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 Single : A 894 THR OG1 : rot 27:sc= 0.029 USER MOD Single : A 898 SER OG : rot 180:sc= -0.0417 USER MOD Single : A 919 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 920 GLN : amide:sc= -0.0374 K(o=-0.037,f=-1.6) USER MOD Single : A 923 SER OG : rot -116:sc= 0.0383 USER MOD Single : A 936 LYS NZ :NH3+ -106:sc= -1.45! (180deg=-3.7!) USER MOD Single : A 937 MET CE :methyl 155:sc= -0.0903 (180deg=-0.436) USER MOD Single : A 940 THR OG1 : rot 180:sc= 0 USER MOD Single : A 945 SER OG : rot 180:sc= 0 USER MOD Single : A 946 SER OG : rot -170:sc= -0.0484 USER MOD Single : A 949 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 952 SER OG : rot 165:sc= 1.8 USER MOD Single : A 954 ASN : amide:sc= -0.85! C(o=-0.85!,f=-3!) USER MOD Single : A 956 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 960 ASN : amide:sc= -1.35 K(o=-1.4,f=-0.017) USER MOD Single : A 962 THR OG1 : rot 180:sc= 0 USER MOD Single : A 964 THR OG1 : rot 180:sc= 0 USER MOD Single : A 968 LYS NZ :NH3+ 172:sc= 0.983 (180deg=0.879) USER MOD ----------------------------------------------------------------- ATOM 73 N THR A 894 0.203 13.699 3.640 1.00 0.00 N ATOM 74 CA THR A 894 0.200 12.545 4.530 1.00 0.00 C ATOM 75 C THR A 894 -1.054 11.701 4.333 1.00 0.00 C ATOM 76 O THR A 894 -2.173 12.182 4.514 1.00 0.00 O ATOM 77 CB THR A 894 0.290 12.973 6.007 1.00 0.00 C ATOM 78 OG1 THR A 894 1.524 13.659 6.244 1.00 0.00 O ATOM 79 CG2 THR A 894 0.189 11.767 6.928 1.00 0.00 C ATOM 0 HA THR A 894 1.078 11.950 4.278 1.00 0.00 H new ATOM 0 HB THR A 894 -0.544 13.642 6.219 1.00 0.00 H new ATOM 0 HG1 THR A 894 1.829 14.080 5.413 1.00 0.00 H new ATOM 0 HG21 THR A 894 0.255 12.095 7.965 1.00 0.00 H new ATOM 0 HG22 THR A 894 -0.765 11.265 6.766 1.00 0.00 H new ATOM 0 HG23 THR A 894 1.004 11.076 6.713 1.00 0.00 H new ATOM 87 N VAL A 895 -0.861 10.440 3.961 1.00 0.00 N ATOM 88 CA VAL A 895 -1.978 9.528 3.741 1.00 0.00 C ATOM 89 C VAL A 895 -1.894 8.322 4.669 1.00 0.00 C ATOM 90 O VAL A 895 -0.814 7.775 4.898 1.00 0.00 O ATOM 91 CB VAL A 895 -2.022 9.037 2.281 1.00 0.00 C ATOM 92 CG1 VAL A 895 -2.141 10.214 1.325 1.00 0.00 C ATOM 93 CG2 VAL A 895 -0.790 8.203 1.963 1.00 0.00 C ATOM 0 H VAL A 895 0.058 10.026 3.806 1.00 0.00 H new ATOM 0 HA VAL A 895 -2.889 10.086 3.957 1.00 0.00 H new ATOM 0 HB VAL A 895 -2.902 8.407 2.154 1.00 0.00 H new ATOM 0 HG11 VAL A 895 -2.171 9.848 0.299 1.00 0.00 H new ATOM 0 HG12 VAL A 895 -3.056 10.766 1.540 1.00 0.00 H new ATOM 0 HG13 VAL A 895 -1.282 10.873 1.450 1.00 0.00 H new ATOM 0 HG21 VAL A 895 -0.837 7.864 0.928 1.00 0.00 H new ATOM 0 HG22 VAL A 895 0.106 8.808 2.107 1.00 0.00 H new ATOM 0 HG23 VAL A 895 -0.755 7.339 2.626 1.00 0.00 H new ATOM 103 N LEU A 896 -3.040 7.911 5.201 1.00 0.00 N ATOM 104 CA LEU A 896 -3.097 6.768 6.106 1.00 0.00 C ATOM 105 C LEU A 896 -3.302 5.470 5.331 1.00 0.00 C ATOM 106 O LEU A 896 -4.083 5.419 4.380 1.00 0.00 O ATOM 107 CB LEU A 896 -4.226 6.953 7.122 1.00 0.00 C ATOM 108 CG LEU A 896 -3.916 7.861 8.312 1.00 0.00 C ATOM 109 CD1 LEU A 896 -3.280 9.160 7.840 1.00 0.00 C ATOM 110 CD2 LEU A 896 -5.180 8.143 9.111 1.00 0.00 C ATOM 0 H LEU A 896 -3.942 8.352 5.021 1.00 0.00 H new ATOM 0 HA LEU A 896 -2.146 6.707 6.636 1.00 0.00 H new ATOM 0 HB2 LEU A 896 -5.095 7.355 6.601 1.00 0.00 H new ATOM 0 HB3 LEU A 896 -4.509 5.972 7.503 1.00 0.00 H new ATOM 0 HG LEU A 896 -3.207 7.348 8.962 1.00 0.00 H new ATOM 0 HD11 LEU A 896 -3.066 9.794 8.700 1.00 0.00 H new ATOM 0 HD12 LEU A 896 -2.352 8.940 7.312 1.00 0.00 H new ATOM 0 HD13 LEU A 896 -3.965 9.678 7.169 1.00 0.00 H new ATOM 0 HD21 LEU A 896 -4.940 8.791 9.954 1.00 0.00 H new ATOM 0 HD22 LEU A 896 -5.912 8.636 8.471 1.00 0.00 H new ATOM 0 HD23 LEU A 896 -5.594 7.205 9.480 1.00 0.00 H new ATOM 122 N VAL A 897 -2.596 4.422 5.745 1.00 0.00 N ATOM 123 CA VAL A 897 -2.703 3.123 5.092 1.00 0.00 C ATOM 124 C VAL A 897 -2.699 1.992 6.114 1.00 0.00 C ATOM 125 O VAL A 897 -1.764 1.860 6.904 1.00 0.00 O ATOM 126 CB VAL A 897 -1.552 2.901 4.092 1.00 0.00 C ATOM 127 CG1 VAL A 897 -1.680 1.541 3.424 1.00 0.00 C ATOM 128 CG2 VAL A 897 -1.526 4.014 3.055 1.00 0.00 C ATOM 0 H VAL A 897 -1.944 4.448 6.529 1.00 0.00 H new ATOM 0 HA VAL A 897 -3.650 3.117 4.552 1.00 0.00 H new ATOM 0 HB VAL A 897 -0.609 2.923 4.639 1.00 0.00 H new ATOM 0 HG11 VAL A 897 -0.858 1.402 2.721 1.00 0.00 H new ATOM 0 HG12 VAL A 897 -1.645 0.759 4.182 1.00 0.00 H new ATOM 0 HG13 VAL A 897 -2.628 1.486 2.889 1.00 0.00 H new ATOM 0 HG21 VAL A 897 -0.707 3.842 2.357 1.00 0.00 H new ATOM 0 HG22 VAL A 897 -2.470 4.026 2.511 1.00 0.00 H new ATOM 0 HG23 VAL A 897 -1.382 4.973 3.554 1.00 0.00 H new ATOM 138 N SER A 898 -3.750 1.179 6.093 1.00 0.00 N ATOM 139 CA SER A 898 -3.869 0.060 7.020 1.00 0.00 C ATOM 140 C SER A 898 -4.098 -1.248 6.268 1.00 0.00 C ATOM 141 O SER A 898 -4.596 -1.249 5.142 1.00 0.00 O ATOM 142 CB SER A 898 -5.017 0.304 8.002 1.00 0.00 C ATOM 143 OG SER A 898 -5.315 -0.868 8.740 1.00 0.00 O ATOM 0 H SER A 898 -4.531 1.274 5.444 1.00 0.00 H new ATOM 0 HA SER A 898 -2.935 -0.020 7.576 1.00 0.00 H new ATOM 0 HB2 SER A 898 -4.750 1.110 8.686 1.00 0.00 H new ATOM 0 HB3 SER A 898 -5.903 0.629 7.457 1.00 0.00 H new ATOM 0 HG SER A 898 -6.051 -0.685 9.361 1.00 0.00 H new ATOM 149 N ILE A 899 -3.730 -2.358 6.898 1.00 0.00 N ATOM 150 CA ILE A 899 -3.895 -3.672 6.290 1.00 0.00 C ATOM 151 C ILE A 899 -4.777 -4.569 7.151 1.00 0.00 C ATOM 152 O ILE A 899 -4.549 -4.715 8.352 1.00 0.00 O ATOM 153 CB ILE A 899 -2.538 -4.365 6.069 1.00 0.00 C ATOM 154 CG1 ILE A 899 -1.626 -4.147 7.278 1.00 0.00 C ATOM 155 CG2 ILE A 899 -1.878 -3.845 4.801 1.00 0.00 C ATOM 156 CD1 ILE A 899 -0.637 -5.270 7.499 1.00 0.00 C ATOM 0 H ILE A 899 -3.315 -2.374 7.830 1.00 0.00 H new ATOM 0 HA ILE A 899 -4.374 -3.514 5.324 1.00 0.00 H new ATOM 0 HB ILE A 899 -2.708 -5.435 5.954 1.00 0.00 H new ATOM 0 HG12 ILE A 899 -1.080 -3.213 7.147 1.00 0.00 H new ATOM 0 HG13 ILE A 899 -2.241 -4.034 8.171 1.00 0.00 H new ATOM 0 HG21 ILE A 899 -0.920 -4.344 4.659 1.00 0.00 H new ATOM 0 HG22 ILE A 899 -2.523 -4.047 3.946 1.00 0.00 H new ATOM 0 HG23 ILE A 899 -1.718 -2.770 4.889 1.00 0.00 H new ATOM 0 HD11 ILE A 899 -0.024 -5.048 8.372 1.00 0.00 H new ATOM 0 HD12 ILE A 899 -1.176 -6.203 7.662 1.00 0.00 H new ATOM 0 HD13 ILE A 899 0.003 -5.369 6.622 1.00 0.00 H new ATOM 308 N PHE A 909 3.600 -3.889 8.947 1.00 0.00 N ATOM 309 CA PHE A 909 3.993 -4.003 7.547 1.00 0.00 C ATOM 310 C PHE A 909 5.432 -4.498 7.424 1.00 0.00 C ATOM 311 O PHE A 909 6.359 -3.878 7.944 1.00 0.00 O ATOM 312 CB PHE A 909 3.844 -2.653 6.842 1.00 0.00 C ATOM 313 CG PHE A 909 2.492 -2.026 7.027 1.00 0.00 C ATOM 314 CD1 PHE A 909 2.173 -1.372 8.206 1.00 0.00 C ATOM 315 CD2 PHE A 909 1.540 -2.092 6.022 1.00 0.00 C ATOM 316 CE1 PHE A 909 0.929 -0.793 8.379 1.00 0.00 C ATOM 317 CE2 PHE A 909 0.296 -1.515 6.190 1.00 0.00 C ATOM 318 CZ PHE A 909 -0.011 -0.866 7.370 1.00 0.00 C ATOM 0 HA PHE A 909 3.336 -4.729 7.069 1.00 0.00 H new ATOM 0 HB2 PHE A 909 4.607 -1.970 7.217 1.00 0.00 H new ATOM 0 HB3 PHE A 909 4.031 -2.786 5.776 1.00 0.00 H new ATOM 0 HD1 PHE A 909 2.904 -1.314 8.999 1.00 0.00 H new ATOM 0 HD2 PHE A 909 1.773 -2.600 5.098 1.00 0.00 H new ATOM 0 HE1 PHE A 909 0.693 -0.284 9.302 1.00 0.00 H new ATOM 0 HE2 PHE A 909 -0.437 -1.571 5.398 1.00 0.00 H new ATOM 0 HZ PHE A 909 -0.984 -0.417 7.503 1.00 0.00 H new ATOM 328 N ASP A 910 5.608 -5.619 6.734 1.00 0.00 N ATOM 329 CA ASP A 910 6.932 -6.198 6.542 1.00 0.00 C ATOM 330 C ASP A 910 7.623 -5.584 5.328 1.00 0.00 C ATOM 331 O ASP A 910 7.045 -4.753 4.627 1.00 0.00 O ATOM 332 CB ASP A 910 6.830 -7.715 6.372 1.00 0.00 C ATOM 333 CG ASP A 910 5.925 -8.353 7.407 1.00 0.00 C ATOM 334 OD1 ASP A 910 4.690 -8.296 7.232 1.00 0.00 O ATOM 335 OD2 ASP A 910 6.452 -8.910 8.394 1.00 0.00 O ATOM 0 H ASP A 910 4.850 -6.145 6.298 1.00 0.00 H new ATOM 0 HA ASP A 910 7.528 -5.979 7.428 1.00 0.00 H new ATOM 0 HB2 ASP A 910 6.453 -7.942 5.375 1.00 0.00 H new ATOM 0 HB3 ASP A 910 7.825 -8.154 6.444 1.00 0.00 H new ATOM 340 N ASP A 911 8.863 -5.997 5.087 1.00 0.00 N ATOM 341 CA ASP A 911 9.633 -5.487 3.959 1.00 0.00 C ATOM 342 C ASP A 911 8.875 -5.685 2.650 1.00 0.00 C ATOM 343 O ASP A 911 8.837 -4.794 1.802 1.00 0.00 O ATOM 344 CB ASP A 911 10.992 -6.184 3.886 1.00 0.00 C ATOM 345 CG ASP A 911 12.025 -5.361 3.141 1.00 0.00 C ATOM 346 OD1 ASP A 911 12.647 -4.480 3.770 1.00 0.00 O ATOM 347 OD2 ASP A 911 12.210 -5.597 1.928 1.00 0.00 O ATOM 0 H ASP A 911 9.356 -6.684 5.658 1.00 0.00 H new ATOM 0 HA ASP A 911 9.789 -4.419 4.110 1.00 0.00 H new ATOM 0 HB2 ASP A 911 11.350 -6.383 4.896 1.00 0.00 H new ATOM 0 HB3 ASP A 911 10.876 -7.149 3.393 1.00 0.00 H new ATOM 352 N ALA A 912 8.273 -6.860 2.492 1.00 0.00 N ATOM 353 CA ALA A 912 7.516 -7.175 1.287 1.00 0.00 C ATOM 354 C ALA A 912 6.305 -6.259 1.145 1.00 0.00 C ATOM 355 O ALA A 912 6.054 -5.707 0.073 1.00 0.00 O ATOM 356 CB ALA A 912 7.078 -8.632 1.305 1.00 0.00 C ATOM 0 H ALA A 912 8.295 -7.609 3.184 1.00 0.00 H new ATOM 0 HA ALA A 912 8.165 -7.012 0.427 1.00 0.00 H new ATOM 0 HB1 ALA A 912 6.514 -8.853 0.399 1.00 0.00 H new ATOM 0 HB2 ALA A 912 7.957 -9.275 1.352 1.00 0.00 H new ATOM 0 HB3 ALA A 912 6.450 -8.812 2.177 1.00 0.00 H new ATOM 362 N LEU A 913 5.557 -6.102 2.232 1.00 0.00 N ATOM 363 CA LEU A 913 4.371 -5.253 2.228 1.00 0.00 C ATOM 364 C LEU A 913 4.736 -3.809 1.901 1.00 0.00 C ATOM 365 O LEU A 913 4.115 -3.181 1.042 1.00 0.00 O ATOM 366 CB LEU A 913 3.668 -5.318 3.585 1.00 0.00 C ATOM 367 CG LEU A 913 2.855 -6.584 3.860 1.00 0.00 C ATOM 368 CD1 LEU A 913 2.377 -6.608 5.304 1.00 0.00 C ATOM 369 CD2 LEU A 913 1.674 -6.677 2.904 1.00 0.00 C ATOM 0 H LEU A 913 5.751 -6.551 3.127 1.00 0.00 H new ATOM 0 HA LEU A 913 3.694 -5.621 1.457 1.00 0.00 H new ATOM 0 HB2 LEU A 913 4.421 -5.217 4.367 1.00 0.00 H new ATOM 0 HB3 LEU A 913 3.003 -4.458 3.669 1.00 0.00 H new ATOM 0 HG LEU A 913 3.498 -7.449 3.697 1.00 0.00 H new ATOM 0 HD11 LEU A 913 1.800 -7.516 5.481 1.00 0.00 H new ATOM 0 HD12 LEU A 913 3.238 -6.588 5.973 1.00 0.00 H new ATOM 0 HD13 LEU A 913 1.750 -5.737 5.494 1.00 0.00 H new ATOM 0 HD21 LEU A 913 1.107 -7.584 3.114 1.00 0.00 H new ATOM 0 HD22 LEU A 913 1.030 -5.807 3.035 1.00 0.00 H new ATOM 0 HD23 LEU A 913 2.039 -6.707 1.877 1.00 0.00 H new ATOM 381 N ILE A 914 5.747 -3.289 2.588 1.00 0.00 N ATOM 382 CA ILE A 914 6.197 -1.921 2.368 1.00 0.00 C ATOM 383 C ILE A 914 6.787 -1.754 0.972 1.00 0.00 C ATOM 384 O ILE A 914 6.299 -0.956 0.172 1.00 0.00 O ATOM 385 CB ILE A 914 7.248 -1.498 3.411 1.00 0.00 C ATOM 386 CG1 ILE A 914 6.674 -1.621 4.824 1.00 0.00 C ATOM 387 CG2 ILE A 914 7.716 -0.076 3.145 1.00 0.00 C ATOM 388 CD1 ILE A 914 7.732 -1.686 5.903 1.00 0.00 C ATOM 0 H ILE A 914 6.270 -3.795 3.302 1.00 0.00 H new ATOM 0 HA ILE A 914 5.320 -1.281 2.469 1.00 0.00 H new ATOM 0 HB ILE A 914 8.108 -2.163 3.329 1.00 0.00 H new ATOM 0 HG12 ILE A 914 6.021 -0.770 5.017 1.00 0.00 H new ATOM 0 HG13 ILE A 914 6.055 -2.516 4.879 1.00 0.00 H new ATOM 0 HG21 ILE A 914 8.459 0.208 3.891 1.00 0.00 H new ATOM 0 HG22 ILE A 914 8.160 -0.019 2.151 1.00 0.00 H new ATOM 0 HG23 ILE A 914 6.866 0.604 3.202 1.00 0.00 H new ATOM 0 HD11 ILE A 914 7.252 -1.772 6.878 1.00 0.00 H new ATOM 0 HD12 ILE A 914 8.371 -2.553 5.735 1.00 0.00 H new ATOM 0 HD13 ILE A 914 8.336 -0.779 5.875 1.00 0.00 H new ATOM 400 N ASP A 915 7.838 -2.514 0.686 1.00 0.00 N ATOM 401 CA ASP A 915 8.494 -2.453 -0.615 1.00 0.00 C ATOM 402 C ASP A 915 7.467 -2.455 -1.743 1.00 0.00 C ATOM 403 O ASP A 915 7.426 -1.536 -2.559 1.00 0.00 O ATOM 404 CB ASP A 915 9.455 -3.632 -0.782 1.00 0.00 C ATOM 405 CG ASP A 915 10.369 -3.469 -1.980 1.00 0.00 C ATOM 406 OD1 ASP A 915 9.887 -3.009 -3.036 1.00 0.00 O ATOM 407 OD2 ASP A 915 11.567 -3.803 -1.862 1.00 0.00 O ATOM 0 H ASP A 915 8.254 -3.180 1.337 1.00 0.00 H new ATOM 0 HA ASP A 915 9.060 -1.523 -0.665 1.00 0.00 H new ATOM 0 HB2 ASP A 915 10.058 -3.736 0.120 1.00 0.00 H new ATOM 0 HB3 ASP A 915 8.881 -4.552 -0.889 1.00 0.00 H new ATOM 412 N GLU A 916 6.640 -3.496 -1.781 1.00 0.00 N ATOM 413 CA GLU A 916 5.614 -3.618 -2.810 1.00 0.00 C ATOM 414 C GLU A 916 4.786 -2.340 -2.907 1.00 0.00 C ATOM 415 O GLU A 916 4.627 -1.769 -3.987 1.00 0.00 O ATOM 416 CB GLU A 916 4.700 -4.808 -2.512 1.00 0.00 C ATOM 417 CG GLU A 916 5.318 -6.152 -2.861 1.00 0.00 C ATOM 418 CD GLU A 916 5.905 -6.178 -4.259 1.00 0.00 C ATOM 419 OE1 GLU A 916 5.141 -6.414 -5.219 1.00 0.00 O ATOM 420 OE2 GLU A 916 7.128 -5.963 -4.394 1.00 0.00 O ATOM 0 H GLU A 916 6.661 -4.266 -1.112 1.00 0.00 H new ATOM 0 HA GLU A 916 6.112 -3.782 -3.765 1.00 0.00 H new ATOM 0 HB2 GLU A 916 4.441 -4.800 -1.453 1.00 0.00 H new ATOM 0 HB3 GLU A 916 3.770 -4.690 -3.068 1.00 0.00 H new ATOM 0 HG2 GLU A 916 6.099 -6.387 -2.138 1.00 0.00 H new ATOM 0 HG3 GLU A 916 4.559 -6.930 -2.775 1.00 0.00 H new ATOM 427 N LEU A 917 4.260 -1.895 -1.771 1.00 0.00 N ATOM 428 CA LEU A 917 3.447 -0.684 -1.727 1.00 0.00 C ATOM 429 C LEU A 917 4.111 0.446 -2.507 1.00 0.00 C ATOM 430 O LEU A 917 3.503 1.040 -3.398 1.00 0.00 O ATOM 431 CB LEU A 917 3.219 -0.252 -0.277 1.00 0.00 C ATOM 432 CG LEU A 917 2.189 -1.063 0.510 1.00 0.00 C ATOM 433 CD1 LEU A 917 2.386 -0.869 2.006 1.00 0.00 C ATOM 434 CD2 LEU A 917 0.776 -0.672 0.101 1.00 0.00 C ATOM 0 H LEU A 917 4.382 -2.354 -0.868 1.00 0.00 H new ATOM 0 HA LEU A 917 2.485 -0.904 -2.190 1.00 0.00 H new ATOM 0 HB2 LEU A 917 4.172 -0.302 0.250 1.00 0.00 H new ATOM 0 HB3 LEU A 917 2.908 0.793 -0.275 1.00 0.00 H new ATOM 0 HG LEU A 917 2.333 -2.118 0.279 1.00 0.00 H new ATOM 0 HD11 LEU A 917 1.644 -1.454 2.550 1.00 0.00 H new ATOM 0 HD12 LEU A 917 3.386 -1.200 2.287 1.00 0.00 H new ATOM 0 HD13 LEU A 917 2.270 0.186 2.255 1.00 0.00 H new ATOM 0 HD21 LEU A 917 0.056 -1.259 0.671 1.00 0.00 H new ATOM 0 HD22 LEU A 917 0.619 0.388 0.301 1.00 0.00 H new ATOM 0 HD23 LEU A 917 0.639 -0.864 -0.963 1.00 0.00 H new ATOM 446 N LEU A 918 5.362 0.737 -2.167 1.00 0.00 N ATOM 447 CA LEU A 918 6.110 1.795 -2.838 1.00 0.00 C ATOM 448 C LEU A 918 5.772 1.843 -4.324 1.00 0.00 C ATOM 449 O LEU A 918 5.213 2.826 -4.811 1.00 0.00 O ATOM 450 CB LEU A 918 7.613 1.580 -2.652 1.00 0.00 C ATOM 451 CG LEU A 918 8.081 1.311 -1.221 1.00 0.00 C ATOM 452 CD1 LEU A 918 9.600 1.308 -1.147 1.00 0.00 C ATOM 453 CD2 LEU A 918 7.501 2.345 -0.267 1.00 0.00 C ATOM 0 H LEU A 918 5.879 0.256 -1.431 1.00 0.00 H new ATOM 0 HA LEU A 918 5.827 2.747 -2.389 1.00 0.00 H new ATOM 0 HB2 LEU A 918 7.920 0.741 -3.277 1.00 0.00 H new ATOM 0 HB3 LEU A 918 8.135 2.462 -3.024 1.00 0.00 H new ATOM 0 HG LEU A 918 7.722 0.327 -0.921 1.00 0.00 H new ATOM 0 HD11 LEU A 918 9.914 1.115 -0.121 1.00 0.00 H new ATOM 0 HD12 LEU A 918 9.995 0.529 -1.800 1.00 0.00 H new ATOM 0 HD13 LEU A 918 9.982 2.278 -1.467 1.00 0.00 H new ATOM 0 HD21 LEU A 918 7.845 2.138 0.747 1.00 0.00 H new ATOM 0 HD22 LEU A 918 7.830 3.340 -0.565 1.00 0.00 H new ATOM 0 HD23 LEU A 918 6.412 2.298 -0.298 1.00 0.00 H new ATOM 465 N GLN A 919 6.113 0.775 -5.038 1.00 0.00 N ATOM 466 CA GLN A 919 5.844 0.696 -6.469 1.00 0.00 C ATOM 467 C GLN A 919 4.390 1.047 -6.770 1.00 0.00 C ATOM 468 O GLN A 919 4.110 1.898 -7.614 1.00 0.00 O ATOM 469 CB GLN A 919 6.161 -0.706 -6.993 1.00 0.00 C ATOM 470 CG GLN A 919 7.618 -0.893 -7.385 1.00 0.00 C ATOM 471 CD GLN A 919 7.855 -2.181 -8.149 1.00 0.00 C ATOM 472 OE1 GLN A 919 8.368 -2.166 -9.269 1.00 0.00 O ATOM 473 NE2 GLN A 919 7.482 -3.304 -7.548 1.00 0.00 N ATOM 0 H GLN A 919 6.576 -0.047 -4.649 1.00 0.00 H new ATOM 0 HA GLN A 919 6.485 1.418 -6.974 1.00 0.00 H new ATOM 0 HB2 GLN A 919 5.902 -1.438 -6.228 1.00 0.00 H new ATOM 0 HB3 GLN A 919 5.531 -0.913 -7.858 1.00 0.00 H new ATOM 0 HG2 GLN A 919 7.937 -0.049 -7.996 1.00 0.00 H new ATOM 0 HG3 GLN A 919 8.236 -0.889 -6.487 1.00 0.00 H new ATOM 0 HE21 GLN A 919 7.061 -3.270 -6.620 1.00 0.00 H new ATOM 0 HE22 GLN A 919 7.617 -4.201 -8.014 1.00 0.00 H new ATOM 482 N GLN A 920 3.471 0.386 -6.074 1.00 0.00 N ATOM 483 CA GLN A 920 2.046 0.628 -6.268 1.00 0.00 C ATOM 484 C GLN A 920 1.733 2.119 -6.197 1.00 0.00 C ATOM 485 O GLN A 920 0.933 2.634 -6.978 1.00 0.00 O ATOM 486 CB GLN A 920 1.231 -0.127 -5.217 1.00 0.00 C ATOM 487 CG GLN A 920 1.200 -1.631 -5.437 1.00 0.00 C ATOM 488 CD GLN A 920 0.342 -2.031 -6.620 1.00 0.00 C ATOM 489 OE1 GLN A 920 -0.312 -1.191 -7.240 1.00 0.00 O ATOM 490 NE2 GLN A 920 0.338 -3.319 -6.941 1.00 0.00 N ATOM 0 H GLN A 920 3.687 -0.321 -5.371 1.00 0.00 H new ATOM 0 HA GLN A 920 1.773 0.265 -7.259 1.00 0.00 H new ATOM 0 HB2 GLN A 920 1.646 0.079 -4.230 1.00 0.00 H new ATOM 0 HB3 GLN A 920 0.210 0.253 -5.219 1.00 0.00 H new ATOM 0 HG2 GLN A 920 2.217 -1.992 -5.592 1.00 0.00 H new ATOM 0 HG3 GLN A 920 0.822 -2.118 -4.538 1.00 0.00 H new ATOM 0 HE21 GLN A 920 0.895 -3.981 -6.400 1.00 0.00 H new ATOM 0 HE22 GLN A 920 -0.222 -3.647 -7.728 1.00 0.00 H new ATOM 499 N PHE A 921 2.368 2.808 -5.255 1.00 0.00 N ATOM 500 CA PHE A 921 2.156 4.240 -5.080 1.00 0.00 C ATOM 501 C PHE A 921 2.752 5.024 -6.246 1.00 0.00 C ATOM 502 O PHE A 921 2.101 5.897 -6.818 1.00 0.00 O ATOM 503 CB PHE A 921 2.776 4.712 -3.763 1.00 0.00 C ATOM 504 CG PHE A 921 2.163 4.073 -2.550 1.00 0.00 C ATOM 505 CD1 PHE A 921 0.793 3.882 -2.468 1.00 0.00 C ATOM 506 CD2 PHE A 921 2.958 3.663 -1.491 1.00 0.00 C ATOM 507 CE1 PHE A 921 0.227 3.295 -1.352 1.00 0.00 C ATOM 508 CE2 PHE A 921 2.397 3.075 -0.373 1.00 0.00 C ATOM 509 CZ PHE A 921 1.030 2.890 -0.304 1.00 0.00 C ATOM 0 H PHE A 921 3.034 2.398 -4.601 1.00 0.00 H new ATOM 0 HA PHE A 921 1.082 4.423 -5.053 1.00 0.00 H new ATOM 0 HB2 PHE A 921 3.845 4.498 -3.776 1.00 0.00 H new ATOM 0 HB3 PHE A 921 2.669 5.794 -3.687 1.00 0.00 H new ATOM 0 HD1 PHE A 921 0.160 4.195 -3.285 1.00 0.00 H new ATOM 0 HD2 PHE A 921 4.028 3.805 -1.540 1.00 0.00 H new ATOM 0 HE1 PHE A 921 -0.842 3.153 -1.300 1.00 0.00 H new ATOM 0 HE2 PHE A 921 3.027 2.760 0.446 1.00 0.00 H new ATOM 0 HZ PHE A 921 0.590 2.429 0.568 1.00 0.00 H new ATOM 519 N ALA A 922 3.996 4.705 -6.591 1.00 0.00 N ATOM 520 CA ALA A 922 4.680 5.378 -7.688 1.00 0.00 C ATOM 521 C ALA A 922 3.796 5.443 -8.929 1.00 0.00 C ATOM 522 O ALA A 922 3.923 6.355 -9.746 1.00 0.00 O ATOM 523 CB ALA A 922 5.989 4.670 -8.007 1.00 0.00 C ATOM 0 H ALA A 922 4.550 3.985 -6.127 1.00 0.00 H new ATOM 0 HA ALA A 922 4.898 6.399 -7.375 1.00 0.00 H new ATOM 0 HB1 ALA A 922 6.489 5.183 -8.828 1.00 0.00 H new ATOM 0 HB2 ALA A 922 6.632 4.680 -7.127 1.00 0.00 H new ATOM 0 HB3 ALA A 922 5.784 3.639 -8.295 1.00 0.00 H new ATOM 529 N SER A 923 2.901 4.470 -9.064 1.00 0.00 N ATOM 530 CA SER A 923 1.998 4.415 -10.208 1.00 0.00 C ATOM 531 C SER A 923 1.352 5.774 -10.457 1.00 0.00 C ATOM 532 O SER A 923 1.020 6.118 -11.591 1.00 0.00 O ATOM 533 CB SER A 923 0.916 3.357 -9.980 1.00 0.00 C ATOM 534 OG SER A 923 0.164 3.135 -11.160 1.00 0.00 O ATOM 0 H SER A 923 2.782 3.709 -8.396 1.00 0.00 H new ATOM 0 HA SER A 923 2.582 4.144 -11.087 1.00 0.00 H new ATOM 0 HB2 SER A 923 1.378 2.424 -9.658 1.00 0.00 H new ATOM 0 HB3 SER A 923 0.252 3.678 -9.177 1.00 0.00 H new ATOM 0 HG SER A 923 -0.768 3.397 -11.008 1.00 0.00 H new ATOM 540 N PHE A 924 1.178 6.544 -9.387 1.00 0.00 N ATOM 541 CA PHE A 924 0.571 7.866 -9.488 1.00 0.00 C ATOM 542 C PHE A 924 1.505 8.937 -8.930 1.00 0.00 C ATOM 543 O PHE A 924 1.968 9.813 -9.658 1.00 0.00 O ATOM 544 CB PHE A 924 -0.763 7.896 -8.740 1.00 0.00 C ATOM 545 CG PHE A 924 -1.632 6.703 -9.015 1.00 0.00 C ATOM 546 CD1 PHE A 924 -1.233 5.434 -8.626 1.00 0.00 C ATOM 547 CD2 PHE A 924 -2.848 6.849 -9.663 1.00 0.00 C ATOM 548 CE1 PHE A 924 -2.030 4.334 -8.879 1.00 0.00 C ATOM 549 CE2 PHE A 924 -3.650 5.752 -9.918 1.00 0.00 C ATOM 550 CZ PHE A 924 -3.240 4.493 -9.525 1.00 0.00 C ATOM 0 H PHE A 924 1.449 6.275 -8.441 1.00 0.00 H new ATOM 0 HA PHE A 924 0.393 8.078 -10.542 1.00 0.00 H new ATOM 0 HB2 PHE A 924 -0.569 7.954 -7.669 1.00 0.00 H new ATOM 0 HB3 PHE A 924 -1.304 8.801 -9.016 1.00 0.00 H new ATOM 0 HD1 PHE A 924 -0.288 5.303 -8.119 1.00 0.00 H new ATOM 0 HD2 PHE A 924 -3.173 7.831 -9.973 1.00 0.00 H new ATOM 0 HE1 PHE A 924 -1.707 3.350 -8.572 1.00 0.00 H new ATOM 0 HE2 PHE A 924 -4.596 5.879 -10.424 1.00 0.00 H new ATOM 0 HZ PHE A 924 -3.865 3.634 -9.723 1.00 0.00 H new ATOM 560 N GLY A 925 1.775 8.859 -7.630 1.00 0.00 N ATOM 561 CA GLY A 925 2.650 9.826 -6.995 1.00 0.00 C ATOM 562 C GLY A 925 3.920 9.195 -6.458 1.00 0.00 C ATOM 563 O GLY A 925 3.950 8.000 -6.165 1.00 0.00 O ATOM 0 H GLY A 925 1.403 8.143 -7.006 1.00 0.00 H new ATOM 0 HA2 GLY A 925 2.910 10.603 -7.714 1.00 0.00 H new ATOM 0 HA3 GLY A 925 2.117 10.313 -6.179 1.00 0.00 H new ATOM 567 N GLU A 926 4.971 9.999 -6.331 1.00 0.00 N ATOM 568 CA GLU A 926 6.249 9.510 -5.828 1.00 0.00 C ATOM 569 C GLU A 926 6.343 9.688 -4.316 1.00 0.00 C ATOM 570 O GLU A 926 5.937 10.717 -3.774 1.00 0.00 O ATOM 571 CB GLU A 926 7.405 10.244 -6.511 1.00 0.00 C ATOM 572 CG GLU A 926 8.777 9.773 -6.059 1.00 0.00 C ATOM 573 CD GLU A 926 9.028 8.313 -6.381 1.00 0.00 C ATOM 574 OE1 GLU A 926 8.268 7.457 -5.881 1.00 0.00 O ATOM 575 OE2 GLU A 926 9.984 8.026 -7.131 1.00 0.00 O ATOM 0 H GLU A 926 4.963 10.991 -6.569 1.00 0.00 H new ATOM 0 HA GLU A 926 6.317 8.446 -6.056 1.00 0.00 H new ATOM 0 HB2 GLU A 926 7.322 10.111 -7.590 1.00 0.00 H new ATOM 0 HB3 GLU A 926 7.313 11.312 -6.313 1.00 0.00 H new ATOM 0 HG2 GLU A 926 9.543 10.384 -6.538 1.00 0.00 H new ATOM 0 HG3 GLU A 926 8.874 9.926 -4.984 1.00 0.00 H new ATOM 582 N VAL A 927 6.880 8.678 -3.639 1.00 0.00 N ATOM 583 CA VAL A 927 7.028 8.722 -2.189 1.00 0.00 C ATOM 584 C VAL A 927 8.401 9.253 -1.793 1.00 0.00 C ATOM 585 O VAL A 927 9.393 9.014 -2.482 1.00 0.00 O ATOM 586 CB VAL A 927 6.828 7.329 -1.562 1.00 0.00 C ATOM 587 CG1 VAL A 927 6.938 7.405 -0.047 1.00 0.00 C ATOM 588 CG2 VAL A 927 5.487 6.745 -1.980 1.00 0.00 C ATOM 0 H VAL A 927 7.220 7.819 -4.072 1.00 0.00 H new ATOM 0 HA VAL A 927 6.258 9.396 -1.812 1.00 0.00 H new ATOM 0 HB VAL A 927 7.615 6.669 -1.926 1.00 0.00 H new ATOM 0 HG11 VAL A 927 6.794 6.412 0.379 1.00 0.00 H new ATOM 0 HG12 VAL A 927 7.925 7.778 0.228 1.00 0.00 H new ATOM 0 HG13 VAL A 927 6.174 8.080 0.340 1.00 0.00 H new ATOM 0 HG21 VAL A 927 5.362 5.761 -1.528 1.00 0.00 H new ATOM 0 HG22 VAL A 927 4.684 7.402 -1.646 1.00 0.00 H new ATOM 0 HG23 VAL A 927 5.453 6.653 -3.066 1.00 0.00 H new ATOM 598 N ILE A 928 8.451 9.975 -0.678 1.00 0.00 N ATOM 599 CA ILE A 928 9.703 10.539 -0.189 1.00 0.00 C ATOM 600 C ILE A 928 9.995 10.076 1.234 1.00 0.00 C ATOM 601 O ILE A 928 11.129 9.726 1.565 1.00 0.00 O ATOM 602 CB ILE A 928 9.677 12.078 -0.221 1.00 0.00 C ATOM 603 CG1 ILE A 928 8.511 12.608 0.616 1.00 0.00 C ATOM 604 CG2 ILE A 928 9.576 12.577 -1.655 1.00 0.00 C ATOM 605 CD1 ILE A 928 8.433 14.118 0.657 1.00 0.00 C ATOM 0 H ILE A 928 7.639 10.183 -0.097 1.00 0.00 H new ATOM 0 HA ILE A 928 10.491 10.183 -0.853 1.00 0.00 H new ATOM 0 HB ILE A 928 10.607 12.451 0.208 1.00 0.00 H new ATOM 0 HG12 ILE A 928 7.577 12.215 0.213 1.00 0.00 H new ATOM 0 HG13 ILE A 928 8.604 12.229 1.634 1.00 0.00 H new ATOM 0 HG21 ILE A 928 9.559 13.667 -1.661 1.00 0.00 H new ATOM 0 HG22 ILE A 928 10.436 12.225 -2.224 1.00 0.00 H new ATOM 0 HG23 ILE A 928 8.661 12.197 -2.109 1.00 0.00 H new ATOM 0 HD11 ILE A 928 7.583 14.422 1.268 1.00 0.00 H new ATOM 0 HD12 ILE A 928 9.351 14.518 1.088 1.00 0.00 H new ATOM 0 HD13 ILE A 928 8.309 14.504 -0.355 1.00 0.00 H new ATOM 617 N LEU A 929 8.965 10.074 2.073 1.00 0.00 N ATOM 618 CA LEU A 929 9.110 9.652 3.462 1.00 0.00 C ATOM 619 C LEU A 929 7.923 8.800 3.899 1.00 0.00 C ATOM 620 O LEU A 929 6.782 9.068 3.522 1.00 0.00 O ATOM 621 CB LEU A 929 9.241 10.872 4.376 1.00 0.00 C ATOM 622 CG LEU A 929 9.543 10.581 5.846 1.00 0.00 C ATOM 623 CD1 LEU A 929 11.019 10.265 6.035 1.00 0.00 C ATOM 624 CD2 LEU A 929 9.131 11.757 6.719 1.00 0.00 C ATOM 0 H LEU A 929 8.020 10.360 1.816 1.00 0.00 H new ATOM 0 HA LEU A 929 10.015 9.049 3.540 1.00 0.00 H new ATOM 0 HB2 LEU A 929 10.031 11.512 3.983 1.00 0.00 H new ATOM 0 HB3 LEU A 929 8.314 11.442 4.323 1.00 0.00 H new ATOM 0 HG LEU A 929 8.964 9.709 6.150 1.00 0.00 H new ATOM 0 HD11 LEU A 929 11.215 10.061 7.087 1.00 0.00 H new ATOM 0 HD12 LEU A 929 11.283 9.391 5.440 1.00 0.00 H new ATOM 0 HD13 LEU A 929 11.618 11.117 5.713 1.00 0.00 H new ATOM 0 HD21 LEU A 929 9.354 11.531 7.762 1.00 0.00 H new ATOM 0 HD22 LEU A 929 9.682 12.647 6.415 1.00 0.00 H new ATOM 0 HD23 LEU A 929 8.062 11.936 6.607 1.00 0.00 H new ATOM 636 N ILE A 930 8.199 7.775 4.698 1.00 0.00 N ATOM 637 CA ILE A 930 7.154 6.886 5.189 1.00 0.00 C ATOM 638 C ILE A 930 7.209 6.758 6.708 1.00 0.00 C ATOM 639 O ILE A 930 8.247 6.416 7.274 1.00 0.00 O ATOM 640 CB ILE A 930 7.267 5.484 4.563 1.00 0.00 C ATOM 641 CG1 ILE A 930 7.091 5.564 3.045 1.00 0.00 C ATOM 642 CG2 ILE A 930 6.235 4.547 5.172 1.00 0.00 C ATOM 643 CD1 ILE A 930 7.426 4.274 2.329 1.00 0.00 C ATOM 0 H ILE A 930 9.138 7.540 5.019 1.00 0.00 H new ATOM 0 HA ILE A 930 6.201 7.329 4.898 1.00 0.00 H new ATOM 0 HB ILE A 930 8.260 5.087 4.775 1.00 0.00 H new ATOM 0 HG12 ILE A 930 6.060 5.837 2.821 1.00 0.00 H new ATOM 0 HG13 ILE A 930 7.724 6.361 2.655 1.00 0.00 H new ATOM 0 HG21 ILE A 930 6.328 3.560 4.719 1.00 0.00 H new ATOM 0 HG22 ILE A 930 6.402 4.470 6.246 1.00 0.00 H new ATOM 0 HG23 ILE A 930 5.235 4.938 4.988 1.00 0.00 H new ATOM 0 HD11 ILE A 930 7.279 4.404 1.257 1.00 0.00 H new ATOM 0 HD12 ILE A 930 8.466 4.010 2.523 1.00 0.00 H new ATOM 0 HD13 ILE A 930 6.776 3.478 2.691 1.00 0.00 H new ATOM 655 N ARG A 931 6.085 7.035 7.361 1.00 0.00 N ATOM 656 CA ARG A 931 6.005 6.950 8.814 1.00 0.00 C ATOM 657 C ARG A 931 5.068 5.824 9.242 1.00 0.00 C ATOM 658 O ARG A 931 3.896 5.800 8.865 1.00 0.00 O ATOM 659 CB ARG A 931 5.523 8.279 9.398 1.00 0.00 C ATOM 660 CG ARG A 931 5.823 8.438 10.879 1.00 0.00 C ATOM 661 CD ARG A 931 7.292 8.751 11.120 1.00 0.00 C ATOM 662 NE ARG A 931 7.519 9.333 12.440 1.00 0.00 N ATOM 663 CZ ARG A 931 7.107 10.547 12.788 1.00 0.00 C ATOM 664 NH1 ARG A 931 6.451 11.303 11.919 1.00 0.00 N ATOM 665 NH2 ARG A 931 7.352 11.007 14.008 1.00 0.00 N ATOM 0 H ARG A 931 5.217 7.320 6.907 1.00 0.00 H new ATOM 0 HA ARG A 931 7.003 6.734 9.196 1.00 0.00 H new ATOM 0 HB2 ARG A 931 5.991 9.097 8.851 1.00 0.00 H new ATOM 0 HB3 ARG A 931 4.448 8.366 9.242 1.00 0.00 H new ATOM 0 HG2 ARG A 931 5.207 9.237 11.292 1.00 0.00 H new ATOM 0 HG3 ARG A 931 5.554 7.523 11.406 1.00 0.00 H new ATOM 0 HD2 ARG A 931 7.878 7.837 11.021 1.00 0.00 H new ATOM 0 HD3 ARG A 931 7.646 9.441 10.354 1.00 0.00 H new ATOM 0 HE ARG A 931 8.021 8.777 13.132 1.00 0.00 H new ATOM 0 HH11 ARG A 931 6.261 10.953 10.980 1.00 0.00 H new ATOM 0 HH12 ARG A 931 6.136 12.235 12.189 1.00 0.00 H new ATOM 0 HH21 ARG A 931 7.857 10.428 14.679 1.00 0.00 H new ATOM 0 HH22 ARG A 931 7.035 11.939 14.275 1.00 0.00 H new ATOM 679 N PHE A 932 5.593 4.893 10.032 1.00 0.00 N ATOM 680 CA PHE A 932 4.804 3.764 10.511 1.00 0.00 C ATOM 681 C PHE A 932 4.136 4.092 11.843 1.00 0.00 C ATOM 682 O PHE A 932 4.806 4.427 12.820 1.00 0.00 O ATOM 683 CB PHE A 932 5.688 2.525 10.663 1.00 0.00 C ATOM 684 CG PHE A 932 6.464 2.186 9.422 1.00 0.00 C ATOM 685 CD1 PHE A 932 5.841 1.580 8.343 1.00 0.00 C ATOM 686 CD2 PHE A 932 7.817 2.474 9.335 1.00 0.00 C ATOM 687 CE1 PHE A 932 6.552 1.267 7.200 1.00 0.00 C ATOM 688 CE2 PHE A 932 8.533 2.164 8.194 1.00 0.00 C ATOM 689 CZ PHE A 932 7.900 1.559 7.126 1.00 0.00 C ATOM 0 H PHE A 932 6.561 4.898 10.354 1.00 0.00 H new ATOM 0 HA PHE A 932 4.026 3.559 9.776 1.00 0.00 H new ATOM 0 HB2 PHE A 932 6.385 2.685 11.486 1.00 0.00 H new ATOM 0 HB3 PHE A 932 5.063 1.674 10.935 1.00 0.00 H new ATOM 0 HD1 PHE A 932 4.787 1.349 8.396 1.00 0.00 H new ATOM 0 HD2 PHE A 932 8.317 2.946 10.168 1.00 0.00 H new ATOM 0 HE1 PHE A 932 6.054 0.795 6.366 1.00 0.00 H new ATOM 0 HE2 PHE A 932 9.587 2.395 8.138 1.00 0.00 H new ATOM 0 HZ PHE A 932 8.458 1.315 6.234 1.00 0.00 H new ATOM 699 N VAL A 933 2.811 3.995 11.873 1.00 0.00 N ATOM 700 CA VAL A 933 2.051 4.281 13.084 1.00 0.00 C ATOM 701 C VAL A 933 1.875 3.027 13.932 1.00 0.00 C ATOM 702 O VAL A 933 1.952 1.908 13.425 1.00 0.00 O ATOM 703 CB VAL A 933 0.663 4.862 12.752 1.00 0.00 C ATOM 704 CG1 VAL A 933 0.076 5.570 13.964 1.00 0.00 C ATOM 705 CG2 VAL A 933 0.752 5.808 11.564 1.00 0.00 C ATOM 0 H VAL A 933 2.241 3.721 11.073 1.00 0.00 H new ATOM 0 HA VAL A 933 2.621 5.020 13.648 1.00 0.00 H new ATOM 0 HB VAL A 933 -0.001 4.040 12.484 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -0.904 5.974 13.710 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -0.025 4.861 14.786 1.00 0.00 H new ATOM 0 HG13 VAL A 933 0.736 6.383 14.266 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -0.237 6.209 11.343 1.00 0.00 H new ATOM 0 HG22 VAL A 933 1.431 6.627 11.801 1.00 0.00 H new ATOM 0 HG23 VAL A 933 1.126 5.267 10.695 1.00 0.00 H new ATOM 715 N GLU A 934 1.637 3.221 15.225 1.00 0.00 N ATOM 716 CA GLU A 934 1.451 2.104 16.143 1.00 0.00 C ATOM 717 C GLU A 934 0.751 0.939 15.448 1.00 0.00 C ATOM 718 O GLU A 934 1.213 -0.201 15.508 1.00 0.00 O ATOM 719 CB GLU A 934 0.638 2.547 17.362 1.00 0.00 C ATOM 720 CG GLU A 934 1.295 3.660 18.160 1.00 0.00 C ATOM 721 CD GLU A 934 0.569 3.955 19.458 1.00 0.00 C ATOM 722 OE1 GLU A 934 -0.673 4.086 19.425 1.00 0.00 O ATOM 723 OE2 GLU A 934 1.241 4.055 20.505 1.00 0.00 O ATOM 0 H GLU A 934 1.568 4.141 15.660 1.00 0.00 H new ATOM 0 HA GLU A 934 2.435 1.770 16.472 1.00 0.00 H new ATOM 0 HB2 GLU A 934 -0.345 2.881 17.031 1.00 0.00 H new ATOM 0 HB3 GLU A 934 0.480 1.688 18.014 1.00 0.00 H new ATOM 0 HG2 GLU A 934 2.326 3.384 18.380 1.00 0.00 H new ATOM 0 HG3 GLU A 934 1.329 4.565 17.554 1.00 0.00 H new ATOM 730 N ASP A 935 -0.364 1.235 14.789 1.00 0.00 N ATOM 731 CA ASP A 935 -1.127 0.213 14.082 1.00 0.00 C ATOM 732 C ASP A 935 -1.351 0.613 12.627 1.00 0.00 C ATOM 733 O ASP A 935 -1.516 -0.241 11.755 1.00 0.00 O ATOM 734 CB ASP A 935 -2.472 -0.019 14.773 1.00 0.00 C ATOM 735 CG ASP A 935 -2.341 -0.099 16.281 1.00 0.00 C ATOM 736 OD1 ASP A 935 -1.342 -0.675 16.760 1.00 0.00 O ATOM 737 OD2 ASP A 935 -3.239 0.413 16.983 1.00 0.00 O ATOM 0 H ASP A 935 -0.759 2.173 14.730 1.00 0.00 H new ATOM 0 HA ASP A 935 -0.553 -0.713 14.102 1.00 0.00 H new ATOM 0 HB2 ASP A 935 -3.155 0.789 14.513 1.00 0.00 H new ATOM 0 HB3 ASP A 935 -2.914 -0.943 14.400 1.00 0.00 H new ATOM 742 N LYS A 936 -1.357 1.917 12.371 1.00 0.00 N ATOM 743 CA LYS A 936 -1.560 2.431 11.022 1.00 0.00 C ATOM 744 C LYS A 936 -0.226 2.737 10.349 1.00 0.00 C ATOM 745 O LYS A 936 0.828 2.673 10.982 1.00 0.00 O ATOM 746 CB LYS A 936 -2.425 3.693 11.060 1.00 0.00 C ATOM 747 CG LYS A 936 -3.283 3.880 9.820 1.00 0.00 C ATOM 748 CD LYS A 936 -4.499 4.744 10.109 1.00 0.00 C ATOM 749 CE LYS A 936 -5.495 4.022 11.004 1.00 0.00 C ATOM 750 NZ LYS A 936 -5.225 4.270 12.447 1.00 0.00 N ATOM 0 H LYS A 936 -1.223 2.637 13.081 1.00 0.00 H new ATOM 0 HA LYS A 936 -2.072 1.664 10.441 1.00 0.00 H new ATOM 0 HB2 LYS A 936 -3.072 3.654 11.937 1.00 0.00 H new ATOM 0 HB3 LYS A 936 -1.779 4.563 11.179 1.00 0.00 H new ATOM 0 HG2 LYS A 936 -2.688 4.340 9.031 1.00 0.00 H new ATOM 0 HG3 LYS A 936 -3.606 2.907 9.450 1.00 0.00 H new ATOM 0 HD2 LYS A 936 -4.183 5.671 10.588 1.00 0.00 H new ATOM 0 HD3 LYS A 936 -4.983 5.019 9.172 1.00 0.00 H new ATOM 0 HE2 LYS A 936 -6.506 4.351 10.762 1.00 0.00 H new ATOM 0 HE3 LYS A 936 -5.452 2.951 10.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 936 -4.806 3.419 12.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 936 -4.564 5.067 12.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 936 -6.116 4.497 12.933 1.00 0.00 H new ATOM 764 N MET A 937 -0.279 3.070 9.063 1.00 0.00 N ATOM 765 CA MET A 937 0.926 3.388 8.307 1.00 0.00 C ATOM 766 C MET A 937 0.718 4.635 7.452 1.00 0.00 C ATOM 767 O MET A 937 -0.053 4.619 6.492 1.00 0.00 O ATOM 768 CB MET A 937 1.324 2.208 7.418 1.00 0.00 C ATOM 769 CG MET A 937 2.293 2.581 6.309 1.00 0.00 C ATOM 770 SD MET A 937 2.795 1.161 5.318 1.00 0.00 S ATOM 771 CE MET A 937 3.572 1.977 3.926 1.00 0.00 C ATOM 0 H MET A 937 -1.143 3.126 8.524 1.00 0.00 H new ATOM 0 HA MET A 937 1.729 3.585 9.018 1.00 0.00 H new ATOM 0 HB2 MET A 937 1.775 1.433 8.038 1.00 0.00 H new ATOM 0 HB3 MET A 937 0.425 1.779 6.975 1.00 0.00 H new ATOM 0 HG2 MET A 937 1.829 3.325 5.662 1.00 0.00 H new ATOM 0 HG3 MET A 937 3.177 3.045 6.746 1.00 0.00 H new ATOM 0 HE1 MET A 937 4.298 1.304 3.469 1.00 0.00 H new ATOM 0 HE2 MET A 937 2.813 2.246 3.191 1.00 0.00 H new ATOM 0 HE3 MET A 937 4.079 2.878 4.270 1.00 0.00 H new ATOM 781 N TRP A 938 1.409 5.712 7.807 1.00 0.00 N ATOM 782 CA TRP A 938 1.299 6.967 7.072 1.00 0.00 C ATOM 783 C TRP A 938 2.365 7.057 5.986 1.00 0.00 C ATOM 784 O TRP A 938 3.479 6.558 6.152 1.00 0.00 O ATOM 785 CB TRP A 938 1.426 8.154 8.028 1.00 0.00 C ATOM 786 CG TRP A 938 0.356 8.190 9.076 1.00 0.00 C ATOM 787 CD1 TRP A 938 -0.649 7.282 9.253 1.00 0.00 C ATOM 788 CD2 TRP A 938 0.183 9.184 10.091 1.00 0.00 C ATOM 789 NE1 TRP A 938 -1.437 7.652 10.316 1.00 0.00 N ATOM 790 CE2 TRP A 938 -0.947 8.816 10.848 1.00 0.00 C ATOM 791 CE3 TRP A 938 0.873 10.349 10.436 1.00 0.00 C ATOM 792 CZ2 TRP A 938 -1.399 9.572 11.926 1.00 0.00 C ATOM 793 CZ3 TRP A 938 0.422 11.099 11.506 1.00 0.00 C ATOM 794 CH2 TRP A 938 -0.704 10.708 12.241 1.00 0.00 C ATOM 0 H TRP A 938 2.051 5.742 8.599 1.00 0.00 H new ATOM 0 HA TRP A 938 0.319 6.996 6.596 1.00 0.00 H new ATOM 0 HB2 TRP A 938 2.400 8.116 8.515 1.00 0.00 H new ATOM 0 HB3 TRP A 938 1.393 9.079 7.453 1.00 0.00 H new ATOM 0 HD1 TRP A 938 -0.802 6.402 8.646 1.00 0.00 H new ATOM 0 HE1 TRP A 938 -2.254 7.143 10.654 1.00 0.00 H new ATOM 0 HE3 TRP A 938 1.743 10.658 9.876 1.00 0.00 H new ATOM 0 HZ2 TRP A 938 -2.268 9.273 12.494 1.00 0.00 H new ATOM 0 HZ3 TRP A 938 0.947 12.002 11.780 1.00 0.00 H new ATOM 0 HH2 TRP A 938 -1.030 11.315 13.073 1.00 0.00 H new ATOM 805 N VAL A 939 2.018 7.696 4.873 1.00 0.00 N ATOM 806 CA VAL A 939 2.946 7.852 3.760 1.00 0.00 C ATOM 807 C VAL A 939 2.964 9.291 3.257 1.00 0.00 C ATOM 808 O VAL A 939 1.936 9.831 2.847 1.00 0.00 O ATOM 809 CB VAL A 939 2.584 6.916 2.591 1.00 0.00 C ATOM 810 CG1 VAL A 939 3.560 7.098 1.439 1.00 0.00 C ATOM 811 CG2 VAL A 939 2.560 5.468 3.057 1.00 0.00 C ATOM 0 H VAL A 939 1.100 8.114 4.719 1.00 0.00 H new ATOM 0 HA VAL A 939 3.935 7.588 4.134 1.00 0.00 H new ATOM 0 HB VAL A 939 1.587 7.176 2.235 1.00 0.00 H new ATOM 0 HG11 VAL A 939 3.288 6.429 0.623 1.00 0.00 H new ATOM 0 HG12 VAL A 939 3.522 8.130 1.090 1.00 0.00 H new ATOM 0 HG13 VAL A 939 4.570 6.866 1.778 1.00 0.00 H new ATOM 0 HG21 VAL A 939 2.303 4.820 2.219 1.00 0.00 H new ATOM 0 HG22 VAL A 939 3.543 5.193 3.440 1.00 0.00 H new ATOM 0 HG23 VAL A 939 1.817 5.352 3.846 1.00 0.00 H new ATOM 821 N THR A 940 4.140 9.910 3.291 1.00 0.00 N ATOM 822 CA THR A 940 4.293 11.287 2.839 1.00 0.00 C ATOM 823 C THR A 940 4.515 11.350 1.332 1.00 0.00 C ATOM 824 O THR A 940 5.037 10.411 0.732 1.00 0.00 O ATOM 825 CB THR A 940 5.468 11.985 3.550 1.00 0.00 C ATOM 826 OG1 THR A 940 5.139 12.220 4.924 1.00 0.00 O ATOM 827 CG2 THR A 940 5.806 13.303 2.871 1.00 0.00 C ATOM 0 H THR A 940 5.001 9.479 3.627 1.00 0.00 H new ATOM 0 HA THR A 940 3.368 11.806 3.089 1.00 0.00 H new ATOM 0 HB THR A 940 6.339 11.332 3.492 1.00 0.00 H new ATOM 0 HG1 THR A 940 5.891 12.662 5.370 1.00 0.00 H new ATOM 0 HG21 THR A 940 6.638 13.777 3.391 1.00 0.00 H new ATOM 0 HG22 THR A 940 6.085 13.117 1.834 1.00 0.00 H new ATOM 0 HG23 THR A 940 4.938 13.961 2.901 1.00 0.00 H new ATOM 835 N PHE A 941 4.118 12.464 0.726 1.00 0.00 N ATOM 836 CA PHE A 941 4.274 12.650 -0.712 1.00 0.00 C ATOM 837 C PHE A 941 4.851 14.028 -1.023 1.00 0.00 C ATOM 838 O PHE A 941 4.511 15.017 -0.373 1.00 0.00 O ATOM 839 CB PHE A 941 2.928 12.476 -1.419 1.00 0.00 C ATOM 840 CG PHE A 941 2.541 11.040 -1.626 1.00 0.00 C ATOM 841 CD1 PHE A 941 2.324 10.204 -0.543 1.00 0.00 C ATOM 842 CD2 PHE A 941 2.394 10.526 -2.905 1.00 0.00 C ATOM 843 CE1 PHE A 941 1.967 8.882 -0.730 1.00 0.00 C ATOM 844 CE2 PHE A 941 2.036 9.205 -3.098 1.00 0.00 C ATOM 845 CZ PHE A 941 1.824 8.381 -2.009 1.00 0.00 C ATOM 0 H PHE A 941 3.686 13.252 1.208 1.00 0.00 H new ATOM 0 HA PHE A 941 4.969 11.894 -1.078 1.00 0.00 H new ATOM 0 HB2 PHE A 941 2.153 12.972 -0.835 1.00 0.00 H new ATOM 0 HB3 PHE A 941 2.967 12.976 -2.387 1.00 0.00 H new ATOM 0 HD1 PHE A 941 2.435 10.590 0.460 1.00 0.00 H new ATOM 0 HD2 PHE A 941 2.561 11.165 -3.760 1.00 0.00 H new ATOM 0 HE1 PHE A 941 1.800 8.241 0.123 1.00 0.00 H new ATOM 0 HE2 PHE A 941 1.922 8.817 -4.099 1.00 0.00 H new ATOM 0 HZ PHE A 941 1.547 7.348 -2.158 1.00 0.00 H new ATOM 855 N LEU A 942 5.726 14.084 -2.021 1.00 0.00 N ATOM 856 CA LEU A 942 6.352 15.340 -2.419 1.00 0.00 C ATOM 857 C LEU A 942 5.332 16.474 -2.439 1.00 0.00 C ATOM 858 O LEU A 942 5.578 17.551 -1.897 1.00 0.00 O ATOM 859 CB LEU A 942 6.998 15.196 -3.798 1.00 0.00 C ATOM 860 CG LEU A 942 7.490 16.490 -4.448 1.00 0.00 C ATOM 861 CD1 LEU A 942 8.772 16.967 -3.784 1.00 0.00 C ATOM 862 CD2 LEU A 942 7.703 16.289 -5.941 1.00 0.00 C ATOM 0 H LEU A 942 6.018 13.275 -2.569 1.00 0.00 H new ATOM 0 HA LEU A 942 7.123 15.582 -1.687 1.00 0.00 H new ATOM 0 HB2 LEU A 942 7.843 14.513 -3.712 1.00 0.00 H new ATOM 0 HB3 LEU A 942 6.277 14.728 -4.468 1.00 0.00 H new ATOM 0 HG LEU A 942 6.727 17.256 -4.310 1.00 0.00 H new ATOM 0 HD11 LEU A 942 9.107 17.889 -4.260 1.00 0.00 H new ATOM 0 HD12 LEU A 942 8.587 17.151 -2.726 1.00 0.00 H new ATOM 0 HD13 LEU A 942 9.543 16.203 -3.890 1.00 0.00 H new ATOM 0 HD21 LEU A 942 8.053 17.220 -6.387 1.00 0.00 H new ATOM 0 HD22 LEU A 942 8.446 15.508 -6.101 1.00 0.00 H new ATOM 0 HD23 LEU A 942 6.762 15.995 -6.406 1.00 0.00 H new ATOM 874 N GLU A 943 4.187 16.223 -3.066 1.00 0.00 N ATOM 875 CA GLU A 943 3.130 17.223 -3.155 1.00 0.00 C ATOM 876 C GLU A 943 1.842 16.712 -2.515 1.00 0.00 C ATOM 877 O GLU A 943 1.767 15.566 -2.075 1.00 0.00 O ATOM 878 CB GLU A 943 2.873 17.597 -4.616 1.00 0.00 C ATOM 879 CG GLU A 943 4.099 18.139 -5.331 1.00 0.00 C ATOM 880 CD GLU A 943 3.747 18.936 -6.572 1.00 0.00 C ATOM 881 OE1 GLU A 943 3.423 18.313 -7.605 1.00 0.00 O ATOM 882 OE2 GLU A 943 3.795 20.182 -6.510 1.00 0.00 O ATOM 0 H GLU A 943 3.968 15.336 -3.520 1.00 0.00 H new ATOM 0 HA GLU A 943 3.458 18.110 -2.613 1.00 0.00 H new ATOM 0 HB2 GLU A 943 2.511 16.718 -5.149 1.00 0.00 H new ATOM 0 HB3 GLU A 943 2.080 18.343 -4.657 1.00 0.00 H new ATOM 0 HG2 GLU A 943 4.664 18.771 -4.646 1.00 0.00 H new ATOM 0 HG3 GLU A 943 4.749 17.309 -5.609 1.00 0.00 H new ATOM 889 N GLY A 944 0.830 17.573 -2.467 1.00 0.00 N ATOM 890 CA GLY A 944 -0.441 17.192 -1.879 1.00 0.00 C ATOM 891 C GLY A 944 -1.390 16.583 -2.892 1.00 0.00 C ATOM 892 O GLY A 944 -2.104 15.628 -2.589 1.00 0.00 O ATOM 0 H GLY A 944 0.868 18.527 -2.825 1.00 0.00 H new ATOM 0 HA2 GLY A 944 -0.266 16.477 -1.075 1.00 0.00 H new ATOM 0 HA3 GLY A 944 -0.908 18.069 -1.430 1.00 0.00 H new ATOM 896 N SER A 945 -1.399 17.139 -4.100 1.00 0.00 N ATOM 897 CA SER A 945 -2.271 16.649 -5.160 1.00 0.00 C ATOM 898 C SER A 945 -1.977 15.185 -5.472 1.00 0.00 C ATOM 899 O SER A 945 -2.891 14.387 -5.683 1.00 0.00 O ATOM 900 CB SER A 945 -2.100 17.495 -6.423 1.00 0.00 C ATOM 901 OG SER A 945 -0.737 17.574 -6.804 1.00 0.00 O ATOM 0 H SER A 945 -0.812 17.929 -4.368 1.00 0.00 H new ATOM 0 HA SER A 945 -3.302 16.729 -4.814 1.00 0.00 H new ATOM 0 HB2 SER A 945 -2.683 17.063 -7.236 1.00 0.00 H new ATOM 0 HB3 SER A 945 -2.491 18.498 -6.249 1.00 0.00 H new ATOM 0 HG SER A 945 -0.655 18.119 -7.615 1.00 0.00 H new ATOM 907 N SER A 946 -0.694 14.839 -5.501 1.00 0.00 N ATOM 908 CA SER A 946 -0.277 13.472 -5.791 1.00 0.00 C ATOM 909 C SER A 946 -0.921 12.489 -4.818 1.00 0.00 C ATOM 910 O SER A 946 -1.245 11.359 -5.183 1.00 0.00 O ATOM 911 CB SER A 946 1.247 13.354 -5.719 1.00 0.00 C ATOM 912 OG SER A 946 1.724 13.699 -4.430 1.00 0.00 O ATOM 0 H SER A 946 0.075 15.486 -5.327 1.00 0.00 H new ATOM 0 HA SER A 946 -0.606 13.225 -6.800 1.00 0.00 H new ATOM 0 HB2 SER A 946 1.548 12.335 -5.961 1.00 0.00 H new ATOM 0 HB3 SER A 946 1.701 14.006 -6.465 1.00 0.00 H new ATOM 0 HG SER A 946 2.701 13.770 -4.451 1.00 0.00 H new ATOM 918 N ALA A 947 -1.103 12.929 -3.577 1.00 0.00 N ATOM 919 CA ALA A 947 -1.709 12.090 -2.551 1.00 0.00 C ATOM 920 C ALA A 947 -3.197 11.887 -2.816 1.00 0.00 C ATOM 921 O ALA A 947 -3.826 11.001 -2.237 1.00 0.00 O ATOM 922 CB ALA A 947 -1.495 12.703 -1.174 1.00 0.00 C ATOM 0 H ALA A 947 -0.839 13.861 -3.258 1.00 0.00 H new ATOM 0 HA ALA A 947 -1.225 11.114 -2.582 1.00 0.00 H new ATOM 0 HB1 ALA A 947 -1.953 12.066 -0.417 1.00 0.00 H new ATOM 0 HB2 ALA A 947 -0.427 12.791 -0.977 1.00 0.00 H new ATOM 0 HB3 ALA A 947 -1.952 13.692 -1.141 1.00 0.00 H new ATOM 928 N LEU A 948 -3.755 12.714 -3.694 1.00 0.00 N ATOM 929 CA LEU A 948 -5.170 12.625 -4.036 1.00 0.00 C ATOM 930 C LEU A 948 -5.404 11.575 -5.117 1.00 0.00 C ATOM 931 O LEU A 948 -6.453 10.933 -5.156 1.00 0.00 O ATOM 932 CB LEU A 948 -5.686 13.985 -4.509 1.00 0.00 C ATOM 933 CG LEU A 948 -5.307 15.186 -3.641 1.00 0.00 C ATOM 934 CD1 LEU A 948 -5.880 16.468 -4.225 1.00 0.00 C ATOM 935 CD2 LEU A 948 -5.792 14.986 -2.213 1.00 0.00 C ATOM 0 H LEU A 948 -3.249 13.453 -4.182 1.00 0.00 H new ATOM 0 HA LEU A 948 -5.717 12.326 -3.142 1.00 0.00 H new ATOM 0 HB2 LEU A 948 -5.315 14.161 -5.519 1.00 0.00 H new ATOM 0 HB3 LEU A 948 -6.773 13.937 -4.572 1.00 0.00 H new ATOM 0 HG LEU A 948 -4.220 15.271 -3.626 1.00 0.00 H new ATOM 0 HD11 LEU A 948 -5.600 17.312 -3.594 1.00 0.00 H new ATOM 0 HD12 LEU A 948 -5.485 16.619 -5.229 1.00 0.00 H new ATOM 0 HD13 LEU A 948 -6.966 16.393 -4.270 1.00 0.00 H new ATOM 0 HD21 LEU A 948 -5.514 15.850 -1.610 1.00 0.00 H new ATOM 0 HD22 LEU A 948 -6.876 14.875 -2.209 1.00 0.00 H new ATOM 0 HD23 LEU A 948 -5.334 14.089 -1.795 1.00 0.00 H new ATOM 947 N ASN A 949 -4.419 11.405 -5.993 1.00 0.00 N ATOM 948 CA ASN A 949 -4.518 10.431 -7.075 1.00 0.00 C ATOM 949 C ASN A 949 -4.317 9.013 -6.549 1.00 0.00 C ATOM 950 O ASN A 949 -5.107 8.114 -6.840 1.00 0.00 O ATOM 951 CB ASN A 949 -3.483 10.737 -8.159 1.00 0.00 C ATOM 952 CG ASN A 949 -3.971 11.778 -9.147 1.00 0.00 C ATOM 953 OD1 ASN A 949 -4.732 11.471 -10.065 1.00 0.00 O ATOM 954 ND2 ASN A 949 -3.534 13.019 -8.963 1.00 0.00 N ATOM 0 H ASN A 949 -3.544 11.928 -5.975 1.00 0.00 H new ATOM 0 HA ASN A 949 -5.517 10.502 -7.506 1.00 0.00 H new ATOM 0 HB2 ASN A 949 -2.563 11.088 -7.691 1.00 0.00 H new ATOM 0 HB3 ASN A 949 -3.239 9.819 -8.694 1.00 0.00 H new ATOM 0 HD21 ASN A 949 -3.828 13.763 -9.596 1.00 0.00 H new ATOM 0 HD22 ASN A 949 -2.904 13.228 -8.189 1.00 0.00 H new ATOM 961 N VAL A 950 -3.255 8.820 -5.774 1.00 0.00 N ATOM 962 CA VAL A 950 -2.951 7.511 -5.206 1.00 0.00 C ATOM 963 C VAL A 950 -4.149 6.948 -4.450 1.00 0.00 C ATOM 964 O VAL A 950 -4.215 5.750 -4.174 1.00 0.00 O ATOM 965 CB VAL A 950 -1.743 7.580 -4.254 1.00 0.00 C ATOM 966 CG1 VAL A 950 -2.129 8.261 -2.949 1.00 0.00 C ATOM 967 CG2 VAL A 950 -1.190 6.187 -3.994 1.00 0.00 C ATOM 0 H VAL A 950 -2.591 9.553 -5.525 1.00 0.00 H new ATOM 0 HA VAL A 950 -2.710 6.852 -6.040 1.00 0.00 H new ATOM 0 HB VAL A 950 -0.962 8.174 -4.729 1.00 0.00 H new ATOM 0 HG11 VAL A 950 -1.262 8.300 -2.289 1.00 0.00 H new ATOM 0 HG12 VAL A 950 -2.474 9.274 -3.155 1.00 0.00 H new ATOM 0 HG13 VAL A 950 -2.927 7.697 -2.466 1.00 0.00 H new ATOM 0 HG21 VAL A 950 -0.337 6.254 -3.319 1.00 0.00 H new ATOM 0 HG22 VAL A 950 -1.963 5.567 -3.540 1.00 0.00 H new ATOM 0 HG23 VAL A 950 -0.873 5.740 -4.936 1.00 0.00 H new ATOM 977 N LEU A 951 -5.095 7.820 -4.119 1.00 0.00 N ATOM 978 CA LEU A 951 -6.293 7.410 -3.394 1.00 0.00 C ATOM 979 C LEU A 951 -6.985 6.248 -4.100 1.00 0.00 C ATOM 980 O LEU A 951 -7.703 5.469 -3.475 1.00 0.00 O ATOM 981 CB LEU A 951 -7.259 8.588 -3.259 1.00 0.00 C ATOM 982 CG LEU A 951 -6.892 9.641 -2.212 1.00 0.00 C ATOM 983 CD1 LEU A 951 -7.826 10.837 -2.308 1.00 0.00 C ATOM 984 CD2 LEU A 951 -6.934 9.040 -0.815 1.00 0.00 C ATOM 0 H LEU A 951 -5.056 8.815 -4.341 1.00 0.00 H new ATOM 0 HA LEU A 951 -5.992 7.080 -2.400 1.00 0.00 H new ATOM 0 HB2 LEU A 951 -7.338 9.080 -4.228 1.00 0.00 H new ATOM 0 HB3 LEU A 951 -8.247 8.196 -3.020 1.00 0.00 H new ATOM 0 HG LEU A 951 -5.876 9.983 -2.409 1.00 0.00 H new ATOM 0 HD11 LEU A 951 -7.550 11.576 -1.556 1.00 0.00 H new ATOM 0 HD12 LEU A 951 -7.746 11.282 -3.300 1.00 0.00 H new ATOM 0 HD13 LEU A 951 -8.852 10.512 -2.137 1.00 0.00 H new ATOM 0 HD21 LEU A 951 -6.670 9.803 -0.083 1.00 0.00 H new ATOM 0 HD22 LEU A 951 -7.938 8.670 -0.608 1.00 0.00 H new ATOM 0 HD23 LEU A 951 -6.224 8.216 -0.752 1.00 0.00 H new ATOM 996 N SER A 952 -6.762 6.138 -5.406 1.00 0.00 N ATOM 997 CA SER A 952 -7.365 5.073 -6.197 1.00 0.00 C ATOM 998 C SER A 952 -7.018 3.704 -5.619 1.00 0.00 C ATOM 999 O SER A 952 -7.726 2.722 -5.849 1.00 0.00 O ATOM 1000 CB SER A 952 -6.896 5.159 -7.650 1.00 0.00 C ATOM 1001 OG SER A 952 -5.481 5.190 -7.728 1.00 0.00 O ATOM 0 H SER A 952 -6.168 6.774 -5.938 1.00 0.00 H new ATOM 0 HA SER A 952 -8.447 5.199 -6.164 1.00 0.00 H new ATOM 0 HB2 SER A 952 -7.276 4.304 -8.209 1.00 0.00 H new ATOM 0 HB3 SER A 952 -7.309 6.054 -8.116 1.00 0.00 H new ATOM 0 HG SER A 952 -5.200 5.002 -8.648 1.00 0.00 H new ATOM 1007 N LEU A 953 -5.924 3.646 -4.868 1.00 0.00 N ATOM 1008 CA LEU A 953 -5.481 2.398 -4.256 1.00 0.00 C ATOM 1009 C LEU A 953 -6.220 2.142 -2.947 1.00 0.00 C ATOM 1010 O LEU A 953 -5.782 1.340 -2.123 1.00 0.00 O ATOM 1011 CB LEU A 953 -3.973 2.437 -4.005 1.00 0.00 C ATOM 1012 CG LEU A 953 -3.083 2.325 -5.244 1.00 0.00 C ATOM 1013 CD1 LEU A 953 -1.632 2.606 -4.886 1.00 0.00 C ATOM 1014 CD2 LEU A 953 -3.221 0.948 -5.876 1.00 0.00 C ATOM 0 H LEU A 953 -5.327 4.449 -4.668 1.00 0.00 H new ATOM 0 HA LEU A 953 -5.707 1.584 -4.945 1.00 0.00 H new ATOM 0 HB2 LEU A 953 -3.734 3.370 -3.494 1.00 0.00 H new ATOM 0 HB3 LEU A 953 -3.717 1.625 -3.324 1.00 0.00 H new ATOM 0 HG LEU A 953 -3.407 3.071 -5.970 1.00 0.00 H new ATOM 0 HD11 LEU A 953 -1.014 2.522 -5.780 1.00 0.00 H new ATOM 0 HD12 LEU A 953 -1.546 3.614 -4.479 1.00 0.00 H new ATOM 0 HD13 LEU A 953 -1.294 1.884 -4.142 1.00 0.00 H new ATOM 0 HD21 LEU A 953 -2.581 0.886 -6.756 1.00 0.00 H new ATOM 0 HD22 LEU A 953 -2.923 0.186 -5.156 1.00 0.00 H new ATOM 0 HD23 LEU A 953 -4.258 0.785 -6.169 1.00 0.00 H new ATOM 1026 N ASN A 954 -7.343 2.827 -2.763 1.00 0.00 N ATOM 1027 CA ASN A 954 -8.144 2.672 -1.554 1.00 0.00 C ATOM 1028 C ASN A 954 -8.871 1.330 -1.551 1.00 0.00 C ATOM 1029 O ASN A 954 -9.795 1.111 -2.333 1.00 0.00 O ATOM 1030 CB ASN A 954 -9.157 3.813 -1.438 1.00 0.00 C ATOM 1031 CG ASN A 954 -10.266 3.709 -2.467 1.00 0.00 C ATOM 1032 OD1 ASN A 954 -10.010 3.655 -3.670 1.00 0.00 O ATOM 1033 ND2 ASN A 954 -11.508 3.679 -1.996 1.00 0.00 N ATOM 0 H ASN A 954 -7.720 3.495 -3.436 1.00 0.00 H new ATOM 0 HA ASN A 954 -7.472 2.703 -0.697 1.00 0.00 H new ATOM 0 HB2 ASN A 954 -9.591 3.809 -0.438 1.00 0.00 H new ATOM 0 HB3 ASN A 954 -8.642 4.766 -1.558 1.00 0.00 H new ATOM 0 HD21 ASN A 954 -12.296 3.609 -2.640 1.00 0.00 H new ATOM 0 HD22 ASN A 954 -11.673 3.726 -0.991 1.00 0.00 H new ATOM 1040 N GLY A 955 -8.446 0.435 -0.664 1.00 0.00 N ATOM 1041 CA GLY A 955 -9.067 -0.873 -0.575 1.00 0.00 C ATOM 1042 C GLY A 955 -8.315 -1.927 -1.365 1.00 0.00 C ATOM 1043 O GLY A 955 -8.377 -3.114 -1.046 1.00 0.00 O ATOM 0 H GLY A 955 -7.683 0.593 -0.006 1.00 0.00 H new ATOM 0 HA2 GLY A 955 -9.120 -1.176 0.471 1.00 0.00 H new ATOM 0 HA3 GLY A 955 -10.092 -0.811 -0.941 1.00 0.00 H new ATOM 1047 N LYS A 956 -7.604 -1.493 -2.399 1.00 0.00 N ATOM 1048 CA LYS A 956 -6.836 -2.406 -3.238 1.00 0.00 C ATOM 1049 C LYS A 956 -6.188 -3.502 -2.398 1.00 0.00 C ATOM 1050 O LYS A 956 -5.498 -3.219 -1.419 1.00 0.00 O ATOM 1051 CB LYS A 956 -5.762 -1.639 -4.012 1.00 0.00 C ATOM 1052 CG LYS A 956 -5.347 -2.315 -5.307 1.00 0.00 C ATOM 1053 CD LYS A 956 -4.188 -3.274 -5.090 1.00 0.00 C ATOM 1054 CE LYS A 956 -3.673 -3.834 -6.407 1.00 0.00 C ATOM 1055 NZ LYS A 956 -4.641 -4.782 -7.023 1.00 0.00 N ATOM 0 H LYS A 956 -7.543 -0.514 -2.677 1.00 0.00 H new ATOM 0 HA LYS A 956 -7.521 -2.873 -3.946 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -6.132 -0.639 -4.236 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -4.884 -1.519 -3.377 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -6.196 -2.857 -5.723 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -5.062 -1.558 -6.038 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -3.380 -2.758 -4.572 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -4.508 -4.093 -4.446 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -3.477 -3.014 -7.098 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -2.724 -4.343 -6.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -4.253 -5.141 -7.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -4.809 -5.577 -6.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -5.539 -4.291 -7.207 1.00 0.00 H new ATOM 1069 N GLU A 957 -6.415 -4.752 -2.787 1.00 0.00 N ATOM 1070 CA GLU A 957 -5.851 -5.890 -2.069 1.00 0.00 C ATOM 1071 C GLU A 957 -4.542 -6.342 -2.708 1.00 0.00 C ATOM 1072 O GLU A 957 -4.474 -6.572 -3.916 1.00 0.00 O ATOM 1073 CB GLU A 957 -6.848 -7.051 -2.046 1.00 0.00 C ATOM 1074 CG GLU A 957 -6.227 -8.377 -1.640 1.00 0.00 C ATOM 1075 CD GLU A 957 -7.217 -9.299 -0.954 1.00 0.00 C ATOM 1076 OE1 GLU A 957 -8.396 -9.314 -1.365 1.00 0.00 O ATOM 1077 OE2 GLU A 957 -6.812 -10.005 -0.007 1.00 0.00 O ATOM 0 H GLU A 957 -6.985 -5.003 -3.595 1.00 0.00 H new ATOM 0 HA GLU A 957 -5.646 -5.576 -1.046 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -7.657 -6.811 -1.355 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -7.294 -7.156 -3.035 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -5.827 -8.873 -2.525 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -5.386 -8.191 -0.972 1.00 0.00 H new ATOM 1084 N LEU A 958 -3.503 -6.466 -1.889 1.00 0.00 N ATOM 1085 CA LEU A 958 -2.194 -6.890 -2.373 1.00 0.00 C ATOM 1086 C LEU A 958 -1.564 -7.904 -1.423 1.00 0.00 C ATOM 1087 O LEU A 958 -1.946 -7.997 -0.256 1.00 0.00 O ATOM 1088 CB LEU A 958 -1.270 -5.681 -2.531 1.00 0.00 C ATOM 1089 CG LEU A 958 -0.059 -5.876 -3.445 1.00 0.00 C ATOM 1090 CD1 LEU A 958 -0.500 -6.005 -4.895 1.00 0.00 C ATOM 1091 CD2 LEU A 958 0.921 -4.723 -3.284 1.00 0.00 C ATOM 0 H LEU A 958 -3.542 -6.279 -0.887 1.00 0.00 H new ATOM 0 HA LEU A 958 -2.330 -7.365 -3.344 1.00 0.00 H new ATOM 0 HB2 LEU A 958 -1.858 -4.847 -2.914 1.00 0.00 H new ATOM 0 HB3 LEU A 958 -0.912 -5.391 -1.543 1.00 0.00 H new ATOM 0 HG LEU A 958 0.445 -6.798 -3.157 1.00 0.00 H new ATOM 0 HD11 LEU A 958 0.375 -6.143 -5.530 1.00 0.00 H new ATOM 0 HD12 LEU A 958 -1.163 -6.864 -4.999 1.00 0.00 H new ATOM 0 HD13 LEU A 958 -1.028 -5.100 -5.196 1.00 0.00 H new ATOM 0 HD21 LEU A 958 1.776 -4.878 -3.941 1.00 0.00 H new ATOM 0 HD22 LEU A 958 0.428 -3.787 -3.545 1.00 0.00 H new ATOM 0 HD23 LEU A 958 1.262 -4.677 -2.250 1.00 0.00 H new ATOM 1103 N LEU A 959 -0.597 -8.661 -1.930 1.00 0.00 N ATOM 1104 CA LEU A 959 0.087 -9.667 -1.127 1.00 0.00 C ATOM 1105 C LEU A 959 -0.885 -10.362 -0.179 1.00 0.00 C ATOM 1106 O LEU A 959 -0.574 -10.590 0.989 1.00 0.00 O ATOM 1107 CB LEU A 959 1.223 -9.025 -0.328 1.00 0.00 C ATOM 1108 CG LEU A 959 2.498 -8.708 -1.111 1.00 0.00 C ATOM 1109 CD1 LEU A 959 3.456 -7.888 -0.261 1.00 0.00 C ATOM 1110 CD2 LEU A 959 3.166 -9.992 -1.583 1.00 0.00 C ATOM 0 H LEU A 959 -0.269 -8.597 -2.894 1.00 0.00 H new ATOM 0 HA LEU A 959 0.503 -10.414 -1.804 1.00 0.00 H new ATOM 0 HB2 LEU A 959 0.852 -8.100 0.114 1.00 0.00 H new ATOM 0 HB3 LEU A 959 1.482 -9.690 0.496 1.00 0.00 H new ATOM 0 HG LEU A 959 2.227 -8.119 -1.987 1.00 0.00 H new ATOM 0 HD11 LEU A 959 4.357 -7.672 -0.834 1.00 0.00 H new ATOM 0 HD12 LEU A 959 2.977 -6.953 0.028 1.00 0.00 H new ATOM 0 HD13 LEU A 959 3.721 -8.451 0.634 1.00 0.00 H new ATOM 0 HD21 LEU A 959 4.072 -9.748 -2.138 1.00 0.00 H new ATOM 0 HD22 LEU A 959 3.424 -10.606 -0.720 1.00 0.00 H new ATOM 0 HD23 LEU A 959 2.482 -10.542 -2.229 1.00 0.00 H new ATOM 1122 N ASN A 960 -2.065 -10.698 -0.692 1.00 0.00 N ATOM 1123 CA ASN A 960 -3.083 -11.369 0.108 1.00 0.00 C ATOM 1124 C ASN A 960 -3.403 -10.566 1.365 1.00 0.00 C ATOM 1125 O ASN A 960 -3.530 -11.125 2.455 1.00 0.00 O ATOM 1126 CB ASN A 960 -2.616 -12.775 0.491 1.00 0.00 C ATOM 1127 CG ASN A 960 -2.225 -13.604 -0.717 1.00 0.00 C ATOM 1128 OD1 ASN A 960 -2.975 -14.478 -1.152 1.00 0.00 O ATOM 1129 ND2 ASN A 960 -1.046 -13.332 -1.264 1.00 0.00 N ATOM 0 H ASN A 960 -2.339 -10.516 -1.658 1.00 0.00 H new ATOM 0 HA ASN A 960 -3.989 -11.446 -0.492 1.00 0.00 H new ATOM 0 HB2 ASN A 960 -1.765 -12.700 1.168 1.00 0.00 H new ATOM 0 HB3 ASN A 960 -3.412 -13.284 1.035 1.00 0.00 H new ATOM 0 HD21 ASN A 960 -0.729 -13.857 -2.079 1.00 0.00 H new ATOM 0 HD22 ASN A 960 -0.458 -12.598 -0.869 1.00 0.00 H new ATOM 1136 N ARG A 961 -3.532 -9.253 1.206 1.00 0.00 N ATOM 1137 CA ARG A 961 -3.836 -8.374 2.328 1.00 0.00 C ATOM 1138 C ARG A 961 -4.635 -7.159 1.865 1.00 0.00 C ATOM 1139 O ARG A 961 -4.197 -6.409 0.991 1.00 0.00 O ATOM 1140 CB ARG A 961 -2.546 -7.919 3.011 1.00 0.00 C ATOM 1141 CG ARG A 961 -1.937 -8.970 3.925 1.00 0.00 C ATOM 1142 CD ARG A 961 -0.504 -8.622 4.298 1.00 0.00 C ATOM 1143 NE ARG A 961 0.100 -9.637 5.156 1.00 0.00 N ATOM 1144 CZ ARG A 961 -0.221 -9.806 6.434 1.00 0.00 C ATOM 1145 NH1 ARG A 961 -1.136 -9.030 6.998 1.00 0.00 N ATOM 1146 NH2 ARG A 961 0.373 -10.752 7.149 1.00 0.00 N ATOM 0 H ARG A 961 -3.431 -8.775 0.311 1.00 0.00 H new ATOM 0 HA ARG A 961 -4.439 -8.934 3.043 1.00 0.00 H new ATOM 0 HB2 ARG A 961 -1.817 -7.647 2.248 1.00 0.00 H new ATOM 0 HB3 ARG A 961 -2.750 -7.019 3.591 1.00 0.00 H new ATOM 0 HG2 ARG A 961 -2.538 -9.059 4.830 1.00 0.00 H new ATOM 0 HG3 ARG A 961 -1.960 -9.941 3.430 1.00 0.00 H new ATOM 0 HD2 ARG A 961 0.091 -8.514 3.391 1.00 0.00 H new ATOM 0 HD3 ARG A 961 -0.486 -7.659 4.808 1.00 0.00 H new ATOM 0 HE ARG A 961 0.808 -10.250 4.752 1.00 0.00 H new ATOM 0 HH11 ARG A 961 -1.595 -8.302 6.451 1.00 0.00 H new ATOM 0 HH12 ARG A 961 -1.381 -9.161 7.979 1.00 0.00 H new ATOM 0 HH21 ARG A 961 1.077 -11.351 6.718 1.00 0.00 H new ATOM 0 HH22 ARG A 961 0.126 -10.881 8.130 1.00 0.00 H new ATOM 1160 N THR A 962 -5.811 -6.970 2.456 1.00 0.00 N ATOM 1161 CA THR A 962 -6.672 -5.848 2.104 1.00 0.00 C ATOM 1162 C THR A 962 -6.141 -4.543 2.689 1.00 0.00 C ATOM 1163 O THR A 962 -6.135 -4.355 3.905 1.00 0.00 O ATOM 1164 CB THR A 962 -8.114 -6.069 2.598 1.00 0.00 C ATOM 1165 OG1 THR A 962 -8.527 -7.411 2.317 1.00 0.00 O ATOM 1166 CG2 THR A 962 -9.070 -5.090 1.934 1.00 0.00 C ATOM 0 H THR A 962 -6.189 -7.580 3.181 1.00 0.00 H new ATOM 0 HA THR A 962 -6.675 -5.781 1.016 1.00 0.00 H new ATOM 0 HB THR A 962 -8.136 -5.900 3.675 1.00 0.00 H new ATOM 0 HG1 THR A 962 -9.444 -7.544 2.635 1.00 0.00 H new ATOM 0 HG21 THR A 962 -10.082 -5.266 2.299 1.00 0.00 H new ATOM 0 HG22 THR A 962 -8.770 -4.070 2.173 1.00 0.00 H new ATOM 0 HG23 THR A 962 -9.044 -5.232 0.854 1.00 0.00 H new ATOM 1174 N ILE A 963 -5.699 -3.646 1.815 1.00 0.00 N ATOM 1175 CA ILE A 963 -5.168 -2.358 2.245 1.00 0.00 C ATOM 1176 C ILE A 963 -6.226 -1.265 2.138 1.00 0.00 C ATOM 1177 O ILE A 963 -6.975 -1.202 1.163 1.00 0.00 O ATOM 1178 CB ILE A 963 -3.938 -1.949 1.414 1.00 0.00 C ATOM 1179 CG1 ILE A 963 -2.828 -2.993 1.559 1.00 0.00 C ATOM 1180 CG2 ILE A 963 -3.441 -0.577 1.842 1.00 0.00 C ATOM 1181 CD1 ILE A 963 -1.702 -2.818 0.564 1.00 0.00 C ATOM 0 H ILE A 963 -5.698 -3.787 0.805 1.00 0.00 H new ATOM 0 HA ILE A 963 -4.870 -2.472 3.287 1.00 0.00 H new ATOM 0 HB ILE A 963 -4.228 -1.897 0.365 1.00 0.00 H new ATOM 0 HG12 ILE A 963 -2.421 -2.941 2.569 1.00 0.00 H new ATOM 0 HG13 ILE A 963 -3.257 -3.988 1.439 1.00 0.00 H new ATOM 0 HG21 ILE A 963 -2.571 -0.303 1.245 1.00 0.00 H new ATOM 0 HG22 ILE A 963 -4.231 0.159 1.692 1.00 0.00 H new ATOM 0 HG23 ILE A 963 -3.164 -0.603 2.896 1.00 0.00 H new ATOM 0 HD11 ILE A 963 -0.951 -3.592 0.724 1.00 0.00 H new ATOM 0 HD12 ILE A 963 -2.096 -2.899 -0.449 1.00 0.00 H new ATOM 0 HD13 ILE A 963 -1.247 -1.837 0.699 1.00 0.00 H new ATOM 1193 N THR A 964 -6.281 -0.401 3.148 1.00 0.00 N ATOM 1194 CA THR A 964 -7.246 0.691 3.168 1.00 0.00 C ATOM 1195 C THR A 964 -6.546 2.040 3.279 1.00 0.00 C ATOM 1196 O THR A 964 -5.932 2.350 4.301 1.00 0.00 O ATOM 1197 CB THR A 964 -8.238 0.542 4.337 1.00 0.00 C ATOM 1198 OG1 THR A 964 -8.724 -0.803 4.398 1.00 0.00 O ATOM 1199 CG2 THR A 964 -9.407 1.502 4.180 1.00 0.00 C ATOM 0 H THR A 964 -5.668 -0.437 3.963 1.00 0.00 H new ATOM 0 HA THR A 964 -7.795 0.646 2.227 1.00 0.00 H new ATOM 0 HB THR A 964 -7.714 0.781 5.262 1.00 0.00 H new ATOM 0 HG1 THR A 964 -9.353 -0.890 5.145 1.00 0.00 H new ATOM 0 HG21 THR A 964 -10.094 1.379 5.017 1.00 0.00 H new ATOM 0 HG22 THR A 964 -9.036 2.527 4.163 1.00 0.00 H new ATOM 0 HG23 THR A 964 -9.930 1.290 3.247 1.00 0.00 H new ATOM 1207 N ILE A 965 -6.644 2.841 2.223 1.00 0.00 N ATOM 1208 CA ILE A 965 -6.021 4.158 2.203 1.00 0.00 C ATOM 1209 C ILE A 965 -7.034 5.250 2.531 1.00 0.00 C ATOM 1210 O ILE A 965 -8.151 5.250 2.013 1.00 0.00 O ATOM 1211 CB ILE A 965 -5.383 4.460 0.834 1.00 0.00 C ATOM 1212 CG1 ILE A 965 -4.426 3.335 0.434 1.00 0.00 C ATOM 1213 CG2 ILE A 965 -4.654 5.794 0.872 1.00 0.00 C ATOM 1214 CD1 ILE A 965 -3.832 3.509 -0.946 1.00 0.00 C ATOM 0 H ILE A 965 -7.149 2.600 1.370 1.00 0.00 H new ATOM 0 HA ILE A 965 -5.240 4.149 2.964 1.00 0.00 H new ATOM 0 HB ILE A 965 -6.174 4.522 0.087 1.00 0.00 H new ATOM 0 HG12 ILE A 965 -3.618 3.279 1.164 1.00 0.00 H new ATOM 0 HG13 ILE A 965 -4.958 2.385 0.474 1.00 0.00 H new ATOM 0 HG21 ILE A 965 -4.209 5.993 -0.103 1.00 0.00 H new ATOM 0 HG22 ILE A 965 -5.360 6.588 1.117 1.00 0.00 H new ATOM 0 HG23 ILE A 965 -3.870 5.759 1.629 1.00 0.00 H new ATOM 0 HD11 ILE A 965 -3.164 2.675 -1.162 1.00 0.00 H new ATOM 0 HD12 ILE A 965 -4.632 3.534 -1.686 1.00 0.00 H new ATOM 0 HD13 ILE A 965 -3.271 4.443 -0.986 1.00 0.00 H new ATOM 1226 N ALA A 966 -6.636 6.180 3.393 1.00 0.00 N ATOM 1227 CA ALA A 966 -7.508 7.280 3.787 1.00 0.00 C ATOM 1228 C ALA A 966 -6.700 8.531 4.113 1.00 0.00 C ATOM 1229 O ALA A 966 -5.667 8.459 4.781 1.00 0.00 O ATOM 1230 CB ALA A 966 -8.362 6.875 4.979 1.00 0.00 C ATOM 0 H ALA A 966 -5.715 6.194 3.832 1.00 0.00 H new ATOM 0 HA ALA A 966 -8.163 7.511 2.947 1.00 0.00 H new ATOM 0 HB1 ALA A 966 -9.008 7.706 5.263 1.00 0.00 H new ATOM 0 HB2 ALA A 966 -8.974 6.014 4.712 1.00 0.00 H new ATOM 0 HB3 ALA A 966 -7.716 6.615 5.818 1.00 0.00 H new ATOM 1236 N LEU A 967 -7.174 9.677 3.637 1.00 0.00 N ATOM 1237 CA LEU A 967 -6.495 10.945 3.877 1.00 0.00 C ATOM 1238 C LEU A 967 -6.514 11.300 5.360 1.00 0.00 C ATOM 1239 O LEU A 967 -7.373 10.837 6.110 1.00 0.00 O ATOM 1240 CB LEU A 967 -7.155 12.061 3.065 1.00 0.00 C ATOM 1241 CG LEU A 967 -6.780 12.126 1.584 1.00 0.00 C ATOM 1242 CD1 LEU A 967 -7.570 13.219 0.881 1.00 0.00 C ATOM 1243 CD2 LEU A 967 -5.285 12.357 1.422 1.00 0.00 C ATOM 0 H LEU A 967 -8.026 9.754 3.082 1.00 0.00 H new ATOM 0 HA LEU A 967 -5.457 10.839 3.561 1.00 0.00 H new ATOM 0 HB2 LEU A 967 -8.236 11.947 3.141 1.00 0.00 H new ATOM 0 HB3 LEU A 967 -6.902 13.016 3.525 1.00 0.00 H new ATOM 0 HG LEU A 967 -7.031 11.171 1.123 1.00 0.00 H new ATOM 0 HD11 LEU A 967 -7.290 13.250 -0.172 1.00 0.00 H new ATOM 0 HD12 LEU A 967 -8.636 13.010 0.967 1.00 0.00 H new ATOM 0 HD13 LEU A 967 -7.351 14.181 1.344 1.00 0.00 H new ATOM 0 HD21 LEU A 967 -5.036 12.400 0.362 1.00 0.00 H new ATOM 0 HD22 LEU A 967 -5.008 13.298 1.898 1.00 0.00 H new ATOM 0 HD23 LEU A 967 -4.738 11.539 1.890 1.00 0.00 H new ATOM 1255 N LYS A 968 -5.561 12.127 5.777 1.00 0.00 N ATOM 1256 CA LYS A 968 -5.469 12.548 7.170 1.00 0.00 C ATOM 1257 C LYS A 968 -6.150 13.898 7.377 1.00 0.00 C ATOM 1258 O LYS A 968 -6.098 14.769 6.509 1.00 0.00 O ATOM 1259 CB LYS A 968 -4.003 12.634 7.603 1.00 0.00 C ATOM 1260 CG LYS A 968 -3.813 12.639 9.110 1.00 0.00 C ATOM 1261 CD LYS A 968 -2.341 12.609 9.486 1.00 0.00 C ATOM 1262 CE LYS A 968 -2.089 13.319 10.807 1.00 0.00 C ATOM 1263 NZ LYS A 968 -0.730 13.926 10.859 1.00 0.00 N ATOM 0 H LYS A 968 -4.841 12.519 5.170 1.00 0.00 H new ATOM 0 HA LYS A 968 -5.980 11.805 7.782 1.00 0.00 H new ATOM 0 HB2 LYS A 968 -3.458 11.791 7.179 1.00 0.00 H new ATOM 0 HB3 LYS A 968 -3.562 13.540 7.187 1.00 0.00 H new ATOM 0 HG2 LYS A 968 -4.280 13.528 9.534 1.00 0.00 H new ATOM 0 HG3 LYS A 968 -4.318 11.776 9.544 1.00 0.00 H new ATOM 0 HD2 LYS A 968 -2.004 11.575 9.557 1.00 0.00 H new ATOM 0 HD3 LYS A 968 -1.754 13.083 8.699 1.00 0.00 H new ATOM 0 HE2 LYS A 968 -2.840 14.096 10.951 1.00 0.00 H new ATOM 0 HE3 LYS A 968 -2.202 12.611 11.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 968 -0.644 14.513 11.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 968 -0.014 13.172 10.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 968 -0.581 14.517 10.016 1.00 0.00 H new