USER MOD reduce.3.24.130724 H: found=0, std=0, add=541, rem=0, adj=13 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 29:sc= 0.0211 USER MOD Single : A 898 SER OG : rot 180:sc= -0.137 USER MOD Single : A 919 GLN : amide:sc= -0.699 X(o=-0.7,f=-0.7) USER MOD Single : A 920 GLN : amide:sc= -1.15 K(o=-1.1,f=-3!) USER MOD Single : A 923 SER OG : rot 180:sc= 0 USER MOD Single : A 936 LYS NZ :NH3+ -149:sc=-0.00378 (180deg=-0.714) USER MOD Single : A 937 MET CE :methyl 148:sc=-0.00127 (180deg=-0.288) USER MOD Single : A 940 THR OG1 : rot -160:sc= 0 USER MOD Single : A 945 SER OG : rot 180:sc= 0 USER MOD Single : A 946 SER OG : rot -178:sc= -0.313 USER MOD Single : A 949 ASN : amide:sc= -0.149 K(o=-0.15,f=-2.3!) USER MOD Single : A 952 SER OG : rot 79:sc= 0.0133 USER MOD Single : A 954 ASN : amide:sc= -0.109 X(o=-0.11,f=0) USER MOD Single : A 956 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0347) USER MOD Single : A 960 ASN : amide:sc= -0.181 X(o=-0.18,f=0) USER MOD Single : A 962 THR OG1 : rot -27:sc= 0.499 USER MOD Single : A 964 THR OG1 : rot 180:sc= 0 USER MOD Single : A 968 LYS NZ :NH3+ -160:sc= 0.403 (180deg=0.22) USER MOD ----------------------------------------------------------------- ATOM 73 N THR A 894 0.196 13.817 3.693 1.00 0.00 N ATOM 74 CA THR A 894 0.236 12.638 4.549 1.00 0.00 C ATOM 75 C THR A 894 -1.024 11.796 4.385 1.00 0.00 C ATOM 76 O THR A 894 -2.133 12.264 4.643 1.00 0.00 O ATOM 77 CB THR A 894 0.392 13.025 6.031 1.00 0.00 C ATOM 78 OG1 THR A 894 1.643 13.692 6.235 1.00 0.00 O ATOM 79 CG2 THR A 894 0.317 11.794 6.923 1.00 0.00 C ATOM 0 HA THR A 894 1.103 12.053 4.241 1.00 0.00 H new ATOM 0 HB THR A 894 -0.425 13.697 6.296 1.00 0.00 H new ATOM 0 HG1 THR A 894 1.900 14.162 5.415 1.00 0.00 H new ATOM 0 HG21 THR A 894 0.430 12.092 7.965 1.00 0.00 H new ATOM 0 HG22 THR A 894 -0.648 11.305 6.788 1.00 0.00 H new ATOM 0 HG23 THR A 894 1.115 11.102 6.655 1.00 0.00 H new ATOM 87 N VAL A 895 -0.847 10.551 3.954 1.00 0.00 N ATOM 88 CA VAL A 895 -1.970 9.643 3.757 1.00 0.00 C ATOM 89 C VAL A 895 -1.872 8.437 4.685 1.00 0.00 C ATOM 90 O VAL A 895 -0.780 7.928 4.945 1.00 0.00 O ATOM 91 CB VAL A 895 -2.045 9.150 2.299 1.00 0.00 C ATOM 92 CG1 VAL A 895 -2.056 10.328 1.337 1.00 0.00 C ATOM 93 CG2 VAL A 895 -0.887 8.213 1.994 1.00 0.00 C ATOM 0 H VAL A 895 0.064 10.148 3.735 1.00 0.00 H new ATOM 0 HA VAL A 895 -2.875 10.204 3.990 1.00 0.00 H new ATOM 0 HB VAL A 895 -2.975 8.596 2.168 1.00 0.00 H new ATOM 0 HG11 VAL A 895 -2.109 9.960 0.312 1.00 0.00 H new ATOM 0 HG12 VAL A 895 -2.922 10.957 1.542 1.00 0.00 H new ATOM 0 HG13 VAL A 895 -1.145 10.912 1.466 1.00 0.00 H new ATOM 0 HG21 VAL A 895 -0.956 7.874 0.960 1.00 0.00 H new ATOM 0 HG22 VAL A 895 0.056 8.740 2.142 1.00 0.00 H new ATOM 0 HG23 VAL A 895 -0.930 7.352 2.661 1.00 0.00 H new ATOM 103 N LEU A 896 -3.017 7.985 5.181 1.00 0.00 N ATOM 104 CA LEU A 896 -3.061 6.837 6.081 1.00 0.00 C ATOM 105 C LEU A 896 -3.261 5.541 5.301 1.00 0.00 C ATOM 106 O LEU A 896 -3.990 5.507 4.309 1.00 0.00 O ATOM 107 CB LEU A 896 -4.185 7.009 7.104 1.00 0.00 C ATOM 108 CG LEU A 896 -3.875 7.917 8.295 1.00 0.00 C ATOM 109 CD1 LEU A 896 -3.172 9.183 7.832 1.00 0.00 C ATOM 110 CD2 LEU A 896 -5.151 8.258 9.051 1.00 0.00 C ATOM 0 H LEU A 896 -3.928 8.395 4.976 1.00 0.00 H new ATOM 0 HA LEU A 896 -2.107 6.780 6.605 1.00 0.00 H new ATOM 0 HB2 LEU A 896 -5.060 7.405 6.589 1.00 0.00 H new ATOM 0 HB3 LEU A 896 -4.457 6.024 7.484 1.00 0.00 H new ATOM 0 HG LEU A 896 -3.208 7.383 8.971 1.00 0.00 H new ATOM 0 HD11 LEU A 896 -2.959 9.817 8.693 1.00 0.00 H new ATOM 0 HD12 LEU A 896 -2.238 8.920 7.336 1.00 0.00 H new ATOM 0 HD13 LEU A 896 -3.814 9.721 7.135 1.00 0.00 H new ATOM 0 HD21 LEU A 896 -4.912 8.905 9.895 1.00 0.00 H new ATOM 0 HD22 LEU A 896 -5.843 8.773 8.384 1.00 0.00 H new ATOM 0 HD23 LEU A 896 -5.614 7.341 9.416 1.00 0.00 H new ATOM 122 N VAL A 897 -2.612 4.475 5.758 1.00 0.00 N ATOM 123 CA VAL A 897 -2.721 3.176 5.106 1.00 0.00 C ATOM 124 C VAL A 897 -2.741 2.047 6.130 1.00 0.00 C ATOM 125 O VAL A 897 -1.865 1.960 6.991 1.00 0.00 O ATOM 126 CB VAL A 897 -1.558 2.942 4.123 1.00 0.00 C ATOM 127 CG1 VAL A 897 -1.614 1.532 3.556 1.00 0.00 C ATOM 128 CG2 VAL A 897 -1.588 3.976 3.007 1.00 0.00 C ATOM 0 H VAL A 897 -2.005 4.486 6.578 1.00 0.00 H new ATOM 0 HA VAL A 897 -3.660 3.177 4.553 1.00 0.00 H new ATOM 0 HB VAL A 897 -0.619 3.053 4.665 1.00 0.00 H new ATOM 0 HG11 VAL A 897 -0.785 1.385 2.864 1.00 0.00 H new ATOM 0 HG12 VAL A 897 -1.540 0.810 4.369 1.00 0.00 H new ATOM 0 HG13 VAL A 897 -2.557 1.389 3.028 1.00 0.00 H new ATOM 0 HG21 VAL A 897 -0.760 3.796 2.322 1.00 0.00 H new ATOM 0 HG22 VAL A 897 -2.531 3.899 2.465 1.00 0.00 H new ATOM 0 HG23 VAL A 897 -1.495 4.975 3.434 1.00 0.00 H new ATOM 138 N SER A 898 -3.747 1.183 6.032 1.00 0.00 N ATOM 139 CA SER A 898 -3.883 0.060 6.952 1.00 0.00 C ATOM 140 C SER A 898 -4.087 -1.245 6.189 1.00 0.00 C ATOM 141 O SER A 898 -4.515 -1.242 5.035 1.00 0.00 O ATOM 142 CB SER A 898 -5.056 0.295 7.906 1.00 0.00 C ATOM 143 OG SER A 898 -5.439 -0.908 8.549 1.00 0.00 O ATOM 0 H SER A 898 -4.480 1.240 5.325 1.00 0.00 H new ATOM 0 HA SER A 898 -2.963 -0.018 7.531 1.00 0.00 H new ATOM 0 HB2 SER A 898 -4.778 1.038 8.653 1.00 0.00 H new ATOM 0 HB3 SER A 898 -5.903 0.701 7.353 1.00 0.00 H new ATOM 0 HG SER A 898 -6.189 -0.731 9.154 1.00 0.00 H new ATOM 149 N ILE A 899 -3.778 -2.360 6.843 1.00 0.00 N ATOM 150 CA ILE A 899 -3.928 -3.672 6.228 1.00 0.00 C ATOM 151 C ILE A 899 -4.869 -4.555 7.040 1.00 0.00 C ATOM 152 O ILE A 899 -5.159 -4.269 8.202 1.00 0.00 O ATOM 153 CB ILE A 899 -2.570 -4.385 6.085 1.00 0.00 C ATOM 154 CG1 ILE A 899 -1.749 -4.229 7.366 1.00 0.00 C ATOM 155 CG2 ILE A 899 -1.806 -3.834 4.890 1.00 0.00 C ATOM 156 CD1 ILE A 899 -0.815 -5.390 7.630 1.00 0.00 C ATOM 0 H ILE A 899 -3.422 -2.380 7.799 1.00 0.00 H new ATOM 0 HA ILE A 899 -4.351 -3.509 5.236 1.00 0.00 H new ATOM 0 HB ILE A 899 -2.750 -5.447 5.919 1.00 0.00 H new ATOM 0 HG12 ILE A 899 -1.165 -3.310 7.304 1.00 0.00 H new ATOM 0 HG13 ILE A 899 -2.428 -4.119 8.212 1.00 0.00 H new ATOM 0 HG21 ILE A 899 -0.849 -4.348 4.802 1.00 0.00 H new ATOM 0 HG22 ILE A 899 -2.388 -3.992 3.982 1.00 0.00 H new ATOM 0 HG23 ILE A 899 -1.634 -2.767 5.029 1.00 0.00 H new ATOM 0 HD11 ILE A 899 -0.265 -5.212 8.554 1.00 0.00 H new ATOM 0 HD12 ILE A 899 -1.394 -6.309 7.724 1.00 0.00 H new ATOM 0 HD13 ILE A 899 -0.112 -5.487 6.802 1.00 0.00 H new ATOM 308 N PHE A 909 3.587 -4.035 9.134 1.00 0.00 N ATOM 309 CA PHE A 909 3.927 -4.031 7.716 1.00 0.00 C ATOM 310 C PHE A 909 5.314 -4.624 7.488 1.00 0.00 C ATOM 311 O PHE A 909 6.310 -4.118 8.004 1.00 0.00 O ATOM 312 CB PHE A 909 3.871 -2.606 7.161 1.00 0.00 C ATOM 313 CG PHE A 909 2.503 -1.991 7.223 1.00 0.00 C ATOM 314 CD1 PHE A 909 2.073 -1.341 8.369 1.00 0.00 C ATOM 315 CD2 PHE A 909 1.645 -2.064 6.137 1.00 0.00 C ATOM 316 CE1 PHE A 909 0.814 -0.773 8.430 1.00 0.00 C ATOM 317 CE2 PHE A 909 0.386 -1.498 6.192 1.00 0.00 C ATOM 318 CZ PHE A 909 -0.031 -0.853 7.340 1.00 0.00 C ATOM 0 HA PHE A 909 3.197 -4.647 7.191 1.00 0.00 H new ATOM 0 HB2 PHE A 909 4.567 -1.980 7.719 1.00 0.00 H new ATOM 0 HB3 PHE A 909 4.210 -2.615 6.125 1.00 0.00 H new ATOM 0 HD1 PHE A 909 2.729 -1.277 9.224 1.00 0.00 H new ATOM 0 HD2 PHE A 909 1.964 -2.569 5.237 1.00 0.00 H new ATOM 0 HE1 PHE A 909 0.492 -0.268 9.328 1.00 0.00 H new ATOM 0 HE2 PHE A 909 -0.272 -1.560 5.338 1.00 0.00 H new ATOM 0 HZ PHE A 909 -1.016 -0.412 7.385 1.00 0.00 H new ATOM 328 N ASP A 910 5.370 -5.701 6.711 1.00 0.00 N ATOM 329 CA ASP A 910 6.634 -6.364 6.413 1.00 0.00 C ATOM 330 C ASP A 910 7.332 -5.698 5.232 1.00 0.00 C ATOM 331 O ASP A 910 6.701 -4.994 4.442 1.00 0.00 O ATOM 332 CB ASP A 910 6.399 -7.845 6.114 1.00 0.00 C ATOM 333 CG ASP A 910 5.596 -8.535 7.199 1.00 0.00 C ATOM 334 OD1 ASP A 910 6.203 -8.978 8.197 1.00 0.00 O ATOM 335 OD2 ASP A 910 4.360 -8.631 7.052 1.00 0.00 O ATOM 0 H ASP A 910 4.555 -6.133 6.276 1.00 0.00 H new ATOM 0 HA ASP A 910 7.278 -6.276 7.288 1.00 0.00 H new ATOM 0 HB2 ASP A 910 5.877 -7.942 5.162 1.00 0.00 H new ATOM 0 HB3 ASP A 910 7.360 -8.347 6.003 1.00 0.00 H new ATOM 340 N ASP A 911 8.636 -5.923 5.118 1.00 0.00 N ATOM 341 CA ASP A 911 9.420 -5.345 4.032 1.00 0.00 C ATOM 342 C ASP A 911 8.701 -5.508 2.697 1.00 0.00 C ATOM 343 O ASP A 911 8.700 -4.600 1.866 1.00 0.00 O ATOM 344 CB ASP A 911 10.800 -6.000 3.967 1.00 0.00 C ATOM 345 CG ASP A 911 10.727 -7.471 3.605 1.00 0.00 C ATOM 346 OD1 ASP A 911 9.814 -8.161 4.106 1.00 0.00 O ATOM 347 OD2 ASP A 911 11.581 -7.931 2.819 1.00 0.00 O ATOM 0 H ASP A 911 9.173 -6.501 5.764 1.00 0.00 H new ATOM 0 HA ASP A 911 9.542 -4.280 4.230 1.00 0.00 H new ATOM 0 HB2 ASP A 911 11.412 -5.478 3.232 1.00 0.00 H new ATOM 0 HB3 ASP A 911 11.297 -5.890 4.931 1.00 0.00 H new ATOM 352 N ALA A 912 8.092 -6.672 2.496 1.00 0.00 N ATOM 353 CA ALA A 912 7.370 -6.954 1.262 1.00 0.00 C ATOM 354 C ALA A 912 6.155 -6.045 1.117 1.00 0.00 C ATOM 355 O ALA A 912 5.954 -5.420 0.075 1.00 0.00 O ATOM 356 CB ALA A 912 6.946 -8.415 1.220 1.00 0.00 C ATOM 0 H ALA A 912 8.084 -7.435 3.173 1.00 0.00 H new ATOM 0 HA ALA A 912 8.040 -6.757 0.425 1.00 0.00 H new ATOM 0 HB1 ALA A 912 6.408 -8.611 0.293 1.00 0.00 H new ATOM 0 HB2 ALA A 912 7.829 -9.052 1.268 1.00 0.00 H new ATOM 0 HB3 ALA A 912 6.297 -8.630 2.069 1.00 0.00 H new ATOM 362 N LEU A 913 5.346 -5.974 2.169 1.00 0.00 N ATOM 363 CA LEU A 913 4.149 -5.141 2.159 1.00 0.00 C ATOM 364 C LEU A 913 4.499 -3.688 1.851 1.00 0.00 C ATOM 365 O LEU A 913 3.845 -3.042 1.033 1.00 0.00 O ATOM 366 CB LEU A 913 3.430 -5.230 3.506 1.00 0.00 C ATOM 367 CG LEU A 913 2.617 -6.501 3.750 1.00 0.00 C ATOM 368 CD1 LEU A 913 2.345 -6.684 5.235 1.00 0.00 C ATOM 369 CD2 LEU A 913 1.311 -6.458 2.969 1.00 0.00 C ATOM 0 H LEU A 913 5.498 -6.483 3.040 1.00 0.00 H new ATOM 0 HA LEU A 913 3.487 -5.510 1.376 1.00 0.00 H new ATOM 0 HB2 LEU A 913 4.173 -5.140 4.298 1.00 0.00 H new ATOM 0 HB3 LEU A 913 2.763 -4.373 3.596 1.00 0.00 H new ATOM 0 HG LEU A 913 3.199 -7.354 3.400 1.00 0.00 H new ATOM 0 HD11 LEU A 913 1.765 -7.594 5.389 1.00 0.00 H new ATOM 0 HD12 LEU A 913 3.291 -6.761 5.771 1.00 0.00 H new ATOM 0 HD13 LEU A 913 1.784 -5.828 5.610 1.00 0.00 H new ATOM 0 HD21 LEU A 913 0.746 -7.371 3.155 1.00 0.00 H new ATOM 0 HD22 LEU A 913 0.724 -5.597 3.288 1.00 0.00 H new ATOM 0 HD23 LEU A 913 1.527 -6.376 1.904 1.00 0.00 H new ATOM 381 N ILE A 914 5.536 -3.183 2.511 1.00 0.00 N ATOM 382 CA ILE A 914 5.975 -1.808 2.305 1.00 0.00 C ATOM 383 C ILE A 914 6.593 -1.629 0.923 1.00 0.00 C ATOM 384 O ILE A 914 6.116 -0.831 0.116 1.00 0.00 O ATOM 385 CB ILE A 914 6.998 -1.378 3.373 1.00 0.00 C ATOM 386 CG1 ILE A 914 6.424 -1.588 4.775 1.00 0.00 C ATOM 387 CG2 ILE A 914 7.397 0.076 3.169 1.00 0.00 C ATOM 388 CD1 ILE A 914 7.479 -1.654 5.857 1.00 0.00 C ATOM 0 H ILE A 914 6.087 -3.705 3.192 1.00 0.00 H new ATOM 0 HA ILE A 914 5.089 -1.178 2.388 1.00 0.00 H new ATOM 0 HB ILE A 914 7.890 -1.996 3.271 1.00 0.00 H new ATOM 0 HG12 ILE A 914 5.734 -0.776 5.001 1.00 0.00 H new ATOM 0 HG13 ILE A 914 5.845 -2.511 4.787 1.00 0.00 H new ATOM 0 HG21 ILE A 914 8.120 0.365 3.931 1.00 0.00 H new ATOM 0 HG22 ILE A 914 7.843 0.196 2.182 1.00 0.00 H new ATOM 0 HG23 ILE A 914 6.514 0.710 3.248 1.00 0.00 H new ATOM 0 HD11 ILE A 914 6.999 -1.804 6.824 1.00 0.00 H new ATOM 0 HD12 ILE A 914 8.156 -2.484 5.655 1.00 0.00 H new ATOM 0 HD13 ILE A 914 8.043 -0.721 5.873 1.00 0.00 H new ATOM 400 N ASP A 915 7.657 -2.379 0.656 1.00 0.00 N ATOM 401 CA ASP A 915 8.340 -2.306 -0.631 1.00 0.00 C ATOM 402 C ASP A 915 7.343 -2.401 -1.781 1.00 0.00 C ATOM 403 O ASP A 915 7.350 -1.573 -2.691 1.00 0.00 O ATOM 404 CB ASP A 915 9.379 -3.423 -0.745 1.00 0.00 C ATOM 405 CG ASP A 915 10.358 -3.189 -1.879 1.00 0.00 C ATOM 406 OD1 ASP A 915 10.696 -2.015 -2.139 1.00 0.00 O ATOM 407 OD2 ASP A 915 10.786 -4.180 -2.505 1.00 0.00 O ATOM 0 H ASP A 915 8.065 -3.044 1.313 1.00 0.00 H new ATOM 0 HA ASP A 915 8.846 -1.343 -0.692 1.00 0.00 H new ATOM 0 HB2 ASP A 915 9.927 -3.503 0.194 1.00 0.00 H new ATOM 0 HB3 ASP A 915 8.870 -4.375 -0.899 1.00 0.00 H new ATOM 412 N GLU A 916 6.488 -3.418 -1.734 1.00 0.00 N ATOM 413 CA GLU A 916 5.487 -3.623 -2.774 1.00 0.00 C ATOM 414 C GLU A 916 4.601 -2.390 -2.926 1.00 0.00 C ATOM 415 O GLU A 916 4.259 -1.990 -4.040 1.00 0.00 O ATOM 416 CB GLU A 916 4.627 -4.846 -2.452 1.00 0.00 C ATOM 417 CG GLU A 916 5.290 -6.167 -2.804 1.00 0.00 C ATOM 418 CD GLU A 916 5.686 -6.249 -4.266 1.00 0.00 C ATOM 419 OE1 GLU A 916 4.783 -6.392 -5.117 1.00 0.00 O ATOM 420 OE2 GLU A 916 6.897 -6.170 -4.559 1.00 0.00 O ATOM 0 H GLU A 916 6.469 -4.112 -0.987 1.00 0.00 H new ATOM 0 HA GLU A 916 6.009 -3.793 -3.716 1.00 0.00 H new ATOM 0 HB2 GLU A 916 4.388 -4.841 -1.389 1.00 0.00 H new ATOM 0 HB3 GLU A 916 3.683 -4.768 -2.991 1.00 0.00 H new ATOM 0 HG2 GLU A 916 6.176 -6.302 -2.183 1.00 0.00 H new ATOM 0 HG3 GLU A 916 4.609 -6.985 -2.569 1.00 0.00 H new ATOM 427 N LEU A 917 4.232 -1.791 -1.799 1.00 0.00 N ATOM 428 CA LEU A 917 3.385 -0.604 -1.805 1.00 0.00 C ATOM 429 C LEU A 917 4.048 0.534 -2.573 1.00 0.00 C ATOM 430 O LEU A 917 3.445 1.128 -3.469 1.00 0.00 O ATOM 431 CB LEU A 917 3.085 -0.160 -0.372 1.00 0.00 C ATOM 432 CG LEU A 917 1.982 -0.932 0.353 1.00 0.00 C ATOM 433 CD1 LEU A 917 2.087 -0.728 1.857 1.00 0.00 C ATOM 434 CD2 LEU A 917 0.612 -0.504 -0.150 1.00 0.00 C ATOM 0 H LEU A 917 4.506 -2.108 -0.869 1.00 0.00 H new ATOM 0 HA LEU A 917 2.450 -0.858 -2.304 1.00 0.00 H new ATOM 0 HB2 LEU A 917 4.002 -0.242 0.212 1.00 0.00 H new ATOM 0 HB3 LEU A 917 2.811 0.895 -0.390 1.00 0.00 H new ATOM 0 HG LEU A 917 2.109 -1.994 0.141 1.00 0.00 H new ATOM 0 HD11 LEU A 917 1.294 -1.285 2.356 1.00 0.00 H new ATOM 0 HD12 LEU A 917 3.056 -1.085 2.206 1.00 0.00 H new ATOM 0 HD13 LEU A 917 1.986 0.332 2.088 1.00 0.00 H new ATOM 0 HD21 LEU A 917 -0.160 -1.064 0.377 1.00 0.00 H new ATOM 0 HD22 LEU A 917 0.475 0.562 0.031 1.00 0.00 H new ATOM 0 HD23 LEU A 917 0.538 -0.703 -1.219 1.00 0.00 H new ATOM 446 N LEU A 918 5.293 0.833 -2.220 1.00 0.00 N ATOM 447 CA LEU A 918 6.040 1.899 -2.878 1.00 0.00 C ATOM 448 C LEU A 918 5.684 1.979 -4.359 1.00 0.00 C ATOM 449 O LEU A 918 5.130 2.977 -4.820 1.00 0.00 O ATOM 450 CB LEU A 918 7.544 1.670 -2.716 1.00 0.00 C ATOM 451 CG LEU A 918 8.029 1.377 -1.295 1.00 0.00 C ATOM 452 CD1 LEU A 918 9.545 1.270 -1.260 1.00 0.00 C ATOM 453 CD2 LEU A 918 7.545 2.452 -0.334 1.00 0.00 C ATOM 0 H LEU A 918 5.807 0.352 -1.482 1.00 0.00 H new ATOM 0 HA LEU A 918 5.769 2.843 -2.406 1.00 0.00 H new ATOM 0 HB2 LEU A 918 7.836 0.838 -3.357 1.00 0.00 H new ATOM 0 HB3 LEU A 918 8.067 2.553 -3.082 1.00 0.00 H new ATOM 0 HG LEU A 918 7.611 0.421 -0.979 1.00 0.00 H new ATOM 0 HD11 LEU A 918 9.872 1.061 -0.241 1.00 0.00 H new ATOM 0 HD12 LEU A 918 9.868 0.463 -1.917 1.00 0.00 H new ATOM 0 HD13 LEU A 918 9.984 2.209 -1.597 1.00 0.00 H new ATOM 0 HD21 LEU A 918 7.899 2.227 0.672 1.00 0.00 H new ATOM 0 HD22 LEU A 918 7.933 3.421 -0.647 1.00 0.00 H new ATOM 0 HD23 LEU A 918 6.455 2.479 -0.337 1.00 0.00 H new ATOM 465 N GLN A 919 6.004 0.922 -5.098 1.00 0.00 N ATOM 466 CA GLN A 919 5.716 0.873 -6.527 1.00 0.00 C ATOM 467 C GLN A 919 4.263 1.243 -6.802 1.00 0.00 C ATOM 468 O GLN A 919 3.979 2.113 -7.625 1.00 0.00 O ATOM 469 CB GLN A 919 6.014 -0.521 -7.081 1.00 0.00 C ATOM 470 CG GLN A 919 7.440 -0.685 -7.581 1.00 0.00 C ATOM 471 CD GLN A 919 7.887 0.467 -8.459 1.00 0.00 C ATOM 472 OE1 GLN A 919 7.249 0.778 -9.466 1.00 0.00 O ATOM 473 NE2 GLN A 919 8.988 1.107 -8.083 1.00 0.00 N ATOM 0 H GLN A 919 6.463 0.088 -4.731 1.00 0.00 H new ATOM 0 HA GLN A 919 6.357 1.599 -7.027 1.00 0.00 H new ATOM 0 HB2 GLN A 919 5.823 -1.260 -6.303 1.00 0.00 H new ATOM 0 HB3 GLN A 919 5.325 -0.733 -7.898 1.00 0.00 H new ATOM 0 HG2 GLN A 919 8.113 -0.769 -6.727 1.00 0.00 H new ATOM 0 HG3 GLN A 919 7.519 -1.616 -8.142 1.00 0.00 H new ATOM 0 HE21 GLN A 919 9.485 0.815 -7.241 1.00 0.00 H new ATOM 0 HE22 GLN A 919 9.337 1.890 -8.636 1.00 0.00 H new ATOM 482 N GLN A 920 3.346 0.576 -6.107 1.00 0.00 N ATOM 483 CA GLN A 920 1.921 0.835 -6.278 1.00 0.00 C ATOM 484 C GLN A 920 1.625 2.329 -6.194 1.00 0.00 C ATOM 485 O GLN A 920 0.813 2.855 -6.955 1.00 0.00 O ATOM 486 CB GLN A 920 1.114 0.082 -5.219 1.00 0.00 C ATOM 487 CG GLN A 920 1.000 -1.409 -5.488 1.00 0.00 C ATOM 488 CD GLN A 920 0.113 -1.722 -6.677 1.00 0.00 C ATOM 489 OE1 GLN A 920 0.444 -1.396 -7.817 1.00 0.00 O ATOM 490 NE2 GLN A 920 -1.024 -2.359 -6.416 1.00 0.00 N ATOM 0 H GLN A 920 3.564 -0.147 -5.421 1.00 0.00 H new ATOM 0 HA GLN A 920 1.629 0.481 -7.267 1.00 0.00 H new ATOM 0 HB2 GLN A 920 1.579 0.232 -4.245 1.00 0.00 H new ATOM 0 HB3 GLN A 920 0.113 0.510 -5.164 1.00 0.00 H new ATOM 0 HG2 GLN A 920 1.994 -1.820 -5.663 1.00 0.00 H new ATOM 0 HG3 GLN A 920 0.602 -1.905 -4.602 1.00 0.00 H new ATOM 0 HE21 GLN A 920 -1.259 -2.610 -5.456 1.00 0.00 H new ATOM 0 HE22 GLN A 920 -1.662 -2.596 -7.176 1.00 0.00 H new ATOM 499 N PHE A 921 2.289 3.007 -5.264 1.00 0.00 N ATOM 500 CA PHE A 921 2.096 4.440 -5.079 1.00 0.00 C ATOM 501 C PHE A 921 2.730 5.227 -6.223 1.00 0.00 C ATOM 502 O PHE A 921 2.143 6.179 -6.735 1.00 0.00 O ATOM 503 CB PHE A 921 2.695 4.889 -3.744 1.00 0.00 C ATOM 504 CG PHE A 921 2.077 4.214 -2.553 1.00 0.00 C ATOM 505 CD1 PHE A 921 0.713 3.972 -2.507 1.00 0.00 C ATOM 506 CD2 PHE A 921 2.859 3.821 -1.480 1.00 0.00 C ATOM 507 CE1 PHE A 921 0.142 3.352 -1.412 1.00 0.00 C ATOM 508 CE2 PHE A 921 2.294 3.200 -0.382 1.00 0.00 C ATOM 509 CZ PHE A 921 0.934 2.964 -0.349 1.00 0.00 C ATOM 0 H PHE A 921 2.966 2.587 -4.627 1.00 0.00 H new ATOM 0 HA PHE A 921 1.024 4.639 -5.074 1.00 0.00 H new ATOM 0 HB2 PHE A 921 3.766 4.689 -3.750 1.00 0.00 H new ATOM 0 HB3 PHE A 921 2.573 5.968 -3.644 1.00 0.00 H new ATOM 0 HD1 PHE A 921 0.089 4.271 -3.336 1.00 0.00 H new ATOM 0 HD2 PHE A 921 3.924 4.002 -1.501 1.00 0.00 H new ATOM 0 HE1 PHE A 921 -0.922 3.171 -1.387 1.00 0.00 H new ATOM 0 HE2 PHE A 921 2.915 2.900 0.449 1.00 0.00 H new ATOM 0 HZ PHE A 921 0.490 2.477 0.507 1.00 0.00 H new ATOM 519 N ALA A 922 3.932 4.820 -6.618 1.00 0.00 N ATOM 520 CA ALA A 922 4.645 5.484 -7.702 1.00 0.00 C ATOM 521 C ALA A 922 3.761 5.623 -8.937 1.00 0.00 C ATOM 522 O ALA A 922 3.810 6.635 -9.636 1.00 0.00 O ATOM 523 CB ALA A 922 5.916 4.721 -8.043 1.00 0.00 C ATOM 0 H ALA A 922 4.432 4.034 -6.203 1.00 0.00 H new ATOM 0 HA ALA A 922 4.915 6.485 -7.366 1.00 0.00 H new ATOM 0 HB1 ALA A 922 6.438 5.228 -8.854 1.00 0.00 H new ATOM 0 HB2 ALA A 922 6.562 4.679 -7.166 1.00 0.00 H new ATOM 0 HB3 ALA A 922 5.660 3.708 -8.354 1.00 0.00 H new ATOM 529 N SER A 923 2.955 4.599 -9.200 1.00 0.00 N ATOM 530 CA SER A 923 2.064 4.606 -10.353 1.00 0.00 C ATOM 531 C SER A 923 1.314 5.931 -10.454 1.00 0.00 C ATOM 532 O SER A 923 0.822 6.300 -11.520 1.00 0.00 O ATOM 533 CB SER A 923 1.067 3.448 -10.261 1.00 0.00 C ATOM 534 OG SER A 923 1.577 2.285 -10.889 1.00 0.00 O ATOM 0 H SER A 923 2.901 3.755 -8.630 1.00 0.00 H new ATOM 0 HA SER A 923 2.671 4.484 -11.250 1.00 0.00 H new ATOM 0 HB2 SER A 923 0.849 3.234 -9.215 1.00 0.00 H new ATOM 0 HB3 SER A 923 0.126 3.736 -10.730 1.00 0.00 H new ATOM 0 HG SER A 923 0.922 1.559 -10.815 1.00 0.00 H new ATOM 540 N PHE A 924 1.230 6.642 -9.334 1.00 0.00 N ATOM 541 CA PHE A 924 0.540 7.926 -9.294 1.00 0.00 C ATOM 542 C PHE A 924 1.464 9.025 -8.778 1.00 0.00 C ATOM 543 O PHE A 924 1.713 10.015 -9.465 1.00 0.00 O ATOM 544 CB PHE A 924 -0.704 7.833 -8.408 1.00 0.00 C ATOM 545 CG PHE A 924 -1.488 6.567 -8.606 1.00 0.00 C ATOM 546 CD1 PHE A 924 -0.982 5.349 -8.179 1.00 0.00 C ATOM 547 CD2 PHE A 924 -2.730 6.594 -9.218 1.00 0.00 C ATOM 548 CE1 PHE A 924 -1.701 4.183 -8.360 1.00 0.00 C ATOM 549 CE2 PHE A 924 -3.454 5.431 -9.402 1.00 0.00 C ATOM 550 CZ PHE A 924 -2.939 4.224 -8.972 1.00 0.00 C ATOM 0 H PHE A 924 1.631 6.351 -8.443 1.00 0.00 H new ATOM 0 HA PHE A 924 0.237 8.178 -10.310 1.00 0.00 H new ATOM 0 HB2 PHE A 924 -0.402 7.904 -7.363 1.00 0.00 H new ATOM 0 HB3 PHE A 924 -1.350 8.687 -8.612 1.00 0.00 H new ATOM 0 HD1 PHE A 924 -0.015 5.311 -7.700 1.00 0.00 H new ATOM 0 HD2 PHE A 924 -3.138 7.535 -9.556 1.00 0.00 H new ATOM 0 HE1 PHE A 924 -1.296 3.240 -8.023 1.00 0.00 H new ATOM 0 HE2 PHE A 924 -4.421 5.466 -9.881 1.00 0.00 H new ATOM 0 HZ PHE A 924 -3.503 3.314 -9.114 1.00 0.00 H new ATOM 560 N GLY A 925 1.970 8.842 -7.562 1.00 0.00 N ATOM 561 CA GLY A 925 2.861 9.825 -6.974 1.00 0.00 C ATOM 562 C GLY A 925 4.129 9.203 -6.423 1.00 0.00 C ATOM 563 O GLY A 925 4.129 8.045 -6.008 1.00 0.00 O ATOM 0 H GLY A 925 1.779 8.031 -6.974 1.00 0.00 H new ATOM 0 HA2 GLY A 925 3.122 10.569 -7.726 1.00 0.00 H new ATOM 0 HA3 GLY A 925 2.340 10.350 -6.173 1.00 0.00 H new ATOM 567 N GLU A 926 5.212 9.974 -6.420 1.00 0.00 N ATOM 568 CA GLU A 926 6.492 9.489 -5.918 1.00 0.00 C ATOM 569 C GLU A 926 6.622 9.749 -4.420 1.00 0.00 C ATOM 570 O GLU A 926 6.476 10.882 -3.960 1.00 0.00 O ATOM 571 CB GLU A 926 7.646 10.161 -6.665 1.00 0.00 C ATOM 572 CG GLU A 926 9.018 9.775 -6.140 1.00 0.00 C ATOM 573 CD GLU A 926 9.420 8.368 -6.536 1.00 0.00 C ATOM 574 OE1 GLU A 926 9.059 7.421 -5.806 1.00 0.00 O ATOM 575 OE2 GLU A 926 10.095 8.213 -7.575 1.00 0.00 O ATOM 0 H GLU A 926 5.228 10.936 -6.759 1.00 0.00 H new ATOM 0 HA GLU A 926 6.536 8.413 -6.088 1.00 0.00 H new ATOM 0 HB2 GLU A 926 7.584 9.900 -7.722 1.00 0.00 H new ATOM 0 HB3 GLU A 926 7.531 11.243 -6.596 1.00 0.00 H new ATOM 0 HG2 GLU A 926 9.759 10.480 -6.517 1.00 0.00 H new ATOM 0 HG3 GLU A 926 9.023 9.858 -5.053 1.00 0.00 H new ATOM 582 N VAL A 927 6.897 8.691 -3.663 1.00 0.00 N ATOM 583 CA VAL A 927 7.048 8.804 -2.217 1.00 0.00 C ATOM 584 C VAL A 927 8.421 9.354 -1.849 1.00 0.00 C ATOM 585 O VAL A 927 9.398 9.146 -2.569 1.00 0.00 O ATOM 586 CB VAL A 927 6.850 7.443 -1.525 1.00 0.00 C ATOM 587 CG1 VAL A 927 6.669 7.627 -0.026 1.00 0.00 C ATOM 588 CG2 VAL A 927 5.663 6.706 -2.127 1.00 0.00 C ATOM 0 H VAL A 927 7.020 7.746 -4.027 1.00 0.00 H new ATOM 0 HA VAL A 927 6.279 9.495 -1.871 1.00 0.00 H new ATOM 0 HB VAL A 927 7.743 6.840 -1.688 1.00 0.00 H new ATOM 0 HG11 VAL A 927 6.530 6.654 0.446 1.00 0.00 H new ATOM 0 HG12 VAL A 927 7.553 8.110 0.391 1.00 0.00 H new ATOM 0 HG13 VAL A 927 5.794 8.249 0.161 1.00 0.00 H new ATOM 0 HG21 VAL A 927 5.538 5.746 -1.626 1.00 0.00 H new ATOM 0 HG22 VAL A 927 4.760 7.303 -1.998 1.00 0.00 H new ATOM 0 HG23 VAL A 927 5.839 6.540 -3.190 1.00 0.00 H new ATOM 598 N ILE A 928 8.488 10.057 -0.724 1.00 0.00 N ATOM 599 CA ILE A 928 9.742 10.637 -0.259 1.00 0.00 C ATOM 600 C ILE A 928 10.053 10.200 1.169 1.00 0.00 C ATOM 601 O ILE A 928 11.202 9.907 1.504 1.00 0.00 O ATOM 602 CB ILE A 928 9.708 12.175 -0.318 1.00 0.00 C ATOM 603 CG1 ILE A 928 8.580 12.716 0.563 1.00 0.00 C ATOM 604 CG2 ILE A 928 9.538 12.646 -1.754 1.00 0.00 C ATOM 605 CD1 ILE A 928 8.517 14.227 0.604 1.00 0.00 C ATOM 0 H ILE A 928 7.689 10.239 -0.117 1.00 0.00 H new ATOM 0 HA ILE A 928 10.524 10.274 -0.926 1.00 0.00 H new ATOM 0 HB ILE A 928 10.655 12.560 0.060 1.00 0.00 H new ATOM 0 HG12 ILE A 928 7.628 12.331 0.198 1.00 0.00 H new ATOM 0 HG13 ILE A 928 8.709 12.338 1.577 1.00 0.00 H new ATOM 0 HG21 ILE A 928 9.516 13.735 -1.779 1.00 0.00 H new ATOM 0 HG22 ILE A 928 10.372 12.286 -2.356 1.00 0.00 H new ATOM 0 HG23 ILE A 928 8.604 12.255 -2.157 1.00 0.00 H new ATOM 0 HD11 ILE A 928 7.694 14.540 1.247 1.00 0.00 H new ATOM 0 HD12 ILE A 928 9.455 14.620 0.998 1.00 0.00 H new ATOM 0 HD13 ILE A 928 8.357 14.612 -0.403 1.00 0.00 H new ATOM 617 N LEU A 929 9.023 10.159 2.006 1.00 0.00 N ATOM 618 CA LEU A 929 9.185 9.756 3.399 1.00 0.00 C ATOM 619 C LEU A 929 8.008 8.903 3.860 1.00 0.00 C ATOM 620 O LEU A 929 6.874 9.106 3.426 1.00 0.00 O ATOM 621 CB LEU A 929 9.318 10.989 4.295 1.00 0.00 C ATOM 622 CG LEU A 929 9.087 10.761 5.789 1.00 0.00 C ATOM 623 CD1 LEU A 929 10.298 10.093 6.421 1.00 0.00 C ATOM 624 CD2 LEU A 929 8.776 12.077 6.488 1.00 0.00 C ATOM 0 H LEU A 929 8.067 10.400 1.745 1.00 0.00 H new ATOM 0 HA LEU A 929 10.094 9.159 3.475 1.00 0.00 H new ATOM 0 HB2 LEU A 929 10.317 11.404 4.161 1.00 0.00 H new ATOM 0 HB3 LEU A 929 8.611 11.743 3.949 1.00 0.00 H new ATOM 0 HG LEU A 929 8.230 10.098 5.907 1.00 0.00 H new ATOM 0 HD11 LEU A 929 10.115 9.939 7.484 1.00 0.00 H new ATOM 0 HD12 LEU A 929 10.475 9.131 5.940 1.00 0.00 H new ATOM 0 HD13 LEU A 929 11.173 10.730 6.292 1.00 0.00 H new ATOM 0 HD21 LEU A 929 8.614 11.895 7.551 1.00 0.00 H new ATOM 0 HD22 LEU A 929 9.613 12.763 6.360 1.00 0.00 H new ATOM 0 HD23 LEU A 929 7.877 12.516 6.054 1.00 0.00 H new ATOM 636 N ILE A 930 8.285 7.949 4.742 1.00 0.00 N ATOM 637 CA ILE A 930 7.248 7.067 5.264 1.00 0.00 C ATOM 638 C ILE A 930 7.367 6.914 6.777 1.00 0.00 C ATOM 639 O ILE A 930 8.469 6.865 7.322 1.00 0.00 O ATOM 640 CB ILE A 930 7.314 5.673 4.612 1.00 0.00 C ATOM 641 CG1 ILE A 930 7.247 5.795 3.088 1.00 0.00 C ATOM 642 CG2 ILE A 930 6.185 4.793 5.129 1.00 0.00 C ATOM 643 CD1 ILE A 930 7.667 4.537 2.362 1.00 0.00 C ATOM 0 H ILE A 930 9.219 7.767 5.110 1.00 0.00 H new ATOM 0 HA ILE A 930 6.290 7.528 5.022 1.00 0.00 H new ATOM 0 HB ILE A 930 8.263 5.207 4.879 1.00 0.00 H new ATOM 0 HG12 ILE A 930 6.228 6.050 2.797 1.00 0.00 H new ATOM 0 HG13 ILE A 930 7.885 6.619 2.769 1.00 0.00 H new ATOM 0 HG21 ILE A 930 6.245 3.811 4.659 1.00 0.00 H new ATOM 0 HG22 ILE A 930 6.274 4.684 6.210 1.00 0.00 H new ATOM 0 HG23 ILE A 930 5.226 5.253 4.889 1.00 0.00 H new ATOM 0 HD11 ILE A 930 7.595 4.696 1.286 1.00 0.00 H new ATOM 0 HD12 ILE A 930 8.696 4.292 2.624 1.00 0.00 H new ATOM 0 HD13 ILE A 930 7.013 3.714 2.652 1.00 0.00 H new ATOM 655 N ARG A 931 6.223 6.838 7.450 1.00 0.00 N ATOM 656 CA ARG A 931 6.198 6.690 8.900 1.00 0.00 C ATOM 657 C ARG A 931 5.176 5.638 9.321 1.00 0.00 C ATOM 658 O ARG A 931 4.016 5.685 8.912 1.00 0.00 O ATOM 659 CB ARG A 931 5.872 8.029 9.565 1.00 0.00 C ATOM 660 CG ARG A 931 4.790 8.818 8.846 1.00 0.00 C ATOM 661 CD ARG A 931 5.377 9.712 7.765 1.00 0.00 C ATOM 662 NE ARG A 931 6.276 10.721 8.318 1.00 0.00 N ATOM 663 CZ ARG A 931 5.857 11.861 8.857 1.00 0.00 C ATOM 664 NH1 ARG A 931 4.561 12.135 8.915 1.00 0.00 N ATOM 665 NH2 ARG A 931 6.736 12.730 9.339 1.00 0.00 N ATOM 0 H ARG A 931 5.302 6.877 7.014 1.00 0.00 H new ATOM 0 HA ARG A 931 7.186 6.362 9.224 1.00 0.00 H new ATOM 0 HB2 ARG A 931 5.556 7.848 10.592 1.00 0.00 H new ATOM 0 HB3 ARG A 931 6.779 8.632 9.612 1.00 0.00 H new ATOM 0 HG2 ARG A 931 4.072 8.130 8.400 1.00 0.00 H new ATOM 0 HG3 ARG A 931 4.243 9.427 9.566 1.00 0.00 H new ATOM 0 HD2 ARG A 931 5.919 9.100 7.043 1.00 0.00 H new ATOM 0 HD3 ARG A 931 4.569 10.204 7.223 1.00 0.00 H new ATOM 0 HE ARG A 931 7.280 10.541 8.289 1.00 0.00 H new ATOM 0 HH11 ARG A 931 3.882 11.470 8.545 1.00 0.00 H new ATOM 0 HH12 ARG A 931 4.243 13.011 9.329 1.00 0.00 H new ATOM 0 HH21 ARG A 931 7.734 12.523 9.296 1.00 0.00 H new ATOM 0 HH22 ARG A 931 6.414 13.605 9.753 1.00 0.00 H new ATOM 679 N PHE A 932 5.616 4.690 10.142 1.00 0.00 N ATOM 680 CA PHE A 932 4.740 3.625 10.618 1.00 0.00 C ATOM 681 C PHE A 932 4.086 4.010 11.942 1.00 0.00 C ATOM 682 O PHE A 932 4.770 4.323 12.917 1.00 0.00 O ATOM 683 CB PHE A 932 5.528 2.324 10.785 1.00 0.00 C ATOM 684 CG PHE A 932 6.388 1.988 9.600 1.00 0.00 C ATOM 685 CD1 PHE A 932 5.844 1.374 8.484 1.00 0.00 C ATOM 686 CD2 PHE A 932 7.741 2.286 9.603 1.00 0.00 C ATOM 687 CE1 PHE A 932 6.632 1.064 7.392 1.00 0.00 C ATOM 688 CE2 PHE A 932 8.535 1.979 8.514 1.00 0.00 C ATOM 689 CZ PHE A 932 7.980 1.366 7.408 1.00 0.00 C ATOM 0 H PHE A 932 6.573 4.637 10.491 1.00 0.00 H new ATOM 0 HA PHE A 932 3.956 3.474 9.876 1.00 0.00 H new ATOM 0 HB2 PHE A 932 6.158 2.401 11.671 1.00 0.00 H new ATOM 0 HB3 PHE A 932 4.830 1.506 10.961 1.00 0.00 H new ATOM 0 HD1 PHE A 932 4.791 1.135 8.467 1.00 0.00 H new ATOM 0 HD2 PHE A 932 8.180 2.764 10.466 1.00 0.00 H new ATOM 0 HE1 PHE A 932 6.195 0.586 6.528 1.00 0.00 H new ATOM 0 HE2 PHE A 932 9.588 2.218 8.528 1.00 0.00 H new ATOM 0 HZ PHE A 932 8.599 1.123 6.557 1.00 0.00 H new ATOM 699 N VAL A 933 2.758 3.985 11.969 1.00 0.00 N ATOM 700 CA VAL A 933 2.010 4.330 13.172 1.00 0.00 C ATOM 701 C VAL A 933 1.807 3.109 14.062 1.00 0.00 C ATOM 702 O VAL A 933 1.857 1.972 13.593 1.00 0.00 O ATOM 703 CB VAL A 933 0.636 4.933 12.825 1.00 0.00 C ATOM 704 CG1 VAL A 933 0.087 5.724 14.003 1.00 0.00 C ATOM 705 CG2 VAL A 933 0.736 5.808 11.585 1.00 0.00 C ATOM 0 H VAL A 933 2.177 3.729 11.171 1.00 0.00 H new ATOM 0 HA VAL A 933 2.599 5.073 13.709 1.00 0.00 H new ATOM 0 HB VAL A 933 -0.056 4.118 12.612 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -0.884 6.143 13.739 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -0.024 5.065 14.864 1.00 0.00 H new ATOM 0 HG13 VAL A 933 0.775 6.532 14.251 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -0.244 6.226 11.354 1.00 0.00 H new ATOM 0 HG22 VAL A 933 1.442 6.618 11.767 1.00 0.00 H new ATOM 0 HG23 VAL A 933 1.082 5.208 10.743 1.00 0.00 H new ATOM 715 N GLU A 934 1.577 3.353 15.348 1.00 0.00 N ATOM 716 CA GLU A 934 1.367 2.272 16.305 1.00 0.00 C ATOM 717 C GLU A 934 0.652 1.096 15.647 1.00 0.00 C ATOM 718 O GLU A 934 1.084 -0.051 15.763 1.00 0.00 O ATOM 719 CB GLU A 934 0.556 2.771 17.502 1.00 0.00 C ATOM 720 CG GLU A 934 1.222 3.910 18.257 1.00 0.00 C ATOM 721 CD GLU A 934 0.522 4.232 19.563 1.00 0.00 C ATOM 722 OE1 GLU A 934 -0.642 4.680 19.517 1.00 0.00 O ATOM 723 OE2 GLU A 934 1.139 4.036 20.631 1.00 0.00 O ATOM 0 H GLU A 934 1.531 4.289 15.751 1.00 0.00 H new ATOM 0 HA GLU A 934 2.343 1.934 16.653 1.00 0.00 H new ATOM 0 HB2 GLU A 934 -0.423 3.100 17.155 1.00 0.00 H new ATOM 0 HB3 GLU A 934 0.388 1.941 18.188 1.00 0.00 H new ATOM 0 HG2 GLU A 934 2.260 3.648 18.461 1.00 0.00 H new ATOM 0 HG3 GLU A 934 1.235 4.800 17.627 1.00 0.00 H new ATOM 730 N ASP A 935 -0.445 1.389 14.956 1.00 0.00 N ATOM 731 CA ASP A 935 -1.220 0.356 14.279 1.00 0.00 C ATOM 732 C ASP A 935 -1.433 0.711 12.811 1.00 0.00 C ATOM 733 O ASP A 935 -1.580 -0.169 11.962 1.00 0.00 O ATOM 734 CB ASP A 935 -2.571 0.166 14.971 1.00 0.00 C ATOM 735 CG ASP A 935 -3.575 1.234 14.584 1.00 0.00 C ATOM 736 OD1 ASP A 935 -4.071 1.195 13.438 1.00 0.00 O ATOM 737 OD2 ASP A 935 -3.866 2.108 15.427 1.00 0.00 O ATOM 0 H ASP A 935 -0.817 2.333 14.850 1.00 0.00 H new ATOM 0 HA ASP A 935 -0.659 -0.577 14.331 1.00 0.00 H new ATOM 0 HB2 ASP A 935 -2.972 -0.815 14.716 1.00 0.00 H new ATOM 0 HB3 ASP A 935 -2.428 0.181 16.051 1.00 0.00 H new ATOM 742 N LYS A 936 -1.450 2.007 12.517 1.00 0.00 N ATOM 743 CA LYS A 936 -1.644 2.480 11.152 1.00 0.00 C ATOM 744 C LYS A 936 -0.305 2.769 10.480 1.00 0.00 C ATOM 745 O LYS A 936 0.744 2.720 11.121 1.00 0.00 O ATOM 746 CB LYS A 936 -2.512 3.741 11.146 1.00 0.00 C ATOM 747 CG LYS A 936 -3.356 3.892 9.892 1.00 0.00 C ATOM 748 CD LYS A 936 -4.558 4.790 10.134 1.00 0.00 C ATOM 749 CE LYS A 936 -5.645 4.067 10.915 1.00 0.00 C ATOM 750 NZ LYS A 936 -6.316 3.022 10.093 1.00 0.00 N ATOM 0 H LYS A 936 -1.332 2.749 13.207 1.00 0.00 H new ATOM 0 HA LYS A 936 -2.150 1.695 10.591 1.00 0.00 H new ATOM 0 HB2 LYS A 936 -3.169 3.724 12.016 1.00 0.00 H new ATOM 0 HB3 LYS A 936 -1.869 4.615 11.249 1.00 0.00 H new ATOM 0 HG2 LYS A 936 -2.746 4.307 9.090 1.00 0.00 H new ATOM 0 HG3 LYS A 936 -3.695 2.911 9.560 1.00 0.00 H new ATOM 0 HD2 LYS A 936 -4.245 5.679 10.682 1.00 0.00 H new ATOM 0 HD3 LYS A 936 -4.959 5.129 9.179 1.00 0.00 H new ATOM 0 HE2 LYS A 936 -5.210 3.607 11.802 1.00 0.00 H new ATOM 0 HE3 LYS A 936 -6.385 4.789 11.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 936 -7.306 2.925 10.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 936 -6.286 3.297 9.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 936 -5.825 2.114 10.218 1.00 0.00 H new ATOM 764 N MET A 937 -0.350 3.071 9.187 1.00 0.00 N ATOM 765 CA MET A 937 0.860 3.370 8.430 1.00 0.00 C ATOM 766 C MET A 937 0.659 4.597 7.546 1.00 0.00 C ATOM 767 O MET A 937 -0.054 4.541 6.544 1.00 0.00 O ATOM 768 CB MET A 937 1.260 2.169 7.571 1.00 0.00 C ATOM 769 CG MET A 937 2.289 2.501 6.503 1.00 0.00 C ATOM 770 SD MET A 937 2.530 1.154 5.328 1.00 0.00 S ATOM 771 CE MET A 937 3.598 1.942 4.125 1.00 0.00 C ATOM 0 H MET A 937 -1.211 3.115 8.642 1.00 0.00 H new ATOM 0 HA MET A 937 1.659 3.582 9.140 1.00 0.00 H new ATOM 0 HB2 MET A 937 1.659 1.387 8.217 1.00 0.00 H new ATOM 0 HB3 MET A 937 0.369 1.763 7.092 1.00 0.00 H new ATOM 0 HG2 MET A 937 1.973 3.395 5.965 1.00 0.00 H new ATOM 0 HG3 MET A 937 3.240 2.736 6.981 1.00 0.00 H new ATOM 0 HE1 MET A 937 4.271 1.200 3.694 1.00 0.00 H new ATOM 0 HE2 MET A 937 2.992 2.384 3.334 1.00 0.00 H new ATOM 0 HE3 MET A 937 4.183 2.722 4.613 1.00 0.00 H new ATOM 781 N TRP A 938 1.290 5.702 7.924 1.00 0.00 N ATOM 782 CA TRP A 938 1.180 6.943 7.165 1.00 0.00 C ATOM 783 C TRP A 938 2.337 7.085 6.183 1.00 0.00 C ATOM 784 O TRP A 938 3.468 6.698 6.480 1.00 0.00 O ATOM 785 CB TRP A 938 1.147 8.143 8.112 1.00 0.00 C ATOM 786 CG TRP A 938 0.108 8.024 9.186 1.00 0.00 C ATOM 787 CD1 TRP A 938 -0.735 6.971 9.398 1.00 0.00 C ATOM 788 CD2 TRP A 938 -0.198 8.995 10.193 1.00 0.00 C ATOM 789 NE1 TRP A 938 -1.547 7.228 10.476 1.00 0.00 N ATOM 790 CE2 TRP A 938 -1.237 8.463 10.982 1.00 0.00 C ATOM 791 CE3 TRP A 938 0.305 10.261 10.506 1.00 0.00 C ATOM 792 CZ2 TRP A 938 -1.781 9.155 12.061 1.00 0.00 C ATOM 793 CZ3 TRP A 938 -0.236 10.946 11.578 1.00 0.00 C ATOM 794 CH2 TRP A 938 -1.269 10.392 12.345 1.00 0.00 C ATOM 0 H TRP A 938 1.883 5.765 8.751 1.00 0.00 H new ATOM 0 HA TRP A 938 0.250 6.912 6.598 1.00 0.00 H new ATOM 0 HB2 TRP A 938 2.127 8.258 8.576 1.00 0.00 H new ATOM 0 HB3 TRP A 938 0.960 9.048 7.534 1.00 0.00 H new ATOM 0 HD1 TRP A 938 -0.760 6.069 8.805 1.00 0.00 H new ATOM 0 HE1 TRP A 938 -2.264 6.601 10.841 1.00 0.00 H new ATOM 0 HE3 TRP A 938 1.102 10.696 9.921 1.00 0.00 H new ATOM 0 HZ2 TRP A 938 -2.579 8.731 12.653 1.00 0.00 H new ATOM 0 HZ3 TRP A 938 0.144 11.925 11.828 1.00 0.00 H new ATOM 0 HH2 TRP A 938 -1.669 10.952 13.177 1.00 0.00 H new ATOM 805 N VAL A 939 2.049 7.644 5.012 1.00 0.00 N ATOM 806 CA VAL A 939 3.068 7.839 3.987 1.00 0.00 C ATOM 807 C VAL A 939 3.076 9.279 3.487 1.00 0.00 C ATOM 808 O VAL A 939 2.023 9.892 3.306 1.00 0.00 O ATOM 809 CB VAL A 939 2.848 6.894 2.791 1.00 0.00 C ATOM 810 CG1 VAL A 939 3.975 7.042 1.779 1.00 0.00 C ATOM 811 CG2 VAL A 939 2.732 5.453 3.265 1.00 0.00 C ATOM 0 H VAL A 939 1.119 7.970 4.749 1.00 0.00 H new ATOM 0 HA VAL A 939 4.029 7.612 4.449 1.00 0.00 H new ATOM 0 HB VAL A 939 1.914 7.168 2.301 1.00 0.00 H new ATOM 0 HG11 VAL A 939 3.803 6.367 0.941 1.00 0.00 H new ATOM 0 HG12 VAL A 939 4.006 8.070 1.417 1.00 0.00 H new ATOM 0 HG13 VAL A 939 4.925 6.796 2.254 1.00 0.00 H new ATOM 0 HG21 VAL A 939 2.577 4.799 2.407 1.00 0.00 H new ATOM 0 HG22 VAL A 939 3.648 5.165 3.780 1.00 0.00 H new ATOM 0 HG23 VAL A 939 1.888 5.362 3.948 1.00 0.00 H new ATOM 821 N THR A 940 4.272 9.816 3.264 1.00 0.00 N ATOM 822 CA THR A 940 4.418 11.185 2.786 1.00 0.00 C ATOM 823 C THR A 940 4.641 11.219 1.278 1.00 0.00 C ATOM 824 O THR A 940 5.106 10.245 0.687 1.00 0.00 O ATOM 825 CB THR A 940 5.590 11.901 3.484 1.00 0.00 C ATOM 826 OG1 THR A 940 5.315 12.042 4.882 1.00 0.00 O ATOM 827 CG2 THR A 940 5.829 13.272 2.868 1.00 0.00 C ATOM 0 H THR A 940 5.153 9.323 3.407 1.00 0.00 H new ATOM 0 HA THR A 940 3.490 11.705 3.025 1.00 0.00 H new ATOM 0 HB THR A 940 6.488 11.298 3.350 1.00 0.00 H new ATOM 0 HG1 THR A 940 5.879 12.750 5.257 1.00 0.00 H new ATOM 0 HG21 THR A 940 6.661 13.759 3.376 1.00 0.00 H new ATOM 0 HG22 THR A 940 6.066 13.159 1.810 1.00 0.00 H new ATOM 0 HG23 THR A 940 4.931 13.881 2.976 1.00 0.00 H new ATOM 835 N PHE A 941 4.308 12.348 0.662 1.00 0.00 N ATOM 836 CA PHE A 941 4.472 12.510 -0.778 1.00 0.00 C ATOM 837 C PHE A 941 5.071 13.874 -1.108 1.00 0.00 C ATOM 838 O PHE A 941 4.858 14.849 -0.386 1.00 0.00 O ATOM 839 CB PHE A 941 3.127 12.346 -1.488 1.00 0.00 C ATOM 840 CG PHE A 941 2.715 10.912 -1.668 1.00 0.00 C ATOM 841 CD1 PHE A 941 2.464 10.107 -0.568 1.00 0.00 C ATOM 842 CD2 PHE A 941 2.579 10.370 -2.936 1.00 0.00 C ATOM 843 CE1 PHE A 941 2.084 8.788 -0.730 1.00 0.00 C ATOM 844 CE2 PHE A 941 2.199 9.052 -3.103 1.00 0.00 C ATOM 845 CZ PHE A 941 1.953 8.260 -1.999 1.00 0.00 C ATOM 0 H PHE A 941 3.923 13.164 1.137 1.00 0.00 H new ATOM 0 HA PHE A 941 5.157 11.738 -1.129 1.00 0.00 H new ATOM 0 HB2 PHE A 941 2.358 12.868 -0.918 1.00 0.00 H new ATOM 0 HB3 PHE A 941 3.180 12.826 -2.465 1.00 0.00 H new ATOM 0 HD1 PHE A 941 2.566 10.515 0.427 1.00 0.00 H new ATOM 0 HD2 PHE A 941 2.772 10.984 -3.803 1.00 0.00 H new ATOM 0 HE1 PHE A 941 1.890 8.171 0.135 1.00 0.00 H new ATOM 0 HE2 PHE A 941 2.094 8.642 -4.096 1.00 0.00 H new ATOM 0 HZ PHE A 941 1.659 7.229 -2.128 1.00 0.00 H new ATOM 855 N LEU A 942 5.821 13.936 -2.203 1.00 0.00 N ATOM 856 CA LEU A 942 6.451 15.180 -2.629 1.00 0.00 C ATOM 857 C LEU A 942 5.434 16.316 -2.683 1.00 0.00 C ATOM 858 O LEU A 942 5.647 17.379 -2.101 1.00 0.00 O ATOM 859 CB LEU A 942 7.104 15.000 -4.001 1.00 0.00 C ATOM 860 CG LEU A 942 7.789 16.236 -4.586 1.00 0.00 C ATOM 861 CD1 LEU A 942 9.075 16.540 -3.833 1.00 0.00 C ATOM 862 CD2 LEU A 942 8.071 16.038 -6.068 1.00 0.00 C ATOM 0 H LEU A 942 6.007 13.139 -2.812 1.00 0.00 H new ATOM 0 HA LEU A 942 7.218 15.438 -1.899 1.00 0.00 H new ATOM 0 HB2 LEU A 942 7.842 14.201 -3.928 1.00 0.00 H new ATOM 0 HB3 LEU A 942 6.340 14.666 -4.703 1.00 0.00 H new ATOM 0 HG LEU A 942 7.117 17.087 -4.475 1.00 0.00 H new ATOM 0 HD11 LEU A 942 9.549 17.422 -4.263 1.00 0.00 H new ATOM 0 HD12 LEU A 942 8.847 16.726 -2.783 1.00 0.00 H new ATOM 0 HD13 LEU A 942 9.753 15.690 -3.912 1.00 0.00 H new ATOM 0 HD21 LEU A 942 8.559 16.927 -6.468 1.00 0.00 H new ATOM 0 HD22 LEU A 942 8.723 15.175 -6.202 1.00 0.00 H new ATOM 0 HD23 LEU A 942 7.133 15.869 -6.597 1.00 0.00 H new ATOM 874 N GLU A 943 4.329 16.081 -3.382 1.00 0.00 N ATOM 875 CA GLU A 943 3.278 17.084 -3.509 1.00 0.00 C ATOM 876 C GLU A 943 1.995 16.617 -2.829 1.00 0.00 C ATOM 877 O GLU A 943 1.903 15.482 -2.365 1.00 0.00 O ATOM 878 CB GLU A 943 3.006 17.385 -4.985 1.00 0.00 C ATOM 879 CG GLU A 943 4.195 17.990 -5.712 1.00 0.00 C ATOM 880 CD GLU A 943 3.836 18.495 -7.096 1.00 0.00 C ATOM 881 OE1 GLU A 943 3.790 17.673 -8.035 1.00 0.00 O ATOM 882 OE2 GLU A 943 3.602 19.714 -7.240 1.00 0.00 O ATOM 0 H GLU A 943 4.138 15.205 -3.869 1.00 0.00 H new ATOM 0 HA GLU A 943 3.619 17.995 -3.016 1.00 0.00 H new ATOM 0 HB2 GLU A 943 2.715 16.463 -5.487 1.00 0.00 H new ATOM 0 HB3 GLU A 943 2.160 18.069 -5.058 1.00 0.00 H new ATOM 0 HG2 GLU A 943 4.597 18.813 -5.122 1.00 0.00 H new ATOM 0 HG3 GLU A 943 4.984 17.243 -5.795 1.00 0.00 H new ATOM 889 N GLY A 944 1.005 17.504 -2.772 1.00 0.00 N ATOM 890 CA GLY A 944 -0.259 17.166 -2.146 1.00 0.00 C ATOM 891 C GLY A 944 -1.223 16.499 -3.109 1.00 0.00 C ATOM 892 O GLY A 944 -1.828 15.478 -2.784 1.00 0.00 O ATOM 0 H GLY A 944 1.057 18.451 -3.149 1.00 0.00 H new ATOM 0 HA2 GLY A 944 -0.076 16.502 -1.301 1.00 0.00 H new ATOM 0 HA3 GLY A 944 -0.717 18.071 -1.747 1.00 0.00 H new ATOM 896 N SER A 945 -1.366 17.079 -4.296 1.00 0.00 N ATOM 897 CA SER A 945 -2.267 16.537 -5.307 1.00 0.00 C ATOM 898 C SER A 945 -1.924 15.084 -5.618 1.00 0.00 C ATOM 899 O SER A 945 -2.785 14.304 -6.024 1.00 0.00 O ATOM 900 CB SER A 945 -2.196 17.375 -6.585 1.00 0.00 C ATOM 901 OG SER A 945 -2.334 18.756 -6.299 1.00 0.00 O ATOM 0 H SER A 945 -0.870 17.923 -4.581 1.00 0.00 H new ATOM 0 HA SER A 945 -3.282 16.575 -4.912 1.00 0.00 H new ATOM 0 HB2 SER A 945 -1.245 17.198 -7.087 1.00 0.00 H new ATOM 0 HB3 SER A 945 -2.982 17.063 -7.272 1.00 0.00 H new ATOM 0 HG SER A 945 -2.283 19.269 -7.132 1.00 0.00 H new ATOM 907 N SER A 946 -0.658 14.727 -5.425 1.00 0.00 N ATOM 908 CA SER A 946 -0.198 13.368 -5.688 1.00 0.00 C ATOM 909 C SER A 946 -0.807 12.386 -4.692 1.00 0.00 C ATOM 910 O SER A 946 -0.990 11.208 -4.998 1.00 0.00 O ATOM 911 CB SER A 946 1.329 13.301 -5.619 1.00 0.00 C ATOM 912 OG SER A 946 1.805 13.806 -4.383 1.00 0.00 O ATOM 0 H SER A 946 0.067 15.360 -5.088 1.00 0.00 H new ATOM 0 HA SER A 946 -0.522 13.089 -6.691 1.00 0.00 H new ATOM 0 HB2 SER A 946 1.657 12.269 -5.745 1.00 0.00 H new ATOM 0 HB3 SER A 946 1.759 13.875 -6.440 1.00 0.00 H new ATOM 0 HG SER A 946 2.785 13.781 -4.375 1.00 0.00 H new ATOM 918 N ALA A 947 -1.120 12.880 -3.498 1.00 0.00 N ATOM 919 CA ALA A 947 -1.710 12.048 -2.457 1.00 0.00 C ATOM 920 C ALA A 947 -3.203 11.848 -2.695 1.00 0.00 C ATOM 921 O ALA A 947 -3.831 10.990 -2.074 1.00 0.00 O ATOM 922 CB ALA A 947 -1.470 12.667 -1.088 1.00 0.00 C ATOM 0 H ALA A 947 -0.974 13.853 -3.228 1.00 0.00 H new ATOM 0 HA ALA A 947 -1.229 11.070 -2.491 1.00 0.00 H new ATOM 0 HB1 ALA A 947 -1.916 12.035 -0.320 1.00 0.00 H new ATOM 0 HB2 ALA A 947 -0.398 12.753 -0.910 1.00 0.00 H new ATOM 0 HB3 ALA A 947 -1.924 13.657 -1.052 1.00 0.00 H new ATOM 928 N LEU A 948 -3.766 12.645 -3.596 1.00 0.00 N ATOM 929 CA LEU A 948 -5.186 12.556 -3.916 1.00 0.00 C ATOM 930 C LEU A 948 -5.439 11.491 -4.978 1.00 0.00 C ATOM 931 O LEU A 948 -6.487 10.847 -4.988 1.00 0.00 O ATOM 932 CB LEU A 948 -5.706 13.910 -4.401 1.00 0.00 C ATOM 933 CG LEU A 948 -5.361 15.115 -3.524 1.00 0.00 C ATOM 934 CD1 LEU A 948 -6.017 16.375 -4.066 1.00 0.00 C ATOM 935 CD2 LEU A 948 -5.787 14.866 -2.085 1.00 0.00 C ATOM 0 H LEU A 948 -3.260 13.361 -4.118 1.00 0.00 H new ATOM 0 HA LEU A 948 -5.720 12.273 -3.009 1.00 0.00 H new ATOM 0 HB2 LEU A 948 -5.314 14.090 -5.402 1.00 0.00 H new ATOM 0 HB3 LEU A 948 -6.791 13.849 -4.490 1.00 0.00 H new ATOM 0 HG LEU A 948 -4.280 15.256 -3.543 1.00 0.00 H new ATOM 0 HD11 LEU A 948 -5.760 17.222 -3.429 1.00 0.00 H new ATOM 0 HD12 LEU A 948 -5.663 16.563 -5.080 1.00 0.00 H new ATOM 0 HD13 LEU A 948 -7.099 16.245 -4.078 1.00 0.00 H new ATOM 0 HD21 LEU A 948 -5.534 15.733 -1.475 1.00 0.00 H new ATOM 0 HD22 LEU A 948 -6.863 14.698 -2.048 1.00 0.00 H new ATOM 0 HD23 LEU A 948 -5.269 13.988 -1.699 1.00 0.00 H new ATOM 947 N ASN A 949 -4.471 11.311 -5.871 1.00 0.00 N ATOM 948 CA ASN A 949 -4.589 10.323 -6.937 1.00 0.00 C ATOM 949 C ASN A 949 -4.376 8.912 -6.397 1.00 0.00 C ATOM 950 O ASN A 949 -5.094 7.981 -6.761 1.00 0.00 O ATOM 951 CB ASN A 949 -3.576 10.616 -8.046 1.00 0.00 C ATOM 952 CG ASN A 949 -4.112 11.589 -9.078 1.00 0.00 C ATOM 953 OD1 ASN A 949 -5.310 11.871 -9.117 1.00 0.00 O ATOM 954 ND2 ASN A 949 -3.226 12.107 -9.920 1.00 0.00 N ATOM 0 H ASN A 949 -3.597 11.836 -5.877 1.00 0.00 H new ATOM 0 HA ASN A 949 -5.596 10.387 -7.348 1.00 0.00 H new ATOM 0 HB2 ASN A 949 -2.666 11.024 -7.605 1.00 0.00 H new ATOM 0 HB3 ASN A 949 -3.301 9.683 -8.539 1.00 0.00 H new ATOM 0 HD21 ASN A 949 -3.528 12.767 -10.636 1.00 0.00 H new ATOM 0 HD22 ASN A 949 -2.243 11.845 -9.851 1.00 0.00 H new ATOM 961 N VAL A 950 -3.383 8.762 -5.526 1.00 0.00 N ATOM 962 CA VAL A 950 -3.076 7.466 -4.934 1.00 0.00 C ATOM 963 C VAL A 950 -4.292 6.885 -4.221 1.00 0.00 C ATOM 964 O VAL A 950 -4.332 5.693 -3.910 1.00 0.00 O ATOM 965 CB VAL A 950 -1.909 7.568 -3.934 1.00 0.00 C ATOM 966 CG1 VAL A 950 -2.372 8.211 -2.635 1.00 0.00 C ATOM 967 CG2 VAL A 950 -1.309 6.194 -3.673 1.00 0.00 C ATOM 0 H VAL A 950 -2.778 9.522 -5.215 1.00 0.00 H new ATOM 0 HA VAL A 950 -2.788 6.805 -5.752 1.00 0.00 H new ATOM 0 HB VAL A 950 -1.136 8.201 -4.369 1.00 0.00 H new ATOM 0 HG11 VAL A 950 -1.534 8.274 -1.941 1.00 0.00 H new ATOM 0 HG12 VAL A 950 -2.750 9.213 -2.839 1.00 0.00 H new ATOM 0 HG13 VAL A 950 -3.164 7.607 -2.192 1.00 0.00 H new ATOM 0 HG21 VAL A 950 -0.486 6.285 -2.964 1.00 0.00 H new ATOM 0 HG22 VAL A 950 -2.073 5.536 -3.259 1.00 0.00 H new ATOM 0 HG23 VAL A 950 -0.938 5.775 -4.608 1.00 0.00 H new ATOM 977 N LEU A 951 -5.282 7.733 -3.965 1.00 0.00 N ATOM 978 CA LEU A 951 -6.501 7.304 -3.289 1.00 0.00 C ATOM 979 C LEU A 951 -7.153 6.140 -4.029 1.00 0.00 C ATOM 980 O LEU A 951 -7.823 5.304 -3.422 1.00 0.00 O ATOM 981 CB LEU A 951 -7.485 8.470 -3.182 1.00 0.00 C ATOM 982 CG LEU A 951 -7.193 9.496 -2.087 1.00 0.00 C ATOM 983 CD1 LEU A 951 -8.217 10.620 -2.122 1.00 0.00 C ATOM 984 CD2 LEU A 951 -7.179 8.828 -0.720 1.00 0.00 C ATOM 0 H LEU A 951 -5.264 8.722 -4.215 1.00 0.00 H new ATOM 0 HA LEU A 951 -6.233 6.969 -2.287 1.00 0.00 H new ATOM 0 HB2 LEU A 951 -7.509 8.988 -4.141 1.00 0.00 H new ATOM 0 HB3 LEU A 951 -8.482 8.063 -3.015 1.00 0.00 H new ATOM 0 HG LEU A 951 -6.207 9.924 -2.270 1.00 0.00 H new ATOM 0 HD11 LEU A 951 -7.993 11.341 -1.336 1.00 0.00 H new ATOM 0 HD12 LEU A 951 -8.179 11.117 -3.091 1.00 0.00 H new ATOM 0 HD13 LEU A 951 -9.214 10.209 -1.964 1.00 0.00 H new ATOM 0 HD21 LEU A 951 -6.970 9.573 0.047 1.00 0.00 H new ATOM 0 HD22 LEU A 951 -8.150 8.372 -0.528 1.00 0.00 H new ATOM 0 HD23 LEU A 951 -6.407 8.059 -0.699 1.00 0.00 H new ATOM 996 N SER A 952 -6.950 6.091 -5.341 1.00 0.00 N ATOM 997 CA SER A 952 -7.520 5.030 -6.164 1.00 0.00 C ATOM 998 C SER A 952 -7.099 3.657 -5.648 1.00 0.00 C ATOM 999 O SER A 952 -7.768 2.654 -5.900 1.00 0.00 O ATOM 1000 CB SER A 952 -7.083 5.196 -7.621 1.00 0.00 C ATOM 1001 OG SER A 952 -7.559 6.417 -8.160 1.00 0.00 O ATOM 0 H SER A 952 -6.395 6.773 -5.858 1.00 0.00 H new ATOM 0 HA SER A 952 -8.606 5.103 -6.107 1.00 0.00 H new ATOM 0 HB2 SER A 952 -5.995 5.167 -7.683 1.00 0.00 H new ATOM 0 HB3 SER A 952 -7.459 4.362 -8.214 1.00 0.00 H new ATOM 0 HG SER A 952 -6.986 7.153 -7.859 1.00 0.00 H new ATOM 1007 N LEU A 953 -5.985 3.621 -4.924 1.00 0.00 N ATOM 1008 CA LEU A 953 -5.473 2.371 -4.372 1.00 0.00 C ATOM 1009 C LEU A 953 -6.190 2.016 -3.073 1.00 0.00 C ATOM 1010 O LEU A 953 -5.795 1.089 -2.368 1.00 0.00 O ATOM 1011 CB LEU A 953 -3.968 2.480 -4.123 1.00 0.00 C ATOM 1012 CG LEU A 953 -3.073 2.352 -5.356 1.00 0.00 C ATOM 1013 CD1 LEU A 953 -1.653 2.792 -5.034 1.00 0.00 C ATOM 1014 CD2 LEU A 953 -3.084 0.922 -5.876 1.00 0.00 C ATOM 0 H LEU A 953 -5.420 4.442 -4.706 1.00 0.00 H new ATOM 0 HA LEU A 953 -5.659 1.579 -5.097 1.00 0.00 H new ATOM 0 HB2 LEU A 953 -3.767 3.442 -3.651 1.00 0.00 H new ATOM 0 HB3 LEU A 953 -3.681 1.708 -3.409 1.00 0.00 H new ATOM 0 HG LEU A 953 -3.466 3.005 -6.135 1.00 0.00 H new ATOM 0 HD11 LEU A 953 -1.031 2.694 -5.924 1.00 0.00 H new ATOM 0 HD12 LEU A 953 -1.659 3.832 -4.709 1.00 0.00 H new ATOM 0 HD13 LEU A 953 -1.250 2.166 -4.238 1.00 0.00 H new ATOM 0 HD21 LEU A 953 -2.442 0.849 -6.754 1.00 0.00 H new ATOM 0 HD22 LEU A 953 -2.716 0.250 -5.101 1.00 0.00 H new ATOM 0 HD23 LEU A 953 -4.102 0.641 -6.147 1.00 0.00 H new ATOM 1026 N ASN A 954 -7.249 2.759 -2.765 1.00 0.00 N ATOM 1027 CA ASN A 954 -8.022 2.521 -1.552 1.00 0.00 C ATOM 1028 C ASN A 954 -8.805 1.215 -1.653 1.00 0.00 C ATOM 1029 O ASN A 954 -9.652 1.054 -2.530 1.00 0.00 O ATOM 1030 CB ASN A 954 -8.982 3.686 -1.298 1.00 0.00 C ATOM 1031 CG ASN A 954 -10.244 3.248 -0.581 1.00 0.00 C ATOM 1032 OD1 ASN A 954 -10.258 3.099 0.642 1.00 0.00 O ATOM 1033 ND2 ASN A 954 -11.314 3.040 -1.340 1.00 0.00 N ATOM 0 H ASN A 954 -7.591 3.530 -3.339 1.00 0.00 H new ATOM 0 HA ASN A 954 -7.326 2.443 -0.717 1.00 0.00 H new ATOM 0 HB2 ASN A 954 -8.476 4.448 -0.705 1.00 0.00 H new ATOM 0 HB3 ASN A 954 -9.249 4.147 -2.249 1.00 0.00 H new ATOM 0 HD21 ASN A 954 -12.192 2.745 -0.913 1.00 0.00 H new ATOM 0 HD22 ASN A 954 -11.257 3.176 -2.349 1.00 0.00 H new ATOM 1040 N GLY A 955 -8.515 0.286 -0.748 1.00 0.00 N ATOM 1041 CA GLY A 955 -9.200 -0.993 -0.752 1.00 0.00 C ATOM 1042 C GLY A 955 -8.467 -2.041 -1.567 1.00 0.00 C ATOM 1043 O GLY A 955 -8.613 -3.239 -1.327 1.00 0.00 O ATOM 0 H GLY A 955 -7.818 0.396 -0.012 1.00 0.00 H new ATOM 0 HA2 GLY A 955 -9.310 -1.346 0.273 1.00 0.00 H new ATOM 0 HA3 GLY A 955 -10.205 -0.862 -1.154 1.00 0.00 H new ATOM 1047 N LYS A 956 -7.678 -1.589 -2.536 1.00 0.00 N ATOM 1048 CA LYS A 956 -6.920 -2.495 -3.390 1.00 0.00 C ATOM 1049 C LYS A 956 -6.263 -3.598 -2.567 1.00 0.00 C ATOM 1050 O LYS A 956 -5.580 -3.325 -1.581 1.00 0.00 O ATOM 1051 CB LYS A 956 -5.853 -1.721 -4.169 1.00 0.00 C ATOM 1052 CG LYS A 956 -5.510 -2.342 -5.512 1.00 0.00 C ATOM 1053 CD LYS A 956 -4.372 -3.342 -5.390 1.00 0.00 C ATOM 1054 CE LYS A 956 -3.894 -3.812 -6.755 1.00 0.00 C ATOM 1055 NZ LYS A 956 -4.956 -4.555 -7.489 1.00 0.00 N ATOM 0 H LYS A 956 -7.547 -0.600 -2.749 1.00 0.00 H new ATOM 0 HA LYS A 956 -7.613 -2.956 -4.094 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -6.200 -0.700 -4.328 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -4.948 -1.659 -3.565 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -6.390 -2.839 -5.919 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -5.232 -1.558 -6.216 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -3.542 -2.886 -4.850 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -4.701 -4.200 -4.804 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -3.578 -2.952 -7.345 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -3.021 -4.453 -6.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -4.571 -4.917 -8.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -5.287 -5.351 -6.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -5.752 -3.916 -7.688 1.00 0.00 H new ATOM 1069 N GLU A 957 -6.475 -4.844 -2.979 1.00 0.00 N ATOM 1070 CA GLU A 957 -5.902 -5.987 -2.279 1.00 0.00 C ATOM 1071 C GLU A 957 -4.563 -6.386 -2.892 1.00 0.00 C ATOM 1072 O GLU A 957 -4.433 -6.493 -4.112 1.00 0.00 O ATOM 1073 CB GLU A 957 -6.867 -7.174 -2.319 1.00 0.00 C ATOM 1074 CG GLU A 957 -6.263 -8.468 -1.801 1.00 0.00 C ATOM 1075 CD GLU A 957 -7.298 -9.392 -1.189 1.00 0.00 C ATOM 1076 OE1 GLU A 957 -7.572 -9.255 0.022 1.00 0.00 O ATOM 1077 OE2 GLU A 957 -7.834 -10.251 -1.919 1.00 0.00 O ATOM 0 H GLU A 957 -7.039 -5.087 -3.793 1.00 0.00 H new ATOM 0 HA GLU A 957 -5.735 -5.698 -1.241 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -7.750 -6.933 -1.728 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -7.202 -7.325 -3.345 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -5.761 -8.983 -2.620 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -5.502 -8.236 -1.055 1.00 0.00 H new ATOM 1084 N LEU A 958 -3.570 -6.605 -2.038 1.00 0.00 N ATOM 1085 CA LEU A 958 -2.239 -6.992 -2.494 1.00 0.00 C ATOM 1086 C LEU A 958 -1.558 -7.903 -1.478 1.00 0.00 C ATOM 1087 O LEU A 958 -1.914 -7.911 -0.298 1.00 0.00 O ATOM 1088 CB LEU A 958 -1.381 -5.749 -2.738 1.00 0.00 C ATOM 1089 CG LEU A 958 -0.162 -5.942 -3.641 1.00 0.00 C ATOM 1090 CD1 LEU A 958 -0.596 -6.204 -5.075 1.00 0.00 C ATOM 1091 CD2 LEU A 958 0.751 -4.727 -3.572 1.00 0.00 C ATOM 0 H LEU A 958 -3.661 -6.521 -1.025 1.00 0.00 H new ATOM 0 HA LEU A 958 -2.348 -7.541 -3.430 1.00 0.00 H new ATOM 0 HB2 LEU A 958 -2.013 -4.976 -3.175 1.00 0.00 H new ATOM 0 HB3 LEU A 958 -1.038 -5.374 -1.774 1.00 0.00 H new ATOM 0 HG LEU A 958 0.394 -6.810 -3.287 1.00 0.00 H new ATOM 0 HD11 LEU A 958 0.285 -6.339 -5.703 1.00 0.00 H new ATOM 0 HD12 LEU A 958 -1.209 -7.105 -5.111 1.00 0.00 H new ATOM 0 HD13 LEU A 958 -1.176 -5.356 -5.440 1.00 0.00 H new ATOM 0 HD21 LEU A 958 1.613 -4.882 -4.221 1.00 0.00 H new ATOM 0 HD22 LEU A 958 0.205 -3.842 -3.900 1.00 0.00 H new ATOM 0 HD23 LEU A 958 1.090 -4.585 -2.546 1.00 0.00 H new ATOM 1103 N LEU A 959 -0.575 -8.667 -1.941 1.00 0.00 N ATOM 1104 CA LEU A 959 0.158 -9.580 -1.072 1.00 0.00 C ATOM 1105 C LEU A 959 -0.782 -10.269 -0.088 1.00 0.00 C ATOM 1106 O LEU A 959 -0.498 -10.347 1.107 1.00 0.00 O ATOM 1107 CB LEU A 959 1.248 -8.825 -0.309 1.00 0.00 C ATOM 1108 CG LEU A 959 2.533 -8.535 -1.086 1.00 0.00 C ATOM 1109 CD1 LEU A 959 3.449 -7.626 -0.282 1.00 0.00 C ATOM 1110 CD2 LEU A 959 3.245 -9.832 -1.442 1.00 0.00 C ATOM 0 H LEU A 959 -0.267 -8.672 -2.913 1.00 0.00 H new ATOM 0 HA LEU A 959 0.622 -10.343 -1.697 1.00 0.00 H new ATOM 0 HB2 LEU A 959 0.833 -7.877 0.035 1.00 0.00 H new ATOM 0 HB3 LEU A 959 1.507 -9.401 0.580 1.00 0.00 H new ATOM 0 HG LEU A 959 2.268 -8.023 -2.011 1.00 0.00 H new ATOM 0 HD11 LEU A 959 4.358 -7.431 -0.851 1.00 0.00 H new ATOM 0 HD12 LEU A 959 2.939 -6.684 -0.078 1.00 0.00 H new ATOM 0 HD13 LEU A 959 3.707 -8.110 0.660 1.00 0.00 H new ATOM 0 HD21 LEU A 959 4.157 -9.607 -1.995 1.00 0.00 H new ATOM 0 HD22 LEU A 959 3.498 -10.371 -0.529 1.00 0.00 H new ATOM 0 HD23 LEU A 959 2.591 -10.449 -2.058 1.00 0.00 H new ATOM 1122 N ASN A 960 -1.902 -10.770 -0.599 1.00 0.00 N ATOM 1123 CA ASN A 960 -2.884 -11.454 0.234 1.00 0.00 C ATOM 1124 C ASN A 960 -3.196 -10.640 1.486 1.00 0.00 C ATOM 1125 O ASN A 960 -3.306 -11.188 2.583 1.00 0.00 O ATOM 1126 CB ASN A 960 -2.371 -12.841 0.628 1.00 0.00 C ATOM 1127 CG ASN A 960 -1.723 -13.569 -0.534 1.00 0.00 C ATOM 1128 OD1 ASN A 960 -2.382 -14.311 -1.262 1.00 0.00 O ATOM 1129 ND2 ASN A 960 -0.424 -13.358 -0.713 1.00 0.00 N ATOM 0 H ASN A 960 -2.152 -10.715 -1.586 1.00 0.00 H new ATOM 0 HA ASN A 960 -3.801 -11.564 -0.344 1.00 0.00 H new ATOM 0 HB2 ASN A 960 -1.649 -12.742 1.439 1.00 0.00 H new ATOM 0 HB3 ASN A 960 -3.200 -13.437 1.010 1.00 0.00 H new ATOM 0 HD21 ASN A 960 0.067 -13.820 -1.479 1.00 0.00 H new ATOM 0 HD22 ASN A 960 0.083 -12.734 -0.085 1.00 0.00 H new ATOM 1136 N ARG A 961 -3.338 -9.330 1.314 1.00 0.00 N ATOM 1137 CA ARG A 961 -3.636 -8.441 2.430 1.00 0.00 C ATOM 1138 C ARG A 961 -4.399 -7.208 1.954 1.00 0.00 C ATOM 1139 O ARG A 961 -3.874 -6.396 1.191 1.00 0.00 O ATOM 1140 CB ARG A 961 -2.345 -8.016 3.131 1.00 0.00 C ATOM 1141 CG ARG A 961 -1.862 -9.011 4.174 1.00 0.00 C ATOM 1142 CD ARG A 961 -0.545 -8.572 4.794 1.00 0.00 C ATOM 1143 NE ARG A 961 -0.243 -9.311 6.018 1.00 0.00 N ATOM 1144 CZ ARG A 961 0.351 -10.498 6.031 1.00 0.00 C ATOM 1145 NH1 ARG A 961 0.707 -11.079 4.894 1.00 0.00 N ATOM 1146 NH2 ARG A 961 0.592 -11.108 7.185 1.00 0.00 N ATOM 0 H ARG A 961 -3.251 -8.861 0.412 1.00 0.00 H new ATOM 0 HA ARG A 961 -4.263 -8.985 3.137 1.00 0.00 H new ATOM 0 HB2 ARG A 961 -1.564 -7.878 2.383 1.00 0.00 H new ATOM 0 HB3 ARG A 961 -2.502 -7.049 3.609 1.00 0.00 H new ATOM 0 HG2 ARG A 961 -2.616 -9.116 4.954 1.00 0.00 H new ATOM 0 HG3 ARG A 961 -1.740 -9.992 3.714 1.00 0.00 H new ATOM 0 HD2 ARG A 961 0.261 -8.718 4.074 1.00 0.00 H new ATOM 0 HD3 ARG A 961 -0.586 -7.505 5.015 1.00 0.00 H new ATOM 0 HE ARG A 961 -0.503 -8.892 6.911 1.00 0.00 H new ATOM 0 HH11 ARG A 961 0.525 -10.614 4.005 1.00 0.00 H new ATOM 0 HH12 ARG A 961 1.163 -11.991 4.908 1.00 0.00 H new ATOM 0 HH21 ARG A 961 0.321 -10.665 8.063 1.00 0.00 H new ATOM 0 HH22 ARG A 961 1.048 -12.020 7.194 1.00 0.00 H new ATOM 1160 N THR A 962 -5.641 -7.074 2.409 1.00 0.00 N ATOM 1161 CA THR A 962 -6.476 -5.942 2.028 1.00 0.00 C ATOM 1162 C THR A 962 -5.946 -4.643 2.625 1.00 0.00 C ATOM 1163 O THR A 962 -5.782 -4.529 3.840 1.00 0.00 O ATOM 1164 CB THR A 962 -7.935 -6.143 2.480 1.00 0.00 C ATOM 1165 OG1 THR A 962 -8.383 -7.454 2.118 1.00 0.00 O ATOM 1166 CG2 THR A 962 -8.845 -5.099 1.851 1.00 0.00 C ATOM 0 H THR A 962 -6.091 -7.736 3.042 1.00 0.00 H new ATOM 0 HA THR A 962 -6.446 -5.878 0.940 1.00 0.00 H new ATOM 0 HB THR A 962 -7.976 -6.032 3.564 1.00 0.00 H new ATOM 0 HG1 THR A 962 -7.888 -7.763 1.331 1.00 0.00 H new ATOM 0 HG21 THR A 962 -9.870 -5.261 2.185 1.00 0.00 H new ATOM 0 HG22 THR A 962 -8.519 -4.103 2.152 1.00 0.00 H new ATOM 0 HG23 THR A 962 -8.799 -5.183 0.765 1.00 0.00 H new ATOM 1174 N ILE A 963 -5.682 -3.666 1.764 1.00 0.00 N ATOM 1175 CA ILE A 963 -5.172 -2.374 2.207 1.00 0.00 C ATOM 1176 C ILE A 963 -6.246 -1.296 2.105 1.00 0.00 C ATOM 1177 O ILE A 963 -7.059 -1.298 1.181 1.00 0.00 O ATOM 1178 CB ILE A 963 -3.945 -1.941 1.384 1.00 0.00 C ATOM 1179 CG1 ILE A 963 -2.815 -2.960 1.537 1.00 0.00 C ATOM 1180 CG2 ILE A 963 -3.481 -0.557 1.814 1.00 0.00 C ATOM 1181 CD1 ILE A 963 -1.686 -2.764 0.549 1.00 0.00 C ATOM 0 H ILE A 963 -5.813 -3.744 0.755 1.00 0.00 H new ATOM 0 HA ILE A 963 -4.876 -2.491 3.249 1.00 0.00 H new ATOM 0 HB ILE A 963 -4.228 -1.897 0.332 1.00 0.00 H new ATOM 0 HG12 ILE A 963 -2.416 -2.898 2.549 1.00 0.00 H new ATOM 0 HG13 ILE A 963 -3.223 -3.964 1.416 1.00 0.00 H new ATOM 0 HG21 ILE A 963 -2.613 -0.264 1.223 1.00 0.00 H new ATOM 0 HG22 ILE A 963 -4.285 0.162 1.657 1.00 0.00 H new ATOM 0 HG23 ILE A 963 -3.212 -0.575 2.870 1.00 0.00 H new ATOM 0 HD11 ILE A 963 -0.921 -3.522 0.716 1.00 0.00 H new ATOM 0 HD12 ILE A 963 -2.071 -2.855 -0.467 1.00 0.00 H new ATOM 0 HD13 ILE A 963 -1.252 -1.774 0.685 1.00 0.00 H new ATOM 1193 N THR A 964 -6.242 -0.373 3.062 1.00 0.00 N ATOM 1194 CA THR A 964 -7.214 0.713 3.080 1.00 0.00 C ATOM 1195 C THR A 964 -6.527 2.064 3.235 1.00 0.00 C ATOM 1196 O THR A 964 -5.872 2.326 4.244 1.00 0.00 O ATOM 1197 CB THR A 964 -8.233 0.535 4.222 1.00 0.00 C ATOM 1198 OG1 THR A 964 -8.718 -0.813 4.240 1.00 0.00 O ATOM 1199 CG2 THR A 964 -9.401 1.497 4.060 1.00 0.00 C ATOM 0 H THR A 964 -5.576 -0.356 3.835 1.00 0.00 H new ATOM 0 HA THR A 964 -7.739 0.683 2.125 1.00 0.00 H new ATOM 0 HB THR A 964 -7.731 0.753 5.165 1.00 0.00 H new ATOM 0 HG1 THR A 964 -9.364 -0.919 4.970 1.00 0.00 H new ATOM 0 HG21 THR A 964 -10.107 1.353 4.878 1.00 0.00 H new ATOM 0 HG22 THR A 964 -9.032 2.523 4.075 1.00 0.00 H new ATOM 0 HG23 THR A 964 -9.901 1.305 3.111 1.00 0.00 H new ATOM 1207 N ILE A 965 -6.680 2.919 2.229 1.00 0.00 N ATOM 1208 CA ILE A 965 -6.075 4.245 2.255 1.00 0.00 C ATOM 1209 C ILE A 965 -7.085 5.302 2.686 1.00 0.00 C ATOM 1210 O ILE A 965 -8.270 5.210 2.366 1.00 0.00 O ATOM 1211 CB ILE A 965 -5.503 4.629 0.877 1.00 0.00 C ATOM 1212 CG1 ILE A 965 -4.643 3.492 0.322 1.00 0.00 C ATOM 1213 CG2 ILE A 965 -4.692 5.912 0.980 1.00 0.00 C ATOM 1214 CD1 ILE A 965 -4.355 3.619 -1.157 1.00 0.00 C ATOM 0 H ILE A 965 -7.218 2.717 1.386 1.00 0.00 H new ATOM 0 HA ILE A 965 -5.262 4.207 2.980 1.00 0.00 H new ATOM 0 HB ILE A 965 -6.332 4.800 0.190 1.00 0.00 H new ATOM 0 HG12 ILE A 965 -3.699 3.462 0.866 1.00 0.00 H new ATOM 0 HG13 ILE A 965 -5.147 2.543 0.506 1.00 0.00 H new ATOM 0 HG21 ILE A 965 -4.294 6.171 -0.001 1.00 0.00 H new ATOM 0 HG22 ILE A 965 -5.332 6.719 1.337 1.00 0.00 H new ATOM 0 HG23 ILE A 965 -3.868 5.767 1.679 1.00 0.00 H new ATOM 0 HD11 ILE A 965 -3.741 2.779 -1.482 1.00 0.00 H new ATOM 0 HD12 ILE A 965 -5.293 3.618 -1.712 1.00 0.00 H new ATOM 0 HD13 ILE A 965 -3.823 4.551 -1.345 1.00 0.00 H new ATOM 1226 N ALA A 966 -6.608 6.306 3.414 1.00 0.00 N ATOM 1227 CA ALA A 966 -7.468 7.384 3.886 1.00 0.00 C ATOM 1228 C ALA A 966 -6.664 8.651 4.156 1.00 0.00 C ATOM 1229 O ALA A 966 -5.646 8.617 4.848 1.00 0.00 O ATOM 1230 CB ALA A 966 -8.214 6.953 5.141 1.00 0.00 C ATOM 0 H ALA A 966 -5.630 6.395 3.690 1.00 0.00 H new ATOM 0 HA ALA A 966 -8.193 7.606 3.103 1.00 0.00 H new ATOM 0 HB1 ALA A 966 -8.852 7.768 5.483 1.00 0.00 H new ATOM 0 HB2 ALA A 966 -8.828 6.080 4.918 1.00 0.00 H new ATOM 0 HB3 ALA A 966 -7.497 6.702 5.922 1.00 0.00 H new ATOM 1236 N LEU A 967 -7.126 9.768 3.605 1.00 0.00 N ATOM 1237 CA LEU A 967 -6.449 11.047 3.785 1.00 0.00 C ATOM 1238 C LEU A 967 -6.492 11.485 5.246 1.00 0.00 C ATOM 1239 O LEU A 967 -7.352 11.049 6.011 1.00 0.00 O ATOM 1240 CB LEU A 967 -7.092 12.117 2.901 1.00 0.00 C ATOM 1241 CG LEU A 967 -6.708 12.085 1.421 1.00 0.00 C ATOM 1242 CD1 LEU A 967 -7.535 13.088 0.633 1.00 0.00 C ATOM 1243 CD2 LEU A 967 -5.222 12.364 1.250 1.00 0.00 C ATOM 0 H LEU A 967 -7.967 9.814 3.030 1.00 0.00 H new ATOM 0 HA LEU A 967 -5.406 10.922 3.492 1.00 0.00 H new ATOM 0 HB2 LEU A 967 -8.175 12.020 2.977 1.00 0.00 H new ATOM 0 HB3 LEU A 967 -6.831 13.096 3.302 1.00 0.00 H new ATOM 0 HG LEU A 967 -6.917 11.088 1.032 1.00 0.00 H new ATOM 0 HD11 LEU A 967 -7.248 13.051 -0.418 1.00 0.00 H new ATOM 0 HD12 LEU A 967 -8.593 12.843 0.729 1.00 0.00 H new ATOM 0 HD13 LEU A 967 -7.358 14.091 1.022 1.00 0.00 H new ATOM 0 HD21 LEU A 967 -4.966 12.337 0.191 1.00 0.00 H new ATOM 0 HD22 LEU A 967 -4.988 13.348 1.655 1.00 0.00 H new ATOM 0 HD23 LEU A 967 -4.646 11.606 1.781 1.00 0.00 H new ATOM 1255 N LYS A 968 -5.559 12.351 5.626 1.00 0.00 N ATOM 1256 CA LYS A 968 -5.492 12.852 6.994 1.00 0.00 C ATOM 1257 C LYS A 968 -6.272 14.156 7.135 1.00 0.00 C ATOM 1258 O LYS A 968 -6.382 14.930 6.185 1.00 0.00 O ATOM 1259 CB LYS A 968 -4.035 13.070 7.408 1.00 0.00 C ATOM 1260 CG LYS A 968 -3.863 13.397 8.881 1.00 0.00 C ATOM 1261 CD LYS A 968 -3.951 12.149 9.743 1.00 0.00 C ATOM 1262 CE LYS A 968 -4.043 12.497 11.221 1.00 0.00 C ATOM 1263 NZ LYS A 968 -4.534 11.348 12.032 1.00 0.00 N ATOM 0 H LYS A 968 -4.838 12.721 5.006 1.00 0.00 H new ATOM 0 HA LYS A 968 -5.942 12.107 7.650 1.00 0.00 H new ATOM 0 HB2 LYS A 968 -3.462 12.173 7.174 1.00 0.00 H new ATOM 0 HB3 LYS A 968 -3.615 13.881 6.813 1.00 0.00 H new ATOM 0 HG2 LYS A 968 -2.899 13.881 9.037 1.00 0.00 H new ATOM 0 HG3 LYS A 968 -4.630 14.108 9.189 1.00 0.00 H new ATOM 0 HD2 LYS A 968 -4.824 11.565 9.451 1.00 0.00 H new ATOM 0 HD3 LYS A 968 -3.076 11.523 9.569 1.00 0.00 H new ATOM 0 HE2 LYS A 968 -3.062 12.804 11.583 1.00 0.00 H new ATOM 0 HE3 LYS A 968 -4.712 13.347 11.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 968 -4.902 11.696 12.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 968 -5.292 10.858 11.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 968 -3.751 10.687 12.207 1.00 0.00 H new