 0.00 H new ATOM 0 HG12 ILE A 914 6.012 -0.851 4.832 1.00 0.00 H new ATOM 0 HG13 ILE A 914 6.061 -2.601 4.735 1.00 0.00 H new ATOM 0 HG21 ILE A 914 8.576 -0.001 3.712 1.00 0.00 H new ATOM 0 HG22 ILE A 914 8.237 -0.187 1.975 1.00 0.00 H new ATOM 0 HG23 ILE A 914 7.008 0.520 3.051 1.00 0.00 H new ATOM 0 HD11 ILE A 914 7.265 -1.797 6.706 1.00 0.00 H new ATOM 0 HD12 ILE A 914 8.383 -2.595 5.574 1.00 0.00 H new ATOM 0 HD13 ILE A 914 8.333 -0.819 5.672 1.00 0.00 H new ATOM 400 N ASP A 915 7.742 -2.579 0.499 1.00 0.00 N ATOM 401 CA ASP A 915 8.384 -2.537 -0.810 1.00 0.00 C ATOM 402 C ASP A 915 7.344 -2.460 -1.923 1.00 0.00 C ATOM 403 O ASP A 915 7.236 -1.449 -2.615 1.00 0.00 O ATOM 404 CB ASP A 915 9.271 -3.767 -1.007 1.00 0.00 C ATOM 405 CG ASP A 915 10.337 -3.550 -2.063 1.00 0.00 C ATOM 406 OD1 ASP A 915 10.053 -2.847 -3.055 1.00 0.00 O ATOM 407 OD2 ASP A 915 11.454 -4.083 -1.897 1.00 0.00 O ATOM 0 H ASP A 915 8.145 -3.258 1.145 1.00 0.00 H new ATOM 0 HA ASP A 915 9.004 -1.642 -0.855 1.00 0.00 H new ATOM 0 HB2 ASP A 915 9.748 -4.022 -0.061 1.00 0.00 H new ATOM 0 HB3 ASP A 915 8.650 -4.617 -1.291 1.00 0.00 H new ATOM 412 N GLU A 916 6.582 -3.537 -2.089 1.00 0.00 N ATOM 413 CA GLU A 916 5.552 -3.592 -3.120 1.00 0.00 C ATOM 414 C GLU A 916 4.756 -2.290 -3.163 1.00 0.00 C ATOM 415 O GLU A 916 4.651 -1.648 -4.209 1.00 0.00 O ATOM 416 CB GLU A 916 4.610 -4.771 -2.869 1.00 0.00 C ATOM 417 CG GLU A 916 5.280 -6.127 -3.013 1.00 0.00 C ATOM 418 CD GLU A 916 5.426 -6.555 -4.460 1.00 0.00 C ATOM 419 OE1 GLU A 916 6.431 -6.170 -5.095 1.00 0.00 O ATOM 420 OE2 GLU A 916 4.536 -7.275 -4.958 1.00 0.00 O ATOM 0 H GLU A 916 6.659 -4.382 -1.523 1.00 0.00 H new ATOM 0 HA GLU A 916 6.044 -3.729 -4.083 1.00 0.00 H new ATOM 0 HB2 GLU A 916 4.194 -4.685 -1.865 1.00 0.00 H new ATOM 0 HB3 GLU A 916 3.774 -4.712 -3.566 1.00 0.00 H new ATOM 0 HG2 GLU A 916 6.265 -6.093 -2.547 1.00 0.00 H new ATOM 0 HG3 GLU A 916 4.698 -6.875 -2.474 1.00 0.00 H new ATOM 427 N LEU A 917 4.197 -1.908 -2.021 1.00 0.00 N ATOM 428 CA LEU A 917 3.410 -0.683 -1.926 1.00 0.00 C ATOM 429 C LEU A 917 4.112 0.471 -2.634 1.00 0.00 C ATOM 430 O LEU A 917 3.566 1.069 -3.562 1.00 0.00 O ATOM 431 CB LEU A 917 3.163 -0.324 -0.460 1.00 0.00 C ATOM 432 CG LEU A 917 2.107 -1.157 0.267 1.00 0.00 C ATOM 433 CD1 LEU A 917 2.283 -1.045 1.773 1.00 0.00 C ATOM 434 CD2 LEU A 917 0.708 -0.720 -0.143 1.00 0.00 C ATOM 0 H LEU A 917 4.274 -2.429 -1.147 1.00 0.00 H new ATOM 0 HA LEU A 917 2.452 -0.857 -2.416 1.00 0.00 H new ATOM 0 HB2 LEU A 917 4.105 -0.418 0.080 1.00 0.00 H new ATOM 0 HB3 LEU A 917 2.869 0.724 -0.408 1.00 0.00 H new ATOM 0 HG LEU A 917 2.237 -2.201 -0.016 1.00 0.00 H new ATOM 0 HD11 LEU A 917 1.523 -1.644 2.274 1.00 0.00 H new ATOM 0 HD12 LEU A 917 3.272 -1.407 2.052 1.00 0.00 H new ATOM 0 HD13 LEU A 917 2.180 -0.003 2.075 1.00 0.00 H new ATOM 0 HD21 LEU A 917 -0.031 -1.324 0.384 1.00 0.00 H new ATOM 0 HD22 LEU A 917 0.566 0.331 0.111 1.00 0.00 H new ATOM 0 HD23 LEU A 917 0.585 -0.854 -1.218 1.00 0.00 H new ATOM 446 N LEU A 918 5.326 0.780 -2.190 1.00 0.00 N ATOM 447 CA LEU A 918 6.104 1.862 -2.783 1.00 0.00 C ATOM 448 C LEU A 918 5.860 1.950 -4.286 1.00 0.00 C ATOM 449 O LEU A 918 5.429 2.984 -4.794 1.00 0.00 O ATOM 450 CB LEU A 918 7.595 1.653 -2.508 1.00 0.00 C ATOM 451 CG LEU A 918 8.006 1.606 -1.036 1.00 0.00 C ATOM 452 CD1 LEU A 918 9.501 1.357 -0.908 1.00 0.00 C ATOM 453 CD2 LEU A 918 7.617 2.898 -0.332 1.00 0.00 C ATOM 0 H LEU A 918 5.792 0.297 -1.422 1.00 0.00 H new ATOM 0 HA LEU A 918 5.783 2.799 -2.327 1.00 0.00 H new ATOM 0 HB2 LEU A 918 7.904 0.721 -2.981 1.00 0.00 H new ATOM 0 HB3 LEU A 918 8.150 2.456 -2.994 1.00 0.00 H new ATOM 0 HG LEU A 918 7.478 0.781 -0.557 1.00 0.00 H new ATOM 0 HD11 LEU A 918 9.776 1.327 0.146 1.00 0.00 H new ATOM 0 HD12 LEU A 918 9.753 0.405 -1.376 1.00 0.00 H new ATOM 0 HD13 LEU A 918 10.047 2.160 -1.402 1.00 0.00 H new ATOM 0 HD21 LEU A 918 7.917 2.847 0.715 1.00 0.00 H new ATOM 0 HD22 LEU A 918 8.117 3.739 -0.812 1.00 0.00 H new ATOM 0 HD23 LEU A 918 6.537 3.035 -0.393 1.00 0.00 H new ATOM 465 N GLN A 919 6.136 0.857 -4.990 1.00 0.00 N ATOM 466 CA GLN A 919 5.944 0.811 -6.434 1.00 0.00 C ATOM 467 C GLN A 919 4.503 1.149 -6.803 1.00 0.00 C ATOM 468 O GLN A 919 4.251 1.829 -7.798 1.00 0.00 O ATOM 469 CB GLN A 919 6.309 -0.573 -6.975 1.00 0.00 C ATOM 470 CG GLN A 919 7.806 -0.788 -7.134 1.00 0.00 C ATOM 471 CD GLN A 919 8.154 -2.218 -7.498 1.00 0.00 C ATOM 472 OE1 GLN A 919 8.218 -3.093 -6.634 1.00 0.00 O ATOM 473 NE2 GLN A 919 8.382 -2.463 -8.783 1.00 0.00 N ATOM 0 H GLN A 919 6.493 -0.008 -4.584 1.00 0.00 H new ATOM 0 HA GLN A 919 6.600 1.555 -6.886 1.00 0.00 H new ATOM 0 HB2 GLN A 919 5.910 -1.333 -6.303 1.00 0.00 H new ATOM 0 HB3 GLN A 919 5.825 -0.716 -7.941 1.00 0.00 H new ATOM 0 HG2 GLN A 919 8.186 -0.118 -7.905 1.00 0.00 H new ATOM 0 HG3 GLN A 919 8.308 -0.521 -6.204 1.00 0.00 H new ATOM 0 HE21 GLN A 919 8.318 -1.708 -9.465 1.00 0.00 H new ATOM 0 HE22 GLN A 919 8.621 -3.407 -9.088 1.00 0.00 H new ATOM 482 N GLN A 920 3.563 0.671 -5.995 1.00 0.00 N ATOM 483 CA GLN A 920 2.147 0.923 -6.238 1.00 0.00 C ATOM 484 C GLN A 920 1.834 2.412 -6.136 1.00 0.00 C ATOM 485 O GLN A 920 1.006 2.935 -6.882 1.00 0.00 O ATOM 486 CB GLN A 920 1.290 0.139 -5.243 1.00 0.00 C ATOM 487 CG GLN A 920 1.457 -1.368 -5.351 1.00 0.00 C ATOM 488 CD GLN A 920 1.017 -1.909 -6.697 1.00 0.00 C ATOM 489 OE1 GLN A 920 0.243 -1.272 -7.413 1.00 0.00 O ATOM 490 NE2 GLN A 920 1.508 -3.091 -7.050 1.00 0.00 N ATOM 0 H GLN A 920 3.755 0.107 -5.167 1.00 0.00 H new ATOM 0 HA GLN A 920 1.912 0.590 -7.249 1.00 0.00 H new ATOM 0 HB2 GLN A 920 1.545 0.453 -4.231 1.00 0.00 H new ATOM 0 HB3 GLN A 920 0.242 0.392 -5.401 1.00 0.00 H new ATOM 0 HG2 GLN A 920 2.503 -1.627 -5.184 1.00 0.00 H new ATOM 0 HG3 GLN A 920 0.879 -1.851 -4.563 1.00 0.00 H new ATOM 0 HE21 GLN A 920 2.147 -3.585 -6.426 1.00 0.00 H new ATOM 0 HE22 GLN A 920 1.247 -3.505 -7.945 1.00 0.00 H new ATOM 499 N PHE A 921 2.500 3.089 -5.206 1.00 0.00 N ATOM 500 CA PHE A 921 2.291 4.518 -5.004 1.00 0.00 C ATOM 501 C PHE A 921 2.895 5.323 -6.151 1.00 0.00 C ATOM 502 O PHE A 921 2.334 6.331 -6.578 1.00 0.00 O ATOM 503 CB PHE A 921 2.905 4.962 -3.675 1.00 0.00 C ATOM 504 CG PHE A 921 2.348 4.235 -2.484 1.00 0.00 C ATOM 505 CD1 PHE A 921 1.007 3.889 -2.433 1.00 0.00 C ATOM 506 CD2 PHE A 921 3.164 3.898 -1.417 1.00 0.00 C ATOM 507 CE1 PHE A 921 0.492 3.221 -1.338 1.00 0.00 C ATOM 508 CE2 PHE A 921 2.654 3.230 -0.320 1.00 0.00 C ATOM 509 CZ PHE A 921 1.317 2.890 -0.281 1.00 0.00 C ATOM 0 H PHE A 921 3.189 2.671 -4.581 1.00 0.00 H new ATOM 0 HA PHE A 921 1.217 4.703 -4.979 1.00 0.00 H new ATOM 0 HB2 PHE A 921 3.983 4.808 -3.713 1.00 0.00 H new ATOM 0 HB3 PHE A 921 2.740 6.032 -3.547 1.00 0.00 H new ATOM 0 HD1 PHE A 921 0.358 4.144 -3.257 1.00 0.00 H new ATOM 0 HD2 PHE A 921 4.211 4.160 -1.443 1.00 0.00 H new ATOM 0 HE1 PHE A 921 -0.555 2.958 -1.309 1.00 0.00 H new ATOM 0 HE2 PHE A 921 3.301 2.974 0.506 1.00 0.00 H new ATOM 0 HZ PHE A 921 0.917 2.366 0.574 1.00 0.00 H new ATOM 519 N ALA A 922 4.043 4.869 -6.644 1.00 0.00 N ATOM 520 CA ALA A 922 4.723 5.545 -7.741 1.00 0.00 C ATOM 521 C ALA A 922 3.823 5.644 -8.968 1.00 0.00 C ATOM 522 O ALA A 922 3.883 6.619 -9.717 1.00 0.00 O ATOM 523 CB ALA A 922 6.014 4.819 -8.089 1.00 0.00 C ATOM 0 H ALA A 922 4.521 4.036 -6.301 1.00 0.00 H new ATOM 0 HA ALA A 922 4.964 6.557 -7.417 1.00 0.00 H new ATOM 0 HB1 ALA A 922 6.512 5.335 -8.910 1.00 0.00 H new ATOM 0 HB2 ALA A 922 6.670 4.805 -7.218 1.00 0.00 H new ATOM 0 HB3 ALA A 922 5.787 3.796 -8.388 1.00 0.00 H new ATOM 529 N SER A 923 2.989 4.628 -9.167 1.00 0.00 N ATOM 530 CA SER A 923 2.079 4.599 -10.306 1.00 0.00 C ATOM 531 C SER A 923 1.339 5.926 -10.445 1.00 0.00 C ATOM 532 O SER A 923 0.898 6.294 -11.534 1.00 0.00 O ATOM 533 CB SER A 923 1.074 3.455 -10.154 1.00 0.00 C ATOM 534 OG SER A 923 1.563 2.264 -10.745 1.00 0.00 O ATOM 0 H SER A 923 2.925 3.815 -8.555 1.00 0.00 H new ATOM 0 HA SER A 923 2.670 4.437 -11.207 1.00 0.00 H new ATOM 0 HB2 SER A 923 0.871 3.283 -9.097 1.00 0.00 H new ATOM 0 HB3 SER A 923 0.128 3.734 -10.619 1.00 0.00 H new ATOM 0 HG SER A 923 0.903 1.548 -10.633 1.00 0.00 H new ATOM 540 N PHE A 924 1.206 6.641 -9.333 1.00 0.00 N ATOM 541 CA PHE A 924 0.519 7.927 -9.328 1.00 0.00 C ATOM 542 C PHE A 924 1.442 9.035 -8.828 1.00 0.00 C ATOM 543 O PHE A 924 1.779 9.959 -9.567 1.00 0.00 O ATOM 544 CB PHE A 924 -0.734 7.857 -8.453 1.00 0.00 C ATOM 545 CG PHE A 924 -1.612 6.678 -8.757 1.00 0.00 C ATOM 546 CD1 PHE A 924 -1.175 5.388 -8.502 1.00 0.00 C ATOM 547 CD2 PHE A 924 -2.875 6.859 -9.297 1.00 0.00 C ATOM 548 CE1 PHE A 924 -1.981 4.300 -8.782 1.00 0.00 C ATOM 549 CE2 PHE A 924 -3.686 5.775 -9.579 1.00 0.00 C ATOM 550 CZ PHE A 924 -3.239 4.494 -9.320 1.00 0.00 C ATOM 0 H PHE A 924 1.565 6.351 -8.423 1.00 0.00 H new ATOM 0 HA PHE A 924 0.225 8.158 -10.352 1.00 0.00 H new ATOM 0 HB2 PHE A 924 -0.434 7.816 -7.406 1.00 0.00 H new ATOM 0 HB3 PHE A 924 -1.311 8.773 -8.584 1.00 0.00 H new ATOM 0 HD1 PHE A 924 -0.194 5.231 -8.080 1.00 0.00 H new ATOM 0 HD2 PHE A 924 -3.230 7.858 -9.500 1.00 0.00 H new ATOM 0 HE1 PHE A 924 -1.628 3.300 -8.580 1.00 0.00 H new ATOM 0 HE2 PHE A 924 -4.668 5.930 -10.001 1.00 0.00 H new ATOM 0 HZ PHE A 924 -3.871 3.646 -9.537 1.00 0.00 H new ATOM 560 N GLY A 925 1.846 8.935 -7.565 1.00 0.00 N ATOM 561 CA GLY A 925 2.725 9.934 -6.986 1.00 0.00 C ATOM 562 C GLY A 925 4.003 9.333 -6.435 1.00 0.00 C ATOM 563 O GLY A 925 4.037 8.158 -6.072 1.00 0.00 O ATOM 0 H GLY A 925 1.580 8.180 -6.933 1.00 0.00 H new ATOM 0 HA2 GLY A 925 2.974 10.677 -7.743 1.00 0.00 H new ATOM 0 HA3 GLY A 925 2.199 10.457 -6.187 1.00 0.00 H new ATOM 567 N GLU A 926 5.057 10.141 -6.376 1.00 0.00 N ATOM 568 CA GLU A 926 6.344 9.680 -5.868 1.00 0.00 C ATOM 569 C GLU A 926 6.433 9.872 -4.357 1.00 0.00 C ATOM 570 O GLU A 926 6.065 10.922 -3.830 1.00 0.00 O ATOM 571 CB GLU A 926 7.487 10.429 -6.557 1.00 0.00 C ATOM 572 CG GLU A 926 8.862 10.064 -6.024 1.00 0.00 C ATOM 573 CD GLU A 926 9.950 10.989 -6.534 1.00 0.00 C ATOM 574 OE1 GLU A 926 10.522 10.697 -7.605 1.00 0.00 O ATOM 575 OE2 GLU A 926 10.229 12.004 -5.863 1.00 0.00 O ATOM 0 H GLU A 926 5.045 11.117 -6.673 1.00 0.00 H new ATOM 0 HA GLU A 926 6.432 8.616 -6.087 1.00 0.00 H new ATOM 0 HB2 GLU A 926 7.454 10.221 -7.626 1.00 0.00 H new ATOM 0 HB3 GLU A 926 7.333 11.501 -6.436 1.00 0.00 H new ATOM 0 HG2 GLU A 926 8.845 10.095 -4.935 1.00 0.00 H new ATOM 0 HG3 GLU A 926 9.098 9.039 -6.310 1.00 0.00 H new ATOM 582 N VAL A 927 6.925 8.850 -3.664 1.00 0.00 N ATOM 583 CA VAL A 927 7.063 8.905 -2.214 1.00 0.00 C ATOM 584 C VAL A 927 8.389 9.543 -1.812 1.00 0.00 C ATOM 585 O VAL A 927 9.386 9.427 -2.525 1.00 0.00 O ATOM 586 CB VAL A 927 6.971 7.501 -1.587 1.00 0.00 C ATOM 587 CG1 VAL A 927 6.898 7.597 -0.071 1.00 0.00 C ATOM 588 CG2 VAL A 927 5.770 6.749 -2.141 1.00 0.00 C ATOM 0 H VAL A 927 7.235 7.974 -4.084 1.00 0.00 H new ATOM 0 HA VAL A 927 6.241 9.516 -1.841 1.00 0.00 H new ATOM 0 HB VAL A 927 7.871 6.945 -1.848 1.00 0.00 H new ATOM 0 HG11 VAL A 927 6.833 6.595 0.354 1.00 0.00 H new ATOM 0 HG12 VAL A 927 7.792 8.094 0.306 1.00 0.00 H new ATOM 0 HG13 VAL A 927 6.016 8.170 0.215 1.00 0.00 H new ATOM 0 HG21 VAL A 927 5.720 5.759 -1.688 1.00 0.00 H new ATOM 0 HG22 VAL A 927 4.858 7.300 -1.911 1.00 0.00 H new ATOM 0 HG23 VAL A 927 5.871 6.648 -3.222 1.00 0.00 H new ATOM 598 N ILE A 928 8.392 10.216 -0.667 1.00 0.00 N ATOM 599 CA ILE A 928 9.595 10.871 -0.169 1.00 0.00 C ATOM 600 C ILE A 928 9.873 10.483 1.279 1.00 0.00 C ATOM 601 O ILE A 928 11.016 10.216 1.654 1.00 0.00 O ATOM 602 CB ILE A 928 9.483 12.404 -0.267 1.00 0.00 C ATOM 603 CG1 ILE A 928 8.283 12.901 0.541 1.00 0.00 C ATOM 604 CG2 ILE A 928 9.365 12.835 -1.721 1.00 0.00 C ATOM 605 CD1 ILE A 928 8.102 14.402 0.491 1.00 0.00 C ATOM 0 H ILE A 928 7.575 10.322 -0.066 1.00 0.00 H new ATOM 0 HA ILE A 928 10.420 10.535 -0.797 1.00 0.00 H new ATOM 0 HB ILE A 928 10.387 12.847 0.150 1.00 0.00 H new ATOM 0 HG12 ILE A 928 7.379 12.421 0.166 1.00 0.00 H new ATOM 0 HG13 ILE A 928 8.401 12.592 1.579 1.00 0.00 H new ATOM 0 HG21 ILE A 928 9.287 13.921 -1.773 1.00 0.00 H new ATOM 0 HG22 ILE A 928 10.248 12.508 -2.270 1.00 0.00 H new ATOM 0 HG23 ILE A 928 8.476 12.385 -2.163 1.00 0.00 H new ATOM 0 HD11 ILE A 928 7.233 14.684 1.086 1.00 0.00 H new ATOM 0 HD12 ILE A 928 8.990 14.889 0.893 1.00 0.00 H new ATOM 0 HD13 ILE A 928 7.952 14.716 -0.542 1.00 0.00 H new ATOM 617 N LEU A 929 8.822 10.454 2.090 1.00 0.00 N ATOM 618 CA LEU A 929 8.951 10.097 3.499 1.00 0.00 C ATOM 619 C LEU A 929 7.837 9.146 3.924 1.00 0.00 C ATOM 620 O LEU A 929 6.709 9.240 3.440 1.00 0.00 O ATOM 621 CB LEU A 929 8.923 11.355 4.368 1.00 0.00 C ATOM 622 CG LEU A 929 8.652 11.136 5.857 1.00 0.00 C ATOM 623 CD1 LEU A 929 9.853 10.488 6.529 1.00 0.00 C ATOM 624 CD2 LEU A 929 8.305 12.453 6.536 1.00 0.00 C ATOM 0 H LEU A 929 7.870 10.673 1.796 1.00 0.00 H new ATOM 0 HA LEU A 929 9.907 9.590 3.634 1.00 0.00 H new ATOM 0 HB2 LEU A 929 9.881 11.865 4.265 1.00 0.00 H new ATOM 0 HB3 LEU A 929 8.160 12.027 3.975 1.00 0.00 H new ATOM 0 HG LEU A 929 7.800 10.464 5.956 1.00 0.00 H new ATOM 0 HD11 LEU A 929 9.641 10.340 7.588 1.00 0.00 H new ATOM 0 HD12 LEU A 929 10.056 9.524 6.061 1.00 0.00 H new ATOM 0 HD13 LEU A 929 10.724 11.135 6.420 1.00 0.00 H new ATOM 0 HD21 LEU A 929 8.115 12.278 7.595 1.00 0.00 H new ATOM 0 HD22 LEU A 929 9.137 13.149 6.427 1.00 0.00 H new ATOM 0 HD23 LEU A 929 7.414 12.877 6.073 1.00 0.00 H new ATOM 636 N ILE A 930 8.161 8.232 4.833 1.00 0.00 N ATOM 637 CA ILE A 930 7.187 7.267 5.326 1.00 0.00 C ATOM 638 C ILE A 930 7.239 7.161 6.846 1.00 0.00 C ATOM 639 O ILE A 930 8.306 6.970 7.429 1.00 0.00 O ATOM 640 CB ILE A 930 7.420 5.871 4.717 1.00 0.00 C ATOM 641 CG1 ILE A 930 7.356 5.940 3.190 1.00 0.00 C ATOM 642 CG2 ILE A 930 6.394 4.882 5.251 1.00 0.00 C ATOM 643 CD1 ILE A 930 7.914 4.712 2.506 1.00 0.00 C ATOM 0 H ILE A 930 9.091 8.140 5.243 1.00 0.00 H new ATOM 0 HA ILE A 930 6.204 7.628 5.023 1.00 0.00 H new ATOM 0 HB ILE A 930 8.413 5.526 5.005 1.00 0.00 H new ATOM 0 HG12 ILE A 930 6.319 6.077 2.884 1.00 0.00 H new ATOM 0 HG13 ILE A 930 7.907 6.817 2.851 1.00 0.00 H new ATOM 0 HG21 ILE A 930 6.572 3.900 4.812 1.00 0.00 H new ATOM 0 HG22 ILE A 930 6.483 4.816 6.335 1.00 0.00 H new ATOM 0 HG23 ILE A 930 5.392 5.221 4.989 1.00 0.00 H new ATOM 0 HD11 ILE A 930 7.836 4.831 1.425 1.00 0.00 H new ATOM 0 HD12 ILE A 930 8.961 4.585 2.783 1.00 0.00 H new ATOM 0 HD13 ILE A 930 7.348 3.834 2.816 1.00 0.00 H new ATOM 655 N ARG A 931 6.078 7.283 7.482 1.00 0.00 N ATOM 656 CA ARG A 931 5.991 7.201 8.935 1.00 0.00 C ATOM 657 C ARG A 931 5.080 6.053 9.361 1.00 0.00 C ATOM 658 O ARG A 931 3.935 5.958 8.918 1.00 0.00 O ATOM 659 CB ARG A 931 5.471 8.519 9.512 1.00 0.00 C ATOM 660 CG ARG A 931 5.615 8.622 11.021 1.00 0.00 C ATOM 661 CD ARG A 931 5.789 10.066 11.467 1.00 0.00 C ATOM 662 NE ARG A 931 5.902 10.181 12.918 1.00 0.00 N ATOM 663 CZ ARG A 931 6.285 11.290 13.540 1.00 0.00 C ATOM 664 NH1 ARG A 931 6.590 12.374 12.841 1.00 0.00 N ATOM 665 NH2 ARG A 931 6.363 11.317 14.864 1.00 0.00 N ATOM 0 H ARG A 931 5.185 7.439 7.014 1.00 0.00 H new ATOM 0 HA ARG A 931 6.992 7.012 9.323 1.00 0.00 H new ATOM 0 HB2 ARG A 931 6.007 9.346 9.047 1.00 0.00 H new ATOM 0 HB3 ARG A 931 4.420 8.632 9.247 1.00 0.00 H new ATOM 0 HG2 ARG A 931 4.735 8.195 11.502 1.00 0.00 H new ATOM 0 HG3 ARG A 931 6.473 8.034 11.347 1.00 0.00 H new ATOM 0 HD2 ARG A 931 6.680 10.485 11.000 1.00 0.00 H new ATOM 0 HD3 ARG A 931 4.941 10.657 11.122 1.00 0.00 H new ATOM 0 HE ARG A 931 5.674 9.364 13.485 1.00 0.00 H new ATOM 0 HH11 ARG A 931 6.531 12.358 11.823 1.00 0.00 H new ATOM 0 HH12 ARG A 931 6.884 13.225 13.321 1.00 0.00 H new ATOM 0 HH21 ARG A 931 6.129 10.485 15.406 1.00 0.00 H new ATOM 0 HH22 ARG A 931 6.657 12.170 15.340 1.00 0.00 H new ATOM 679 N PHE A 932 5.597 5.182 10.221 1.00 0.00 N ATOM 680 CA PHE A 932 4.831 4.039 10.705 1.00 0.00 C ATOM 681 C PHE A 932 4.103 4.383 12.002 1.00 0.00 C ATOM 682 O PHE A 932 4.726 4.742 13.001 1.00 0.00 O ATOM 683 CB PHE A 932 5.753 2.838 10.928 1.00 0.00 C ATOM 684 CG PHE A 932 6.546 2.458 9.710 1.00 0.00 C ATOM 685 CD1 PHE A 932 5.968 1.709 8.698 1.00 0.00 C ATOM 686 CD2 PHE A 932 7.869 2.848 9.579 1.00 0.00 C ATOM 687 CE1 PHE A 932 6.695 1.357 7.576 1.00 0.00 C ATOM 688 CE2 PHE A 932 8.600 2.499 8.460 1.00 0.00 C ATOM 689 CZ PHE A 932 8.013 1.752 7.457 1.00 0.00 C ATOM 0 H PHE A 932 6.543 5.246 10.597 1.00 0.00 H new ATOM 0 HA PHE A 932 4.089 3.783 9.949 1.00 0.00 H new ATOM 0 HB2 PHE A 932 6.440 3.064 11.743 1.00 0.00 H new ATOM 0 HB3 PHE A 932 5.154 1.984 11.243 1.00 0.00 H new ATOM 0 HD1 PHE A 932 4.938 1.397 8.787 1.00 0.00 H new ATOM 0 HD2 PHE A 932 8.334 3.431 10.360 1.00 0.00 H new ATOM 0 HE1 PHE A 932 6.233 0.774 6.793 1.00 0.00 H new ATOM 0 HE2 PHE A 932 9.630 2.810 8.369 1.00 0.00 H new ATOM 0 HZ PHE A 932 8.583 1.478 6.582 1.00 0.00 H new ATOM 699 N VAL A 933 2.779 4.270 11.977 1.00 0.00 N ATOM 700 CA VAL A 933 1.964 4.567 13.149 1.00 0.00 C ATOM 701 C VAL A 933 1.826 3.344 14.048 1.00 0.00 C ATOM 702 O VAL A 933 1.981 2.210 13.596 1.00 0.00 O ATOM 703 CB VAL A 933 0.560 5.056 12.747 1.00 0.00 C ATOM 704 CG1 VAL A 933 -0.109 5.774 13.909 1.00 0.00 C ATOM 705 CG2 VAL A 933 0.640 5.960 11.526 1.00 0.00 C ATOM 0 H VAL A 933 2.248 3.975 11.158 1.00 0.00 H new ATOM 0 HA VAL A 933 2.474 5.360 13.696 1.00 0.00 H new ATOM 0 HB VAL A 933 -0.048 4.188 12.489 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -1.100 6.112 13.606 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -0.201 5.091 14.754 1.00 0.00 H new ATOM 0 HG13 VAL A 933 0.494 6.634 14.201 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -0.361 6.296 11.256 1.00 0.00 H new ATOM 0 HG22 VAL A 933 1.264 6.824 11.753 1.00 0.00 H new ATOM 0 HG23 VAL A 933 1.074 5.408 10.693 1.00 0.00 H new ATOM 715 N GLU A 934 1.534 3.582 15.322 1.00 0.00 N ATOM 716 CA GLU A 934 1.376 2.498 16.285 1.00 0.00 C ATOM 717 C GLU A 934 0.766 1.266 15.622 1.00 0.00 C ATOM 718 O GLU A 934 1.305 0.164 15.721 1.00 0.00 O ATOM 719 CB GLU A 934 0.498 2.949 17.454 1.00 0.00 C ATOM 720 CG GLU A 934 1.156 3.992 18.342 1.00 0.00 C ATOM 721 CD GLU A 934 2.091 3.379 19.368 1.00 0.00 C ATOM 722 OE1 GLU A 934 1.707 2.365 19.988 1.00 0.00 O ATOM 723 OE2 GLU A 934 3.204 3.913 19.550 1.00 0.00 O ATOM 0 H GLU A 934 1.402 4.515 15.712 1.00 0.00 H new ATOM 0 HA GLU A 934 2.364 2.234 16.662 1.00 0.00 H new ATOM 0 HB2 GLU A 934 -0.435 3.354 17.062 1.00 0.00 H new ATOM 0 HB3 GLU A 934 0.239 2.080 18.059 1.00 0.00 H new ATOM 0 HG2 GLU A 934 1.714 4.693 17.721 1.00 0.00 H new ATOM 0 HG3 GLU A 934 0.384 4.565 18.856 1.00 0.00 H new ATOM 730 N ASP A 935 -0.361 1.463 14.947 1.00 0.00 N ATOM 731 CA ASP A 935 -1.046 0.369 14.267 1.00 0.00 C ATOM 732 C ASP A 935 -1.261 0.696 12.792 1.00 0.00 C ATOM 733 O ASP A 935 -1.391 -0.201 11.959 1.00 0.00 O ATOM 734 CB ASP A 935 -2.389 0.083 14.940 1.00 0.00 C ATOM 735 CG ASP A 935 -2.815 -1.364 14.789 1.00 0.00 C ATOM 736 OD1 ASP A 935 -1.930 -2.231 14.631 1.00 0.00 O ATOM 737 OD2 ASP A 935 -4.035 -1.630 14.829 1.00 0.00 O ATOM 0 H ASP A 935 -0.820 2.369 14.856 1.00 0.00 H new ATOM 0 HA ASP A 935 -0.418 -0.519 14.336 1.00 0.00 H new ATOM 0 HB2 ASP A 935 -2.321 0.330 15.999 1.00 0.00 H new ATOM 0 HB3 ASP A 935 -3.153 0.731 14.510 1.00 0.00 H new ATOM 742 N LYS A 936 -1.298 1.986 12.477 1.00 0.00 N ATOM 743 CA LYS A 936 -1.497 2.433 11.103 1.00 0.00 C ATOM 744 C LYS A 936 -0.164 2.768 10.442 1.00 0.00 C ATOM 745 O LYS A 936 0.879 2.771 11.094 1.00 0.00 O ATOM 746 CB LYS A 936 -2.416 3.657 11.072 1.00 0.00 C ATOM 747 CG LYS A 936 -3.246 3.761 9.804 1.00 0.00 C ATOM 748 CD LYS A 936 -4.426 4.700 9.986 1.00 0.00 C ATOM 749 CE LYS A 936 -5.602 4.293 9.112 1.00 0.00 C ATOM 750 NZ LYS A 936 -5.170 3.930 7.734 1.00 0.00 N ATOM 0 H LYS A 936 -1.193 2.741 13.155 1.00 0.00 H new ATOM 0 HA LYS A 936 -1.964 1.621 10.546 1.00 0.00 H new ATOM 0 HB2 LYS A 936 -3.085 3.621 11.932 1.00 0.00 H new ATOM 0 HB3 LYS A 936 -1.811 4.558 11.176 1.00 0.00 H new ATOM 0 HG2 LYS A 936 -2.619 4.117 8.986 1.00 0.00 H new ATOM 0 HG3 LYS A 936 -3.607 2.772 9.522 1.00 0.00 H new ATOM 0 HD2 LYS A 936 -4.732 4.702 11.032 1.00 0.00 H new ATOM 0 HD3 LYS A 936 -4.124 5.718 9.740 1.00 0.00 H new ATOM 0 HE2 LYS A 936 -6.116 3.446 9.566 1.00 0.00 H new ATOM 0 HE3 LYS A 936 -6.319 5.112 9.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 936 -5.709 4.490 7.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 936 -4.155 4.128 7.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 936 -5.344 2.918 7.571 1.00 0.00 H new ATOM 764 N MET A 937 -0.208 3.050 9.144 1.00 0.00 N ATOM 765 CA MET A 937 0.997 3.389 8.395 1.00 0.00 C ATOM 766 C MET A 937 0.779 4.640 7.550 1.00 0.00 C ATOM 767 O MET A 937 -0.033 4.641 6.625 1.00 0.00 O ATOM 768 CB MET A 937 1.412 2.220 7.499 1.00 0.00 C ATOM 769 CG MET A 937 2.558 2.553 6.557 1.00 0.00 C ATOM 770 SD MET A 937 3.172 1.108 5.672 1.00 0.00 S ATOM 771 CE MET A 937 3.781 1.866 4.167 1.00 0.00 C ATOM 0 H MET A 937 -1.064 3.051 8.589 1.00 0.00 H new ATOM 0 HA MET A 937 1.794 3.590 9.110 1.00 0.00 H new ATOM 0 HB2 MET A 937 1.702 1.377 8.126 1.00 0.00 H new ATOM 0 HB3 MET A 937 0.551 1.900 6.912 1.00 0.00 H new ATOM 0 HG2 MET A 937 2.226 3.301 5.837 1.00 0.00 H new ATOM 0 HG3 MET A 937 3.373 2.999 7.127 1.00 0.00 H new ATOM 0 HE1 MET A 937 4.194 1.097 3.514 1.00 0.00 H new ATOM 0 HE2 MET A 937 2.962 2.373 3.658 1.00 0.00 H new ATOM 0 HE3 MET A 937 4.559 2.589 4.413 1.00 0.00 H new ATOM 781 N TRP A 938 1.507 5.702 7.875 1.00 0.00 N ATOM 782 CA TRP A 938 1.392 6.959 7.145 1.00 0.00 C ATOM 783 C TRP A 938 2.447 7.051 6.048 1.00 0.00 C ATOM 784 O TRP A 938 3.535 6.487 6.170 1.00 0.00 O ATOM 785 CB TRP A 938 1.531 8.143 8.103 1.00 0.00 C ATOM 786 CG TRP A 938 0.446 8.203 9.135 1.00 0.00 C ATOM 787 CD1 TRP A 938 -0.563 7.300 9.317 1.00 0.00 C ATOM 788 CD2 TRP A 938 0.261 9.219 10.127 1.00 0.00 C ATOM 789 NE1 TRP A 938 -1.365 7.694 10.361 1.00 0.00 N ATOM 790 CE2 TRP A 938 -0.880 8.868 10.875 1.00 0.00 C ATOM 791 CE3 TRP A 938 0.948 10.390 10.457 1.00 0.00 C ATOM 792 CZ2 TRP A 938 -1.346 9.647 11.930 1.00 0.00 C ATOM 793 CZ3 TRP A 938 0.484 11.162 11.504 1.00 0.00 C ATOM 794 CH2 TRP A 938 -0.654 10.788 12.231 1.00 0.00 C ATOM 0 H TRP A 938 2.183 5.718 8.639 1.00 0.00 H new ATOM 0 HA TRP A 938 0.407 6.990 6.679 1.00 0.00 H new ATOM 0 HB2 TRP A 938 2.497 8.084 8.605 1.00 0.00 H new ATOM 0 HB3 TRP A 938 1.527 9.069 7.528 1.00 0.00 H new ATOM 0 HD1 TRP A 938 -0.709 6.407 8.727 1.00 0.00 H new ATOM 0 HE1 TRP A 938 -2.187 7.194 10.698 1.00 0.00 H new ATOM 0 HE3 TRP A 938 1.826 10.686 9.903 1.00 0.00 H new ATOM 0 HZ2 TRP A 938 -2.223 9.361 12.491 1.00 0.00 H new ATOM 0 HZ3 TRP A 938 1.007 12.069 11.767 1.00 0.00 H new ATOM 0 HH2 TRP A 938 -0.991 11.413 13.045 1.00 0.00 H new ATOM 805 N VAL A 939 2.119 7.765 4.975 1.00 0.00 N ATOM 806 CA VAL A 939 3.040 7.931 3.857 1.00 0.00 C ATOM 807 C VAL A 939 2.949 9.337 3.275 1.00 0.00 C ATOM 808 O VAL A 939 1.862 9.818 2.949 1.00 0.00 O ATOM 809 CB VAL A 939 2.759 6.906 2.742 1.00 0.00 C ATOM 810 CG1 VAL A 939 3.720 7.104 1.580 1.00 0.00 C ATOM 811 CG2 VAL A 939 2.852 5.489 3.286 1.00 0.00 C ATOM 0 H VAL A 939 1.223 8.237 4.857 1.00 0.00 H new ATOM 0 HA VAL A 939 4.045 7.767 4.247 1.00 0.00 H new ATOM 0 HB VAL A 939 1.745 7.064 2.374 1.00 0.00 H new ATOM 0 HG11 VAL A 939 3.506 6.371 0.802 1.00 0.00 H new ATOM 0 HG12 VAL A 939 3.599 8.109 1.175 1.00 0.00 H new ATOM 0 HG13 VAL A 939 4.744 6.974 1.929 1.00 0.00 H new ATOM 0 HG21 VAL A 939 2.651 4.778 2.485 1.00 0.00 H new ATOM 0 HG22 VAL A 939 3.853 5.316 3.682 1.00 0.00 H new ATOM 0 HG23 VAL A 939 2.119 5.356 4.082 1.00 0.00 H new ATOM 821 N THR A 940 4.097 9.993 3.145 1.00 0.00 N ATOM 822 CA THR A 940 4.148 11.345 2.603 1.00 0.00 C ATOM 823 C THR A 940 4.458 11.327 1.110 1.00 0.00 C ATOM 824 O THR A 940 5.129 10.421 0.616 1.00 0.00 O ATOM 825 CB THR A 940 5.206 12.201 3.325 1.00 0.00 C ATOM 826 OG1 THR A 940 4.728 12.580 4.620 1.00 0.00 O ATOM 827 CG2 THR A 940 5.538 13.446 2.517 1.00 0.00 C ATOM 0 H THR A 940 5.005 9.610 3.408 1.00 0.00 H new ATOM 0 HA THR A 940 3.164 11.787 2.762 1.00 0.00 H new ATOM 0 HB THR A 940 6.112 11.605 3.433 1.00 0.00 H new ATOM 0 HG1 THR A 940 5.407 13.122 5.073 1.00 0.00 H new ATOM 0 HG21 THR A 940 6.287 14.035 3.047 1.00 0.00 H new ATOM 0 HG22 THR A 940 5.929 13.154 1.542 1.00 0.00 H new ATOM 0 HG23 THR A 940 4.636 14.043 2.382 1.00 0.00 H new ATOM 835 N PHE A 941 3.967 12.335 0.396 1.00 0.00 N ATOM 836 CA PHE A 941 4.192 12.434 -1.041 1.00 0.00 C ATOM 837 C PHE A 941 4.718 13.817 -1.415 1.00 0.00 C ATOM 838 O PHE A 941 4.346 14.821 -0.805 1.00 0.00 O ATOM 839 CB PHE A 941 2.896 12.146 -1.803 1.00 0.00 C ATOM 840 CG PHE A 941 2.559 10.684 -1.879 1.00 0.00 C ATOM 841 CD1 PHE A 941 2.357 9.945 -0.724 1.00 0.00 C ATOM 842 CD2 PHE A 941 2.443 10.050 -3.105 1.00 0.00 C ATOM 843 CE1 PHE A 941 2.046 8.600 -0.791 1.00 0.00 C ATOM 844 CE2 PHE A 941 2.131 8.705 -3.178 1.00 0.00 C ATOM 845 CZ PHE A 941 1.934 7.979 -2.019 1.00 0.00 C ATOM 0 H PHE A 941 3.411 13.094 0.789 1.00 0.00 H new ATOM 0 HA PHE A 941 4.941 11.692 -1.318 1.00 0.00 H new ATOM 0 HB2 PHE A 941 2.075 12.676 -1.321 1.00 0.00 H new ATOM 0 HB3 PHE A 941 2.982 12.544 -2.814 1.00 0.00 H new ATOM 0 HD1 PHE A 941 2.444 10.426 0.239 1.00 0.00 H new ATOM 0 HD2 PHE A 941 2.598 10.612 -4.014 1.00 0.00 H new ATOM 0 HE1 PHE A 941 1.891 8.035 0.116 1.00 0.00 H new ATOM 0 HE2 PHE A 941 2.041 8.222 -4.140 1.00 0.00 H new ATOM 0 HZ PHE A 941 1.693 6.928 -2.074 1.00 0.00 H new ATOM 855 N LEU A 942 5.585 13.862 -2.420 1.00 0.00 N ATOM 856 CA LEU A 942 6.163 15.121 -2.876 1.00 0.00 C ATOM 857 C LEU A 942 5.157 16.260 -2.748 1.00 0.00 C ATOM 858 O LEU A 942 5.359 17.194 -1.973 1.00 0.00 O ATOM 859 CB LEU A 942 6.627 14.995 -4.329 1.00 0.00 C ATOM 860 CG LEU A 942 7.212 16.260 -4.958 1.00 0.00 C ATOM 861 CD1 LEU A 942 8.646 16.471 -4.497 1.00 0.00 C ATOM 862 CD2 LEU A 942 7.144 16.181 -6.476 1.00 0.00 C ATOM 0 H LEU A 942 5.903 13.041 -2.935 1.00 0.00 H new ATOM 0 HA LEU A 942 7.022 15.348 -2.245 1.00 0.00 H new ATOM 0 HB2 LEU A 942 7.377 14.206 -4.383 1.00 0.00 H new ATOM 0 HB3 LEU A 942 5.780 14.671 -4.933 1.00 0.00 H new ATOM 0 HG LEU A 942 6.618 17.113 -4.632 1.00 0.00 H new ATOM 0 HD11 LEU A 942 9.046 17.376 -4.955 1.00 0.00 H new ATOM 0 HD12 LEU A 942 8.668 16.573 -3.412 1.00 0.00 H new ATOM 0 HD13 LEU A 942 9.253 15.616 -4.793 1.00 0.00 H new ATOM 0 HD21 LEU A 942 7.565 17.090 -6.907 1.00 0.00 H new ATOM 0 HD22 LEU A 942 7.714 15.318 -6.821 1.00 0.00 H new ATOM 0 HD23 LEU A 942 6.105 16.078 -6.789 1.00 0.00 H new ATOM 874 N GLU A 943 4.073 16.174 -3.513 1.00 0.00 N ATOM 875 CA GLU A 943 3.035 17.198 -3.483 1.00 0.00 C ATOM 876 C GLU A 943 1.725 16.630 -2.944 1.00 0.00 C ATOM 877 O GLU A 943 1.555 15.415 -2.850 1.00 0.00 O ATOM 878 CB GLU A 943 2.816 17.774 -4.883 1.00 0.00 C ATOM 879 CG GLU A 943 4.089 18.279 -5.540 1.00 0.00 C ATOM 880 CD GLU A 943 3.818 19.097 -6.787 1.00 0.00 C ATOM 881 OE1 GLU A 943 3.625 18.494 -7.863 1.00 0.00 O ATOM 882 OE2 GLU A 943 3.798 20.342 -6.687 1.00 0.00 O ATOM 0 H GLU A 943 3.891 15.407 -4.160 1.00 0.00 H new ATOM 0 HA GLU A 943 3.366 17.995 -2.817 1.00 0.00 H new ATOM 0 HB2 GLU A 943 2.370 17.007 -5.516 1.00 0.00 H new ATOM 0 HB3 GLU A 943 2.099 18.593 -4.822 1.00 0.00 H new ATOM 0 HG2 GLU A 943 4.646 18.886 -4.826 1.00 0.00 H new ATOM 0 HG3 GLU A 943 4.722 17.430 -5.798 1.00 0.00 H new ATOM 889 N GLY A 944 0.801 17.519 -2.591 1.00 0.00 N ATOM 890 CA GLY A 944 -0.481 17.087 -2.066 1.00 0.00 C ATOM 891 C GLY A 944 -1.309 16.344 -3.095 1.00 0.00 C ATOM 892 O GLY A 944 -1.754 15.222 -2.851 1.00 0.00 O ATOM 0 H GLY A 944 0.918 18.530 -2.659 1.00 0.00 H new ATOM 0 HA2 GLY A 944 -0.318 16.443 -1.202 1.00 0.00 H new ATOM 0 HA3 GLY A 944 -1.038 17.956 -1.715 1.00 0.00 H new ATOM 896 N SER A 945 -1.518 16.970 -4.248 1.00 0.00 N ATOM 897 CA SER A 945 -2.303 16.363 -5.316 1.00 0.00 C ATOM 898 C SER A 945 -1.854 14.927 -5.572 1.00 0.00 C ATOM 899 O SER A 945 -2.634 14.093 -6.031 1.00 0.00 O ATOM 900 CB SER A 945 -2.178 17.185 -6.601 1.00 0.00 C ATOM 901 OG SER A 945 -0.833 17.240 -7.042 1.00 0.00 O ATOM 0 H SER A 945 -1.155 17.898 -4.467 1.00 0.00 H new ATOM 0 HA SER A 945 -3.347 16.349 -5.002 1.00 0.00 H new ATOM 0 HB2 SER A 945 -2.802 16.746 -7.380 1.00 0.00 H new ATOM 0 HB3 SER A 945 -2.549 18.195 -6.428 1.00 0.00 H new ATOM 0 HG SER A 945 -0.780 17.769 -7.865 1.00 0.00 H new ATOM 907 N SER A 946 -0.590 14.647 -5.272 1.00 0.00 N ATOM 908 CA SER A 946 -0.034 13.314 -5.472 1.00 0.00 C ATOM 909 C SER A 946 -0.676 12.309 -4.522 1.00 0.00 C ATOM 910 O SER A 946 -0.875 11.146 -4.872 1.00 0.00 O ATOM 911 CB SER A 946 1.482 13.334 -5.263 1.00 0.00 C ATOM 912 OG SER A 946 2.118 14.167 -6.218 1.00 0.00 O ATOM 0 H SER A 946 0.069 15.326 -4.889 1.00 0.00 H new ATOM 0 HA SER A 946 -0.249 13.008 -6.496 1.00 0.00 H new ATOM 0 HB2 SER A 946 1.709 13.689 -4.258 1.00 0.00 H new ATOM 0 HB3 SER A 946 1.876 12.321 -5.340 1.00 0.00 H new ATOM 0 HG SER A 946 3.085 14.164 -6.062 1.00 0.00 H new ATOM 918 N ALA A 947 -0.999 12.767 -3.317 1.00 0.00 N ATOM 919 CA ALA A 947 -1.621 11.909 -2.316 1.00 0.00 C ATOM 920 C ALA A 947 -3.117 11.759 -2.574 1.00 0.00 C ATOM 921 O ALA A 947 -3.772 10.887 -2.001 1.00 0.00 O ATOM 922 CB ALA A 947 -1.378 12.465 -0.920 1.00 0.00 C ATOM 0 H ALA A 947 -0.840 13.727 -3.010 1.00 0.00 H new ATOM 0 HA ALA A 947 -1.166 10.921 -2.387 1.00 0.00 H new ATOM 0 HB1 ALA A 947 -1.848 11.814 -0.182 1.00 0.00 H new ATOM 0 HB2 ALA A 947 -0.306 12.514 -0.730 1.00 0.00 H new ATOM 0 HB3 ALA A 947 -1.806 13.465 -0.847 1.00 0.00 H new ATOM 928 N LEU A 948 -3.652 12.615 -3.438 1.00 0.00 N ATOM 929 CA LEU A 948 -5.071 12.578 -3.771 1.00 0.00 C ATOM 930 C LEU A 948 -5.336 11.611 -4.921 1.00 0.00 C ATOM 931 O LEU A 948 -6.449 11.112 -5.082 1.00 0.00 O ATOM 932 CB LEU A 948 -5.564 13.978 -4.144 1.00 0.00 C ATOM 933 CG LEU A 948 -5.141 15.110 -3.207 1.00 0.00 C ATOM 934 CD1 LEU A 948 -5.516 16.460 -3.798 1.00 0.00 C ATOM 935 CD2 LEU A 948 -5.773 14.932 -1.835 1.00 0.00 C ATOM 0 H LEU A 948 -3.124 13.343 -3.920 1.00 0.00 H new ATOM 0 HA LEU A 948 -5.616 12.229 -2.894 1.00 0.00 H new ATOM 0 HB2 LEU A 948 -5.208 14.212 -5.147 1.00 0.00 H new ATOM 0 HB3 LEU A 948 -6.653 13.958 -4.189 1.00 0.00 H new ATOM 0 HG LEU A 948 -4.058 15.075 -3.092 1.00 0.00 H new ATOM 0 HD11 LEU A 948 -5.207 17.254 -3.117 1.00 0.00 H new ATOM 0 HD12 LEU A 948 -5.015 16.589 -4.757 1.00 0.00 H new ATOM 0 HD13 LEU A 948 -6.595 16.506 -3.944 1.00 0.00 H new ATOM 0 HD21 LEU A 948 -5.460 15.747 -1.182 1.00 0.00 H new ATOM 0 HD22 LEU A 948 -6.859 14.940 -1.931 1.00 0.00 H new ATOM 0 HD23 LEU A 948 -5.453 13.982 -1.408 1.00 0.00 H new ATOM 947 N ASN A 949 -4.304 11.349 -5.716 1.00 0.00 N ATOM 948 CA ASN A 949 -4.424 10.440 -6.850 1.00 0.00 C ATOM 949 C ASN A 949 -4.209 8.994 -6.413 1.00 0.00 C ATOM 950 O ASN A 949 -4.882 8.082 -6.894 1.00 0.00 O ATOM 951 CB ASN A 949 -3.414 10.811 -7.938 1.00 0.00 C ATOM 952 CG ASN A 949 -3.934 11.894 -8.864 1.00 0.00 C ATOM 953 OD1 ASN A 949 -5.129 12.188 -8.884 1.00 0.00 O ATOM 954 ND2 ASN A 949 -3.035 12.494 -9.635 1.00 0.00 N ATOM 0 H ASN A 949 -3.375 11.753 -5.596 1.00 0.00 H new ATOM 0 HA ASN A 949 -5.432 10.534 -7.253 1.00 0.00 H new ATOM 0 HB2 ASN A 949 -2.489 11.149 -7.471 1.00 0.00 H new ATOM 0 HB3 ASN A 949 -3.170 9.923 -8.522 1.00 0.00 H new ATOM 0 HD21 ASN A 949 -3.325 13.231 -10.277 1.00 0.00 H new ATOM 0 HD22 ASN A 949 -2.054 12.218 -9.585 1.00 0.00 H new ATOM 961 N VAL A 950 -3.267 8.792 -5.498 1.00 0.00 N ATOM 962 CA VAL A 950 -2.964 7.458 -4.994 1.00 0.00 C ATOM 963 C VAL A 950 -4.185 6.829 -4.333 1.00 0.00 C ATOM 964 O VAL A 950 -4.277 5.607 -4.207 1.00 0.00 O ATOM 965 CB VAL A 950 -1.805 7.491 -3.980 1.00 0.00 C ATOM 966 CG1 VAL A 950 -2.247 8.154 -2.685 1.00 0.00 C ATOM 967 CG2 VAL A 950 -1.286 6.085 -3.718 1.00 0.00 C ATOM 0 H VAL A 950 -2.700 9.536 -5.090 1.00 0.00 H new ATOM 0 HA VAL A 950 -2.669 6.855 -5.853 1.00 0.00 H new ATOM 0 HB VAL A 950 -0.992 8.081 -4.403 1.00 0.00 H new ATOM 0 HG11 VAL A 950 -1.415 8.168 -1.981 1.00 0.00 H new ATOM 0 HG12 VAL A 950 -2.566 9.176 -2.890 1.00 0.00 H new ATOM 0 HG13 VAL A 950 -3.077 7.594 -2.254 1.00 0.00 H new ATOM 0 HG21 VAL A 950 -0.468 6.127 -2.999 1.00 0.00 H new ATOM 0 HG22 VAL A 950 -2.091 5.469 -3.316 1.00 0.00 H new ATOM 0 HG23 VAL A 950 -0.928 5.650 -4.651 1.00 0.00 H new ATOM 977 N LEU A 951 -5.122 7.672 -3.912 1.00 0.00 N ATOM 978 CA LEU A 951 -6.340 7.199 -3.263 1.00 0.00 C ATOM 979 C LEU A 951 -7.002 6.097 -4.084 1.00 0.00 C ATOM 980 O LEU A 951 -7.763 5.287 -3.555 1.00 0.00 O ATOM 981 CB LEU A 951 -7.318 8.359 -3.063 1.00 0.00 C ATOM 982 CG LEU A 951 -7.006 9.308 -1.906 1.00 0.00 C ATOM 983 CD1 LEU A 951 -7.880 10.550 -1.983 1.00 0.00 C ATOM 984 CD2 LEU A 951 -7.195 8.602 -0.571 1.00 0.00 C ATOM 0 H LEU A 951 -5.062 8.686 -4.008 1.00 0.00 H new ATOM 0 HA LEU A 951 -6.068 6.789 -2.290 1.00 0.00 H new ATOM 0 HB2 LEU A 951 -7.354 8.941 -3.984 1.00 0.00 H new ATOM 0 HB3 LEU A 951 -8.315 7.945 -2.909 1.00 0.00 H new ATOM 0 HG LEU A 951 -5.964 9.617 -1.986 1.00 0.00 H new ATOM 0 HD11 LEU A 951 -7.643 11.214 -1.151 1.00 0.00 H new ATOM 0 HD12 LEU A 951 -7.695 11.068 -2.924 1.00 0.00 H new ATOM 0 HD13 LEU A 951 -8.929 10.260 -1.929 1.00 0.00 H new ATOM 0 HD21 LEU A 951 -6.968 9.293 0.241 1.00 0.00 H new ATOM 0 HD22 LEU A 951 -8.227 8.263 -0.482 1.00 0.00 H new ATOM 0 HD23 LEU A 951 -6.525 7.744 -0.515 1.00 0.00 H new ATOM 996 N SER A 952 -6.706 6.072 -5.380 1.00 0.00 N ATOM 997 CA SER A 952 -7.273 5.071 -6.275 1.00 0.00 C ATOM 998 C SER A 952 -6.951 3.661 -5.786 1.00 0.00 C ATOM 999 O SER A 952 -7.555 2.684 -6.231 1.00 0.00 O ATOM 1000 CB SER A 952 -6.739 5.264 -7.695 1.00 0.00 C ATOM 1001 OG SER A 952 -6.939 6.595 -8.138 1.00 0.00 O ATOM 0 H SER A 952 -6.076 6.734 -5.833 1.00 0.00 H new ATOM 0 HA SER A 952 -8.356 5.197 -6.282 1.00 0.00 H new ATOM 0 HB2 SER A 952 -5.676 5.024 -7.723 1.00 0.00 H new ATOM 0 HB3 SER A 952 -7.240 4.573 -8.373 1.00 0.00 H new ATOM 0 HG SER A 952 -6.238 7.172 -7.768 1.00 0.00 H new ATOM 1007 N LEU A 953 -5.996 3.564 -4.868 1.00 0.00 N ATOM 1008 CA LEU A 953 -5.593 2.275 -4.318 1.00 0.00 C ATOM 1009 C LEU A 953 -6.367 1.961 -3.041 1.00 0.00 C ATOM 1010 O LEU A 953 -6.032 1.028 -2.314 1.00 0.00 O ATOM 1011 CB LEU A 953 -4.090 2.268 -4.031 1.00 0.00 C ATOM 1012 CG LEU A 953 -3.174 2.277 -5.255 1.00 0.00 C ATOM 1013 CD1 LEU A 953 -1.758 2.665 -4.858 1.00 0.00 C ATOM 1014 CD2 LEU A 953 -3.184 0.917 -5.939 1.00 0.00 C ATOM 0 H LEU A 953 -5.487 4.362 -4.489 1.00 0.00 H new ATOM 0 HA LEU A 953 -5.820 1.506 -5.057 1.00 0.00 H new ATOM 0 HB2 LEU A 953 -3.853 3.138 -3.418 1.00 0.00 H new ATOM 0 HB3 LEU A 953 -3.858 1.385 -3.435 1.00 0.00 H new ATOM 0 HG LEU A 953 -3.549 3.019 -5.960 1.00 0.00 H new ATOM 0 HD11 LEU A 953 -1.120 2.666 -5.742 1.00 0.00 H new ATOM 0 HD12 LEU A 953 -1.764 3.660 -4.414 1.00 0.00 H new ATOM 0 HD13 LEU A 953 -1.373 1.947 -4.134 1.00 0.00 H new ATOM 0 HD21 LEU A 953 -2.527 0.942 -6.808 1.00 0.00 H new ATOM 0 HD22 LEU A 953 -2.834 0.156 -5.241 1.00 0.00 H new ATOM 0 HD23 LEU A 953 -4.198 0.678 -6.258 1.00 0.00 H new ATOM 1026 N ASN A 954 -7.406 2.748 -2.777 1.00 0.00 N ATOM 1027 CA ASN A 954 -8.229 2.553 -1.589 1.00 0.00 C ATOM 1028 C ASN A 954 -8.933 1.200 -1.631 1.00 0.00 C ATOM 1029 O ASN A 954 -9.757 0.944 -2.507 1.00 0.00 O ATOM 1030 CB ASN A 954 -9.263 3.675 -1.470 1.00 0.00 C ATOM 1031 CG ASN A 954 -10.365 3.557 -2.505 1.00 0.00 C ATOM 1032 OD1 ASN A 954 -10.113 3.628 -3.708 1.00 0.00 O ATOM 1033 ND2 ASN A 954 -11.596 3.375 -2.040 1.00 0.00 N ATOM 0 H ASN A 954 -7.697 3.526 -3.369 1.00 0.00 H new ATOM 0 HA ASN A 954 -7.576 2.576 -0.717 1.00 0.00 H new ATOM 0 HB2 ASN A 954 -9.702 3.657 -0.472 1.00 0.00 H new ATOM 0 HB3 ASN A 954 -8.765 4.638 -1.582 1.00 0.00 H new ATOM 0 HD21 ASN A 954 -12.378 3.288 -2.689 1.00 0.00 H new ATOM 0 HD22 ASN A 954 -11.759 3.322 -1.034 1.00 0.00 H new ATOM 1040 N GLY A 955 -8.601 0.337 -0.675 1.00 0.00 N ATOM 1041 CA GLY A 955 -9.210 -0.979 -0.621 1.00 0.00 C ATOM 1042 C GLY A 955 -8.423 -2.016 -1.398 1.00 0.00 C ATOM 1043 O GLY A 955 -8.493 -3.209 -1.103 1.00 0.00 O ATOM 0 H GLY A 955 -7.922 0.526 0.062 1.00 0.00 H new ATOM 0 HA2 GLY A 955 -9.293 -1.295 0.419 1.00 0.00 H new ATOM 0 HA3 GLY A 955 -10.223 -0.923 -1.019 1.00 0.00 H new ATOM 1047 N LYS A 956 -7.672 -1.560 -2.395 1.00 0.00 N ATOM 1048 CA LYS A 956 -6.868 -2.456 -3.218 1.00 0.00 C ATOM 1049 C LYS A 956 -6.171 -3.506 -2.359 1.00 0.00 C ATOM 1050 O LYS A 956 -5.501 -3.176 -1.381 1.00 0.00 O ATOM 1051 CB LYS A 956 -5.829 -1.658 -4.010 1.00 0.00 C ATOM 1052 CG LYS A 956 -5.421 -2.319 -5.315 1.00 0.00 C ATOM 1053 CD LYS A 956 -4.244 -3.261 -5.120 1.00 0.00 C ATOM 1054 CE LYS A 956 -3.767 -3.838 -6.443 1.00 0.00 C ATOM 1055 NZ LYS A 956 -4.672 -4.913 -6.938 1.00 0.00 N ATOM 0 H LYS A 956 -7.603 -0.575 -2.653 1.00 0.00 H new ATOM 0 HA LYS A 956 -7.534 -2.966 -3.914 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -6.230 -0.667 -4.224 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -4.943 -1.517 -3.391 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -6.267 -2.872 -5.724 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -5.158 -1.553 -6.045 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -3.425 -2.727 -4.638 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -4.533 -4.072 -4.451 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -3.708 -3.043 -7.186 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -2.760 -4.238 -6.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -4.312 -5.281 -7.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -4.709 -5.684 -6.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -5.627 -4.526 -7.077 1.00 0.00 H new ATOM 1069 N GLU A 957 -6.333 -4.772 -2.732 1.00 0.00 N ATOM 1070 CA GLU A 957 -5.718 -5.869 -1.995 1.00 0.00 C ATOM 1071 C GLU A 957 -4.392 -6.277 -2.631 1.00 0.00 C ATOM 1072 O GLU A 957 -4.320 -6.529 -3.835 1.00 0.00 O ATOM 1073 CB GLU A 957 -6.663 -7.072 -1.945 1.00 0.00 C ATOM 1074 CG GLU A 957 -6.015 -8.333 -1.400 1.00 0.00 C ATOM 1075 CD GLU A 957 -7.003 -9.237 -0.688 1.00 0.00 C ATOM 1076 OE1 GLU A 957 -7.910 -9.770 -1.361 1.00 0.00 O ATOM 1077 OE2 GLU A 957 -6.869 -9.411 0.541 1.00 0.00 O ATOM 0 H GLU A 957 -6.884 -5.063 -3.539 1.00 0.00 H new ATOM 0 HA GLU A 957 -5.523 -5.526 -0.979 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -7.525 -6.821 -1.327 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -7.038 -7.271 -2.949 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -5.552 -8.882 -2.220 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -5.218 -8.058 -0.710 1.00 0.00 H new ATOM 1084 N LEU A 958 -3.346 -6.339 -1.815 1.00 0.00 N ATOM 1085 CA LEU A 958 -2.021 -6.715 -2.297 1.00 0.00 C ATOM 1086 C LEU A 958 -1.358 -7.708 -1.347 1.00 0.00 C ATOM 1087 O LEU A 958 -1.654 -7.732 -0.152 1.00 0.00 O ATOM 1088 CB LEU A 958 -1.141 -5.473 -2.451 1.00 0.00 C ATOM 1089 CG LEU A 958 0.073 -5.621 -3.368 1.00 0.00 C ATOM 1090 CD1 LEU A 958 -0.367 -5.918 -4.793 1.00 0.00 C ATOM 1091 CD2 LEU A 958 0.931 -4.365 -3.323 1.00 0.00 C ATOM 0 H LEU A 958 -3.389 -6.134 -0.817 1.00 0.00 H new ATOM 0 HA LEU A 958 -2.137 -7.193 -3.270 1.00 0.00 H new ATOM 0 HB2 LEU A 958 -1.759 -4.659 -2.828 1.00 0.00 H new ATOM 0 HB3 LEU A 958 -0.791 -5.176 -1.463 1.00 0.00 H new ATOM 0 HG LEU A 958 0.672 -6.459 -3.013 1.00 0.00 H new ATOM 0 HD11 LEU A 958 0.511 -6.020 -5.431 1.00 0.00 H new ATOM 0 HD12 LEU A 958 -0.939 -6.846 -4.811 1.00 0.00 H new ATOM 0 HD13 LEU A 958 -0.989 -5.101 -5.159 1.00 0.00 H new ATOM 0 HD21 LEU A 958 1.791 -4.488 -3.982 1.00 0.00 H new ATOM 0 HD22 LEU A 958 0.341 -3.509 -3.652 1.00 0.00 H new ATOM 0 HD23 LEU A 958 1.276 -4.197 -2.303 1.00 0.00 H new ATOM 1103 N LEU A 959 -0.459 -8.523 -1.886 1.00 0.00 N ATOM 1104 CA LEU A 959 0.249 -9.517 -1.087 1.00 0.00 C ATOM 1105 C LEU A 959 -0.702 -10.218 -0.122 1.00 0.00 C ATOM 1106 O LEU A 959 -0.422 -10.328 1.071 1.00 0.00 O ATOM 1107 CB LEU A 959 1.388 -8.857 -0.308 1.00 0.00 C ATOM 1108 CG LEU A 959 2.655 -8.547 -1.106 1.00 0.00 C ATOM 1109 CD1 LEU A 959 3.559 -7.604 -0.328 1.00 0.00 C ATOM 1110 CD2 LEU A 959 3.394 -9.831 -1.454 1.00 0.00 C ATOM 0 H LEU A 959 -0.203 -8.515 -2.873 1.00 0.00 H new ATOM 0 HA LEU A 959 0.665 -10.263 -1.765 1.00 0.00 H new ATOM 0 HB2 LEU A 959 1.016 -7.927 0.122 1.00 0.00 H new ATOM 0 HB3 LEU A 959 1.657 -9.507 0.524 1.00 0.00 H new ATOM 0 HG LEU A 959 2.365 -8.055 -2.034 1.00 0.00 H new ATOM 0 HD11 LEU A 959 4.455 -7.395 -0.912 1.00 0.00 H new ATOM 0 HD12 LEU A 959 3.029 -6.672 -0.131 1.00 0.00 H new ATOM 0 HD13 LEU A 959 3.842 -8.068 0.617 1.00 0.00 H new ATOM 0 HD21 LEU A 959 4.293 -9.591 -2.022 1.00 0.00 H new ATOM 0 HD22 LEU A 959 3.672 -10.351 -0.537 1.00 0.00 H new ATOM 0 HD23 LEU A 959 2.747 -10.472 -2.053 1.00 0.00 H new ATOM 1122 N ASN A 960 -1.828 -10.690 -0.647 1.00 0.00 N ATOM 1123 CA ASN A 960 -2.820 -11.382 0.168 1.00 0.00 C ATOM 1124 C ASN A 960 -3.113 -10.603 1.446 1.00 0.00 C ATOM 1125 O ASN A 960 -3.195 -11.178 2.531 1.00 0.00 O ATOM 1126 CB ASN A 960 -2.333 -12.790 0.516 1.00 0.00 C ATOM 1127 CG ASN A 960 -1.862 -13.557 -0.705 1.00 0.00 C ATOM 1128 OD1 ASN A 960 -2.652 -14.221 -1.377 1.00 0.00 O ATOM 1129 ND2 ASN A 960 -0.570 -13.469 -0.997 1.00 0.00 N ATOM 0 H ASN A 960 -2.076 -10.606 -1.633 1.00 0.00 H new ATOM 0 HA ASN A 960 -3.741 -11.456 -0.411 1.00 0.00 H new ATOM 0 HB2 ASN A 960 -1.517 -12.722 1.236 1.00 0.00 H new ATOM 0 HB3 ASN A 960 -3.140 -13.341 0.999 1.00 0.00 H new ATOM 0 HD21 ASN A 960 -0.195 -13.964 -1.807 1.00 0.00 H new ATOM 0 HD22 ASN A 960 0.048 -12.907 -0.412 1.00 0.00 H new ATOM 1136 N ARG A 961 -3.271 -9.290 1.309 1.00 0.00 N ATOM 1137 CA ARG A 961 -3.554 -8.431 2.453 1.00 0.00 C ATOM 1138 C ARG A 961 -4.335 -7.193 2.023 1.00 0.00 C ATOM 1139 O ARG A 961 -3.800 -6.309 1.353 1.00 0.00 O ATOM 1140 CB ARG A 961 -2.253 -8.014 3.139 1.00 0.00 C ATOM 1141 CG ARG A 961 -1.692 -9.070 4.078 1.00 0.00 C ATOM 1142 CD ARG A 961 -0.373 -8.628 4.690 1.00 0.00 C ATOM 1143 NE ARG A 961 0.006 -9.457 5.831 1.00 0.00 N ATOM 1144 CZ ARG A 961 -0.610 -9.415 7.007 1.00 0.00 C ATOM 1145 NH1 ARG A 961 -1.630 -8.590 7.195 1.00 0.00 N ATOM 1146 NH2 ARG A 961 -0.207 -10.201 7.997 1.00 0.00 N ATOM 0 H ARG A 961 -3.208 -8.798 0.418 1.00 0.00 H new ATOM 0 HA ARG A 961 -4.163 -8.997 3.158 1.00 0.00 H new ATOM 0 HB2 ARG A 961 -1.508 -7.785 2.377 1.00 0.00 H new ATOM 0 HB3 ARG A 961 -2.427 -7.096 3.701 1.00 0.00 H new ATOM 0 HG2 ARG A 961 -2.412 -9.273 4.871 1.00 0.00 H new ATOM 0 HG3 ARG A 961 -1.547 -10.003 3.533 1.00 0.00 H new ATOM 0 HD2 ARG A 961 0.411 -8.672 3.934 1.00 0.00 H new ATOM 0 HD3 ARG A 961 -0.451 -7.588 5.007 1.00 0.00 H new ATOM 0 HE ARG A 961 0.787 -10.104 5.719 1.00 0.00 H new ATOM 0 HH11 ARG A 961 -1.944 -7.985 6.436 1.00 0.00 H new ATOM 0 HH12 ARG A 961 -2.101 -8.560 8.099 1.00 0.00 H new ATOM 0 HH21 ARG A 961 0.577 -10.838 7.855 1.00 0.00 H new ATOM 0 HH22 ARG A 961 -0.681 -10.168 8.900 1.00 0.00 H new ATOM 1160 N THR A 962 -5.605 -7.136 2.412 1.00 0.00 N ATOM 1161 CA THR A 962 -6.460 -6.007 2.066 1.00 0.00 C ATOM 1162 C THR A 962 -5.934 -4.712 2.673 1.00 0.00 C ATOM 1163 O THR A 962 -5.775 -4.605 3.890 1.00 0.00 O ATOM 1164 CB THR A 962 -7.908 -6.233 2.542 1.00 0.00 C ATOM 1165 OG1 THR A 962 -8.392 -7.491 2.059 1.00 0.00 O ATOM 1166 CG2 THR A 962 -8.818 -5.114 2.057 1.00 0.00 C ATOM 0 H THR A 962 -6.064 -7.858 2.967 1.00 0.00 H new ATOM 0 HA THR A 962 -6.451 -5.925 0.979 1.00 0.00 H new ATOM 0 HB THR A 962 -7.912 -6.237 3.632 1.00 0.00 H new ATOM 0 HG1 THR A 962 -7.723 -7.893 1.467 1.00 0.00 H new ATOM 0 HG21 THR A 962 -9.835 -5.295 2.405 1.00 0.00 H new ATOM 0 HG22 THR A 962 -8.464 -4.161 2.450 1.00 0.00 H new ATOM 0 HG23 THR A 962 -8.808 -5.083 0.967 1.00 0.00 H new ATOM 1174 N ILE A 963 -5.666 -3.730 1.819 1.00 0.00 N ATOM 1175 CA ILE A 963 -5.160 -2.441 2.273 1.00 0.00 C ATOM 1176 C ILE A 963 -6.247 -1.373 2.220 1.00 0.00 C ATOM 1177 O ILE A 963 -7.137 -1.418 1.369 1.00 0.00 O ATOM 1178 CB ILE A 963 -3.960 -1.978 1.426 1.00 0.00 C ATOM 1179 CG1 ILE A 963 -2.804 -2.973 1.552 1.00 0.00 C ATOM 1180 CG2 ILE A 963 -3.516 -0.586 1.852 1.00 0.00 C ATOM 1181 CD1 ILE A 963 -1.647 -2.676 0.624 1.00 0.00 C ATOM 0 H ILE A 963 -5.791 -3.803 0.809 1.00 0.00 H new ATOM 0 HA ILE A 963 -4.836 -2.575 3.305 1.00 0.00 H new ATOM 0 HB ILE A 963 -4.267 -1.937 0.381 1.00 0.00 H new ATOM 0 HG12 ILE A 963 -2.444 -2.971 2.581 1.00 0.00 H new ATOM 0 HG13 ILE A 963 -3.175 -3.977 1.347 1.00 0.00 H new ATOM 0 HG21 ILE A 963 -2.667 -0.273 1.244 1.00 0.00 H new ATOM 0 HG22 ILE A 963 -4.339 0.116 1.715 1.00 0.00 H new ATOM 0 HG23 ILE A 963 -3.224 -0.603 2.902 1.00 0.00 H new ATOM 0 HD11 ILE A 963 -0.865 -3.421 0.768 1.00 0.00 H new ATOM 0 HD12 ILE A 963 -1.992 -2.707 -0.409 1.00 0.00 H new ATOM 0 HD13 ILE A 963 -1.249 -1.685 0.844 1.00 0.00 H new ATOM 1193 N THR A 964 -6.169 -0.410 3.133 1.00 0.00 N ATOM 1194 CA THR A 964 -7.146 0.670 3.191 1.00 0.00 C ATOM 1195 C THR A 964 -6.460 2.025 3.317 1.00 0.00 C ATOM 1196 O THR A 964 -5.823 2.317 4.330 1.00 0.00 O ATOM 1197 CB THR A 964 -8.117 0.487 4.372 1.00 0.00 C ATOM 1198 OG1 THR A 964 -8.540 -0.879 4.452 1.00 0.00 O ATOM 1199 CG2 THR A 964 -9.332 1.390 4.219 1.00 0.00 C ATOM 0 H THR A 964 -5.439 -0.356 3.843 1.00 0.00 H new ATOM 0 HA THR A 964 -7.710 0.636 2.259 1.00 0.00 H new ATOM 0 HB THR A 964 -7.594 0.760 5.289 1.00 0.00 H new ATOM 0 HG1 THR A 964 -9.156 -0.987 5.207 1.00 0.00 H new ATOM 0 HG21 THR A 964 -10.003 1.243 5.065 1.00 0.00 H new ATOM 0 HG22 THR A 964 -9.010 2.431 4.188 1.00 0.00 H new ATOM 0 HG23 THR A 964 -9.854 1.144 3.294 1.00 0.00 H new ATOM 1207 N ILE A 965 -6.594 2.850 2.284 1.00 0.00 N ATOM 1208 CA ILE A 965 -5.988 4.175 2.281 1.00 0.00 C ATOM 1209 C ILE A 965 -6.991 5.240 2.712 1.00 0.00 C ATOM 1210 O ILE A 965 -8.163 5.191 2.337 1.00 0.00 O ATOM 1211 CB ILE A 965 -5.436 4.540 0.890 1.00 0.00 C ATOM 1212 CG1 ILE A 965 -4.489 3.447 0.391 1.00 0.00 C ATOM 1213 CG2 ILE A 965 -4.725 5.884 0.938 1.00 0.00 C ATOM 1214 CD1 ILE A 965 -4.098 3.603 -1.062 1.00 0.00 C ATOM 0 H ILE A 965 -7.117 2.624 1.438 1.00 0.00 H new ATOM 0 HA ILE A 965 -5.164 4.145 2.994 1.00 0.00 H new ATOM 0 HB ILE A 965 -6.270 4.618 0.193 1.00 0.00 H new ATOM 0 HG12 ILE A 965 -3.588 3.451 1.004 1.00 0.00 H new ATOM 0 HG13 ILE A 965 -4.964 2.476 0.529 1.00 0.00 H new ATOM 0 HG21 ILE A 965 -4.341 6.128 -0.052 1.00 0.00 H new ATOM 0 HG22 ILE A 965 -5.427 6.656 1.255 1.00 0.00 H new ATOM 0 HG23 ILE A 965 -3.898 5.833 1.646 1.00 0.00 H new ATOM 0 HD11 ILE A 965 -3.426 2.794 -1.347 1.00 0.00 H new ATOM 0 HD12 ILE A 965 -4.992 3.569 -1.685 1.00 0.00 H new ATOM 0 HD13 ILE A 965 -3.594 4.559 -1.203 1.00 0.00 H new ATOM 1226 N ALA A 966 -6.524 6.201 3.501 1.00 0.00 N ATOM 1227 CA ALA A 966 -7.379 7.280 3.980 1.00 0.00 C ATOM 1228 C ALA A 966 -6.582 8.564 4.182 1.00 0.00 C ATOM 1229 O ALA A 966 -5.483 8.544 4.739 1.00 0.00 O ATOM 1230 CB ALA A 966 -8.065 6.874 5.276 1.00 0.00 C ATOM 0 H ALA A 966 -5.557 6.255 3.822 1.00 0.00 H new ATOM 0 HA ALA A 966 -8.139 7.471 3.223 1.00 0.00 H new ATOM 0 HB1 ALA A 966 -8.700 7.689 5.622 1.00 0.00 H new ATOM 0 HB2 ALA A 966 -8.675 5.987 5.103 1.00 0.00 H new ATOM 0 HB3 ALA A 966 -7.312 6.654 6.033 1.00 0.00 H new ATOM 1236 N LEU A 967 -7.141 9.680 3.726 1.00 0.00 N ATOM 1237 CA LEU A 967 -6.481 10.974 3.855 1.00 0.00 C ATOM 1238 C LEU A 967 -6.495 11.450 5.305 1.00 0.00 C ATOM 1239 O LEU A 967 -7.359 11.059 6.090 1.00 0.00 O ATOM 1240 CB LEU A 967 -7.166 12.009 2.961 1.00 0.00 C ATOM 1241 CG LEU A 967 -6.790 11.969 1.479 1.00 0.00 C ATOM 1242 CD1 LEU A 967 -7.582 13.008 0.700 1.00 0.00 C ATOM 1243 CD2 LEU A 967 -5.295 12.193 1.302 1.00 0.00 C ATOM 0 H LEU A 967 -8.050 9.714 3.264 1.00 0.00 H new ATOM 0 HA LEU A 967 -5.444 10.859 3.539 1.00 0.00 H new ATOM 0 HB2 LEU A 967 -8.245 11.876 3.045 1.00 0.00 H new ATOM 0 HB3 LEU A 967 -6.936 13.002 3.347 1.00 0.00 H new ATOM 0 HG LEU A 967 -7.038 10.983 1.087 1.00 0.00 H new ATOM 0 HD11 LEU A 967 -7.302 12.965 -0.352 1.00 0.00 H new ATOM 0 HD12 LEU A 967 -8.648 12.803 0.800 1.00 0.00 H new ATOM 0 HD13 LEU A 967 -7.365 14.001 1.093 1.00 0.00 H new ATOM 0 HD21 LEU A 967 -5.045 12.161 0.241 1.00 0.00 H new ATOM 0 HD22 LEU A 967 -5.022 13.166 1.710 1.00 0.00 H new ATOM 0 HD23 LEU A 967 -4.745 11.412 1.828 1.00 0.00 H new ATOM 1255 N LYS A 968 -5.533 12.297 5.653 1.00 0.00 N ATOM 1256 CA LYS A 968 -5.435 12.829 7.007 1.00 0.00 C ATOM 1257 C LYS A 968 -6.294 14.080 7.164 1.00 0.00 C ATOM 1258 O LYS A 968 -6.045 15.100 6.521 1.00 0.00 O ATOM 1259 CB LYS A 968 -3.978 13.153 7.346 1.00 0.00 C ATOM 1260 CG LYS A 968 -3.789 13.716 8.744 1.00 0.00 C ATOM 1261 CD LYS A 968 -3.814 12.618 9.794 1.00 0.00 C ATOM 1262 CE LYS A 968 -4.258 13.152 11.148 1.00 0.00 C ATOM 1263 NZ LYS A 968 -3.303 14.159 11.687 1.00 0.00 N ATOM 0 H LYS A 968 -4.810 12.630 5.016 1.00 0.00 H new ATOM 0 HA LYS A 968 -5.802 12.068 7.696 1.00 0.00 H new ATOM 0 HB2 LYS A 968 -3.380 12.247 7.244 1.00 0.00 H new ATOM 0 HB3 LYS A 968 -3.596 13.870 6.620 1.00 0.00 H new ATOM 0 HG2 LYS A 968 -2.840 14.250 8.797 1.00 0.00 H new ATOM 0 HG3 LYS A 968 -4.575 14.441 8.955 1.00 0.00 H new ATOM 0 HD2 LYS A 968 -4.489 11.824 9.476 1.00 0.00 H new ATOM 0 HD3 LYS A 968 -2.822 12.176 9.884 1.00 0.00 H new ATOM 0 HE2 LYS A 968 -5.246 13.602 11.055 1.00 0.00 H new ATOM 0 HE3 LYS A 968 -4.350 12.325 11.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 968 -3.595 14.436 12.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 968 -2.348 13.749 11.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 968 -3.298 14.997 11.071 1.00 0.00 H new