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 Set 1.1: A 920 GLN : amide:sc= -2.02 K(o=-3.9,f=-6.9) USER MOD Set 1.2: A 956 LYS NZ :NH3+ -164:sc= -1.86 (180deg=0) USER MOD Set 2.1: A 894 THR OG1 : rot 36:sc= 0.0214 USER MOD Set 2.2: A 940 THR OG1 : rot -170:sc= 0 USER MOD Single : A 898 SER OG : rot 180:sc= -0.088 USER MOD Single : A 919 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 923 SER OG : rot -115:sc= 1.08 USER MOD Single : A 936 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0253) USER MOD Single : A 937 MET CE :methyl 170:sc= 0 (180deg=-0.043) USER MOD Single : A 945 SER OG : rot 180:sc= 0 USER MOD Single : A 946 SER OG : rot 40:sc= -0.266 USER MOD Single : A 949 ASN : amide:sc= 0.691 K(o=0.69,f=0) USER MOD Single : A 952 SER OG : rot 180:sc= 0 USER MOD Single : A 954 ASN : amide:sc= -0.847 X(o=-0.85,f=-0.88) USER MOD Single : A 960 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 962 THR OG1 : rot -48:sc= 0.248 USER MOD Single : A 964 THR OG1 : rot 180:sc= 0 USER MOD Single : A 968 LYS NZ :NH3+ 167:sc= 1.3 (180deg=0.937) USER MOD ----------------------------------------------------------------- ATOM 73 N THR A 894 0.016 13.753 3.751 1.00 0.00 N ATOM 74 CA THR A 894 0.126 12.550 4.566 1.00 0.00 C ATOM 75 C THR A 894 -1.123 11.684 4.439 1.00 0.00 C ATOM 76 O THR A 894 -2.220 12.100 4.812 1.00 0.00 O ATOM 77 CB THR A 894 0.349 12.895 6.050 1.00 0.00 C ATOM 78 OG1 THR A 894 1.591 13.589 6.210 1.00 0.00 O ATOM 79 CG2 THR A 894 0.351 11.637 6.904 1.00 0.00 C ATOM 0 HA THR A 894 0.989 11.996 4.196 1.00 0.00 H new ATOM 0 HB THR A 894 -0.469 13.536 6.378 1.00 0.00 H new ATOM 0 HG1 THR A 894 1.739 14.177 5.440 1.00 0.00 H new ATOM 0 HG21 THR A 894 0.510 11.906 7.948 1.00 0.00 H new ATOM 0 HG22 THR A 894 -0.607 11.127 6.803 1.00 0.00 H new ATOM 0 HG23 THR A 894 1.151 10.975 6.574 1.00 0.00 H new ATOM 87 N VAL A 895 -0.949 10.476 3.912 1.00 0.00 N ATOM 88 CA VAL A 895 -2.061 9.550 3.738 1.00 0.00 C ATOM 89 C VAL A 895 -1.922 8.345 4.661 1.00 0.00 C ATOM 90 O VAL A 895 -0.818 7.853 4.896 1.00 0.00 O ATOM 91 CB VAL A 895 -2.161 9.060 2.282 1.00 0.00 C ATOM 92 CG1 VAL A 895 -2.272 10.239 1.327 1.00 0.00 C ATOM 93 CG2 VAL A 895 -0.964 8.189 1.930 1.00 0.00 C ATOM 0 H VAL A 895 -0.048 10.116 3.598 1.00 0.00 H new ATOM 0 HA VAL A 895 -2.970 10.095 3.992 1.00 0.00 H new ATOM 0 HB VAL A 895 -3.063 8.457 2.182 1.00 0.00 H new ATOM 0 HG11 VAL A 895 -2.342 9.872 0.303 1.00 0.00 H new ATOM 0 HG12 VAL A 895 -3.164 10.818 1.566 1.00 0.00 H new ATOM 0 HG13 VAL A 895 -1.390 10.872 1.427 1.00 0.00 H new ATOM 0 HG21 VAL A 895 -1.051 7.851 0.897 1.00 0.00 H new ATOM 0 HG22 VAL A 895 -0.047 8.766 2.047 1.00 0.00 H new ATOM 0 HG23 VAL A 895 -0.936 7.324 2.593 1.00 0.00 H new ATOM 103 N LEU A 896 -3.049 7.872 5.181 1.00 0.00 N ATOM 104 CA LEU A 896 -3.055 6.722 6.078 1.00 0.00 C ATOM 105 C LEU A 896 -3.234 5.423 5.298 1.00 0.00 C ATOM 106 O LEU A 896 -3.918 5.390 4.276 1.00 0.00 O ATOM 107 CB LEU A 896 -4.169 6.864 7.116 1.00 0.00 C ATOM 108 CG LEU A 896 -3.866 7.776 8.306 1.00 0.00 C ATOM 109 CD1 LEU A 896 -3.155 9.038 7.843 1.00 0.00 C ATOM 110 CD2 LEU A 896 -5.147 8.125 9.050 1.00 0.00 C ATOM 0 H LEU A 896 -3.971 8.267 4.997 1.00 0.00 H new ATOM 0 HA LEU A 896 -2.093 6.688 6.589 1.00 0.00 H new ATOM 0 HB2 LEU A 896 -5.060 7.240 6.614 1.00 0.00 H new ATOM 0 HB3 LEU A 896 -4.412 5.872 7.497 1.00 0.00 H new ATOM 0 HG LEU A 896 -3.206 7.242 8.990 1.00 0.00 H new ATOM 0 HD11 LEU A 896 -2.947 9.675 8.703 1.00 0.00 H new ATOM 0 HD12 LEU A 896 -2.218 8.770 7.356 1.00 0.00 H new ATOM 0 HD13 LEU A 896 -3.790 9.575 7.138 1.00 0.00 H new ATOM 0 HD21 LEU A 896 -4.912 8.774 9.893 1.00 0.00 H new ATOM 0 HD22 LEU A 896 -5.831 8.640 8.375 1.00 0.00 H new ATOM 0 HD23 LEU A 896 -5.616 7.211 9.415 1.00 0.00 H new ATOM 122 N VAL A 897 -2.615 4.354 5.789 1.00 0.00 N ATOM 123 CA VAL A 897 -2.708 3.051 5.140 1.00 0.00 C ATOM 124 C VAL A 897 -2.672 1.923 6.165 1.00 0.00 C ATOM 125 O VAL A 897 -1.752 1.839 6.978 1.00 0.00 O ATOM 126 CB VAL A 897 -1.567 2.846 4.126 1.00 0.00 C ATOM 127 CG1 VAL A 897 -1.619 1.443 3.541 1.00 0.00 C ATOM 128 CG2 VAL A 897 -1.638 3.894 3.026 1.00 0.00 C ATOM 0 H VAL A 897 -2.044 4.364 6.634 1.00 0.00 H new ATOM 0 HA VAL A 897 -3.661 3.028 4.612 1.00 0.00 H new ATOM 0 HB VAL A 897 -0.616 2.962 4.646 1.00 0.00 H new ATOM 0 HG11 VAL A 897 -0.805 1.316 2.827 1.00 0.00 H new ATOM 0 HG12 VAL A 897 -1.516 0.711 4.342 1.00 0.00 H new ATOM 0 HG13 VAL A 897 -2.573 1.295 3.035 1.00 0.00 H new ATOM 0 HG21 VAL A 897 -0.825 3.734 2.318 1.00 0.00 H new ATOM 0 HG22 VAL A 897 -2.593 3.812 2.506 1.00 0.00 H new ATOM 0 HG23 VAL A 897 -1.548 4.888 3.464 1.00 0.00 H new ATOM 138 N SER A 898 -3.679 1.057 6.119 1.00 0.00 N ATOM 139 CA SER A 898 -3.764 -0.066 7.046 1.00 0.00 C ATOM 140 C SER A 898 -3.907 -1.384 6.291 1.00 0.00 C ATOM 141 O SER A 898 -4.376 -1.412 5.153 1.00 0.00 O ATOM 142 CB SER A 898 -4.947 0.120 7.998 1.00 0.00 C ATOM 143 OG SER A 898 -5.305 -1.105 8.613 1.00 0.00 O ATOM 0 H SER A 898 -4.447 1.111 5.450 1.00 0.00 H new ATOM 0 HA SER A 898 -2.841 -0.097 7.626 1.00 0.00 H new ATOM 0 HB2 SER A 898 -4.690 0.853 8.763 1.00 0.00 H new ATOM 0 HB3 SER A 898 -5.800 0.518 7.449 1.00 0.00 H new ATOM 0 HG SER A 898 -6.062 -0.958 9.218 1.00 0.00 H new ATOM 149 N ILE A 899 -3.500 -2.473 6.934 1.00 0.00 N ATOM 150 CA ILE A 899 -3.583 -3.795 6.324 1.00 0.00 C ATOM 151 C ILE A 899 -4.427 -4.739 7.173 1.00 0.00 C ATOM 152 O ILE A 899 -4.307 -4.767 8.398 1.00 0.00 O ATOM 153 CB ILE A 899 -2.186 -4.412 6.125 1.00 0.00 C ATOM 154 CG1 ILE A 899 -1.301 -4.128 7.341 1.00 0.00 C ATOM 155 CG2 ILE A 899 -1.542 -3.869 4.858 1.00 0.00 C ATOM 156 CD1 ILE A 899 -0.245 -5.185 7.580 1.00 0.00 C ATOM 0 H ILE A 899 -3.110 -2.467 7.876 1.00 0.00 H new ATOM 0 HA ILE A 899 -4.055 -3.665 5.350 1.00 0.00 H new ATOM 0 HB ILE A 899 -2.294 -5.492 6.021 1.00 0.00 H new ATOM 0 HG12 ILE A 899 -0.813 -3.162 7.208 1.00 0.00 H new ATOM 0 HG13 ILE A 899 -1.930 -4.048 8.227 1.00 0.00 H new ATOM 0 HG21 ILE A 899 -0.555 -4.315 4.732 1.00 0.00 H new ATOM 0 HG22 ILE A 899 -2.165 -4.117 3.998 1.00 0.00 H new ATOM 0 HG23 ILE A 899 -1.444 -2.786 4.935 1.00 0.00 H new ATOM 0 HD11 ILE A 899 0.345 -4.918 8.457 1.00 0.00 H new ATOM 0 HD12 ILE A 899 -0.726 -6.149 7.745 1.00 0.00 H new ATOM 0 HD13 ILE A 899 0.408 -5.250 6.710 1.00 0.00 H new ATOM 308 N PHE A 909 3.128 -3.822 9.137 1.00 0.00 N ATOM 309 CA PHE A 909 3.526 -3.868 7.735 1.00 0.00 C ATOM 310 C PHE A 909 4.884 -4.546 7.577 1.00 0.00 C ATOM 311 O PHE A 909 5.857 -4.171 8.232 1.00 0.00 O ATOM 312 CB PHE A 909 3.579 -2.455 7.151 1.00 0.00 C ATOM 313 CG PHE A 909 2.223 -1.840 6.947 1.00 0.00 C ATOM 314 CD1 PHE A 909 1.579 -1.190 7.987 1.00 0.00 C ATOM 315 CD2 PHE A 909 1.594 -1.913 5.715 1.00 0.00 C ATOM 316 CE1 PHE A 909 0.332 -0.623 7.802 1.00 0.00 C ATOM 317 CE2 PHE A 909 0.347 -1.348 5.524 1.00 0.00 C ATOM 318 CZ PHE A 909 -0.285 -0.703 6.569 1.00 0.00 C ATOM 0 HA PHE A 909 2.782 -4.451 7.192 1.00 0.00 H new ATOM 0 HB2 PHE A 909 4.162 -1.817 7.815 1.00 0.00 H new ATOM 0 HB3 PHE A 909 4.103 -2.484 6.196 1.00 0.00 H new ATOM 0 HD1 PHE A 909 2.057 -1.125 8.953 1.00 0.00 H new ATOM 0 HD2 PHE A 909 2.083 -2.417 4.895 1.00 0.00 H new ATOM 0 HE1 PHE A 909 -0.159 -0.118 8.621 1.00 0.00 H new ATOM 0 HE2 PHE A 909 -0.133 -1.411 4.558 1.00 0.00 H new ATOM 0 HZ PHE A 909 -1.260 -0.262 6.422 1.00 0.00 H new ATOM 328 N ASP A 910 4.941 -5.547 6.706 1.00 0.00 N ATOM 329 CA ASP A 910 6.179 -6.278 6.461 1.00 0.00 C ATOM 330 C ASP A 910 6.943 -5.675 5.287 1.00 0.00 C ATOM 331 O ASP A 910 6.368 -4.976 4.452 1.00 0.00 O ATOM 332 CB ASP A 910 5.880 -7.753 6.187 1.00 0.00 C ATOM 333 CG ASP A 910 5.072 -8.396 7.297 1.00 0.00 C ATOM 334 OD1 ASP A 910 5.601 -8.515 8.423 1.00 0.00 O ATOM 335 OD2 ASP A 910 3.912 -8.779 7.041 1.00 0.00 O ATOM 0 H ASP A 910 4.144 -5.871 6.158 1.00 0.00 H new ATOM 0 HA ASP A 910 6.800 -6.201 7.354 1.00 0.00 H new ATOM 0 HB2 ASP A 910 5.335 -7.842 5.247 1.00 0.00 H new ATOM 0 HB3 ASP A 910 6.818 -8.294 6.064 1.00 0.00 H new ATOM 340 N ASP A 911 8.242 -5.948 5.230 1.00 0.00 N ATOM 341 CA ASP A 911 9.086 -5.432 4.158 1.00 0.00 C ATOM 342 C ASP A 911 8.406 -5.600 2.802 1.00 0.00 C ATOM 343 O ASP A 911 8.324 -4.656 2.017 1.00 0.00 O ATOM 344 CB ASP A 911 10.438 -6.147 4.156 1.00 0.00 C ATOM 345 CG ASP A 911 11.033 -6.263 5.545 1.00 0.00 C ATOM 346 OD1 ASP A 911 10.747 -7.266 6.231 1.00 0.00 O ATOM 347 OD2 ASP A 911 11.785 -5.350 5.947 1.00 0.00 O ATOM 0 H ASP A 911 8.734 -6.524 5.914 1.00 0.00 H new ATOM 0 HA ASP A 911 9.246 -4.368 4.335 1.00 0.00 H new ATOM 0 HB2 ASP A 911 10.318 -7.143 3.731 1.00 0.00 H new ATOM 0 HB3 ASP A 911 11.131 -5.606 3.511 1.00 0.00 H new ATOM 352 N ALA A 912 7.921 -6.808 2.535 1.00 0.00 N ATOM 353 CA ALA A 912 7.248 -7.100 1.276 1.00 0.00 C ATOM 354 C ALA A 912 6.109 -6.118 1.022 1.00 0.00 C ATOM 355 O ALA A 912 6.028 -5.507 -0.044 1.00 0.00 O ATOM 356 CB ALA A 912 6.725 -8.529 1.274 1.00 0.00 C ATOM 0 H ALA A 912 7.982 -7.600 3.174 1.00 0.00 H new ATOM 0 HA ALA A 912 7.975 -6.990 0.471 1.00 0.00 H new ATOM 0 HB1 ALA A 912 6.225 -8.732 0.327 1.00 0.00 H new ATOM 0 HB2 ALA A 912 7.557 -9.221 1.400 1.00 0.00 H new ATOM 0 HB3 ALA A 912 6.018 -8.659 2.093 1.00 0.00 H new ATOM 362 N LEU A 913 5.230 -5.971 2.007 1.00 0.00 N ATOM 363 CA LEU A 913 4.094 -5.064 1.891 1.00 0.00 C ATOM 364 C LEU A 913 4.554 -3.662 1.502 1.00 0.00 C ATOM 365 O LEU A 913 4.071 -3.089 0.525 1.00 0.00 O ATOM 366 CB LEU A 913 3.321 -5.011 3.210 1.00 0.00 C ATOM 367 CG LEU A 913 2.400 -6.198 3.496 1.00 0.00 C ATOM 368 CD1 LEU A 913 1.861 -6.125 4.916 1.00 0.00 C ATOM 369 CD2 LEU A 913 1.258 -6.241 2.491 1.00 0.00 C ATOM 0 H LEU A 913 5.282 -6.469 2.896 1.00 0.00 H new ATOM 0 HA LEU A 913 3.438 -5.442 1.107 1.00 0.00 H new ATOM 0 HB2 LEU A 913 4.039 -4.929 4.026 1.00 0.00 H new ATOM 0 HB3 LEU A 913 2.721 -4.101 3.220 1.00 0.00 H new ATOM 0 HG LEU A 913 2.980 -7.116 3.396 1.00 0.00 H new ATOM 0 HD11 LEU A 913 1.208 -6.978 5.101 1.00 0.00 H new ATOM 0 HD12 LEU A 913 2.691 -6.144 5.622 1.00 0.00 H new ATOM 0 HD13 LEU A 913 1.297 -5.201 5.044 1.00 0.00 H new ATOM 0 HD21 LEU A 913 0.613 -7.092 2.710 1.00 0.00 H new ATOM 0 HD22 LEU A 913 0.679 -5.320 2.558 1.00 0.00 H new ATOM 0 HD23 LEU A 913 1.663 -6.342 1.484 1.00 0.00 H new ATOM 381 N ILE A 914 5.492 -3.119 2.270 1.00 0.00 N ATOM 382 CA ILE A 914 6.020 -1.786 2.003 1.00 0.00 C ATOM 383 C ILE A 914 6.663 -1.716 0.622 1.00 0.00 C ATOM 384 O ILE A 914 6.210 -0.972 -0.247 1.00 0.00 O ATOM 385 CB ILE A 914 7.057 -1.369 3.062 1.00 0.00 C ATOM 386 CG1 ILE A 914 6.435 -1.406 4.460 1.00 0.00 C ATOM 387 CG2 ILE A 914 7.600 0.018 2.754 1.00 0.00 C ATOM 388 CD1 ILE A 914 7.456 -1.441 5.575 1.00 0.00 C ATOM 0 H ILE A 914 5.902 -3.581 3.082 1.00 0.00 H new ATOM 0 HA ILE A 914 5.176 -1.098 2.043 1.00 0.00 H new ATOM 0 HB ILE A 914 7.886 -2.076 3.036 1.00 0.00 H new ATOM 0 HG12 ILE A 914 5.798 -0.531 4.589 1.00 0.00 H new ATOM 0 HG13 ILE A 914 5.792 -2.282 4.540 1.00 0.00 H new ATOM 0 HG21 ILE A 914 8.332 0.299 3.511 1.00 0.00 H new ATOM 0 HG22 ILE A 914 8.076 0.013 1.774 1.00 0.00 H new ATOM 0 HG23 ILE A 914 6.782 0.738 2.756 1.00 0.00 H new ATOM 0 HD11 ILE A 914 6.944 -1.466 6.537 1.00 0.00 H new ATOM 0 HD12 ILE A 914 8.077 -2.331 5.472 1.00 0.00 H new ATOM 0 HD13 ILE A 914 8.084 -0.552 5.521 1.00 0.00 H new ATOM 400 N ASP A 915 7.720 -2.497 0.428 1.00 0.00 N ATOM 401 CA ASP A 915 8.424 -2.526 -0.848 1.00 0.00 C ATOM 402 C ASP A 915 7.439 -2.529 -2.013 1.00 0.00 C ATOM 403 O ASP A 915 7.552 -1.722 -2.935 1.00 0.00 O ATOM 404 CB ASP A 915 9.330 -3.757 -0.928 1.00 0.00 C ATOM 405 CG ASP A 915 10.211 -3.748 -2.161 1.00 0.00 C ATOM 406 OD1 ASP A 915 9.675 -3.921 -3.275 1.00 0.00 O ATOM 407 OD2 ASP A 915 11.439 -3.569 -2.012 1.00 0.00 O ATOM 0 H ASP A 915 8.108 -3.118 1.138 1.00 0.00 H new ATOM 0 HA ASP A 915 9.037 -1.627 -0.916 1.00 0.00 H new ATOM 0 HB2 ASP A 915 9.957 -3.802 -0.037 1.00 0.00 H new ATOM 0 HB3 ASP A 915 8.715 -4.657 -0.931 1.00 0.00 H new ATOM 412 N GLU A 916 6.474 -3.442 -1.963 1.00 0.00 N ATOM 413 CA GLU A 916 5.470 -3.550 -3.016 1.00 0.00 C ATOM 414 C GLU A 916 4.655 -2.264 -3.124 1.00 0.00 C ATOM 415 O GLU A 916 4.395 -1.771 -4.222 1.00 0.00 O ATOM 416 CB GLU A 916 4.541 -4.735 -2.745 1.00 0.00 C ATOM 417 CG GLU A 916 5.187 -6.086 -3.001 1.00 0.00 C ATOM 418 CD GLU A 916 5.830 -6.175 -4.372 1.00 0.00 C ATOM 419 OE1 GLU A 916 5.104 -6.451 -5.350 1.00 0.00 O ATOM 420 OE2 GLU A 916 7.058 -5.969 -4.466 1.00 0.00 O ATOM 0 H GLU A 916 6.366 -4.117 -1.206 1.00 0.00 H new ATOM 0 HA GLU A 916 5.987 -3.712 -3.962 1.00 0.00 H new ATOM 0 HB2 GLU A 916 4.205 -4.693 -1.709 1.00 0.00 H new ATOM 0 HB3 GLU A 916 3.654 -4.641 -3.372 1.00 0.00 H new ATOM 0 HG2 GLU A 916 5.941 -6.274 -2.237 1.00 0.00 H new ATOM 0 HG3 GLU A 916 4.434 -6.868 -2.905 1.00 0.00 H new ATOM 427 N LEU A 917 4.254 -1.727 -1.977 1.00 0.00 N ATOM 428 CA LEU A 917 3.467 -0.499 -1.941 1.00 0.00 C ATOM 429 C LEU A 917 4.196 0.635 -2.656 1.00 0.00 C ATOM 430 O LEU A 917 3.675 1.220 -3.607 1.00 0.00 O ATOM 431 CB LEU A 917 3.174 -0.100 -0.494 1.00 0.00 C ATOM 432 CG LEU A 917 2.073 -0.893 0.211 1.00 0.00 C ATOM 433 CD1 LEU A 917 2.201 -0.758 1.721 1.00 0.00 C ATOM 434 CD2 LEU A 917 0.701 -0.428 -0.253 1.00 0.00 C ATOM 0 H LEU A 917 4.461 -2.122 -1.060 1.00 0.00 H new ATOM 0 HA LEU A 917 2.525 -0.684 -2.458 1.00 0.00 H new ATOM 0 HB2 LEU A 917 4.093 -0.201 0.083 1.00 0.00 H new ATOM 0 HB3 LEU A 917 2.902 0.955 -0.477 1.00 0.00 H new ATOM 0 HG LEU A 917 2.186 -1.945 -0.050 1.00 0.00 H new ATOM 0 HD11 LEU A 917 1.409 -1.329 2.206 1.00 0.00 H new ATOM 0 HD12 LEU A 917 3.171 -1.140 2.040 1.00 0.00 H new ATOM 0 HD13 LEU A 917 2.115 0.292 2.001 1.00 0.00 H new ATOM 0 HD21 LEU A 917 -0.070 -1.003 0.259 1.00 0.00 H new ATOM 0 HD22 LEU A 917 0.578 0.630 -0.022 1.00 0.00 H new ATOM 0 HD23 LEU A 917 0.611 -0.577 -1.329 1.00 0.00 H new ATOM 446 N LEU A 918 5.403 0.940 -2.193 1.00 0.00 N ATOM 447 CA LEU A 918 6.205 2.003 -2.789 1.00 0.00 C ATOM 448 C LEU A 918 5.984 2.071 -4.297 1.00 0.00 C ATOM 449 O LEU A 918 5.741 3.144 -4.850 1.00 0.00 O ATOM 450 CB LEU A 918 7.688 1.779 -2.489 1.00 0.00 C ATOM 451 CG LEU A 918 8.057 1.618 -1.015 1.00 0.00 C ATOM 452 CD1 LEU A 918 9.541 1.318 -0.866 1.00 0.00 C ATOM 453 CD2 LEU A 918 7.682 2.867 -0.231 1.00 0.00 C ATOM 0 H LEU A 918 5.848 0.466 -1.407 1.00 0.00 H new ATOM 0 HA LEU A 918 5.891 2.951 -2.351 1.00 0.00 H new ATOM 0 HB2 LEU A 918 8.016 0.888 -3.024 1.00 0.00 H new ATOM 0 HB3 LEU A 918 8.251 2.620 -2.894 1.00 0.00 H new ATOM 0 HG LEU A 918 7.495 0.777 -0.610 1.00 0.00 H new ATOM 0 HD11 LEU A 918 9.785 1.207 0.190 1.00 0.00 H new ATOM 0 HD12 LEU A 918 9.780 0.394 -1.393 1.00 0.00 H new ATOM 0 HD13 LEU A 918 10.122 2.138 -1.288 1.00 0.00 H new ATOM 0 HD21 LEU A 918 7.952 2.734 0.817 1.00 0.00 H new ATOM 0 HD22 LEU A 918 8.216 3.726 -0.637 1.00 0.00 H new ATOM 0 HD23 LEU A 918 6.608 3.037 -0.310 1.00 0.00 H new ATOM 465 N GLN A 919 6.068 0.920 -4.955 1.00 0.00 N ATOM 466 CA GLN A 919 5.875 0.849 -6.399 1.00 0.00 C ATOM 467 C GLN A 919 4.446 1.224 -6.776 1.00 0.00 C ATOM 468 O GLN A 919 4.224 2.023 -7.686 1.00 0.00 O ATOM 469 CB GLN A 919 6.199 -0.556 -6.910 1.00 0.00 C ATOM 470 CG GLN A 919 7.688 -0.830 -7.036 1.00 0.00 C ATOM 471 CD GLN A 919 8.003 -2.308 -7.148 1.00 0.00 C ATOM 472 OE1 GLN A 919 8.460 -2.932 -6.190 1.00 0.00 O ATOM 473 NE2 GLN A 919 7.758 -2.879 -8.322 1.00 0.00 N ATOM 0 H GLN A 919 6.268 0.023 -4.512 1.00 0.00 H new ATOM 0 HA GLN A 919 6.553 1.563 -6.867 1.00 0.00 H new ATOM 0 HB2 GLN A 919 5.759 -1.290 -6.234 1.00 0.00 H new ATOM 0 HB3 GLN A 919 5.729 -0.697 -7.883 1.00 0.00 H new ATOM 0 HG2 GLN A 919 8.076 -0.313 -7.914 1.00 0.00 H new ATOM 0 HG3 GLN A 919 8.204 -0.417 -6.169 1.00 0.00 H new ATOM 0 HE21 GLN A 919 7.379 -2.324 -9.090 1.00 0.00 H new ATOM 0 HE22 GLN A 919 7.949 -3.872 -8.456 1.00 0.00 H new ATOM 482 N GLN A 920 3.481 0.643 -6.071 1.00 0.00 N ATOM 483 CA GLN A 920 2.073 0.916 -6.334 1.00 0.00 C ATOM 484 C GLN A 920 1.783 2.411 -6.249 1.00 0.00 C ATOM 485 O GLN A 920 0.985 2.944 -7.019 1.00 0.00 O ATOM 486 CB GLN A 920 1.191 0.156 -5.342 1.00 0.00 C ATOM 487 CG GLN A 920 1.079 -1.330 -5.642 1.00 0.00 C ATOM 488 CD GLN A 920 0.226 -1.617 -6.863 1.00 0.00 C ATOM 489 OE1 GLN A 920 -0.629 -0.815 -7.239 1.00 0.00 O ATOM 490 NE2 GLN A 920 0.456 -2.765 -7.489 1.00 0.00 N ATOM 0 H GLN A 920 3.648 -0.019 -5.314 1.00 0.00 H new ATOM 0 HA GLN A 920 1.846 0.578 -7.345 1.00 0.00 H new ATOM 0 HB2 GLN A 920 1.593 0.286 -4.337 1.00 0.00 H new ATOM 0 HB3 GLN A 920 0.193 0.595 -5.345 1.00 0.00 H new ATOM 0 HG2 GLN A 920 2.076 -1.742 -5.796 1.00 0.00 H new ATOM 0 HG3 GLN A 920 0.653 -1.840 -4.778 1.00 0.00 H new ATOM 0 HE21 GLN A 920 1.175 -3.400 -7.142 1.00 0.00 H new ATOM 0 HE22 GLN A 920 -0.086 -3.012 -8.317 1.00 0.00 H new ATOM 499 N PHE A 921 2.437 3.082 -5.306 1.00 0.00 N ATOM 500 CA PHE A 921 2.249 4.516 -5.119 1.00 0.00 C ATOM 501 C PHE A 921 2.795 5.297 -6.311 1.00 0.00 C ATOM 502 O PHE A 921 2.108 6.145 -6.879 1.00 0.00 O ATOM 503 CB PHE A 921 2.936 4.979 -3.833 1.00 0.00 C ATOM 504 CG PHE A 921 2.419 4.298 -2.598 1.00 0.00 C ATOM 505 CD1 PHE A 921 1.066 4.039 -2.450 1.00 0.00 C ATOM 506 CD2 PHE A 921 3.285 3.917 -1.586 1.00 0.00 C ATOM 507 CE1 PHE A 921 0.587 3.413 -1.314 1.00 0.00 C ATOM 508 CE2 PHE A 921 2.812 3.291 -0.448 1.00 0.00 C ATOM 509 CZ PHE A 921 1.461 3.038 -0.313 1.00 0.00 C ATOM 0 H PHE A 921 3.101 2.656 -4.660 1.00 0.00 H new ATOM 0 HA PHE A 921 1.179 4.709 -5.041 1.00 0.00 H new ATOM 0 HB2 PHE A 921 4.007 4.797 -3.917 1.00 0.00 H new ATOM 0 HB3 PHE A 921 2.803 6.056 -3.727 1.00 0.00 H new ATOM 0 HD1 PHE A 921 0.378 4.329 -3.230 1.00 0.00 H new ATOM 0 HD2 PHE A 921 4.342 4.111 -1.687 1.00 0.00 H new ATOM 0 HE1 PHE A 921 -0.470 3.217 -1.210 1.00 0.00 H new ATOM 0 HE2 PHE A 921 3.498 3.000 0.334 1.00 0.00 H new ATOM 0 HZ PHE A 921 1.089 2.548 0.574 1.00 0.00 H new ATOM 519 N ALA A 922 4.037 5.004 -6.683 1.00 0.00 N ATOM 520 CA ALA A 922 4.677 5.676 -7.807 1.00 0.00 C ATOM 521 C ALA A 922 3.743 5.741 -9.011 1.00 0.00 C ATOM 522 O ALA A 922 3.886 6.608 -9.873 1.00 0.00 O ATOM 523 CB ALA A 922 5.972 4.969 -8.178 1.00 0.00 C ATOM 0 H ALA A 922 4.620 4.305 -6.222 1.00 0.00 H new ATOM 0 HA ALA A 922 4.909 6.697 -7.504 1.00 0.00 H new ATOM 0 HB1 ALA A 922 6.439 5.482 -9.019 1.00 0.00 H new ATOM 0 HB2 ALA A 922 6.650 4.980 -7.325 1.00 0.00 H new ATOM 0 HB3 ALA A 922 5.756 3.938 -8.457 1.00 0.00 H new ATOM 529 N SER A 923 2.789 4.817 -9.064 1.00 0.00 N ATOM 530 CA SER A 923 1.835 4.767 -10.166 1.00 0.00 C ATOM 531 C SER A 923 1.234 6.145 -10.428 1.00 0.00 C ATOM 532 O SER A 923 0.906 6.485 -11.565 1.00 0.00 O ATOM 533 CB SER A 923 0.722 3.763 -9.859 1.00 0.00 C ATOM 534 OG SER A 923 -0.294 3.809 -10.846 1.00 0.00 O ATOM 0 H SER A 923 2.656 4.093 -8.357 1.00 0.00 H new ATOM 0 HA SER A 923 2.368 4.446 -11.061 1.00 0.00 H new ATOM 0 HB2 SER A 923 1.139 2.757 -9.809 1.00 0.00 H new ATOM 0 HB3 SER A 923 0.293 3.979 -8.881 1.00 0.00 H new ATOM 0 HG SER A 923 -1.131 4.118 -10.440 1.00 0.00 H new ATOM 540 N PHE A 924 1.093 6.933 -9.368 1.00 0.00 N ATOM 541 CA PHE A 924 0.532 8.274 -9.482 1.00 0.00 C ATOM 542 C PHE A 924 1.503 9.318 -8.939 1.00 0.00 C ATOM 543 O PHE A 924 1.831 10.290 -9.620 1.00 0.00 O ATOM 544 CB PHE A 924 -0.798 8.359 -8.729 1.00 0.00 C ATOM 545 CG PHE A 924 -1.650 7.130 -8.878 1.00 0.00 C ATOM 546 CD1 PHE A 924 -1.220 5.909 -8.385 1.00 0.00 C ATOM 547 CD2 PHE A 924 -2.881 7.197 -9.510 1.00 0.00 C ATOM 548 CE1 PHE A 924 -2.001 4.777 -8.521 1.00 0.00 C ATOM 549 CE2 PHE A 924 -3.667 6.069 -9.649 1.00 0.00 C ATOM 550 CZ PHE A 924 -3.227 4.858 -9.152 1.00 0.00 C ATOM 0 H PHE A 924 1.359 6.666 -8.420 1.00 0.00 H new ATOM 0 HA PHE A 924 0.358 8.479 -10.538 1.00 0.00 H new ATOM 0 HB2 PHE A 924 -0.597 8.526 -7.671 1.00 0.00 H new ATOM 0 HB3 PHE A 924 -1.356 9.224 -9.088 1.00 0.00 H new ATOM 0 HD1 PHE A 924 -0.263 5.841 -7.889 1.00 0.00 H new ATOM 0 HD2 PHE A 924 -3.231 8.142 -9.899 1.00 0.00 H new ATOM 0 HE1 PHE A 924 -1.653 3.830 -8.134 1.00 0.00 H new ATOM 0 HE2 PHE A 924 -4.624 6.134 -10.146 1.00 0.00 H new ATOM 0 HZ PHE A 924 -3.841 3.975 -9.257 1.00 0.00 H new ATOM 560 N GLY A 925 1.959 9.111 -7.708 1.00 0.00 N ATOM 561 CA GLY A 925 2.888 10.042 -7.094 1.00 0.00 C ATOM 562 C GLY A 925 4.078 9.345 -6.465 1.00 0.00 C ATOM 563 O GLY A 925 3.960 8.221 -5.978 1.00 0.00 O ATOM 0 H GLY A 925 1.702 8.315 -7.124 1.00 0.00 H new ATOM 0 HA2 GLY A 925 3.240 10.748 -7.846 1.00 0.00 H new ATOM 0 HA3 GLY A 925 2.366 10.622 -6.332 1.00 0.00 H new ATOM 567 N GLU A 926 5.227 10.012 -6.478 1.00 0.00 N ATOM 568 CA GLU A 926 6.444 9.447 -5.906 1.00 0.00 C ATOM 569 C GLU A 926 6.513 9.709 -4.404 1.00 0.00 C ATOM 570 O GLU A 926 6.236 10.816 -3.943 1.00 0.00 O ATOM 571 CB GLU A 926 7.678 10.035 -6.594 1.00 0.00 C ATOM 572 CG GLU A 926 8.990 9.620 -5.951 1.00 0.00 C ATOM 573 CD GLU A 926 10.198 10.025 -6.773 1.00 0.00 C ATOM 574 OE1 GLU A 926 10.621 9.229 -7.637 1.00 0.00 O ATOM 575 OE2 GLU A 926 10.719 11.138 -6.553 1.00 0.00 O ATOM 0 H GLU A 926 5.341 10.943 -6.878 1.00 0.00 H new ATOM 0 HA GLU A 926 6.424 8.369 -6.069 1.00 0.00 H new ATOM 0 HB2 GLU A 926 7.682 9.726 -7.639 1.00 0.00 H new ATOM 0 HB3 GLU A 926 7.606 11.123 -6.583 1.00 0.00 H new ATOM 0 HG2 GLU A 926 9.063 10.069 -4.960 1.00 0.00 H new ATOM 0 HG3 GLU A 926 8.996 8.539 -5.812 1.00 0.00 H new ATOM 582 N VAL A 927 6.882 8.681 -3.647 1.00 0.00 N ATOM 583 CA VAL A 927 6.988 8.799 -2.197 1.00 0.00 C ATOM 584 C VAL A 927 8.318 9.424 -1.792 1.00 0.00 C ATOM 585 O VAL A 927 9.343 9.199 -2.437 1.00 0.00 O ATOM 586 CB VAL A 927 6.848 7.427 -1.511 1.00 0.00 C ATOM 587 CG1 VAL A 927 6.673 7.597 -0.010 1.00 0.00 C ATOM 588 CG2 VAL A 927 5.684 6.650 -2.108 1.00 0.00 C ATOM 0 H VAL A 927 7.113 7.757 -4.013 1.00 0.00 H new ATOM 0 HA VAL A 927 6.173 9.445 -1.871 1.00 0.00 H new ATOM 0 HB VAL A 927 7.761 6.858 -1.684 1.00 0.00 H new ATOM 0 HG11 VAL A 927 6.576 6.618 0.458 1.00 0.00 H new ATOM 0 HG12 VAL A 927 7.541 8.111 0.402 1.00 0.00 H new ATOM 0 HG13 VAL A 927 5.776 8.184 0.188 1.00 0.00 H new ATOM 0 HG21 VAL A 927 5.599 5.683 -1.612 1.00 0.00 H new ATOM 0 HG22 VAL A 927 4.761 7.212 -1.967 1.00 0.00 H new ATOM 0 HG23 VAL A 927 5.857 6.497 -3.173 1.00 0.00 H new ATOM 598 N ILE A 928 8.294 10.210 -0.721 1.00 0.00 N ATOM 599 CA ILE A 928 9.499 10.866 -0.229 1.00 0.00 C ATOM 600 C ILE A 928 9.784 10.480 1.219 1.00 0.00 C ATOM 601 O ILE A 928 10.939 10.326 1.616 1.00 0.00 O ATOM 602 CB ILE A 928 9.384 12.399 -0.326 1.00 0.00 C ATOM 603 CG1 ILE A 928 8.178 12.894 0.476 1.00 0.00 C ATOM 604 CG2 ILE A 928 9.274 12.831 -1.780 1.00 0.00 C ATOM 605 CD1 ILE A 928 8.143 14.396 0.648 1.00 0.00 C ATOM 0 H ILE A 928 7.454 10.408 -0.178 1.00 0.00 H new ATOM 0 HA ILE A 928 10.321 10.530 -0.861 1.00 0.00 H new ATOM 0 HB ILE A 928 10.285 12.844 0.097 1.00 0.00 H new ATOM 0 HG12 ILE A 928 7.264 12.572 -0.022 1.00 0.00 H new ATOM 0 HG13 ILE A 928 8.188 12.424 1.459 1.00 0.00 H new ATOM 0 HG21 ILE A 928 9.193 13.917 -1.832 1.00 0.00 H new ATOM 0 HG22 ILE A 928 10.161 12.507 -2.324 1.00 0.00 H new ATOM 0 HG23 ILE A 928 8.389 12.380 -2.228 1.00 0.00 H new ATOM 0 HD11 ILE A 928 7.262 14.676 1.226 1.00 0.00 H new ATOM 0 HD12 ILE A 928 9.040 14.723 1.173 1.00 0.00 H new ATOM 0 HD13 ILE A 928 8.102 14.873 -0.331 1.00 0.00 H new ATOM 617 N LEU A 929 8.723 10.322 2.003 1.00 0.00 N ATOM 618 CA LEU A 929 8.858 9.951 3.407 1.00 0.00 C ATOM 619 C LEU A 929 7.725 9.024 3.836 1.00 0.00 C ATOM 620 O LEU A 929 6.598 9.141 3.355 1.00 0.00 O ATOM 621 CB LEU A 929 8.869 11.202 4.287 1.00 0.00 C ATOM 622 CG LEU A 929 8.532 10.988 5.763 1.00 0.00 C ATOM 623 CD1 LEU A 929 9.707 10.354 6.492 1.00 0.00 C ATOM 624 CD2 LEU A 929 8.143 12.305 6.418 1.00 0.00 C ATOM 0 H LEU A 929 7.760 10.445 1.690 1.00 0.00 H new ATOM 0 HA LEU A 929 9.803 9.421 3.528 1.00 0.00 H new ATOM 0 HB2 LEU A 929 9.857 11.658 4.223 1.00 0.00 H new ATOM 0 HB3 LEU A 929 8.160 11.919 3.873 1.00 0.00 H new ATOM 0 HG LEU A 929 7.682 10.309 5.827 1.00 0.00 H new ATOM 0 HD11 LEU A 929 9.449 10.209 7.541 1.00 0.00 H new ATOM 0 HD12 LEU A 929 9.939 9.390 6.039 1.00 0.00 H new ATOM 0 HD13 LEU A 929 10.576 11.008 6.419 1.00 0.00 H new ATOM 0 HD21 LEU A 929 7.907 12.133 7.468 1.00 0.00 H new ATOM 0 HD22 LEU A 929 8.973 13.008 6.343 1.00 0.00 H new ATOM 0 HD23 LEU A 929 7.270 12.719 5.913 1.00 0.00 H new ATOM 636 N ILE A 930 8.032 8.105 4.746 1.00 0.00 N ATOM 637 CA ILE A 930 7.039 7.161 5.242 1.00 0.00 C ATOM 638 C ILE A 930 7.127 7.016 6.757 1.00 0.00 C ATOM 639 O ILE A 930 8.202 6.775 7.307 1.00 0.00 O ATOM 640 CB ILE A 930 7.208 5.773 4.595 1.00 0.00 C ATOM 641 CG1 ILE A 930 7.204 5.895 3.069 1.00 0.00 C ATOM 642 CG2 ILE A 930 6.105 4.834 5.059 1.00 0.00 C ATOM 643 CD1 ILE A 930 7.697 4.651 2.363 1.00 0.00 C ATOM 0 H ILE A 930 8.960 7.995 5.154 1.00 0.00 H new ATOM 0 HA ILE A 930 6.062 7.562 4.973 1.00 0.00 H new ATOM 0 HB ILE A 930 8.166 5.357 4.906 1.00 0.00 H new ATOM 0 HG12 ILE A 930 6.191 6.117 2.733 1.00 0.00 H new ATOM 0 HG13 ILE A 930 7.828 6.740 2.778 1.00 0.00 H new ATOM 0 HG21 ILE A 930 6.238 3.858 4.593 1.00 0.00 H new ATOM 0 HG22 ILE A 930 6.150 4.728 6.143 1.00 0.00 H new ATOM 0 HG23 ILE A 930 5.136 5.243 4.774 1.00 0.00 H new ATOM 0 HD11 ILE A 930 7.667 4.808 1.285 1.00 0.00 H new ATOM 0 HD12 ILE A 930 8.721 4.440 2.671 1.00 0.00 H new ATOM 0 HD13 ILE A 930 7.058 3.807 2.624 1.00 0.00 H new ATOM 655 N ARG A 931 5.989 7.163 7.428 1.00 0.00 N ATOM 656 CA ARG A 931 5.937 7.048 8.880 1.00 0.00 C ATOM 657 C ARG A 931 5.023 5.902 9.303 1.00 0.00 C ATOM 658 O ARG A 931 3.851 5.858 8.929 1.00 0.00 O ATOM 659 CB ARG A 931 5.448 8.359 9.499 1.00 0.00 C ATOM 660 CG ARG A 931 6.007 8.622 10.888 1.00 0.00 C ATOM 661 CD ARG A 931 5.891 10.091 11.266 1.00 0.00 C ATOM 662 NE ARG A 931 6.196 10.319 12.676 1.00 0.00 N ATOM 663 CZ ARG A 931 5.402 9.939 13.671 1.00 0.00 C ATOM 664 NH1 ARG A 931 4.260 9.316 13.411 1.00 0.00 N ATOM 665 NH2 ARG A 931 5.748 10.182 14.928 1.00 0.00 N ATOM 0 H ARG A 931 5.090 7.362 6.989 1.00 0.00 H new ATOM 0 HA ARG A 931 6.944 6.837 9.239 1.00 0.00 H new ATOM 0 HB2 ARG A 931 5.723 9.185 8.843 1.00 0.00 H new ATOM 0 HB3 ARG A 931 4.359 8.342 9.552 1.00 0.00 H new ATOM 0 HG2 ARG A 931 5.472 8.014 11.618 1.00 0.00 H new ATOM 0 HG3 ARG A 931 7.053 8.317 10.924 1.00 0.00 H new ATOM 0 HD2 ARG A 931 6.570 10.679 10.649 1.00 0.00 H new ATOM 0 HD3 ARG A 931 4.881 10.442 11.052 1.00 0.00 H new ATOM 0 HE ARG A 931 7.067 10.796 12.910 1.00 0.00 H new ATOM 0 HH11 ARG A 931 3.990 9.128 12.446 1.00 0.00 H new ATOM 0 HH12 ARG A 931 3.652 9.025 14.177 1.00 0.00 H new ATOM 0 HH21 ARG A 931 6.625 10.661 15.132 1.00 0.00 H new ATOM 0 HH22 ARG A 931 5.137 9.890 15.691 1.00 0.00 H new ATOM 679 N PHE A 932 5.568 4.975 10.083 1.00 0.00 N ATOM 680 CA PHE A 932 4.803 3.826 10.555 1.00 0.00 C ATOM 681 C PHE A 932 4.146 4.126 11.900 1.00 0.00 C ATOM 682 O PHE A 932 4.822 4.457 12.874 1.00 0.00 O ATOM 683 CB PHE A 932 5.709 2.600 10.680 1.00 0.00 C ATOM 684 CG PHE A 932 6.508 2.316 9.440 1.00 0.00 C ATOM 685 CD1 PHE A 932 5.954 1.601 8.391 1.00 0.00 C ATOM 686 CD2 PHE A 932 7.814 2.765 9.324 1.00 0.00 C ATOM 687 CE1 PHE A 932 6.687 1.338 7.249 1.00 0.00 C ATOM 688 CE2 PHE A 932 8.551 2.506 8.184 1.00 0.00 C ATOM 689 CZ PHE A 932 7.987 1.791 7.146 1.00 0.00 C ATOM 0 H PHE A 932 6.537 4.996 10.402 1.00 0.00 H new ATOM 0 HA PHE A 932 4.020 3.618 9.826 1.00 0.00 H new ATOM 0 HB2 PHE A 932 6.392 2.747 11.517 1.00 0.00 H new ATOM 0 HB3 PHE A 932 5.098 1.729 10.916 1.00 0.00 H new ATOM 0 HD1 PHE A 932 4.937 1.245 8.466 1.00 0.00 H new ATOM 0 HD2 PHE A 932 8.261 3.323 10.133 1.00 0.00 H new ATOM 0 HE1 PHE A 932 6.243 0.779 6.438 1.00 0.00 H new ATOM 0 HE2 PHE A 932 9.567 2.863 8.105 1.00 0.00 H new ATOM 0 HZ PHE A 932 8.562 1.586 6.255 1.00 0.00 H new ATOM 699 N VAL A 933 2.823 4.009 11.944 1.00 0.00 N ATOM 700 CA VAL A 933 2.073 4.267 13.168 1.00 0.00 C ATOM 701 C VAL A 933 1.919 2.996 13.996 1.00 0.00 C ATOM 702 O VAL A 933 2.004 1.887 13.469 1.00 0.00 O ATOM 703 CB VAL A 933 0.677 4.838 12.861 1.00 0.00 C ATOM 704 CG1 VAL A 933 0.100 5.528 14.087 1.00 0.00 C ATOM 705 CG2 VAL A 933 0.741 5.797 11.681 1.00 0.00 C ATOM 0 H VAL A 933 2.248 3.737 11.146 1.00 0.00 H new ATOM 0 HA VAL A 933 2.641 5.002 13.738 1.00 0.00 H new ATOM 0 HB VAL A 933 0.017 4.012 12.594 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -0.887 5.925 13.850 1.00 0.00 H new ATOM 0 HG12 VAL A 933 0.016 4.810 14.903 1.00 0.00 H new ATOM 0 HG13 VAL A 933 0.757 6.344 14.388 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -0.255 6.191 11.478 1.00 0.00 H new ATOM 0 HG22 VAL A 933 1.416 6.620 11.917 1.00 0.00 H new ATOM 0 HG23 VAL A 933 1.108 5.268 10.802 1.00 0.00 H new ATOM 715 N GLU A 934 1.693 3.166 15.295 1.00 0.00 N ATOM 716 CA GLU A 934 1.527 2.032 16.196 1.00 0.00 C ATOM 717 C GLU A 934 0.839 0.869 15.486 1.00 0.00 C ATOM 718 O GLU A 934 1.327 -0.261 15.507 1.00 0.00 O ATOM 719 CB GLU A 934 0.717 2.443 17.426 1.00 0.00 C ATOM 720 CG GLU A 934 1.411 3.481 18.292 1.00 0.00 C ATOM 721 CD GLU A 934 2.717 2.977 18.875 1.00 0.00 C ATOM 722 OE1 GLU A 934 2.801 1.770 19.183 1.00 0.00 O ATOM 723 OE2 GLU A 934 3.654 3.788 19.022 1.00 0.00 O ATOM 0 H GLU A 934 1.621 4.078 15.746 1.00 0.00 H new ATOM 0 HA GLU A 934 2.517 1.707 16.515 1.00 0.00 H new ATOM 0 HB2 GLU A 934 -0.246 2.838 17.101 1.00 0.00 H new ATOM 0 HB3 GLU A 934 0.512 1.558 18.028 1.00 0.00 H new ATOM 0 HG2 GLU A 934 1.604 4.374 17.698 1.00 0.00 H new ATOM 0 HG3 GLU A 934 0.745 3.775 19.103 1.00 0.00 H new ATOM 730 N ASP A 935 -0.297 1.155 14.859 1.00 0.00 N ATOM 731 CA ASP A 935 -1.052 0.135 14.142 1.00 0.00 C ATOM 732 C ASP A 935 -1.295 0.554 12.696 1.00 0.00 C ATOM 733 O ASP A 935 -1.466 -0.288 11.814 1.00 0.00 O ATOM 734 CB ASP A 935 -2.387 -0.127 14.841 1.00 0.00 C ATOM 735 CG ASP A 935 -2.224 -0.920 16.123 1.00 0.00 C ATOM 736 OD1 ASP A 935 -1.311 -0.595 16.910 1.00 0.00 O ATOM 737 OD2 ASP A 935 -3.010 -1.866 16.339 1.00 0.00 O ATOM 0 H ASP A 935 -0.715 2.085 14.833 1.00 0.00 H new ATOM 0 HA ASP A 935 -0.464 -0.783 14.141 1.00 0.00 H new ATOM 0 HB2 ASP A 935 -2.869 0.824 15.065 1.00 0.00 H new ATOM 0 HB3 ASP A 935 -3.048 -0.668 14.164 1.00 0.00 H new ATOM 742 N LYS A 936 -1.310 1.861 12.459 1.00 0.00 N ATOM 743 CA LYS A 936 -1.532 2.394 11.120 1.00 0.00 C ATOM 744 C LYS A 936 -0.206 2.714 10.435 1.00 0.00 C ATOM 745 O LYS A 936 0.851 2.679 11.063 1.00 0.00 O ATOM 746 CB LYS A 936 -2.400 3.652 11.186 1.00 0.00 C ATOM 747 CG LYS A 936 -3.271 3.856 9.958 1.00 0.00 C ATOM 748 CD LYS A 936 -4.417 4.813 10.240 1.00 0.00 C ATOM 749 CE LYS A 936 -5.503 4.151 11.075 1.00 0.00 C ATOM 750 NZ LYS A 936 -6.333 3.217 10.265 1.00 0.00 N ATOM 0 H LYS A 936 -1.171 2.572 13.177 1.00 0.00 H new ATOM 0 HA LYS A 936 -2.050 1.634 10.535 1.00 0.00 H new ATOM 0 HB2 LYS A 936 -3.038 3.597 12.068 1.00 0.00 H new ATOM 0 HB3 LYS A 936 -1.755 4.522 11.312 1.00 0.00 H new ATOM 0 HG2 LYS A 936 -2.664 4.245 9.141 1.00 0.00 H new ATOM 0 HG3 LYS A 936 -3.670 2.896 9.630 1.00 0.00 H new ATOM 0 HD2 LYS A 936 -4.039 5.691 10.763 1.00 0.00 H new ATOM 0 HD3 LYS A 936 -4.842 5.161 9.299 1.00 0.00 H new ATOM 0 HE2 LYS A 936 -5.045 3.607 11.901 1.00 0.00 H new ATOM 0 HE3 LYS A 936 -6.142 4.918 11.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 936 -7.132 2.877 10.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 936 -6.695 3.713 9.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 936 -5.753 2.407 9.966 1.00 0.00 H new ATOM 764 N MET A 937 -0.272 3.028 9.146 1.00 0.00 N ATOM 765 CA MET A 937 0.923 3.357 8.378 1.00 0.00 C ATOM 766 C MET A 937 0.694 4.600 7.522 1.00 0.00 C ATOM 767 O MET A 937 -0.090 4.575 6.574 1.00 0.00 O ATOM 768 CB MET A 937 1.325 2.179 7.489 1.00 0.00 C ATOM 769 CG MET A 937 2.374 2.533 6.448 1.00 0.00 C ATOM 770 SD MET A 937 3.031 1.082 5.602 1.00 0.00 S ATOM 771 CE MET A 937 3.632 1.818 4.084 1.00 0.00 C ATOM 0 H MET A 937 -1.140 3.062 8.611 1.00 0.00 H new ATOM 0 HA MET A 937 1.730 3.564 9.081 1.00 0.00 H new ATOM 0 HB2 MET A 937 1.706 1.374 8.117 1.00 0.00 H new ATOM 0 HB3 MET A 937 0.438 1.797 6.984 1.00 0.00 H new ATOM 0 HG2 MET A 937 1.938 3.210 5.714 1.00 0.00 H new ATOM 0 HG3 MET A 937 3.192 3.069 6.930 1.00 0.00 H new ATOM 0 HE1 MET A 937 4.223 1.086 3.534 1.00 0.00 H new ATOM 0 HE2 MET A 937 2.786 2.135 3.473 1.00 0.00 H new ATOM 0 HE3 MET A 937 4.253 2.682 4.320 1.00 0.00 H new ATOM 781 N TRP A 938 1.383 5.682 7.864 1.00 0.00 N ATOM 782 CA TRP A 938 1.254 6.934 7.126 1.00 0.00 C ATOM 783 C TRP A 938 2.318 7.037 6.038 1.00 0.00 C ATOM 784 O TRP A 938 3.461 6.624 6.233 1.00 0.00 O ATOM 785 CB TRP A 938 1.365 8.125 8.079 1.00 0.00 C ATOM 786 CG TRP A 938 0.299 8.143 9.133 1.00 0.00 C ATOM 787 CD1 TRP A 938 -0.686 7.216 9.319 1.00 0.00 C ATOM 788 CD2 TRP A 938 0.111 9.139 10.145 1.00 0.00 C ATOM 789 NE1 TRP A 938 -1.475 7.575 10.385 1.00 0.00 N ATOM 790 CE2 TRP A 938 -1.006 8.750 10.909 1.00 0.00 C ATOM 791 CE3 TRP A 938 0.779 10.319 10.481 1.00 0.00 C ATOM 792 CZ2 TRP A 938 -1.469 9.502 11.987 1.00 0.00 C ATOM 793 CZ3 TRP A 938 0.319 11.064 11.550 1.00 0.00 C ATOM 794 CH2 TRP A 938 -0.795 10.653 12.293 1.00 0.00 C ATOM 0 H TRP A 938 2.036 5.718 8.647 1.00 0.00 H new ATOM 0 HA TRP A 938 0.273 6.948 6.651 1.00 0.00 H new ATOM 0 HB2 TRP A 938 2.342 8.106 8.561 1.00 0.00 H new ATOM 0 HB3 TRP A 938 1.312 9.049 7.503 1.00 0.00 H new ATOM 0 HD1 TRP A 938 -0.825 6.330 8.717 1.00 0.00 H new ATOM 0 HE1 TRP A 938 -2.279 7.051 10.730 1.00 0.00 H new ATOM 0 HE3 TRP A 938 1.640 10.643 9.915 1.00 0.00 H new ATOM 0 HZ2 TRP A 938 -2.329 9.188 12.560 1.00 0.00 H new ATOM 0 HZ3 TRP A 938 0.827 11.979 11.817 1.00 0.00 H new ATOM 0 HH2 TRP A 938 -1.129 11.257 13.124 1.00 0.00 H new ATOM 805 N VAL A 939 1.934 7.591 4.893 1.00 0.00 N ATOM 806 CA VAL A 939 2.856 7.750 3.774 1.00 0.00 C ATOM 807 C VAL A 939 2.819 9.173 3.228 1.00 0.00 C ATOM 808 O VAL A 939 1.752 9.699 2.908 1.00 0.00 O ATOM 809 CB VAL A 939 2.531 6.766 2.635 1.00 0.00 C ATOM 810 CG1 VAL A 939 3.534 6.911 1.501 1.00 0.00 C ATOM 811 CG2 VAL A 939 2.506 5.337 3.156 1.00 0.00 C ATOM 0 H VAL A 939 0.991 7.937 4.715 1.00 0.00 H new ATOM 0 HA VAL A 939 3.855 7.537 4.155 1.00 0.00 H new ATOM 0 HB VAL A 939 1.541 7.004 2.245 1.00 0.00 H new ATOM 0 HG11 VAL A 939 3.288 6.208 0.706 1.00 0.00 H new ATOM 0 HG12 VAL A 939 3.497 7.928 1.110 1.00 0.00 H new ATOM 0 HG13 VAL A 939 4.537 6.702 1.873 1.00 0.00 H new ATOM 0 HG21 VAL A 939 2.275 4.655 2.338 1.00 0.00 H new ATOM 0 HG22 VAL A 939 3.481 5.085 3.574 1.00 0.00 H new ATOM 0 HG23 VAL A 939 1.745 5.245 3.931 1.00 0.00 H new ATOM 821 N THR A 940 3.990 9.792 3.124 1.00 0.00 N ATOM 822 CA THR A 940 4.092 11.155 2.618 1.00 0.00 C ATOM 823 C THR A 940 4.487 11.166 1.145 1.00 0.00 C ATOM 824 O THR A 940 5.143 10.244 0.661 1.00 0.00 O ATOM 825 CB THR A 940 5.119 11.977 3.419 1.00 0.00 C ATOM 826 OG1 THR A 940 4.586 12.307 4.706 1.00 0.00 O ATOM 827 CG2 THR A 940 5.490 13.252 2.676 1.00 0.00 C ATOM 0 H THR A 940 4.882 9.371 3.384 1.00 0.00 H new ATOM 0 HA THR A 940 3.107 11.609 2.731 1.00 0.00 H new ATOM 0 HB THR A 940 6.018 11.373 3.543 1.00 0.00 H new ATOM 0 HG1 THR A 940 5.173 12.957 5.146 1.00 0.00 H new ATOM 0 HG21 THR A 940 6.216 13.816 3.261 1.00 0.00 H new ATOM 0 HG22 THR A 940 5.923 12.997 1.709 1.00 0.00 H new ATOM 0 HG23 THR A 940 4.597 13.858 2.525 1.00 0.00 H new ATOM 835 N PHE A 941 4.083 12.216 0.437 1.00 0.00 N ATOM 836 CA PHE A 941 4.395 12.347 -0.981 1.00 0.00 C ATOM 837 C PHE A 941 5.035 13.701 -1.275 1.00 0.00 C ATOM 838 O PHE A 941 4.704 14.707 -0.645 1.00 0.00 O ATOM 839 CB PHE A 941 3.128 12.176 -1.821 1.00 0.00 C ATOM 840 CG PHE A 941 2.678 10.749 -1.944 1.00 0.00 C ATOM 841 CD1 PHE A 941 2.368 10.006 -0.816 1.00 0.00 C ATOM 842 CD2 PHE A 941 2.565 10.149 -3.188 1.00 0.00 C ATOM 843 CE1 PHE A 941 1.954 8.692 -0.926 1.00 0.00 C ATOM 844 CE2 PHE A 941 2.150 8.835 -3.304 1.00 0.00 C ATOM 845 CZ PHE A 941 1.845 8.106 -2.171 1.00 0.00 C ATOM 0 H PHE A 941 3.539 12.988 0.822 1.00 0.00 H new ATOM 0 HA PHE A 941 5.106 11.564 -1.245 1.00 0.00 H new ATOM 0 HB2 PHE A 941 2.325 12.765 -1.377 1.00 0.00 H new ATOM 0 HB3 PHE A 941 3.305 12.580 -2.818 1.00 0.00 H new ATOM 0 HD1 PHE A 941 2.451 10.459 0.161 1.00 0.00 H new ATOM 0 HD2 PHE A 941 2.804 10.714 -4.077 1.00 0.00 H new ATOM 0 HE1 PHE A 941 1.716 8.124 -0.039 1.00 0.00 H new ATOM 0 HE2 PHE A 941 2.064 8.379 -4.279 1.00 0.00 H new ATOM 0 HZ PHE A 941 1.522 7.079 -2.259 1.00 0.00 H new ATOM 855 N LEU A 942 5.954 13.719 -2.234 1.00 0.00 N ATOM 856 CA LEU A 942 6.641 14.948 -2.612 1.00 0.00 C ATOM 857 C LEU A 942 5.671 16.125 -2.652 1.00 0.00 C ATOM 858 O LEU A 942 6.000 17.227 -2.215 1.00 0.00 O ATOM 859 CB LEU A 942 7.315 14.781 -3.975 1.00 0.00 C ATOM 860 CG LEU A 942 7.952 16.038 -4.568 1.00 0.00 C ATOM 861 CD1 LEU A 942 9.252 16.367 -3.850 1.00 0.00 C ATOM 862 CD2 LEU A 942 8.195 15.861 -6.060 1.00 0.00 C ATOM 0 H LEU A 942 6.240 12.896 -2.764 1.00 0.00 H new ATOM 0 HA LEU A 942 7.403 15.155 -1.860 1.00 0.00 H new ATOM 0 HB2 LEU A 942 8.086 14.015 -3.885 1.00 0.00 H new ATOM 0 HB3 LEU A 942 6.574 14.406 -4.681 1.00 0.00 H new ATOM 0 HG LEU A 942 7.263 16.871 -4.429 1.00 0.00 H new ATOM 0 HD11 LEU A 942 9.691 17.265 -4.286 1.00 0.00 H new ATOM 0 HD12 LEU A 942 9.050 16.538 -2.793 1.00 0.00 H new ATOM 0 HD13 LEU A 942 9.947 15.534 -3.957 1.00 0.00 H new ATOM 0 HD21 LEU A 942 8.649 16.766 -6.465 1.00 0.00 H new ATOM 0 HD22 LEU A 942 8.864 15.016 -6.222 1.00 0.00 H new ATOM 0 HD23 LEU A 942 7.246 15.674 -6.564 1.00 0.00 H new ATOM 874 N GLU A 943 4.475 15.881 -3.177 1.00 0.00 N ATOM 875 CA GLU A 943 3.457 16.920 -3.272 1.00 0.00 C ATOM 876 C GLU A 943 2.123 16.428 -2.718 1.00 0.00 C ATOM 877 O GLU A 943 1.991 15.270 -2.324 1.00 0.00 O ATOM 878 CB GLU A 943 3.285 17.366 -4.725 1.00 0.00 C ATOM 879 CG GLU A 943 4.548 17.947 -5.337 1.00 0.00 C ATOM 880 CD GLU A 943 4.341 18.421 -6.763 1.00 0.00 C ATOM 881 OE1 GLU A 943 4.238 17.563 -7.664 1.00 0.00 O ATOM 882 OE2 GLU A 943 4.283 19.650 -6.977 1.00 0.00 O ATOM 0 H GLU A 943 4.187 14.973 -3.543 1.00 0.00 H new ATOM 0 HA GLU A 943 3.787 17.771 -2.675 1.00 0.00 H new ATOM 0 HB2 GLU A 943 2.961 16.513 -5.322 1.00 0.00 H new ATOM 0 HB3 GLU A 943 2.491 18.111 -4.776 1.00 0.00 H new ATOM 0 HG2 GLU A 943 4.892 18.782 -4.727 1.00 0.00 H new ATOM 0 HG3 GLU A 943 5.336 17.194 -5.319 1.00 0.00 H new ATOM 889 N GLY A 944 1.135 17.318 -2.691 1.00 0.00 N ATOM 890 CA GLY A 944 -0.176 16.956 -2.184 1.00 0.00 C ATOM 891 C GLY A 944 -1.059 16.336 -3.248 1.00 0.00 C ATOM 892 O GLY A 944 -1.593 15.243 -3.062 1.00 0.00 O ATOM 0 H GLY A 944 1.219 18.283 -3.011 1.00 0.00 H new ATOM 0 HA2 GLY A 944 -0.061 16.255 -1.358 1.00 0.00 H new ATOM 0 HA3 GLY A 944 -0.665 17.844 -1.783 1.00 0.00 H new ATOM 896 N SER A 945 -1.215 17.037 -4.367 1.00 0.00 N ATOM 897 CA SER A 945 -2.044 16.551 -5.464 1.00 0.00 C ATOM 898 C SER A 945 -1.736 15.089 -5.772 1.00 0.00 C ATOM 899 O SER A 945 -2.560 14.377 -6.347 1.00 0.00 O ATOM 900 CB SER A 945 -1.824 17.404 -6.714 1.00 0.00 C ATOM 901 OG SER A 945 -0.454 17.437 -7.075 1.00 0.00 O ATOM 0 H SER A 945 -0.778 17.943 -4.538 1.00 0.00 H new ATOM 0 HA SER A 945 -3.088 16.628 -5.159 1.00 0.00 H new ATOM 0 HB2 SER A 945 -2.411 17.003 -7.540 1.00 0.00 H new ATOM 0 HB3 SER A 945 -2.180 18.418 -6.533 1.00 0.00 H new ATOM 0 HG SER A 945 -0.340 17.987 -7.878 1.00 0.00 H new ATOM 907 N SER A 946 -0.544 14.647 -5.384 1.00 0.00 N ATOM 908 CA SER A 946 -0.124 13.271 -5.621 1.00 0.00 C ATOM 909 C SER A 946 -0.820 12.317 -4.655 1.00 0.00 C ATOM 910 O SER A 946 -1.178 11.198 -5.021 1.00 0.00 O ATOM 911 CB SER A 946 1.394 13.146 -5.475 1.00 0.00 C ATOM 912 OG SER A 946 1.878 13.993 -4.447 1.00 0.00 O ATOM 0 H SER A 946 0.148 15.222 -4.904 1.00 0.00 H new ATOM 0 HA SER A 946 -0.407 13.001 -6.638 1.00 0.00 H new ATOM 0 HB2 SER A 946 1.657 12.112 -5.253 1.00 0.00 H new ATOM 0 HB3 SER A 946 1.876 13.402 -6.419 1.00 0.00 H new ATOM 0 HG SER A 946 1.257 13.976 -3.689 1.00 0.00 H new ATOM 918 N ALA A 947 -1.007 12.768 -3.419 1.00 0.00 N ATOM 919 CA ALA A 947 -1.661 11.957 -2.400 1.00 0.00 C ATOM 920 C ALA A 947 -3.150 11.806 -2.691 1.00 0.00 C ATOM 921 O ALA A 947 -3.817 10.933 -2.134 1.00 0.00 O ATOM 922 CB ALA A 947 -1.449 12.568 -1.023 1.00 0.00 C ATOM 0 H ALA A 947 -0.714 13.691 -3.099 1.00 0.00 H new ATOM 0 HA ALA A 947 -1.212 10.964 -2.417 1.00 0.00 H new ATOM 0 HB1 ALA A 947 -1.943 11.952 -0.272 1.00 0.00 H new ATOM 0 HB2 ALA A 947 -0.382 12.617 -0.807 1.00 0.00 H new ATOM 0 HB3 ALA A 947 -1.870 13.573 -1.002 1.00 0.00 H new ATOM 928 N LEU A 948 -3.667 12.663 -3.565 1.00 0.00 N ATOM 929 CA LEU A 948 -5.079 12.625 -3.929 1.00 0.00 C ATOM 930 C LEU A 948 -5.331 11.599 -5.029 1.00 0.00 C ATOM 931 O LEU A 948 -6.416 11.027 -5.122 1.00 0.00 O ATOM 932 CB LEU A 948 -5.545 14.008 -4.389 1.00 0.00 C ATOM 933 CG LEU A 948 -5.155 15.181 -3.489 1.00 0.00 C ATOM 934 CD1 LEU A 948 -5.654 16.492 -4.076 1.00 0.00 C ATOM 935 CD2 LEU A 948 -5.704 14.980 -2.084 1.00 0.00 C ATOM 0 H LEU A 948 -3.130 13.392 -4.034 1.00 0.00 H new ATOM 0 HA LEU A 948 -5.648 12.331 -3.047 1.00 0.00 H new ATOM 0 HB2 LEU A 948 -5.144 14.192 -5.386 1.00 0.00 H new ATOM 0 HB3 LEU A 948 -6.631 13.992 -4.481 1.00 0.00 H new ATOM 0 HG LEU A 948 -4.067 15.224 -3.430 1.00 0.00 H new ATOM 0 HD11 LEU A 948 -5.367 17.316 -3.422 1.00 0.00 H new ATOM 0 HD12 LEU A 948 -5.213 16.641 -5.062 1.00 0.00 H new ATOM 0 HD13 LEU A 948 -6.740 16.461 -4.165 1.00 0.00 H new ATOM 0 HD21 LEU A 948 -5.417 15.824 -1.457 1.00 0.00 H new ATOM 0 HD22 LEU A 948 -6.791 14.911 -2.125 1.00 0.00 H new ATOM 0 HD23 LEU A 948 -5.298 14.060 -1.663 1.00 0.00 H new ATOM 947 N ASN A 949 -4.319 11.370 -5.860 1.00 0.00 N ATOM 948 CA ASN A 949 -4.430 10.412 -6.954 1.00 0.00 C ATOM 949 C ASN A 949 -4.217 8.987 -6.452 1.00 0.00 C ATOM 950 O ASN A 949 -4.980 8.080 -6.785 1.00 0.00 O ATOM 951 CB ASN A 949 -3.411 10.736 -8.049 1.00 0.00 C ATOM 952 CG ASN A 949 -3.915 11.792 -9.013 1.00 0.00 C ATOM 953 OD1 ASN A 949 -4.423 11.474 -10.089 1.00 0.00 O ATOM 954 ND2 ASN A 949 -3.777 13.056 -8.632 1.00 0.00 N ATOM 0 H ASN A 949 -3.413 11.835 -5.797 1.00 0.00 H new ATOM 0 HA ASN A 949 -5.435 10.487 -7.369 1.00 0.00 H new ATOM 0 HB2 ASN A 949 -2.485 11.080 -7.589 1.00 0.00 H new ATOM 0 HB3 ASN A 949 -3.174 9.827 -8.602 1.00 0.00 H new ATOM 0 HD21 ASN A 949 -4.098 13.810 -9.240 1.00 0.00 H new ATOM 0 HD22 ASN A 949 -3.350 13.274 -7.732 1.00 0.00 H new ATOM 961 N VAL A 950 -3.176 8.797 -5.647 1.00 0.00 N ATOM 962 CA VAL A 950 -2.864 7.484 -5.097 1.00 0.00 C ATOM 963 C VAL A 950 -4.071 6.887 -4.381 1.00 0.00 C ATOM 964 O VAL A 950 -4.124 5.683 -4.128 1.00 0.00 O ATOM 965 CB VAL A 950 -1.680 7.554 -4.115 1.00 0.00 C ATOM 966 CG1 VAL A 950 -2.111 8.193 -2.804 1.00 0.00 C ATOM 967 CG2 VAL A 950 -1.104 6.166 -3.876 1.00 0.00 C ATOM 0 H VAL A 950 -2.534 9.537 -5.361 1.00 0.00 H new ATOM 0 HA VAL A 950 -2.592 6.845 -5.937 1.00 0.00 H new ATOM 0 HB VAL A 950 -0.901 8.176 -4.556 1.00 0.00 H new ATOM 0 HG11 VAL A 950 -1.261 8.234 -2.123 1.00 0.00 H new ATOM 0 HG12 VAL A 950 -2.473 9.203 -2.994 1.00 0.00 H new ATOM 0 HG13 VAL A 950 -2.908 7.600 -2.355 1.00 0.00 H new ATOM 0 HG21 VAL A 950 -0.268 6.234 -3.180 1.00 0.00 H new ATOM 0 HG22 VAL A 950 -1.875 5.520 -3.456 1.00 0.00 H new ATOM 0 HG23 VAL A 950 -0.756 5.749 -4.821 1.00 0.00 H new ATOM 977 N LEU A 951 -5.038 7.737 -4.056 1.00 0.00 N ATOM 978 CA LEU A 951 -6.246 7.295 -3.368 1.00 0.00 C ATOM 979 C LEU A 951 -6.905 6.139 -4.115 1.00 0.00 C ATOM 980 O LEU A 951 -7.650 5.353 -3.529 1.00 0.00 O ATOM 981 CB LEU A 951 -7.233 8.455 -3.230 1.00 0.00 C ATOM 982 CG LEU A 951 -6.887 9.508 -2.176 1.00 0.00 C ATOM 983 CD1 LEU A 951 -7.786 10.726 -2.323 1.00 0.00 C ATOM 984 CD2 LEU A 951 -7.006 8.921 -0.777 1.00 0.00 C ATOM 0 H LEU A 951 -5.009 8.736 -4.258 1.00 0.00 H new ATOM 0 HA LEU A 951 -5.962 6.948 -2.374 1.00 0.00 H new ATOM 0 HB2 LEU A 951 -7.317 8.951 -4.197 1.00 0.00 H new ATOM 0 HB3 LEU A 951 -8.215 8.044 -2.996 1.00 0.00 H new ATOM 0 HG LEU A 951 -5.855 9.823 -2.330 1.00 0.00 H new ATOM 0 HD11 LEU A 951 -7.525 11.464 -1.565 1.00 0.00 H new ATOM 0 HD12 LEU A 951 -7.651 11.160 -3.314 1.00 0.00 H new ATOM 0 HD13 LEU A 951 -8.827 10.428 -2.196 1.00 0.00 H new ATOM 0 HD21 LEU A 951 -6.756 9.684 -0.040 1.00 0.00 H new ATOM 0 HD22 LEU A 951 -8.027 8.578 -0.612 1.00 0.00 H new ATOM 0 HD23 LEU A 951 -6.320 8.080 -0.676 1.00 0.00 H new ATOM 996 N SER A 952 -6.623 6.040 -5.410 1.00 0.00 N ATOM 997 CA SER A 952 -7.190 4.981 -6.237 1.00 0.00 C ATOM 998 C SER A 952 -6.804 3.607 -5.699 1.00 0.00 C ATOM 999 O SER A 952 -7.342 2.585 -6.128 1.00 0.00 O ATOM 1000 CB SER A 952 -6.716 5.127 -7.684 1.00 0.00 C ATOM 1001 OG SER A 952 -7.648 4.556 -8.586 1.00 0.00 O ATOM 0 H SER A 952 -6.005 6.680 -5.909 1.00 0.00 H new ATOM 0 HA SER A 952 -8.276 5.071 -6.207 1.00 0.00 H new ATOM 0 HB2 SER A 952 -6.577 6.182 -7.920 1.00 0.00 H new ATOM 0 HB3 SER A 952 -5.747 4.643 -7.803 1.00 0.00 H new ATOM 0 HG SER A 952 -7.323 4.664 -9.504 1.00 0.00 H new ATOM 1007 N LEU A 953 -5.867 3.589 -4.757 1.00 0.00 N ATOM 1008 CA LEU A 953 -5.407 2.340 -4.159 1.00 0.00 C ATOM 1009 C LEU A 953 -6.176 2.035 -2.877 1.00 0.00 C ATOM 1010 O LEU A 953 -5.755 1.205 -2.073 1.00 0.00 O ATOM 1011 CB LEU A 953 -3.908 2.416 -3.863 1.00 0.00 C ATOM 1012 CG LEU A 953 -2.978 2.271 -5.068 1.00 0.00 C ATOM 1013 CD1 LEU A 953 -1.545 2.599 -4.678 1.00 0.00 C ATOM 1014 CD2 LEU A 953 -3.067 0.866 -5.645 1.00 0.00 C ATOM 0 H LEU A 953 -5.411 4.425 -4.391 1.00 0.00 H new ATOM 0 HA LEU A 953 -5.590 1.535 -4.871 1.00 0.00 H new ATOM 0 HB2 LEU A 953 -3.701 3.372 -3.382 1.00 0.00 H new ATOM 0 HB3 LEU A 953 -3.660 1.637 -3.142 1.00 0.00 H new ATOM 0 HG LEU A 953 -3.296 2.978 -5.835 1.00 0.00 H new ATOM 0 HD11 LEU A 953 -0.897 2.490 -5.548 1.00 0.00 H new ATOM 0 HD12 LEU A 953 -1.493 3.625 -4.313 1.00 0.00 H new ATOM 0 HD13 LEU A 953 -1.216 1.917 -3.894 1.00 0.00 H new ATOM 0 HD21 LEU A 953 -2.398 0.781 -6.502 1.00 0.00 H new ATOM 0 HD22 LEU A 953 -2.776 0.141 -4.885 1.00 0.00 H new ATOM 0 HD23 LEU A 953 -4.091 0.667 -5.963 1.00 0.00 H new ATOM 1026 N ASN A 954 -7.306 2.711 -2.696 1.00 0.00 N ATOM 1027 CA ASN A 954 -8.134 2.510 -1.512 1.00 0.00 C ATOM 1028 C ASN A 954 -8.817 1.146 -1.551 1.00 0.00 C ATOM 1029 O ASN A 954 -9.591 0.853 -2.460 1.00 0.00 O ATOM 1030 CB ASN A 954 -9.186 3.616 -1.408 1.00 0.00 C ATOM 1031 CG ASN A 954 -10.452 3.285 -2.174 1.00 0.00 C ATOM 1032 OD1 ASN A 954 -11.428 2.797 -1.603 1.00 0.00 O ATOM 1033 ND2 ASN A 954 -10.442 3.549 -3.476 1.00 0.00 N ATOM 0 H ASN A 954 -7.669 3.402 -3.353 1.00 0.00 H new ATOM 0 HA ASN A 954 -7.487 2.548 -0.635 1.00 0.00 H new ATOM 0 HB2 ASN A 954 -9.432 3.782 -0.359 1.00 0.00 H new ATOM 0 HB3 ASN A 954 -8.768 4.548 -1.788 1.00 0.00 H new ATOM 0 HD21 ASN A 954 -11.265 3.347 -4.044 1.00 0.00 H new ATOM 0 HD22 ASN A 954 -9.611 3.954 -3.908 1.00 0.00 H new ATOM 1040 N GLY A 955 -8.523 0.315 -0.555 1.00 0.00 N ATOM 1041 CA GLY A 955 -9.116 -1.008 -0.494 1.00 0.00 C ATOM 1042 C GLY A 955 -8.334 -2.032 -1.291 1.00 0.00 C ATOM 1043 O GLY A 955 -8.343 -3.220 -0.969 1.00 0.00 O ATOM 0 H GLY A 955 -7.885 0.535 0.210 1.00 0.00 H new ATOM 0 HA2 GLY A 955 -9.174 -1.329 0.546 1.00 0.00 H new ATOM 0 HA3 GLY A 955 -10.138 -0.962 -0.871 1.00 0.00 H new ATOM 1047 N LYS A 956 -7.655 -1.572 -2.336 1.00 0.00 N ATOM 1048 CA LYS A 956 -6.863 -2.456 -3.184 1.00 0.00 C ATOM 1049 C LYS A 956 -6.204 -3.556 -2.357 1.00 0.00 C ATOM 1050 O LYS A 956 -5.523 -3.279 -1.370 1.00 0.00 O ATOM 1051 CB LYS A 956 -5.795 -1.656 -3.933 1.00 0.00 C ATOM 1052 CG LYS A 956 -5.318 -2.325 -5.211 1.00 0.00 C ATOM 1053 CD LYS A 956 -4.211 -3.329 -4.936 1.00 0.00 C ATOM 1054 CE LYS A 956 -3.511 -3.751 -6.218 1.00 0.00 C ATOM 1055 NZ LYS A 956 -2.354 -2.868 -6.535 1.00 0.00 N ATOM 0 H LYS A 956 -7.637 -0.592 -2.617 1.00 0.00 H new ATOM 0 HA LYS A 956 -7.533 -2.921 -3.907 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -6.194 -0.671 -4.176 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -4.941 -1.500 -3.274 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -6.156 -2.829 -5.693 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -4.958 -1.567 -5.907 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -3.485 -2.893 -4.250 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -4.629 -4.207 -4.442 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -3.166 -4.781 -6.122 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -4.222 -3.729 -7.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -2.073 -3.006 -7.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -2.624 -1.875 -6.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -1.555 -3.106 -5.913 1.00 0.00 H new ATOM 1069 N GLU A 957 -6.410 -4.803 -2.769 1.00 0.00 N ATOM 1070 CA GLU A 957 -5.834 -5.943 -2.065 1.00 0.00 C ATOM 1071 C GLU A 957 -4.489 -6.334 -2.672 1.00 0.00 C ATOM 1072 O GLU A 957 -4.375 -6.534 -3.882 1.00 0.00 O ATOM 1073 CB GLU A 957 -6.792 -7.136 -2.111 1.00 0.00 C ATOM 1074 CG GLU A 957 -6.153 -8.447 -1.686 1.00 0.00 C ATOM 1075 CD GLU A 957 -7.149 -9.409 -1.069 1.00 0.00 C ATOM 1076 OE1 GLU A 957 -8.040 -8.944 -0.327 1.00 0.00 O ATOM 1077 OE2 GLU A 957 -7.039 -10.625 -1.328 1.00 0.00 O ATOM 0 H GLU A 957 -6.970 -5.049 -3.585 1.00 0.00 H new ATOM 0 HA GLU A 957 -5.675 -5.653 -1.026 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -7.645 -6.931 -1.464 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -7.179 -7.242 -3.125 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -5.688 -8.918 -2.552 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -5.358 -8.243 -0.969 1.00 0.00 H new ATOM 1084 N LEU A 958 -3.473 -6.441 -1.823 1.00 0.00 N ATOM 1085 CA LEU A 958 -2.135 -6.807 -2.273 1.00 0.00 C ATOM 1086 C LEU A 958 -1.486 -7.793 -1.308 1.00 0.00 C ATOM 1087 O LEU A 958 -1.741 -7.758 -0.103 1.00 0.00 O ATOM 1088 CB LEU A 958 -1.261 -5.559 -2.409 1.00 0.00 C ATOM 1089 CG LEU A 958 -0.024 -5.698 -3.296 1.00 0.00 C ATOM 1090 CD1 LEU A 958 -0.427 -5.897 -4.748 1.00 0.00 C ATOM 1091 CD2 LEU A 958 0.876 -4.479 -3.152 1.00 0.00 C ATOM 0 H LEU A 958 -3.550 -6.279 -0.819 1.00 0.00 H new ATOM 0 HA LEU A 958 -2.226 -7.287 -3.247 1.00 0.00 H new ATOM 0 HB2 LEU A 958 -1.877 -4.750 -2.803 1.00 0.00 H new ATOM 0 HB3 LEU A 958 -0.937 -5.257 -1.413 1.00 0.00 H new ATOM 0 HG LEU A 958 0.534 -6.577 -2.972 1.00 0.00 H new ATOM 0 HD11 LEU A 958 0.467 -5.994 -5.364 1.00 0.00 H new ATOM 0 HD12 LEU A 958 -1.029 -6.801 -4.838 1.00 0.00 H new ATOM 0 HD13 LEU A 958 -1.008 -5.039 -5.085 1.00 0.00 H new ATOM 0 HD21 LEU A 958 1.752 -4.596 -3.791 1.00 0.00 H new ATOM 0 HD22 LEU A 958 0.327 -3.585 -3.448 1.00 0.00 H new ATOM 0 HD23 LEU A 958 1.194 -4.382 -2.114 1.00 0.00 H new ATOM 1103 N LEU A 959 -0.644 -8.670 -1.843 1.00 0.00 N ATOM 1104 CA LEU A 959 0.044 -9.666 -1.028 1.00 0.00 C ATOM 1105 C LEU A 959 -0.907 -10.291 -0.013 1.00 0.00 C ATOM 1106 O LEU A 959 -0.620 -10.326 1.182 1.00 0.00 O ATOM 1107 CB LEU A 959 1.232 -9.029 -0.305 1.00 0.00 C ATOM 1108 CG LEU A 959 2.473 -8.763 -1.158 1.00 0.00 C ATOM 1109 CD1 LEU A 959 3.510 -7.984 -0.364 1.00 0.00 C ATOM 1110 CD2 LEU A 959 3.060 -10.071 -1.667 1.00 0.00 C ATOM 0 H LEU A 959 -0.421 -8.712 -2.837 1.00 0.00 H new ATOM 0 HA LEU A 959 0.407 -10.452 -1.690 1.00 0.00 H new ATOM 0 HB2 LEU A 959 0.904 -8.084 0.128 1.00 0.00 H new ATOM 0 HB3 LEU A 959 1.517 -9.677 0.524 1.00 0.00 H new ATOM 0 HG LEU A 959 2.177 -8.162 -2.018 1.00 0.00 H new ATOM 0 HD11 LEU A 959 4.386 -7.804 -0.987 1.00 0.00 H new ATOM 0 HD12 LEU A 959 3.086 -7.030 -0.050 1.00 0.00 H new ATOM 0 HD13 LEU A 959 3.802 -8.559 0.515 1.00 0.00 H new ATOM 0 HD21 LEU A 959 3.942 -9.863 -2.272 1.00 0.00 H new ATOM 0 HD22 LEU A 959 3.340 -10.698 -0.820 1.00 0.00 H new ATOM 0 HD23 LEU A 959 2.319 -10.591 -2.274 1.00 0.00 H new ATOM 1122 N ASN A 960 -2.041 -10.786 -0.500 1.00 0.00 N ATOM 1123 CA ASN A 960 -3.035 -11.412 0.365 1.00 0.00 C ATOM 1124 C ASN A 960 -3.263 -10.580 1.623 1.00 0.00 C ATOM 1125 O ASN A 960 -3.324 -11.114 2.730 1.00 0.00 O ATOM 1126 CB ASN A 960 -2.589 -12.825 0.748 1.00 0.00 C ATOM 1127 CG ASN A 960 -2.052 -13.604 -0.437 1.00 0.00 C ATOM 1128 OD1 ASN A 960 -2.813 -14.061 -1.290 1.00 0.00 O ATOM 1129 ND2 ASN A 960 -0.734 -13.758 -0.495 1.00 0.00 N ATOM 0 H ASN A 960 -2.294 -10.766 -1.488 1.00 0.00 H new ATOM 0 HA ASN A 960 -3.974 -11.470 -0.185 1.00 0.00 H new ATOM 0 HB2 ASN A 960 -1.820 -12.764 1.518 1.00 0.00 H new ATOM 0 HB3 ASN A 960 -3.432 -13.364 1.182 1.00 0.00 H new ATOM 0 HD21 ASN A 960 -0.314 -14.272 -1.269 1.00 0.00 H new ATOM 0 HD22 ASN A 960 -0.142 -13.362 0.235 1.00 0.00 H new ATOM 1136 N ARG A 961 -3.389 -9.269 1.444 1.00 0.00 N ATOM 1137 CA ARG A 961 -3.610 -8.363 2.564 1.00 0.00 C ATOM 1138 C ARG A 961 -4.391 -7.130 2.119 1.00 0.00 C ATOM 1139 O ARG A 961 -3.852 -6.248 1.449 1.00 0.00 O ATOM 1140 CB ARG A 961 -2.274 -7.940 3.177 1.00 0.00 C ATOM 1141 CG ARG A 961 -1.757 -8.902 4.234 1.00 0.00 C ATOM 1142 CD ARG A 961 -0.450 -8.415 4.839 1.00 0.00 C ATOM 1143 NE ARG A 961 -0.205 -8.998 6.155 1.00 0.00 N ATOM 1144 CZ ARG A 961 0.198 -10.250 6.341 1.00 0.00 C ATOM 1145 NH1 ARG A 961 0.400 -11.046 5.300 1.00 0.00 N ATOM 1146 NH2 ARG A 961 0.399 -10.708 7.570 1.00 0.00 N ATOM 0 H ARG A 961 -3.342 -8.811 0.534 1.00 0.00 H new ATOM 0 HA ARG A 961 -4.196 -8.891 3.316 1.00 0.00 H new ATOM 0 HB2 ARG A 961 -1.532 -7.852 2.384 1.00 0.00 H new ATOM 0 HB3 ARG A 961 -2.385 -6.951 3.621 1.00 0.00 H new ATOM 0 HG2 ARG A 961 -2.503 -9.015 5.020 1.00 0.00 H new ATOM 0 HG3 ARG A 961 -1.609 -9.887 3.790 1.00 0.00 H new ATOM 0 HD2 ARG A 961 0.374 -8.667 4.172 1.00 0.00 H new ATOM 0 HD3 ARG A 961 -0.472 -7.328 4.922 1.00 0.00 H new ATOM 0 HE ARG A 961 -0.351 -8.412 6.977 1.00 0.00 H new ATOM 0 HH11 ARG A 961 0.246 -10.697 4.354 1.00 0.00 H new ATOM 0 HH12 ARG A 961 0.709 -12.007 5.445 1.00 0.00 H new ATOM 0 HH21 ARG A 961 0.244 -10.099 8.373 1.00 0.00 H new ATOM 0 HH22 ARG A 961 0.708 -11.670 7.712 1.00 0.00 H new ATOM 1160 N THR A 962 -5.665 -7.074 2.496 1.00 0.00 N ATOM 1161 CA THR A 962 -6.521 -5.951 2.135 1.00 0.00 C ATOM 1162 C THR A 962 -5.988 -4.646 2.716 1.00 0.00 C ATOM 1163 O THR A 962 -5.879 -4.496 3.933 1.00 0.00 O ATOM 1164 CB THR A 962 -7.965 -6.166 2.624 1.00 0.00 C ATOM 1165 OG1 THR A 962 -8.383 -7.506 2.344 1.00 0.00 O ATOM 1166 CG2 THR A 962 -8.915 -5.183 1.956 1.00 0.00 C ATOM 0 H THR A 962 -6.127 -7.794 3.052 1.00 0.00 H new ATOM 0 HA THR A 962 -6.520 -5.889 1.047 1.00 0.00 H new ATOM 0 HB THR A 962 -7.989 -5.996 3.700 1.00 0.00 H new ATOM 0 HG1 THR A 962 -8.161 -7.731 1.416 1.00 0.00 H new ATOM 0 HG21 THR A 962 -9.929 -5.354 2.317 1.00 0.00 H new ATOM 0 HG22 THR A 962 -8.612 -4.164 2.196 1.00 0.00 H new ATOM 0 HG23 THR A 962 -8.886 -5.326 0.876 1.00 0.00 H new ATOM 1174 N ILE A 963 -5.660 -3.704 1.838 1.00 0.00 N ATOM 1175 CA ILE A 963 -5.141 -2.410 2.265 1.00 0.00 C ATOM 1176 C ILE A 963 -6.217 -1.333 2.187 1.00 0.00 C ATOM 1177 O ILE A 963 -7.007 -1.296 1.243 1.00 0.00 O ATOM 1178 CB ILE A 963 -3.935 -1.978 1.410 1.00 0.00 C ATOM 1179 CG1 ILE A 963 -2.797 -2.992 1.544 1.00 0.00 C ATOM 1180 CG2 ILE A 963 -3.465 -0.590 1.821 1.00 0.00 C ATOM 1181 CD1 ILE A 963 -1.645 -2.737 0.598 1.00 0.00 C ATOM 0 H ILE A 963 -5.744 -3.812 0.827 1.00 0.00 H new ATOM 0 HA ILE A 963 -4.820 -2.525 3.300 1.00 0.00 H new ATOM 0 HB ILE A 963 -4.244 -1.942 0.365 1.00 0.00 H new ATOM 0 HG12 ILE A 963 -2.425 -2.975 2.569 1.00 0.00 H new ATOM 0 HG13 ILE A 963 -3.190 -3.993 1.364 1.00 0.00 H new ATOM 0 HG21 ILE A 963 -2.612 -0.298 1.208 1.00 0.00 H new ATOM 0 HG22 ILE A 963 -4.275 0.125 1.679 1.00 0.00 H new ATOM 0 HG23 ILE A 963 -3.170 -0.602 2.870 1.00 0.00 H new ATOM 0 HD11 ILE A 963 -0.876 -3.494 0.749 1.00 0.00 H new ATOM 0 HD12 ILE A 963 -2.002 -2.783 -0.431 1.00 0.00 H new ATOM 0 HD13 ILE A 963 -1.226 -1.750 0.793 1.00 0.00 H new ATOM 1193 N THR A 964 -6.242 -0.455 3.185 1.00 0.00 N ATOM 1194 CA THR A 964 -7.221 0.624 3.230 1.00 0.00 C ATOM 1195 C THR A 964 -6.538 1.980 3.356 1.00 0.00 C ATOM 1196 O THR A 964 -5.934 2.289 4.384 1.00 0.00 O ATOM 1197 CB THR A 964 -8.202 0.444 4.404 1.00 0.00 C ATOM 1198 OG1 THR A 964 -8.629 -0.920 4.481 1.00 0.00 O ATOM 1199 CG2 THR A 964 -9.412 1.352 4.242 1.00 0.00 C ATOM 0 H THR A 964 -5.595 -0.470 3.973 1.00 0.00 H new ATOM 0 HA THR A 964 -7.777 0.586 2.293 1.00 0.00 H new ATOM 0 HB THR A 964 -7.686 0.715 5.325 1.00 0.00 H new ATOM 0 HG1 THR A 964 -9.251 -1.026 5.231 1.00 0.00 H new ATOM 0 HG21 THR A 964 -10.091 1.207 5.083 1.00 0.00 H new ATOM 0 HG22 THR A 964 -9.086 2.392 4.214 1.00 0.00 H new ATOM 0 HG23 THR A 964 -9.928 1.108 3.313 1.00 0.00 H new ATOM 1207 N ILE A 965 -6.638 2.788 2.305 1.00 0.00 N ATOM 1208 CA ILE A 965 -6.030 4.113 2.300 1.00 0.00 C ATOM 1209 C ILE A 965 -7.057 5.189 2.637 1.00 0.00 C ATOM 1210 O ILE A 965 -8.196 5.142 2.172 1.00 0.00 O ATOM 1211 CB ILE A 965 -5.394 4.435 0.935 1.00 0.00 C ATOM 1212 CG1 ILE A 965 -4.398 3.342 0.542 1.00 0.00 C ATOM 1213 CG2 ILE A 965 -4.709 5.793 0.978 1.00 0.00 C ATOM 1214 CD1 ILE A 965 -3.819 3.523 -0.844 1.00 0.00 C ATOM 0 H ILE A 965 -7.134 2.548 1.447 1.00 0.00 H new ATOM 0 HA ILE A 965 -5.250 4.106 3.062 1.00 0.00 H new ATOM 0 HB ILE A 965 -6.181 4.470 0.182 1.00 0.00 H new ATOM 0 HG12 ILE A 965 -3.585 3.325 1.267 1.00 0.00 H new ATOM 0 HG13 ILE A 965 -4.894 2.373 0.596 1.00 0.00 H new ATOM 0 HG21 ILE A 965 -4.264 6.007 0.006 1.00 0.00 H new ATOM 0 HG22 ILE A 965 -5.442 6.563 1.219 1.00 0.00 H new ATOM 0 HG23 ILE A 965 -3.929 5.783 1.740 1.00 0.00 H new ATOM 0 HD11 ILE A 965 -3.121 2.713 -1.056 1.00 0.00 H new ATOM 0 HD12 ILE A 965 -4.624 3.510 -1.579 1.00 0.00 H new ATOM 0 HD13 ILE A 965 -3.294 4.477 -0.897 1.00 0.00 H new ATOM 1226 N ALA A 966 -6.645 6.160 3.446 1.00 0.00 N ATOM 1227 CA ALA A 966 -7.527 7.251 3.841 1.00 0.00 C ATOM 1228 C ALA A 966 -6.730 8.502 4.193 1.00 0.00 C ATOM 1229 O ALA A 966 -5.694 8.424 4.856 1.00 0.00 O ATOM 1230 CB ALA A 966 -8.395 6.827 5.017 1.00 0.00 C ATOM 0 H ALA A 966 -5.706 6.213 3.840 1.00 0.00 H new ATOM 0 HA ALA A 966 -8.171 7.490 2.995 1.00 0.00 H new ATOM 0 HB1 ALA A 966 -9.049 7.651 5.302 1.00 0.00 H new ATOM 0 HB2 ALA A 966 -8.999 5.966 4.731 1.00 0.00 H new ATOM 0 HB3 ALA A 966 -7.759 6.560 5.861 1.00 0.00 H new ATOM 1236 N LEU A 967 -7.217 9.654 3.746 1.00 0.00 N ATOM 1237 CA LEU A 967 -6.549 10.922 4.013 1.00 0.00 C ATOM 1238 C LEU A 967 -6.633 11.281 5.494 1.00 0.00 C ATOM 1239 O LEU A 967 -7.528 10.823 6.205 1.00 0.00 O ATOM 1240 CB LEU A 967 -7.171 12.037 3.171 1.00 0.00 C ATOM 1241 CG LEU A 967 -6.721 12.106 1.711 1.00 0.00 C ATOM 1242 CD1 LEU A 967 -7.439 13.232 0.984 1.00 0.00 C ATOM 1243 CD2 LEU A 967 -5.213 12.290 1.626 1.00 0.00 C ATOM 0 H LEU A 967 -8.073 9.736 3.197 1.00 0.00 H new ATOM 0 HA LEU A 967 -5.499 10.814 3.743 1.00 0.00 H new ATOM 0 HB2 LEU A 967 -8.254 11.919 3.191 1.00 0.00 H new ATOM 0 HB3 LEU A 967 -6.946 12.992 3.645 1.00 0.00 H new ATOM 0 HG LEU A 967 -6.980 11.165 1.226 1.00 0.00 H new ATOM 0 HD11 LEU A 967 -7.106 13.266 -0.053 1.00 0.00 H new ATOM 0 HD12 LEU A 967 -8.514 13.057 1.014 1.00 0.00 H new ATOM 0 HD13 LEU A 967 -7.212 14.181 1.469 1.00 0.00 H new ATOM 0 HD21 LEU A 967 -4.911 12.337 0.580 1.00 0.00 H new ATOM 0 HD22 LEU A 967 -4.931 13.216 2.127 1.00 0.00 H new ATOM 0 HD23 LEU A 967 -4.716 11.449 2.110 1.00 0.00 H new ATOM 1255 N LYS A 968 -5.697 12.105 5.952 1.00 0.00 N ATOM 1256 CA LYS A 968 -5.666 12.529 7.346 1.00 0.00 C ATOM 1257 C LYS A 968 -6.763 13.550 7.629 1.00 0.00 C ATOM 1258 O LYS A 968 -7.625 13.329 8.480 1.00 0.00 O ATOM 1259 CB LYS A 968 -4.299 13.126 7.689 1.00 0.00 C ATOM 1260 CG LYS A 968 -4.065 13.292 9.181 1.00 0.00 C ATOM 1261 CD LYS A 968 -3.646 11.983 9.829 1.00 0.00 C ATOM 1262 CE LYS A 968 -3.975 11.967 11.314 1.00 0.00 C ATOM 1263 NZ LYS A 968 -3.038 12.818 12.099 1.00 0.00 N ATOM 0 H LYS A 968 -4.949 12.493 5.377 1.00 0.00 H new ATOM 0 HA LYS A 968 -5.840 11.652 7.970 1.00 0.00 H new ATOM 0 HB2 LYS A 968 -3.519 12.487 7.276 1.00 0.00 H new ATOM 0 HB3 LYS A 968 -4.204 14.098 7.204 1.00 0.00 H new ATOM 0 HG2 LYS A 968 -3.294 14.045 9.348 1.00 0.00 H new ATOM 0 HG3 LYS A 968 -4.976 13.658 9.655 1.00 0.00 H new ATOM 0 HD2 LYS A 968 -4.150 11.153 9.334 1.00 0.00 H new ATOM 0 HD3 LYS A 968 -2.575 11.833 9.691 1.00 0.00 H new ATOM 0 HE2 LYS A 968 -4.996 12.318 11.464 1.00 0.00 H new ATOM 0 HE3 LYS A 968 -3.932 10.943 11.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 968 -3.417 12.960 13.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 968 -2.111 12.350 12.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 968 -2.930 13.740 11.630 1.00 0.00 H new