USER MOD reduce.3.24.130724 H: found=0, std=0, add=541, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 543 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 920 GLN : amide:sc= -2.14 X(o=-4.4,f=-4.4) USER MOD Set 1.2: A 956 LYS NZ :NH3+ 173:sc= -2.29 (180deg=0) USER MOD Single : A 894 THR OG1 : rot 29:sc= 0.0705 USER MOD Single : A 898 SER OG : rot 180:sc= -0.15 USER MOD Single : A 919 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 923 SER OG : rot 66:sc= -1.79! USER MOD Single : A 936 LYS NZ :NH3+ 144:sc= -1.19 (180deg=-2.98!) USER MOD Single : A 937 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 940 THR OG1 : rot -170:sc= 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= -0.563 X(o=-0.56,f=-0.077) USER MOD Single : A 952 SER OG : rot 180:sc= 0 USER MOD Single : A 954 ASN : amide:sc= -0.647 K(o=-0.65,f=-3.5!) USER MOD Single : A 960 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 962 THR OG1 : rot -18:sc= 1.19 USER MOD Single : A 964 THR OG1 : rot 180:sc= 0 USER MOD Single : A 968 LYS NZ :NH3+ 178:sc= 0.0808 (180deg=0.076) USER MOD ----------------------------------------------------------------- ATOM 73 N THR A 894 -0.078 13.859 3.733 1.00 0.00 N ATOM 74 CA THR A 894 0.064 12.624 4.494 1.00 0.00 C ATOM 75 C THR A 894 -1.190 11.763 4.384 1.00 0.00 C ATOM 76 O THR A 894 -2.288 12.202 4.724 1.00 0.00 O ATOM 77 CB THR A 894 0.347 12.910 5.981 1.00 0.00 C ATOM 78 OG1 THR A 894 1.541 13.689 6.111 1.00 0.00 O ATOM 79 CG2 THR A 894 0.495 11.613 6.762 1.00 0.00 C ATOM 0 HA THR A 894 0.910 12.085 4.067 1.00 0.00 H new ATOM 0 HB THR A 894 -0.496 13.467 6.388 1.00 0.00 H new ATOM 0 HG1 THR A 894 1.661 14.240 5.310 1.00 0.00 H new ATOM 0 HG21 THR A 894 0.694 11.840 7.809 1.00 0.00 H new ATOM 0 HG22 THR A 894 -0.426 11.035 6.685 1.00 0.00 H new ATOM 0 HG23 THR A 894 1.323 11.034 6.352 1.00 0.00 H new ATOM 87 N VAL A 895 -1.018 10.534 3.907 1.00 0.00 N ATOM 88 CA VAL A 895 -2.136 9.611 3.754 1.00 0.00 C ATOM 89 C VAL A 895 -1.995 8.417 4.692 1.00 0.00 C ATOM 90 O VAL A 895 -0.885 7.973 4.987 1.00 0.00 O ATOM 91 CB VAL A 895 -2.248 9.101 2.305 1.00 0.00 C ATOM 92 CG1 VAL A 895 -2.273 10.267 1.329 1.00 0.00 C ATOM 93 CG2 VAL A 895 -1.103 8.151 1.985 1.00 0.00 C ATOM 0 H VAL A 895 -0.116 10.155 3.620 1.00 0.00 H new ATOM 0 HA VAL A 895 -3.040 10.164 4.008 1.00 0.00 H new ATOM 0 HB VAL A 895 -3.184 8.553 2.202 1.00 0.00 H new ATOM 0 HG11 VAL A 895 -2.352 9.887 0.310 1.00 0.00 H new ATOM 0 HG12 VAL A 895 -3.130 10.905 1.546 1.00 0.00 H new ATOM 0 HG13 VAL A 895 -1.355 10.846 1.430 1.00 0.00 H new ATOM 0 HG21 VAL A 895 -1.198 7.800 0.957 1.00 0.00 H new ATOM 0 HG22 VAL A 895 -0.153 8.673 2.104 1.00 0.00 H new ATOM 0 HG23 VAL A 895 -1.137 7.299 2.664 1.00 0.00 H new ATOM 103 N LEU A 896 -3.127 7.901 5.158 1.00 0.00 N ATOM 104 CA LEU A 896 -3.131 6.758 6.063 1.00 0.00 C ATOM 105 C LEU A 896 -3.342 5.456 5.296 1.00 0.00 C ATOM 106 O LEU A 896 -4.083 5.416 4.314 1.00 0.00 O ATOM 107 CB LEU A 896 -4.224 6.922 7.120 1.00 0.00 C ATOM 108 CG LEU A 896 -3.888 7.840 8.296 1.00 0.00 C ATOM 109 CD1 LEU A 896 -3.136 9.071 7.815 1.00 0.00 C ATOM 110 CD2 LEU A 896 -5.155 8.243 9.038 1.00 0.00 C ATOM 0 H LEU A 896 -4.054 8.256 4.924 1.00 0.00 H new ATOM 0 HA LEU A 896 -2.160 6.715 6.557 1.00 0.00 H new ATOM 0 HB2 LEU A 896 -5.120 7.304 6.631 1.00 0.00 H new ATOM 0 HB3 LEU A 896 -4.472 5.936 7.514 1.00 0.00 H new ATOM 0 HG LEU A 896 -3.245 7.293 8.986 1.00 0.00 H new ATOM 0 HD11 LEU A 896 -2.906 9.712 8.666 1.00 0.00 H new ATOM 0 HD12 LEU A 896 -2.209 8.765 7.330 1.00 0.00 H new ATOM 0 HD13 LEU A 896 -3.753 9.620 7.104 1.00 0.00 H new ATOM 0 HD21 LEU A 896 -4.896 8.896 9.872 1.00 0.00 H new ATOM 0 HD22 LEU A 896 -5.823 8.771 8.357 1.00 0.00 H new ATOM 0 HD23 LEU A 896 -5.654 7.351 9.417 1.00 0.00 H new ATOM 122 N VAL A 897 -2.686 4.393 5.751 1.00 0.00 N ATOM 123 CA VAL A 897 -2.805 3.090 5.110 1.00 0.00 C ATOM 124 C VAL A 897 -2.778 1.966 6.140 1.00 0.00 C ATOM 125 O VAL A 897 -1.916 1.936 7.019 1.00 0.00 O ATOM 126 CB VAL A 897 -1.674 2.862 4.089 1.00 0.00 C ATOM 127 CG1 VAL A 897 -1.828 1.507 3.415 1.00 0.00 C ATOM 128 CG2 VAL A 897 -1.656 3.980 3.058 1.00 0.00 C ATOM 0 H VAL A 897 -2.067 4.409 6.561 1.00 0.00 H new ATOM 0 HA VAL A 897 -3.763 3.079 4.590 1.00 0.00 H new ATOM 0 HB VAL A 897 -0.722 2.871 4.619 1.00 0.00 H new ATOM 0 HG11 VAL A 897 -1.020 1.364 2.697 1.00 0.00 H new ATOM 0 HG12 VAL A 897 -1.788 0.720 4.168 1.00 0.00 H new ATOM 0 HG13 VAL A 897 -2.786 1.465 2.896 1.00 0.00 H new ATOM 0 HG21 VAL A 897 -0.851 3.804 2.344 1.00 0.00 H new ATOM 0 HG22 VAL A 897 -2.610 4.004 2.531 1.00 0.00 H new ATOM 0 HG23 VAL A 897 -1.494 4.934 3.559 1.00 0.00 H new ATOM 138 N SER A 898 -3.727 1.042 6.025 1.00 0.00 N ATOM 139 CA SER A 898 -3.814 -0.083 6.949 1.00 0.00 C ATOM 140 C SER A 898 -4.033 -1.390 6.193 1.00 0.00 C ATOM 141 O SER A 898 -4.467 -1.388 5.041 1.00 0.00 O ATOM 142 CB SER A 898 -4.951 0.138 7.948 1.00 0.00 C ATOM 143 OG SER A 898 -5.235 -1.050 8.667 1.00 0.00 O ATOM 0 H SER A 898 -4.446 1.050 5.302 1.00 0.00 H new ATOM 0 HA SER A 898 -2.871 -0.150 7.492 1.00 0.00 H new ATOM 0 HB2 SER A 898 -4.679 0.932 8.644 1.00 0.00 H new ATOM 0 HB3 SER A 898 -5.845 0.470 7.419 1.00 0.00 H new ATOM 0 HG SER A 898 -5.964 -0.883 9.300 1.00 0.00 H new ATOM 149 N ILE A 899 -3.728 -2.504 6.850 1.00 0.00 N ATOM 150 CA ILE A 899 -3.892 -3.818 6.242 1.00 0.00 C ATOM 151 C ILE A 899 -4.833 -4.692 7.065 1.00 0.00 C ATOM 152 O ILE A 899 -5.089 -4.415 8.237 1.00 0.00 O ATOM 153 CB ILE A 899 -2.540 -4.541 6.090 1.00 0.00 C ATOM 154 CG1 ILE A 899 -1.750 -4.470 7.398 1.00 0.00 C ATOM 155 CG2 ILE A 899 -1.740 -3.934 4.947 1.00 0.00 C ATOM 156 CD1 ILE A 899 -0.823 -5.647 7.609 1.00 0.00 C ATOM 0 H ILE A 899 -3.366 -2.522 7.803 1.00 0.00 H new ATOM 0 HA ILE A 899 -4.322 -3.656 5.253 1.00 0.00 H new ATOM 0 HB ILE A 899 -2.729 -5.589 5.858 1.00 0.00 H new ATOM 0 HG12 ILE A 899 -1.165 -3.550 7.410 1.00 0.00 H new ATOM 0 HG13 ILE A 899 -2.449 -4.414 8.233 1.00 0.00 H new ATOM 0 HG21 ILE A 899 -0.788 -4.456 4.852 1.00 0.00 H new ATOM 0 HG22 ILE A 899 -2.301 -4.032 4.018 1.00 0.00 H new ATOM 0 HG23 ILE A 899 -1.557 -2.879 5.151 1.00 0.00 H new ATOM 0 HD11 ILE A 899 -0.296 -5.530 8.556 1.00 0.00 H new ATOM 0 HD12 ILE A 899 -1.404 -6.569 7.629 1.00 0.00 H new ATOM 0 HD13 ILE A 899 -0.100 -5.692 6.794 1.00 0.00 H new ATOM 308 N PHE A 909 3.846 -4.073 9.127 1.00 0.00 N ATOM 309 CA PHE A 909 4.139 -4.012 7.700 1.00 0.00 C ATOM 310 C PHE A 909 5.526 -4.576 7.406 1.00 0.00 C ATOM 311 O PHE A 909 6.541 -3.953 7.718 1.00 0.00 O ATOM 312 CB PHE A 909 4.047 -2.568 7.200 1.00 0.00 C ATOM 313 CG PHE A 909 2.647 -2.024 7.194 1.00 0.00 C ATOM 314 CD1 PHE A 909 2.130 -1.394 8.314 1.00 0.00 C ATOM 315 CD2 PHE A 909 1.848 -2.144 6.069 1.00 0.00 C ATOM 316 CE1 PHE A 909 0.842 -0.892 8.312 1.00 0.00 C ATOM 317 CE2 PHE A 909 0.560 -1.643 6.060 1.00 0.00 C ATOM 318 CZ PHE A 909 0.056 -1.017 7.184 1.00 0.00 C ATOM 0 HA PHE A 909 3.400 -4.618 7.176 1.00 0.00 H new ATOM 0 HB2 PHE A 909 4.672 -1.934 7.829 1.00 0.00 H new ATOM 0 HB3 PHE A 909 4.453 -2.515 6.190 1.00 0.00 H new ATOM 0 HD1 PHE A 909 2.740 -1.294 9.199 1.00 0.00 H new ATOM 0 HD2 PHE A 909 2.236 -2.635 5.189 1.00 0.00 H new ATOM 0 HE1 PHE A 909 0.451 -0.403 9.192 1.00 0.00 H new ATOM 0 HE2 PHE A 909 -0.052 -1.741 5.175 1.00 0.00 H new ATOM 0 HZ PHE A 909 -0.951 -0.626 7.180 1.00 0.00 H new ATOM 328 N ASP A 910 5.561 -5.760 6.804 1.00 0.00 N ATOM 329 CA ASP A 910 6.822 -6.410 6.466 1.00 0.00 C ATOM 330 C ASP A 910 7.500 -5.704 5.296 1.00 0.00 C ATOM 331 O ASP A 910 6.871 -4.928 4.577 1.00 0.00 O ATOM 332 CB ASP A 910 6.586 -7.881 6.123 1.00 0.00 C ATOM 333 CG ASP A 910 7.795 -8.525 5.472 1.00 0.00 C ATOM 334 OD1 ASP A 910 8.896 -8.443 6.056 1.00 0.00 O ATOM 335 OD2 ASP A 910 7.640 -9.109 4.379 1.00 0.00 O ATOM 0 H ASP A 910 4.730 -6.289 6.540 1.00 0.00 H new ATOM 0 HA ASP A 910 7.479 -6.349 7.334 1.00 0.00 H new ATOM 0 HB2 ASP A 910 6.332 -8.427 7.032 1.00 0.00 H new ATOM 0 HB3 ASP A 910 5.730 -7.962 5.453 1.00 0.00 H new ATOM 340 N ASP A 911 8.787 -5.978 5.112 1.00 0.00 N ATOM 341 CA ASP A 911 9.552 -5.370 4.030 1.00 0.00 C ATOM 342 C ASP A 911 8.837 -5.547 2.694 1.00 0.00 C ATOM 343 O ASP A 911 8.875 -4.664 1.837 1.00 0.00 O ATOM 344 CB ASP A 911 10.951 -5.983 3.959 1.00 0.00 C ATOM 345 CG ASP A 911 11.867 -5.226 3.017 1.00 0.00 C ATOM 346 OD1 ASP A 911 11.888 -5.560 1.813 1.00 0.00 O ATOM 347 OD2 ASP A 911 12.562 -4.299 3.483 1.00 0.00 O ATOM 0 H ASP A 911 9.323 -6.618 5.699 1.00 0.00 H new ATOM 0 HA ASP A 911 9.642 -4.303 4.236 1.00 0.00 H new ATOM 0 HB2 ASP A 911 11.390 -5.995 4.957 1.00 0.00 H new ATOM 0 HB3 ASP A 911 10.874 -7.020 3.632 1.00 0.00 H new ATOM 352 N ALA A 912 8.186 -6.693 2.524 1.00 0.00 N ATOM 353 CA ALA A 912 7.462 -6.985 1.293 1.00 0.00 C ATOM 354 C ALA A 912 6.211 -6.121 1.174 1.00 0.00 C ATOM 355 O ALA A 912 5.984 -5.478 0.148 1.00 0.00 O ATOM 356 CB ALA A 912 7.095 -8.460 1.234 1.00 0.00 C ATOM 0 H ALA A 912 8.145 -7.434 3.223 1.00 0.00 H new ATOM 0 HA ALA A 912 8.115 -6.751 0.452 1.00 0.00 H new ATOM 0 HB1 ALA A 912 6.555 -8.664 0.310 1.00 0.00 H new ATOM 0 HB2 ALA A 912 8.003 -9.062 1.264 1.00 0.00 H new ATOM 0 HB3 ALA A 912 6.464 -8.712 2.086 1.00 0.00 H new ATOM 362 N LEU A 913 5.402 -6.112 2.227 1.00 0.00 N ATOM 363 CA LEU A 913 4.172 -5.327 2.240 1.00 0.00 C ATOM 364 C LEU A 913 4.458 -3.863 1.925 1.00 0.00 C ATOM 365 O LEU A 913 3.658 -3.191 1.273 1.00 0.00 O ATOM 366 CB LEU A 913 3.485 -5.444 3.602 1.00 0.00 C ATOM 367 CG LEU A 913 2.907 -6.816 3.947 1.00 0.00 C ATOM 368 CD1 LEU A 913 2.503 -6.872 5.412 1.00 0.00 C ATOM 369 CD2 LEU A 913 1.718 -7.135 3.052 1.00 0.00 C ATOM 0 H LEU A 913 5.575 -6.639 3.083 1.00 0.00 H new ATOM 0 HA LEU A 913 3.509 -5.722 1.470 1.00 0.00 H new ATOM 0 HB2 LEU A 913 4.204 -5.171 4.374 1.00 0.00 H new ATOM 0 HB3 LEU A 913 2.679 -4.712 3.644 1.00 0.00 H new ATOM 0 HG LEU A 913 3.678 -7.567 3.775 1.00 0.00 H new ATOM 0 HD11 LEU A 913 2.094 -7.856 5.639 1.00 0.00 H new ATOM 0 HD12 LEU A 913 3.377 -6.689 6.038 1.00 0.00 H new ATOM 0 HD13 LEU A 913 1.749 -6.111 5.611 1.00 0.00 H new ATOM 0 HD21 LEU A 913 1.320 -8.116 3.312 1.00 0.00 H new ATOM 0 HD22 LEU A 913 0.944 -6.380 3.192 1.00 0.00 H new ATOM 0 HD23 LEU A 913 2.037 -7.138 2.010 1.00 0.00 H new ATOM 381 N ILE A 914 5.602 -3.375 2.391 1.00 0.00 N ATOM 382 CA ILE A 914 5.994 -1.991 2.156 1.00 0.00 C ATOM 383 C ILE A 914 6.562 -1.811 0.752 1.00 0.00 C ATOM 384 O ILE A 914 5.982 -1.111 -0.078 1.00 0.00 O ATOM 385 CB ILE A 914 7.039 -1.519 3.184 1.00 0.00 C ATOM 386 CG1 ILE A 914 6.464 -1.596 4.600 1.00 0.00 C ATOM 387 CG2 ILE A 914 7.492 -0.101 2.868 1.00 0.00 C ATOM 388 CD1 ILE A 914 7.483 -1.312 5.682 1.00 0.00 C ATOM 0 H ILE A 914 6.274 -3.917 2.934 1.00 0.00 H new ATOM 0 HA ILE A 914 5.093 -1.386 2.262 1.00 0.00 H new ATOM 0 HB ILE A 914 7.906 -2.178 3.127 1.00 0.00 H new ATOM 0 HG12 ILE A 914 5.643 -0.884 4.689 1.00 0.00 H new ATOM 0 HG13 ILE A 914 6.044 -2.589 4.759 1.00 0.00 H new ATOM 0 HG21 ILE A 914 8.230 0.218 3.604 1.00 0.00 H new ATOM 0 HG22 ILE A 914 7.936 -0.074 1.873 1.00 0.00 H new ATOM 0 HG23 ILE A 914 6.634 0.571 2.901 1.00 0.00 H new ATOM 0 HD11 ILE A 914 7.006 -1.384 6.659 1.00 0.00 H new ATOM 0 HD12 ILE A 914 8.293 -2.039 5.619 1.00 0.00 H new ATOM 0 HD13 ILE A 914 7.886 -0.308 5.548 1.00 0.00 H new ATOM 400 N ASP A 915 7.698 -2.449 0.493 1.00 0.00 N ATOM 401 CA ASP A 915 8.343 -2.363 -0.811 1.00 0.00 C ATOM 402 C ASP A 915 7.310 -2.398 -1.933 1.00 0.00 C ATOM 403 O ASP A 915 7.256 -1.496 -2.768 1.00 0.00 O ATOM 404 CB ASP A 915 9.343 -3.507 -0.986 1.00 0.00 C ATOM 405 CG ASP A 915 10.239 -3.314 -2.194 1.00 0.00 C ATOM 406 OD1 ASP A 915 9.762 -3.530 -3.327 1.00 0.00 O ATOM 407 OD2 ASP A 915 11.418 -2.947 -2.005 1.00 0.00 O ATOM 0 H ASP A 915 8.191 -3.032 1.170 1.00 0.00 H new ATOM 0 HA ASP A 915 8.876 -1.414 -0.862 1.00 0.00 H new ATOM 0 HB2 ASP A 915 9.959 -3.588 -0.090 1.00 0.00 H new ATOM 0 HB3 ASP A 915 8.801 -4.447 -1.086 1.00 0.00 H new ATOM 412 N GLU A 916 6.491 -3.446 -1.944 1.00 0.00 N ATOM 413 CA GLU A 916 5.461 -3.598 -2.964 1.00 0.00 C ATOM 414 C GLU A 916 4.605 -2.339 -3.065 1.00 0.00 C ATOM 415 O GLU A 916 4.364 -1.824 -4.158 1.00 0.00 O ATOM 416 CB GLU A 916 4.575 -4.806 -2.649 1.00 0.00 C ATOM 417 CG GLU A 916 5.264 -6.141 -2.876 1.00 0.00 C ATOM 418 CD GLU A 916 5.853 -6.265 -4.268 1.00 0.00 C ATOM 419 OE1 GLU A 916 5.220 -5.771 -5.225 1.00 0.00 O ATOM 420 OE2 GLU A 916 6.946 -6.855 -4.401 1.00 0.00 O ATOM 0 H GLU A 916 6.521 -4.201 -1.259 1.00 0.00 H new ATOM 0 HA GLU A 916 5.955 -3.758 -3.922 1.00 0.00 H new ATOM 0 HB2 GLU A 916 4.250 -4.746 -1.610 1.00 0.00 H new ATOM 0 HB3 GLU A 916 3.678 -4.760 -3.267 1.00 0.00 H new ATOM 0 HG2 GLU A 916 6.056 -6.267 -2.138 1.00 0.00 H new ATOM 0 HG3 GLU A 916 4.548 -6.947 -2.716 1.00 0.00 H new ATOM 427 N LEU A 917 4.147 -1.849 -1.918 1.00 0.00 N ATOM 428 CA LEU A 917 3.316 -0.650 -1.876 1.00 0.00 C ATOM 429 C LEU A 917 4.009 0.517 -2.573 1.00 0.00 C ATOM 430 O LEU A 917 3.405 1.212 -3.391 1.00 0.00 O ATOM 431 CB LEU A 917 2.998 -0.277 -0.427 1.00 0.00 C ATOM 432 CG LEU A 917 1.918 -1.114 0.260 1.00 0.00 C ATOM 433 CD1 LEU A 917 2.011 -0.968 1.771 1.00 0.00 C ATOM 434 CD2 LEU A 917 0.537 -0.710 -0.233 1.00 0.00 C ATOM 0 H LEU A 917 4.337 -2.263 -1.005 1.00 0.00 H new ATOM 0 HA LEU A 917 2.386 -0.863 -2.402 1.00 0.00 H new ATOM 0 HB2 LEU A 917 3.915 -0.354 0.157 1.00 0.00 H new ATOM 0 HB3 LEU A 917 2.691 0.768 -0.401 1.00 0.00 H new ATOM 0 HG LEU A 917 2.080 -2.162 0.006 1.00 0.00 H new ATOM 0 HD11 LEU A 917 1.235 -1.570 2.243 1.00 0.00 H new ATOM 0 HD12 LEU A 917 2.990 -1.307 2.110 1.00 0.00 H new ATOM 0 HD13 LEU A 917 1.875 0.078 2.045 1.00 0.00 H new ATOM 0 HD21 LEU A 917 -0.219 -1.316 0.266 1.00 0.00 H new ATOM 0 HD22 LEU A 917 0.364 0.343 -0.009 1.00 0.00 H new ATOM 0 HD23 LEU A 917 0.475 -0.867 -1.310 1.00 0.00 H new ATOM 446 N LEU A 918 5.279 0.725 -2.246 1.00 0.00 N ATOM 447 CA LEU A 918 6.056 1.806 -2.842 1.00 0.00 C ATOM 448 C LEU A 918 5.804 1.893 -4.344 1.00 0.00 C ATOM 449 O LEU A 918 5.418 2.942 -4.858 1.00 0.00 O ATOM 450 CB LEU A 918 7.548 1.597 -2.575 1.00 0.00 C ATOM 451 CG LEU A 918 7.939 1.344 -1.119 1.00 0.00 C ATOM 452 CD1 LEU A 918 9.449 1.216 -0.987 1.00 0.00 C ATOM 453 CD2 LEU A 918 7.416 2.458 -0.224 1.00 0.00 C ATOM 0 H LEU A 918 5.793 0.159 -1.571 1.00 0.00 H new ATOM 0 HA LEU A 918 5.739 2.743 -2.384 1.00 0.00 H new ATOM 0 HB2 LEU A 918 7.889 0.753 -3.174 1.00 0.00 H new ATOM 0 HB3 LEU A 918 8.087 2.477 -2.928 1.00 0.00 H new ATOM 0 HG LEU A 918 7.486 0.406 -0.799 1.00 0.00 H new ATOM 0 HD11 LEU A 918 9.709 1.036 0.056 1.00 0.00 H new ATOM 0 HD12 LEU A 918 9.798 0.383 -1.597 1.00 0.00 H new ATOM 0 HD13 LEU A 918 9.923 2.137 -1.326 1.00 0.00 H new ATOM 0 HD21 LEU A 918 7.704 2.261 0.809 1.00 0.00 H new ATOM 0 HD22 LEU A 918 7.840 3.410 -0.543 1.00 0.00 H new ATOM 0 HD23 LEU A 918 6.329 2.502 -0.295 1.00 0.00 H new ATOM 465 N GLN A 919 6.024 0.783 -5.041 1.00 0.00 N ATOM 466 CA GLN A 919 5.820 0.734 -6.484 1.00 0.00 C ATOM 467 C GLN A 919 4.380 1.089 -6.842 1.00 0.00 C ATOM 468 O GLN A 919 4.128 1.769 -7.836 1.00 0.00 O ATOM 469 CB GLN A 919 6.164 -0.656 -7.023 1.00 0.00 C ATOM 470 CG GLN A 919 7.632 -0.823 -7.380 1.00 0.00 C ATOM 471 CD GLN A 919 7.874 -1.981 -8.328 1.00 0.00 C ATOM 472 OE1 GLN A 919 7.412 -3.098 -8.092 1.00 0.00 O ATOM 473 NE2 GLN A 919 8.601 -1.721 -9.408 1.00 0.00 N ATOM 0 H GLN A 919 6.343 -0.094 -4.630 1.00 0.00 H new ATOM 0 HA GLN A 919 6.482 1.468 -6.944 1.00 0.00 H new ATOM 0 HB2 GLN A 919 5.893 -1.403 -6.277 1.00 0.00 H new ATOM 0 HB3 GLN A 919 5.559 -0.854 -7.908 1.00 0.00 H new ATOM 0 HG2 GLN A 919 7.998 0.097 -7.836 1.00 0.00 H new ATOM 0 HG3 GLN A 919 8.208 -0.978 -6.468 1.00 0.00 H new ATOM 0 HE21 GLN A 919 8.964 -0.781 -9.564 1.00 0.00 H new ATOM 0 HE22 GLN A 919 8.796 -2.462 -10.082 1.00 0.00 H new ATOM 482 N GLN A 920 3.441 0.623 -6.025 1.00 0.00 N ATOM 483 CA GLN A 920 2.026 0.891 -6.258 1.00 0.00 C ATOM 484 C GLN A 920 1.729 2.382 -6.143 1.00 0.00 C ATOM 485 O GLN A 920 0.892 2.916 -6.872 1.00 0.00 O ATOM 486 CB GLN A 920 1.168 0.109 -5.262 1.00 0.00 C ATOM 487 CG GLN A 920 1.124 -1.385 -5.537 1.00 0.00 C ATOM 488 CD GLN A 920 0.260 -1.733 -6.733 1.00 0.00 C ATOM 489 OE1 GLN A 920 -0.346 -0.858 -7.351 1.00 0.00 O ATOM 490 NE2 GLN A 920 0.200 -3.018 -7.066 1.00 0.00 N ATOM 0 H GLN A 920 3.634 0.059 -5.197 1.00 0.00 H new ATOM 0 HA GLN A 920 1.781 0.568 -7.270 1.00 0.00 H new ATOM 0 HB2 GLN A 920 1.554 0.273 -4.256 1.00 0.00 H new ATOM 0 HB3 GLN A 920 0.152 0.504 -5.282 1.00 0.00 H new ATOM 0 HG2 GLN A 920 2.137 -1.749 -5.707 1.00 0.00 H new ATOM 0 HG3 GLN A 920 0.743 -1.902 -4.656 1.00 0.00 H new ATOM 0 HE21 GLN A 920 0.719 -3.710 -6.525 1.00 0.00 H new ATOM 0 HE22 GLN A 920 -0.365 -3.313 -7.862 1.00 0.00 H new ATOM 499 N PHE A 921 2.419 3.049 -5.224 1.00 0.00 N ATOM 500 CA PHE A 921 2.227 4.480 -5.014 1.00 0.00 C ATOM 501 C PHE A 921 2.902 5.287 -6.119 1.00 0.00 C ATOM 502 O PHE A 921 2.423 6.353 -6.504 1.00 0.00 O ATOM 503 CB PHE A 921 2.784 4.895 -3.650 1.00 0.00 C ATOM 504 CG PHE A 921 2.180 4.140 -2.501 1.00 0.00 C ATOM 505 CD1 PHE A 921 0.845 3.767 -2.525 1.00 0.00 C ATOM 506 CD2 PHE A 921 2.946 3.803 -1.397 1.00 0.00 C ATOM 507 CE1 PHE A 921 0.287 3.074 -1.468 1.00 0.00 C ATOM 508 CE2 PHE A 921 2.393 3.109 -0.337 1.00 0.00 C ATOM 509 CZ PHE A 921 1.061 2.743 -0.374 1.00 0.00 C ATOM 0 H PHE A 921 3.116 2.622 -4.613 1.00 0.00 H new ATOM 0 HA PHE A 921 1.157 4.686 -5.040 1.00 0.00 H new ATOM 0 HB2 PHE A 921 3.863 4.744 -3.646 1.00 0.00 H new ATOM 0 HB3 PHE A 921 2.611 5.961 -3.505 1.00 0.00 H new ATOM 0 HD1 PHE A 921 0.235 4.021 -3.379 1.00 0.00 H new ATOM 0 HD2 PHE A 921 3.988 4.086 -1.364 1.00 0.00 H new ATOM 0 HE1 PHE A 921 -0.755 2.791 -1.498 1.00 0.00 H new ATOM 0 HE2 PHE A 921 3.001 2.853 0.518 1.00 0.00 H new ATOM 0 HZ PHE A 921 0.626 2.199 0.452 1.00 0.00 H new ATOM 519 N ALA A 922 4.018 4.771 -6.624 1.00 0.00 N ATOM 520 CA ALA A 922 4.758 5.442 -7.685 1.00 0.00 C ATOM 521 C ALA A 922 3.883 5.654 -8.915 1.00 0.00 C ATOM 522 O ALA A 922 4.047 6.631 -9.645 1.00 0.00 O ATOM 523 CB ALA A 922 6.000 4.643 -8.049 1.00 0.00 C ATOM 0 H ALA A 922 4.429 3.890 -6.315 1.00 0.00 H new ATOM 0 HA ALA A 922 5.065 6.421 -7.317 1.00 0.00 H new ATOM 0 HB1 ALA A 922 6.543 5.156 -8.843 1.00 0.00 H new ATOM 0 HB2 ALA A 922 6.642 4.549 -7.173 1.00 0.00 H new ATOM 0 HB3 ALA A 922 5.707 3.651 -8.393 1.00 0.00 H new ATOM 529 N SER A 923 2.953 4.731 -9.141 1.00 0.00 N ATOM 530 CA SER A 923 2.055 4.814 -10.286 1.00 0.00 C ATOM 531 C SER A 923 1.285 6.131 -10.278 1.00 0.00 C ATOM 532 O SER A 923 0.665 6.508 -11.273 1.00 0.00 O ATOM 533 CB SER A 923 1.077 3.638 -10.281 1.00 0.00 C ATOM 534 OG SER A 923 0.043 3.839 -9.332 1.00 0.00 O ATOM 0 H SER A 923 2.802 3.917 -8.545 1.00 0.00 H new ATOM 0 HA SER A 923 2.658 4.771 -11.193 1.00 0.00 H new ATOM 0 HB2 SER A 923 0.645 3.516 -11.274 1.00 0.00 H new ATOM 0 HB3 SER A 923 1.612 2.717 -10.051 1.00 0.00 H new ATOM 0 HG SER A 923 -0.504 4.606 -9.602 1.00 0.00 H new ATOM 540 N PHE A 924 1.329 6.828 -9.147 1.00 0.00 N ATOM 541 CA PHE A 924 0.635 8.103 -9.008 1.00 0.00 C ATOM 542 C PHE A 924 1.594 9.196 -8.546 1.00 0.00 C ATOM 543 O PHE A 924 1.750 10.220 -9.210 1.00 0.00 O ATOM 544 CB PHE A 924 -0.522 7.972 -8.015 1.00 0.00 C ATOM 545 CG PHE A 924 -1.503 6.893 -8.377 1.00 0.00 C ATOM 546 CD1 PHE A 924 -2.577 7.166 -9.209 1.00 0.00 C ATOM 547 CD2 PHE A 924 -1.352 5.607 -7.884 1.00 0.00 C ATOM 548 CE1 PHE A 924 -3.481 6.176 -9.544 1.00 0.00 C ATOM 549 CE2 PHE A 924 -2.252 4.613 -8.217 1.00 0.00 C ATOM 550 CZ PHE A 924 -3.319 4.898 -9.047 1.00 0.00 C ATOM 0 H PHE A 924 1.838 6.531 -8.314 1.00 0.00 H new ATOM 0 HA PHE A 924 0.238 8.381 -9.984 1.00 0.00 H new ATOM 0 HB2 PHE A 924 -0.118 7.767 -7.024 1.00 0.00 H new ATOM 0 HB3 PHE A 924 -1.048 8.925 -7.954 1.00 0.00 H new ATOM 0 HD1 PHE A 924 -2.709 8.164 -9.600 1.00 0.00 H new ATOM 0 HD2 PHE A 924 -0.522 5.379 -7.232 1.00 0.00 H new ATOM 0 HE1 PHE A 924 -4.313 6.402 -10.194 1.00 0.00 H new ATOM 0 HE2 PHE A 924 -2.121 3.614 -7.829 1.00 0.00 H new ATOM 0 HZ PHE A 924 -4.025 4.123 -9.307 1.00 0.00 H new ATOM 560 N GLY A 925 2.234 8.971 -7.403 1.00 0.00 N ATOM 561 CA GLY A 925 3.169 9.945 -6.871 1.00 0.00 C ATOM 562 C GLY A 925 4.432 9.302 -6.334 1.00 0.00 C ATOM 563 O GLY A 925 4.379 8.247 -5.704 1.00 0.00 O ATOM 0 H GLY A 925 2.122 8.131 -6.835 1.00 0.00 H new ATOM 0 HA2 GLY A 925 3.432 10.657 -7.653 1.00 0.00 H new ATOM 0 HA3 GLY A 925 2.686 10.511 -6.074 1.00 0.00 H new ATOM 567 N GLU A 926 5.571 9.940 -6.584 1.00 0.00 N ATOM 568 CA GLU A 926 6.854 9.422 -6.123 1.00 0.00 C ATOM 569 C GLU A 926 7.023 9.645 -4.623 1.00 0.00 C ATOM 570 O GLU A 926 7.387 10.736 -4.183 1.00 0.00 O ATOM 571 CB GLU A 926 8.002 10.091 -6.882 1.00 0.00 C ATOM 572 CG GLU A 926 9.376 9.745 -6.334 1.00 0.00 C ATOM 573 CD GLU A 926 10.491 10.065 -7.311 1.00 0.00 C ATOM 574 OE1 GLU A 926 10.405 9.620 -8.475 1.00 0.00 O ATOM 575 OE2 GLU A 926 11.448 10.761 -6.913 1.00 0.00 O ATOM 0 H GLU A 926 5.632 10.816 -7.103 1.00 0.00 H new ATOM 0 HA GLU A 926 6.875 8.350 -6.318 1.00 0.00 H new ATOM 0 HB2 GLU A 926 7.954 9.797 -7.930 1.00 0.00 H new ATOM 0 HB3 GLU A 926 7.868 11.172 -6.848 1.00 0.00 H new ATOM 0 HG2 GLU A 926 9.542 10.293 -5.407 1.00 0.00 H new ATOM 0 HG3 GLU A 926 9.408 8.684 -6.087 1.00 0.00 H new ATOM 582 N VAL A 927 6.754 8.603 -3.842 1.00 0.00 N ATOM 583 CA VAL A 927 6.877 8.684 -2.391 1.00 0.00 C ATOM 584 C VAL A 927 8.229 9.259 -1.985 1.00 0.00 C ATOM 585 O VAL A 927 9.241 9.015 -2.642 1.00 0.00 O ATOM 586 CB VAL A 927 6.702 7.301 -1.736 1.00 0.00 C ATOM 587 CG1 VAL A 927 6.789 7.413 -0.221 1.00 0.00 C ATOM 588 CG2 VAL A 927 5.381 6.676 -2.157 1.00 0.00 C ATOM 0 H VAL A 927 6.450 7.694 -4.190 1.00 0.00 H new ATOM 0 HA VAL A 927 6.085 9.347 -2.042 1.00 0.00 H new ATOM 0 HB VAL A 927 7.509 6.652 -2.076 1.00 0.00 H new ATOM 0 HG11 VAL A 927 6.663 6.426 0.225 1.00 0.00 H new ATOM 0 HG12 VAL A 927 7.762 7.816 0.059 1.00 0.00 H new ATOM 0 HG13 VAL A 927 6.004 8.077 0.140 1.00 0.00 H new ATOM 0 HG21 VAL A 927 5.274 5.699 -1.685 1.00 0.00 H new ATOM 0 HG22 VAL A 927 4.558 7.321 -1.848 1.00 0.00 H new ATOM 0 HG23 VAL A 927 5.363 6.559 -3.241 1.00 0.00 H new ATOM 598 N ILE A 928 8.238 10.024 -0.898 1.00 0.00 N ATOM 599 CA ILE A 928 9.466 10.633 -0.403 1.00 0.00 C ATOM 600 C ILE A 928 9.774 10.173 1.017 1.00 0.00 C ATOM 601 O ILE A 928 10.911 9.821 1.335 1.00 0.00 O ATOM 602 CB ILE A 928 9.380 12.171 -0.426 1.00 0.00 C ATOM 603 CG1 ILE A 928 8.186 12.649 0.403 1.00 0.00 C ATOM 604 CG2 ILE A 928 9.275 12.675 -1.857 1.00 0.00 C ATOM 605 CD1 ILE A 928 7.991 14.148 0.371 1.00 0.00 C ATOM 0 H ILE A 928 7.409 10.236 -0.344 1.00 0.00 H new ATOM 0 HA ILE A 928 10.268 10.312 -1.068 1.00 0.00 H new ATOM 0 HB ILE A 928 10.290 12.578 0.015 1.00 0.00 H new ATOM 0 HG12 ILE A 928 7.281 12.165 0.035 1.00 0.00 H new ATOM 0 HG13 ILE A 928 8.320 12.330 1.437 1.00 0.00 H new ATOM 0 HG21 ILE A 928 9.215 13.763 -1.856 1.00 0.00 H new ATOM 0 HG22 ILE A 928 10.154 12.361 -2.419 1.00 0.00 H new ATOM 0 HG23 ILE A 928 8.380 12.263 -2.323 1.00 0.00 H new ATOM 0 HD11 ILE A 928 7.127 14.416 0.980 1.00 0.00 H new ATOM 0 HD12 ILE A 928 8.880 14.639 0.767 1.00 0.00 H new ATOM 0 HD13 ILE A 928 7.825 14.471 -0.657 1.00 0.00 H new ATOM 617 N LEU A 929 8.754 10.175 1.868 1.00 0.00 N ATOM 618 CA LEU A 929 8.915 9.756 3.256 1.00 0.00 C ATOM 619 C LEU A 929 7.743 8.887 3.702 1.00 0.00 C ATOM 620 O LEU A 929 6.630 9.021 3.192 1.00 0.00 O ATOM 621 CB LEU A 929 9.034 10.978 4.169 1.00 0.00 C ATOM 622 CG LEU A 929 8.765 10.735 5.654 1.00 0.00 C ATOM 623 CD1 LEU A 929 9.948 10.033 6.303 1.00 0.00 C ATOM 624 CD2 LEU A 929 8.467 12.048 6.364 1.00 0.00 C ATOM 0 H LEU A 929 7.807 10.462 1.621 1.00 0.00 H new ATOM 0 HA LEU A 929 9.829 9.167 3.327 1.00 0.00 H new ATOM 0 HB2 LEU A 929 10.039 11.388 4.065 1.00 0.00 H new ATOM 0 HB3 LEU A 929 8.340 11.740 3.815 1.00 0.00 H new ATOM 0 HG LEU A 929 7.891 10.089 5.744 1.00 0.00 H new ATOM 0 HD11 LEU A 929 9.738 9.868 7.360 1.00 0.00 H new ATOM 0 HD12 LEU A 929 10.116 9.074 5.813 1.00 0.00 H new ATOM 0 HD13 LEU A 929 10.839 10.653 6.202 1.00 0.00 H new ATOM 0 HD21 LEU A 929 8.278 11.856 7.420 1.00 0.00 H new ATOM 0 HD22 LEU A 929 9.321 12.718 6.264 1.00 0.00 H new ATOM 0 HD23 LEU A 929 7.588 12.512 5.917 1.00 0.00 H new ATOM 636 N ILE A 930 8.001 7.999 4.656 1.00 0.00 N ATOM 637 CA ILE A 930 6.966 7.111 5.172 1.00 0.00 C ATOM 638 C ILE A 930 7.022 7.028 6.693 1.00 0.00 C ATOM 639 O ILE A 930 8.082 6.792 7.274 1.00 0.00 O ATOM 640 CB ILE A 930 7.098 5.693 4.586 1.00 0.00 C ATOM 641 CG1 ILE A 930 7.093 5.746 3.057 1.00 0.00 C ATOM 642 CG2 ILE A 930 5.973 4.803 5.094 1.00 0.00 C ATOM 643 CD1 ILE A 930 7.652 4.500 2.407 1.00 0.00 C ATOM 0 H ILE A 930 8.917 7.875 5.087 1.00 0.00 H new ATOM 0 HA ILE A 930 6.008 7.533 4.869 1.00 0.00 H new ATOM 0 HB ILE A 930 8.047 5.268 4.913 1.00 0.00 H new ATOM 0 HG12 ILE A 930 6.071 5.900 2.710 1.00 0.00 H new ATOM 0 HG13 ILE A 930 7.674 6.608 2.730 1.00 0.00 H new ATOM 0 HG21 ILE A 930 6.080 3.804 4.671 1.00 0.00 H new ATOM 0 HG22 ILE A 930 6.019 4.743 6.181 1.00 0.00 H new ATOM 0 HG23 ILE A 930 5.013 5.223 4.794 1.00 0.00 H new ATOM 0 HD11 ILE A 930 7.617 4.608 1.323 1.00 0.00 H new ATOM 0 HD12 ILE A 930 8.685 4.356 2.724 1.00 0.00 H new ATOM 0 HD13 ILE A 930 7.057 3.636 2.705 1.00 0.00 H new ATOM 655 N ARG A 931 5.874 7.221 7.334 1.00 0.00 N ATOM 656 CA ARG A 931 5.792 7.167 8.788 1.00 0.00 C ATOM 657 C ARG A 931 4.893 6.020 9.240 1.00 0.00 C ATOM 658 O ARG A 931 3.730 5.936 8.845 1.00 0.00 O ATOM 659 CB ARG A 931 5.261 8.492 9.340 1.00 0.00 C ATOM 660 CG ARG A 931 5.766 8.816 10.736 1.00 0.00 C ATOM 661 CD ARG A 931 5.687 10.307 11.025 1.00 0.00 C ATOM 662 NE ARG A 931 6.174 10.631 12.364 1.00 0.00 N ATOM 663 CZ ARG A 931 5.466 10.434 13.470 1.00 0.00 C ATOM 664 NH1 ARG A 931 4.248 9.915 13.399 1.00 0.00 N ATOM 665 NH2 ARG A 931 5.978 10.755 14.652 1.00 0.00 N ATOM 0 H ARG A 931 4.988 7.416 6.869 1.00 0.00 H new ATOM 0 HA ARG A 931 6.796 6.995 9.177 1.00 0.00 H new ATOM 0 HB2 ARG A 931 5.546 9.298 8.664 1.00 0.00 H new ATOM 0 HB3 ARG A 931 4.172 8.459 9.355 1.00 0.00 H new ATOM 0 HG2 ARG A 931 5.177 8.270 11.473 1.00 0.00 H new ATOM 0 HG3 ARG A 931 6.797 8.479 10.838 1.00 0.00 H new ATOM 0 HD2 ARG A 931 6.273 10.851 10.284 1.00 0.00 H new ATOM 0 HD3 ARG A 931 4.655 10.642 10.924 1.00 0.00 H new ATOM 0 HE ARG A 931 7.108 11.030 12.454 1.00 0.00 H new ATOM 0 HH11 ARG A 931 3.852 9.666 12.493 1.00 0.00 H new ATOM 0 HH12 ARG A 931 3.707 9.765 14.251 1.00 0.00 H new ATOM 0 HH21 ARG A 931 6.915 11.153 14.711 1.00 0.00 H new ATOM 0 HH22 ARG A 931 5.434 10.604 15.501 1.00 0.00 H new ATOM 679 N PHE A 932 5.440 5.137 10.069 1.00 0.00 N ATOM 680 CA PHE A 932 4.689 3.994 10.573 1.00 0.00 C ATOM 681 C PHE A 932 4.006 4.332 11.895 1.00 0.00 C ATOM 682 O PHE A 932 4.656 4.742 12.856 1.00 0.00 O ATOM 683 CB PHE A 932 5.615 2.790 10.758 1.00 0.00 C ATOM 684 CG PHE A 932 6.427 2.464 9.537 1.00 0.00 C ATOM 685 CD1 PHE A 932 5.864 1.764 8.482 1.00 0.00 C ATOM 686 CD2 PHE A 932 7.752 2.858 9.445 1.00 0.00 C ATOM 687 CE1 PHE A 932 6.608 1.463 7.356 1.00 0.00 C ATOM 688 CE2 PHE A 932 8.500 2.560 8.322 1.00 0.00 C ATOM 689 CZ PHE A 932 7.928 1.861 7.277 1.00 0.00 C ATOM 0 H PHE A 932 6.401 5.192 10.406 1.00 0.00 H new ATOM 0 HA PHE A 932 3.921 3.744 9.841 1.00 0.00 H new ATOM 0 HB2 PHE A 932 6.290 2.986 11.591 1.00 0.00 H new ATOM 0 HB3 PHE A 932 5.017 1.920 11.029 1.00 0.00 H new ATOM 0 HD1 PHE A 932 4.832 1.450 8.540 1.00 0.00 H new ATOM 0 HD2 PHE A 932 8.205 3.404 10.259 1.00 0.00 H new ATOM 0 HE1 PHE A 932 6.158 0.918 6.540 1.00 0.00 H new ATOM 0 HE2 PHE A 932 9.532 2.874 8.261 1.00 0.00 H new ATOM 0 HZ PHE A 932 8.512 1.626 6.400 1.00 0.00 H new ATOM 699 N VAL A 933 2.689 4.157 11.935 1.00 0.00 N ATOM 700 CA VAL A 933 1.916 4.442 13.138 1.00 0.00 C ATOM 701 C VAL A 933 1.799 3.206 14.023 1.00 0.00 C ATOM 702 O VAL A 933 1.929 2.078 13.549 1.00 0.00 O ATOM 703 CB VAL A 933 0.502 4.946 12.790 1.00 0.00 C ATOM 704 CG1 VAL A 933 -0.140 5.611 13.998 1.00 0.00 C ATOM 705 CG2 VAL A 933 0.554 5.903 11.609 1.00 0.00 C ATOM 0 H VAL A 933 2.135 3.819 11.148 1.00 0.00 H new ATOM 0 HA VAL A 933 2.450 5.223 13.679 1.00 0.00 H new ATOM 0 HB VAL A 933 -0.111 4.090 12.508 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -1.138 5.961 13.733 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -0.212 4.892 14.814 1.00 0.00 H new ATOM 0 HG13 VAL A 933 0.469 6.458 14.314 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -0.453 6.249 11.377 1.00 0.00 H new ATOM 0 HG22 VAL A 933 1.182 6.757 11.860 1.00 0.00 H new ATOM 0 HG23 VAL A 933 0.970 5.389 10.742 1.00 0.00 H new ATOM 715 N GLU A 934 1.554 3.428 15.310 1.00 0.00 N ATOM 716 CA GLU A 934 1.420 2.331 16.262 1.00 0.00 C ATOM 717 C GLU A 934 0.767 1.118 15.605 1.00 0.00 C ATOM 718 O GLU A 934 1.284 0.003 15.684 1.00 0.00 O ATOM 719 CB GLU A 934 0.597 2.774 17.473 1.00 0.00 C ATOM 720 CG GLU A 934 1.233 3.907 18.260 1.00 0.00 C ATOM 721 CD GLU A 934 2.695 3.651 18.573 1.00 0.00 C ATOM 722 OE1 GLU A 934 3.056 2.476 18.795 1.00 0.00 O ATOM 723 OE2 GLU A 934 3.477 4.624 18.596 1.00 0.00 O ATOM 0 H GLU A 934 1.444 4.357 15.718 1.00 0.00 H new ATOM 0 HA GLU A 934 2.419 2.049 16.595 1.00 0.00 H new ATOM 0 HB2 GLU A 934 -0.391 3.087 17.135 1.00 0.00 H new ATOM 0 HB3 GLU A 934 0.452 1.920 18.135 1.00 0.00 H new ATOM 0 HG2 GLU A 934 1.144 4.833 17.693 1.00 0.00 H new ATOM 0 HG3 GLU A 934 0.685 4.050 19.192 1.00 0.00 H new ATOM 730 N ASP A 935 -0.371 1.344 14.958 1.00 0.00 N ATOM 731 CA ASP A 935 -1.095 0.270 14.288 1.00 0.00 C ATOM 732 C ASP A 935 -1.340 0.614 12.822 1.00 0.00 C ATOM 733 O ASP A 935 -1.497 -0.273 11.982 1.00 0.00 O ATOM 734 CB ASP A 935 -2.426 0.007 14.992 1.00 0.00 C ATOM 735 CG ASP A 935 -3.518 0.959 14.543 1.00 0.00 C ATOM 736 OD1 ASP A 935 -3.937 0.870 13.370 1.00 0.00 O ATOM 737 OD2 ASP A 935 -3.953 1.792 15.365 1.00 0.00 O ATOM 0 H ASP A 935 -0.812 2.261 14.883 1.00 0.00 H new ATOM 0 HA ASP A 935 -0.484 -0.632 14.335 1.00 0.00 H new ATOM 0 HB2 ASP A 935 -2.740 -1.019 14.798 1.00 0.00 H new ATOM 0 HB3 ASP A 935 -2.288 0.099 16.069 1.00 0.00 H new ATOM 742 N LYS A 936 -1.373 1.908 12.520 1.00 0.00 N ATOM 743 CA LYS A 936 -1.599 2.370 11.156 1.00 0.00 C ATOM 744 C LYS A 936 -0.278 2.688 10.463 1.00 0.00 C ATOM 745 O LYS A 936 0.781 2.670 11.089 1.00 0.00 O ATOM 746 CB LYS A 936 -2.498 3.609 11.158 1.00 0.00 C ATOM 747 CG LYS A 936 -3.355 3.740 9.911 1.00 0.00 C ATOM 748 CD LYS A 936 -4.569 4.621 10.159 1.00 0.00 C ATOM 749 CE LYS A 936 -5.684 3.851 10.849 1.00 0.00 C ATOM 750 NZ LYS A 936 -5.473 3.770 12.321 1.00 0.00 N ATOM 0 H LYS A 936 -1.246 2.655 13.202 1.00 0.00 H new ATOM 0 HA LYS A 936 -2.094 1.570 10.605 1.00 0.00 H new ATOM 0 HB2 LYS A 936 -3.147 3.575 12.033 1.00 0.00 H new ATOM 0 HB3 LYS A 936 -1.876 4.499 11.257 1.00 0.00 H new ATOM 0 HG2 LYS A 936 -2.759 4.160 9.101 1.00 0.00 H new ATOM 0 HG3 LYS A 936 -3.681 2.752 9.587 1.00 0.00 H new ATOM 0 HD2 LYS A 936 -4.281 5.475 10.772 1.00 0.00 H new ATOM 0 HD3 LYS A 936 -4.932 5.018 9.211 1.00 0.00 H new ATOM 0 HE2 LYS A 936 -6.639 4.334 10.645 1.00 0.00 H new ATOM 0 HE3 LYS A 936 -5.741 2.845 10.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 936 -6.391 3.826 12.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 936 -5.011 2.869 12.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 936 -4.870 4.559 12.629 1.00 0.00 H new ATOM 764 N MET A 937 -0.349 2.981 9.169 1.00 0.00 N ATOM 765 CA MET A 937 0.842 3.306 8.393 1.00 0.00 C ATOM 766 C MET A 937 0.605 4.537 7.523 1.00 0.00 C ATOM 767 O MET A 937 -0.201 4.504 6.592 1.00 0.00 O ATOM 768 CB MET A 937 1.246 2.119 7.517 1.00 0.00 C ATOM 769 CG MET A 937 2.309 2.458 6.485 1.00 0.00 C ATOM 770 SD MET A 937 2.901 1.007 5.594 1.00 0.00 S ATOM 771 CE MET A 937 3.414 1.747 4.045 1.00 0.00 C ATOM 0 H MET A 937 -1.218 3.000 8.636 1.00 0.00 H new ATOM 0 HA MET A 937 1.650 3.525 9.090 1.00 0.00 H new ATOM 0 HB2 MET A 937 1.614 1.316 8.155 1.00 0.00 H new ATOM 0 HB3 MET A 937 0.362 1.739 7.005 1.00 0.00 H new ATOM 0 HG2 MET A 937 1.902 3.176 5.773 1.00 0.00 H new ATOM 0 HG3 MET A 937 3.150 2.943 6.981 1.00 0.00 H new ATOM 0 HE1 MET A 937 3.805 0.973 3.384 1.00 0.00 H new ATOM 0 HE2 MET A 937 2.559 2.230 3.572 1.00 0.00 H new ATOM 0 HE3 MET A 937 4.190 2.488 4.235 1.00 0.00 H new ATOM 781 N TRP A 938 1.310 5.619 7.831 1.00 0.00 N ATOM 782 CA TRP A 938 1.175 6.860 7.077 1.00 0.00 C ATOM 783 C TRP A 938 2.223 6.942 5.973 1.00 0.00 C ATOM 784 O TRP A 938 3.307 6.371 6.088 1.00 0.00 O ATOM 785 CB TRP A 938 1.305 8.064 8.011 1.00 0.00 C ATOM 786 CG TRP A 938 0.265 8.095 9.089 1.00 0.00 C ATOM 787 CD1 TRP A 938 -0.739 7.190 9.286 1.00 0.00 C ATOM 788 CD2 TRP A 938 0.126 9.080 10.118 1.00 0.00 C ATOM 789 NE1 TRP A 938 -1.494 7.553 10.375 1.00 0.00 N ATOM 790 CE2 TRP A 938 -0.983 8.709 10.904 1.00 0.00 C ATOM 791 CE3 TRP A 938 0.831 10.239 10.454 1.00 0.00 C ATOM 792 CZ2 TRP A 938 -1.401 9.457 12.001 1.00 0.00 C ATOM 793 CZ3 TRP A 938 0.415 10.980 11.544 1.00 0.00 C ATOM 794 CH2 TRP A 938 -0.692 10.587 12.307 1.00 0.00 C ATOM 0 H TRP A 938 1.981 5.662 8.598 1.00 0.00 H new ATOM 0 HA TRP A 938 0.187 6.871 6.616 1.00 0.00 H new ATOM 0 HB2 TRP A 938 2.294 8.053 8.470 1.00 0.00 H new ATOM 0 HB3 TRP A 938 1.236 8.980 7.423 1.00 0.00 H new ATOM 0 HD1 TRP A 938 -0.914 6.317 8.675 1.00 0.00 H new ATOM 0 HE1 TRP A 938 -2.303 7.045 10.732 1.00 0.00 H new ATOM 0 HE3 TRP A 938 1.686 10.550 9.872 1.00 0.00 H new ATOM 0 HZ2 TRP A 938 -2.255 9.156 12.590 1.00 0.00 H new ATOM 0 HZ3 TRP A 938 0.953 11.877 11.812 1.00 0.00 H new ATOM 0 HH2 TRP A 938 -0.992 11.187 13.153 1.00 0.00 H new ATOM 805 N VAL A 939 1.893 7.656 4.901 1.00 0.00 N ATOM 806 CA VAL A 939 2.806 7.814 3.776 1.00 0.00 C ATOM 807 C VAL A 939 2.858 9.264 3.309 1.00 0.00 C ATOM 808 O VAL A 939 1.833 9.945 3.244 1.00 0.00 O ATOM 809 CB VAL A 939 2.397 6.919 2.591 1.00 0.00 C ATOM 810 CG1 VAL A 939 3.428 7.005 1.476 1.00 0.00 C ATOM 811 CG2 VAL A 939 2.214 5.480 3.049 1.00 0.00 C ATOM 0 H VAL A 939 0.999 8.134 4.789 1.00 0.00 H new ATOM 0 HA VAL A 939 3.793 7.513 4.126 1.00 0.00 H new ATOM 0 HB VAL A 939 1.444 7.276 2.200 1.00 0.00 H new ATOM 0 HG11 VAL A 939 3.122 6.366 0.648 1.00 0.00 H new ATOM 0 HG12 VAL A 939 3.505 8.036 1.130 1.00 0.00 H new ATOM 0 HG13 VAL A 939 4.397 6.675 1.850 1.00 0.00 H new ATOM 0 HG21 VAL A 939 1.925 4.862 2.199 1.00 0.00 H new ATOM 0 HG22 VAL A 939 3.150 5.109 3.466 1.00 0.00 H new ATOM 0 HG23 VAL A 939 1.435 5.437 3.810 1.00 0.00 H new ATOM 821 N THR A 940 4.059 9.733 2.984 1.00 0.00 N ATOM 822 CA THR A 940 4.245 11.103 2.524 1.00 0.00 C ATOM 823 C THR A 940 4.623 11.141 1.047 1.00 0.00 C ATOM 824 O THR A 940 5.304 10.245 0.548 1.00 0.00 O ATOM 825 CB THR A 940 5.333 11.827 3.339 1.00 0.00 C ATOM 826 OG1 THR A 940 4.885 12.029 4.684 1.00 0.00 O ATOM 827 CG2 THR A 940 5.680 13.167 2.708 1.00 0.00 C ATOM 0 H THR A 940 4.917 9.184 3.031 1.00 0.00 H new ATOM 0 HA THR A 940 3.294 11.615 2.666 1.00 0.00 H new ATOM 0 HB THR A 940 6.227 11.203 3.344 1.00 0.00 H new ATOM 0 HG1 THR A 940 5.509 12.624 5.151 1.00 0.00 H new ATOM 0 HG21 THR A 940 6.450 13.660 3.301 1.00 0.00 H new ATOM 0 HG22 THR A 940 6.049 13.007 1.695 1.00 0.00 H new ATOM 0 HG23 THR A 940 4.790 13.795 2.675 1.00 0.00 H new ATOM 835 N PHE A 941 4.178 12.183 0.353 1.00 0.00 N ATOM 836 CA PHE A 941 4.470 12.336 -1.067 1.00 0.00 C ATOM 837 C PHE A 941 5.010 13.732 -1.364 1.00 0.00 C ATOM 838 O PHE A 941 4.666 14.701 -0.684 1.00 0.00 O ATOM 839 CB PHE A 941 3.212 12.077 -1.899 1.00 0.00 C ATOM 840 CG PHE A 941 2.796 10.634 -1.922 1.00 0.00 C ATOM 841 CD1 PHE A 941 2.421 9.988 -0.755 1.00 0.00 C ATOM 842 CD2 PHE A 941 2.780 9.922 -3.111 1.00 0.00 C ATOM 843 CE1 PHE A 941 2.037 8.661 -0.772 1.00 0.00 C ATOM 844 CE2 PHE A 941 2.397 8.595 -3.135 1.00 0.00 C ATOM 845 CZ PHE A 941 2.026 7.963 -1.964 1.00 0.00 C ATOM 0 H PHE A 941 3.614 12.934 0.751 1.00 0.00 H new ATOM 0 HA PHE A 941 5.233 11.605 -1.336 1.00 0.00 H new ATOM 0 HB2 PHE A 941 2.393 12.677 -1.502 1.00 0.00 H new ATOM 0 HB3 PHE A 941 3.386 12.413 -2.921 1.00 0.00 H new ATOM 0 HD1 PHE A 941 2.429 10.529 0.180 1.00 0.00 H new ATOM 0 HD2 PHE A 941 3.070 10.410 -4.029 1.00 0.00 H new ATOM 0 HE1 PHE A 941 1.746 8.170 0.145 1.00 0.00 H new ATOM 0 HE2 PHE A 941 2.388 8.052 -4.069 1.00 0.00 H new ATOM 0 HZ PHE A 941 1.728 6.925 -1.980 1.00 0.00 H new ATOM 855 N LEU A 942 5.857 13.828 -2.382 1.00 0.00 N ATOM 856 CA LEU A 942 6.447 15.105 -2.769 1.00 0.00 C ATOM 857 C LEU A 942 5.418 16.228 -2.684 1.00 0.00 C ATOM 858 O LEU A 942 5.564 17.157 -1.891 1.00 0.00 O ATOM 859 CB LEU A 942 7.009 15.020 -4.190 1.00 0.00 C ATOM 860 CG LEU A 942 7.498 16.335 -4.798 1.00 0.00 C ATOM 861 CD1 LEU A 942 8.832 16.740 -4.191 1.00 0.00 C ATOM 862 CD2 LEU A 942 7.613 16.212 -6.310 1.00 0.00 C ATOM 0 H LEU A 942 6.151 13.037 -2.955 1.00 0.00 H new ATOM 0 HA LEU A 942 7.259 15.327 -2.076 1.00 0.00 H new ATOM 0 HB2 LEU A 942 7.838 14.313 -4.190 1.00 0.00 H new ATOM 0 HB3 LEU A 942 6.238 14.607 -4.840 1.00 0.00 H new ATOM 0 HG LEU A 942 6.768 17.112 -4.571 1.00 0.00 H new ATOM 0 HD11 LEU A 942 9.164 17.678 -4.636 1.00 0.00 H new ATOM 0 HD12 LEU A 942 8.718 16.869 -3.115 1.00 0.00 H new ATOM 0 HD13 LEU A 942 9.572 15.964 -4.387 1.00 0.00 H new ATOM 0 HD21 LEU A 942 7.962 17.157 -6.726 1.00 0.00 H new ATOM 0 HD22 LEU A 942 8.322 15.422 -6.558 1.00 0.00 H new ATOM 0 HD23 LEU A 942 6.637 15.969 -6.731 1.00 0.00 H new ATOM 874 N GLU A 943 4.377 16.133 -3.506 1.00 0.00 N ATOM 875 CA GLU A 943 3.323 17.141 -3.521 1.00 0.00 C ATOM 876 C GLU A 943 2.044 16.601 -2.888 1.00 0.00 C ATOM 877 O GLU A 943 1.921 15.403 -2.637 1.00 0.00 O ATOM 878 CB GLU A 943 3.042 17.595 -4.955 1.00 0.00 C ATOM 879 CG GLU A 943 4.183 18.380 -5.580 1.00 0.00 C ATOM 880 CD GLU A 943 3.706 19.380 -6.615 1.00 0.00 C ATOM 881 OE1 GLU A 943 3.518 18.982 -7.783 1.00 0.00 O ATOM 882 OE2 GLU A 943 3.520 20.562 -6.255 1.00 0.00 O ATOM 0 H GLU A 943 4.241 15.370 -4.169 1.00 0.00 H new ATOM 0 HA GLU A 943 3.665 17.995 -2.937 1.00 0.00 H new ATOM 0 HB2 GLU A 943 2.835 16.719 -5.570 1.00 0.00 H new ATOM 0 HB3 GLU A 943 2.142 18.210 -4.963 1.00 0.00 H new ATOM 0 HG2 GLU A 943 4.729 18.906 -4.797 1.00 0.00 H new ATOM 0 HG3 GLU A 943 4.883 17.687 -6.046 1.00 0.00 H new ATOM 889 N GLY A 944 1.095 17.495 -2.630 1.00 0.00 N ATOM 890 CA GLY A 944 -0.162 17.090 -2.027 1.00 0.00 C ATOM 891 C GLY A 944 -1.088 16.413 -3.017 1.00 0.00 C ATOM 892 O GLY A 944 -1.618 15.336 -2.745 1.00 0.00 O ATOM 0 H GLY A 944 1.174 18.493 -2.828 1.00 0.00 H new ATOM 0 HA2 GLY A 944 0.038 16.411 -1.198 1.00 0.00 H new ATOM 0 HA3 GLY A 944 -0.659 17.965 -1.609 1.00 0.00 H new ATOM 896 N SER A 945 -1.286 17.045 -4.170 1.00 0.00 N ATOM 897 CA SER A 945 -2.159 16.499 -5.202 1.00 0.00 C ATOM 898 C SER A 945 -1.824 15.037 -5.480 1.00 0.00 C ATOM 899 O SER A 945 -2.681 14.261 -5.901 1.00 0.00 O ATOM 900 CB SER A 945 -2.035 17.317 -6.489 1.00 0.00 C ATOM 901 OG SER A 945 -0.678 17.597 -6.787 1.00 0.00 O ATOM 0 H SER A 945 -0.853 17.936 -4.413 1.00 0.00 H new ATOM 0 HA SER A 945 -3.186 16.555 -4.842 1.00 0.00 H new ATOM 0 HB2 SER A 945 -2.487 16.770 -7.316 1.00 0.00 H new ATOM 0 HB3 SER A 945 -2.588 18.251 -6.385 1.00 0.00 H new ATOM 0 HG SER A 945 -0.626 18.119 -7.615 1.00 0.00 H new ATOM 907 N SER A 946 -0.569 14.669 -5.240 1.00 0.00 N ATOM 908 CA SER A 946 -0.118 13.301 -5.468 1.00 0.00 C ATOM 909 C SER A 946 -0.857 12.326 -4.556 1.00 0.00 C ATOM 910 O SER A 946 -1.347 11.290 -5.005 1.00 0.00 O ATOM 911 CB SER A 946 1.390 13.193 -5.232 1.00 0.00 C ATOM 912 OG SER A 946 2.108 14.002 -6.148 1.00 0.00 O ATOM 0 H SER A 946 0.152 15.298 -4.888 1.00 0.00 H new ATOM 0 HA SER A 946 -0.337 13.040 -6.504 1.00 0.00 H new ATOM 0 HB2 SER A 946 1.624 13.497 -4.212 1.00 0.00 H new ATOM 0 HB3 SER A 946 1.704 12.154 -5.335 1.00 0.00 H new ATOM 0 HG SER A 946 3.069 13.917 -5.976 1.00 0.00 H new ATOM 918 N ALA A 947 -0.933 12.666 -3.274 1.00 0.00 N ATOM 919 CA ALA A 947 -1.614 11.823 -2.299 1.00 0.00 C ATOM 920 C ALA A 947 -3.084 11.641 -2.662 1.00 0.00 C ATOM 921 O ALA A 947 -3.697 10.629 -2.321 1.00 0.00 O ATOM 922 CB ALA A 947 -1.482 12.417 -0.904 1.00 0.00 C ATOM 0 H ALA A 947 -0.531 13.520 -2.886 1.00 0.00 H new ATOM 0 HA ALA A 947 -1.140 10.841 -2.310 1.00 0.00 H new ATOM 0 HB1 ALA A 947 -1.995 11.777 -0.186 1.00 0.00 H new ATOM 0 HB2 ALA A 947 -0.428 12.489 -0.637 1.00 0.00 H new ATOM 0 HB3 ALA A 947 -1.929 13.411 -0.888 1.00 0.00 H new ATOM 928 N LEU A 948 -3.644 12.627 -3.354 1.00 0.00 N ATOM 929 CA LEU A 948 -5.043 12.575 -3.763 1.00 0.00 C ATOM 930 C LEU A 948 -5.240 11.585 -4.907 1.00 0.00 C ATOM 931 O LEU A 948 -6.331 11.048 -5.094 1.00 0.00 O ATOM 932 CB LEU A 948 -5.522 13.965 -4.188 1.00 0.00 C ATOM 933 CG LEU A 948 -5.106 15.124 -3.283 1.00 0.00 C ATOM 934 CD1 LEU A 948 -5.617 16.445 -3.837 1.00 0.00 C ATOM 935 CD2 LEU A 948 -5.617 14.904 -1.866 1.00 0.00 C ATOM 0 H LEU A 948 -3.151 13.472 -3.643 1.00 0.00 H new ATOM 0 HA LEU A 948 -5.633 12.238 -2.911 1.00 0.00 H new ATOM 0 HB2 LEU A 948 -5.150 14.164 -5.193 1.00 0.00 H new ATOM 0 HB3 LEU A 948 -6.610 13.950 -4.248 1.00 0.00 H new ATOM 0 HG LEU A 948 -4.017 15.164 -3.253 1.00 0.00 H new ATOM 0 HD11 LEU A 948 -5.311 17.258 -3.179 1.00 0.00 H new ATOM 0 HD12 LEU A 948 -5.202 16.607 -4.832 1.00 0.00 H new ATOM 0 HD13 LEU A 948 -6.705 16.418 -3.898 1.00 0.00 H new ATOM 0 HD21 LEU A 948 -5.312 15.739 -1.235 1.00 0.00 H new ATOM 0 HD22 LEU A 948 -6.705 14.837 -1.878 1.00 0.00 H new ATOM 0 HD23 LEU A 948 -5.201 13.978 -1.469 1.00 0.00 H new ATOM 947 N ASN A 949 -4.176 11.348 -5.667 1.00 0.00 N ATOM 948 CA ASN A 949 -4.232 10.420 -6.791 1.00 0.00 C ATOM 949 C ASN A 949 -4.074 8.979 -6.316 1.00 0.00 C ATOM 950 O ASN A 949 -4.811 8.089 -6.741 1.00 0.00 O ATOM 951 CB ASN A 949 -3.141 10.756 -7.810 1.00 0.00 C ATOM 952 CG ASN A 949 -3.167 12.214 -8.226 1.00 0.00 C ATOM 953 OD1 ASN A 949 -2.122 12.830 -8.432 1.00 0.00 O ATOM 954 ND2 ASN A 949 -4.365 12.772 -8.350 1.00 0.00 N ATOM 0 H ASN A 949 -3.265 11.785 -5.525 1.00 0.00 H new ATOM 0 HA ASN A 949 -5.208 10.521 -7.266 1.00 0.00 H new ATOM 0 HB2 ASN A 949 -2.166 10.520 -7.385 1.00 0.00 H new ATOM 0 HB3 ASN A 949 -3.265 10.127 -8.692 1.00 0.00 H new ATOM 0 HD21 ASN A 949 -4.446 13.751 -8.626 1.00 0.00 H new ATOM 0 HD22 ASN A 949 -5.205 12.222 -8.169 1.00 0.00 H new ATOM 961 N VAL A 950 -3.108 8.756 -5.430 1.00 0.00 N ATOM 962 CA VAL A 950 -2.854 7.424 -4.896 1.00 0.00 C ATOM 963 C VAL A 950 -4.097 6.857 -4.219 1.00 0.00 C ATOM 964 O VAL A 950 -4.208 5.648 -4.013 1.00 0.00 O ATOM 965 CB VAL A 950 -1.693 7.438 -3.883 1.00 0.00 C ATOM 966 CG1 VAL A 950 -2.173 7.930 -2.527 1.00 0.00 C ATOM 967 CG2 VAL A 950 -1.071 6.054 -3.768 1.00 0.00 C ATOM 0 H VAL A 950 -2.489 9.481 -5.067 1.00 0.00 H new ATOM 0 HA VAL A 950 -2.583 6.791 -5.741 1.00 0.00 H new ATOM 0 HB VAL A 950 -0.928 8.127 -4.242 1.00 0.00 H new ATOM 0 HG11 VAL A 950 -1.339 7.933 -1.825 1.00 0.00 H new ATOM 0 HG12 VAL A 950 -2.568 8.941 -2.626 1.00 0.00 H new ATOM 0 HG13 VAL A 950 -2.957 7.269 -2.157 1.00 0.00 H new ATOM 0 HG21 VAL A 950 -0.253 6.082 -3.049 1.00 0.00 H new ATOM 0 HG22 VAL A 950 -1.826 5.343 -3.432 1.00 0.00 H new ATOM 0 HG23 VAL A 950 -0.689 5.745 -4.741 1.00 0.00 H new ATOM 977 N LEU A 951 -5.030 7.738 -3.875 1.00 0.00 N ATOM 978 CA LEU A 951 -6.268 7.325 -3.222 1.00 0.00 C ATOM 979 C LEU A 951 -6.950 6.207 -4.003 1.00 0.00 C ATOM 980 O LEU A 951 -7.616 5.348 -3.425 1.00 0.00 O ATOM 981 CB LEU A 951 -7.216 8.517 -3.083 1.00 0.00 C ATOM 982 CG LEU A 951 -6.920 9.480 -1.933 1.00 0.00 C ATOM 983 CD1 LEU A 951 -7.951 10.597 -1.893 1.00 0.00 C ATOM 984 CD2 LEU A 951 -6.889 8.733 -0.607 1.00 0.00 C ATOM 0 H LEU A 951 -4.953 8.742 -4.037 1.00 0.00 H new ATOM 0 HA LEU A 951 -6.018 6.949 -2.230 1.00 0.00 H new ATOM 0 HB2 LEU A 951 -7.198 9.081 -4.016 1.00 0.00 H new ATOM 0 HB3 LEU A 951 -8.230 8.137 -2.960 1.00 0.00 H new ATOM 0 HG LEU A 951 -5.939 9.925 -2.100 1.00 0.00 H new ATOM 0 HD11 LEU A 951 -7.724 11.272 -1.068 1.00 0.00 H new ATOM 0 HD12 LEU A 951 -7.925 11.150 -2.832 1.00 0.00 H new ATOM 0 HD13 LEU A 951 -8.944 10.171 -1.750 1.00 0.00 H new ATOM 0 HD21 LEU A 951 -6.677 9.434 0.201 1.00 0.00 H new ATOM 0 HD22 LEU A 951 -7.856 8.260 -0.433 1.00 0.00 H new ATOM 0 HD23 LEU A 951 -6.112 7.969 -0.638 1.00 0.00 H new ATOM 996 N SER A 952 -6.777 6.222 -5.321 1.00 0.00 N ATOM 997 CA SER A 952 -7.377 5.210 -6.183 1.00 0.00 C ATOM 998 C SER A 952 -7.050 3.806 -5.681 1.00 0.00 C ATOM 999 O SER A 952 -7.699 2.831 -6.062 1.00 0.00 O ATOM 1000 CB SER A 952 -6.884 5.377 -7.621 1.00 0.00 C ATOM 1001 OG SER A 952 -7.728 4.694 -8.532 1.00 0.00 O ATOM 0 H SER A 952 -6.226 6.924 -5.815 1.00 0.00 H new ATOM 0 HA SER A 952 -8.459 5.343 -6.160 1.00 0.00 H new ATOM 0 HB2 SER A 952 -6.850 6.436 -7.876 1.00 0.00 H new ATOM 0 HB3 SER A 952 -5.867 4.995 -7.707 1.00 0.00 H new ATOM 0 HG SER A 952 -7.392 4.817 -9.444 1.00 0.00 H new ATOM 1007 N LEU A 953 -6.039 3.712 -4.824 1.00 0.00 N ATOM 1008 CA LEU A 953 -5.624 2.428 -4.269 1.00 0.00 C ATOM 1009 C LEU A 953 -6.412 2.102 -3.004 1.00 0.00 C ATOM 1010 O LEU A 953 -6.049 1.200 -2.250 1.00 0.00 O ATOM 1011 CB LEU A 953 -4.126 2.444 -3.961 1.00 0.00 C ATOM 1012 CG LEU A 953 -3.193 2.268 -5.159 1.00 0.00 C ATOM 1013 CD1 LEU A 953 -1.747 2.501 -4.748 1.00 0.00 C ATOM 1014 CD2 LEU A 953 -3.360 0.884 -5.767 1.00 0.00 C ATOM 0 H LEU A 953 -5.492 4.509 -4.499 1.00 0.00 H new ATOM 0 HA LEU A 953 -5.828 1.656 -5.011 1.00 0.00 H new ATOM 0 HB2 LEU A 953 -3.886 3.389 -3.474 1.00 0.00 H new ATOM 0 HB3 LEU A 953 -3.915 1.653 -3.242 1.00 0.00 H new ATOM 0 HG LEU A 953 -3.459 3.008 -5.914 1.00 0.00 H new ATOM 0 HD11 LEU A 953 -1.097 2.371 -5.614 1.00 0.00 H new ATOM 0 HD12 LEU A 953 -1.638 3.514 -4.361 1.00 0.00 H new ATOM 0 HD13 LEU A 953 -1.469 1.785 -3.975 1.00 0.00 H new ATOM 0 HD21 LEU A 953 -2.688 0.777 -6.618 1.00 0.00 H new ATOM 0 HD22 LEU A 953 -3.122 0.127 -5.020 1.00 0.00 H new ATOM 0 HD23 LEU A 953 -4.390 0.754 -6.099 1.00 0.00 H new ATOM 1026 N ASN A 954 -7.493 2.842 -2.779 1.00 0.00 N ATOM 1027 CA ASN A 954 -8.334 2.630 -1.606 1.00 0.00 C ATOM 1028 C ASN A 954 -9.027 1.272 -1.672 1.00 0.00 C ATOM 1029 O ASN A 954 -9.826 1.015 -2.572 1.00 0.00 O ATOM 1030 CB ASN A 954 -9.377 3.743 -1.493 1.00 0.00 C ATOM 1031 CG ASN A 954 -10.412 3.681 -2.599 1.00 0.00 C ATOM 1032 OD1 ASN A 954 -10.074 3.519 -3.772 1.00 0.00 O ATOM 1033 ND2 ASN A 954 -11.681 3.810 -2.230 1.00 0.00 N ATOM 0 H ASN A 954 -7.807 3.593 -3.393 1.00 0.00 H new ATOM 0 HA ASN A 954 -7.695 2.649 -0.723 1.00 0.00 H new ATOM 0 HB2 ASN A 954 -9.877 3.672 -0.527 1.00 0.00 H new ATOM 0 HB3 ASN A 954 -8.876 4.711 -1.522 1.00 0.00 H new ATOM 0 HD21 ASN A 954 -12.422 3.777 -2.930 1.00 0.00 H new ATOM 0 HD22 ASN A 954 -11.915 3.943 -1.246 1.00 0.00 H new ATOM 1040 N GLY A 955 -8.716 0.407 -0.711 1.00 0.00 N ATOM 1041 CA GLY A 955 -9.318 -0.913 -0.678 1.00 0.00 C ATOM 1042 C GLY A 955 -8.501 -1.942 -1.433 1.00 0.00 C ATOM 1043 O GLY A 955 -8.558 -3.134 -1.132 1.00 0.00 O ATOM 0 H GLY A 955 -8.058 0.597 0.045 1.00 0.00 H new ATOM 0 HA2 GLY A 955 -9.430 -1.232 0.358 1.00 0.00 H new ATOM 0 HA3 GLY A 955 -10.319 -0.863 -1.106 1.00 0.00 H new ATOM 1047 N LYS A 956 -7.739 -1.482 -2.420 1.00 0.00 N ATOM 1048 CA LYS A 956 -6.906 -2.370 -3.222 1.00 0.00 C ATOM 1049 C LYS A 956 -6.226 -3.417 -2.345 1.00 0.00 C ATOM 1050 O LYS A 956 -5.592 -3.085 -1.345 1.00 0.00 O ATOM 1051 CB LYS A 956 -5.851 -1.565 -3.983 1.00 0.00 C ATOM 1052 CG LYS A 956 -5.414 -2.213 -5.285 1.00 0.00 C ATOM 1053 CD LYS A 956 -4.231 -3.144 -5.076 1.00 0.00 C ATOM 1054 CE LYS A 956 -3.555 -3.491 -6.393 1.00 0.00 C ATOM 1055 NZ LYS A 956 -2.631 -2.413 -6.843 1.00 0.00 N ATOM 0 H LYS A 956 -7.681 -0.498 -2.684 1.00 0.00 H new ATOM 0 HA LYS A 956 -7.549 -2.882 -3.938 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -6.248 -0.572 -4.196 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -4.979 -1.429 -3.344 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -6.247 -2.772 -5.712 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -5.147 -1.440 -6.005 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -3.509 -2.673 -4.409 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -4.568 -4.058 -4.587 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -3.000 -4.422 -6.282 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -4.314 -3.661 -7.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -2.102 -2.735 -7.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -3.180 -1.564 -7.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -1.964 -2.185 -6.078 1.00 0.00 H new ATOM 1069 N GLU A 957 -6.363 -4.683 -2.729 1.00 0.00 N ATOM 1070 CA GLU A 957 -5.761 -5.778 -1.977 1.00 0.00 C ATOM 1071 C GLU A 957 -4.436 -6.203 -2.603 1.00 0.00 C ATOM 1072 O GLU A 957 -4.352 -6.433 -3.810 1.00 0.00 O ATOM 1073 CB GLU A 957 -6.716 -6.971 -1.917 1.00 0.00 C ATOM 1074 CG GLU A 957 -6.047 -8.266 -1.487 1.00 0.00 C ATOM 1075 CD GLU A 957 -7.008 -9.219 -0.803 1.00 0.00 C ATOM 1076 OE1 GLU A 957 -7.216 -9.075 0.420 1.00 0.00 O ATOM 1077 OE2 GLU A 957 -7.550 -10.110 -1.490 1.00 0.00 O ATOM 0 H GLU A 957 -6.885 -4.975 -3.555 1.00 0.00 H new ATOM 0 HA GLU A 957 -5.568 -5.426 -0.964 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -7.526 -6.743 -1.224 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -7.167 -7.114 -2.899 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -5.616 -8.755 -2.360 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -5.224 -8.038 -0.810 1.00 0.00 H new ATOM 1084 N LEU A 958 -3.403 -6.306 -1.774 1.00 0.00 N ATOM 1085 CA LEU A 958 -2.081 -6.704 -2.245 1.00 0.00 C ATOM 1086 C LEU A 958 -1.463 -7.746 -1.318 1.00 0.00 C ATOM 1087 O LEU A 958 -1.819 -7.835 -0.142 1.00 0.00 O ATOM 1088 CB LEU A 958 -1.164 -5.483 -2.342 1.00 0.00 C ATOM 1089 CG LEU A 958 0.092 -5.654 -3.197 1.00 0.00 C ATOM 1090 CD1 LEU A 958 -0.277 -5.803 -4.665 1.00 0.00 C ATOM 1091 CD2 LEU A 958 1.036 -4.476 -2.999 1.00 0.00 C ATOM 0 H LEU A 958 -3.455 -6.119 -0.773 1.00 0.00 H new ATOM 0 HA LEU A 958 -2.193 -7.147 -3.235 1.00 0.00 H new ATOM 0 HB2 LEU A 958 -1.742 -4.650 -2.743 1.00 0.00 H new ATOM 0 HB3 LEU A 958 -0.858 -5.202 -1.334 1.00 0.00 H new ATOM 0 HG LEU A 958 0.604 -6.562 -2.879 1.00 0.00 H new ATOM 0 HD11 LEU A 958 0.630 -5.924 -5.258 1.00 0.00 H new ATOM 0 HD12 LEU A 958 -0.913 -6.679 -4.793 1.00 0.00 H new ATOM 0 HD13 LEU A 958 -0.812 -4.914 -4.998 1.00 0.00 H new ATOM 0 HD21 LEU A 958 1.925 -4.614 -3.615 1.00 0.00 H new ATOM 0 HD22 LEU A 958 0.533 -3.554 -3.290 1.00 0.00 H new ATOM 0 HD23 LEU A 958 1.327 -4.415 -1.950 1.00 0.00 H new ATOM 1103 N LEU A 959 -0.535 -8.531 -1.854 1.00 0.00 N ATOM 1104 CA LEU A 959 0.135 -9.566 -1.074 1.00 0.00 C ATOM 1105 C LEU A 959 -0.843 -10.253 -0.127 1.00 0.00 C ATOM 1106 O LEU A 959 -0.544 -10.458 1.049 1.00 0.00 O ATOM 1107 CB LEU A 959 1.294 -8.963 -0.279 1.00 0.00 C ATOM 1108 CG LEU A 959 2.540 -8.592 -1.084 1.00 0.00 C ATOM 1109 CD1 LEU A 959 3.434 -7.658 -0.285 1.00 0.00 C ATOM 1110 CD2 LEU A 959 3.303 -9.844 -1.492 1.00 0.00 C ATOM 0 H LEU A 959 -0.229 -8.471 -2.825 1.00 0.00 H new ATOM 0 HA LEU A 959 0.526 -10.312 -1.766 1.00 0.00 H new ATOM 0 HB2 LEU A 959 0.934 -8.068 0.228 1.00 0.00 H new ATOM 0 HB3 LEU A 959 1.585 -9.673 0.496 1.00 0.00 H new ATOM 0 HG LEU A 959 2.223 -8.072 -1.988 1.00 0.00 H new ATOM 0 HD11 LEU A 959 4.315 -7.405 -0.874 1.00 0.00 H new ATOM 0 HD12 LEU A 959 2.886 -6.747 -0.044 1.00 0.00 H new ATOM 0 HD13 LEU A 959 3.743 -8.150 0.637 1.00 0.00 H new ATOM 0 HD21 LEU A 959 4.187 -9.561 -2.064 1.00 0.00 H new ATOM 0 HD22 LEU A 959 3.608 -10.391 -0.600 1.00 0.00 H new ATOM 0 HD23 LEU A 959 2.662 -10.478 -2.105 1.00 0.00 H new ATOM 1122 N ASN A 960 -2.013 -10.608 -0.648 1.00 0.00 N ATOM 1123 CA ASN A 960 -3.035 -11.275 0.151 1.00 0.00 C ATOM 1124 C ASN A 960 -3.314 -10.498 1.434 1.00 0.00 C ATOM 1125 O ASN A 960 -3.402 -11.079 2.516 1.00 0.00 O ATOM 1126 CB ASN A 960 -2.598 -12.701 0.489 1.00 0.00 C ATOM 1127 CG ASN A 960 -2.063 -13.444 -0.719 1.00 0.00 C ATOM 1128 OD1 ASN A 960 -2.824 -14.031 -1.489 1.00 0.00 O ATOM 1129 ND2 ASN A 960 -0.746 -13.422 -0.892 1.00 0.00 N ATOM 0 H ASN A 960 -2.277 -10.445 -1.620 1.00 0.00 H new ATOM 0 HA ASN A 960 -3.953 -11.314 -0.436 1.00 0.00 H new ATOM 0 HB2 ASN A 960 -1.830 -12.669 1.262 1.00 0.00 H new ATOM 0 HB3 ASN A 960 -3.444 -13.249 0.903 1.00 0.00 H new ATOM 0 HD21 ASN A 960 -0.328 -13.904 -1.688 1.00 0.00 H new ATOM 0 HD22 ASN A 960 -0.153 -12.923 -0.229 1.00 0.00 H new ATOM 1136 N ARG A 961 -3.453 -9.183 1.305 1.00 0.00 N ATOM 1137 CA ARG A 961 -3.722 -8.326 2.453 1.00 0.00 C ATOM 1138 C ARG A 961 -4.499 -7.082 2.034 1.00 0.00 C ATOM 1139 O ARG A 961 -3.943 -6.163 1.431 1.00 0.00 O ATOM 1140 CB ARG A 961 -2.412 -7.919 3.130 1.00 0.00 C ATOM 1141 CG ARG A 961 -1.953 -8.892 4.204 1.00 0.00 C ATOM 1142 CD ARG A 961 -0.582 -8.518 4.745 1.00 0.00 C ATOM 1143 NE ARG A 961 -0.279 -9.209 5.995 1.00 0.00 N ATOM 1144 CZ ARG A 961 0.184 -10.452 6.055 1.00 0.00 C ATOM 1145 NH1 ARG A 961 0.398 -11.137 4.940 1.00 0.00 N ATOM 1146 NH2 ARG A 961 0.435 -11.012 7.231 1.00 0.00 N ATOM 0 H ARG A 961 -3.384 -8.687 0.416 1.00 0.00 H new ATOM 0 HA ARG A 961 -4.329 -8.890 3.161 1.00 0.00 H new ATOM 0 HB2 ARG A 961 -1.633 -7.833 2.373 1.00 0.00 H new ATOM 0 HB3 ARG A 961 -2.534 -6.931 3.575 1.00 0.00 H new ATOM 0 HG2 ARG A 961 -2.676 -8.904 5.019 1.00 0.00 H new ATOM 0 HG3 ARG A 961 -1.920 -9.901 3.793 1.00 0.00 H new ATOM 0 HD2 ARG A 961 0.179 -8.761 4.003 1.00 0.00 H new ATOM 0 HD3 ARG A 961 -0.538 -7.441 4.906 1.00 0.00 H new ATOM 0 HE ARG A 961 -0.431 -8.709 6.871 1.00 0.00 H new ATOM 0 HH11 ARG A 961 0.207 -10.709 4.034 1.00 0.00 H new ATOM 0 HH12 ARG A 961 0.754 -12.092 4.988 1.00 0.00 H new ATOM 0 HH21 ARG A 961 0.272 -10.488 8.091 1.00 0.00 H new ATOM 0 HH22 ARG A 961 0.791 -11.967 7.276 1.00 0.00 H new ATOM 1160 N THR A 962 -5.788 -7.059 2.357 1.00 0.00 N ATOM 1161 CA THR A 962 -6.642 -5.929 2.012 1.00 0.00 C ATOM 1162 C THR A 962 -6.102 -4.631 2.602 1.00 0.00 C ATOM 1163 O THR A 962 -6.009 -4.484 3.821 1.00 0.00 O ATOM 1164 CB THR A 962 -8.085 -6.143 2.509 1.00 0.00 C ATOM 1165 OG1 THR A 962 -8.549 -7.440 2.119 1.00 0.00 O ATOM 1166 CG2 THR A 962 -9.014 -5.077 1.949 1.00 0.00 C ATOM 0 H THR A 962 -6.264 -7.810 2.857 1.00 0.00 H new ATOM 0 HA THR A 962 -6.646 -5.857 0.924 1.00 0.00 H new ATOM 0 HB THR A 962 -8.087 -6.068 3.596 1.00 0.00 H new ATOM 0 HG1 THR A 962 -7.986 -7.785 1.395 1.00 0.00 H new ATOM 0 HG21 THR A 962 -10.027 -5.249 2.314 1.00 0.00 H new ATOM 0 HG22 THR A 962 -8.674 -4.093 2.271 1.00 0.00 H new ATOM 0 HG23 THR A 962 -9.008 -5.124 0.860 1.00 0.00 H new ATOM 1174 N ILE A 963 -5.747 -3.694 1.730 1.00 0.00 N ATOM 1175 CA ILE A 963 -5.217 -2.408 2.165 1.00 0.00 C ATOM 1176 C ILE A 963 -6.286 -1.322 2.101 1.00 0.00 C ATOM 1177 O ILE A 963 -7.070 -1.263 1.153 1.00 0.00 O ATOM 1178 CB ILE A 963 -4.011 -1.976 1.309 1.00 0.00 C ATOM 1179 CG1 ILE A 963 -2.864 -2.976 1.465 1.00 0.00 C ATOM 1180 CG2 ILE A 963 -3.559 -0.577 1.698 1.00 0.00 C ATOM 1181 CD1 ILE A 963 -1.732 -2.755 0.486 1.00 0.00 C ATOM 0 H ILE A 963 -5.817 -3.801 0.718 1.00 0.00 H new ATOM 0 HA ILE A 963 -4.892 -2.535 3.198 1.00 0.00 H new ATOM 0 HB ILE A 963 -4.314 -1.960 0.262 1.00 0.00 H new ATOM 0 HG12 ILE A 963 -2.473 -2.912 2.480 1.00 0.00 H new ATOM 0 HG13 ILE A 963 -3.253 -3.986 1.336 1.00 0.00 H new ATOM 0 HG21 ILE A 963 -2.706 -0.286 1.084 1.00 0.00 H new ATOM 0 HG22 ILE A 963 -4.376 0.127 1.540 1.00 0.00 H new ATOM 0 HG23 ILE A 963 -3.270 -0.567 2.749 1.00 0.00 H new ATOM 0 HD11 ILE A 963 -0.954 -3.500 0.655 1.00 0.00 H new ATOM 0 HD12 ILE A 963 -2.109 -2.848 -0.533 1.00 0.00 H new ATOM 0 HD13 ILE A 963 -1.316 -1.758 0.630 1.00 0.00 H new ATOM 1193 N THR A 964 -6.311 -0.463 3.115 1.00 0.00 N ATOM 1194 CA THR A 964 -7.283 0.621 3.174 1.00 0.00 C ATOM 1195 C THR A 964 -6.592 1.974 3.303 1.00 0.00 C ATOM 1196 O THR A 964 -5.919 2.245 4.298 1.00 0.00 O ATOM 1197 CB THR A 964 -8.256 0.441 4.355 1.00 0.00 C ATOM 1198 OG1 THR A 964 -8.654 -0.931 4.456 1.00 0.00 O ATOM 1199 CG2 THR A 964 -9.485 1.320 4.183 1.00 0.00 C ATOM 0 H THR A 964 -5.669 -0.497 3.907 1.00 0.00 H new ATOM 0 HA THR A 964 -7.846 0.590 2.241 1.00 0.00 H new ATOM 0 HB THR A 964 -7.742 0.738 5.269 1.00 0.00 H new ATOM 0 HG1 THR A 964 -9.271 -1.038 5.210 1.00 0.00 H new ATOM 0 HG21 THR A 964 -10.157 1.175 5.029 1.00 0.00 H new ATOM 0 HG22 THR A 964 -9.181 2.366 4.136 1.00 0.00 H new ATOM 0 HG23 THR A 964 -9.999 1.050 3.261 1.00 0.00 H new ATOM 1207 N ILE A 965 -6.762 2.818 2.291 1.00 0.00 N ATOM 1208 CA ILE A 965 -6.155 4.144 2.293 1.00 0.00 C ATOM 1209 C ILE A 965 -7.172 5.214 2.672 1.00 0.00 C ATOM 1210 O ILE A 965 -8.327 5.165 2.248 1.00 0.00 O ATOM 1211 CB ILE A 965 -5.551 4.488 0.919 1.00 0.00 C ATOM 1212 CG1 ILE A 965 -4.592 3.385 0.467 1.00 0.00 C ATOM 1213 CG2 ILE A 965 -4.835 5.829 0.976 1.00 0.00 C ATOM 1214 CD1 ILE A 965 -4.039 3.597 -0.924 1.00 0.00 C ATOM 0 H ILE A 965 -7.314 2.608 1.460 1.00 0.00 H new ATOM 0 HA ILE A 965 -5.358 4.125 3.037 1.00 0.00 H new ATOM 0 HB ILE A 965 -6.360 4.560 0.192 1.00 0.00 H new ATOM 0 HG12 ILE A 965 -3.764 3.323 1.173 1.00 0.00 H new ATOM 0 HG13 ILE A 965 -5.111 2.427 0.501 1.00 0.00 H new ATOM 0 HG21 ILE A 965 -4.413 6.058 -0.003 1.00 0.00 H new ATOM 0 HG22 ILE A 965 -5.543 6.608 1.257 1.00 0.00 H new ATOM 0 HG23 ILE A 965 -4.034 5.783 1.714 1.00 0.00 H new ATOM 0 HD11 ILE A 965 -3.367 2.777 -1.177 1.00 0.00 H new ATOM 0 HD12 ILE A 965 -4.860 3.629 -1.641 1.00 0.00 H new ATOM 0 HD13 ILE A 965 -3.491 4.539 -0.958 1.00 0.00 H new ATOM 1226 N ALA A 966 -6.736 6.182 3.471 1.00 0.00 N ATOM 1227 CA ALA A 966 -7.607 7.267 3.904 1.00 0.00 C ATOM 1228 C ALA A 966 -6.807 8.533 4.192 1.00 0.00 C ATOM 1229 O ALA A 966 -5.796 8.494 4.895 1.00 0.00 O ATOM 1230 CB ALA A 966 -8.398 6.849 5.135 1.00 0.00 C ATOM 0 H ALA A 966 -5.784 6.237 3.832 1.00 0.00 H new ATOM 0 HA ALA A 966 -8.303 7.486 3.094 1.00 0.00 H new ATOM 0 HB1 ALA A 966 -9.045 7.669 5.448 1.00 0.00 H new ATOM 0 HB2 ALA A 966 -9.007 5.977 4.897 1.00 0.00 H new ATOM 0 HB3 ALA A 966 -7.710 6.601 5.943 1.00 0.00 H new ATOM 1236 N LEU A 967 -7.264 9.653 3.644 1.00 0.00 N ATOM 1237 CA LEU A 967 -6.590 10.932 3.842 1.00 0.00 C ATOM 1238 C LEU A 967 -6.636 11.351 5.307 1.00 0.00 C ATOM 1239 O LEU A 967 -7.495 10.902 6.066 1.00 0.00 O ATOM 1240 CB LEU A 967 -7.234 12.011 2.970 1.00 0.00 C ATOM 1241 CG LEU A 967 -6.824 12.017 1.497 1.00 0.00 C ATOM 1242 CD1 LEU A 967 -7.658 13.020 0.715 1.00 0.00 C ATOM 1243 CD2 LEU A 967 -5.341 12.331 1.358 1.00 0.00 C ATOM 0 H LEU A 967 -8.098 9.702 3.059 1.00 0.00 H new ATOM 0 HA LEU A 967 -5.546 10.813 3.550 1.00 0.00 H new ATOM 0 HB2 LEU A 967 -8.317 11.896 3.025 1.00 0.00 H new ATOM 0 HB3 LEU A 967 -6.995 12.985 3.397 1.00 0.00 H new ATOM 0 HG LEU A 967 -7.006 11.024 1.085 1.00 0.00 H new ATOM 0 HD11 LEU A 967 -7.352 13.010 -0.331 1.00 0.00 H new ATOM 0 HD12 LEU A 967 -8.712 12.752 0.787 1.00 0.00 H new ATOM 0 HD13 LEU A 967 -7.508 14.018 1.128 1.00 0.00 H new ATOM 0 HD21 LEU A 967 -5.066 12.331 0.303 1.00 0.00 H new ATOM 0 HD22 LEU A 967 -5.135 13.312 1.787 1.00 0.00 H new ATOM 0 HD23 LEU A 967 -4.758 11.575 1.884 1.00 0.00 H new ATOM 1255 N LYS A 968 -5.708 12.217 5.699 1.00 0.00 N ATOM 1256 CA LYS A 968 -5.643 12.701 7.073 1.00 0.00 C ATOM 1257 C LYS A 968 -6.602 13.869 7.284 1.00 0.00 C ATOM 1258 O LYS A 968 -7.613 13.738 7.974 1.00 0.00 O ATOM 1259 CB LYS A 968 -4.216 13.131 7.418 1.00 0.00 C ATOM 1260 CG LYS A 968 -4.037 13.539 8.870 1.00 0.00 C ATOM 1261 CD LYS A 968 -4.178 12.349 9.805 1.00 0.00 C ATOM 1262 CE LYS A 968 -4.188 12.784 11.262 1.00 0.00 C ATOM 1263 NZ LYS A 968 -2.874 13.343 11.684 1.00 0.00 N ATOM 0 H LYS A 968 -4.990 12.599 5.084 1.00 0.00 H new ATOM 0 HA LYS A 968 -5.939 11.886 7.733 1.00 0.00 H new ATOM 0 HB2 LYS A 968 -3.534 12.311 7.193 1.00 0.00 H new ATOM 0 HB3 LYS A 968 -3.932 13.966 6.777 1.00 0.00 H new ATOM 0 HG2 LYS A 968 -3.055 13.993 9.003 1.00 0.00 H new ATOM 0 HG3 LYS A 968 -4.776 14.297 9.130 1.00 0.00 H new ATOM 0 HD2 LYS A 968 -5.100 11.813 9.578 1.00 0.00 H new ATOM 0 HD3 LYS A 968 -3.356 11.654 9.637 1.00 0.00 H new ATOM 0 HE2 LYS A 968 -4.966 13.533 11.412 1.00 0.00 H new ATOM 0 HE3 LYS A 968 -4.440 11.932 11.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 968 -2.933 13.659 12.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 968 -2.141 12.610 11.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 968 -2.629 14.151 11.077 1.00 0.00 H new