USER MOD reduce.3.24.130724 H: found=0, std=0, add=671, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 672 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 20 SER OG : rot 33:sc= 0.388 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -41:sc= -0.692 USER MOD Single : A 28 LYS NZ :NH3+ -161:sc= 0.807 (180deg=0.572) USER MOD Single : A 29 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.013) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= -1.64 K(o=-1.6,f=-3.8!) USER MOD Single : A 39 SER OG : rot 84:sc=0.000318 USER MOD Single : A 42 LYS NZ :NH3+ 173:sc= 0.0714 (180deg=0.0629) USER MOD Single : A 45 LYS NZ :NH3+ -110:sc= -1.42 (180deg=-4.32!) USER MOD Single : A 49 ASN : amide:sc= -1.28 X(o=-1.3,f=-1.4) USER MOD Single : A 51 GLN : amide:sc= -0.18 X(o=-0.18,f=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= -2.24 X(o=-2.2,f=-2.4) USER MOD Single : A 58 SER OG : rot 75:sc= 0.0114 USER MOD Single : A 63 MET CE :methyl 162:sc= -6.26! (180deg=-8.9!) USER MOD Single : A 65 LYS NZ :NH3+ -124:sc= 0.184 (180deg=-0.225) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 SER OG : rot 25:sc= 0.0162 USER MOD Single : A 69 THR OG1 : rot -48:sc= 1.04 USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 71 MET CE :methyl -152:sc= -2.54 (180deg=-4.62!) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= -0.193 X(o=-0.19,f=-0.19) USER MOD Single : A 77 GLN : amide:sc=-0.00169 X(o=-0.0017,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 81:sc= 1.01 USER MOD Single : A 87 SER OG : rot 98:sc= 0.105 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=-0.039) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ -146:sc= -0.272 (180deg=-1.73!) USER MOD ----------------------------------------------------------------- ATOM 46 N SER A 20 -3.064 -17.549 4.328 1.00 0.00 N ATOM 47 CA SER A 20 -2.289 -16.536 3.621 1.00 0.00 C ATOM 48 C SER A 20 -3.207 -15.579 2.867 1.00 0.00 C ATOM 49 O SER A 20 -3.007 -14.364 2.891 1.00 0.00 O ATOM 50 CB SER A 20 -1.314 -17.197 2.645 1.00 0.00 C ATOM 51 OG SER A 20 -0.759 -18.378 3.197 1.00 0.00 O ATOM 0 HA SER A 20 -1.724 -15.967 4.359 1.00 0.00 H new ATOM 0 HB2 SER A 20 -1.831 -17.435 1.715 1.00 0.00 H new ATOM 0 HB3 SER A 20 -0.515 -16.499 2.396 1.00 0.00 H new ATOM 0 HG SER A 20 -1.422 -18.813 3.773 1.00 0.00 H new ATOM 57 N LEU A 21 -4.212 -16.134 2.199 1.00 0.00 N ATOM 58 CA LEU A 21 -5.161 -15.330 1.436 1.00 0.00 C ATOM 59 C LEU A 21 -5.836 -14.288 2.324 1.00 0.00 C ATOM 60 O LEU A 21 -6.115 -13.172 1.887 1.00 0.00 O ATOM 61 CB LEU A 21 -6.219 -16.232 0.793 1.00 0.00 C ATOM 62 CG LEU A 21 -5.686 -17.209 -0.258 1.00 0.00 C ATOM 63 CD1 LEU A 21 -6.318 -18.582 -0.081 1.00 0.00 C ATOM 64 CD2 LEU A 21 -5.941 -16.680 -1.660 1.00 0.00 C ATOM 0 H LEU A 21 -4.391 -17.138 2.170 1.00 0.00 H new ATOM 0 HA LEU A 21 -4.610 -14.808 0.654 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -6.714 -16.802 1.579 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -6.978 -15.602 0.329 1.00 0.00 H new ATOM 0 HG LEU A 21 -4.609 -17.306 -0.120 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -5.927 -19.263 -0.837 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -6.081 -18.966 0.911 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -7.400 -18.501 -0.190 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -5.555 -17.389 -2.392 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -7.013 -16.550 -1.811 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -5.439 -15.721 -1.784 1.00 0.00 H new ATOM 76 N VAL A 22 -6.095 -14.663 3.573 1.00 0.00 N ATOM 77 CA VAL A 22 -6.737 -13.762 4.522 1.00 0.00 C ATOM 78 C VAL A 22 -5.806 -12.615 4.911 1.00 0.00 C ATOM 79 O VAL A 22 -6.211 -11.453 4.920 1.00 0.00 O ATOM 80 CB VAL A 22 -7.185 -14.509 5.793 1.00 0.00 C ATOM 81 CG1 VAL A 22 -5.988 -15.121 6.507 1.00 0.00 C ATOM 82 CG2 VAL A 22 -7.949 -13.576 6.721 1.00 0.00 C ATOM 0 H VAL A 22 -5.870 -15.584 3.950 1.00 0.00 H new ATOM 0 HA VAL A 22 -7.617 -13.354 4.025 1.00 0.00 H new ATOM 0 HB VAL A 22 -7.853 -15.318 5.498 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -6.326 -15.644 7.402 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -5.489 -15.826 5.842 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -5.291 -14.332 6.789 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -8.257 -14.122 7.613 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -7.307 -12.743 7.009 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -8.831 -13.194 6.207 1.00 0.00 H new ATOM 92 N LYS A 23 -4.559 -12.949 5.229 1.00 0.00 N ATOM 93 CA LYS A 23 -3.578 -11.941 5.615 1.00 0.00 C ATOM 94 C LYS A 23 -3.372 -10.937 4.487 1.00 0.00 C ATOM 95 O LYS A 23 -3.370 -9.725 4.705 1.00 0.00 O ATOM 96 CB LYS A 23 -2.247 -12.605 5.975 1.00 0.00 C ATOM 97 CG LYS A 23 -2.037 -12.775 7.472 1.00 0.00 C ATOM 98 CD LYS A 23 -0.596 -13.135 7.792 1.00 0.00 C ATOM 99 CE LYS A 23 -0.272 -12.894 9.257 1.00 0.00 C ATOM 100 NZ LYS A 23 1.191 -12.738 9.485 1.00 0.00 N ATOM 0 H LYS A 23 -4.205 -13.906 5.227 1.00 0.00 H new ATOM 0 HA LYS A 23 -3.956 -11.411 6.490 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -2.197 -13.583 5.496 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -1.431 -12.008 5.567 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -2.306 -11.852 7.986 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -2.700 -13.554 7.848 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -0.419 -14.182 7.547 1.00 0.00 H new ATOM 0 HD3 LYS A 23 0.075 -12.544 7.168 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -0.790 -11.999 9.601 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -0.645 -13.727 9.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 1.369 -12.575 10.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 1.684 -13.602 9.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 1.543 -11.927 8.937 1.00 0.00 H new ATOM 114 N VAL A 24 -3.208 -11.457 3.276 1.00 0.00 N ATOM 115 CA VAL A 24 -3.008 -10.616 2.104 1.00 0.00 C ATOM 116 C VAL A 24 -4.163 -9.632 1.945 1.00 0.00 C ATOM 117 O VAL A 24 -3.952 -8.440 1.715 1.00 0.00 O ATOM 118 CB VAL A 24 -2.879 -11.463 0.823 1.00 0.00 C ATOM 119 CG1 VAL A 24 -2.411 -10.605 -0.340 1.00 0.00 C ATOM 120 CG2 VAL A 24 -1.931 -12.634 1.048 1.00 0.00 C ATOM 0 H VAL A 24 -3.210 -12.458 3.081 1.00 0.00 H new ATOM 0 HA VAL A 24 -2.080 -10.064 2.254 1.00 0.00 H new ATOM 0 HB VAL A 24 -3.862 -11.864 0.575 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -2.326 -11.221 -1.235 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -3.132 -9.806 -0.516 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -1.439 -10.171 -0.104 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -1.853 -13.220 0.132 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -0.946 -12.257 1.323 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -2.315 -13.264 1.850 1.00 0.00 H new ATOM 130 N GLY A 25 -5.385 -10.138 2.083 1.00 0.00 N ATOM 131 CA GLY A 25 -6.554 -9.285 1.969 1.00 0.00 C ATOM 132 C GLY A 25 -6.554 -8.193 3.016 1.00 0.00 C ATOM 133 O GLY A 25 -6.928 -7.051 2.740 1.00 0.00 O ATOM 0 H GLY A 25 -5.586 -11.120 2.271 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -6.582 -8.837 0.976 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -7.456 -9.888 2.072 1.00 0.00 H new ATOM 137 N THR A 26 -6.119 -8.542 4.226 1.00 0.00 N ATOM 138 CA THR A 26 -6.056 -7.583 5.321 1.00 0.00 C ATOM 139 C THR A 26 -5.195 -6.392 4.926 1.00 0.00 C ATOM 140 O THR A 26 -5.555 -5.239 5.169 1.00 0.00 O ATOM 141 CB THR A 26 -5.491 -8.246 6.578 1.00 0.00 C ATOM 142 OG1 THR A 26 -5.815 -9.625 6.607 1.00 0.00 O ATOM 143 CG2 THR A 26 -6.001 -7.628 7.861 1.00 0.00 C ATOM 0 H THR A 26 -5.806 -9.482 4.470 1.00 0.00 H new ATOM 0 HA THR A 26 -7.066 -7.233 5.535 1.00 0.00 H new ATOM 0 HB THR A 26 -4.413 -8.095 6.524 1.00 0.00 H new ATOM 0 HG1 THR A 26 -6.739 -9.750 6.305 1.00 0.00 H new ATOM 0 HG21 THR A 26 -5.561 -8.145 8.714 1.00 0.00 H new ATOM 0 HG22 THR A 26 -5.723 -6.574 7.893 1.00 0.00 H new ATOM 0 HG23 THR A 26 -7.086 -7.719 7.902 1.00 0.00 H new ATOM 151 N LEU A 27 -4.056 -6.677 4.301 1.00 0.00 N ATOM 152 CA LEU A 27 -3.152 -5.624 3.857 1.00 0.00 C ATOM 153 C LEU A 27 -3.848 -4.734 2.840 1.00 0.00 C ATOM 154 O LEU A 27 -3.734 -3.510 2.892 1.00 0.00 O ATOM 155 CB LEU A 27 -1.877 -6.225 3.260 1.00 0.00 C ATOM 156 CG LEU A 27 -0.591 -5.888 4.017 1.00 0.00 C ATOM 157 CD1 LEU A 27 0.546 -6.786 3.559 1.00 0.00 C ATOM 158 CD2 LEU A 27 -0.228 -4.423 3.823 1.00 0.00 C ATOM 0 H LEU A 27 -3.739 -7.624 4.092 1.00 0.00 H new ATOM 0 HA LEU A 27 -2.872 -5.019 4.719 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -1.986 -7.309 3.223 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -1.777 -5.879 2.231 1.00 0.00 H new ATOM 0 HG LEU A 27 -0.759 -6.062 5.080 1.00 0.00 H new ATOM 0 HD11 LEU A 27 1.453 -6.533 4.108 1.00 0.00 H new ATOM 0 HD12 LEU A 27 0.286 -7.827 3.749 1.00 0.00 H new ATOM 0 HD13 LEU A 27 0.715 -6.643 2.492 1.00 0.00 H new ATOM 0 HD21 LEU A 27 0.689 -4.200 4.368 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -0.077 -4.223 2.762 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -1.036 -3.795 4.200 1.00 0.00 H new ATOM 170 N LYS A 28 -4.592 -5.355 1.927 1.00 0.00 N ATOM 171 CA LYS A 28 -5.326 -4.603 0.919 1.00 0.00 C ATOM 172 C LYS A 28 -6.182 -3.547 1.606 1.00 0.00 C ATOM 173 O LYS A 28 -6.281 -2.405 1.150 1.00 0.00 O ATOM 174 CB LYS A 28 -6.205 -5.538 0.082 1.00 0.00 C ATOM 175 CG LYS A 28 -5.933 -5.453 -1.410 1.00 0.00 C ATOM 176 CD LYS A 28 -6.802 -4.399 -2.080 1.00 0.00 C ATOM 177 CE LYS A 28 -7.844 -5.031 -2.991 1.00 0.00 C ATOM 178 NZ LYS A 28 -7.394 -5.063 -4.410 1.00 0.00 N ATOM 0 H LYS A 28 -4.700 -6.367 1.866 1.00 0.00 H new ATOM 0 HA LYS A 28 -4.617 -4.117 0.249 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.048 -6.564 0.414 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -7.253 -5.300 0.266 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -4.882 -5.217 -1.576 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -6.118 -6.424 -1.870 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -7.299 -3.799 -1.318 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -6.174 -3.722 -2.659 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -8.054 -6.046 -2.654 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -8.777 -4.472 -2.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -8.217 -5.191 -5.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -6.919 -4.168 -4.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -6.731 -5.853 -4.546 1.00 0.00 H new ATOM 192 N LYS A 29 -6.775 -3.937 2.729 1.00 0.00 N ATOM 193 CA LYS A 29 -7.596 -3.028 3.512 1.00 0.00 C ATOM 194 C LYS A 29 -6.732 -1.898 4.056 1.00 0.00 C ATOM 195 O LYS A 29 -7.152 -0.741 4.091 1.00 0.00 O ATOM 196 CB LYS A 29 -8.278 -3.772 4.661 1.00 0.00 C ATOM 197 CG LYS A 29 -9.684 -4.245 4.331 1.00 0.00 C ATOM 198 CD LYS A 29 -9.666 -5.594 3.630 1.00 0.00 C ATOM 199 CE LYS A 29 -10.822 -5.728 2.650 1.00 0.00 C ATOM 200 NZ LYS A 29 -12.142 -5.666 3.335 1.00 0.00 N ATOM 0 H LYS A 29 -6.701 -4.878 3.116 1.00 0.00 H new ATOM 0 HA LYS A 29 -8.371 -2.611 2.869 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -7.669 -4.633 4.937 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -8.319 -3.118 5.532 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -10.269 -4.317 5.248 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -10.177 -3.510 3.695 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -8.722 -5.717 3.100 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -9.722 -6.391 4.371 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -10.761 -4.933 1.907 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -10.735 -6.673 2.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -12.899 -5.862 2.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -12.172 -6.374 4.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -12.279 -4.718 3.740 1.00 0.00 H new ATOM 214 N ARG A 30 -5.509 -2.240 4.464 1.00 0.00 N ATOM 215 CA ARG A 30 -4.581 -1.249 4.986 1.00 0.00 C ATOM 216 C ARG A 30 -4.237 -0.237 3.900 1.00 0.00 C ATOM 217 O ARG A 30 -4.083 0.955 4.167 1.00 0.00 O ATOM 218 CB ARG A 30 -3.308 -1.924 5.500 1.00 0.00 C ATOM 219 CG ARG A 30 -2.723 -1.258 6.735 1.00 0.00 C ATOM 220 CD ARG A 30 -2.685 -2.209 7.921 1.00 0.00 C ATOM 221 NE ARG A 30 -4.025 -2.572 8.375 1.00 0.00 N ATOM 222 CZ ARG A 30 -4.789 -1.787 9.133 1.00 0.00 C ATOM 223 NH1 ARG A 30 -4.350 -0.597 9.520 1.00 0.00 N ATOM 224 NH2 ARG A 30 -5.995 -2.195 9.504 1.00 0.00 N ATOM 0 H ARG A 30 -5.144 -3.192 4.441 1.00 0.00 H new ATOM 0 HA ARG A 30 -5.056 -0.730 5.819 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -3.527 -2.967 5.729 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -2.560 -1.922 4.707 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -1.714 -0.908 6.517 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -3.316 -0.380 6.991 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -2.139 -3.111 7.645 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -2.138 -1.744 8.741 1.00 0.00 H new ATOM 0 HE ARG A 30 -4.397 -3.479 8.095 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -3.423 -0.279 9.237 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -4.939 -0.000 10.100 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -6.337 -3.109 9.209 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -6.580 -1.594 10.084 1.00 0.00 H new ATOM 238 N LEU A 31 -4.131 -0.723 2.668 1.00 0.00 N ATOM 239 CA LEU A 31 -3.821 0.136 1.534 1.00 0.00 C ATOM 240 C LEU A 31 -4.916 1.178 1.347 1.00 0.00 C ATOM 241 O LEU A 31 -4.638 2.354 1.115 1.00 0.00 O ATOM 242 CB LEU A 31 -3.668 -0.701 0.261 1.00 0.00 C ATOM 243 CG LEU A 31 -2.225 -1.017 -0.136 1.00 0.00 C ATOM 244 CD1 LEU A 31 -1.567 -1.904 0.909 1.00 0.00 C ATOM 245 CD2 LEU A 31 -2.184 -1.678 -1.506 1.00 0.00 C ATOM 0 H LEU A 31 -4.255 -1.707 2.431 1.00 0.00 H new ATOM 0 HA LEU A 31 -2.879 0.648 1.732 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -4.206 -1.640 0.395 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -4.148 -0.173 -0.563 1.00 0.00 H new ATOM 0 HG LEU A 31 -1.667 -0.082 -0.190 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -0.541 -2.119 0.610 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -1.565 -1.392 1.871 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.123 -2.838 0.996 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -1.150 -1.896 -1.774 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -2.756 -2.606 -1.480 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -2.617 -1.006 -2.247 1.00 0.00 H new ATOM 257 N ASP A 32 -6.164 0.735 1.456 1.00 0.00 N ATOM 258 CA ASP A 32 -7.307 1.627 1.306 1.00 0.00 C ATOM 259 C ASP A 32 -7.258 2.751 2.338 1.00 0.00 C ATOM 260 O ASP A 32 -7.441 3.921 2.003 1.00 0.00 O ATOM 261 CB ASP A 32 -8.613 0.844 1.449 1.00 0.00 C ATOM 262 CG ASP A 32 -9.048 0.202 0.146 1.00 0.00 C ATOM 263 OD1 ASP A 32 -8.222 -0.496 -0.477 1.00 0.00 O ATOM 264 OD2 ASP A 32 -10.216 0.397 -0.251 1.00 0.00 O ATOM 0 H ASP A 32 -6.409 -0.236 1.648 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.264 2.069 0.311 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.489 0.071 2.208 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -9.398 1.513 1.801 1.00 0.00 H new ATOM 269 N LYS A 33 -7.012 2.388 3.594 1.00 0.00 N ATOM 270 CA LYS A 33 -6.941 3.370 4.668 1.00 0.00 C ATOM 271 C LYS A 33 -5.835 4.390 4.405 1.00 0.00 C ATOM 272 O LYS A 33 -5.963 5.562 4.759 1.00 0.00 O ATOM 273 CB LYS A 33 -6.735 2.675 6.020 1.00 0.00 C ATOM 274 CG LYS A 33 -5.281 2.513 6.424 1.00 0.00 C ATOM 275 CD LYS A 33 -4.829 3.637 7.341 1.00 0.00 C ATOM 276 CE LYS A 33 -5.622 3.655 8.638 1.00 0.00 C ATOM 277 NZ LYS A 33 -4.748 3.885 9.820 1.00 0.00 N ATOM 0 H LYS A 33 -6.859 1.424 3.891 1.00 0.00 H new ATOM 0 HA LYS A 33 -7.889 3.907 4.701 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -7.253 3.245 6.791 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -7.202 1.691 5.984 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -5.147 1.555 6.927 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -4.654 2.495 5.532 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -3.768 3.521 7.564 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -4.945 4.593 6.830 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -6.380 4.437 8.589 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -6.148 2.708 8.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -5.327 3.890 10.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.041 3.125 9.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -4.265 4.801 9.722 1.00 0.00 H new ATOM 291 N PHE A 34 -4.752 3.939 3.776 1.00 0.00 N ATOM 292 CA PHE A 34 -3.635 4.821 3.464 1.00 0.00 C ATOM 293 C PHE A 34 -4.058 5.882 2.454 1.00 0.00 C ATOM 294 O PHE A 34 -3.733 7.059 2.602 1.00 0.00 O ATOM 295 CB PHE A 34 -2.452 4.015 2.919 1.00 0.00 C ATOM 296 CG PHE A 34 -1.693 3.268 3.980 1.00 0.00 C ATOM 297 CD1 PHE A 34 -1.397 3.867 5.195 1.00 0.00 C ATOM 298 CD2 PHE A 34 -1.275 1.965 3.763 1.00 0.00 C ATOM 299 CE1 PHE A 34 -0.701 3.180 6.171 1.00 0.00 C ATOM 300 CE2 PHE A 34 -0.577 1.273 4.735 1.00 0.00 C ATOM 301 CZ PHE A 34 -0.290 1.882 5.941 1.00 0.00 C ATOM 0 H PHE A 34 -4.626 2.973 3.475 1.00 0.00 H new ATOM 0 HA PHE A 34 -3.325 5.319 4.383 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -2.818 3.305 2.178 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -1.770 4.691 2.403 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -1.714 4.883 5.381 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -1.497 1.484 2.822 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -0.478 3.658 7.114 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -0.257 0.258 4.552 1.00 0.00 H new ATOM 0 HZ PHE A 34 0.255 1.344 6.703 1.00 0.00 H new ATOM 311 N ASN A 35 -4.791 5.455 1.430 1.00 0.00 N ATOM 312 CA ASN A 35 -5.268 6.369 0.400 1.00 0.00 C ATOM 313 C ASN A 35 -6.170 7.436 1.010 1.00 0.00 C ATOM 314 O ASN A 35 -6.113 8.605 0.628 1.00 0.00 O ATOM 315 CB ASN A 35 -6.027 5.600 -0.683 1.00 0.00 C ATOM 316 CG ASN A 35 -5.097 4.844 -1.612 1.00 0.00 C ATOM 317 OD1 ASN A 35 -4.600 3.769 -1.274 1.00 0.00 O ATOM 318 ND2 ASN A 35 -4.857 5.404 -2.793 1.00 0.00 N ATOM 0 H ASN A 35 -5.067 4.483 1.292 1.00 0.00 H new ATOM 0 HA ASN A 35 -4.405 6.857 -0.053 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -6.716 4.898 -0.212 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -6.630 6.297 -1.265 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -4.240 4.942 -3.461 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -5.290 6.296 -3.032 1.00 0.00 H new ATOM 325 N GLU A 36 -6.999 7.026 1.964 1.00 0.00 N ATOM 326 CA GLU A 36 -7.911 7.949 2.633 1.00 0.00 C ATOM 327 C GLU A 36 -7.133 9.069 3.311 1.00 0.00 C ATOM 328 O GLU A 36 -7.381 10.251 3.067 1.00 0.00 O ATOM 329 CB GLU A 36 -8.762 7.204 3.663 1.00 0.00 C ATOM 330 CG GLU A 36 -10.085 7.888 3.968 1.00 0.00 C ATOM 331 CD GLU A 36 -11.043 7.856 2.792 1.00 0.00 C ATOM 332 OE1 GLU A 36 -11.428 6.746 2.371 1.00 0.00 O ATOM 333 OE2 GLU A 36 -11.406 8.942 2.293 1.00 0.00 O ATOM 0 H GLU A 36 -7.059 6.062 2.292 1.00 0.00 H new ATOM 0 HA GLU A 36 -8.570 8.385 1.882 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -8.959 6.196 3.298 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -8.193 7.103 4.587 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -10.552 7.403 4.825 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -9.898 8.924 4.251 1.00 0.00 H new ATOM 340 N VAL A 37 -6.187 8.689 4.160 1.00 0.00 N ATOM 341 CA VAL A 37 -5.363 9.659 4.870 1.00 0.00 C ATOM 342 C VAL A 37 -4.609 10.549 3.889 1.00 0.00 C ATOM 343 O VAL A 37 -4.444 11.747 4.119 1.00 0.00 O ATOM 344 CB VAL A 37 -4.348 8.963 5.799 1.00 0.00 C ATOM 345 CG1 VAL A 37 -3.620 9.986 6.656 1.00 0.00 C ATOM 346 CG2 VAL A 37 -5.043 7.925 6.667 1.00 0.00 C ATOM 0 H VAL A 37 -5.971 7.715 4.374 1.00 0.00 H new ATOM 0 HA VAL A 37 -6.035 10.269 5.474 1.00 0.00 H new ATOM 0 HB VAL A 37 -3.610 8.450 5.182 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -2.908 9.476 7.305 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -3.088 10.687 6.013 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -4.342 10.530 7.266 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -4.311 7.444 7.316 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -5.804 8.411 7.277 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -5.512 7.174 6.031 1.00 0.00 H new ATOM 356 N VAL A 38 -4.155 9.952 2.793 1.00 0.00 N ATOM 357 CA VAL A 38 -3.422 10.686 1.769 1.00 0.00 C ATOM 358 C VAL A 38 -4.344 11.632 1.007 1.00 0.00 C ATOM 359 O VAL A 38 -3.921 12.694 0.552 1.00 0.00 O ATOM 360 CB VAL A 38 -2.744 9.724 0.772 1.00 0.00 C ATOM 361 CG1 VAL A 38 -1.939 10.495 -0.265 1.00 0.00 C ATOM 362 CG2 VAL A 38 -1.859 8.730 1.509 1.00 0.00 C ATOM 0 H VAL A 38 -4.282 8.960 2.591 1.00 0.00 H new ATOM 0 HA VAL A 38 -2.655 11.269 2.279 1.00 0.00 H new ATOM 0 HB VAL A 38 -3.524 9.170 0.249 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -1.471 9.795 -0.956 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -2.601 11.162 -0.817 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -1.168 11.081 0.235 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -1.389 8.059 0.790 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -1.089 9.268 2.061 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.465 8.149 2.205 1.00 0.00 H new ATOM 372 N SER A 39 -5.605 11.240 0.873 1.00 0.00 N ATOM 373 CA SER A 39 -6.587 12.054 0.167 1.00 0.00 C ATOM 374 C SER A 39 -6.997 13.263 1.003 1.00 0.00 C ATOM 375 O SER A 39 -7.396 14.295 0.465 1.00 0.00 O ATOM 376 CB SER A 39 -7.819 11.218 -0.181 1.00 0.00 C ATOM 377 OG SER A 39 -7.632 10.516 -1.400 1.00 0.00 O ATOM 0 H SER A 39 -5.972 10.363 1.244 1.00 0.00 H new ATOM 0 HA SER A 39 -6.128 12.412 -0.754 1.00 0.00 H new ATOM 0 HB2 SER A 39 -8.021 10.510 0.623 1.00 0.00 H new ATOM 0 HB3 SER A 39 -8.692 11.866 -0.261 1.00 0.00 H new ATOM 0 HG SER A 39 -7.142 9.685 -1.227 1.00 0.00 H new ATOM 383 N ALA A 40 -6.900 13.127 2.322 1.00 0.00 N ATOM 384 CA ALA A 40 -7.263 14.210 3.229 1.00 0.00 C ATOM 385 C ALA A 40 -6.220 15.323 3.213 1.00 0.00 C ATOM 386 O ALA A 40 -6.554 16.500 3.343 1.00 0.00 O ATOM 387 CB ALA A 40 -7.445 13.673 4.643 1.00 0.00 C ATOM 0 H ALA A 40 -6.574 12.279 2.786 1.00 0.00 H new ATOM 0 HA ALA A 40 -8.207 14.634 2.886 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.716 14.491 5.311 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -8.236 12.923 4.648 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -6.514 13.220 4.983 1.00 0.00 H new ATOM 393 N LEU A 41 -4.955 14.945 3.054 1.00 0.00 N ATOM 394 CA LEU A 41 -3.867 15.917 3.025 1.00 0.00 C ATOM 395 C LEU A 41 -3.632 16.444 1.611 1.00 0.00 C ATOM 396 O LEU A 41 -3.138 17.558 1.431 1.00 0.00 O ATOM 397 CB LEU A 41 -2.579 15.301 3.578 1.00 0.00 C ATOM 398 CG LEU A 41 -2.105 14.027 2.875 1.00 0.00 C ATOM 399 CD1 LEU A 41 -1.193 14.367 1.707 1.00 0.00 C ATOM 400 CD2 LEU A 41 -1.393 13.114 3.860 1.00 0.00 C ATOM 0 H LEU A 41 -4.659 13.975 2.944 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.157 16.756 3.657 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -1.785 16.046 3.517 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -2.727 15.079 4.635 1.00 0.00 H new ATOM 0 HG LEU A 41 -2.978 13.503 2.485 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -0.867 13.448 1.220 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -1.734 14.984 0.990 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -0.323 14.913 2.072 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -1.062 12.212 3.346 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -0.529 13.632 4.277 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -2.077 12.843 4.664 1.00 0.00 H new ATOM 412 N LYS A 42 -3.991 15.644 0.612 1.00 0.00 N ATOM 413 CA LYS A 42 -3.818 16.038 -0.783 1.00 0.00 C ATOM 414 C LYS A 42 -2.357 16.339 -1.091 1.00 0.00 C ATOM 415 O LYS A 42 -1.493 16.244 -0.219 1.00 0.00 O ATOM 416 CB LYS A 42 -4.679 17.263 -1.098 1.00 0.00 C ATOM 417 CG LYS A 42 -6.156 17.064 -0.798 1.00 0.00 C ATOM 418 CD LYS A 42 -6.550 17.714 0.518 1.00 0.00 C ATOM 419 CE LYS A 42 -8.028 17.519 0.815 1.00 0.00 C ATOM 420 NZ LYS A 42 -8.493 18.403 1.919 1.00 0.00 N ATOM 0 H LYS A 42 -4.403 14.720 0.742 1.00 0.00 H new ATOM 0 HA LYS A 42 -4.136 15.205 -1.409 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -4.311 18.112 -0.522 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -4.562 17.517 -2.151 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -6.753 17.486 -1.607 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -6.380 15.998 -0.760 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -5.956 17.289 1.327 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -6.323 18.779 0.481 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -8.609 17.724 -0.084 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -8.211 16.478 1.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -9.526 18.328 2.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -8.043 18.112 2.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -8.235 19.388 1.707 1.00 0.00 H new ATOM 434 N ASP A 43 -2.083 16.705 -2.340 1.00 0.00 N ATOM 435 CA ASP A 43 -0.724 17.021 -2.768 1.00 0.00 C ATOM 436 C ASP A 43 0.136 15.760 -2.813 1.00 0.00 C ATOM 437 O ASP A 43 -0.078 14.824 -2.043 1.00 0.00 O ATOM 438 CB ASP A 43 -0.090 18.053 -1.831 1.00 0.00 C ATOM 439 CG ASP A 43 0.811 19.025 -2.567 1.00 0.00 C ATOM 440 OD1 ASP A 43 1.837 18.580 -3.122 1.00 0.00 O ATOM 441 OD2 ASP A 43 0.491 20.232 -2.586 1.00 0.00 O ATOM 0 H ASP A 43 -2.786 16.790 -3.075 1.00 0.00 H new ATOM 0 HA ASP A 43 -0.777 17.443 -3.772 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -0.877 18.607 -1.320 1.00 0.00 H new ATOM 0 HB3 ASP A 43 0.487 17.537 -1.063 1.00 0.00 H new ATOM 446 N GLY A 44 1.105 15.742 -3.723 1.00 0.00 N ATOM 447 CA GLY A 44 1.976 14.590 -3.852 1.00 0.00 C ATOM 448 C GLY A 44 1.220 13.336 -4.247 1.00 0.00 C ATOM 449 O GLY A 44 1.662 12.221 -3.971 1.00 0.00 O ATOM 0 H GLY A 44 1.302 16.504 -4.372 1.00 0.00 H new ATOM 0 HA2 GLY A 44 2.743 14.799 -4.598 1.00 0.00 H new ATOM 0 HA3 GLY A 44 2.490 14.419 -2.906 1.00 0.00 H new ATOM 453 N LYS A 45 0.072 13.522 -4.895 1.00 0.00 N ATOM 454 CA LYS A 45 -0.757 12.404 -5.330 1.00 0.00 C ATOM 455 C LYS A 45 0.038 11.415 -6.183 1.00 0.00 C ATOM 456 O LYS A 45 -0.011 10.211 -5.948 1.00 0.00 O ATOM 457 CB LYS A 45 -1.962 12.926 -6.115 1.00 0.00 C ATOM 458 CG LYS A 45 -3.234 13.018 -5.289 1.00 0.00 C ATOM 459 CD LYS A 45 -3.022 13.812 -4.007 1.00 0.00 C ATOM 460 CE LYS A 45 -3.600 13.088 -2.801 1.00 0.00 C ATOM 461 NZ LYS A 45 -5.087 13.164 -2.763 1.00 0.00 N ATOM 0 H LYS A 45 -0.305 14.440 -5.130 1.00 0.00 H new ATOM 0 HA LYS A 45 -1.103 11.874 -4.442 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -1.726 13.913 -6.513 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -2.140 12.272 -6.969 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -4.019 13.488 -5.882 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -3.580 12.014 -5.042 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -1.956 13.981 -3.855 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -3.490 14.792 -4.103 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -3.291 12.043 -2.823 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -3.192 13.522 -1.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -5.383 13.780 -1.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -5.438 13.554 -3.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -5.480 12.211 -2.622 1.00 0.00 H new ATOM 475 N PRO A 46 0.775 11.908 -7.192 1.00 0.00 N ATOM 476 CA PRO A 46 1.569 11.048 -8.075 1.00 0.00 C ATOM 477 C PRO A 46 2.522 10.136 -7.304 1.00 0.00 C ATOM 478 O PRO A 46 2.607 8.939 -7.576 1.00 0.00 O ATOM 479 CB PRO A 46 2.359 12.043 -8.928 1.00 0.00 C ATOM 480 CG PRO A 46 1.544 13.290 -8.908 1.00 0.00 C ATOM 481 CD PRO A 46 0.887 13.332 -7.557 1.00 0.00 C ATOM 0 HA PRO A 46 0.938 10.374 -8.654 1.00 0.00 H new ATOM 0 HB2 PRO A 46 3.354 12.214 -8.517 1.00 0.00 H new ATOM 0 HB3 PRO A 46 2.493 11.674 -9.945 1.00 0.00 H new ATOM 0 HG2 PRO A 46 2.170 14.168 -9.065 1.00 0.00 H new ATOM 0 HG3 PRO A 46 0.800 13.283 -9.704 1.00 0.00 H new ATOM 0 HD2 PRO A 46 1.486 13.887 -6.835 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -0.089 13.815 -7.599 1.00 0.00 H new ATOM 489 N GLU A 47 3.239 10.711 -6.345 1.00 0.00 N ATOM 490 CA GLU A 47 4.190 9.950 -5.540 1.00 0.00 C ATOM 491 C GLU A 47 3.488 8.870 -4.721 1.00 0.00 C ATOM 492 O GLU A 47 3.889 7.705 -4.739 1.00 0.00 O ATOM 493 CB GLU A 47 4.964 10.887 -4.609 1.00 0.00 C ATOM 494 CG GLU A 47 5.852 11.877 -5.344 1.00 0.00 C ATOM 495 CD GLU A 47 5.278 13.281 -5.351 1.00 0.00 C ATOM 496 OE1 GLU A 47 4.930 13.786 -4.264 1.00 0.00 O ATOM 497 OE2 GLU A 47 5.178 13.875 -6.446 1.00 0.00 O ATOM 0 H GLU A 47 3.181 11.701 -6.105 1.00 0.00 H new ATOM 0 HA GLU A 47 4.886 9.461 -6.222 1.00 0.00 H new ATOM 0 HB2 GLU A 47 4.255 11.437 -3.990 1.00 0.00 H new ATOM 0 HB3 GLU A 47 5.579 10.290 -3.936 1.00 0.00 H new ATOM 0 HG2 GLU A 47 6.837 11.893 -4.876 1.00 0.00 H new ATOM 0 HG3 GLU A 47 5.992 11.541 -6.371 1.00 0.00 H new ATOM 504 N VAL A 48 2.443 9.264 -4.006 1.00 0.00 N ATOM 505 CA VAL A 48 1.688 8.328 -3.178 1.00 0.00 C ATOM 506 C VAL A 48 0.991 7.280 -4.031 1.00 0.00 C ATOM 507 O VAL A 48 1.184 6.085 -3.840 1.00 0.00 O ATOM 508 CB VAL A 48 0.635 9.057 -2.320 1.00 0.00 C ATOM 509 CG1 VAL A 48 0.065 8.118 -1.267 1.00 0.00 C ATOM 510 CG2 VAL A 48 1.232 10.300 -1.672 1.00 0.00 C ATOM 0 H VAL A 48 2.098 10.223 -3.981 1.00 0.00 H new ATOM 0 HA VAL A 48 2.407 7.839 -2.520 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.179 9.376 -2.972 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -0.677 8.648 -0.670 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.405 7.265 -1.756 1.00 0.00 H new ATOM 0 HG13 VAL A 48 0.868 7.767 -0.619 1.00 0.00 H new ATOM 0 HG21 VAL A 48 0.471 10.798 -1.071 1.00 0.00 H new ATOM 0 HG22 VAL A 48 2.067 10.012 -1.033 1.00 0.00 H new ATOM 0 HG23 VAL A 48 1.586 10.980 -2.447 1.00 0.00 H new ATOM 520 N ASN A 49 0.183 7.730 -4.978 1.00 0.00 N ATOM 521 CA ASN A 49 -0.538 6.820 -5.857 1.00 0.00 C ATOM 522 C ASN A 49 0.414 5.842 -6.541 1.00 0.00 C ATOM 523 O ASN A 49 0.027 4.730 -6.885 1.00 0.00 O ATOM 524 CB ASN A 49 -1.321 7.607 -6.910 1.00 0.00 C ATOM 525 CG ASN A 49 -2.303 8.584 -6.292 1.00 0.00 C ATOM 526 OD1 ASN A 49 -2.849 8.337 -5.217 1.00 0.00 O ATOM 527 ND2 ASN A 49 -2.532 9.702 -6.970 1.00 0.00 N ATOM 0 H ASN A 49 0.009 8.719 -5.158 1.00 0.00 H new ATOM 0 HA ASN A 49 -1.235 6.247 -5.245 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -0.623 8.151 -7.546 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -1.861 6.911 -7.552 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -3.182 10.397 -6.603 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -2.057 9.866 -7.858 1.00 0.00 H new ATOM 534 N ARG A 50 1.658 6.266 -6.741 1.00 0.00 N ATOM 535 CA ARG A 50 2.659 5.424 -7.395 1.00 0.00 C ATOM 536 C ARG A 50 3.124 4.282 -6.493 1.00 0.00 C ATOM 537 O ARG A 50 3.145 3.120 -6.905 1.00 0.00 O ATOM 538 CB ARG A 50 3.862 6.269 -7.821 1.00 0.00 C ATOM 539 CG ARG A 50 4.921 5.483 -8.576 1.00 0.00 C ATOM 540 CD ARG A 50 5.325 6.181 -9.864 1.00 0.00 C ATOM 541 NE ARG A 50 5.636 5.229 -10.929 1.00 0.00 N ATOM 542 CZ ARG A 50 6.742 4.492 -10.965 1.00 0.00 C ATOM 543 NH1 ARG A 50 7.647 4.595 -9.997 1.00 0.00 N ATOM 544 NH2 ARG A 50 6.947 3.651 -11.969 1.00 0.00 N ATOM 0 H ARG A 50 1.999 7.186 -6.461 1.00 0.00 H new ATOM 0 HA ARG A 50 2.189 4.984 -8.274 1.00 0.00 H new ATOM 0 HB2 ARG A 50 3.515 7.090 -8.448 1.00 0.00 H new ATOM 0 HB3 ARG A 50 4.315 6.714 -6.935 1.00 0.00 H new ATOM 0 HG2 ARG A 50 5.798 5.352 -7.942 1.00 0.00 H new ATOM 0 HG3 ARG A 50 4.541 4.487 -8.805 1.00 0.00 H new ATOM 0 HD2 ARG A 50 4.518 6.838 -10.189 1.00 0.00 H new ATOM 0 HD3 ARG A 50 6.194 6.812 -9.677 1.00 0.00 H new ATOM 0 HE ARG A 50 4.965 5.124 -11.690 1.00 0.00 H new ATOM 0 HH11 ARG A 50 7.494 5.241 -9.223 1.00 0.00 H new ATOM 0 HH12 ARG A 50 8.494 4.028 -10.028 1.00 0.00 H new ATOM 0 HH21 ARG A 50 6.256 3.569 -12.715 1.00 0.00 H new ATOM 0 HH22 ARG A 50 7.796 3.086 -11.996 1.00 0.00 H new ATOM 558 N GLN A 51 3.487 4.613 -5.260 1.00 0.00 N ATOM 559 CA GLN A 51 3.945 3.607 -4.309 1.00 0.00 C ATOM 560 C GLN A 51 2.763 2.797 -3.818 1.00 0.00 C ATOM 561 O GLN A 51 2.817 1.570 -3.725 1.00 0.00 O ATOM 562 CB GLN A 51 4.659 4.269 -3.129 1.00 0.00 C ATOM 563 CG GLN A 51 6.054 4.771 -3.465 1.00 0.00 C ATOM 564 CD GLN A 51 6.783 5.318 -2.252 1.00 0.00 C ATOM 565 OE1 GLN A 51 7.936 4.969 -1.998 1.00 0.00 O ATOM 566 NE2 GLN A 51 6.114 6.180 -1.497 1.00 0.00 N ATOM 0 H GLN A 51 3.474 5.566 -4.896 1.00 0.00 H new ATOM 0 HA GLN A 51 4.652 2.945 -4.808 1.00 0.00 H new ATOM 0 HB2 GLN A 51 4.057 5.105 -2.774 1.00 0.00 H new ATOM 0 HB3 GLN A 51 4.727 3.554 -2.309 1.00 0.00 H new ATOM 0 HG2 GLN A 51 6.635 3.957 -3.897 1.00 0.00 H new ATOM 0 HG3 GLN A 51 5.983 5.550 -4.224 1.00 0.00 H new ATOM 0 HE21 GLN A 51 5.160 6.441 -1.745 1.00 0.00 H new ATOM 0 HE22 GLN A 51 6.554 6.581 -0.669 1.00 0.00 H new ATOM 575 N ILE A 52 1.688 3.508 -3.521 1.00 0.00 N ATOM 576 CA ILE A 52 0.462 2.898 -3.052 1.00 0.00 C ATOM 577 C ILE A 52 -0.041 1.867 -4.064 1.00 0.00 C ATOM 578 O ILE A 52 -0.567 0.820 -3.685 1.00 0.00 O ATOM 579 CB ILE A 52 -0.609 3.982 -2.806 1.00 0.00 C ATOM 580 CG1 ILE A 52 -0.199 4.854 -1.606 1.00 0.00 C ATOM 581 CG2 ILE A 52 -1.973 3.355 -2.589 1.00 0.00 C ATOM 582 CD1 ILE A 52 -1.356 5.314 -0.741 1.00 0.00 C ATOM 0 H ILE A 52 1.644 4.524 -3.599 1.00 0.00 H new ATOM 0 HA ILE A 52 0.662 2.386 -2.111 1.00 0.00 H new ATOM 0 HB ILE A 52 -0.680 4.617 -3.689 1.00 0.00 H new ATOM 0 HG12 ILE A 52 0.501 4.293 -0.987 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.334 5.730 -1.975 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -2.711 4.139 -2.418 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -2.253 2.779 -3.471 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -1.936 2.695 -1.722 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -0.977 5.922 0.080 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -2.047 5.906 -1.342 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -1.877 4.445 -0.339 1.00 0.00 H new ATOM 594 N LYS A 53 0.142 2.159 -5.351 1.00 0.00 N ATOM 595 CA LYS A 53 -0.275 1.238 -6.403 1.00 0.00 C ATOM 596 C LYS A 53 0.602 -0.004 -6.391 1.00 0.00 C ATOM 597 O LYS A 53 0.104 -1.127 -6.463 1.00 0.00 O ATOM 598 CB LYS A 53 -0.208 1.907 -7.778 1.00 0.00 C ATOM 599 CG LYS A 53 -1.298 1.450 -8.732 1.00 0.00 C ATOM 600 CD LYS A 53 -1.001 0.070 -9.296 1.00 0.00 C ATOM 601 CE LYS A 53 -2.077 -0.376 -10.274 1.00 0.00 C ATOM 602 NZ LYS A 53 -1.659 -0.171 -11.689 1.00 0.00 N ATOM 0 H LYS A 53 0.573 3.020 -5.687 1.00 0.00 H new ATOM 0 HA LYS A 53 -1.309 0.951 -6.210 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -0.278 2.987 -7.651 1.00 0.00 H new ATOM 0 HB3 LYS A 53 0.764 1.701 -8.226 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -2.255 1.433 -8.211 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -1.392 2.166 -9.549 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -0.034 0.082 -9.798 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -0.928 -0.650 -8.480 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -2.302 -1.430 -10.111 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -2.995 0.179 -10.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -2.419 -0.487 -12.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -1.469 0.838 -11.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -0.797 -0.721 -11.880 1.00 0.00 H new ATOM 616 N ASN A 54 1.914 0.201 -6.294 1.00 0.00 N ATOM 617 CA ASN A 54 2.858 -0.914 -6.271 1.00 0.00 C ATOM 618 C ASN A 54 2.452 -1.943 -5.223 1.00 0.00 C ATOM 619 O ASN A 54 2.520 -3.149 -5.466 1.00 0.00 O ATOM 620 CB ASN A 54 4.274 -0.408 -5.985 1.00 0.00 C ATOM 621 CG ASN A 54 4.676 0.733 -6.898 1.00 0.00 C ATOM 622 OD1 ASN A 54 4.159 0.869 -8.006 1.00 0.00 O ATOM 623 ND2 ASN A 54 5.606 1.560 -6.435 1.00 0.00 N ATOM 0 H ASN A 54 2.346 1.123 -6.230 1.00 0.00 H new ATOM 0 HA ASN A 54 2.844 -1.391 -7.251 1.00 0.00 H new ATOM 0 HB2 ASN A 54 4.337 -0.079 -4.948 1.00 0.00 H new ATOM 0 HB3 ASN A 54 4.981 -1.229 -6.102 1.00 0.00 H new ATOM 0 HD21 ASN A 54 5.919 2.346 -7.005 1.00 0.00 H new ATOM 0 HD22 ASN A 54 6.008 1.409 -5.510 1.00 0.00 H new ATOM 630 N LEU A 55 2.018 -1.467 -4.058 1.00 0.00 N ATOM 631 CA LEU A 55 1.591 -2.365 -2.992 1.00 0.00 C ATOM 632 C LEU A 55 0.295 -3.060 -3.374 1.00 0.00 C ATOM 633 O LEU A 55 0.150 -4.269 -3.186 1.00 0.00 O ATOM 634 CB LEU A 55 1.415 -1.606 -1.672 1.00 0.00 C ATOM 635 CG LEU A 55 2.453 -0.515 -1.400 1.00 0.00 C ATOM 636 CD1 LEU A 55 2.345 -0.025 0.037 1.00 0.00 C ATOM 637 CD2 LEU A 55 3.859 -1.022 -1.687 1.00 0.00 C ATOM 0 H LEU A 55 1.954 -0.475 -3.831 1.00 0.00 H new ATOM 0 HA LEU A 55 2.367 -3.117 -2.852 1.00 0.00 H new ATOM 0 HB2 LEU A 55 0.424 -1.152 -1.663 1.00 0.00 H new ATOM 0 HB3 LEU A 55 1.444 -2.324 -0.853 1.00 0.00 H new ATOM 0 HG LEU A 55 2.251 0.322 -2.068 1.00 0.00 H new ATOM 0 HD11 LEU A 55 3.090 0.751 0.214 1.00 0.00 H new ATOM 0 HD12 LEU A 55 1.349 0.383 0.208 1.00 0.00 H new ATOM 0 HD13 LEU A 55 2.519 -0.857 0.719 1.00 0.00 H new ATOM 0 HD21 LEU A 55 4.580 -0.229 -1.487 1.00 0.00 H new ATOM 0 HD22 LEU A 55 4.074 -1.878 -1.048 1.00 0.00 H new ATOM 0 HD23 LEU A 55 3.931 -1.322 -2.732 1.00 0.00 H new ATOM 649 N GLU A 56 -0.638 -2.301 -3.938 1.00 0.00 N ATOM 650 CA GLU A 56 -1.909 -2.866 -4.373 1.00 0.00 C ATOM 651 C GLU A 56 -1.639 -4.000 -5.353 1.00 0.00 C ATOM 652 O GLU A 56 -2.325 -5.022 -5.355 1.00 0.00 O ATOM 653 CB GLU A 56 -2.781 -1.792 -5.028 1.00 0.00 C ATOM 654 CG GLU A 56 -4.068 -1.509 -4.270 1.00 0.00 C ATOM 655 CD GLU A 56 -5.285 -2.114 -4.940 1.00 0.00 C ATOM 656 OE1 GLU A 56 -5.159 -3.214 -5.518 1.00 0.00 O ATOM 657 OE2 GLU A 56 -6.365 -1.487 -4.888 1.00 0.00 O ATOM 0 H GLU A 56 -0.539 -1.299 -4.104 1.00 0.00 H new ATOM 0 HA GLU A 56 -2.447 -3.252 -3.507 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -2.207 -0.869 -5.110 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -3.028 -2.105 -6.043 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -3.983 -1.902 -3.257 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -4.204 -0.431 -4.183 1.00 0.00 H new ATOM 664 N ILE A 57 -0.607 -3.807 -6.168 1.00 0.00 N ATOM 665 CA ILE A 57 -0.194 -4.798 -7.144 1.00 0.00 C ATOM 666 C ILE A 57 0.436 -5.993 -6.444 1.00 0.00 C ATOM 667 O ILE A 57 0.172 -7.143 -6.795 1.00 0.00 O ATOM 668 CB ILE A 57 0.818 -4.193 -8.132 1.00 0.00 C ATOM 669 CG1 ILE A 57 0.238 -2.927 -8.754 1.00 0.00 C ATOM 670 CG2 ILE A 57 1.196 -5.196 -9.207 1.00 0.00 C ATOM 671 CD1 ILE A 57 1.283 -1.891 -9.100 1.00 0.00 C ATOM 0 H ILE A 57 -0.038 -2.961 -6.167 1.00 0.00 H new ATOM 0 HA ILE A 57 -1.077 -5.124 -7.694 1.00 0.00 H new ATOM 0 HB ILE A 57 1.726 -3.935 -7.587 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -0.310 -3.194 -9.657 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -0.481 -2.489 -8.062 1.00 0.00 H new ATOM 0 HG21 ILE A 57 1.912 -4.743 -9.892 1.00 0.00 H new ATOM 0 HG22 ILE A 57 1.644 -6.075 -8.743 1.00 0.00 H new ATOM 0 HG23 ILE A 57 0.304 -5.492 -9.759 1.00 0.00 H new ATOM 0 HD11 ILE A 57 0.799 -1.018 -9.538 1.00 0.00 H new ATOM 0 HD12 ILE A 57 1.815 -1.595 -8.196 1.00 0.00 H new ATOM 0 HD13 ILE A 57 1.989 -2.312 -9.816 1.00 0.00 H new ATOM 683 N SER A 58 1.265 -5.711 -5.443 1.00 0.00 N ATOM 684 CA SER A 58 1.925 -6.766 -4.682 1.00 0.00 C ATOM 685 C SER A 58 0.891 -7.674 -4.024 1.00 0.00 C ATOM 686 O SER A 58 0.992 -8.900 -4.087 1.00 0.00 O ATOM 687 CB SER A 58 2.843 -6.161 -3.619 1.00 0.00 C ATOM 688 OG SER A 58 4.060 -5.709 -4.188 1.00 0.00 O ATOM 0 H SER A 58 1.495 -4.764 -5.141 1.00 0.00 H new ATOM 0 HA SER A 58 2.527 -7.361 -5.369 1.00 0.00 H new ATOM 0 HB2 SER A 58 2.337 -5.329 -3.129 1.00 0.00 H new ATOM 0 HB3 SER A 58 3.052 -6.905 -2.850 1.00 0.00 H new ATOM 0 HG SER A 58 3.901 -4.878 -4.683 1.00 0.00 H new ATOM 694 N ILE A 59 -0.111 -7.059 -3.403 1.00 0.00 N ATOM 695 CA ILE A 59 -1.177 -7.802 -2.741 1.00 0.00 C ATOM 696 C ILE A 59 -1.973 -8.615 -3.757 1.00 0.00 C ATOM 697 O ILE A 59 -2.138 -9.830 -3.610 1.00 0.00 O ATOM 698 CB ILE A 59 -2.130 -6.850 -1.987 1.00 0.00 C ATOM 699 CG1 ILE A 59 -1.341 -5.973 -1.013 1.00 0.00 C ATOM 700 CG2 ILE A 59 -3.202 -7.634 -1.247 1.00 0.00 C ATOM 701 CD1 ILE A 59 -2.111 -4.763 -0.532 1.00 0.00 C ATOM 0 H ILE A 59 -0.207 -6.045 -3.345 1.00 0.00 H new ATOM 0 HA ILE A 59 -0.712 -8.477 -2.022 1.00 0.00 H new ATOM 0 HB ILE A 59 -2.622 -6.207 -2.717 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -1.048 -6.573 -0.152 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -0.423 -5.641 -1.497 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -3.862 -6.943 -0.723 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -3.782 -8.219 -1.960 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -2.731 -8.303 -0.526 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -1.491 -4.187 0.155 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -2.382 -4.141 -1.385 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -3.016 -5.088 -0.019 1.00 0.00 H new ATOM 713 N ASP A 60 -2.457 -7.937 -4.794 1.00 0.00 N ATOM 714 CA ASP A 60 -3.225 -8.593 -5.844 1.00 0.00 C ATOM 715 C ASP A 60 -2.410 -9.718 -6.471 1.00 0.00 C ATOM 716 O ASP A 60 -2.954 -10.751 -6.867 1.00 0.00 O ATOM 717 CB ASP A 60 -3.632 -7.581 -6.917 1.00 0.00 C ATOM 718 CG ASP A 60 -4.693 -6.613 -6.428 1.00 0.00 C ATOM 719 OD1 ASP A 60 -5.379 -6.937 -5.436 1.00 0.00 O ATOM 720 OD2 ASP A 60 -4.836 -5.533 -7.038 1.00 0.00 O ATOM 0 H ASP A 60 -2.330 -6.934 -4.928 1.00 0.00 H new ATOM 0 HA ASP A 60 -4.126 -9.016 -5.400 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -2.753 -7.021 -7.236 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -4.006 -8.114 -7.792 1.00 0.00 H new ATOM 725 N ALA A 61 -1.100 -9.509 -6.551 1.00 0.00 N ATOM 726 CA ALA A 61 -0.203 -10.503 -7.120 1.00 0.00 C ATOM 727 C ALA A 61 -0.259 -11.800 -6.324 1.00 0.00 C ATOM 728 O ALA A 61 -0.408 -12.883 -6.891 1.00 0.00 O ATOM 729 CB ALA A 61 1.221 -9.967 -7.162 1.00 0.00 C ATOM 0 H ALA A 61 -0.638 -8.659 -6.228 1.00 0.00 H new ATOM 0 HA ALA A 61 -0.527 -10.714 -8.139 1.00 0.00 H new ATOM 0 HB1 ALA A 61 1.881 -10.721 -7.590 1.00 0.00 H new ATOM 0 HB2 ALA A 61 1.253 -9.067 -7.775 1.00 0.00 H new ATOM 0 HB3 ALA A 61 1.550 -9.729 -6.151 1.00 0.00 H new ATOM 735 N LEU A 62 -0.141 -11.689 -5.002 1.00 0.00 N ATOM 736 CA LEU A 62 -0.181 -12.857 -4.138 1.00 0.00 C ATOM 737 C LEU A 62 -1.457 -13.654 -4.358 1.00 0.00 C ATOM 738 O LEU A 62 -1.399 -14.839 -4.676 1.00 0.00 O ATOM 739 CB LEU A 62 -0.081 -12.435 -2.673 1.00 0.00 C ATOM 740 CG LEU A 62 1.326 -12.050 -2.219 1.00 0.00 C ATOM 741 CD1 LEU A 62 1.418 -10.554 -1.942 1.00 0.00 C ATOM 742 CD2 LEU A 62 1.733 -12.853 -0.991 1.00 0.00 C ATOM 0 H LEU A 62 -0.017 -10.803 -4.511 1.00 0.00 H new ATOM 0 HA LEU A 62 0.670 -13.491 -4.388 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -0.747 -11.589 -2.506 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -0.440 -13.252 -2.047 1.00 0.00 H new ATOM 0 HG LEU A 62 2.019 -12.286 -3.026 1.00 0.00 H new ATOM 0 HD11 LEU A 62 2.429 -10.305 -1.620 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.179 -10.000 -2.850 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.711 -10.285 -1.157 1.00 0.00 H new ATOM 0 HD21 LEU A 62 2.738 -12.564 -0.684 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.034 -12.655 -0.178 1.00 0.00 H new ATOM 0 HD23 LEU A 62 1.719 -13.916 -1.230 1.00 0.00 H new ATOM 754 N MET A 63 -2.607 -12.996 -4.197 1.00 0.00 N ATOM 755 CA MET A 63 -3.903 -13.669 -4.383 1.00 0.00 C ATOM 756 C MET A 63 -3.898 -14.512 -5.655 1.00 0.00 C ATOM 757 O MET A 63 -4.193 -15.708 -5.619 1.00 0.00 O ATOM 758 CB MET A 63 -5.086 -12.679 -4.436 1.00 0.00 C ATOM 759 CG MET A 63 -4.713 -11.202 -4.517 1.00 0.00 C ATOM 760 SD MET A 63 -5.205 -10.263 -3.052 1.00 0.00 S ATOM 761 CE MET A 63 -4.915 -11.450 -1.740 1.00 0.00 C ATOM 0 H MET A 63 -2.673 -12.011 -3.942 1.00 0.00 H new ATOM 0 HA MET A 63 -4.041 -14.310 -3.512 1.00 0.00 H new ATOM 0 HB2 MET A 63 -5.704 -12.926 -5.299 1.00 0.00 H new ATOM 0 HB3 MET A 63 -5.702 -12.831 -3.550 1.00 0.00 H new ATOM 0 HG2 MET A 63 -3.635 -11.113 -4.653 1.00 0.00 H new ATOM 0 HG3 MET A 63 -5.183 -10.763 -5.397 1.00 0.00 H new ATOM 0 HE1 MET A 63 -4.864 -10.930 -0.784 1.00 0.00 H new ATOM 0 HE2 MET A 63 -5.730 -12.173 -1.717 1.00 0.00 H new ATOM 0 HE3 MET A 63 -3.974 -11.970 -1.921 1.00 0.00 H new ATOM 771 N ALA A 64 -3.553 -13.887 -6.773 1.00 0.00 N ATOM 772 CA ALA A 64 -3.505 -14.590 -8.046 1.00 0.00 C ATOM 773 C ALA A 64 -2.487 -15.727 -8.003 1.00 0.00 C ATOM 774 O ALA A 64 -2.602 -16.703 -8.744 1.00 0.00 O ATOM 775 CB ALA A 64 -3.170 -13.623 -9.171 1.00 0.00 C ATOM 0 H ALA A 64 -3.304 -12.899 -6.824 1.00 0.00 H new ATOM 0 HA ALA A 64 -4.488 -15.021 -8.234 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -3.137 -14.163 -10.117 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -3.933 -12.846 -9.222 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -2.199 -13.166 -8.981 1.00 0.00 H new ATOM 781 N LYS A 65 -1.495 -15.597 -7.125 1.00 0.00 N ATOM 782 CA LYS A 65 -0.463 -16.614 -6.978 1.00 0.00 C ATOM 783 C LYS A 65 -0.948 -17.743 -6.080 1.00 0.00 C ATOM 784 O LYS A 65 -0.541 -18.893 -6.229 1.00 0.00 O ATOM 785 CB LYS A 65 0.815 -16.001 -6.404 1.00 0.00 C ATOM 786 CG LYS A 65 1.683 -15.311 -7.444 1.00 0.00 C ATOM 787 CD LYS A 65 3.157 -15.369 -7.071 1.00 0.00 C ATOM 788 CE LYS A 65 3.711 -13.987 -6.762 1.00 0.00 C ATOM 789 NZ LYS A 65 3.550 -13.632 -5.325 1.00 0.00 N ATOM 0 H LYS A 65 -1.386 -14.795 -6.505 1.00 0.00 H new ATOM 0 HA LYS A 65 -0.244 -17.022 -7.965 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.546 -15.280 -5.632 1.00 0.00 H new ATOM 0 HB3 LYS A 65 1.398 -16.785 -5.920 1.00 0.00 H new ATOM 0 HG2 LYS A 65 1.534 -15.784 -8.415 1.00 0.00 H new ATOM 0 HG3 LYS A 65 1.373 -14.271 -7.545 1.00 0.00 H new ATOM 0 HD2 LYS A 65 3.288 -16.016 -6.204 1.00 0.00 H new ATOM 0 HD3 LYS A 65 3.723 -15.814 -7.890 1.00 0.00 H new ATOM 0 HE2 LYS A 65 4.767 -13.952 -7.028 1.00 0.00 H new ATOM 0 HE3 LYS A 65 3.202 -13.246 -7.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 3.026 -12.738 -5.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 3.025 -14.386 -4.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 4.487 -13.524 -4.887 1.00 0.00 H new ATOM 803 N ILE A 66 -1.817 -17.399 -5.139 1.00 0.00 N ATOM 804 CA ILE A 66 -2.352 -18.379 -4.206 1.00 0.00 C ATOM 805 C ILE A 66 -3.320 -19.325 -4.904 1.00 0.00 C ATOM 806 O ILE A 66 -3.419 -20.501 -4.554 1.00 0.00 O ATOM 807 CB ILE A 66 -3.078 -17.718 -3.016 1.00 0.00 C ATOM 808 CG1 ILE A 66 -2.514 -16.331 -2.725 1.00 0.00 C ATOM 809 CG2 ILE A 66 -2.971 -18.598 -1.787 1.00 0.00 C ATOM 810 CD1 ILE A 66 -1.022 -16.312 -2.456 1.00 0.00 C ATOM 0 H ILE A 66 -2.165 -16.450 -5.002 1.00 0.00 H new ATOM 0 HA ILE A 66 -1.496 -18.936 -3.826 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.129 -17.603 -3.282 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -2.728 -15.679 -3.572 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -3.033 -15.913 -1.862 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.487 -18.122 -0.953 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.428 -19.566 -1.992 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.921 -18.740 -1.531 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -0.701 -15.289 -2.258 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -0.800 -16.936 -1.590 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -0.490 -16.697 -3.326 1.00 0.00 H new ATOM 822 N LYS A 67 -4.044 -18.798 -5.884 1.00 0.00 N ATOM 823 CA LYS A 67 -5.021 -19.587 -6.627 1.00 0.00 C ATOM 824 C LYS A 67 -4.423 -20.205 -7.894 1.00 0.00 C ATOM 825 O LYS A 67 -5.126 -20.883 -8.642 1.00 0.00 O ATOM 826 CB LYS A 67 -6.230 -18.720 -6.991 1.00 0.00 C ATOM 827 CG LYS A 67 -7.498 -19.100 -6.242 1.00 0.00 C ATOM 828 CD LYS A 67 -7.995 -17.961 -5.359 1.00 0.00 C ATOM 829 CE LYS A 67 -9.321 -17.407 -5.855 1.00 0.00 C ATOM 830 NZ LYS A 67 -9.501 -15.977 -5.484 1.00 0.00 N ATOM 0 H LYS A 67 -3.973 -17.826 -6.184 1.00 0.00 H new ATOM 0 HA LYS A 67 -5.336 -20.406 -5.980 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -5.994 -17.676 -6.783 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -6.413 -18.798 -8.063 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -8.275 -19.372 -6.957 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -7.308 -19.980 -5.628 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -8.109 -18.317 -4.335 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -7.252 -17.164 -5.339 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -9.374 -17.510 -6.939 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -10.138 -17.995 -5.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -10.417 -15.638 -5.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -9.476 -15.881 -4.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -8.736 -15.411 -5.903 1.00 0.00 H new ATOM 844 N SER A 68 -3.134 -19.973 -8.141 1.00 0.00 N ATOM 845 CA SER A 68 -2.490 -20.524 -9.330 1.00 0.00 C ATOM 846 C SER A 68 -1.054 -20.959 -9.053 1.00 0.00 C ATOM 847 O SER A 68 -0.243 -21.075 -9.974 1.00 0.00 O ATOM 848 CB SER A 68 -2.516 -19.506 -10.473 1.00 0.00 C ATOM 849 OG SER A 68 -3.701 -19.632 -11.241 1.00 0.00 O ATOM 0 H SER A 68 -2.524 -19.416 -7.543 1.00 0.00 H new ATOM 0 HA SER A 68 -3.055 -21.409 -9.621 1.00 0.00 H new ATOM 0 HB2 SER A 68 -2.448 -18.497 -10.067 1.00 0.00 H new ATOM 0 HB3 SER A 68 -1.646 -19.652 -11.114 1.00 0.00 H new ATOM 0 HG SER A 68 -4.409 -20.025 -10.688 1.00 0.00 H new ATOM 855 N THR A 69 -0.750 -21.214 -7.788 1.00 0.00 N ATOM 856 CA THR A 69 0.588 -21.656 -7.392 1.00 0.00 C ATOM 857 C THR A 69 0.548 -22.329 -6.023 1.00 0.00 C ATOM 858 O THR A 69 -0.364 -22.091 -5.230 1.00 0.00 O ATOM 859 CB THR A 69 1.588 -20.487 -7.362 1.00 0.00 C ATOM 860 OG1 THR A 69 1.636 -19.892 -6.077 1.00 0.00 O ATOM 861 CG2 THR A 69 1.290 -19.389 -8.364 1.00 0.00 C ATOM 0 H THR A 69 -1.409 -21.124 -7.015 1.00 0.00 H new ATOM 0 HA THR A 69 0.924 -22.374 -8.140 1.00 0.00 H new ATOM 0 HB THR A 69 2.543 -20.939 -7.628 1.00 0.00 H new ATOM 0 HG1 THR A 69 0.724 -19.727 -5.759 1.00 0.00 H new ATOM 0 HG21 THR A 69 2.041 -18.604 -8.278 1.00 0.00 H new ATOM 0 HG22 THR A 69 1.311 -19.802 -9.373 1.00 0.00 H new ATOM 0 HG23 THR A 69 0.304 -18.971 -8.163 1.00 0.00 H new ATOM 869 N MET A 70 1.543 -23.165 -5.750 1.00 0.00 N ATOM 870 CA MET A 70 1.623 -23.864 -4.474 1.00 0.00 C ATOM 871 C MET A 70 2.602 -23.161 -3.541 1.00 0.00 C ATOM 872 O MET A 70 3.323 -23.806 -2.778 1.00 0.00 O ATOM 873 CB MET A 70 2.050 -25.320 -4.690 1.00 0.00 C ATOM 874 CG MET A 70 1.127 -26.326 -4.024 1.00 0.00 C ATOM 875 SD MET A 70 1.984 -27.840 -3.541 1.00 0.00 S ATOM 876 CE MET A 70 0.715 -28.648 -2.567 1.00 0.00 C ATOM 0 H MET A 70 2.305 -23.375 -6.395 1.00 0.00 H new ATOM 0 HA MET A 70 0.635 -23.854 -4.013 1.00 0.00 H new ATOM 0 HB2 MET A 70 2.087 -25.525 -5.760 1.00 0.00 H new ATOM 0 HB3 MET A 70 3.061 -25.455 -4.305 1.00 0.00 H new ATOM 0 HG2 MET A 70 0.676 -25.871 -3.142 1.00 0.00 H new ATOM 0 HG3 MET A 70 0.314 -26.575 -4.706 1.00 0.00 H new ATOM 0 HE1 MET A 70 1.093 -29.601 -2.196 1.00 0.00 H new ATOM 0 HE2 MET A 70 0.443 -28.012 -1.724 1.00 0.00 H new ATOM 0 HE3 MET A 70 -0.164 -28.823 -3.188 1.00 0.00 H new ATOM 886 N MET A 71 2.623 -21.833 -3.608 1.00 0.00 N ATOM 887 CA MET A 71 3.513 -21.034 -2.775 1.00 0.00 C ATOM 888 C MET A 71 3.275 -21.312 -1.295 1.00 0.00 C ATOM 889 O MET A 71 2.133 -21.438 -0.851 1.00 0.00 O ATOM 890 CB MET A 71 3.312 -19.545 -3.062 1.00 0.00 C ATOM 891 CG MET A 71 4.226 -19.008 -4.153 1.00 0.00 C ATOM 892 SD MET A 71 5.539 -17.954 -3.507 1.00 0.00 S ATOM 893 CE MET A 71 4.586 -16.778 -2.550 1.00 0.00 C ATOM 0 H MET A 71 2.031 -21.287 -4.234 1.00 0.00 H new ATOM 0 HA MET A 71 4.539 -21.311 -3.017 1.00 0.00 H new ATOM 0 HB2 MET A 71 2.275 -19.376 -3.352 1.00 0.00 H new ATOM 0 HB3 MET A 71 3.483 -18.980 -2.145 1.00 0.00 H new ATOM 0 HG2 MET A 71 4.670 -19.844 -4.693 1.00 0.00 H new ATOM 0 HG3 MET A 71 3.633 -18.443 -4.872 1.00 0.00 H new ATOM 0 HE1 MET A 71 5.119 -15.828 -2.505 1.00 0.00 H new ATOM 0 HE2 MET A 71 3.615 -16.627 -3.022 1.00 0.00 H new ATOM 0 HE3 MET A 71 4.443 -17.162 -1.540 1.00 0.00 H new ATOM 903 N THR A 72 4.361 -21.404 -0.538 1.00 0.00 N ATOM 904 CA THR A 72 4.275 -21.664 0.894 1.00 0.00 C ATOM 905 C THR A 72 3.805 -20.423 1.642 1.00 0.00 C ATOM 906 O THR A 72 4.132 -19.298 1.263 1.00 0.00 O ATOM 907 CB THR A 72 5.635 -22.113 1.432 1.00 0.00 C ATOM 908 OG1 THR A 72 6.191 -23.123 0.610 1.00 0.00 O ATOM 909 CG2 THR A 72 5.571 -22.652 2.845 1.00 0.00 C ATOM 0 H THR A 72 5.312 -21.302 -0.892 1.00 0.00 H new ATOM 0 HA THR A 72 3.547 -22.460 1.053 1.00 0.00 H new ATOM 0 HB THR A 72 6.257 -21.218 1.430 1.00 0.00 H new ATOM 0 HG1 THR A 72 7.061 -23.395 0.970 1.00 0.00 H new ATOM 0 HG21 THR A 72 6.569 -22.952 3.165 1.00 0.00 H new ATOM 0 HG22 THR A 72 5.193 -21.878 3.513 1.00 0.00 H new ATOM 0 HG23 THR A 72 4.905 -23.514 2.876 1.00 0.00 H new ATOM 917 N ARG A 73 3.039 -20.632 2.708 1.00 0.00 N ATOM 918 CA ARG A 73 2.529 -19.526 3.510 1.00 0.00 C ATOM 919 C ARG A 73 3.674 -18.653 4.013 1.00 0.00 C ATOM 920 O ARG A 73 3.514 -17.446 4.194 1.00 0.00 O ATOM 921 CB ARG A 73 1.717 -20.055 4.693 1.00 0.00 C ATOM 922 CG ARG A 73 2.519 -20.938 5.636 1.00 0.00 C ATOM 923 CD ARG A 73 2.945 -20.179 6.883 1.00 0.00 C ATOM 924 NE ARG A 73 1.800 -19.772 7.694 1.00 0.00 N ATOM 925 CZ ARG A 73 1.128 -20.598 8.492 1.00 0.00 C ATOM 926 NH1 ARG A 73 1.482 -21.871 8.592 1.00 0.00 N ATOM 927 NH2 ARG A 73 0.097 -20.146 9.195 1.00 0.00 N ATOM 0 H ARG A 73 2.758 -21.556 3.036 1.00 0.00 H new ATOM 0 HA ARG A 73 1.880 -18.919 2.879 1.00 0.00 H new ATOM 0 HB2 ARG A 73 1.315 -19.211 5.253 1.00 0.00 H new ATOM 0 HB3 ARG A 73 0.866 -20.621 4.315 1.00 0.00 H new ATOM 0 HG2 ARG A 73 1.921 -21.804 5.922 1.00 0.00 H new ATOM 0 HG3 ARG A 73 3.401 -21.316 5.120 1.00 0.00 H new ATOM 0 HD2 ARG A 73 3.608 -20.806 7.480 1.00 0.00 H new ATOM 0 HD3 ARG A 73 3.516 -19.297 6.593 1.00 0.00 H new ATOM 0 HE ARG A 73 1.498 -18.799 7.646 1.00 0.00 H new ATOM 0 HH11 ARG A 73 2.274 -22.224 8.055 1.00 0.00 H new ATOM 0 HH12 ARG A 73 0.962 -22.498 9.206 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -0.179 -19.167 9.123 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -0.419 -20.778 9.807 1.00 0.00 H new ATOM 941 N GLU A 74 4.830 -19.271 4.230 1.00 0.00 N ATOM 942 CA GLU A 74 6.005 -18.549 4.704 1.00 0.00 C ATOM 943 C GLU A 74 6.386 -17.448 3.720 1.00 0.00 C ATOM 944 O GLU A 74 6.665 -16.315 4.116 1.00 0.00 O ATOM 945 CB GLU A 74 7.179 -19.511 4.901 1.00 0.00 C ATOM 946 CG GLU A 74 7.834 -19.398 6.268 1.00 0.00 C ATOM 947 CD GLU A 74 8.618 -20.641 6.645 1.00 0.00 C ATOM 948 OE1 GLU A 74 9.250 -21.237 5.748 1.00 0.00 O ATOM 949 OE2 GLU A 74 8.599 -21.016 7.836 1.00 0.00 O ATOM 0 H GLU A 74 4.978 -20.270 4.085 1.00 0.00 H new ATOM 0 HA GLU A 74 5.764 -18.091 5.663 1.00 0.00 H new ATOM 0 HB2 GLU A 74 6.828 -20.533 4.759 1.00 0.00 H new ATOM 0 HB3 GLU A 74 7.927 -19.321 4.132 1.00 0.00 H new ATOM 0 HG2 GLU A 74 8.501 -18.536 6.277 1.00 0.00 H new ATOM 0 HG3 GLU A 74 7.067 -19.215 7.020 1.00 0.00 H new ATOM 956 N GLN A 75 6.386 -17.787 2.434 1.00 0.00 N ATOM 957 CA GLN A 75 6.722 -16.825 1.393 1.00 0.00 C ATOM 958 C GLN A 75 5.750 -15.650 1.422 1.00 0.00 C ATOM 959 O GLN A 75 6.125 -14.513 1.141 1.00 0.00 O ATOM 960 CB GLN A 75 6.697 -17.497 0.018 1.00 0.00 C ATOM 961 CG GLN A 75 8.075 -17.882 -0.494 1.00 0.00 C ATOM 962 CD GLN A 75 8.982 -16.682 -0.684 1.00 0.00 C ATOM 963 OE1 GLN A 75 8.710 -15.806 -1.505 1.00 0.00 O ATOM 964 NE2 GLN A 75 10.069 -16.635 0.079 1.00 0.00 N ATOM 0 H GLN A 75 6.157 -18.719 2.090 1.00 0.00 H new ATOM 0 HA GLN A 75 7.728 -16.451 1.580 1.00 0.00 H new ATOM 0 HB2 GLN A 75 6.075 -18.391 0.070 1.00 0.00 H new ATOM 0 HB3 GLN A 75 6.227 -16.823 -0.698 1.00 0.00 H new ATOM 0 HG2 GLN A 75 8.538 -18.576 0.207 1.00 0.00 H new ATOM 0 HG3 GLN A 75 7.972 -18.409 -1.443 1.00 0.00 H new ATOM 0 HE21 GLN A 75 10.256 -17.383 0.747 1.00 0.00 H new ATOM 0 HE22 GLN A 75 10.716 -15.851 -0.003 1.00 0.00 H new ATOM 973 N ILE A 76 4.502 -15.937 1.777 1.00 0.00 N ATOM 974 CA ILE A 76 3.474 -14.908 1.859 1.00 0.00 C ATOM 975 C ILE A 76 3.728 -13.994 3.051 1.00 0.00 C ATOM 976 O ILE A 76 3.450 -12.795 3.001 1.00 0.00 O ATOM 977 CB ILE A 76 2.066 -15.522 1.988 1.00 0.00 C ATOM 978 CG1 ILE A 76 1.838 -16.571 0.895 1.00 0.00 C ATOM 979 CG2 ILE A 76 1.002 -14.436 1.920 1.00 0.00 C ATOM 980 CD1 ILE A 76 1.717 -15.986 -0.495 1.00 0.00 C ATOM 0 H ILE A 76 4.179 -16.875 2.013 1.00 0.00 H new ATOM 0 HA ILE A 76 3.521 -14.332 0.935 1.00 0.00 H new ATOM 0 HB ILE A 76 1.991 -16.014 2.958 1.00 0.00 H new ATOM 0 HG12 ILE A 76 2.663 -17.283 0.909 1.00 0.00 H new ATOM 0 HG13 ILE A 76 0.931 -17.130 1.124 1.00 0.00 H new ATOM 0 HG21 ILE A 76 0.014 -14.888 2.013 1.00 0.00 H new ATOM 0 HG22 ILE A 76 1.154 -13.726 2.733 1.00 0.00 H new ATOM 0 HG23 ILE A 76 1.074 -13.915 0.965 1.00 0.00 H new ATOM 0 HD11 ILE A 76 1.557 -16.789 -1.215 1.00 0.00 H new ATOM 0 HD12 ILE A 76 0.874 -15.296 -0.527 1.00 0.00 H new ATOM 0 HD13 ILE A 76 2.633 -15.451 -0.746 1.00 0.00 H new ATOM 992 N GLN A 77 4.261 -14.570 4.122 1.00 0.00 N ATOM 993 CA GLN A 77 4.560 -13.813 5.332 1.00 0.00 C ATOM 994 C GLN A 77 5.616 -12.748 5.052 1.00 0.00 C ATOM 995 O GLN A 77 5.432 -11.577 5.382 1.00 0.00 O ATOM 996 CB GLN A 77 5.039 -14.752 6.441 1.00 0.00 C ATOM 997 CG GLN A 77 4.294 -14.571 7.754 1.00 0.00 C ATOM 998 CD GLN A 77 3.137 -15.538 7.905 1.00 0.00 C ATOM 999 OE1 GLN A 77 3.195 -16.473 8.705 1.00 0.00 O ATOM 1000 NE2 GLN A 77 2.078 -15.320 7.135 1.00 0.00 N ATOM 0 H GLN A 77 4.496 -15.561 4.177 1.00 0.00 H new ATOM 0 HA GLN A 77 3.647 -13.317 5.661 1.00 0.00 H new ATOM 0 HB2 GLN A 77 4.925 -15.783 6.107 1.00 0.00 H new ATOM 0 HB3 GLN A 77 6.103 -14.588 6.611 1.00 0.00 H new ATOM 0 HG2 GLN A 77 4.988 -14.708 8.583 1.00 0.00 H new ATOM 0 HG3 GLN A 77 3.920 -13.549 7.817 1.00 0.00 H new ATOM 0 HE21 GLN A 77 2.073 -14.533 6.486 1.00 0.00 H new ATOM 0 HE22 GLN A 77 1.270 -15.939 7.192 1.00 0.00 H new ATOM 1009 N LYS A 78 6.721 -13.161 4.439 1.00 0.00 N ATOM 1010 CA LYS A 78 7.799 -12.235 4.115 1.00 0.00 C ATOM 1011 C LYS A 78 7.304 -11.153 3.168 1.00 0.00 C ATOM 1012 O LYS A 78 7.554 -9.969 3.385 1.00 0.00 O ATOM 1013 CB LYS A 78 8.982 -12.980 3.497 1.00 0.00 C ATOM 1014 CG LYS A 78 9.499 -14.122 4.356 1.00 0.00 C ATOM 1015 CD LYS A 78 10.711 -13.704 5.171 1.00 0.00 C ATOM 1016 CE LYS A 78 11.194 -14.829 6.071 1.00 0.00 C ATOM 1017 NZ LYS A 78 10.336 -14.979 7.279 1.00 0.00 N ATOM 0 H LYS A 78 6.893 -14.126 4.158 1.00 0.00 H new ATOM 0 HA LYS A 78 8.133 -11.763 5.039 1.00 0.00 H new ATOM 0 HB2 LYS A 78 8.685 -13.374 2.525 1.00 0.00 H new ATOM 0 HB3 LYS A 78 9.793 -12.274 3.320 1.00 0.00 H new ATOM 0 HG2 LYS A 78 8.709 -14.461 5.026 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.762 -14.967 3.719 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.515 -13.403 4.500 1.00 0.00 H new ATOM 0 HD3 LYS A 78 10.460 -12.834 5.778 1.00 0.00 H new ATOM 0 HE2 LYS A 78 11.201 -15.764 5.512 1.00 0.00 H new ATOM 0 HE3 LYS A 78 12.222 -14.634 6.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 10.698 -15.756 7.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 10.350 -14.095 7.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 9.360 -15.191 6.988 1.00 0.00 H new ATOM 1031 N GLU A 79 6.581 -11.557 2.129 1.00 0.00 N ATOM 1032 CA GLU A 79 6.041 -10.596 1.179 1.00 0.00 C ATOM 1033 C GLU A 79 5.187 -9.586 1.927 1.00 0.00 C ATOM 1034 O GLU A 79 5.155 -8.404 1.587 1.00 0.00 O ATOM 1035 CB GLU A 79 5.216 -11.298 0.099 1.00 0.00 C ATOM 1036 CG GLU A 79 6.050 -12.134 -0.858 1.00 0.00 C ATOM 1037 CD GLU A 79 5.205 -13.075 -1.696 1.00 0.00 C ATOM 1038 OE1 GLU A 79 4.549 -13.964 -1.112 1.00 0.00 O ATOM 1039 OE2 GLU A 79 5.199 -12.924 -2.935 1.00 0.00 O ATOM 0 H GLU A 79 6.358 -12.531 1.926 1.00 0.00 H new ATOM 0 HA GLU A 79 6.865 -10.083 0.683 1.00 0.00 H new ATOM 0 HB2 GLU A 79 4.476 -11.939 0.578 1.00 0.00 H new ATOM 0 HB3 GLU A 79 4.667 -10.549 -0.471 1.00 0.00 H new ATOM 0 HG2 GLU A 79 6.613 -11.473 -1.517 1.00 0.00 H new ATOM 0 HG3 GLU A 79 6.778 -12.713 -0.290 1.00 0.00 H new ATOM 1046 N TYR A 80 4.532 -10.058 2.983 1.00 0.00 N ATOM 1047 CA TYR A 80 3.721 -9.193 3.814 1.00 0.00 C ATOM 1048 C TYR A 80 4.628 -8.164 4.468 1.00 0.00 C ATOM 1049 O TYR A 80 4.273 -6.994 4.597 1.00 0.00 O ATOM 1050 CB TYR A 80 2.982 -10.004 4.881 1.00 0.00 C ATOM 1051 CG TYR A 80 1.832 -9.259 5.525 1.00 0.00 C ATOM 1052 CD1 TYR A 80 2.050 -8.089 6.241 1.00 0.00 C ATOM 1053 CD2 TYR A 80 0.529 -9.729 5.416 1.00 0.00 C ATOM 1054 CE1 TYR A 80 1.002 -7.409 6.831 1.00 0.00 C ATOM 1055 CE2 TYR A 80 -0.523 -9.053 6.003 1.00 0.00 C ATOM 1056 CZ TYR A 80 -0.283 -7.895 6.708 1.00 0.00 C ATOM 1057 OH TYR A 80 -1.329 -7.219 7.294 1.00 0.00 O ATOM 0 H TYR A 80 4.551 -11.034 3.278 1.00 0.00 H new ATOM 0 HA TYR A 80 2.972 -8.693 3.199 1.00 0.00 H new ATOM 0 HB2 TYR A 80 2.602 -10.920 4.429 1.00 0.00 H new ATOM 0 HB3 TYR A 80 3.690 -10.300 5.655 1.00 0.00 H new ATOM 0 HD1 TYR A 80 3.055 -7.705 6.338 1.00 0.00 H new ATOM 0 HD2 TYR A 80 0.336 -10.637 4.864 1.00 0.00 H new ATOM 0 HE1 TYR A 80 1.188 -6.501 7.386 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -1.530 -9.432 5.909 1.00 0.00 H new ATOM 0 HH TYR A 80 -2.167 -7.693 7.112 1.00 0.00 H new ATOM 1067 N ASP A 81 5.824 -8.614 4.855 1.00 0.00 N ATOM 1068 CA ASP A 81 6.804 -7.733 5.467 1.00 0.00 C ATOM 1069 C ASP A 81 7.339 -6.748 4.437 1.00 0.00 C ATOM 1070 O ASP A 81 7.592 -5.586 4.751 1.00 0.00 O ATOM 1071 CB ASP A 81 7.952 -8.543 6.072 1.00 0.00 C ATOM 1072 CG ASP A 81 8.431 -7.970 7.392 1.00 0.00 C ATOM 1073 OD1 ASP A 81 8.982 -6.849 7.389 1.00 0.00 O ATOM 1074 OD2 ASP A 81 8.258 -8.644 8.430 1.00 0.00 O ATOM 0 H ASP A 81 6.130 -9.582 4.753 1.00 0.00 H new ATOM 0 HA ASP A 81 6.317 -7.176 6.267 1.00 0.00 H new ATOM 0 HB2 ASP A 81 7.627 -9.572 6.223 1.00 0.00 H new ATOM 0 HB3 ASP A 81 8.784 -8.571 5.368 1.00 0.00 H new ATOM 1079 N ALA A 82 7.496 -7.212 3.196 1.00 0.00 N ATOM 1080 CA ALA A 82 7.981 -6.351 2.129 1.00 0.00 C ATOM 1081 C ALA A 82 7.048 -5.162 1.958 1.00 0.00 C ATOM 1082 O ALA A 82 7.485 -4.037 1.711 1.00 0.00 O ATOM 1083 CB ALA A 82 8.103 -7.128 0.826 1.00 0.00 C ATOM 0 H ALA A 82 7.295 -8.171 2.912 1.00 0.00 H new ATOM 0 HA ALA A 82 8.972 -5.984 2.397 1.00 0.00 H new ATOM 0 HB1 ALA A 82 8.467 -6.466 0.040 1.00 0.00 H new ATOM 0 HB2 ALA A 82 8.803 -7.953 0.959 1.00 0.00 H new ATOM 0 HB3 ALA A 82 7.126 -7.522 0.545 1.00 0.00 H new ATOM 1089 N LEU A 83 5.755 -5.423 2.116 1.00 0.00 N ATOM 1090 CA LEU A 83 4.746 -4.381 2.006 1.00 0.00 C ATOM 1091 C LEU A 83 4.737 -3.525 3.267 1.00 0.00 C ATOM 1092 O LEU A 83 4.427 -2.334 3.218 1.00 0.00 O ATOM 1093 CB LEU A 83 3.365 -4.997 1.776 1.00 0.00 C ATOM 1094 CG LEU A 83 3.147 -5.593 0.384 1.00 0.00 C ATOM 1095 CD1 LEU A 83 2.029 -6.623 0.414 1.00 0.00 C ATOM 1096 CD2 LEU A 83 2.839 -4.497 -0.624 1.00 0.00 C ATOM 0 H LEU A 83 5.382 -6.350 2.321 1.00 0.00 H new ATOM 0 HA LEU A 83 4.990 -3.749 1.152 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.204 -5.778 2.519 1.00 0.00 H new ATOM 0 HB3 LEU A 83 2.609 -4.231 1.950 1.00 0.00 H new ATOM 0 HG LEU A 83 4.065 -6.093 0.076 1.00 0.00 H new ATOM 0 HD11 LEU A 83 1.888 -7.036 -0.585 1.00 0.00 H new ATOM 0 HD12 LEU A 83 2.291 -7.424 1.105 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.105 -6.148 0.744 1.00 0.00 H new ATOM 0 HD21 LEU A 83 2.687 -4.940 -1.608 1.00 0.00 H new ATOM 0 HD22 LEU A 83 1.936 -3.967 -0.321 1.00 0.00 H new ATOM 0 HD23 LEU A 83 3.673 -3.797 -0.666 1.00 0.00 H new ATOM 1108 N VAL A 84 5.090 -4.136 4.397 1.00 0.00 N ATOM 1109 CA VAL A 84 5.132 -3.421 5.664 1.00 0.00 C ATOM 1110 C VAL A 84 6.302 -2.446 5.689 1.00 0.00 C ATOM 1111 O VAL A 84 6.210 -1.362 6.264 1.00 0.00 O ATOM 1112 CB VAL A 84 5.253 -4.389 6.859 1.00 0.00 C ATOM 1113 CG1 VAL A 84 5.232 -3.626 8.175 1.00 0.00 C ATOM 1114 CG2 VAL A 84 4.140 -5.428 6.821 1.00 0.00 C ATOM 0 H VAL A 84 5.349 -5.121 4.457 1.00 0.00 H new ATOM 0 HA VAL A 84 4.195 -2.872 5.755 1.00 0.00 H new ATOM 0 HB VAL A 84 6.209 -4.908 6.783 1.00 0.00 H new ATOM 0 HG11 VAL A 84 5.319 -4.328 9.004 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.067 -2.926 8.203 1.00 0.00 H new ATOM 0 HG13 VAL A 84 4.295 -3.076 8.262 1.00 0.00 H new ATOM 0 HG21 VAL A 84 4.242 -6.102 7.672 1.00 0.00 H new ATOM 0 HG22 VAL A 84 3.173 -4.927 6.869 1.00 0.00 H new ATOM 0 HG23 VAL A 84 4.207 -6.000 5.895 1.00 0.00 H new ATOM 1124 N LYS A 85 7.404 -2.836 5.051 1.00 0.00 N ATOM 1125 CA LYS A 85 8.590 -1.991 4.993 1.00 0.00 C ATOM 1126 C LYS A 85 8.354 -0.806 4.065 1.00 0.00 C ATOM 1127 O LYS A 85 8.610 0.344 4.428 1.00 0.00 O ATOM 1128 CB LYS A 85 9.799 -2.801 4.518 1.00 0.00 C ATOM 1129 CG LYS A 85 10.730 -3.221 5.645 1.00 0.00 C ATOM 1130 CD LYS A 85 11.556 -2.049 6.149 1.00 0.00 C ATOM 1131 CE LYS A 85 11.952 -2.233 7.604 1.00 0.00 C ATOM 1132 NZ LYS A 85 12.296 -0.938 8.255 1.00 0.00 N ATOM 0 H LYS A 85 7.498 -3.730 4.569 1.00 0.00 H new ATOM 0 HA LYS A 85 8.794 -1.614 5.995 1.00 0.00 H new ATOM 0 HB2 LYS A 85 9.447 -3.692 3.997 1.00 0.00 H new ATOM 0 HB3 LYS A 85 10.361 -2.210 3.795 1.00 0.00 H new ATOM 0 HG2 LYS A 85 10.145 -3.636 6.466 1.00 0.00 H new ATOM 0 HG3 LYS A 85 11.394 -4.012 5.295 1.00 0.00 H new ATOM 0 HD2 LYS A 85 12.452 -1.944 5.537 1.00 0.00 H new ATOM 0 HD3 LYS A 85 10.986 -1.127 6.040 1.00 0.00 H new ATOM 0 HE2 LYS A 85 11.133 -2.705 8.146 1.00 0.00 H new ATOM 0 HE3 LYS A 85 12.806 -2.908 7.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 12.561 -1.107 9.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 13.094 -0.499 7.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 11.473 -0.303 8.220 1.00 0.00 H new ATOM 1146 N SER A 86 7.854 -1.094 2.870 1.00 0.00 N ATOM 1147 CA SER A 86 7.572 -0.054 1.890 1.00 0.00 C ATOM 1148 C SER A 86 6.500 0.893 2.418 1.00 0.00 C ATOM 1149 O SER A 86 6.589 2.109 2.249 1.00 0.00 O ATOM 1150 CB SER A 86 7.119 -0.674 0.568 1.00 0.00 C ATOM 1151 OG SER A 86 7.980 -1.730 0.178 1.00 0.00 O ATOM 0 H SER A 86 7.635 -2.040 2.556 1.00 0.00 H new ATOM 0 HA SER A 86 8.487 0.512 1.715 1.00 0.00 H new ATOM 0 HB2 SER A 86 6.101 -1.049 0.669 1.00 0.00 H new ATOM 0 HB3 SER A 86 7.101 0.091 -0.209 1.00 0.00 H new ATOM 0 HG SER A 86 7.741 -2.545 0.667 1.00 0.00 H new ATOM 1157 N SER A 87 5.491 0.322 3.065 1.00 0.00 N ATOM 1158 CA SER A 87 4.402 1.109 3.629 1.00 0.00 C ATOM 1159 C SER A 87 4.925 2.046 4.711 1.00 0.00 C ATOM 1160 O SER A 87 4.645 3.243 4.696 1.00 0.00 O ATOM 1161 CB SER A 87 3.325 0.190 4.209 1.00 0.00 C ATOM 1162 OG SER A 87 2.392 -0.192 3.213 1.00 0.00 O ATOM 0 H SER A 87 5.405 -0.684 3.212 1.00 0.00 H new ATOM 0 HA SER A 87 3.962 1.707 2.831 1.00 0.00 H new ATOM 0 HB2 SER A 87 3.791 -0.698 4.635 1.00 0.00 H new ATOM 0 HB3 SER A 87 2.807 0.699 5.022 1.00 0.00 H new ATOM 0 HG SER A 87 2.629 -1.077 2.865 1.00 0.00 H new ATOM 1168 N GLU A 88 5.695 1.495 5.647 1.00 0.00 N ATOM 1169 CA GLU A 88 6.262 2.284 6.734 1.00 0.00 C ATOM 1170 C GLU A 88 7.004 3.500 6.189 1.00 0.00 C ATOM 1171 O GLU A 88 6.900 4.601 6.729 1.00 0.00 O ATOM 1172 CB GLU A 88 7.209 1.428 7.580 1.00 0.00 C ATOM 1173 CG GLU A 88 7.019 1.608 9.077 1.00 0.00 C ATOM 1174 CD GLU A 88 7.509 2.956 9.568 1.00 0.00 C ATOM 1175 OE1 GLU A 88 8.573 3.409 9.096 1.00 0.00 O ATOM 1176 OE2 GLU A 88 6.829 3.558 10.425 1.00 0.00 O ATOM 0 H GLU A 88 5.940 0.505 5.673 1.00 0.00 H new ATOM 0 HA GLU A 88 5.443 2.631 7.364 1.00 0.00 H new ATOM 0 HB2 GLU A 88 7.060 0.378 7.327 1.00 0.00 H new ATOM 0 HB3 GLU A 88 8.238 1.675 7.321 1.00 0.00 H new ATOM 0 HG2 GLU A 88 5.962 1.498 9.321 1.00 0.00 H new ATOM 0 HG3 GLU A 88 7.552 0.817 9.605 1.00 0.00 H new ATOM 1183 N ASP A 89 7.750 3.290 5.111 1.00 0.00 N ATOM 1184 CA ASP A 89 8.506 4.367 4.484 1.00 0.00 C ATOM 1185 C ASP A 89 7.566 5.392 3.859 1.00 0.00 C ATOM 1186 O ASP A 89 7.868 6.586 3.822 1.00 0.00 O ATOM 1187 CB ASP A 89 9.449 3.805 3.418 1.00 0.00 C ATOM 1188 CG ASP A 89 10.684 3.164 4.020 1.00 0.00 C ATOM 1189 OD1 ASP A 89 11.656 3.894 4.301 1.00 0.00 O ATOM 1190 OD2 ASP A 89 10.679 1.930 4.209 1.00 0.00 O ATOM 0 H ASP A 89 7.848 2.384 4.653 1.00 0.00 H new ATOM 0 HA ASP A 89 9.097 4.861 5.255 1.00 0.00 H new ATOM 0 HB2 ASP A 89 8.916 3.068 2.817 1.00 0.00 H new ATOM 0 HB3 ASP A 89 9.751 4.607 2.744 1.00 0.00 H new ATOM 1195 N LEU A 90 6.424 4.919 3.370 1.00 0.00 N ATOM 1196 CA LEU A 90 5.437 5.795 2.746 1.00 0.00 C ATOM 1197 C LEU A 90 4.860 6.776 3.760 1.00 0.00 C ATOM 1198 O LEU A 90 4.769 7.973 3.495 1.00 0.00 O ATOM 1199 CB LEU A 90 4.316 4.965 2.115 1.00 0.00 C ATOM 1200 CG LEU A 90 3.110 5.765 1.619 1.00 0.00 C ATOM 1201 CD1 LEU A 90 2.533 5.138 0.359 1.00 0.00 C ATOM 1202 CD2 LEU A 90 2.050 5.855 2.705 1.00 0.00 C ATOM 0 H LEU A 90 6.159 3.934 3.394 1.00 0.00 H new ATOM 0 HA LEU A 90 5.936 6.368 1.964 1.00 0.00 H new ATOM 0 HB2 LEU A 90 4.729 4.405 1.276 1.00 0.00 H new ATOM 0 HB3 LEU A 90 3.971 4.235 2.847 1.00 0.00 H new ATOM 0 HG LEU A 90 3.442 6.774 1.377 1.00 0.00 H new ATOM 0 HD11 LEU A 90 1.676 5.721 0.022 1.00 0.00 H new ATOM 0 HD12 LEU A 90 3.293 5.125 -0.422 1.00 0.00 H new ATOM 0 HD13 LEU A 90 2.215 4.117 0.573 1.00 0.00 H new ATOM 0 HD21 LEU A 90 1.199 6.427 2.336 1.00 0.00 H new ATOM 0 HD22 LEU A 90 1.722 4.852 2.977 1.00 0.00 H new ATOM 0 HD23 LEU A 90 2.468 6.351 3.581 1.00 0.00 H new ATOM 1214 N LEU A 91 4.478 6.261 4.922 1.00 0.00 N ATOM 1215 CA LEU A 91 3.917 7.100 5.978 1.00 0.00 C ATOM 1216 C LEU A 91 4.933 8.144 6.406 1.00 0.00 C ATOM 1217 O LEU A 91 4.628 9.334 6.493 1.00 0.00 O ATOM 1218 CB LEU A 91 3.499 6.264 7.188 1.00 0.00 C ATOM 1219 CG LEU A 91 2.922 4.892 6.855 1.00 0.00 C ATOM 1220 CD1 LEU A 91 2.660 4.099 8.126 1.00 0.00 C ATOM 1221 CD2 LEU A 91 1.649 5.034 6.036 1.00 0.00 C ATOM 0 H LEU A 91 4.545 5.271 5.158 1.00 0.00 H new ATOM 0 HA LEU A 91 3.030 7.593 5.580 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.366 6.130 7.835 1.00 0.00 H new ATOM 0 HB3 LEU A 91 2.759 6.824 7.759 1.00 0.00 H new ATOM 0 HG LEU A 91 3.653 4.346 6.258 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.249 3.123 7.868 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.595 3.966 8.671 1.00 0.00 H new ATOM 0 HD13 LEU A 91 1.949 4.639 8.751 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.251 4.045 5.808 1.00 0.00 H new ATOM 0 HD22 LEU A 91 0.911 5.599 6.605 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.871 5.559 5.107 1.00 0.00 H new ATOM 1233 N SER A 92 6.153 7.684 6.663 1.00 0.00 N ATOM 1234 CA SER A 92 7.233 8.572 7.077 1.00 0.00 C ATOM 1235 C SER A 92 7.413 9.697 6.062 1.00 0.00 C ATOM 1236 O SER A 92 7.586 10.860 6.429 1.00 0.00 O ATOM 1237 CB SER A 92 8.539 7.788 7.232 1.00 0.00 C ATOM 1238 OG SER A 92 9.027 7.867 8.559 1.00 0.00 O ATOM 0 H SER A 92 6.418 6.702 6.592 1.00 0.00 H new ATOM 0 HA SER A 92 6.971 9.008 8.041 1.00 0.00 H new ATOM 0 HB2 SER A 92 8.374 6.745 6.963 1.00 0.00 H new ATOM 0 HB3 SER A 92 9.286 8.181 6.542 1.00 0.00 H new ATOM 0 HG SER A 92 9.861 7.357 8.632 1.00 0.00 H new ATOM 1244 N ALA A 93 7.357 9.340 4.783 1.00 0.00 N ATOM 1245 CA ALA A 93 7.501 10.317 3.712 1.00 0.00 C ATOM 1246 C ALA A 93 6.327 11.289 3.721 1.00 0.00 C ATOM 1247 O ALA A 93 6.489 12.482 3.461 1.00 0.00 O ATOM 1248 CB ALA A 93 7.602 9.618 2.365 1.00 0.00 C ATOM 0 H ALA A 93 7.213 8.382 4.464 1.00 0.00 H new ATOM 0 HA ALA A 93 8.419 10.880 3.877 1.00 0.00 H new ATOM 0 HB1 ALA A 93 7.709 10.362 1.576 1.00 0.00 H new ATOM 0 HB2 ALA A 93 8.470 8.958 2.362 1.00 0.00 H new ATOM 0 HB3 ALA A 93 6.700 9.032 2.191 1.00 0.00 H new ATOM 1254 N LEU A 94 5.144 10.768 4.034 1.00 0.00 N ATOM 1255 CA LEU A 94 3.940 11.584 4.089 1.00 0.00 C ATOM 1256 C LEU A 94 4.026 12.582 5.237 1.00 0.00 C ATOM 1257 O LEU A 94 3.672 13.751 5.086 1.00 0.00 O ATOM 1258 CB LEU A 94 2.702 10.701 4.252 1.00 0.00 C ATOM 1259 CG LEU A 94 2.103 10.180 2.944 1.00 0.00 C ATOM 1260 CD1 LEU A 94 1.378 8.864 3.177 1.00 0.00 C ATOM 1261 CD2 LEU A 94 1.160 11.211 2.345 1.00 0.00 C ATOM 0 H LEU A 94 4.996 9.783 4.253 1.00 0.00 H new ATOM 0 HA LEU A 94 3.855 12.134 3.152 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.962 9.849 4.880 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.938 11.267 4.784 1.00 0.00 H new ATOM 0 HG LEU A 94 2.914 10.004 2.238 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.958 8.508 2.236 1.00 0.00 H new ATOM 0 HD12 LEU A 94 2.080 8.125 3.563 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.575 9.014 3.899 1.00 0.00 H new ATOM 0 HD21 LEU A 94 0.742 10.825 1.415 1.00 0.00 H new ATOM 0 HD22 LEU A 94 0.353 11.417 3.048 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.708 12.131 2.142 1.00 0.00 H new ATOM 1273 N GLN A 95 4.509 12.113 6.384 1.00 0.00 N ATOM 1274 CA GLN A 95 4.652 12.963 7.559 1.00 0.00 C ATOM 1275 C GLN A 95 5.507 14.182 7.230 1.00 0.00 C ATOM 1276 O GLN A 95 5.088 15.323 7.432 1.00 0.00 O ATOM 1277 CB GLN A 95 5.277 12.177 8.714 1.00 0.00 C ATOM 1278 CG GLN A 95 4.262 11.678 9.729 1.00 0.00 C ATOM 1279 CD GLN A 95 4.048 10.179 9.656 1.00 0.00 C ATOM 1280 OE1 GLN A 95 4.978 9.397 9.854 1.00 0.00 O ATOM 1281 NE2 GLN A 95 2.818 9.769 9.365 1.00 0.00 N ATOM 0 H GLN A 95 4.808 11.148 6.524 1.00 0.00 H new ATOM 0 HA GLN A 95 3.661 13.301 7.863 1.00 0.00 H new ATOM 0 HB2 GLN A 95 5.823 11.325 8.309 1.00 0.00 H new ATOM 0 HB3 GLN A 95 6.005 12.810 9.221 1.00 0.00 H new ATOM 0 HG2 GLN A 95 4.596 11.944 10.732 1.00 0.00 H new ATOM 0 HG3 GLN A 95 3.311 12.185 9.565 1.00 0.00 H new ATOM 0 HE21 GLN A 95 2.077 10.452 9.208 1.00 0.00 H new ATOM 0 HE22 GLN A 95 2.615 8.772 9.298 1.00 0.00 H new ATOM 1290 N LYS A 96 6.700 13.930 6.705 1.00 0.00 N ATOM 1291 CA LYS A 96 7.608 15.006 6.329 1.00 0.00 C ATOM 1292 C LYS A 96 6.978 15.874 5.244 1.00 0.00 C ATOM 1293 O LYS A 96 7.266 17.065 5.137 1.00 0.00 O ATOM 1294 CB LYS A 96 8.938 14.433 5.837 1.00 0.00 C ATOM 1295 CG LYS A 96 8.805 13.573 4.590 1.00 0.00 C ATOM 1296 CD LYS A 96 10.165 13.164 4.046 1.00 0.00 C ATOM 1297 CE LYS A 96 10.609 11.824 4.610 1.00 0.00 C ATOM 1298 NZ LYS A 96 12.059 11.818 4.954 1.00 0.00 N ATOM 0 H LYS A 96 7.060 12.992 6.530 1.00 0.00 H new ATOM 0 HA LYS A 96 7.797 15.623 7.208 1.00 0.00 H new ATOM 0 HB2 LYS A 96 9.624 15.254 5.630 1.00 0.00 H new ATOM 0 HB3 LYS A 96 9.384 13.837 6.633 1.00 0.00 H new ATOM 0 HG2 LYS A 96 8.222 12.682 4.822 1.00 0.00 H new ATOM 0 HG3 LYS A 96 8.256 14.122 3.825 1.00 0.00 H new ATOM 0 HD2 LYS A 96 10.121 13.106 2.958 1.00 0.00 H new ATOM 0 HD3 LYS A 96 10.902 13.927 4.295 1.00 0.00 H new ATOM 0 HE2 LYS A 96 10.024 11.593 5.500 1.00 0.00 H new ATOM 0 HE3 LYS A 96 10.405 11.039 3.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 12.322 10.887 5.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.619 12.013 4.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 12.250 12.550 5.668 1.00 0.00 H new ATOM 1312 N LYS A 97 6.113 15.260 4.440 1.00 0.00 N ATOM 1313 CA LYS A 97 5.435 15.964 3.360 1.00 0.00 C ATOM 1314 C LYS A 97 4.473 17.014 3.906 1.00 0.00 C ATOM 1315 O LYS A 97 4.408 18.134 3.399 1.00 0.00 O ATOM 1316 CB LYS A 97 4.672 14.974 2.481 1.00 0.00 C ATOM 1317 CG LYS A 97 4.527 15.428 1.039 1.00 0.00 C ATOM 1318 CD LYS A 97 4.241 14.256 0.114 1.00 0.00 C ATOM 1319 CE LYS A 97 4.918 14.432 -1.235 1.00 0.00 C ATOM 1320 NZ LYS A 97 4.445 15.656 -1.940 1.00 0.00 N ATOM 0 H LYS A 97 5.866 14.273 4.518 1.00 0.00 H new ATOM 0 HA LYS A 97 6.193 16.469 2.762 1.00 0.00 H new ATOM 0 HB2 LYS A 97 5.186 14.013 2.501 1.00 0.00 H new ATOM 0 HB3 LYS A 97 3.680 14.814 2.904 1.00 0.00 H new ATOM 0 HG2 LYS A 97 3.720 16.157 0.965 1.00 0.00 H new ATOM 0 HG3 LYS A 97 5.441 15.930 0.721 1.00 0.00 H new ATOM 0 HD2 LYS A 97 4.587 13.332 0.578 1.00 0.00 H new ATOM 0 HD3 LYS A 97 3.165 14.158 -0.028 1.00 0.00 H new ATOM 0 HE2 LYS A 97 5.997 14.489 -1.095 1.00 0.00 H new ATOM 0 HE3 LYS A 97 4.723 13.558 -1.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 4.430 15.482 -2.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 3.486 15.895 -1.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 5.088 16.447 -1.732 1.00 0.00 H new