USER MOD reduce.3.24.130724 H: found=0, std=0, add=1151, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1144 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 114 HIS : no HD1:sc= -7.54! C(o=-17!,f=-19!) USER MOD Set 1.2: A 136 HIS : no HE2:sc= -9.61! C(o=-17!,f=-18!) USER MOD Single : A 15 SER OG : rot -148:sc= 0.862 USER MOD Single : A 24 GLN : amide:sc= -0.021 K(o=-0.021,f=-1.6!) USER MOD Single : A 31 HIS : no HD1:sc= -0.0879 X(o=-0.088,f=0) USER MOD Single : A 36 HIS : no HD1:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 41 ASN : amide:sc= -0.64 K(o=-0.64,f=-6.7!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot -160:sc= -0.0205 USER MOD Single : A 49 GLN : amide:sc= -0.0228 X(o=-0.023,f=-0.46) USER MOD Single : A 51 MET CE :methyl 170:sc= -1.55 (180deg=-1.93!) USER MOD Single : A 52 MET CE :methyl -162:sc= -1.67 (180deg=-1.85!) USER MOD Single : A 55 SER OG : rot 180:sc= -2.31! USER MOD Single : A 64 LYS NZ :NH3+ 165:sc= -0.56 (180deg=-1.3!) USER MOD Single : A 65 GLN : amide:sc= -1.13 K(o=-1.1,f=-3) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= -0.314 X(o=-0.31,f=-0.15) USER MOD Single : A 72 GLN : amide:sc= -0.0431 X(o=-0.043,f=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -98:sc= 1.04 USER MOD Single : A 81 HIS : no HD1:sc= -7.4! C(o=-7.4!,f=-8.3!) USER MOD Single : A 86 THR OG1 : rot 3:sc= -0.713 USER MOD Single : A 91 THR OG1 : rot 165:sc= -2.21! USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 HIS : no HD1:sc= -0.594 K(o=-0.59,f=-1.3!) USER MOD Single : A 103 ASN : amide:sc= -0.222 X(o=-0.22,f=-0.0004) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0.0215 USER MOD Single : A 110 SER OG : rot 21:sc= -0.525 USER MOD Single : A 121 HIS :FLIP no HD1:sc= -1.2 F(o=-3.7,f=-1.2) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot -92:sc= -0.838! USER MOD Single : A 126 SER OG : rot 179:sc= -1.51! USER MOD Single : A 132 SER OG : rot -69:sc= 1.13 USER MOD Single : A 135 HIS : no HD1:sc= -0.0564 X(o=-0.056,f=0) USER MOD Single : A 140 SER OG : rot 129:sc= -0.748 USER MOD Single : A 143 THR OG1 : rot 180:sc= -0.597 USER MOD Single : A 150 GLN : amide:sc= -0.394 K(o=-0.39,f=-1.7) USER MOD Single : A 154 GLN :FLIP amide:sc= -0.547 F(o=-2!,f=-0.55) USER MOD Single : A 155 ASN :FLIP amide:sc= 0 F(o=-1.5,f=0) USER MOD Single : A 157 MET CE :methyl -155:sc= -0.26 (180deg=-1.05) USER MOD Single : A 161 GLN : amide:sc= -0.174 K(o=-0.17,f=-1.2!) USER MOD Single : A 163 HIS : no HD1:sc= -0.354 K(o=-0.35,f=-1) USER MOD Single : A 164 MET CE :methyl -157:sc= -2.37! (180deg=-3.22!) USER MOD ----------------------------------------------------------------- ATOM 133 N VAL A 10 -23.216 -2.857 -0.969 1.00 0.00 N ATOM 134 CA VAL A 10 -22.219 -1.899 -0.484 1.00 0.00 C ATOM 135 C VAL A 10 -20.812 -2.340 -0.867 1.00 0.00 C ATOM 136 O VAL A 10 -19.971 -1.519 -1.235 1.00 0.00 O ATOM 137 CB VAL A 10 -22.269 -1.700 1.045 1.00 0.00 C ATOM 138 CG1 VAL A 10 -21.208 -0.705 1.485 1.00 0.00 C ATOM 139 CG2 VAL A 10 -23.653 -1.249 1.485 1.00 0.00 C ATOM 0 HA VAL A 10 -22.465 -0.950 -0.960 1.00 0.00 H new ATOM 0 HB VAL A 10 -22.060 -2.656 1.524 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -21.257 -0.576 2.566 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -20.222 -1.078 1.208 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -21.383 0.254 0.997 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -23.665 -1.115 2.567 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -23.899 -0.305 0.999 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -24.388 -2.004 1.205 1.00 0.00 H new ATOM 149 N GLY A 11 -20.564 -3.642 -0.777 1.00 0.00 N ATOM 150 CA GLY A 11 -19.257 -4.174 -1.116 1.00 0.00 C ATOM 151 C GLY A 11 -18.926 -4.018 -2.586 1.00 0.00 C ATOM 152 O GLY A 11 -17.793 -4.259 -3.002 1.00 0.00 O ATOM 0 H GLY A 11 -21.245 -4.339 -0.475 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -18.497 -3.667 -0.521 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -19.219 -5.230 -0.849 1.00 0.00 H new ATOM 156 N ASP A 12 -19.916 -3.616 -3.375 1.00 0.00 N ATOM 157 CA ASP A 12 -19.723 -3.430 -4.807 1.00 0.00 C ATOM 158 C ASP A 12 -19.960 -1.976 -5.203 1.00 0.00 C ATOM 159 O ASP A 12 -20.178 -1.669 -6.375 1.00 0.00 O ATOM 160 CB ASP A 12 -20.665 -4.346 -5.590 1.00 0.00 C ATOM 161 CG ASP A 12 -19.922 -5.427 -6.349 1.00 0.00 C ATOM 162 OD1 ASP A 12 -18.701 -5.269 -6.565 1.00 0.00 O ATOM 163 OD2 ASP A 12 -20.559 -6.432 -6.728 1.00 0.00 O ATOM 0 H ASP A 12 -20.860 -3.413 -3.047 1.00 0.00 H new ATOM 0 HA ASP A 12 -18.692 -3.689 -5.048 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -21.372 -4.810 -4.902 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -21.248 -3.749 -6.291 1.00 0.00 H new ATOM 168 N ARG A 13 -19.913 -1.086 -4.217 1.00 0.00 N ATOM 169 CA ARG A 13 -20.122 0.337 -4.459 1.00 0.00 C ATOM 170 C ARG A 13 -18.921 1.150 -3.984 1.00 0.00 C ATOM 171 O ARG A 13 -18.355 1.938 -4.740 1.00 0.00 O ATOM 172 CB ARG A 13 -21.389 0.815 -3.751 1.00 0.00 C ATOM 173 CG ARG A 13 -22.117 1.926 -4.489 1.00 0.00 C ATOM 174 CD ARG A 13 -23.114 1.369 -5.492 1.00 0.00 C ATOM 175 NE ARG A 13 -23.678 2.415 -6.341 1.00 0.00 N ATOM 176 CZ ARG A 13 -23.002 3.020 -7.312 1.00 0.00 C ATOM 177 NH1 ARG A 13 -21.743 2.681 -7.554 1.00 0.00 N ATOM 178 NH2 ARG A 13 -23.584 3.963 -8.040 1.00 0.00 N ATOM 0 H ARG A 13 -19.732 -1.325 -3.242 1.00 0.00 H new ATOM 0 HA ARG A 13 -20.237 0.486 -5.533 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -22.066 -0.030 -3.625 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -21.127 1.165 -2.752 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -22.637 2.561 -3.772 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -21.393 2.556 -5.006 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -22.622 0.622 -6.115 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -23.918 0.861 -4.960 1.00 0.00 H new ATOM 0 HE ARG A 13 -24.645 2.697 -6.180 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -21.294 1.956 -6.995 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -21.224 3.145 -8.299 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -24.552 4.225 -7.855 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -23.063 4.426 -8.785 1.00 0.00 H new ATOM 192 N LEU A 14 -18.540 0.952 -2.726 1.00 0.00 N ATOM 193 CA LEU A 14 -17.406 1.666 -2.149 1.00 0.00 C ATOM 194 C LEU A 14 -16.094 1.183 -2.762 1.00 0.00 C ATOM 195 O LEU A 14 -15.223 1.985 -3.099 1.00 0.00 O ATOM 196 CB LEU A 14 -17.386 1.486 -0.626 1.00 0.00 C ATOM 197 CG LEU A 14 -15.994 1.437 0.011 1.00 0.00 C ATOM 198 CD1 LEU A 14 -15.353 2.815 -0.001 1.00 0.00 C ATOM 199 CD2 LEU A 14 -16.078 0.897 1.430 1.00 0.00 C ATOM 0 H LEU A 14 -19.000 0.303 -2.087 1.00 0.00 H new ATOM 0 HA LEU A 14 -17.515 2.727 -2.374 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -17.946 2.304 -0.173 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -17.913 0.564 -0.379 1.00 0.00 H new ATOM 0 HG LEU A 14 -15.369 0.764 -0.576 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -14.365 2.761 0.456 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -15.259 3.164 -1.029 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -15.975 3.511 0.562 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -15.080 0.869 1.868 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -16.719 1.545 2.028 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -16.495 -0.110 1.412 1.00 0.00 H new ATOM 211 N SER A 15 -15.962 -0.132 -2.906 1.00 0.00 N ATOM 212 CA SER A 15 -14.758 -0.720 -3.481 1.00 0.00 C ATOM 213 C SER A 15 -14.480 -0.140 -4.864 1.00 0.00 C ATOM 214 O SER A 15 -13.328 -0.018 -5.279 1.00 0.00 O ATOM 215 CB SER A 15 -14.901 -2.240 -3.572 1.00 0.00 C ATOM 216 OG SER A 15 -16.261 -2.617 -3.693 1.00 0.00 O ATOM 0 H SER A 15 -16.674 -0.810 -2.633 1.00 0.00 H new ATOM 0 HA SER A 15 -13.918 -0.480 -2.829 1.00 0.00 H new ATOM 0 HB2 SER A 15 -14.340 -2.611 -4.430 1.00 0.00 H new ATOM 0 HB3 SER A 15 -14.469 -2.703 -2.685 1.00 0.00 H new ATOM 0 HG SER A 15 -16.399 -3.486 -3.262 1.00 0.00 H new ATOM 222 N GLY A 16 -15.547 0.218 -5.572 1.00 0.00 N ATOM 223 CA GLY A 16 -15.398 0.782 -6.899 1.00 0.00 C ATOM 224 C GLY A 16 -14.867 2.202 -6.867 1.00 0.00 C ATOM 225 O GLY A 16 -13.873 2.514 -7.521 1.00 0.00 O ATOM 0 H GLY A 16 -16.511 0.127 -5.250 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -14.722 0.157 -7.483 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -16.362 0.769 -7.407 1.00 0.00 H new ATOM 229 N ALA A 17 -15.531 3.063 -6.103 1.00 0.00 N ATOM 230 CA ALA A 17 -15.117 4.457 -5.988 1.00 0.00 C ATOM 231 C ALA A 17 -13.680 4.563 -5.491 1.00 0.00 C ATOM 232 O ALA A 17 -12.821 5.135 -6.161 1.00 0.00 O ATOM 233 CB ALA A 17 -16.056 5.214 -5.061 1.00 0.00 C ATOM 0 H ALA A 17 -16.357 2.821 -5.555 1.00 0.00 H new ATOM 0 HA ALA A 17 -15.165 4.907 -6.980 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -15.734 6.253 -4.986 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -17.070 5.177 -5.460 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -16.038 4.756 -4.072 1.00 0.00 H new ATOM 239 N ALA A 18 -13.424 4.007 -4.311 1.00 0.00 N ATOM 240 CA ALA A 18 -12.089 4.040 -3.729 1.00 0.00 C ATOM 241 C ALA A 18 -11.056 3.479 -4.701 1.00 0.00 C ATOM 242 O ALA A 18 -9.955 4.012 -4.829 1.00 0.00 O ATOM 243 CB ALA A 18 -12.063 3.261 -2.423 1.00 0.00 C ATOM 0 H ALA A 18 -14.122 3.530 -3.741 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.833 5.080 -3.524 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -11.059 3.294 -1.999 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -12.768 3.705 -1.720 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -12.343 2.225 -2.612 1.00 0.00 H new ATOM 249 N ALA A 19 -11.424 2.399 -5.383 1.00 0.00 N ATOM 250 CA ALA A 19 -10.533 1.759 -6.343 1.00 0.00 C ATOM 251 C ALA A 19 -10.404 2.585 -7.622 1.00 0.00 C ATOM 252 O ALA A 19 -9.380 2.532 -8.303 1.00 0.00 O ATOM 253 CB ALA A 19 -11.026 0.358 -6.663 1.00 0.00 C ATOM 0 H ALA A 19 -12.334 1.949 -5.288 1.00 0.00 H new ATOM 0 HA ALA A 19 -9.544 1.692 -5.891 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -10.352 -0.110 -7.381 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -11.052 -0.236 -5.750 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -12.028 0.413 -7.088 1.00 0.00 H new ATOM 259 N ARG A 20 -11.448 3.344 -7.947 1.00 0.00 N ATOM 260 CA ARG A 20 -11.443 4.176 -9.147 1.00 0.00 C ATOM 261 C ARG A 20 -10.541 5.399 -8.970 1.00 0.00 C ATOM 262 O ARG A 20 -10.419 6.226 -9.874 1.00 0.00 O ATOM 263 CB ARG A 20 -12.875 4.610 -9.504 1.00 0.00 C ATOM 264 CG ARG A 20 -13.233 6.021 -9.057 1.00 0.00 C ATOM 265 CD ARG A 20 -14.559 6.473 -9.648 1.00 0.00 C ATOM 266 NE ARG A 20 -14.517 7.866 -10.083 1.00 0.00 N ATOM 267 CZ ARG A 20 -14.030 8.255 -11.257 1.00 0.00 C ATOM 268 NH1 ARG A 20 -13.549 7.358 -12.107 1.00 0.00 N ATOM 269 NH2 ARG A 20 -14.021 9.541 -11.582 1.00 0.00 N ATOM 0 H ARG A 20 -12.306 3.400 -7.398 1.00 0.00 H new ATOM 0 HA ARG A 20 -11.042 3.581 -9.967 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -13.005 4.540 -10.584 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -13.577 3.909 -9.053 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -13.288 6.056 -7.969 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -12.445 6.711 -9.359 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -14.814 5.836 -10.495 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -15.348 6.348 -8.906 1.00 0.00 H new ATOM 0 HE ARG A 20 -14.881 8.580 -9.452 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -13.552 6.368 -11.860 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -13.176 7.658 -13.008 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -14.388 10.234 -10.930 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -13.647 9.837 -12.484 1.00 0.00 H new ATOM 283 N GLY A 21 -9.913 5.507 -7.803 1.00 0.00 N ATOM 284 CA GLY A 21 -9.036 6.632 -7.536 1.00 0.00 C ATOM 285 C GLY A 21 -9.692 7.965 -7.837 1.00 0.00 C ATOM 286 O GLY A 21 -9.435 8.571 -8.879 1.00 0.00 O ATOM 0 H GLY A 21 -9.996 4.837 -7.039 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -8.730 6.609 -6.490 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -8.131 6.533 -8.135 1.00 0.00 H new ATOM 290 N ASP A 22 -10.542 8.422 -6.924 1.00 0.00 N ATOM 291 CA ASP A 22 -11.239 9.690 -7.092 1.00 0.00 C ATOM 292 C ASP A 22 -11.582 10.298 -5.735 1.00 0.00 C ATOM 293 O ASP A 22 -12.586 9.940 -5.119 1.00 0.00 O ATOM 294 CB ASP A 22 -12.518 9.487 -7.908 1.00 0.00 C ATOM 295 CG ASP A 22 -13.298 8.263 -7.469 1.00 0.00 C ATOM 296 OD1 ASP A 22 -13.483 8.082 -6.247 1.00 0.00 O ATOM 297 OD2 ASP A 22 -13.727 7.486 -8.349 1.00 0.00 O ATOM 0 H ASP A 22 -10.765 7.931 -6.058 1.00 0.00 H new ATOM 0 HA ASP A 22 -10.580 10.375 -7.626 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -13.150 10.370 -7.813 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -12.261 9.391 -8.963 1.00 0.00 H new ATOM 302 N VAL A 23 -10.741 11.219 -5.273 1.00 0.00 N ATOM 303 CA VAL A 23 -10.958 11.873 -3.989 1.00 0.00 C ATOM 304 C VAL A 23 -12.360 12.466 -3.909 1.00 0.00 C ATOM 305 O VAL A 23 -12.912 12.640 -2.822 1.00 0.00 O ATOM 306 CB VAL A 23 -9.924 12.987 -3.740 1.00 0.00 C ATOM 307 CG1 VAL A 23 -9.767 13.857 -4.978 1.00 0.00 C ATOM 308 CG2 VAL A 23 -10.319 13.824 -2.533 1.00 0.00 C ATOM 0 H VAL A 23 -9.905 11.528 -5.769 1.00 0.00 H new ATOM 0 HA VAL A 23 -10.843 11.109 -3.221 1.00 0.00 H new ATOM 0 HB VAL A 23 -8.961 12.523 -3.528 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -9.032 14.638 -4.783 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -9.431 13.243 -5.814 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -10.725 14.314 -5.226 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -9.576 14.606 -2.373 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -11.293 14.280 -2.709 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -10.371 13.187 -1.650 1.00 0.00 H new ATOM 318 N GLN A 24 -12.931 12.771 -5.068 1.00 0.00 N ATOM 319 CA GLN A 24 -14.271 13.340 -5.133 1.00 0.00 C ATOM 320 C GLN A 24 -15.329 12.284 -4.827 1.00 0.00 C ATOM 321 O GLN A 24 -16.216 12.499 -4.003 1.00 0.00 O ATOM 322 CB GLN A 24 -14.520 13.944 -6.516 1.00 0.00 C ATOM 323 CG GLN A 24 -14.519 15.463 -6.526 1.00 0.00 C ATOM 324 CD GLN A 24 -13.269 16.041 -7.160 1.00 0.00 C ATOM 325 OE1 GLN A 24 -12.150 15.677 -6.798 1.00 0.00 O ATOM 326 NE2 GLN A 24 -13.453 16.950 -8.111 1.00 0.00 N ATOM 0 H GLN A 24 -12.487 12.634 -5.976 1.00 0.00 H new ATOM 0 HA GLN A 24 -14.343 14.125 -4.380 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -13.755 13.584 -7.203 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -15.479 13.587 -6.892 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -15.395 15.820 -7.068 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -14.606 15.829 -5.503 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -14.398 17.222 -8.380 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -12.649 17.376 -8.572 1.00 0.00 H new ATOM 335 N GLU A 25 -15.227 11.144 -5.504 1.00 0.00 N ATOM 336 CA GLU A 25 -16.176 10.051 -5.313 1.00 0.00 C ATOM 337 C GLU A 25 -15.954 9.342 -3.981 1.00 0.00 C ATOM 338 O GLU A 25 -16.910 8.967 -3.303 1.00 0.00 O ATOM 339 CB GLU A 25 -16.064 9.049 -6.463 1.00 0.00 C ATOM 340 CG GLU A 25 -17.294 9.008 -7.354 1.00 0.00 C ATOM 341 CD GLU A 25 -17.838 7.604 -7.531 1.00 0.00 C ATOM 342 OE1 GLU A 25 -17.333 6.879 -8.413 1.00 0.00 O ATOM 343 OE2 GLU A 25 -18.769 7.231 -6.786 1.00 0.00 O ATOM 0 H GLU A 25 -14.497 10.953 -6.190 1.00 0.00 H new ATOM 0 HA GLU A 25 -17.178 10.479 -5.302 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -15.194 9.300 -7.070 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -15.890 8.055 -6.052 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -18.070 9.643 -6.926 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -17.045 9.423 -8.331 1.00 0.00 H new ATOM 350 N VAL A 26 -14.690 9.154 -3.611 1.00 0.00 N ATOM 351 CA VAL A 26 -14.357 8.481 -2.360 1.00 0.00 C ATOM 352 C VAL A 26 -15.085 9.118 -1.182 1.00 0.00 C ATOM 353 O VAL A 26 -15.593 8.421 -0.303 1.00 0.00 O ATOM 354 CB VAL A 26 -12.840 8.512 -2.083 1.00 0.00 C ATOM 355 CG1 VAL A 26 -12.391 9.919 -1.726 1.00 0.00 C ATOM 356 CG2 VAL A 26 -12.484 7.536 -0.972 1.00 0.00 C ATOM 0 H VAL A 26 -13.883 9.457 -4.157 1.00 0.00 H new ATOM 0 HA VAL A 26 -14.677 7.445 -2.469 1.00 0.00 H new ATOM 0 HB VAL A 26 -12.316 8.207 -2.989 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -11.318 9.921 -1.534 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -12.613 10.593 -2.554 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -12.920 10.254 -0.834 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -11.410 7.570 -0.788 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -13.017 7.811 -0.062 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -12.770 6.527 -1.269 1.00 0.00 H new ATOM 366 N ARG A 27 -15.132 10.446 -1.169 1.00 0.00 N ATOM 367 CA ARG A 27 -15.798 11.177 -0.098 1.00 0.00 C ATOM 368 C ARG A 27 -17.314 11.055 -0.213 1.00 0.00 C ATOM 369 O ARG A 27 -17.996 10.715 0.753 1.00 0.00 O ATOM 370 CB ARG A 27 -15.391 12.652 -0.132 1.00 0.00 C ATOM 371 CG ARG A 27 -13.957 12.898 0.306 1.00 0.00 C ATOM 372 CD ARG A 27 -13.502 14.306 -0.044 1.00 0.00 C ATOM 373 NE ARG A 27 -14.176 15.317 0.765 1.00 0.00 N ATOM 374 CZ ARG A 27 -13.840 15.601 2.020 1.00 0.00 C ATOM 375 NH1 ARG A 27 -12.842 14.952 2.604 1.00 0.00 N ATOM 376 NH2 ARG A 27 -14.501 16.534 2.691 1.00 0.00 N ATOM 0 H ARG A 27 -14.717 11.038 -1.888 1.00 0.00 H new ATOM 0 HA ARG A 27 -15.489 10.741 0.852 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -15.523 13.033 -1.144 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -16.061 13.220 0.513 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -13.872 12.744 1.382 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -13.299 12.172 -0.173 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -12.425 14.385 0.101 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -13.696 14.498 -1.099 1.00 0.00 H new ATOM 0 HE ARG A 27 -14.948 15.834 0.344 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -12.331 14.234 2.091 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -12.585 15.171 3.567 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -15.269 17.036 2.245 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -14.242 16.750 3.653 1.00 0.00 H new ATOM 390 N ARG A 28 -17.835 11.336 -1.401 1.00 0.00 N ATOM 391 CA ARG A 28 -19.271 11.259 -1.642 1.00 0.00 C ATOM 392 C ARG A 28 -19.818 9.903 -1.215 1.00 0.00 C ATOM 393 O ARG A 28 -20.972 9.788 -0.804 1.00 0.00 O ATOM 394 CB ARG A 28 -19.576 11.501 -3.122 1.00 0.00 C ATOM 395 CG ARG A 28 -19.054 12.830 -3.643 1.00 0.00 C ATOM 396 CD ARG A 28 -20.188 13.726 -4.111 1.00 0.00 C ATOM 397 NE ARG A 28 -21.337 13.668 -3.212 1.00 0.00 N ATOM 398 CZ ARG A 28 -22.575 13.986 -3.578 1.00 0.00 C ATOM 399 NH1 ARG A 28 -22.820 14.383 -4.819 1.00 0.00 N ATOM 400 NH2 ARG A 28 -23.567 13.905 -2.702 1.00 0.00 N ATOM 0 H ARG A 28 -17.285 11.619 -2.212 1.00 0.00 H new ATOM 0 HA ARG A 28 -19.757 12.033 -1.048 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -19.140 10.694 -3.711 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -20.655 11.460 -3.273 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -18.490 13.334 -2.858 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -18.364 12.653 -4.468 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -19.833 14.754 -4.180 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -20.496 13.427 -5.113 1.00 0.00 H new ATOM 0 HE ARG A 28 -21.181 13.367 -2.250 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -22.058 14.445 -5.494 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -23.770 14.627 -5.098 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -23.380 13.599 -1.747 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -24.517 14.149 -2.983 1.00 0.00 H new ATOM 414 N LEU A 29 -18.983 8.879 -1.318 1.00 0.00 N ATOM 415 CA LEU A 29 -19.383 7.531 -0.944 1.00 0.00 C ATOM 416 C LEU A 29 -19.465 7.381 0.574 1.00 0.00 C ATOM 417 O LEU A 29 -20.554 7.312 1.144 1.00 0.00 O ATOM 418 CB LEU A 29 -18.396 6.513 -1.520 1.00 0.00 C ATOM 419 CG LEU A 29 -18.515 6.254 -3.028 1.00 0.00 C ATOM 420 CD1 LEU A 29 -19.121 4.884 -3.285 1.00 0.00 C ATOM 421 CD2 LEU A 29 -19.339 7.339 -3.709 1.00 0.00 C ATOM 0 H LEU A 29 -18.024 8.956 -1.658 1.00 0.00 H new ATOM 0 HA LEU A 29 -20.375 7.344 -1.356 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -17.383 6.855 -1.307 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -18.530 5.567 -0.995 1.00 0.00 H new ATOM 0 HG LEU A 29 -17.512 6.278 -3.454 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -19.198 4.716 -4.359 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -18.486 4.116 -2.843 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -20.114 4.836 -2.838 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -19.406 7.129 -4.776 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -20.341 7.359 -3.279 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -18.861 8.307 -3.559 1.00 0.00 H new ATOM 433 N LEU A 30 -18.306 7.318 1.219 1.00 0.00 N ATOM 434 CA LEU A 30 -18.242 7.161 2.672 1.00 0.00 C ATOM 435 C LEU A 30 -18.608 8.452 3.404 1.00 0.00 C ATOM 436 O LEU A 30 -19.325 8.424 4.404 1.00 0.00 O ATOM 437 CB LEU A 30 -16.844 6.704 3.092 1.00 0.00 C ATOM 438 CG LEU A 30 -16.291 5.511 2.309 1.00 0.00 C ATOM 439 CD1 LEU A 30 -14.778 5.611 2.186 1.00 0.00 C ATOM 440 CD2 LEU A 30 -16.686 4.203 2.979 1.00 0.00 C ATOM 0 H LEU A 30 -17.396 7.373 0.761 1.00 0.00 H new ATOM 0 HA LEU A 30 -18.974 6.403 2.950 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -16.156 7.542 2.982 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -16.865 6.446 4.151 1.00 0.00 H new ATOM 0 HG LEU A 30 -16.721 5.527 1.307 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -14.401 4.755 1.627 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -14.515 6.530 1.663 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -14.332 5.619 3.180 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -16.284 3.366 2.408 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -16.285 4.177 3.992 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -17.773 4.127 3.017 1.00 0.00 H new ATOM 452 N HIS A 31 -18.098 9.578 2.914 1.00 0.00 N ATOM 453 CA HIS A 31 -18.358 10.874 3.539 1.00 0.00 C ATOM 454 C HIS A 31 -19.822 11.288 3.405 1.00 0.00 C ATOM 455 O HIS A 31 -20.233 12.314 3.948 1.00 0.00 O ATOM 456 CB HIS A 31 -17.457 11.948 2.926 1.00 0.00 C ATOM 457 CG HIS A 31 -16.707 12.754 3.941 1.00 0.00 C ATOM 458 ND1 HIS A 31 -17.342 13.680 4.731 1.00 0.00 N ATOM 459 CD2 HIS A 31 -15.388 12.738 4.250 1.00 0.00 C ATOM 460 CE1 HIS A 31 -16.405 14.205 5.500 1.00 0.00 C ATOM 461 NE2 HIS A 31 -15.203 13.665 5.243 1.00 0.00 N ATOM 0 H HIS A 31 -17.503 9.621 2.087 1.00 0.00 H new ATOM 0 HA HIS A 31 -18.135 10.774 4.601 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -16.743 11.471 2.254 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -18.066 12.619 2.320 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -14.629 12.115 3.801 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -16.583 14.971 6.241 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -14.321 13.899 5.699 1.00 0.00 H new ATOM 469 N ARG A 32 -20.609 10.495 2.685 1.00 0.00 N ATOM 470 CA ARG A 32 -22.023 10.803 2.496 1.00 0.00 C ATOM 471 C ARG A 32 -22.852 9.530 2.337 1.00 0.00 C ATOM 472 O ARG A 32 -23.530 9.102 3.271 1.00 0.00 O ATOM 473 CB ARG A 32 -22.211 11.712 1.280 1.00 0.00 C ATOM 474 CG ARG A 32 -23.661 11.869 0.854 1.00 0.00 C ATOM 475 CD ARG A 32 -24.350 12.983 1.625 1.00 0.00 C ATOM 476 NE ARG A 32 -25.458 13.567 0.872 1.00 0.00 N ATOM 477 CZ ARG A 32 -26.327 14.427 1.392 1.00 0.00 C ATOM 478 NH1 ARG A 32 -26.215 14.800 2.658 1.00 0.00 N ATOM 479 NH2 ARG A 32 -27.308 14.914 0.644 1.00 0.00 N ATOM 0 H ARG A 32 -20.295 9.640 2.226 1.00 0.00 H new ATOM 0 HA ARG A 32 -22.374 11.324 3.387 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -21.799 12.696 1.506 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -21.637 11.310 0.445 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -23.707 12.082 -0.214 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -24.192 10.931 1.015 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -24.722 12.592 2.572 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -23.625 13.761 1.864 1.00 0.00 H new ATOM 0 HE ARG A 32 -25.570 13.300 -0.106 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -25.461 14.427 3.235 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -26.883 15.460 3.056 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -27.396 14.628 -0.331 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -27.975 15.574 1.044 1.00 0.00 H new ATOM 493 N GLU A 33 -22.796 8.930 1.152 1.00 0.00 N ATOM 494 CA GLU A 33 -23.550 7.709 0.882 1.00 0.00 C ATOM 495 C GLU A 33 -23.483 6.754 2.072 1.00 0.00 C ATOM 496 O GLU A 33 -24.386 5.945 2.282 1.00 0.00 O ATOM 497 CB GLU A 33 -23.018 7.020 -0.377 1.00 0.00 C ATOM 498 CG GLU A 33 -23.354 5.538 -0.451 1.00 0.00 C ATOM 499 CD GLU A 33 -22.135 4.674 -0.716 1.00 0.00 C ATOM 500 OE1 GLU A 33 -21.005 5.191 -0.591 1.00 0.00 O ATOM 501 OE2 GLU A 33 -22.312 3.484 -1.048 1.00 0.00 O ATOM 0 H GLU A 33 -22.239 9.267 0.366 1.00 0.00 H new ATOM 0 HA GLU A 33 -24.592 7.984 0.720 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -23.427 7.521 -1.255 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -21.935 7.141 -0.417 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -23.818 5.228 0.485 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -24.088 5.375 -1.240 1.00 0.00 H new ATOM 508 N LEU A 34 -22.408 6.855 2.849 1.00 0.00 N ATOM 509 CA LEU A 34 -22.226 6.001 4.016 1.00 0.00 C ATOM 510 C LEU A 34 -22.041 4.546 3.600 1.00 0.00 C ATOM 511 O LEU A 34 -22.993 3.767 3.589 1.00 0.00 O ATOM 512 CB LEU A 34 -23.427 6.125 4.957 1.00 0.00 C ATOM 513 CG LEU A 34 -23.074 6.307 6.434 1.00 0.00 C ATOM 514 CD1 LEU A 34 -22.063 7.430 6.607 1.00 0.00 C ATOM 515 CD2 LEU A 34 -24.327 6.583 7.251 1.00 0.00 C ATOM 0 H LEU A 34 -21.651 7.520 2.691 1.00 0.00 H new ATOM 0 HA LEU A 34 -21.328 6.329 4.539 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -24.034 6.972 4.637 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -24.044 5.233 4.854 1.00 0.00 H new ATOM 0 HG LEU A 34 -22.624 5.383 6.797 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -21.824 7.545 7.664 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -21.155 7.191 6.054 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -22.484 8.361 6.227 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -24.057 6.710 8.299 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -24.806 7.492 6.887 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -25.017 5.745 7.153 1.00 0.00 H new ATOM 527 N VAL A 35 -20.809 4.188 3.256 1.00 0.00 N ATOM 528 CA VAL A 35 -20.498 2.828 2.837 1.00 0.00 C ATOM 529 C VAL A 35 -19.620 2.123 3.863 1.00 0.00 C ATOM 530 O VAL A 35 -18.648 2.690 4.360 1.00 0.00 O ATOM 531 CB VAL A 35 -19.787 2.802 1.469 1.00 0.00 C ATOM 532 CG1 VAL A 35 -20.660 2.119 0.430 1.00 0.00 C ATOM 533 CG2 VAL A 35 -19.410 4.206 1.019 1.00 0.00 C ATOM 0 H VAL A 35 -20.010 4.822 3.259 1.00 0.00 H new ATOM 0 HA VAL A 35 -21.450 2.304 2.752 1.00 0.00 H new ATOM 0 HB VAL A 35 -18.866 2.229 1.577 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -20.143 2.109 -0.530 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -20.864 1.095 0.743 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -21.600 2.662 0.331 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -18.910 4.156 0.052 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -20.310 4.814 0.931 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -18.739 4.655 1.751 1.00 0.00 H new ATOM 543 N HIS A 36 -19.969 0.879 4.175 1.00 0.00 N ATOM 544 CA HIS A 36 -19.212 0.093 5.139 1.00 0.00 C ATOM 545 C HIS A 36 -17.861 -0.316 4.559 1.00 0.00 C ATOM 546 O HIS A 36 -17.784 -0.846 3.450 1.00 0.00 O ATOM 547 CB HIS A 36 -20.003 -1.151 5.549 1.00 0.00 C ATOM 548 CG HIS A 36 -20.032 -1.380 7.028 1.00 0.00 C ATOM 549 ND1 HIS A 36 -19.393 -2.453 7.598 1.00 0.00 N ATOM 550 CD2 HIS A 36 -20.632 -0.653 8.001 1.00 0.00 C ATOM 551 CE1 HIS A 36 -19.614 -2.358 8.898 1.00 0.00 C ATOM 552 NE2 HIS A 36 -20.361 -1.282 9.189 1.00 0.00 N ATOM 0 H HIS A 36 -20.772 0.395 3.773 1.00 0.00 H new ATOM 0 HA HIS A 36 -19.039 0.710 6.021 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -21.026 -1.058 5.184 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -19.569 -2.024 5.063 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -21.212 0.248 7.867 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -19.241 -3.057 9.632 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -20.668 -0.988 10.116 1.00 0.00 H new ATOM 560 N PRO A 37 -16.776 -0.071 5.306 1.00 0.00 N ATOM 561 CA PRO A 37 -15.419 -0.412 4.869 1.00 0.00 C ATOM 562 C PRO A 37 -15.187 -1.919 4.829 1.00 0.00 C ATOM 563 O PRO A 37 -14.226 -2.395 4.225 1.00 0.00 O ATOM 564 CB PRO A 37 -14.529 0.240 5.929 1.00 0.00 C ATOM 565 CG PRO A 37 -15.390 0.339 7.140 1.00 0.00 C ATOM 566 CD PRO A 37 -16.790 0.558 6.638 1.00 0.00 C ATOM 0 HA PRO A 37 -15.217 -0.066 3.855 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -13.640 -0.361 6.123 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -14.185 1.223 5.607 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -15.328 -0.570 7.738 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -15.071 1.163 7.779 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -17.529 0.096 7.293 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -17.035 1.619 6.579 1.00 0.00 H new ATOM 574 N ASP A 38 -16.076 -2.665 5.478 1.00 0.00 N ATOM 575 CA ASP A 38 -15.971 -4.119 5.515 1.00 0.00 C ATOM 576 C ASP A 38 -16.584 -4.742 4.266 1.00 0.00 C ATOM 577 O ASP A 38 -16.175 -5.820 3.832 1.00 0.00 O ATOM 578 CB ASP A 38 -16.662 -4.669 6.765 1.00 0.00 C ATOM 579 CG ASP A 38 -16.049 -5.973 7.240 1.00 0.00 C ATOM 580 OD1 ASP A 38 -14.806 -6.088 7.212 1.00 0.00 O ATOM 581 OD2 ASP A 38 -16.813 -6.876 7.639 1.00 0.00 O ATOM 0 H ASP A 38 -16.876 -2.287 5.985 1.00 0.00 H new ATOM 0 HA ASP A 38 -14.913 -4.381 5.547 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -16.602 -3.930 7.564 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -17.720 -4.824 6.553 1.00 0.00 H new ATOM 586 N ALA A 39 -17.566 -4.057 3.689 1.00 0.00 N ATOM 587 CA ALA A 39 -18.233 -4.543 2.486 1.00 0.00 C ATOM 588 C ALA A 39 -17.221 -5.087 1.487 1.00 0.00 C ATOM 589 O ALA A 39 -16.042 -4.734 1.528 1.00 0.00 O ATOM 590 CB ALA A 39 -19.058 -3.432 1.855 1.00 0.00 C ATOM 0 H ALA A 39 -17.918 -3.164 4.035 1.00 0.00 H new ATOM 0 HA ALA A 39 -18.900 -5.357 2.770 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -19.550 -3.809 0.958 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -19.811 -3.089 2.565 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -18.405 -2.601 1.589 1.00 0.00 H new ATOM 596 N LEU A 40 -17.685 -5.950 0.592 1.00 0.00 N ATOM 597 CA LEU A 40 -16.814 -6.544 -0.416 1.00 0.00 C ATOM 598 C LEU A 40 -17.541 -6.713 -1.744 1.00 0.00 C ATOM 599 O LEU A 40 -18.726 -7.043 -1.780 1.00 0.00 O ATOM 600 CB LEU A 40 -16.294 -7.896 0.067 1.00 0.00 C ATOM 601 CG LEU A 40 -15.687 -7.889 1.471 1.00 0.00 C ATOM 602 CD1 LEU A 40 -16.778 -8.024 2.521 1.00 0.00 C ATOM 603 CD2 LEU A 40 -14.663 -9.003 1.613 1.00 0.00 C ATOM 0 H LEU A 40 -18.657 -6.254 0.543 1.00 0.00 H new ATOM 0 HA LEU A 40 -15.973 -5.869 -0.571 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -17.115 -8.613 0.045 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -15.541 -8.252 -0.637 1.00 0.00 H new ATOM 0 HG LEU A 40 -15.179 -6.937 1.625 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -16.330 -8.017 3.514 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -17.474 -7.190 2.432 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -17.313 -8.961 2.371 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -14.241 -8.983 2.618 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -15.146 -9.965 1.441 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -13.867 -8.861 0.882 1.00 0.00 H new ATOM 615 N ASN A 41 -16.820 -6.487 -2.837 1.00 0.00 N ATOM 616 CA ASN A 41 -17.389 -6.615 -4.171 1.00 0.00 C ATOM 617 C ASN A 41 -17.638 -8.081 -4.514 1.00 0.00 C ATOM 618 O ASN A 41 -17.193 -8.980 -3.800 1.00 0.00 O ATOM 619 CB ASN A 41 -16.456 -5.986 -5.208 1.00 0.00 C ATOM 620 CG ASN A 41 -15.024 -6.457 -5.059 1.00 0.00 C ATOM 621 OD1 ASN A 41 -14.749 -7.432 -4.360 1.00 0.00 O ATOM 622 ND2 ASN A 41 -14.101 -5.767 -5.719 1.00 0.00 N ATOM 0 H ASN A 41 -15.837 -6.213 -2.823 1.00 0.00 H new ATOM 0 HA ASN A 41 -18.343 -6.089 -4.187 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -16.813 -6.229 -6.209 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -16.490 -4.901 -5.112 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -13.120 -6.039 -5.658 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -14.373 -4.965 -6.287 1.00 0.00 H new ATOM 629 N ARG A 42 -18.353 -8.316 -5.609 1.00 0.00 N ATOM 630 CA ARG A 42 -18.661 -9.674 -6.043 1.00 0.00 C ATOM 631 C ARG A 42 -17.460 -10.593 -5.843 1.00 0.00 C ATOM 632 O ARG A 42 -17.613 -11.772 -5.524 1.00 0.00 O ATOM 633 CB ARG A 42 -19.080 -9.680 -7.515 1.00 0.00 C ATOM 634 CG ARG A 42 -19.922 -10.884 -7.903 1.00 0.00 C ATOM 635 CD ARG A 42 -19.077 -11.970 -8.548 1.00 0.00 C ATOM 636 NE ARG A 42 -19.860 -13.165 -8.853 1.00 0.00 N ATOM 637 CZ ARG A 42 -19.501 -14.069 -9.759 1.00 0.00 C ATOM 638 NH1 ARG A 42 -18.375 -13.915 -10.443 1.00 0.00 N ATOM 639 NH2 ARG A 42 -20.267 -15.128 -9.981 1.00 0.00 N ATOM 0 H ARG A 42 -18.730 -7.585 -6.212 1.00 0.00 H new ATOM 0 HA ARG A 42 -19.487 -10.044 -5.435 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -19.642 -8.771 -7.728 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -18.186 -9.656 -8.139 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -20.417 -11.284 -7.018 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -20.706 -10.574 -8.593 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -18.631 -11.585 -9.465 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -18.257 -12.235 -7.881 1.00 0.00 H new ATOM 0 HE ARG A 42 -20.730 -13.314 -8.342 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -17.783 -13.102 -10.274 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -18.101 -14.610 -11.138 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -21.133 -15.250 -9.456 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -19.990 -15.821 -10.677 1.00 0.00 H new ATOM 653 N PHE A 43 -16.265 -10.044 -6.032 1.00 0.00 N ATOM 654 CA PHE A 43 -15.037 -10.813 -5.873 1.00 0.00 C ATOM 655 C PHE A 43 -14.891 -11.320 -4.442 1.00 0.00 C ATOM 656 O PHE A 43 -14.694 -12.512 -4.212 1.00 0.00 O ATOM 657 CB PHE A 43 -13.825 -9.958 -6.250 1.00 0.00 C ATOM 658 CG PHE A 43 -13.961 -9.282 -7.584 1.00 0.00 C ATOM 659 CD1 PHE A 43 -14.822 -9.791 -8.552 1.00 0.00 C ATOM 660 CD2 PHE A 43 -13.229 -8.137 -7.876 1.00 0.00 C ATOM 661 CE1 PHE A 43 -14.949 -9.171 -9.785 1.00 0.00 C ATOM 662 CE2 PHE A 43 -13.352 -7.511 -9.106 1.00 0.00 C ATOM 663 CZ PHE A 43 -14.211 -8.027 -10.061 1.00 0.00 C ATOM 0 H PHE A 43 -16.121 -9.069 -6.296 1.00 0.00 H new ATOM 0 HA PHE A 43 -15.089 -11.674 -6.539 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -13.672 -9.200 -5.482 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -12.935 -10.587 -6.259 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -15.398 -10.680 -8.340 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -12.556 -7.730 -7.135 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -15.619 -9.576 -10.529 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -12.778 -6.621 -9.319 1.00 0.00 H new ATOM 0 HZ PHE A 43 -14.307 -7.540 -11.020 1.00 0.00 H new ATOM 673 N GLY A 44 -14.990 -10.404 -3.483 1.00 0.00 N ATOM 674 CA GLY A 44 -14.868 -10.777 -2.085 1.00 0.00 C ATOM 675 C GLY A 44 -13.695 -10.100 -1.404 1.00 0.00 C ATOM 676 O GLY A 44 -13.067 -10.677 -0.516 1.00 0.00 O ATOM 0 H GLY A 44 -15.152 -9.411 -3.649 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -15.788 -10.517 -1.561 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -14.753 -11.858 -2.009 1.00 0.00 H new ATOM 680 N LYS A 45 -13.397 -8.874 -1.821 1.00 0.00 N ATOM 681 CA LYS A 45 -12.291 -8.119 -1.245 1.00 0.00 C ATOM 682 C LYS A 45 -12.802 -6.950 -0.409 1.00 0.00 C ATOM 683 O LYS A 45 -13.993 -6.638 -0.421 1.00 0.00 O ATOM 684 CB LYS A 45 -11.367 -7.604 -2.351 1.00 0.00 C ATOM 685 CG LYS A 45 -10.679 -8.711 -3.132 1.00 0.00 C ATOM 686 CD LYS A 45 -10.222 -8.228 -4.499 1.00 0.00 C ATOM 687 CE LYS A 45 -8.708 -8.135 -4.582 1.00 0.00 C ATOM 688 NZ LYS A 45 -8.200 -8.541 -5.920 1.00 0.00 N ATOM 0 H LYS A 45 -13.906 -8.382 -2.556 1.00 0.00 H new ATOM 0 HA LYS A 45 -11.730 -8.789 -0.593 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -11.946 -6.990 -3.041 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -10.609 -6.958 -1.908 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -9.820 -9.076 -2.568 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -11.362 -9.552 -3.252 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -10.588 -8.909 -5.267 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -10.659 -7.251 -4.705 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -8.395 -7.113 -4.370 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -8.263 -8.770 -3.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -7.163 -8.464 -5.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -8.477 -9.525 -6.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -8.605 -7.919 -6.648 1.00 0.00 H new ATOM 702 N THR A 46 -11.891 -6.307 0.316 1.00 0.00 N ATOM 703 CA THR A 46 -12.248 -5.172 1.159 1.00 0.00 C ATOM 704 C THR A 46 -11.931 -3.852 0.461 1.00 0.00 C ATOM 705 O THR A 46 -11.223 -3.826 -0.547 1.00 0.00 O ATOM 706 CB THR A 46 -11.506 -5.248 2.494 1.00 0.00 C ATOM 707 OG1 THR A 46 -10.196 -5.757 2.311 1.00 0.00 O ATOM 708 CG2 THR A 46 -12.200 -6.124 3.515 1.00 0.00 C ATOM 0 H THR A 46 -10.901 -6.553 0.336 1.00 0.00 H new ATOM 0 HA THR A 46 -13.321 -5.214 1.345 1.00 0.00 H new ATOM 0 HB THR A 46 -11.484 -4.226 2.871 1.00 0.00 H new ATOM 0 HG1 THR A 46 -9.854 -6.095 3.165 1.00 0.00 H new ATOM 0 HG21 THR A 46 -11.621 -6.134 4.439 1.00 0.00 H new ATOM 0 HG22 THR A 46 -13.196 -5.730 3.715 1.00 0.00 H new ATOM 0 HG23 THR A 46 -12.283 -7.139 3.127 1.00 0.00 H new ATOM 716 N ALA A 47 -12.459 -2.760 1.003 1.00 0.00 N ATOM 717 CA ALA A 47 -12.234 -1.437 0.434 1.00 0.00 C ATOM 718 C ALA A 47 -10.746 -1.108 0.374 1.00 0.00 C ATOM 719 O ALA A 47 -10.245 -0.632 -0.645 1.00 0.00 O ATOM 720 CB ALA A 47 -12.976 -0.384 1.244 1.00 0.00 C ATOM 0 H ALA A 47 -13.047 -2.765 1.837 1.00 0.00 H new ATOM 0 HA ALA A 47 -12.619 -1.437 -0.586 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -12.800 0.600 0.809 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -14.044 -0.601 1.231 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -12.616 -0.396 2.273 1.00 0.00 H new ATOM 726 N LEU A 48 -10.045 -1.367 1.472 1.00 0.00 N ATOM 727 CA LEU A 48 -8.614 -1.099 1.546 1.00 0.00 C ATOM 728 C LEU A 48 -7.845 -1.981 0.565 1.00 0.00 C ATOM 729 O LEU A 48 -6.832 -1.565 0.003 1.00 0.00 O ATOM 730 CB LEU A 48 -8.105 -1.335 2.970 1.00 0.00 C ATOM 731 CG LEU A 48 -6.964 -0.415 3.411 1.00 0.00 C ATOM 732 CD1 LEU A 48 -6.080 -0.058 2.226 1.00 0.00 C ATOM 733 CD2 LEU A 48 -7.515 0.841 4.068 1.00 0.00 C ATOM 0 H LEU A 48 -10.445 -1.762 2.323 1.00 0.00 H new ATOM 0 HA LEU A 48 -8.448 -0.056 1.276 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -8.938 -1.213 3.662 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -7.770 -2.369 3.053 1.00 0.00 H new ATOM 0 HG LEU A 48 -6.356 -0.945 4.144 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -5.274 0.597 2.558 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -5.657 -0.968 1.801 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -6.675 0.454 1.469 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -6.689 1.483 4.375 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -8.146 1.376 3.358 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -8.105 0.565 4.942 1.00 0.00 H new ATOM 745 N GLN A 49 -8.333 -3.200 0.369 1.00 0.00 N ATOM 746 CA GLN A 49 -7.696 -4.143 -0.544 1.00 0.00 C ATOM 747 C GLN A 49 -7.939 -3.751 -1.998 1.00 0.00 C ATOM 748 O GLN A 49 -7.022 -3.759 -2.817 1.00 0.00 O ATOM 749 CB GLN A 49 -8.218 -5.558 -0.291 1.00 0.00 C ATOM 750 CG GLN A 49 -7.409 -6.639 -0.988 1.00 0.00 C ATOM 751 CD GLN A 49 -6.672 -7.533 -0.012 1.00 0.00 C ATOM 752 OE1 GLN A 49 -7.253 -8.030 0.954 1.00 0.00 O ATOM 753 NE2 GLN A 49 -5.384 -7.743 -0.258 1.00 0.00 N ATOM 0 H GLN A 49 -9.169 -3.560 0.830 1.00 0.00 H new ATOM 0 HA GLN A 49 -6.622 -4.118 -0.358 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -8.217 -5.750 0.782 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -9.254 -5.619 -0.625 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -8.074 -7.247 -1.602 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -6.691 -6.173 -1.662 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -4.943 -7.311 -1.070 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -4.836 -8.336 0.365 1.00 0.00 H new ATOM 762 N VAL A 50 -9.186 -3.414 -2.310 1.00 0.00 N ATOM 763 CA VAL A 50 -9.560 -3.026 -3.666 1.00 0.00 C ATOM 764 C VAL A 50 -9.036 -1.638 -4.019 1.00 0.00 C ATOM 765 O VAL A 50 -8.602 -1.398 -5.145 1.00 0.00 O ATOM 766 CB VAL A 50 -11.088 -3.043 -3.851 1.00 0.00 C ATOM 767 CG1 VAL A 50 -11.613 -4.471 -3.835 1.00 0.00 C ATOM 768 CG2 VAL A 50 -11.764 -2.204 -2.777 1.00 0.00 C ATOM 0 H VAL A 50 -9.956 -3.402 -1.641 1.00 0.00 H new ATOM 0 HA VAL A 50 -9.106 -3.758 -4.334 1.00 0.00 H new ATOM 0 HB VAL A 50 -11.324 -2.607 -4.822 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -12.695 -4.462 -3.967 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -11.153 -5.037 -4.645 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -11.368 -4.938 -2.881 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -12.844 -2.227 -2.923 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -11.522 -2.608 -1.794 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -11.411 -1.175 -2.843 1.00 0.00 H new ATOM 778 N MET A 51 -9.085 -0.724 -3.053 1.00 0.00 N ATOM 779 CA MET A 51 -8.618 0.643 -3.268 1.00 0.00 C ATOM 780 C MET A 51 -7.410 0.669 -4.200 1.00 0.00 C ATOM 781 O MET A 51 -6.607 -0.264 -4.218 1.00 0.00 O ATOM 782 CB MET A 51 -8.263 1.300 -1.935 1.00 0.00 C ATOM 783 CG MET A 51 -7.069 0.664 -1.246 1.00 0.00 C ATOM 784 SD MET A 51 -5.582 1.675 -1.363 1.00 0.00 S ATOM 785 CE MET A 51 -6.152 3.197 -0.612 1.00 0.00 C ATOM 0 H MET A 51 -9.443 -0.905 -2.115 1.00 0.00 H new ATOM 0 HA MET A 51 -9.426 1.204 -3.737 1.00 0.00 H new ATOM 0 HB2 MET A 51 -8.055 2.357 -2.104 1.00 0.00 H new ATOM 0 HB3 MET A 51 -9.126 1.247 -1.271 1.00 0.00 H new ATOM 0 HG2 MET A 51 -7.308 0.495 -0.196 1.00 0.00 H new ATOM 0 HG3 MET A 51 -6.876 -0.313 -1.690 1.00 0.00 H new ATOM 0 HE1 MET A 51 -5.304 3.861 -0.447 1.00 0.00 H new ATOM 0 HE2 MET A 51 -6.870 3.682 -1.273 1.00 0.00 H new ATOM 0 HE3 MET A 51 -6.630 2.975 0.342 1.00 0.00 H new ATOM 795 N MET A 52 -7.292 1.742 -4.974 1.00 0.00 N ATOM 796 CA MET A 52 -6.186 1.892 -5.914 1.00 0.00 C ATOM 797 C MET A 52 -5.237 3.003 -5.475 1.00 0.00 C ATOM 798 O MET A 52 -4.515 3.570 -6.295 1.00 0.00 O ATOM 799 CB MET A 52 -6.725 2.200 -7.313 1.00 0.00 C ATOM 800 CG MET A 52 -7.178 3.642 -7.487 1.00 0.00 C ATOM 801 SD MET A 52 -7.197 4.163 -9.213 1.00 0.00 S ATOM 802 CE MET A 52 -5.976 5.473 -9.184 1.00 0.00 C ATOM 0 H MET A 52 -7.949 2.522 -4.969 1.00 0.00 H new ATOM 0 HA MET A 52 -5.632 0.954 -5.934 1.00 0.00 H new ATOM 0 HB2 MET A 52 -5.951 1.980 -8.048 1.00 0.00 H new ATOM 0 HB3 MET A 52 -7.563 1.536 -7.525 1.00 0.00 H new ATOM 0 HG2 MET A 52 -8.177 3.758 -7.066 1.00 0.00 H new ATOM 0 HG3 MET A 52 -6.516 4.297 -6.921 1.00 0.00 H new ATOM 0 HE1 MET A 52 -6.094 6.100 -10.067 1.00 0.00 H new ATOM 0 HE2 MET A 52 -6.113 6.078 -8.288 1.00 0.00 H new ATOM 0 HE3 MET A 52 -4.976 5.039 -9.179 1.00 0.00 H new ATOM 812 N PHE A 53 -5.249 3.317 -4.185 1.00 0.00 N ATOM 813 CA PHE A 53 -4.393 4.371 -3.653 1.00 0.00 C ATOM 814 C PHE A 53 -4.537 5.642 -4.485 1.00 0.00 C ATOM 815 O PHE A 53 -5.353 6.509 -4.171 1.00 0.00 O ATOM 816 CB PHE A 53 -2.928 3.921 -3.633 1.00 0.00 C ATOM 817 CG PHE A 53 -2.636 2.865 -2.604 1.00 0.00 C ATOM 818 CD1 PHE A 53 -2.997 1.542 -2.831 1.00 0.00 C ATOM 819 CD2 PHE A 53 -1.999 3.189 -1.407 1.00 0.00 C ATOM 820 CE1 PHE A 53 -2.733 0.562 -1.888 1.00 0.00 C ATOM 821 CE2 PHE A 53 -1.732 2.212 -0.461 1.00 0.00 C ATOM 822 CZ PHE A 53 -2.099 0.898 -0.702 1.00 0.00 C ATOM 0 H PHE A 53 -5.839 2.859 -3.490 1.00 0.00 H new ATOM 0 HA PHE A 53 -4.706 4.580 -2.630 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -2.660 3.540 -4.618 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -2.293 4.787 -3.443 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -3.490 1.275 -3.754 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -1.711 4.212 -1.215 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -3.021 -0.462 -2.077 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -1.238 2.475 0.463 1.00 0.00 H new ATOM 0 HZ PHE A 53 -1.891 0.136 0.034 1.00 0.00 H new ATOM 832 N GLY A 54 -3.742 5.743 -5.548 1.00 0.00 N ATOM 833 CA GLY A 54 -3.799 6.910 -6.411 1.00 0.00 C ATOM 834 C GLY A 54 -4.101 8.180 -5.645 1.00 0.00 C ATOM 835 O GLY A 54 -3.197 8.818 -5.106 1.00 0.00 O ATOM 0 H GLY A 54 -3.060 5.038 -5.826 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -2.848 7.020 -6.931 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -4.563 6.758 -7.173 1.00 0.00 H new ATOM 839 N SER A 55 -5.377 8.546 -5.586 1.00 0.00 N ATOM 840 CA SER A 55 -5.789 9.744 -4.869 1.00 0.00 C ATOM 841 C SER A 55 -5.263 9.710 -3.440 1.00 0.00 C ATOM 842 O SER A 55 -4.980 8.641 -2.902 1.00 0.00 O ATOM 843 CB SER A 55 -7.313 9.870 -4.863 1.00 0.00 C ATOM 844 OG SER A 55 -7.783 10.326 -3.607 1.00 0.00 O ATOM 0 H SER A 55 -6.140 8.031 -6.025 1.00 0.00 H new ATOM 0 HA SER A 55 -5.370 10.611 -5.380 1.00 0.00 H new ATOM 0 HB2 SER A 55 -7.627 10.562 -5.645 1.00 0.00 H new ATOM 0 HB3 SER A 55 -7.762 8.904 -5.093 1.00 0.00 H new ATOM 0 HG SER A 55 -8.760 10.399 -3.630 1.00 0.00 H new ATOM 850 N PRO A 56 -5.118 10.882 -2.810 1.00 0.00 N ATOM 851 CA PRO A 56 -4.620 10.992 -1.446 1.00 0.00 C ATOM 852 C PRO A 56 -5.735 10.916 -0.408 1.00 0.00 C ATOM 853 O PRO A 56 -5.671 10.118 0.527 1.00 0.00 O ATOM 854 CB PRO A 56 -3.974 12.374 -1.444 1.00 0.00 C ATOM 855 CG PRO A 56 -4.763 13.175 -2.432 1.00 0.00 C ATOM 856 CD PRO A 56 -5.424 12.201 -3.383 1.00 0.00 C ATOM 0 HA PRO A 56 -3.944 10.179 -1.181 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -4.011 12.825 -0.452 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -2.924 12.319 -1.730 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -5.512 13.782 -1.923 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -4.113 13.861 -2.976 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -6.499 12.370 -3.444 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -5.028 12.299 -4.394 1.00 0.00 H new ATOM 864 N ALA A 57 -6.758 11.749 -0.578 1.00 0.00 N ATOM 865 CA ALA A 57 -7.885 11.771 0.346 1.00 0.00 C ATOM 866 C ALA A 57 -8.626 10.440 0.340 1.00 0.00 C ATOM 867 O ALA A 57 -9.309 10.094 1.304 1.00 0.00 O ATOM 868 CB ALA A 57 -8.836 12.905 -0.004 1.00 0.00 C ATOM 0 H ALA A 57 -6.829 12.416 -1.346 1.00 0.00 H new ATOM 0 HA ALA A 57 -7.494 11.937 1.350 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -9.672 12.908 0.695 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -8.307 13.856 0.059 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -9.211 12.765 -1.018 1.00 0.00 H new ATOM 874 N VAL A 58 -8.487 9.697 -0.751 1.00 0.00 N ATOM 875 CA VAL A 58 -9.135 8.410 -0.886 1.00 0.00 C ATOM 876 C VAL A 58 -8.638 7.435 0.174 1.00 0.00 C ATOM 877 O VAL A 58 -9.427 6.734 0.808 1.00 0.00 O ATOM 878 CB VAL A 58 -8.872 7.815 -2.278 1.00 0.00 C ATOM 879 CG1 VAL A 58 -7.380 7.766 -2.561 1.00 0.00 C ATOM 880 CG2 VAL A 58 -9.486 6.437 -2.389 1.00 0.00 C ATOM 0 H VAL A 58 -7.926 9.971 -1.557 1.00 0.00 H new ATOM 0 HA VAL A 58 -10.206 8.566 -0.754 1.00 0.00 H new ATOM 0 HB VAL A 58 -9.340 8.457 -3.024 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.211 7.342 -3.551 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -6.969 8.775 -2.524 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -6.888 7.146 -1.812 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -9.290 6.030 -3.381 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -9.049 5.782 -1.636 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -10.562 6.504 -2.230 1.00 0.00 H new ATOM 890 N ALA A 59 -7.324 7.398 0.361 1.00 0.00 N ATOM 891 CA ALA A 59 -6.717 6.511 1.343 1.00 0.00 C ATOM 892 C ALA A 59 -7.170 6.863 2.756 1.00 0.00 C ATOM 893 O ALA A 59 -7.577 5.994 3.523 1.00 0.00 O ATOM 894 CB ALA A 59 -5.200 6.576 1.245 1.00 0.00 C ATOM 0 H ALA A 59 -6.659 7.973 -0.156 1.00 0.00 H new ATOM 0 HA ALA A 59 -7.043 5.494 1.127 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -4.759 5.908 1.985 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -4.886 6.270 0.247 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -4.867 7.597 1.433 1.00 0.00 H new ATOM 900 N LEU A 60 -7.090 8.145 3.092 1.00 0.00 N ATOM 901 CA LEU A 60 -7.483 8.617 4.414 1.00 0.00 C ATOM 902 C LEU A 60 -8.966 8.363 4.672 1.00 0.00 C ATOM 903 O LEU A 60 -9.341 7.837 5.720 1.00 0.00 O ATOM 904 CB LEU A 60 -7.173 10.113 4.547 1.00 0.00 C ATOM 905 CG LEU A 60 -7.476 10.753 5.913 1.00 0.00 C ATOM 906 CD1 LEU A 60 -8.000 9.729 6.911 1.00 0.00 C ATOM 907 CD2 LEU A 60 -6.233 11.438 6.461 1.00 0.00 C ATOM 0 H LEU A 60 -6.756 8.878 2.466 1.00 0.00 H new ATOM 0 HA LEU A 60 -6.912 8.062 5.158 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -6.117 10.265 4.325 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -7.739 10.649 3.785 1.00 0.00 H new ATOM 0 HG LEU A 60 -8.258 11.498 5.764 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -8.202 10.219 7.863 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -8.919 9.286 6.529 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -7.254 8.948 7.056 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -6.461 11.887 7.428 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.436 10.704 6.581 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -5.910 12.215 5.768 1.00 0.00 H new ATOM 919 N GLU A 61 -9.805 8.745 3.718 1.00 0.00 N ATOM 920 CA GLU A 61 -11.246 8.568 3.852 1.00 0.00 C ATOM 921 C GLU A 61 -11.628 7.093 3.956 1.00 0.00 C ATOM 922 O GLU A 61 -12.257 6.675 4.927 1.00 0.00 O ATOM 923 CB GLU A 61 -11.968 9.206 2.664 1.00 0.00 C ATOM 924 CG GLU A 61 -12.808 10.415 3.042 1.00 0.00 C ATOM 925 CD GLU A 61 -11.988 11.513 3.690 1.00 0.00 C ATOM 926 OE1 GLU A 61 -11.855 11.501 4.932 1.00 0.00 O ATOM 927 OE2 GLU A 61 -11.478 12.385 2.955 1.00 0.00 O ATOM 0 H GLU A 61 -9.513 9.180 2.843 1.00 0.00 H new ATOM 0 HA GLU A 61 -11.553 9.061 4.775 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -11.231 9.505 1.919 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -12.610 8.460 2.196 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -13.295 10.808 2.150 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -13.598 10.105 3.726 1.00 0.00 H new ATOM 934 N LEU A 62 -11.257 6.313 2.947 1.00 0.00 N ATOM 935 CA LEU A 62 -11.578 4.889 2.926 1.00 0.00 C ATOM 936 C LEU A 62 -10.913 4.149 4.087 1.00 0.00 C ATOM 937 O LEU A 62 -11.567 3.393 4.805 1.00 0.00 O ATOM 938 CB LEU A 62 -11.170 4.277 1.578 1.00 0.00 C ATOM 939 CG LEU A 62 -9.964 3.332 1.610 1.00 0.00 C ATOM 940 CD1 LEU A 62 -10.314 2.041 2.333 1.00 0.00 C ATOM 941 CD2 LEU A 62 -9.482 3.041 0.196 1.00 0.00 C ATOM 0 H LEU A 62 -10.735 6.641 2.134 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.656 4.780 3.048 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -12.024 3.732 1.175 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -10.953 5.088 0.883 1.00 0.00 H new ATOM 0 HG LEU A 62 -9.157 3.820 2.157 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -9.445 1.384 2.345 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -10.612 2.267 3.357 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -11.136 1.546 1.816 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -8.625 2.369 0.235 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -10.285 2.573 -0.373 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -9.190 3.973 -0.288 1.00 0.00 H new ATOM 953 N LEU A 63 -9.613 4.363 4.265 1.00 0.00 N ATOM 954 CA LEU A 63 -8.874 3.705 5.340 1.00 0.00 C ATOM 955 C LEU A 63 -9.399 4.127 6.710 1.00 0.00 C ATOM 956 O LEU A 63 -9.584 3.292 7.596 1.00 0.00 O ATOM 957 CB LEU A 63 -7.379 4.017 5.236 1.00 0.00 C ATOM 958 CG LEU A 63 -6.936 5.315 5.916 1.00 0.00 C ATOM 959 CD1 LEU A 63 -6.875 5.131 7.425 1.00 0.00 C ATOM 960 CD2 LEU A 63 -5.587 5.765 5.378 1.00 0.00 C ATOM 0 H LEU A 63 -9.051 4.984 3.683 1.00 0.00 H new ATOM 0 HA LEU A 63 -9.021 2.630 5.232 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -6.820 3.188 5.671 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -7.107 4.067 4.182 1.00 0.00 H new ATOM 0 HG LEU A 63 -7.670 6.089 5.693 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -6.558 6.063 7.893 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -7.861 4.855 7.798 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -6.162 4.343 7.667 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -5.288 6.689 5.873 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.842 4.993 5.571 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -5.662 5.936 4.304 1.00 0.00 H new ATOM 972 N LYS A 64 -9.636 5.424 6.881 1.00 0.00 N ATOM 973 CA LYS A 64 -10.138 5.945 8.147 1.00 0.00 C ATOM 974 C LYS A 64 -11.514 5.371 8.461 1.00 0.00 C ATOM 975 O LYS A 64 -11.874 5.193 9.624 1.00 0.00 O ATOM 976 CB LYS A 64 -10.208 7.473 8.105 1.00 0.00 C ATOM 977 CG LYS A 64 -10.601 8.103 9.431 1.00 0.00 C ATOM 978 CD LYS A 64 -10.731 9.613 9.312 1.00 0.00 C ATOM 979 CE LYS A 64 -12.075 10.015 8.725 1.00 0.00 C ATOM 980 NZ LYS A 64 -13.165 9.091 9.144 1.00 0.00 N ATOM 0 H LYS A 64 -9.489 6.131 6.161 1.00 0.00 H new ATOM 0 HA LYS A 64 -9.448 5.643 8.934 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -9.237 7.864 7.801 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -10.926 7.774 7.343 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -11.547 7.681 9.770 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -9.854 7.859 10.187 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -10.612 10.068 10.296 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -9.929 9.999 8.683 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -12.319 11.030 9.039 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -12.007 10.026 7.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -14.087 9.528 8.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -13.084 8.197 8.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -13.087 8.902 10.164 1.00 0.00 H new ATOM 994 N GLN A 65 -12.280 5.082 7.415 1.00 0.00 N ATOM 995 CA GLN A 65 -13.618 4.528 7.577 1.00 0.00 C ATOM 996 C GLN A 65 -13.618 3.400 8.604 1.00 0.00 C ATOM 997 O GLN A 65 -14.619 3.164 9.281 1.00 0.00 O ATOM 998 CB GLN A 65 -14.146 4.013 6.237 1.00 0.00 C ATOM 999 CG GLN A 65 -15.649 3.791 6.219 1.00 0.00 C ATOM 1000 CD GLN A 65 -16.432 5.071 6.437 1.00 0.00 C ATOM 1001 OE1 GLN A 65 -15.880 6.170 6.374 1.00 0.00 O ATOM 1002 NE2 GLN A 65 -17.727 4.935 6.694 1.00 0.00 N ATOM 0 H GLN A 65 -11.997 5.222 6.445 1.00 0.00 H new ATOM 0 HA GLN A 65 -14.272 5.323 7.936 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -13.883 4.725 5.455 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -13.646 3.075 5.995 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -15.936 3.353 5.263 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -15.915 3.071 6.993 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -18.143 4.005 6.737 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -18.306 5.761 6.848 1.00 0.00 H new ATOM 1011 N GLY A 66 -12.489 2.708 8.717 1.00 0.00 N ATOM 1012 CA GLY A 66 -12.381 1.615 9.665 1.00 0.00 C ATOM 1013 C GLY A 66 -11.591 0.442 9.115 1.00 0.00 C ATOM 1014 O GLY A 66 -11.109 -0.399 9.872 1.00 0.00 O ATOM 0 H GLY A 66 -11.647 2.885 8.169 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -11.903 1.975 10.576 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -13.380 1.278 9.941 1.00 0.00 H new ATOM 1018 N ALA A 67 -11.460 0.387 7.793 1.00 0.00 N ATOM 1019 CA ALA A 67 -10.724 -0.691 7.144 1.00 0.00 C ATOM 1020 C ALA A 67 -9.297 -0.779 7.675 1.00 0.00 C ATOM 1021 O ALA A 67 -8.727 0.216 8.121 1.00 0.00 O ATOM 1022 CB ALA A 67 -10.718 -0.491 5.636 1.00 0.00 C ATOM 0 H ALA A 67 -11.854 1.076 7.152 1.00 0.00 H new ATOM 0 HA ALA A 67 -11.226 -1.631 7.373 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -10.165 -1.303 5.163 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -11.743 -0.486 5.266 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -10.241 0.460 5.397 1.00 0.00 H new ATOM 1028 N SER A 68 -8.725 -1.979 7.624 1.00 0.00 N ATOM 1029 CA SER A 68 -7.363 -2.198 8.101 1.00 0.00 C ATOM 1030 C SER A 68 -6.397 -2.376 6.933 1.00 0.00 C ATOM 1031 O SER A 68 -6.612 -3.215 6.058 1.00 0.00 O ATOM 1032 CB SER A 68 -7.311 -3.429 9.009 1.00 0.00 C ATOM 1033 OG SER A 68 -8.322 -3.375 10.002 1.00 0.00 O ATOM 0 H SER A 68 -9.183 -2.814 7.258 1.00 0.00 H new ATOM 0 HA SER A 68 -7.060 -1.319 8.670 1.00 0.00 H new ATOM 0 HB2 SER A 68 -7.433 -4.332 8.410 1.00 0.00 H new ATOM 0 HB3 SER A 68 -6.333 -3.492 9.485 1.00 0.00 H new ATOM 0 HG SER A 68 -8.268 -4.174 10.568 1.00 0.00 H new ATOM 1039 N PRO A 69 -5.313 -1.585 6.909 1.00 0.00 N ATOM 1040 CA PRO A 69 -4.305 -1.653 5.846 1.00 0.00 C ATOM 1041 C PRO A 69 -3.506 -2.951 5.888 1.00 0.00 C ATOM 1042 O PRO A 69 -2.671 -3.205 5.018 1.00 0.00 O ATOM 1043 CB PRO A 69 -3.395 -0.457 6.139 1.00 0.00 C ATOM 1044 CG PRO A 69 -3.566 -0.197 7.596 1.00 0.00 C ATOM 1045 CD PRO A 69 -4.989 -0.562 7.918 1.00 0.00 C ATOM 0 HA PRO A 69 -4.758 -1.628 4.855 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -2.356 -0.681 5.896 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -3.680 0.412 5.546 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -2.868 -0.793 8.183 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -3.369 0.849 7.832 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -5.085 -0.952 8.931 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -5.652 0.300 7.844 1.00 0.00 H new ATOM 1053 N ASN A 70 -3.765 -3.769 6.902 1.00 0.00 N ATOM 1054 CA ASN A 70 -3.070 -5.042 7.055 1.00 0.00 C ATOM 1055 C ASN A 70 -3.915 -6.192 6.518 1.00 0.00 C ATOM 1056 O ASN A 70 -4.334 -7.072 7.271 1.00 0.00 O ATOM 1057 CB ASN A 70 -2.728 -5.289 8.525 1.00 0.00 C ATOM 1058 CG ASN A 70 -1.550 -4.458 8.991 1.00 0.00 C ATOM 1059 OD1 ASN A 70 -0.483 -4.989 9.304 1.00 0.00 O ATOM 1060 ND2 ASN A 70 -1.736 -3.144 9.041 1.00 0.00 N ATOM 0 H ASN A 70 -4.451 -3.573 7.631 1.00 0.00 H new ATOM 0 HA ASN A 70 -2.146 -4.993 6.478 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -3.597 -5.060 9.141 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -2.504 -6.346 8.671 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -0.979 -2.533 9.348 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -2.636 -2.746 8.773 1.00 0.00 H new ATOM 1067 N VAL A 71 -4.163 -6.180 5.213 1.00 0.00 N ATOM 1068 CA VAL A 71 -4.958 -7.223 4.577 1.00 0.00 C ATOM 1069 C VAL A 71 -4.133 -8.004 3.562 1.00 0.00 C ATOM 1070 O VAL A 71 -3.532 -7.426 2.656 1.00 0.00 O ATOM 1071 CB VAL A 71 -6.195 -6.635 3.871 1.00 0.00 C ATOM 1072 CG1 VAL A 71 -7.151 -6.030 4.887 1.00 0.00 C ATOM 1073 CG2 VAL A 71 -5.778 -5.602 2.835 1.00 0.00 C ATOM 0 H VAL A 71 -3.825 -5.459 4.575 1.00 0.00 H new ATOM 0 HA VAL A 71 -5.285 -7.896 5.369 1.00 0.00 H new ATOM 0 HB VAL A 71 -6.715 -7.442 3.354 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -8.019 -5.620 4.371 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -7.476 -6.801 5.585 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -6.645 -5.235 5.434 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -6.665 -5.198 2.347 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.234 -4.795 3.325 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -5.136 -6.072 2.090 1.00 0.00 H new ATOM 1083 N GLN A 72 -4.107 -9.324 3.720 1.00 0.00 N ATOM 1084 CA GLN A 72 -3.355 -10.189 2.819 1.00 0.00 C ATOM 1085 C GLN A 72 -4.289 -10.921 1.862 1.00 0.00 C ATOM 1086 O GLN A 72 -5.400 -11.302 2.232 1.00 0.00 O ATOM 1087 CB GLN A 72 -2.532 -11.201 3.617 1.00 0.00 C ATOM 1088 CG GLN A 72 -1.949 -10.634 4.900 1.00 0.00 C ATOM 1089 CD GLN A 72 -1.062 -11.627 5.626 1.00 0.00 C ATOM 1090 OE1 GLN A 72 -1.311 -11.970 6.781 1.00 0.00 O ATOM 1091 NE2 GLN A 72 -0.019 -12.094 4.950 1.00 0.00 N ATOM 0 H GLN A 72 -4.599 -9.818 4.465 1.00 0.00 H new ATOM 0 HA GLN A 72 -2.681 -9.563 2.234 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -3.161 -12.057 3.861 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -1.720 -11.571 2.991 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -1.372 -9.739 4.668 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -2.761 -10.328 5.560 1.00 0.00 H new ATOM 0 HE21 GLN A 72 0.150 -11.782 3.994 1.00 0.00 H new ATOM 0 HE22 GLN A 72 0.613 -12.765 5.387 1.00 0.00 H new ATOM 1133 N GLY A 76 0.557 -12.834 -0.676 1.00 0.00 N ATOM 1134 CA GLY A 76 0.897 -11.800 0.285 1.00 0.00 C ATOM 1135 C GLY A 76 1.095 -10.445 -0.365 1.00 0.00 C ATOM 1136 O GLY A 76 2.058 -9.740 -0.062 1.00 0.00 O ATOM 0 HA2 GLY A 76 0.106 -11.729 1.032 1.00 0.00 H new ATOM 0 HA3 GLY A 76 1.808 -12.083 0.811 1.00 0.00 H new ATOM 1140 N THR A 77 0.184 -10.080 -1.260 1.00 0.00 N ATOM 1141 CA THR A 77 0.264 -8.800 -1.954 1.00 0.00 C ATOM 1142 C THR A 77 -0.810 -7.840 -1.452 1.00 0.00 C ATOM 1143 O THR A 77 -1.872 -7.709 -2.058 1.00 0.00 O ATOM 1144 CB THR A 77 0.115 -9.002 -3.462 1.00 0.00 C ATOM 1145 OG1 THR A 77 0.267 -10.368 -3.802 1.00 0.00 O ATOM 1146 CG2 THR A 77 1.118 -8.212 -4.274 1.00 0.00 C ATOM 0 H THR A 77 -0.619 -10.652 -1.522 1.00 0.00 H new ATOM 0 HA THR A 77 1.242 -8.365 -1.747 1.00 0.00 H new ATOM 0 HB THR A 77 -0.886 -8.644 -3.704 1.00 0.00 H new ATOM 0 HG1 THR A 77 0.167 -10.477 -4.771 1.00 0.00 H new ATOM 0 HG21 THR A 77 0.957 -8.401 -5.335 1.00 0.00 H new ATOM 0 HG22 THR A 77 0.993 -7.148 -4.072 1.00 0.00 H new ATOM 0 HG23 THR A 77 2.128 -8.517 -4.001 1.00 0.00 H new ATOM 1154 N SER A 78 -0.523 -7.170 -0.341 1.00 0.00 N ATOM 1155 CA SER A 78 -1.466 -6.221 0.242 1.00 0.00 C ATOM 1156 C SER A 78 -1.330 -4.851 -0.416 1.00 0.00 C ATOM 1157 O SER A 78 -0.365 -4.588 -1.134 1.00 0.00 O ATOM 1158 CB SER A 78 -1.237 -6.103 1.751 1.00 0.00 C ATOM 1159 OG SER A 78 -0.938 -7.366 2.321 1.00 0.00 O ATOM 0 H SER A 78 0.353 -7.266 0.173 1.00 0.00 H new ATOM 0 HA SER A 78 -2.476 -6.591 0.065 1.00 0.00 H new ATOM 0 HB2 SER A 78 -0.418 -5.410 1.945 1.00 0.00 H new ATOM 0 HB3 SER A 78 -2.126 -5.687 2.226 1.00 0.00 H new ATOM 0 HG SER A 78 -1.751 -7.750 2.710 1.00 0.00 H new ATOM 1165 N PRO A 79 -2.303 -3.958 -0.177 1.00 0.00 N ATOM 1166 CA PRO A 79 -2.296 -2.609 -0.747 1.00 0.00 C ATOM 1167 C PRO A 79 -0.948 -1.915 -0.576 1.00 0.00 C ATOM 1168 O PRO A 79 -0.526 -1.136 -1.431 1.00 0.00 O ATOM 1169 CB PRO A 79 -3.379 -1.887 0.054 1.00 0.00 C ATOM 1170 CG PRO A 79 -4.324 -2.965 0.460 1.00 0.00 C ATOM 1171 CD PRO A 79 -3.487 -4.197 0.669 1.00 0.00 C ATOM 0 HA PRO A 79 -2.474 -2.615 -1.822 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -2.959 -1.380 0.922 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -3.878 -1.128 -0.548 1.00 0.00 H new ATOM 0 HG2 PRO A 79 -4.854 -2.695 1.373 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -5.078 -3.132 -0.309 1.00 0.00 H new ATOM 0 HD2 PRO A 79 -3.213 -4.323 1.716 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -4.019 -5.099 0.368 1.00 0.00 H new ATOM 1179 N VAL A 80 -0.278 -2.204 0.534 1.00 0.00 N ATOM 1180 CA VAL A 80 1.021 -1.609 0.822 1.00 0.00 C ATOM 1181 C VAL A 80 2.003 -1.852 -0.327 1.00 0.00 C ATOM 1182 O VAL A 80 2.755 -0.956 -0.711 1.00 0.00 O ATOM 1183 CB VAL A 80 1.592 -2.157 2.161 1.00 0.00 C ATOM 1184 CG1 VAL A 80 2.903 -2.915 1.971 1.00 0.00 C ATOM 1185 CG2 VAL A 80 1.769 -1.022 3.157 1.00 0.00 C ATOM 0 H VAL A 80 -0.614 -2.848 1.250 1.00 0.00 H new ATOM 0 HA VAL A 80 0.884 -0.533 0.924 1.00 0.00 H new ATOM 0 HB VAL A 80 0.869 -2.872 2.553 1.00 0.00 H new ATOM 0 HG11 VAL A 80 3.258 -3.276 2.936 1.00 0.00 H new ATOM 0 HG12 VAL A 80 2.740 -3.762 1.304 1.00 0.00 H new ATOM 0 HG13 VAL A 80 3.649 -2.249 1.536 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.169 -1.417 4.091 1.00 0.00 H new ATOM 0 HG22 VAL A 80 2.460 -0.284 2.749 1.00 0.00 H new ATOM 0 HG23 VAL A 80 0.805 -0.550 3.346 1.00 0.00 H new ATOM 1195 N HIS A 81 1.991 -3.066 -0.865 1.00 0.00 N ATOM 1196 CA HIS A 81 2.880 -3.423 -1.966 1.00 0.00 C ATOM 1197 C HIS A 81 2.472 -2.710 -3.253 1.00 0.00 C ATOM 1198 O HIS A 81 3.307 -2.123 -3.941 1.00 0.00 O ATOM 1199 CB HIS A 81 2.871 -4.938 -2.187 1.00 0.00 C ATOM 1200 CG HIS A 81 3.316 -5.725 -0.993 1.00 0.00 C ATOM 1201 ND1 HIS A 81 2.654 -5.641 0.206 1.00 0.00 N ATOM 1202 CD2 HIS A 81 4.351 -6.591 -0.869 1.00 0.00 C ATOM 1203 CE1 HIS A 81 3.294 -6.451 1.030 1.00 0.00 C ATOM 1204 NE2 HIS A 81 4.330 -7.049 0.424 1.00 0.00 N ATOM 0 H HIS A 81 1.376 -3.820 -0.558 1.00 0.00 H new ATOM 0 HA HIS A 81 3.888 -3.105 -1.700 1.00 0.00 H new ATOM 0 HB2 HIS A 81 1.863 -5.250 -2.461 1.00 0.00 H new ATOM 0 HB3 HIS A 81 3.519 -5.177 -3.030 1.00 0.00 H new ATOM 0 HD2 HIS A 81 5.056 -6.867 -1.639 1.00 0.00 H new ATOM 0 HE1 HIS A 81 3.018 -6.611 2.062 1.00 0.00 H new ATOM 0 HE2 HIS A 81 4.978 -7.716 0.844 1.00 0.00 H new ATOM 1212 N ASP A 82 1.184 -2.770 -3.573 1.00 0.00 N ATOM 1213 CA ASP A 82 0.661 -2.136 -4.781 1.00 0.00 C ATOM 1214 C ASP A 82 1.001 -0.650 -4.817 1.00 0.00 C ATOM 1215 O ASP A 82 1.517 -0.146 -5.813 1.00 0.00 O ATOM 1216 CB ASP A 82 -0.855 -2.318 -4.861 1.00 0.00 C ATOM 1217 CG ASP A 82 -1.567 -1.779 -3.636 1.00 0.00 C ATOM 1218 OD1 ASP A 82 -1.593 -0.543 -3.460 1.00 0.00 O ATOM 1219 OD2 ASP A 82 -2.098 -2.594 -2.853 1.00 0.00 O ATOM 0 H ASP A 82 0.481 -3.252 -3.013 1.00 0.00 H new ATOM 0 HA ASP A 82 1.130 -2.618 -5.639 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -1.233 -1.812 -5.749 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -1.086 -3.377 -4.975 1.00 0.00 H new ATOM 1224 N ALA A 83 0.705 0.048 -3.725 1.00 0.00 N ATOM 1225 CA ALA A 83 0.975 1.478 -3.636 1.00 0.00 C ATOM 1226 C ALA A 83 2.427 1.785 -3.983 1.00 0.00 C ATOM 1227 O ALA A 83 2.709 2.676 -4.785 1.00 0.00 O ATOM 1228 CB ALA A 83 0.642 1.989 -2.243 1.00 0.00 C ATOM 0 H ALA A 83 0.278 -0.354 -2.890 1.00 0.00 H new ATOM 0 HA ALA A 83 0.342 1.990 -4.360 1.00 0.00 H new ATOM 0 HB1 ALA A 83 0.848 3.058 -2.189 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -0.413 1.811 -2.033 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.252 1.464 -1.508 1.00 0.00 H new ATOM 1234 N ALA A 84 3.344 1.042 -3.375 1.00 0.00 N ATOM 1235 CA ALA A 84 4.768 1.234 -3.620 1.00 0.00 C ATOM 1236 C ALA A 84 5.127 0.918 -5.069 1.00 0.00 C ATOM 1237 O ALA A 84 5.788 1.710 -5.741 1.00 0.00 O ATOM 1238 CB ALA A 84 5.586 0.371 -2.672 1.00 0.00 C ATOM 0 H ALA A 84 3.127 0.301 -2.709 1.00 0.00 H new ATOM 0 HA ALA A 84 5.004 2.282 -3.437 1.00 0.00 H new ATOM 0 HB1 ALA A 84 6.648 0.524 -2.865 1.00 0.00 H new ATOM 0 HB2 ALA A 84 5.361 0.648 -1.642 1.00 0.00 H new ATOM 0 HB3 ALA A 84 5.336 -0.678 -2.828 1.00 0.00 H new ATOM 1244 N ARG A 85 4.688 -0.243 -5.544 1.00 0.00 N ATOM 1245 CA ARG A 85 4.965 -0.664 -6.912 1.00 0.00 C ATOM 1246 C ARG A 85 4.260 0.240 -7.918 1.00 0.00 C ATOM 1247 O ARG A 85 4.805 0.551 -8.978 1.00 0.00 O ATOM 1248 CB ARG A 85 4.525 -2.114 -7.123 1.00 0.00 C ATOM 1249 CG ARG A 85 5.243 -2.806 -8.271 1.00 0.00 C ATOM 1250 CD ARG A 85 5.850 -4.129 -7.832 1.00 0.00 C ATOM 1251 NE ARG A 85 5.047 -5.269 -8.260 1.00 0.00 N ATOM 1252 CZ ARG A 85 5.451 -6.532 -8.161 1.00 0.00 C ATOM 1253 NH1 ARG A 85 6.645 -6.811 -7.653 1.00 0.00 N ATOM 1254 NH2 ARG A 85 4.662 -7.517 -8.568 1.00 0.00 N ATOM 0 H ARG A 85 4.139 -0.909 -5.001 1.00 0.00 H new ATOM 0 HA ARG A 85 6.040 -0.588 -7.073 1.00 0.00 H new ATOM 0 HB2 ARG A 85 4.699 -2.675 -6.205 1.00 0.00 H new ATOM 0 HB3 ARG A 85 3.452 -2.136 -7.311 1.00 0.00 H new ATOM 0 HG2 ARG A 85 4.543 -2.979 -9.088 1.00 0.00 H new ATOM 0 HG3 ARG A 85 6.027 -2.155 -8.656 1.00 0.00 H new ATOM 0 HD2 ARG A 85 6.856 -4.220 -8.242 1.00 0.00 H new ATOM 0 HD3 ARG A 85 5.946 -4.141 -6.746 1.00 0.00 H new ATOM 0 HE ARG A 85 4.125 -5.087 -8.657 1.00 0.00 H new ATOM 0 HH11 ARG A 85 7.254 -6.056 -7.338 1.00 0.00 H new ATOM 0 HH12 ARG A 85 6.953 -7.780 -7.578 1.00 0.00 H new ATOM 0 HH21 ARG A 85 3.743 -7.307 -8.958 1.00 0.00 H new ATOM 0 HH22 ARG A 85 4.974 -8.485 -8.491 1.00 0.00 H new ATOM 1268 N THR A 86 3.043 0.656 -7.583 1.00 0.00 N ATOM 1269 CA THR A 86 2.264 1.522 -8.460 1.00 0.00 C ATOM 1270 C THR A 86 2.897 2.906 -8.563 1.00 0.00 C ATOM 1271 O THR A 86 2.738 3.599 -9.568 1.00 0.00 O ATOM 1272 CB THR A 86 0.827 1.640 -7.948 1.00 0.00 C ATOM 1273 OG1 THR A 86 0.809 2.110 -6.612 1.00 0.00 O ATOM 1274 CG2 THR A 86 0.069 0.330 -7.982 1.00 0.00 C ATOM 0 H THR A 86 2.575 0.408 -6.711 1.00 0.00 H new ATOM 0 HA THR A 86 2.252 1.075 -9.454 1.00 0.00 H new ATOM 0 HB THR A 86 0.337 2.342 -8.622 1.00 0.00 H new ATOM 0 HG1 THR A 86 1.724 2.311 -6.323 1.00 0.00 H new ATOM 0 HG21 THR A 86 -0.942 0.485 -7.606 1.00 0.00 H new ATOM 0 HG22 THR A 86 0.022 -0.037 -9.007 1.00 0.00 H new ATOM 0 HG23 THR A 86 0.580 -0.403 -7.357 1.00 0.00 H new ATOM 1282 N GLY A 87 3.617 3.303 -7.519 1.00 0.00 N ATOM 1283 CA GLY A 87 4.263 4.602 -7.514 1.00 0.00 C ATOM 1284 C GLY A 87 3.307 5.720 -7.143 1.00 0.00 C ATOM 1285 O GLY A 87 2.893 6.501 -7.998 1.00 0.00 O ATOM 0 H GLY A 87 3.765 2.748 -6.676 1.00 0.00 H new ATOM 0 HA2 GLY A 87 5.094 4.589 -6.809 1.00 0.00 H new ATOM 0 HA3 GLY A 87 4.684 4.799 -8.500 1.00 0.00 H new ATOM 1289 N PHE A 88 2.955 5.792 -5.864 1.00 0.00 N ATOM 1290 CA PHE A 88 2.041 6.819 -5.380 1.00 0.00 C ATOM 1291 C PHE A 88 2.288 7.111 -3.904 1.00 0.00 C ATOM 1292 O PHE A 88 1.393 6.971 -3.071 1.00 0.00 O ATOM 1293 CB PHE A 88 0.590 6.379 -5.591 1.00 0.00 C ATOM 1294 CG PHE A 88 0.097 6.598 -6.993 1.00 0.00 C ATOM 1295 CD1 PHE A 88 0.427 7.758 -7.686 1.00 0.00 C ATOM 1296 CD2 PHE A 88 -0.698 5.647 -7.621 1.00 0.00 C ATOM 1297 CE1 PHE A 88 -0.026 7.963 -8.979 1.00 0.00 C ATOM 1298 CE2 PHE A 88 -1.155 5.846 -8.914 1.00 0.00 C ATOM 1299 CZ PHE A 88 -0.820 7.004 -9.594 1.00 0.00 C ATOM 0 H PHE A 88 3.289 5.151 -5.144 1.00 0.00 H new ATOM 0 HA PHE A 88 2.222 7.732 -5.948 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.499 5.321 -5.343 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -0.051 6.925 -4.899 1.00 0.00 H new ATOM 0 HD1 PHE A 88 1.043 8.507 -7.211 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -0.963 4.742 -7.095 1.00 0.00 H new ATOM 0 HE1 PHE A 88 0.238 8.867 -9.508 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -1.772 5.098 -9.391 1.00 0.00 H new ATOM 0 HZ PHE A 88 -1.176 7.162 -10.602 1.00 0.00 H new ATOM 1309 N LEU A 89 3.514 7.515 -3.591 1.00 0.00 N ATOM 1310 CA LEU A 89 3.897 7.825 -2.217 1.00 0.00 C ATOM 1311 C LEU A 89 2.953 8.845 -1.585 1.00 0.00 C ATOM 1312 O LEU A 89 2.927 8.998 -0.364 1.00 0.00 O ATOM 1313 CB LEU A 89 5.332 8.354 -2.176 1.00 0.00 C ATOM 1314 CG LEU A 89 5.818 8.789 -0.792 1.00 0.00 C ATOM 1315 CD1 LEU A 89 5.774 7.619 0.179 1.00 0.00 C ATOM 1316 CD2 LEU A 89 7.225 9.362 -0.878 1.00 0.00 C ATOM 0 H LEU A 89 4.263 7.636 -4.273 1.00 0.00 H new ATOM 0 HA LEU A 89 3.831 6.902 -1.641 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.000 7.580 -2.553 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.411 9.202 -2.856 1.00 0.00 H new ATOM 0 HG LEU A 89 5.153 9.568 -0.420 1.00 0.00 H new ATOM 0 HD11 LEU A 89 6.123 7.946 1.159 1.00 0.00 H new ATOM 0 HD12 LEU A 89 4.751 7.253 0.262 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.417 6.818 -0.187 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.555 9.666 0.115 1.00 0.00 H new ATOM 0 HD22 LEU A 89 7.903 8.604 -1.269 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.226 10.227 -1.542 1.00 0.00 H new ATOM 1328 N ASP A 90 2.179 9.543 -2.411 1.00 0.00 N ATOM 1329 CA ASP A 90 1.245 10.540 -1.908 1.00 0.00 C ATOM 1330 C ASP A 90 0.253 9.905 -0.944 1.00 0.00 C ATOM 1331 O ASP A 90 0.346 10.086 0.269 1.00 0.00 O ATOM 1332 CB ASP A 90 0.496 11.207 -3.064 1.00 0.00 C ATOM 1333 CG ASP A 90 -1.009 11.122 -2.906 1.00 0.00 C ATOM 1334 OD1 ASP A 90 -1.579 10.057 -3.221 1.00 0.00 O ATOM 1335 OD2 ASP A 90 -1.616 12.121 -2.465 1.00 0.00 O ATOM 0 H ASP A 90 2.181 9.436 -3.425 1.00 0.00 H new ATOM 0 HA ASP A 90 1.815 11.300 -1.374 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.793 12.254 -3.129 1.00 0.00 H new ATOM 0 HB3 ASP A 90 0.787 10.734 -4.002 1.00 0.00 H new ATOM 1340 N THR A 91 -0.695 9.153 -1.493 1.00 0.00 N ATOM 1341 CA THR A 91 -1.700 8.485 -0.678 1.00 0.00 C ATOM 1342 C THR A 91 -1.093 7.296 0.055 1.00 0.00 C ATOM 1343 O THR A 91 -1.492 6.973 1.174 1.00 0.00 O ATOM 1344 CB THR A 91 -2.884 8.036 -1.542 1.00 0.00 C ATOM 1345 OG1 THR A 91 -4.096 8.149 -0.819 1.00 0.00 O ATOM 1346 CG2 THR A 91 -2.782 6.607 -2.039 1.00 0.00 C ATOM 0 H THR A 91 -0.788 8.992 -2.496 1.00 0.00 H new ATOM 0 HA THR A 91 -2.065 9.195 0.064 1.00 0.00 H new ATOM 0 HB THR A 91 -2.865 8.697 -2.408 1.00 0.00 H new ATOM 0 HG1 THR A 91 -4.853 8.096 -1.439 1.00 0.00 H new ATOM 0 HG21 THR A 91 -3.658 6.368 -2.642 1.00 0.00 H new ATOM 0 HG22 THR A 91 -1.883 6.496 -2.645 1.00 0.00 H new ATOM 0 HG23 THR A 91 -2.732 5.928 -1.188 1.00 0.00 H new ATOM 1354 N LEU A 92 -0.126 6.647 -0.583 1.00 0.00 N ATOM 1355 CA LEU A 92 0.531 5.495 0.015 1.00 0.00 C ATOM 1356 C LEU A 92 1.032 5.845 1.408 1.00 0.00 C ATOM 1357 O LEU A 92 0.671 5.198 2.390 1.00 0.00 O ATOM 1358 CB LEU A 92 1.696 5.030 -0.864 1.00 0.00 C ATOM 1359 CG LEU A 92 2.640 4.017 -0.212 1.00 0.00 C ATOM 1360 CD1 LEU A 92 3.497 3.329 -1.264 1.00 0.00 C ATOM 1361 CD2 LEU A 92 3.517 4.698 0.828 1.00 0.00 C ATOM 0 H LEU A 92 0.218 6.899 -1.510 1.00 0.00 H new ATOM 0 HA LEU A 92 -0.191 4.682 0.093 1.00 0.00 H new ATOM 0 HB2 LEU A 92 1.290 4.590 -1.775 1.00 0.00 H new ATOM 0 HB3 LEU A 92 2.276 5.903 -1.163 1.00 0.00 H new ATOM 0 HG LEU A 92 2.037 3.259 0.288 1.00 0.00 H new ATOM 0 HD11 LEU A 92 4.161 2.613 -0.781 1.00 0.00 H new ATOM 0 HD12 LEU A 92 2.854 2.807 -1.972 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.091 4.074 -1.794 1.00 0.00 H new ATOM 0 HD21 LEU A 92 4.182 3.963 1.281 1.00 0.00 H new ATOM 0 HD22 LEU A 92 4.110 5.477 0.350 1.00 0.00 H new ATOM 0 HD23 LEU A 92 2.888 5.143 1.599 1.00 0.00 H new ATOM 1373 N LYS A 93 1.862 6.880 1.484 1.00 0.00 N ATOM 1374 CA LYS A 93 2.413 7.325 2.757 1.00 0.00 C ATOM 1375 C LYS A 93 1.301 7.655 3.748 1.00 0.00 C ATOM 1376 O LYS A 93 1.445 7.439 4.949 1.00 0.00 O ATOM 1377 CB LYS A 93 3.309 8.547 2.550 1.00 0.00 C ATOM 1378 CG LYS A 93 2.540 9.846 2.382 1.00 0.00 C ATOM 1379 CD LYS A 93 3.430 11.052 2.632 1.00 0.00 C ATOM 1380 CE LYS A 93 4.157 11.480 1.366 1.00 0.00 C ATOM 1381 NZ LYS A 93 4.088 12.952 1.156 1.00 0.00 N ATOM 0 H LYS A 93 2.167 7.426 0.678 1.00 0.00 H new ATOM 0 HA LYS A 93 3.010 6.512 3.169 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.982 8.641 3.402 1.00 0.00 H new ATOM 0 HB3 LYS A 93 3.930 8.386 1.669 1.00 0.00 H new ATOM 0 HG2 LYS A 93 2.127 9.899 1.375 1.00 0.00 H new ATOM 0 HG3 LYS A 93 1.697 9.864 3.073 1.00 0.00 H new ATOM 0 HD2 LYS A 93 2.827 11.880 3.004 1.00 0.00 H new ATOM 0 HD3 LYS A 93 4.158 10.814 3.408 1.00 0.00 H new ATOM 0 HE2 LYS A 93 5.200 11.170 1.424 1.00 0.00 H new ATOM 0 HE3 LYS A 93 3.721 10.970 0.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 4.595 13.202 0.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 3.093 13.245 1.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 4.527 13.439 1.963 1.00 0.00 H new ATOM 1395 N VAL A 94 0.187 8.177 3.241 1.00 0.00 N ATOM 1396 CA VAL A 94 -0.941 8.527 4.096 1.00 0.00 C ATOM 1397 C VAL A 94 -1.400 7.320 4.903 1.00 0.00 C ATOM 1398 O VAL A 94 -1.340 7.322 6.133 1.00 0.00 O ATOM 1399 CB VAL A 94 -2.131 9.070 3.278 1.00 0.00 C ATOM 1400 CG1 VAL A 94 -3.372 9.177 4.150 1.00 0.00 C ATOM 1401 CG2 VAL A 94 -1.787 10.417 2.660 1.00 0.00 C ATOM 0 H VAL A 94 0.043 8.366 2.249 1.00 0.00 H new ATOM 0 HA VAL A 94 -0.597 9.310 4.771 1.00 0.00 H new ATOM 0 HB VAL A 94 -2.341 8.370 2.469 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -4.202 9.562 3.557 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -3.630 8.192 4.538 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -3.175 9.854 4.981 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -2.639 10.783 2.087 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -1.548 11.129 3.450 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -0.927 10.305 2.000 1.00 0.00 H new ATOM 1411 N LEU A 95 -1.854 6.285 4.204 1.00 0.00 N ATOM 1412 CA LEU A 95 -2.316 5.065 4.855 1.00 0.00 C ATOM 1413 C LEU A 95 -1.138 4.262 5.397 1.00 0.00 C ATOM 1414 O LEU A 95 -1.249 3.588 6.421 1.00 0.00 O ATOM 1415 CB LEU A 95 -3.121 4.211 3.873 1.00 0.00 C ATOM 1416 CG LEU A 95 -2.305 3.591 2.738 1.00 0.00 C ATOM 1417 CD1 LEU A 95 -2.250 2.078 2.885 1.00 0.00 C ATOM 1418 CD2 LEU A 95 -2.890 3.978 1.388 1.00 0.00 C ATOM 0 H LEU A 95 -1.912 6.267 3.186 1.00 0.00 H new ATOM 0 HA LEU A 95 -2.958 5.347 5.690 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -3.611 3.411 4.428 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -3.909 4.827 3.440 1.00 0.00 H new ATOM 0 HG LEU A 95 -1.287 3.977 2.794 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -1.665 1.654 2.069 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -1.784 1.822 3.836 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -3.261 1.673 2.856 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -2.297 3.528 0.592 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -3.918 3.621 1.321 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -2.875 5.063 1.283 1.00 0.00 H new ATOM 1430 N VAL A 96 -0.009 4.340 4.699 1.00 0.00 N ATOM 1431 CA VAL A 96 1.194 3.620 5.102 1.00 0.00 C ATOM 1432 C VAL A 96 1.807 4.227 6.364 1.00 0.00 C ATOM 1433 O VAL A 96 2.160 3.509 7.300 1.00 0.00 O ATOM 1434 CB VAL A 96 2.244 3.612 3.967 1.00 0.00 C ATOM 1435 CG1 VAL A 96 3.625 3.254 4.500 1.00 0.00 C ATOM 1436 CG2 VAL A 96 1.828 2.645 2.869 1.00 0.00 C ATOM 0 H VAL A 96 0.098 4.896 3.850 1.00 0.00 H new ATOM 0 HA VAL A 96 0.898 2.593 5.316 1.00 0.00 H new ATOM 0 HB VAL A 96 2.297 4.616 3.547 1.00 0.00 H new ATOM 0 HG11 VAL A 96 4.343 3.256 3.680 1.00 0.00 H new ATOM 0 HG12 VAL A 96 3.927 3.986 5.249 1.00 0.00 H new ATOM 0 HG13 VAL A 96 3.594 2.263 4.953 1.00 0.00 H new ATOM 0 HG21 VAL A 96 2.577 2.650 2.077 1.00 0.00 H new ATOM 0 HG22 VAL A 96 1.744 1.640 3.282 1.00 0.00 H new ATOM 0 HG23 VAL A 96 0.865 2.951 2.460 1.00 0.00 H new ATOM 1446 N GLU A 97 1.931 5.550 6.382 1.00 0.00 N ATOM 1447 CA GLU A 97 2.502 6.249 7.529 1.00 0.00 C ATOM 1448 C GLU A 97 1.743 5.910 8.808 1.00 0.00 C ATOM 1449 O GLU A 97 2.324 5.870 9.893 1.00 0.00 O ATOM 1450 CB GLU A 97 2.481 7.761 7.296 1.00 0.00 C ATOM 1451 CG GLU A 97 1.087 8.363 7.321 1.00 0.00 C ATOM 1452 CD GLU A 97 0.245 7.933 6.134 1.00 0.00 C ATOM 1453 OE1 GLU A 97 0.022 6.715 5.975 1.00 0.00 O ATOM 1454 OE2 GLU A 97 -0.189 8.817 5.365 1.00 0.00 O ATOM 0 H GLU A 97 1.644 6.160 5.616 1.00 0.00 H new ATOM 0 HA GLU A 97 3.535 5.920 7.643 1.00 0.00 H new ATOM 0 HB2 GLU A 97 3.090 8.246 8.059 1.00 0.00 H new ATOM 0 HB3 GLU A 97 2.944 7.978 6.333 1.00 0.00 H new ATOM 0 HG2 GLU A 97 0.585 8.070 8.243 1.00 0.00 H new ATOM 0 HG3 GLU A 97 1.165 9.450 7.332 1.00 0.00 H new ATOM 1461 N HIS A 98 0.444 5.669 8.674 1.00 0.00 N ATOM 1462 CA HIS A 98 -0.393 5.336 9.821 1.00 0.00 C ATOM 1463 C HIS A 98 -0.011 3.975 10.396 1.00 0.00 C ATOM 1464 O HIS A 98 -0.404 3.629 11.510 1.00 0.00 O ATOM 1465 CB HIS A 98 -1.869 5.337 9.421 1.00 0.00 C ATOM 1466 CG HIS A 98 -2.669 6.410 10.093 1.00 0.00 C ATOM 1467 ND1 HIS A 98 -2.144 7.157 11.119 1.00 0.00 N ATOM 1468 CD2 HIS A 98 -3.937 6.819 9.850 1.00 0.00 C ATOM 1469 CE1 HIS A 98 -3.096 7.998 11.476 1.00 0.00 C ATOM 1470 NE2 HIS A 98 -4.202 7.831 10.736 1.00 0.00 N ATOM 0 H HIS A 98 -0.052 5.698 7.783 1.00 0.00 H new ATOM 0 HA HIS A 98 -0.232 6.093 10.588 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -1.944 5.461 8.341 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -2.303 4.367 9.661 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -4.609 6.424 9.103 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -2.997 8.729 12.265 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -5.073 8.356 10.817 1.00 0.00 H new ATOM 1478 N GLY A 99 0.757 3.209 9.629 1.00 0.00 N ATOM 1479 CA GLY A 99 1.179 1.897 10.079 1.00 0.00 C ATOM 1480 C GLY A 99 1.221 0.885 8.953 1.00 0.00 C ATOM 1481 O GLY A 99 2.294 0.433 8.554 1.00 0.00 O ATOM 0 H GLY A 99 1.095 3.474 8.704 1.00 0.00 H new ATOM 0 HA2 GLY A 99 2.167 1.972 10.533 1.00 0.00 H new ATOM 0 HA3 GLY A 99 0.498 1.546 10.854 1.00 0.00 H new ATOM 1485 N ALA A 100 0.049 0.528 8.436 1.00 0.00 N ATOM 1486 CA ALA A 100 -0.045 -0.437 7.349 1.00 0.00 C ATOM 1487 C ALA A 100 0.879 -1.626 7.589 1.00 0.00 C ATOM 1488 O ALA A 100 1.399 -1.808 8.690 1.00 0.00 O ATOM 1489 CB ALA A 100 0.284 0.231 6.022 1.00 0.00 C ATOM 0 H ALA A 100 -0.849 0.894 8.754 1.00 0.00 H new ATOM 0 HA ALA A 100 -1.069 -0.809 7.313 1.00 0.00 H new ATOM 0 HB1 ALA A 100 0.210 -0.501 5.218 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -0.420 1.043 5.839 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.298 0.630 6.057 1.00 0.00 H new ATOM 1495 N ASP A 101 1.079 -2.432 6.553 1.00 0.00 N ATOM 1496 CA ASP A 101 1.940 -3.605 6.652 1.00 0.00 C ATOM 1497 C ASP A 101 3.203 -3.427 5.813 1.00 0.00 C ATOM 1498 O ASP A 101 3.422 -4.151 4.843 1.00 0.00 O ATOM 1499 CB ASP A 101 1.186 -4.857 6.200 1.00 0.00 C ATOM 1500 CG ASP A 101 0.053 -4.536 5.245 1.00 0.00 C ATOM 1501 OD1 ASP A 101 -0.230 -3.338 5.039 1.00 0.00 O ATOM 1502 OD2 ASP A 101 -0.553 -5.484 4.704 1.00 0.00 O ATOM 0 H ASP A 101 0.657 -2.295 5.635 1.00 0.00 H new ATOM 0 HA ASP A 101 2.233 -3.722 7.695 1.00 0.00 H new ATOM 0 HB2 ASP A 101 1.882 -5.542 5.716 1.00 0.00 H new ATOM 0 HB3 ASP A 101 0.786 -5.372 7.073 1.00 0.00 H new ATOM 1507 N VAL A 102 4.029 -2.459 6.196 1.00 0.00 N ATOM 1508 CA VAL A 102 5.271 -2.186 5.481 1.00 0.00 C ATOM 1509 C VAL A 102 6.365 -3.171 5.878 1.00 0.00 C ATOM 1510 O VAL A 102 7.515 -3.035 5.461 1.00 0.00 O ATOM 1511 CB VAL A 102 5.770 -0.753 5.745 1.00 0.00 C ATOM 1512 CG1 VAL A 102 4.912 0.258 4.999 1.00 0.00 C ATOM 1513 CG2 VAL A 102 5.781 -0.459 7.237 1.00 0.00 C ATOM 0 H VAL A 102 3.861 -1.850 6.997 1.00 0.00 H new ATOM 0 HA VAL A 102 5.052 -2.298 4.419 1.00 0.00 H new ATOM 0 HB VAL A 102 6.792 -0.669 5.375 1.00 0.00 H new ATOM 0 HG11 VAL A 102 5.280 1.265 5.198 1.00 0.00 H new ATOM 0 HG12 VAL A 102 4.962 0.058 3.929 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.878 0.177 5.335 1.00 0.00 H new ATOM 0 HG21 VAL A 102 6.136 0.558 7.405 1.00 0.00 H new ATOM 0 HG22 VAL A 102 4.772 -0.561 7.635 1.00 0.00 H new ATOM 0 HG23 VAL A 102 6.443 -1.163 7.742 1.00 0.00 H new ATOM 1523 N ASN A 103 6.002 -4.163 6.685 1.00 0.00 N ATOM 1524 CA ASN A 103 6.959 -5.168 7.137 1.00 0.00 C ATOM 1525 C ASN A 103 6.515 -6.568 6.725 1.00 0.00 C ATOM 1526 O ASN A 103 6.889 -7.558 7.354 1.00 0.00 O ATOM 1527 CB ASN A 103 7.126 -5.098 8.656 1.00 0.00 C ATOM 1528 CG ASN A 103 6.706 -3.756 9.224 1.00 0.00 C ATOM 1529 OD1 ASN A 103 5.547 -3.558 9.589 1.00 0.00 O ATOM 1530 ND2 ASN A 103 7.649 -2.824 9.302 1.00 0.00 N ATOM 0 H ASN A 103 5.054 -4.293 7.039 1.00 0.00 H new ATOM 0 HA ASN A 103 7.918 -4.958 6.664 1.00 0.00 H new ATOM 0 HB2 ASN A 103 6.534 -5.887 9.120 1.00 0.00 H new ATOM 0 HB3 ASN A 103 8.168 -5.288 8.913 1.00 0.00 H new ATOM 0 HD21 ASN A 103 7.425 -1.902 9.676 1.00 0.00 H new ATOM 0 HD22 ASN A 103 8.597 -3.030 8.988 1.00 0.00 H new ATOM 1537 N ALA A 104 5.716 -6.643 5.665 1.00 0.00 N ATOM 1538 CA ALA A 104 5.222 -7.923 5.169 1.00 0.00 C ATOM 1539 C ALA A 104 5.670 -8.165 3.732 1.00 0.00 C ATOM 1540 O ALA A 104 5.483 -7.314 2.861 1.00 0.00 O ATOM 1541 CB ALA A 104 3.706 -7.976 5.268 1.00 0.00 C ATOM 0 H ALA A 104 5.397 -5.833 5.133 1.00 0.00 H new ATOM 0 HA ALA A 104 5.644 -8.713 5.790 1.00 0.00 H new ATOM 0 HB1 ALA A 104 3.350 -8.936 4.895 1.00 0.00 H new ATOM 0 HB2 ALA A 104 3.405 -7.857 6.309 1.00 0.00 H new ATOM 0 HB3 ALA A 104 3.274 -7.172 4.672 1.00 0.00 H new ATOM 1547 N LEU A 105 6.264 -9.329 3.490 1.00 0.00 N ATOM 1548 CA LEU A 105 6.740 -9.683 2.157 1.00 0.00 C ATOM 1549 C LEU A 105 5.623 -10.299 1.322 1.00 0.00 C ATOM 1550 O LEU A 105 4.607 -10.743 1.855 1.00 0.00 O ATOM 1551 CB LEU A 105 7.912 -10.661 2.251 1.00 0.00 C ATOM 1552 CG LEU A 105 8.869 -10.415 3.417 1.00 0.00 C ATOM 1553 CD1 LEU A 105 9.861 -11.561 3.543 1.00 0.00 C ATOM 1554 CD2 LEU A 105 9.597 -9.092 3.237 1.00 0.00 C ATOM 0 H LEU A 105 6.427 -10.043 4.199 1.00 0.00 H new ATOM 0 HA LEU A 105 7.074 -8.768 1.669 1.00 0.00 H new ATOM 0 HB2 LEU A 105 7.515 -11.673 2.334 1.00 0.00 H new ATOM 0 HB3 LEU A 105 8.478 -10.616 1.321 1.00 0.00 H new ATOM 0 HG LEU A 105 8.287 -10.364 4.337 1.00 0.00 H new ATOM 0 HD11 LEU A 105 10.535 -11.369 4.378 1.00 0.00 H new ATOM 0 HD12 LEU A 105 9.321 -12.492 3.719 1.00 0.00 H new ATOM 0 HD13 LEU A 105 10.439 -11.645 2.623 1.00 0.00 H new ATOM 0 HD21 LEU A 105 10.274 -8.932 4.076 1.00 0.00 H new ATOM 0 HD22 LEU A 105 10.168 -9.114 2.309 1.00 0.00 H new ATOM 0 HD23 LEU A 105 8.871 -8.280 3.197 1.00 0.00 H new ATOM 1566 N ASP A 106 5.823 -10.325 0.009 1.00 0.00 N ATOM 1567 CA ASP A 106 4.839 -10.886 -0.902 1.00 0.00 C ATOM 1568 C ASP A 106 5.067 -12.383 -1.091 1.00 0.00 C ATOM 1569 O ASP A 106 4.450 -13.205 -0.415 1.00 0.00 O ATOM 1570 CB ASP A 106 4.898 -10.172 -2.254 1.00 0.00 C ATOM 1571 CG ASP A 106 5.895 -9.030 -2.260 1.00 0.00 C ATOM 1572 OD1 ASP A 106 6.939 -9.149 -1.585 1.00 0.00 O ATOM 1573 OD2 ASP A 106 5.632 -8.015 -2.939 1.00 0.00 O ATOM 0 H ASP A 106 6.661 -9.963 -0.447 1.00 0.00 H new ATOM 0 HA ASP A 106 3.850 -10.739 -0.467 1.00 0.00 H new ATOM 0 HB2 ASP A 106 5.166 -10.889 -3.030 1.00 0.00 H new ATOM 0 HB3 ASP A 106 3.909 -9.789 -2.503 1.00 0.00 H new ATOM 1578 N SER A 107 5.959 -12.729 -2.014 1.00 0.00 N ATOM 1579 CA SER A 107 6.270 -14.127 -2.290 1.00 0.00 C ATOM 1580 C SER A 107 7.777 -14.353 -2.319 1.00 0.00 C ATOM 1581 O SER A 107 8.284 -15.306 -1.729 1.00 0.00 O ATOM 1582 CB SER A 107 5.653 -14.556 -3.622 1.00 0.00 C ATOM 1583 OG SER A 107 6.224 -15.768 -4.082 1.00 0.00 O ATOM 0 H SER A 107 6.479 -12.061 -2.583 1.00 0.00 H new ATOM 0 HA SER A 107 5.845 -14.732 -1.489 1.00 0.00 H new ATOM 0 HB2 SER A 107 4.576 -14.679 -3.505 1.00 0.00 H new ATOM 0 HB3 SER A 107 5.805 -13.774 -4.365 1.00 0.00 H new ATOM 0 HG SER A 107 5.811 -16.021 -4.934 1.00 0.00 H new ATOM 1589 N THR A 108 8.490 -13.466 -3.007 1.00 0.00 N ATOM 1590 CA THR A 108 9.941 -13.567 -3.110 1.00 0.00 C ATOM 1591 C THR A 108 10.616 -13.000 -1.865 1.00 0.00 C ATOM 1592 O THR A 108 11.839 -12.870 -1.816 1.00 0.00 O ATOM 1593 CB THR A 108 10.438 -12.831 -4.356 1.00 0.00 C ATOM 1594 OG1 THR A 108 9.379 -12.629 -5.274 1.00 0.00 O ATOM 1595 CG2 THR A 108 11.543 -13.566 -5.082 1.00 0.00 C ATOM 0 H THR A 108 8.086 -12.670 -3.501 1.00 0.00 H new ATOM 0 HA THR A 108 10.202 -14.622 -3.193 1.00 0.00 H new ATOM 0 HB THR A 108 10.832 -11.881 -3.994 1.00 0.00 H new ATOM 0 HG1 THR A 108 9.716 -12.156 -6.063 1.00 0.00 H new ATOM 0 HG21 THR A 108 11.850 -12.991 -5.956 1.00 0.00 H new ATOM 0 HG22 THR A 108 12.395 -13.694 -4.414 1.00 0.00 H new ATOM 0 HG23 THR A 108 11.182 -14.544 -5.400 1.00 0.00 H new ATOM 1603 N GLY A 109 9.811 -12.662 -0.862 1.00 0.00 N ATOM 1604 CA GLY A 109 10.348 -12.113 0.368 1.00 0.00 C ATOM 1605 C GLY A 109 10.882 -10.706 0.192 1.00 0.00 C ATOM 1606 O GLY A 109 11.549 -10.171 1.079 1.00 0.00 O ATOM 0 H GLY A 109 8.796 -12.759 -0.880 1.00 0.00 H new ATOM 0 HA2 GLY A 109 9.569 -12.110 1.131 1.00 0.00 H new ATOM 0 HA3 GLY A 109 11.148 -12.759 0.731 1.00 0.00 H new ATOM 1610 N SER A 110 10.592 -10.104 -0.957 1.00 0.00 N ATOM 1611 CA SER A 110 11.048 -8.750 -1.249 1.00 0.00 C ATOM 1612 C SER A 110 10.174 -7.715 -0.549 1.00 0.00 C ATOM 1613 O SER A 110 9.153 -7.287 -1.088 1.00 0.00 O ATOM 1614 CB SER A 110 11.041 -8.501 -2.757 1.00 0.00 C ATOM 1615 OG SER A 110 9.748 -8.698 -3.301 1.00 0.00 O ATOM 0 H SER A 110 10.043 -10.533 -1.702 1.00 0.00 H new ATOM 0 HA SER A 110 12.067 -8.651 -0.874 1.00 0.00 H new ATOM 0 HB2 SER A 110 11.374 -7.484 -2.962 1.00 0.00 H new ATOM 0 HB3 SER A 110 11.749 -9.172 -3.243 1.00 0.00 H new ATOM 0 HG SER A 110 9.079 -8.621 -2.590 1.00 0.00 H new ATOM 1621 N LEU A 111 10.582 -7.314 0.652 1.00 0.00 N ATOM 1622 CA LEU A 111 9.836 -6.324 1.421 1.00 0.00 C ATOM 1623 C LEU A 111 9.235 -5.270 0.498 1.00 0.00 C ATOM 1624 O LEU A 111 9.822 -4.923 -0.527 1.00 0.00 O ATOM 1625 CB LEU A 111 10.750 -5.653 2.450 1.00 0.00 C ATOM 1626 CG LEU A 111 10.312 -5.809 3.907 1.00 0.00 C ATOM 1627 CD1 LEU A 111 11.459 -6.339 4.754 1.00 0.00 C ATOM 1628 CD2 LEU A 111 9.806 -4.485 4.457 1.00 0.00 C ATOM 0 H LEU A 111 11.424 -7.659 1.113 1.00 0.00 H new ATOM 0 HA LEU A 111 9.027 -6.835 1.943 1.00 0.00 H new ATOM 0 HB2 LEU A 111 11.754 -6.063 2.343 1.00 0.00 H new ATOM 0 HB3 LEU A 111 10.813 -4.590 2.218 1.00 0.00 H new ATOM 0 HG LEU A 111 9.495 -6.530 3.946 1.00 0.00 H new ATOM 0 HD11 LEU A 111 11.130 -6.444 5.788 1.00 0.00 H new ATOM 0 HD12 LEU A 111 11.774 -7.311 4.373 1.00 0.00 H new ATOM 0 HD13 LEU A 111 12.297 -5.643 4.709 1.00 0.00 H new ATOM 0 HD21 LEU A 111 9.499 -4.616 5.495 1.00 0.00 H new ATOM 0 HD22 LEU A 111 10.601 -3.742 4.405 1.00 0.00 H new ATOM 0 HD23 LEU A 111 8.954 -4.147 3.866 1.00 0.00 H new ATOM 1640 N PRO A 112 8.053 -4.742 0.850 1.00 0.00 N ATOM 1641 CA PRO A 112 7.380 -3.722 0.047 1.00 0.00 C ATOM 1642 C PRO A 112 8.347 -2.655 -0.453 1.00 0.00 C ATOM 1643 O PRO A 112 8.133 -2.053 -1.505 1.00 0.00 O ATOM 1644 CB PRO A 112 6.371 -3.130 1.026 1.00 0.00 C ATOM 1645 CG PRO A 112 6.030 -4.263 1.932 1.00 0.00 C ATOM 1646 CD PRO A 112 7.284 -5.092 2.058 1.00 0.00 C ATOM 0 HA PRO A 112 6.927 -4.131 -0.856 1.00 0.00 H new ATOM 0 HB2 PRO A 112 6.797 -2.293 1.579 1.00 0.00 H new ATOM 0 HB3 PRO A 112 5.488 -2.754 0.509 1.00 0.00 H new ATOM 0 HG2 PRO A 112 5.705 -3.898 2.906 1.00 0.00 H new ATOM 0 HG3 PRO A 112 5.211 -4.855 1.524 1.00 0.00 H new ATOM 0 HD2 PRO A 112 7.834 -4.851 2.968 1.00 0.00 H new ATOM 0 HD3 PRO A 112 7.058 -6.158 2.095 1.00 0.00 H new ATOM 1654 N ILE A 113 9.415 -2.431 0.307 1.00 0.00 N ATOM 1655 CA ILE A 113 10.420 -1.442 -0.063 1.00 0.00 C ATOM 1656 C ILE A 113 11.273 -1.942 -1.224 1.00 0.00 C ATOM 1657 O ILE A 113 11.686 -1.164 -2.084 1.00 0.00 O ATOM 1658 CB ILE A 113 11.337 -1.095 1.126 1.00 0.00 C ATOM 1659 CG1 ILE A 113 12.537 -0.274 0.649 1.00 0.00 C ATOM 1660 CG2 ILE A 113 11.800 -2.362 1.829 1.00 0.00 C ATOM 1661 CD1 ILE A 113 12.150 0.962 -0.133 1.00 0.00 C ATOM 0 H ILE A 113 9.606 -2.921 1.181 1.00 0.00 H new ATOM 0 HA ILE A 113 9.885 -0.543 -0.367 1.00 0.00 H new ATOM 0 HB ILE A 113 10.770 -0.496 1.839 1.00 0.00 H new ATOM 0 HG12 ILE A 113 13.130 0.024 1.514 1.00 0.00 H new ATOM 0 HG13 ILE A 113 13.174 -0.903 0.027 1.00 0.00 H new ATOM 0 HG21 ILE A 113 12.447 -2.098 2.666 1.00 0.00 H new ATOM 0 HG22 ILE A 113 10.934 -2.910 2.199 1.00 0.00 H new ATOM 0 HG23 ILE A 113 12.352 -2.987 1.127 1.00 0.00 H new ATOM 0 HD11 ILE A 113 13.050 1.495 -0.439 1.00 0.00 H new ATOM 0 HD12 ILE A 113 11.582 0.671 -1.017 1.00 0.00 H new ATOM 0 HD13 ILE A 113 11.538 1.612 0.493 1.00 0.00 H new ATOM 1673 N HIS A 114 11.534 -3.246 -1.242 1.00 0.00 N ATOM 1674 CA HIS A 114 12.337 -3.849 -2.298 1.00 0.00 C ATOM 1675 C HIS A 114 11.721 -3.580 -3.666 1.00 0.00 C ATOM 1676 O HIS A 114 12.422 -3.237 -4.618 1.00 0.00 O ATOM 1677 CB HIS A 114 12.469 -5.356 -2.070 1.00 0.00 C ATOM 1678 CG HIS A 114 13.460 -5.715 -1.007 1.00 0.00 C ATOM 1679 ND1 HIS A 114 13.158 -5.585 0.326 1.00 0.00 N ATOM 1680 CD2 HIS A 114 14.724 -6.189 -1.130 1.00 0.00 C ATOM 1681 CE1 HIS A 114 14.235 -5.978 0.982 1.00 0.00 C ATOM 1682 NE2 HIS A 114 15.211 -6.354 0.141 1.00 0.00 N ATOM 0 H HIS A 114 11.201 -3.904 -0.537 1.00 0.00 H new ATOM 0 HA HIS A 114 13.329 -3.398 -2.271 1.00 0.00 H new ATOM 0 HB2 HIS A 114 11.494 -5.761 -1.798 1.00 0.00 H new ATOM 0 HB3 HIS A 114 12.763 -5.833 -3.005 1.00 0.00 H new ATOM 0 HD2 HIS A 114 15.247 -6.397 -2.052 1.00 0.00 H new ATOM 0 HE1 HIS A 114 14.319 -5.995 2.059 1.00 0.00 H new ATOM 0 HE2 HIS A 114 16.137 -6.697 0.398 1.00 0.00 H new ATOM 1690 N LEU A 115 10.403 -3.732 -3.755 1.00 0.00 N ATOM 1691 CA LEU A 115 9.692 -3.497 -5.007 1.00 0.00 C ATOM 1692 C LEU A 115 9.916 -2.069 -5.487 1.00 0.00 C ATOM 1693 O LEU A 115 10.149 -1.831 -6.671 1.00 0.00 O ATOM 1694 CB LEU A 115 8.196 -3.766 -4.831 1.00 0.00 C ATOM 1695 CG LEU A 115 7.846 -4.831 -3.788 1.00 0.00 C ATOM 1696 CD1 LEU A 115 6.360 -5.152 -3.831 1.00 0.00 C ATOM 1697 CD2 LEU A 115 8.671 -6.089 -4.013 1.00 0.00 C ATOM 0 H LEU A 115 9.807 -4.016 -2.977 1.00 0.00 H new ATOM 0 HA LEU A 115 10.084 -4.183 -5.758 1.00 0.00 H new ATOM 0 HB2 LEU A 115 7.705 -2.833 -4.554 1.00 0.00 H new ATOM 0 HB3 LEU A 115 7.782 -4.071 -5.792 1.00 0.00 H new ATOM 0 HG LEU A 115 8.084 -4.436 -2.800 1.00 0.00 H new ATOM 0 HD11 LEU A 115 6.130 -5.911 -3.083 1.00 0.00 H new ATOM 0 HD12 LEU A 115 5.787 -4.249 -3.621 1.00 0.00 H new ATOM 0 HD13 LEU A 115 6.097 -5.526 -4.820 1.00 0.00 H new ATOM 0 HD21 LEU A 115 8.409 -6.835 -3.263 1.00 0.00 H new ATOM 0 HD22 LEU A 115 8.465 -6.486 -5.007 1.00 0.00 H new ATOM 0 HD23 LEU A 115 9.731 -5.849 -3.931 1.00 0.00 H new ATOM 1709 N ALA A 116 9.850 -1.121 -4.558 1.00 0.00 N ATOM 1710 CA ALA A 116 10.055 0.281 -4.888 1.00 0.00 C ATOM 1711 C ALA A 116 11.388 0.474 -5.599 1.00 0.00 C ATOM 1712 O ALA A 116 11.459 1.117 -6.646 1.00 0.00 O ATOM 1713 CB ALA A 116 9.993 1.136 -3.630 1.00 0.00 C ATOM 0 H ALA A 116 9.656 -1.300 -3.573 1.00 0.00 H new ATOM 0 HA ALA A 116 9.258 0.597 -5.561 1.00 0.00 H new ATOM 0 HB1 ALA A 116 10.148 2.182 -3.893 1.00 0.00 H new ATOM 0 HB2 ALA A 116 9.016 1.021 -3.160 1.00 0.00 H new ATOM 0 HB3 ALA A 116 10.770 0.818 -2.935 1.00 0.00 H new ATOM 1719 N ILE A 117 12.443 -0.096 -5.024 1.00 0.00 N ATOM 1720 CA ILE A 117 13.775 0.003 -5.605 1.00 0.00 C ATOM 1721 C ILE A 117 13.779 -0.513 -7.038 1.00 0.00 C ATOM 1722 O ILE A 117 14.410 0.072 -7.917 1.00 0.00 O ATOM 1723 CB ILE A 117 14.808 -0.789 -4.781 1.00 0.00 C ATOM 1724 CG1 ILE A 117 14.978 -0.164 -3.396 1.00 0.00 C ATOM 1725 CG2 ILE A 117 16.141 -0.842 -5.513 1.00 0.00 C ATOM 1726 CD1 ILE A 117 15.726 -1.048 -2.422 1.00 0.00 C ATOM 0 H ILE A 117 12.400 -0.631 -4.157 1.00 0.00 H new ATOM 0 HA ILE A 117 14.051 1.057 -5.597 1.00 0.00 H new ATOM 0 HB ILE A 117 14.444 -1.809 -4.655 1.00 0.00 H new ATOM 0 HG12 ILE A 117 15.509 0.783 -3.496 1.00 0.00 H new ATOM 0 HG13 ILE A 117 13.994 0.064 -2.986 1.00 0.00 H new ATOM 0 HG21 ILE A 117 16.861 -1.405 -4.918 1.00 0.00 H new ATOM 0 HG22 ILE A 117 16.007 -1.330 -6.478 1.00 0.00 H new ATOM 0 HG23 ILE A 117 16.512 0.171 -5.668 1.00 0.00 H new ATOM 0 HD11 ILE A 117 15.809 -0.541 -1.461 1.00 0.00 H new ATOM 0 HD12 ILE A 117 15.185 -1.985 -2.292 1.00 0.00 H new ATOM 0 HD13 ILE A 117 16.723 -1.255 -2.811 1.00 0.00 H new ATOM 1738 N ARG A 118 13.064 -1.611 -7.268 1.00 0.00 N ATOM 1739 CA ARG A 118 12.982 -2.201 -8.598 1.00 0.00 C ATOM 1740 C ARG A 118 12.332 -1.227 -9.574 1.00 0.00 C ATOM 1741 O ARG A 118 12.511 -1.335 -10.788 1.00 0.00 O ATOM 1742 CB ARG A 118 12.185 -3.506 -8.557 1.00 0.00 C ATOM 1743 CG ARG A 118 12.594 -4.433 -7.424 1.00 0.00 C ATOM 1744 CD ARG A 118 13.116 -5.761 -7.948 1.00 0.00 C ATOM 1745 NE ARG A 118 13.639 -6.605 -6.877 1.00 0.00 N ATOM 1746 CZ ARG A 118 12.888 -7.431 -6.158 1.00 0.00 C ATOM 1747 NH1 ARG A 118 11.587 -7.525 -6.399 1.00 0.00 N ATOM 1748 NH2 ARG A 118 13.436 -8.165 -5.199 1.00 0.00 N ATOM 0 H ARG A 118 12.535 -2.108 -6.552 1.00 0.00 H new ATOM 0 HA ARG A 118 13.995 -2.418 -8.938 1.00 0.00 H new ATOM 0 HB2 ARG A 118 11.125 -3.272 -8.459 1.00 0.00 H new ATOM 0 HB3 ARG A 118 12.310 -4.028 -9.506 1.00 0.00 H new ATOM 0 HG2 ARG A 118 13.363 -3.952 -6.819 1.00 0.00 H new ATOM 0 HG3 ARG A 118 11.739 -4.610 -6.771 1.00 0.00 H new ATOM 0 HD2 ARG A 118 12.314 -6.287 -8.465 1.00 0.00 H new ATOM 0 HD3 ARG A 118 13.901 -5.578 -8.681 1.00 0.00 H new ATOM 0 HE ARG A 118 14.637 -6.557 -6.670 1.00 0.00 H new ATOM 0 HH11 ARG A 118 11.163 -6.963 -7.137 1.00 0.00 H new ATOM 0 HH12 ARG A 118 11.011 -8.160 -5.846 1.00 0.00 H new ATOM 0 HH21 ARG A 118 14.436 -8.096 -5.012 1.00 0.00 H new ATOM 0 HH22 ARG A 118 12.857 -8.799 -4.648 1.00 0.00 H new ATOM 1762 N GLU A 119 11.581 -0.274 -9.033 1.00 0.00 N ATOM 1763 CA GLU A 119 10.905 0.724 -9.851 1.00 0.00 C ATOM 1764 C GLU A 119 11.794 1.945 -10.056 1.00 0.00 C ATOM 1765 O GLU A 119 12.058 2.350 -11.189 1.00 0.00 O ATOM 1766 CB GLU A 119 9.587 1.141 -9.198 1.00 0.00 C ATOM 1767 CG GLU A 119 8.602 -0.005 -9.029 1.00 0.00 C ATOM 1768 CD GLU A 119 7.925 -0.390 -10.329 1.00 0.00 C ATOM 1769 OE1 GLU A 119 7.068 0.385 -10.804 1.00 0.00 O ATOM 1770 OE2 GLU A 119 8.250 -1.466 -10.873 1.00 0.00 O ATOM 0 H GLU A 119 11.425 -0.172 -8.030 1.00 0.00 H new ATOM 0 HA GLU A 119 10.694 0.281 -10.824 1.00 0.00 H new ATOM 0 HB2 GLU A 119 9.797 1.576 -8.221 1.00 0.00 H new ATOM 0 HB3 GLU A 119 9.123 1.922 -9.801 1.00 0.00 H new ATOM 0 HG2 GLU A 119 9.125 -0.872 -8.626 1.00 0.00 H new ATOM 0 HG3 GLU A 119 7.844 0.278 -8.299 1.00 0.00 H new ATOM 1777 N GLY A 120 12.256 2.528 -8.954 1.00 0.00 N ATOM 1778 CA GLY A 120 13.112 3.697 -9.038 1.00 0.00 C ATOM 1779 C GLY A 120 12.477 4.926 -8.423 1.00 0.00 C ATOM 1780 O GLY A 120 13.117 5.970 -8.302 1.00 0.00 O ATOM 0 H GLY A 120 12.053 2.212 -8.006 1.00 0.00 H new ATOM 0 HA2 GLY A 120 14.056 3.489 -8.534 1.00 0.00 H new ATOM 0 HA3 GLY A 120 13.346 3.898 -10.084 1.00 0.00 H new ATOM 1784 N HIS A 121 11.213 4.801 -8.032 1.00 0.00 N ATOM 1785 CA HIS A 121 10.487 5.908 -7.424 1.00 0.00 C ATOM 1786 C HIS A 121 11.284 6.513 -6.273 1.00 0.00 C ATOM 1787 O HIS A 121 11.088 6.153 -5.112 1.00 0.00 O ATOM 1788 CB HIS A 121 9.125 5.430 -6.922 1.00 0.00 C ATOM 1789 CG HIS A 121 8.236 4.907 -8.008 1.00 0.00 C ATOM 1790 ND1 HIS A 121 7.950 3.626 -8.344 1.00 0.00 N flip ATOM 1791 CD2 HIS A 121 7.559 5.756 -8.850 1.00 0.00 C flip ATOM 1792 CE1 HIS A 121 7.084 3.681 -9.406 1.00 0.00 C flip ATOM 1793 NE2 HIS A 121 6.880 4.979 -9.675 1.00 0.00 N flip ATOM 0 H HIS A 121 10.670 3.942 -8.126 1.00 0.00 H new ATOM 0 HA HIS A 121 10.339 6.677 -8.182 1.00 0.00 H new ATOM 0 HB2 HIS A 121 9.275 4.647 -6.178 1.00 0.00 H new ATOM 0 HB3 HIS A 121 8.622 6.256 -6.418 1.00 0.00 H new ATOM 0 HD2 HIS A 121 7.578 6.836 -8.840 1.00 0.00 H new ATOM 0 HE1 HIS A 121 6.650 2.840 -9.926 1.00 0.00 H new ATOM 0 HE2 HIS A 121 6.277 5.323 -10.422 1.00 0.00 H new ATOM 1801 N SER A 122 12.183 7.434 -6.601 1.00 0.00 N ATOM 1802 CA SER A 122 13.013 8.088 -5.596 1.00 0.00 C ATOM 1803 C SER A 122 12.214 8.375 -4.329 1.00 0.00 C ATOM 1804 O SER A 122 12.727 8.242 -3.218 1.00 0.00 O ATOM 1805 CB SER A 122 13.594 9.390 -6.151 1.00 0.00 C ATOM 1806 OG SER A 122 12.585 10.189 -6.742 1.00 0.00 O ATOM 0 H SER A 122 12.356 7.745 -7.557 1.00 0.00 H new ATOM 0 HA SER A 122 13.830 7.412 -5.343 1.00 0.00 H new ATOM 0 HB2 SER A 122 14.079 9.946 -5.349 1.00 0.00 H new ATOM 0 HB3 SER A 122 14.362 9.163 -6.891 1.00 0.00 H new ATOM 0 HG SER A 122 12.983 11.016 -7.087 1.00 0.00 H new ATOM 1812 N SER A 123 10.958 8.771 -4.503 1.00 0.00 N ATOM 1813 CA SER A 123 10.090 9.081 -3.372 1.00 0.00 C ATOM 1814 C SER A 123 9.656 7.810 -2.649 1.00 0.00 C ATOM 1815 O SER A 123 9.988 7.604 -1.482 1.00 0.00 O ATOM 1816 CB SER A 123 8.861 9.860 -3.844 1.00 0.00 C ATOM 1817 OG SER A 123 7.785 8.986 -4.138 1.00 0.00 O ATOM 0 H SER A 123 10.518 8.885 -5.416 1.00 0.00 H new ATOM 0 HA SER A 123 10.656 9.697 -2.672 1.00 0.00 H new ATOM 0 HB2 SER A 123 8.558 10.569 -3.073 1.00 0.00 H new ATOM 0 HB3 SER A 123 9.114 10.442 -4.730 1.00 0.00 H new ATOM 0 HG SER A 123 7.810 8.744 -5.087 1.00 0.00 H new ATOM 1823 N VAL A 124 8.909 6.961 -3.348 1.00 0.00 N ATOM 1824 CA VAL A 124 8.425 5.711 -2.771 1.00 0.00 C ATOM 1825 C VAL A 124 9.575 4.867 -2.229 1.00 0.00 C ATOM 1826 O VAL A 124 9.593 4.511 -1.050 1.00 0.00 O ATOM 1827 CB VAL A 124 7.632 4.888 -3.805 1.00 0.00 C ATOM 1828 CG1 VAL A 124 7.425 3.462 -3.317 1.00 0.00 C ATOM 1829 CG2 VAL A 124 6.299 5.555 -4.107 1.00 0.00 C ATOM 0 H VAL A 124 8.625 7.116 -4.315 1.00 0.00 H new ATOM 0 HA VAL A 124 7.764 5.978 -1.947 1.00 0.00 H new ATOM 0 HB VAL A 124 8.211 4.847 -4.727 1.00 0.00 H new ATOM 0 HG11 VAL A 124 6.863 2.900 -4.063 1.00 0.00 H new ATOM 0 HG12 VAL A 124 8.393 2.987 -3.159 1.00 0.00 H new ATOM 0 HG13 VAL A 124 6.870 3.475 -2.379 1.00 0.00 H new ATOM 0 HG21 VAL A 124 5.752 4.960 -4.839 1.00 0.00 H new ATOM 0 HG22 VAL A 124 5.714 5.630 -3.190 1.00 0.00 H new ATOM 0 HG23 VAL A 124 6.474 6.553 -4.508 1.00 0.00 H new ATOM 1839 N VAL A 125 10.533 4.543 -3.093 1.00 0.00 N ATOM 1840 CA VAL A 125 11.678 3.735 -2.691 1.00 0.00 C ATOM 1841 C VAL A 125 12.352 4.314 -1.450 1.00 0.00 C ATOM 1842 O VAL A 125 12.540 3.617 -0.454 1.00 0.00 O ATOM 1843 CB VAL A 125 12.718 3.632 -3.821 1.00 0.00 C ATOM 1844 CG1 VAL A 125 13.685 2.490 -3.555 1.00 0.00 C ATOM 1845 CG2 VAL A 125 12.033 3.458 -5.168 1.00 0.00 C ATOM 0 H VAL A 125 10.539 4.827 -4.073 1.00 0.00 H new ATOM 0 HA VAL A 125 11.297 2.739 -2.465 1.00 0.00 H new ATOM 0 HB VAL A 125 13.288 4.561 -3.849 1.00 0.00 H new ATOM 0 HG11 VAL A 125 14.413 2.433 -4.365 1.00 0.00 H new ATOM 0 HG12 VAL A 125 14.204 2.665 -2.613 1.00 0.00 H new ATOM 0 HG13 VAL A 125 13.133 1.552 -3.497 1.00 0.00 H new ATOM 0 HG21 VAL A 125 12.786 3.387 -5.953 1.00 0.00 H new ATOM 0 HG22 VAL A 125 11.434 2.547 -5.157 1.00 0.00 H new ATOM 0 HG23 VAL A 125 11.387 4.315 -5.361 1.00 0.00 H new ATOM 1855 N SER A 126 12.718 5.590 -1.518 1.00 0.00 N ATOM 1856 CA SER A 126 13.374 6.257 -0.401 1.00 0.00 C ATOM 1857 C SER A 126 12.455 6.327 0.813 1.00 0.00 C ATOM 1858 O SER A 126 12.912 6.295 1.956 1.00 0.00 O ATOM 1859 CB SER A 126 13.816 7.664 -0.803 1.00 0.00 C ATOM 1860 OG SER A 126 14.422 8.341 0.285 1.00 0.00 O ATOM 0 H SER A 126 12.571 6.182 -2.335 1.00 0.00 H new ATOM 0 HA SER A 126 14.253 5.672 -0.133 1.00 0.00 H new ATOM 0 HB2 SER A 126 14.519 7.604 -1.634 1.00 0.00 H new ATOM 0 HB3 SER A 126 12.955 8.232 -1.154 1.00 0.00 H new ATOM 0 HG SER A 126 14.711 9.232 -0.004 1.00 0.00 H new ATOM 1866 N PHE A 127 11.159 6.425 0.553 1.00 0.00 N ATOM 1867 CA PHE A 127 10.169 6.503 1.621 1.00 0.00 C ATOM 1868 C PHE A 127 9.997 5.152 2.306 1.00 0.00 C ATOM 1869 O PHE A 127 9.999 5.063 3.534 1.00 0.00 O ATOM 1870 CB PHE A 127 8.824 6.980 1.069 1.00 0.00 C ATOM 1871 CG PHE A 127 7.725 6.969 2.092 1.00 0.00 C ATOM 1872 CD1 PHE A 127 7.523 8.062 2.927 1.00 0.00 C ATOM 1873 CD2 PHE A 127 6.893 5.862 2.221 1.00 0.00 C ATOM 1874 CE1 PHE A 127 6.510 8.051 3.873 1.00 0.00 C ATOM 1875 CE2 PHE A 127 5.878 5.847 3.166 1.00 0.00 C ATOM 1876 CZ PHE A 127 5.687 6.942 3.993 1.00 0.00 C ATOM 0 H PHE A 127 10.767 6.452 -0.388 1.00 0.00 H new ATOM 0 HA PHE A 127 10.527 7.222 2.358 1.00 0.00 H new ATOM 0 HB2 PHE A 127 8.937 7.991 0.678 1.00 0.00 H new ATOM 0 HB3 PHE A 127 8.537 6.345 0.231 1.00 0.00 H new ATOM 0 HD1 PHE A 127 8.162 8.928 2.838 1.00 0.00 H new ATOM 0 HD2 PHE A 127 7.039 5.006 1.579 1.00 0.00 H new ATOM 0 HE1 PHE A 127 6.362 8.906 4.516 1.00 0.00 H new ATOM 0 HE2 PHE A 127 5.237 4.983 3.257 1.00 0.00 H new ATOM 0 HZ PHE A 127 4.898 6.932 4.730 1.00 0.00 H new ATOM 1886 N LEU A 128 9.846 4.102 1.505 1.00 0.00 N ATOM 1887 CA LEU A 128 9.672 2.757 2.038 1.00 0.00 C ATOM 1888 C LEU A 128 10.946 2.269 2.721 1.00 0.00 C ATOM 1889 O LEU A 128 10.951 1.227 3.375 1.00 0.00 O ATOM 1890 CB LEU A 128 9.273 1.791 0.921 1.00 0.00 C ATOM 1891 CG LEU A 128 7.830 1.291 0.984 1.00 0.00 C ATOM 1892 CD1 LEU A 128 7.101 1.602 -0.314 1.00 0.00 C ATOM 1893 CD2 LEU A 128 7.796 -0.202 1.272 1.00 0.00 C ATOM 0 H LEU A 128 9.841 4.157 0.487 1.00 0.00 H new ATOM 0 HA LEU A 128 8.876 2.790 2.782 1.00 0.00 H new ATOM 0 HB2 LEU A 128 9.429 2.284 -0.038 1.00 0.00 H new ATOM 0 HB3 LEU A 128 9.941 0.930 0.949 1.00 0.00 H new ATOM 0 HG LEU A 128 7.321 1.809 1.796 1.00 0.00 H new ATOM 0 HD11 LEU A 128 6.075 1.239 -0.251 1.00 0.00 H new ATOM 0 HD12 LEU A 128 7.095 2.679 -0.479 1.00 0.00 H new ATOM 0 HD13 LEU A 128 7.610 1.111 -1.144 1.00 0.00 H new ATOM 0 HD21 LEU A 128 6.761 -0.541 1.313 1.00 0.00 H new ATOM 0 HD22 LEU A 128 8.322 -0.737 0.481 1.00 0.00 H new ATOM 0 HD23 LEU A 128 8.281 -0.399 2.228 1.00 0.00 H new ATOM 1905 N ALA A 129 12.026 3.029 2.565 1.00 0.00 N ATOM 1906 CA ALA A 129 13.304 2.671 3.169 1.00 0.00 C ATOM 1907 C ALA A 129 13.229 2.738 4.689 1.00 0.00 C ATOM 1908 O ALA A 129 13.373 1.727 5.375 1.00 0.00 O ATOM 1909 CB ALA A 129 14.407 3.582 2.652 1.00 0.00 C ATOM 0 H ALA A 129 12.041 3.895 2.026 1.00 0.00 H new ATOM 0 HA ALA A 129 13.536 1.644 2.887 1.00 0.00 H new ATOM 0 HB1 ALA A 129 15.355 3.303 3.112 1.00 0.00 H new ATOM 0 HB2 ALA A 129 14.485 3.481 1.570 1.00 0.00 H new ATOM 0 HB3 ALA A 129 14.173 4.616 2.904 1.00 0.00 H new ATOM 1915 N PRO A 130 13.000 3.942 5.234 1.00 0.00 N ATOM 1916 CA PRO A 130 12.903 4.152 6.682 1.00 0.00 C ATOM 1917 C PRO A 130 11.662 3.496 7.280 1.00 0.00 C ATOM 1918 O PRO A 130 11.738 2.824 8.309 1.00 0.00 O ATOM 1919 CB PRO A 130 12.820 5.674 6.818 1.00 0.00 C ATOM 1920 CG PRO A 130 12.279 6.142 5.512 1.00 0.00 C ATOM 1921 CD PRO A 130 12.817 5.193 4.479 1.00 0.00 C ATOM 0 HA PRO A 130 13.745 3.709 7.214 1.00 0.00 H new ATOM 0 HB2 PRO A 130 12.168 5.963 7.643 1.00 0.00 H new ATOM 0 HB3 PRO A 130 13.800 6.108 7.019 1.00 0.00 H new ATOM 0 HG2 PRO A 130 11.189 6.137 5.517 1.00 0.00 H new ATOM 0 HG3 PRO A 130 12.592 7.165 5.303 1.00 0.00 H new ATOM 0 HD2 PRO A 130 12.122 5.065 3.649 1.00 0.00 H new ATOM 0 HD3 PRO A 130 13.756 5.549 4.056 1.00 0.00 H new ATOM 1929 N GLU A 131 10.521 3.695 6.628 1.00 0.00 N ATOM 1930 CA GLU A 131 9.263 3.123 7.094 1.00 0.00 C ATOM 1931 C GLU A 131 9.407 1.624 7.341 1.00 0.00 C ATOM 1932 O GLU A 131 8.985 1.112 8.379 1.00 0.00 O ATOM 1933 CB GLU A 131 8.152 3.379 6.074 1.00 0.00 C ATOM 1934 CG GLU A 131 7.802 4.850 5.913 1.00 0.00 C ATOM 1935 CD GLU A 131 7.424 5.507 7.226 1.00 0.00 C ATOM 1936 OE1 GLU A 131 8.301 5.615 8.108 1.00 0.00 O ATOM 1937 OE2 GLU A 131 6.253 5.915 7.370 1.00 0.00 O ATOM 0 H GLU A 131 10.442 4.248 5.775 1.00 0.00 H new ATOM 0 HA GLU A 131 9.000 3.606 8.035 1.00 0.00 H new ATOM 0 HB2 GLU A 131 8.458 2.979 5.107 1.00 0.00 H new ATOM 0 HB3 GLU A 131 7.259 2.832 6.377 1.00 0.00 H new ATOM 0 HG2 GLU A 131 8.652 5.376 5.479 1.00 0.00 H new ATOM 0 HG3 GLU A 131 6.974 4.948 5.211 1.00 0.00 H new ATOM 1944 N SER A 132 10.007 0.926 6.382 1.00 0.00 N ATOM 1945 CA SER A 132 10.207 -0.514 6.495 1.00 0.00 C ATOM 1946 C SER A 132 11.378 -0.830 7.421 1.00 0.00 C ATOM 1947 O SER A 132 12.454 -0.245 7.299 1.00 0.00 O ATOM 1948 CB SER A 132 10.455 -1.126 5.116 1.00 0.00 C ATOM 1949 OG SER A 132 9.259 -1.184 4.360 1.00 0.00 O ATOM 0 H SER A 132 10.363 1.335 5.518 1.00 0.00 H new ATOM 0 HA SER A 132 9.302 -0.948 6.920 1.00 0.00 H new ATOM 0 HB2 SER A 132 11.198 -0.535 4.581 1.00 0.00 H new ATOM 0 HB3 SER A 132 10.866 -2.129 5.229 1.00 0.00 H new ATOM 0 HG SER A 132 8.652 -1.842 4.758 1.00 0.00 H new ATOM 1955 N ASP A 133 11.159 -1.759 8.347 1.00 0.00 N ATOM 1956 CA ASP A 133 12.196 -2.154 9.295 1.00 0.00 C ATOM 1957 C ASP A 133 13.570 -2.142 8.631 1.00 0.00 C ATOM 1958 O ASP A 133 13.961 -3.106 7.974 1.00 0.00 O ATOM 1959 CB ASP A 133 11.900 -3.545 9.855 1.00 0.00 C ATOM 1960 CG ASP A 133 11.247 -3.491 11.222 1.00 0.00 C ATOM 1961 OD1 ASP A 133 11.747 -2.744 12.090 1.00 0.00 O ATOM 1962 OD2 ASP A 133 10.237 -4.197 11.425 1.00 0.00 O ATOM 0 H ASP A 133 10.273 -2.252 8.461 1.00 0.00 H new ATOM 0 HA ASP A 133 12.200 -1.434 10.114 1.00 0.00 H new ATOM 0 HB2 ASP A 133 11.248 -4.080 9.165 1.00 0.00 H new ATOM 0 HB3 ASP A 133 12.828 -4.112 9.921 1.00 0.00 H new ATOM 1967 N LEU A 134 14.297 -1.044 8.805 1.00 0.00 N ATOM 1968 CA LEU A 134 15.623 -0.905 8.224 1.00 0.00 C ATOM 1969 C LEU A 134 16.537 -2.046 8.659 1.00 0.00 C ATOM 1970 O LEU A 134 16.424 -2.552 9.776 1.00 0.00 O ATOM 1971 CB LEU A 134 16.229 0.439 8.628 1.00 0.00 C ATOM 1972 CG LEU A 134 15.933 1.602 7.676 1.00 0.00 C ATOM 1973 CD1 LEU A 134 16.888 2.758 7.935 1.00 0.00 C ATOM 1974 CD2 LEU A 134 16.022 1.148 6.227 1.00 0.00 C ATOM 0 H LEU A 134 13.987 -0.236 9.346 1.00 0.00 H new ATOM 0 HA LEU A 134 15.527 -0.946 7.139 1.00 0.00 H new ATOM 0 HB2 LEU A 134 15.862 0.701 9.620 1.00 0.00 H new ATOM 0 HB3 LEU A 134 17.310 0.322 8.708 1.00 0.00 H new ATOM 0 HG LEU A 134 14.916 1.947 7.862 1.00 0.00 H new ATOM 0 HD11 LEU A 134 16.664 3.576 7.250 1.00 0.00 H new ATOM 0 HD12 LEU A 134 16.772 3.103 8.962 1.00 0.00 H new ATOM 0 HD13 LEU A 134 17.914 2.425 7.778 1.00 0.00 H new ATOM 0 HD21 LEU A 134 15.808 1.990 5.568 1.00 0.00 H new ATOM 0 HD22 LEU A 134 17.025 0.774 6.024 1.00 0.00 H new ATOM 0 HD23 LEU A 134 15.296 0.355 6.049 1.00 0.00 H new ATOM 1986 N HIS A 135 17.443 -2.443 7.768 1.00 0.00 N ATOM 1987 CA HIS A 135 18.383 -3.524 8.050 1.00 0.00 C ATOM 1988 C HIS A 135 17.782 -4.879 7.685 1.00 0.00 C ATOM 1989 O HIS A 135 18.506 -5.854 7.478 1.00 0.00 O ATOM 1990 CB HIS A 135 18.787 -3.512 9.526 1.00 0.00 C ATOM 1991 CG HIS A 135 20.022 -4.307 9.818 1.00 0.00 C ATOM 1992 ND1 HIS A 135 20.136 -5.061 10.961 1.00 0.00 N ATOM 1993 CD2 HIS A 135 21.162 -4.430 9.092 1.00 0.00 C ATOM 1994 CE1 HIS A 135 21.330 -5.624 10.908 1.00 0.00 C ATOM 1995 NE2 HIS A 135 21.989 -5.270 9.793 1.00 0.00 N ATOM 0 H HIS A 135 17.546 -2.030 6.841 1.00 0.00 H new ATOM 0 HA HIS A 135 19.271 -3.364 7.439 1.00 0.00 H new ATOM 0 HB2 HIS A 135 18.946 -2.481 9.842 1.00 0.00 H new ATOM 0 HB3 HIS A 135 17.963 -3.905 10.122 1.00 0.00 H new ATOM 0 HD2 HIS A 135 21.377 -3.958 8.145 1.00 0.00 H new ATOM 0 HE1 HIS A 135 21.726 -6.285 11.665 1.00 0.00 H new ATOM 0 HE2 HIS A 135 22.925 -5.569 9.520 1.00 0.00 H new ATOM 2003 N HIS A 136 16.457 -4.934 7.608 1.00 0.00 N ATOM 2004 CA HIS A 136 15.761 -6.169 7.268 1.00 0.00 C ATOM 2005 C HIS A 136 16.461 -6.894 6.122 1.00 0.00 C ATOM 2006 O HIS A 136 17.333 -6.332 5.460 1.00 0.00 O ATOM 2007 CB HIS A 136 14.310 -5.871 6.886 1.00 0.00 C ATOM 2008 CG HIS A 136 14.175 -4.957 5.709 1.00 0.00 C ATOM 2009 ND1 HIS A 136 13.356 -3.855 5.747 1.00 0.00 N ATOM 2010 CD2 HIS A 136 14.773 -5.022 4.494 1.00 0.00 C ATOM 2011 CE1 HIS A 136 13.471 -3.275 4.566 1.00 0.00 C ATOM 2012 NE2 HIS A 136 14.319 -3.947 3.772 1.00 0.00 N ATOM 0 H HIS A 136 15.843 -4.137 7.777 1.00 0.00 H new ATOM 0 HA HIS A 136 15.775 -6.817 8.145 1.00 0.00 H new ATOM 0 HB2 HIS A 136 13.801 -6.810 6.667 1.00 0.00 H new ATOM 0 HB3 HIS A 136 13.802 -5.425 7.741 1.00 0.00 H new ATOM 0 HD1 HIS A 136 12.777 -3.547 6.528 1.00 0.00 H new ATOM 0 HD2 HIS A 136 15.472 -5.774 4.159 1.00 0.00 H new ATOM 0 HE1 HIS A 136 12.949 -2.375 4.276 1.00 0.00 H new ATOM 2020 N ARG A 137 16.071 -8.144 5.895 1.00 0.00 N ATOM 2021 CA ARG A 137 16.659 -8.948 4.830 1.00 0.00 C ATOM 2022 C ARG A 137 15.588 -9.429 3.857 1.00 0.00 C ATOM 2023 O ARG A 137 14.428 -9.025 3.946 1.00 0.00 O ATOM 2024 CB ARG A 137 17.406 -10.147 5.419 1.00 0.00 C ATOM 2025 CG ARG A 137 18.829 -9.827 5.844 1.00 0.00 C ATOM 2026 CD ARG A 137 19.347 -10.827 6.865 1.00 0.00 C ATOM 2027 NE ARG A 137 20.498 -10.309 7.600 1.00 0.00 N ATOM 2028 CZ ARG A 137 20.816 -10.687 8.834 1.00 0.00 C ATOM 2029 NH1 ARG A 137 20.076 -11.586 9.468 1.00 0.00 N ATOM 2030 NH2 ARG A 137 21.876 -10.165 9.435 1.00 0.00 N ATOM 0 H ARG A 137 15.350 -8.622 6.435 1.00 0.00 H new ATOM 0 HA ARG A 137 17.365 -8.322 4.284 1.00 0.00 H new ATOM 0 HB2 ARG A 137 16.854 -10.521 6.281 1.00 0.00 H new ATOM 0 HB3 ARG A 137 17.428 -10.949 4.681 1.00 0.00 H new ATOM 0 HG2 ARG A 137 19.480 -9.829 4.969 1.00 0.00 H new ATOM 0 HG3 ARG A 137 18.866 -8.823 6.266 1.00 0.00 H new ATOM 0 HD2 ARG A 137 18.550 -11.075 7.566 1.00 0.00 H new ATOM 0 HD3 ARG A 137 19.626 -11.751 6.359 1.00 0.00 H new ATOM 0 HE ARG A 137 21.091 -9.618 7.140 1.00 0.00 H new ATOM 0 HH11 ARG A 137 19.260 -11.990 9.009 1.00 0.00 H new ATOM 0 HH12 ARG A 137 20.323 -11.874 10.415 1.00 0.00 H new ATOM 0 HH21 ARG A 137 22.448 -9.473 8.950 1.00 0.00 H new ATOM 0 HH22 ARG A 137 22.120 -10.455 10.382 1.00 0.00 H new ATOM 2044 N ASP A 138 15.982 -10.296 2.930 1.00 0.00 N ATOM 2045 CA ASP A 138 15.056 -10.833 1.941 1.00 0.00 C ATOM 2046 C ASP A 138 15.151 -12.354 1.877 1.00 0.00 C ATOM 2047 O ASP A 138 16.153 -12.940 2.287 1.00 0.00 O ATOM 2048 CB ASP A 138 15.345 -10.236 0.562 1.00 0.00 C ATOM 2049 CG ASP A 138 14.117 -9.605 -0.065 1.00 0.00 C ATOM 2050 OD1 ASP A 138 13.882 -8.401 0.169 1.00 0.00 O ATOM 2051 OD2 ASP A 138 13.389 -10.316 -0.790 1.00 0.00 O ATOM 0 H ASP A 138 16.938 -10.642 2.843 1.00 0.00 H new ATOM 0 HA ASP A 138 14.045 -10.561 2.243 1.00 0.00 H new ATOM 0 HB2 ASP A 138 16.130 -9.485 0.652 1.00 0.00 H new ATOM 0 HB3 ASP A 138 15.725 -11.017 -0.096 1.00 0.00 H new ATOM 2056 N ALA A 139 14.104 -12.987 1.359 1.00 0.00 N ATOM 2057 CA ALA A 139 14.075 -14.440 1.240 1.00 0.00 C ATOM 2058 C ALA A 139 15.151 -14.933 0.279 1.00 0.00 C ATOM 2059 O ALA A 139 15.419 -16.131 0.192 1.00 0.00 O ATOM 2060 CB ALA A 139 12.701 -14.904 0.781 1.00 0.00 C ATOM 0 H ALA A 139 13.266 -12.518 1.016 1.00 0.00 H new ATOM 0 HA ALA A 139 14.280 -14.865 2.222 1.00 0.00 H new ATOM 0 HB1 ALA A 139 12.693 -15.991 0.696 1.00 0.00 H new ATOM 0 HB2 ALA A 139 11.950 -14.591 1.507 1.00 0.00 H new ATOM 0 HB3 ALA A 139 12.473 -14.463 -0.189 1.00 0.00 H new ATOM 2066 N SER A 140 15.765 -13.998 -0.438 1.00 0.00 N ATOM 2067 CA SER A 140 16.813 -14.332 -1.394 1.00 0.00 C ATOM 2068 C SER A 140 18.175 -13.866 -0.889 1.00 0.00 C ATOM 2069 O SER A 140 19.212 -14.403 -1.281 1.00 0.00 O ATOM 2070 CB SER A 140 16.513 -13.695 -2.752 1.00 0.00 C ATOM 2071 OG SER A 140 17.073 -12.396 -2.843 1.00 0.00 O ATOM 0 H SER A 140 15.554 -13.002 -0.375 1.00 0.00 H new ATOM 0 HA SER A 140 16.839 -15.416 -1.507 1.00 0.00 H new ATOM 0 HB2 SER A 140 16.913 -14.323 -3.548 1.00 0.00 H new ATOM 0 HB3 SER A 140 15.435 -13.640 -2.901 1.00 0.00 H new ATOM 0 HG SER A 140 17.598 -12.323 -3.667 1.00 0.00 H new ATOM 2077 N GLY A 141 18.164 -12.865 -0.014 1.00 0.00 N ATOM 2078 CA GLY A 141 19.403 -12.344 0.534 1.00 0.00 C ATOM 2079 C GLY A 141 19.713 -10.942 0.046 1.00 0.00 C ATOM 2080 O GLY A 141 20.877 -10.555 -0.050 1.00 0.00 O ATOM 0 H GLY A 141 17.319 -12.405 0.325 1.00 0.00 H new ATOM 0 HA2 GLY A 141 19.341 -12.341 1.622 1.00 0.00 H new ATOM 0 HA3 GLY A 141 20.223 -13.009 0.263 1.00 0.00 H new ATOM 2084 N LEU A 142 18.669 -10.179 -0.264 1.00 0.00 N ATOM 2085 CA LEU A 142 18.838 -8.813 -0.742 1.00 0.00 C ATOM 2086 C LEU A 142 18.539 -7.808 0.366 1.00 0.00 C ATOM 2087 O LEU A 142 18.217 -8.188 1.492 1.00 0.00 O ATOM 2088 CB LEU A 142 17.926 -8.552 -1.943 1.00 0.00 C ATOM 2089 CG LEU A 142 18.295 -9.314 -3.218 1.00 0.00 C ATOM 2090 CD1 LEU A 142 17.441 -8.842 -4.386 1.00 0.00 C ATOM 2091 CD2 LEU A 142 19.774 -9.146 -3.534 1.00 0.00 C ATOM 0 H LEU A 142 17.698 -10.484 -0.192 1.00 0.00 H new ATOM 0 HA LEU A 142 19.876 -8.689 -1.050 1.00 0.00 H new ATOM 0 HB2 LEU A 142 16.904 -8.812 -1.666 1.00 0.00 H new ATOM 0 HB3 LEU A 142 17.936 -7.484 -2.161 1.00 0.00 H new ATOM 0 HG LEU A 142 18.099 -10.374 -3.054 1.00 0.00 H new ATOM 0 HD11 LEU A 142 17.716 -9.394 -5.285 1.00 0.00 H new ATOM 0 HD12 LEU A 142 16.389 -9.016 -4.161 1.00 0.00 H new ATOM 0 HD13 LEU A 142 17.605 -7.777 -4.550 1.00 0.00 H new ATOM 0 HD21 LEU A 142 20.016 -9.695 -4.444 1.00 0.00 H new ATOM 0 HD22 LEU A 142 19.998 -8.089 -3.678 1.00 0.00 H new ATOM 0 HD23 LEU A 142 20.369 -9.533 -2.707 1.00 0.00 H new ATOM 2103 N THR A 143 18.648 -6.524 0.040 1.00 0.00 N ATOM 2104 CA THR A 143 18.389 -5.464 1.009 1.00 0.00 C ATOM 2105 C THR A 143 18.338 -4.103 0.324 1.00 0.00 C ATOM 2106 O THR A 143 18.562 -3.994 -0.882 1.00 0.00 O ATOM 2107 CB THR A 143 19.467 -5.464 2.094 1.00 0.00 C ATOM 2108 OG1 THR A 143 20.537 -6.322 1.739 1.00 0.00 O ATOM 2109 CG2 THR A 143 18.952 -5.906 3.447 1.00 0.00 C ATOM 0 H THR A 143 18.914 -6.192 -0.887 1.00 0.00 H new ATOM 0 HA THR A 143 17.420 -5.654 1.470 1.00 0.00 H new ATOM 0 HB THR A 143 19.801 -4.429 2.170 1.00 0.00 H new ATOM 0 HG1 THR A 143 21.217 -6.307 2.445 1.00 0.00 H new ATOM 0 HG21 THR A 143 19.766 -5.884 4.171 1.00 0.00 H new ATOM 0 HG22 THR A 143 18.159 -5.233 3.772 1.00 0.00 H new ATOM 0 HG23 THR A 143 18.560 -6.920 3.373 1.00 0.00 H new ATOM 2117 N PRO A 144 18.045 -3.041 1.091 1.00 0.00 N ATOM 2118 CA PRO A 144 17.967 -1.679 0.558 1.00 0.00 C ATOM 2119 C PRO A 144 19.192 -1.317 -0.273 1.00 0.00 C ATOM 2120 O PRO A 144 19.079 -0.984 -1.453 1.00 0.00 O ATOM 2121 CB PRO A 144 17.895 -0.813 1.816 1.00 0.00 C ATOM 2122 CG PRO A 144 17.283 -1.698 2.846 1.00 0.00 C ATOM 2123 CD PRO A 144 17.771 -3.089 2.539 1.00 0.00 C ATOM 0 HA PRO A 144 17.119 -1.547 -0.114 1.00 0.00 H new ATOM 0 HB2 PRO A 144 18.885 -0.475 2.122 1.00 0.00 H new ATOM 0 HB3 PRO A 144 17.291 0.079 1.650 1.00 0.00 H new ATOM 0 HG2 PRO A 144 17.580 -1.393 3.849 1.00 0.00 H new ATOM 0 HG3 PRO A 144 16.195 -1.648 2.807 1.00 0.00 H new ATOM 0 HD2 PRO A 144 18.666 -3.336 3.110 1.00 0.00 H new ATOM 0 HD3 PRO A 144 17.020 -3.841 2.782 1.00 0.00 H new ATOM 2131 N LEU A 145 20.363 -1.385 0.350 1.00 0.00 N ATOM 2132 CA LEU A 145 21.611 -1.069 -0.332 1.00 0.00 C ATOM 2133 C LEU A 145 21.919 -2.112 -1.401 1.00 0.00 C ATOM 2134 O LEU A 145 22.301 -1.772 -2.522 1.00 0.00 O ATOM 2135 CB LEU A 145 22.761 -0.991 0.673 1.00 0.00 C ATOM 2136 CG LEU A 145 23.348 0.407 0.876 1.00 0.00 C ATOM 2137 CD1 LEU A 145 24.561 0.347 1.793 1.00 0.00 C ATOM 2138 CD2 LEU A 145 23.715 1.030 -0.462 1.00 0.00 C ATOM 0 H LEU A 145 20.474 -1.656 1.327 1.00 0.00 H new ATOM 0 HA LEU A 145 21.500 -0.099 -0.816 1.00 0.00 H new ATOM 0 HB2 LEU A 145 22.409 -1.364 1.635 1.00 0.00 H new ATOM 0 HB3 LEU A 145 23.557 -1.659 0.344 1.00 0.00 H new ATOM 0 HG LEU A 145 22.593 1.034 1.349 1.00 0.00 H new ATOM 0 HD11 LEU A 145 24.966 1.350 1.927 1.00 0.00 H new ATOM 0 HD12 LEU A 145 24.265 -0.057 2.761 1.00 0.00 H new ATOM 0 HD13 LEU A 145 25.322 -0.295 1.349 1.00 0.00 H new ATOM 0 HD21 LEU A 145 24.131 2.024 -0.299 1.00 0.00 H new ATOM 0 HD22 LEU A 145 24.454 0.405 -0.964 1.00 0.00 H new ATOM 0 HD23 LEU A 145 22.823 1.108 -1.084 1.00 0.00 H new ATOM 2150 N GLU A 146 21.746 -3.382 -1.049 1.00 0.00 N ATOM 2151 CA GLU A 146 22.001 -4.472 -1.982 1.00 0.00 C ATOM 2152 C GLU A 146 21.200 -4.277 -3.264 1.00 0.00 C ATOM 2153 O GLU A 146 21.766 -4.167 -4.351 1.00 0.00 O ATOM 2154 CB GLU A 146 21.645 -5.815 -1.339 1.00 0.00 C ATOM 2155 CG GLU A 146 22.573 -6.950 -1.743 1.00 0.00 C ATOM 2156 CD GLU A 146 21.827 -8.142 -2.306 1.00 0.00 C ATOM 2157 OE1 GLU A 146 20.670 -7.967 -2.742 1.00 0.00 O ATOM 2158 OE2 GLU A 146 22.401 -9.252 -2.313 1.00 0.00 O ATOM 0 H GLU A 146 21.431 -3.681 -0.126 1.00 0.00 H new ATOM 0 HA GLU A 146 23.062 -4.471 -2.231 1.00 0.00 H new ATOM 0 HB2 GLU A 146 21.669 -5.706 -0.255 1.00 0.00 H new ATOM 0 HB3 GLU A 146 20.623 -6.079 -1.611 1.00 0.00 H new ATOM 0 HG2 GLU A 146 23.283 -6.587 -2.486 1.00 0.00 H new ATOM 0 HG3 GLU A 146 23.153 -7.266 -0.876 1.00 0.00 H new ATOM 2165 N LEU A 147 19.879 -4.223 -3.127 1.00 0.00 N ATOM 2166 CA LEU A 147 19.001 -4.031 -4.275 1.00 0.00 C ATOM 2167 C LEU A 147 19.428 -2.805 -5.071 1.00 0.00 C ATOM 2168 O LEU A 147 19.628 -2.879 -6.283 1.00 0.00 O ATOM 2169 CB LEU A 147 17.551 -3.872 -3.815 1.00 0.00 C ATOM 2170 CG LEU A 147 16.578 -4.911 -4.374 1.00 0.00 C ATOM 2171 CD1 LEU A 147 15.150 -4.571 -3.977 1.00 0.00 C ATOM 2172 CD2 LEU A 147 16.709 -5.000 -5.886 1.00 0.00 C ATOM 0 H LEU A 147 19.394 -4.309 -2.234 1.00 0.00 H new ATOM 0 HA LEU A 147 19.075 -4.910 -4.915 1.00 0.00 H new ATOM 0 HB2 LEU A 147 17.524 -3.919 -2.726 1.00 0.00 H new ATOM 0 HB3 LEU A 147 17.202 -2.879 -4.100 1.00 0.00 H new ATOM 0 HG LEU A 147 16.828 -5.884 -3.950 1.00 0.00 H new ATOM 0 HD11 LEU A 147 14.471 -5.321 -4.383 1.00 0.00 H new ATOM 0 HD12 LEU A 147 15.068 -4.558 -2.890 1.00 0.00 H new ATOM 0 HD13 LEU A 147 14.886 -3.590 -4.373 1.00 0.00 H new ATOM 0 HD21 LEU A 147 16.010 -5.744 -6.269 1.00 0.00 H new ATOM 0 HD22 LEU A 147 16.484 -4.029 -6.328 1.00 0.00 H new ATOM 0 HD23 LEU A 147 17.727 -5.291 -6.147 1.00 0.00 H new ATOM 2184 N ALA A 148 19.577 -1.679 -4.379 1.00 0.00 N ATOM 2185 CA ALA A 148 19.992 -0.444 -5.027 1.00 0.00 C ATOM 2186 C ALA A 148 21.268 -0.674 -5.825 1.00 0.00 C ATOM 2187 O ALA A 148 21.447 -0.113 -6.906 1.00 0.00 O ATOM 2188 CB ALA A 148 20.190 0.657 -3.998 1.00 0.00 C ATOM 0 H ALA A 148 19.417 -1.599 -3.375 1.00 0.00 H new ATOM 0 HA ALA A 148 19.207 -0.128 -5.714 1.00 0.00 H new ATOM 0 HB1 ALA A 148 20.500 1.573 -4.501 1.00 0.00 H new ATOM 0 HB2 ALA A 148 19.254 0.833 -3.468 1.00 0.00 H new ATOM 0 HB3 ALA A 148 20.958 0.356 -3.286 1.00 0.00 H new ATOM 2194 N ARG A 149 22.146 -1.519 -5.292 1.00 0.00 N ATOM 2195 CA ARG A 149 23.395 -1.840 -5.965 1.00 0.00 C ATOM 2196 C ARG A 149 23.096 -2.535 -7.286 1.00 0.00 C ATOM 2197 O ARG A 149 23.831 -2.388 -8.263 1.00 0.00 O ATOM 2198 CB ARG A 149 24.270 -2.734 -5.085 1.00 0.00 C ATOM 2199 CG ARG A 149 25.760 -2.528 -5.305 1.00 0.00 C ATOM 2200 CD ARG A 149 26.581 -3.136 -4.179 1.00 0.00 C ATOM 2201 NE ARG A 149 27.501 -2.168 -3.589 1.00 0.00 N ATOM 2202 CZ ARG A 149 27.168 -1.344 -2.600 1.00 0.00 C ATOM 2203 NH1 ARG A 149 25.942 -1.373 -2.096 1.00 0.00 N ATOM 2204 NH2 ARG A 149 28.060 -0.491 -2.115 1.00 0.00 N ATOM 0 H ARG A 149 22.014 -1.992 -4.398 1.00 0.00 H new ATOM 0 HA ARG A 149 23.939 -0.915 -6.157 1.00 0.00 H new ATOM 0 HB2 ARG A 149 24.035 -2.542 -4.038 1.00 0.00 H new ATOM 0 HB3 ARG A 149 24.023 -3.777 -5.281 1.00 0.00 H new ATOM 0 HG2 ARG A 149 26.054 -2.977 -6.254 1.00 0.00 H new ATOM 0 HG3 ARG A 149 25.974 -1.462 -5.377 1.00 0.00 H new ATOM 0 HD2 ARG A 149 25.912 -3.517 -3.408 1.00 0.00 H new ATOM 0 HD3 ARG A 149 27.145 -3.987 -4.560 1.00 0.00 H new ATOM 0 HE ARG A 149 28.452 -2.121 -3.956 1.00 0.00 H new ATOM 0 HH11 ARG A 149 25.253 -2.028 -2.467 1.00 0.00 H new ATOM 0 HH12 ARG A 149 25.687 -0.741 -1.337 1.00 0.00 H new ATOM 0 HH21 ARG A 149 29.004 -0.466 -2.501 1.00 0.00 H new ATOM 0 HH22 ARG A 149 27.802 0.140 -1.356 1.00 0.00 H new ATOM 2218 N GLN A 150 21.991 -3.274 -7.308 1.00 0.00 N ATOM 2219 CA GLN A 150 21.561 -3.977 -8.506 1.00 0.00 C ATOM 2220 C GLN A 150 21.183 -2.961 -9.571 1.00 0.00 C ATOM 2221 O GLN A 150 21.972 -2.660 -10.466 1.00 0.00 O ATOM 2222 CB GLN A 150 20.369 -4.884 -8.187 1.00 0.00 C ATOM 2223 CG GLN A 150 20.562 -6.323 -8.627 1.00 0.00 C ATOM 2224 CD GLN A 150 19.848 -7.311 -7.724 1.00 0.00 C ATOM 2225 OE1 GLN A 150 18.708 -7.087 -7.319 1.00 0.00 O ATOM 2226 NE2 GLN A 150 20.519 -8.411 -7.404 1.00 0.00 N ATOM 0 H GLN A 150 21.376 -3.400 -6.504 1.00 0.00 H new ATOM 0 HA GLN A 150 22.375 -4.600 -8.875 1.00 0.00 H new ATOM 0 HB2 GLN A 150 20.186 -4.863 -7.113 1.00 0.00 H new ATOM 0 HB3 GLN A 150 19.478 -4.482 -8.670 1.00 0.00 H new ATOM 0 HG2 GLN A 150 20.196 -6.439 -9.647 1.00 0.00 H new ATOM 0 HG3 GLN A 150 21.627 -6.555 -8.642 1.00 0.00 H new ATOM 0 HE21 GLN A 150 21.463 -8.555 -7.763 1.00 0.00 H new ATOM 0 HE22 GLN A 150 20.091 -9.112 -6.799 1.00 0.00 H new ATOM 2235 N ARG A 151 19.984 -2.404 -9.446 1.00 0.00 N ATOM 2236 CA ARG A 151 19.525 -1.388 -10.375 1.00 0.00 C ATOM 2237 C ARG A 151 20.254 -0.087 -10.076 1.00 0.00 C ATOM 2238 O ARG A 151 19.694 0.822 -9.471 1.00 0.00 O ATOM 2239 CB ARG A 151 18.012 -1.189 -10.259 1.00 0.00 C ATOM 2240 CG ARG A 151 17.203 -2.217 -11.033 1.00 0.00 C ATOM 2241 CD ARG A 151 15.903 -2.555 -10.321 1.00 0.00 C ATOM 2242 NE ARG A 151 14.779 -2.650 -11.249 1.00 0.00 N ATOM 2243 CZ ARG A 151 14.499 -3.740 -11.958 1.00 0.00 C ATOM 2244 NH1 ARG A 151 15.263 -4.819 -11.850 1.00 0.00 N ATOM 2245 NH2 ARG A 151 13.455 -3.751 -12.776 1.00 0.00 N ATOM 0 H ARG A 151 19.317 -2.640 -8.712 1.00 0.00 H new ATOM 0 HA ARG A 151 19.741 -1.707 -11.395 1.00 0.00 H new ATOM 0 HB2 ARG A 151 17.728 -1.232 -9.208 1.00 0.00 H new ATOM 0 HB3 ARG A 151 17.756 -0.192 -10.618 1.00 0.00 H new ATOM 0 HG2 ARG A 151 16.984 -1.834 -12.030 1.00 0.00 H new ATOM 0 HG3 ARG A 151 17.794 -3.124 -11.163 1.00 0.00 H new ATOM 0 HD2 ARG A 151 16.016 -3.500 -9.790 1.00 0.00 H new ATOM 0 HD3 ARG A 151 15.691 -1.792 -9.572 1.00 0.00 H new ATOM 0 HE ARG A 151 14.175 -1.835 -11.359 1.00 0.00 H new ATOM 0 HH11 ARG A 151 16.067 -4.814 -11.222 1.00 0.00 H new ATOM 0 HH12 ARG A 151 15.046 -5.654 -12.395 1.00 0.00 H new ATOM 0 HH21 ARG A 151 12.866 -2.923 -12.862 1.00 0.00 H new ATOM 0 HH22 ARG A 151 13.241 -4.588 -13.319 1.00 0.00 H new ATOM 2259 N GLY A 152 21.519 -0.025 -10.471 1.00 0.00 N ATOM 2260 CA GLY A 152 22.341 1.146 -10.217 1.00 0.00 C ATOM 2261 C GLY A 152 21.819 2.417 -10.853 1.00 0.00 C ATOM 2262 O GLY A 152 22.540 3.090 -11.590 1.00 0.00 O ATOM 0 H GLY A 152 21.997 -0.775 -10.970 1.00 0.00 H new ATOM 0 HA2 GLY A 152 22.418 1.296 -9.140 1.00 0.00 H new ATOM 0 HA3 GLY A 152 23.349 0.956 -10.585 1.00 0.00 H new ATOM 2266 N ALA A 153 20.575 2.759 -10.555 1.00 0.00 N ATOM 2267 CA ALA A 153 19.973 3.974 -11.089 1.00 0.00 C ATOM 2268 C ALA A 153 20.784 5.196 -10.661 1.00 0.00 C ATOM 2269 O ALA A 153 20.681 6.259 -11.272 1.00 0.00 O ATOM 2270 CB ALA A 153 18.526 4.100 -10.634 1.00 0.00 C ATOM 0 H ALA A 153 19.963 2.215 -9.948 1.00 0.00 H new ATOM 0 HA ALA A 153 19.981 3.918 -12.178 1.00 0.00 H new ATOM 0 HB1 ALA A 153 18.094 5.013 -11.043 1.00 0.00 H new ATOM 0 HB2 ALA A 153 17.957 3.240 -10.987 1.00 0.00 H new ATOM 0 HB3 ALA A 153 18.489 4.137 -9.545 1.00 0.00 H new ATOM 2276 N GLN A 154 21.602 5.012 -9.615 1.00 0.00 N ATOM 2277 CA GLN A 154 22.473 6.067 -9.082 1.00 0.00 C ATOM 2278 C GLN A 154 21.928 6.694 -7.794 1.00 0.00 C ATOM 2279 O GLN A 154 22.317 6.303 -6.693 1.00 0.00 O ATOM 2280 CB GLN A 154 22.733 7.155 -10.130 1.00 0.00 C ATOM 2281 CG GLN A 154 23.807 8.147 -9.719 1.00 0.00 C ATOM 2282 CD GLN A 154 25.082 7.468 -9.260 1.00 0.00 C ATOM 2283 OE1 GLN A 154 25.367 6.301 -9.826 1.00 0.00 O flip ATOM 2284 NE2 GLN A 154 25.803 7.986 -8.408 1.00 0.00 N flip ATOM 0 H GLN A 154 21.678 4.126 -9.115 1.00 0.00 H new ATOM 0 HA GLN A 154 23.417 5.582 -8.832 1.00 0.00 H new ATOM 0 HB2 GLN A 154 23.025 6.683 -11.068 1.00 0.00 H new ATOM 0 HB3 GLN A 154 21.805 7.694 -10.320 1.00 0.00 H new ATOM 0 HG2 GLN A 154 24.032 8.803 -10.560 1.00 0.00 H new ATOM 0 HG3 GLN A 154 23.426 8.778 -8.916 1.00 0.00 H new ATOM 0 HE21 GLN A 154 25.545 8.884 -8.000 1.00 0.00 H new ATOM 0 HE22 GLN A 154 26.658 7.517 -8.110 1.00 0.00 H new ATOM 2293 N ASN A 155 21.055 7.688 -7.936 1.00 0.00 N ATOM 2294 CA ASN A 155 20.488 8.395 -6.786 1.00 0.00 C ATOM 2295 C ASN A 155 19.818 7.457 -5.781 1.00 0.00 C ATOM 2296 O ASN A 155 19.969 7.628 -4.571 1.00 0.00 O ATOM 2297 CB ASN A 155 19.479 9.441 -7.262 1.00 0.00 C ATOM 2298 CG ASN A 155 19.724 10.803 -6.644 1.00 0.00 C ATOM 2299 OD1 ASN A 155 19.287 10.976 -5.402 1.00 0.00 O flip ATOM 2300 ND2 ASN A 155 20.302 11.688 -7.275 1.00 0.00 N flip ATOM 0 H ASN A 155 20.722 8.025 -8.839 1.00 0.00 H new ATOM 0 HA ASN A 155 21.319 8.877 -6.272 1.00 0.00 H new ATOM 0 HB2 ASN A 155 19.530 9.523 -8.348 1.00 0.00 H new ATOM 0 HB3 ASN A 155 18.471 9.109 -7.014 1.00 0.00 H new ATOM 0 HD21 ASN A 155 20.621 11.510 -8.227 1.00 0.00 H new ATOM 0 HD22 ASN A 155 20.462 12.599 -6.845 1.00 0.00 H new ATOM 2307 N LEU A 156 19.061 6.488 -6.277 1.00 0.00 N ATOM 2308 CA LEU A 156 18.350 5.555 -5.409 1.00 0.00 C ATOM 2309 C LEU A 156 19.273 4.911 -4.375 1.00 0.00 C ATOM 2310 O LEU A 156 18.996 4.959 -3.178 1.00 0.00 O ATOM 2311 CB LEU A 156 17.663 4.471 -6.241 1.00 0.00 C ATOM 2312 CG LEU A 156 18.609 3.541 -6.995 1.00 0.00 C ATOM 2313 CD1 LEU A 156 17.830 2.435 -7.690 1.00 0.00 C ATOM 2314 CD2 LEU A 156 19.442 4.325 -7.990 1.00 0.00 C ATOM 0 H LEU A 156 18.922 6.326 -7.275 1.00 0.00 H new ATOM 0 HA LEU A 156 17.598 6.130 -4.868 1.00 0.00 H new ATOM 0 HB2 LEU A 156 17.036 3.871 -5.582 1.00 0.00 H new ATOM 0 HB3 LEU A 156 17.000 4.952 -6.960 1.00 0.00 H new ATOM 0 HG LEU A 156 19.285 3.078 -6.277 1.00 0.00 H new ATOM 0 HD11 LEU A 156 18.522 1.782 -8.222 1.00 0.00 H new ATOM 0 HD12 LEU A 156 17.281 1.855 -6.948 1.00 0.00 H new ATOM 0 HD13 LEU A 156 17.128 2.874 -8.398 1.00 0.00 H new ATOM 0 HD21 LEU A 156 20.111 3.646 -8.519 1.00 0.00 H new ATOM 0 HD22 LEU A 156 18.785 4.818 -8.706 1.00 0.00 H new ATOM 0 HD23 LEU A 156 20.030 5.075 -7.461 1.00 0.00 H new ATOM 2326 N MET A 157 20.365 4.308 -4.834 1.00 0.00 N ATOM 2327 CA MET A 157 21.307 3.659 -3.938 1.00 0.00 C ATOM 2328 C MET A 157 21.889 4.657 -2.945 1.00 0.00 C ATOM 2329 O MET A 157 22.127 4.324 -1.784 1.00 0.00 O ATOM 2330 CB MET A 157 22.419 2.990 -4.746 1.00 0.00 C ATOM 2331 CG MET A 157 23.614 3.891 -5.014 1.00 0.00 C ATOM 2332 SD MET A 157 25.025 2.990 -5.685 1.00 0.00 S ATOM 2333 CE MET A 157 25.404 1.894 -4.321 1.00 0.00 C ATOM 0 H MET A 157 20.617 4.257 -5.821 1.00 0.00 H new ATOM 0 HA MET A 157 20.776 2.895 -3.370 1.00 0.00 H new ATOM 0 HB2 MET A 157 22.758 2.102 -4.213 1.00 0.00 H new ATOM 0 HB3 MET A 157 22.010 2.653 -5.698 1.00 0.00 H new ATOM 0 HG2 MET A 157 23.323 4.676 -5.712 1.00 0.00 H new ATOM 0 HG3 MET A 157 23.909 4.383 -4.087 1.00 0.00 H new ATOM 0 HE1 MET A 157 26.454 1.605 -4.367 1.00 0.00 H new ATOM 0 HE2 MET A 157 25.210 2.406 -3.378 1.00 0.00 H new ATOM 0 HE3 MET A 157 24.779 1.003 -4.386 1.00 0.00 H new ATOM 2343 N ASP A 158 22.112 5.882 -3.406 1.00 0.00 N ATOM 2344 CA ASP A 158 22.660 6.921 -2.549 1.00 0.00 C ATOM 2345 C ASP A 158 21.610 7.413 -1.559 1.00 0.00 C ATOM 2346 O ASP A 158 21.940 7.916 -0.485 1.00 0.00 O ATOM 2347 CB ASP A 158 23.182 8.090 -3.387 1.00 0.00 C ATOM 2348 CG ASP A 158 22.410 8.262 -4.681 1.00 0.00 C ATOM 2349 OD1 ASP A 158 22.391 7.311 -5.491 1.00 0.00 O ATOM 2350 OD2 ASP A 158 21.825 9.347 -4.885 1.00 0.00 O ATOM 0 H ASP A 158 21.922 6.177 -4.364 1.00 0.00 H new ATOM 0 HA ASP A 158 23.492 6.494 -1.989 1.00 0.00 H new ATOM 0 HB2 ASP A 158 23.118 9.009 -2.804 1.00 0.00 H new ATOM 0 HB3 ASP A 158 24.236 7.929 -3.614 1.00 0.00 H new ATOM 2355 N ILE A 159 20.345 7.261 -1.930 1.00 0.00 N ATOM 2356 CA ILE A 159 19.243 7.681 -1.090 1.00 0.00 C ATOM 2357 C ILE A 159 19.064 6.740 0.099 1.00 0.00 C ATOM 2358 O ILE A 159 18.814 7.181 1.221 1.00 0.00 O ATOM 2359 CB ILE A 159 17.935 7.721 -1.896 1.00 0.00 C ATOM 2360 CG1 ILE A 159 17.990 8.822 -2.957 1.00 0.00 C ATOM 2361 CG2 ILE A 159 16.754 7.925 -0.970 1.00 0.00 C ATOM 2362 CD1 ILE A 159 17.184 8.501 -4.198 1.00 0.00 C ATOM 0 H ILE A 159 20.061 6.845 -2.817 1.00 0.00 H new ATOM 0 HA ILE A 159 19.478 8.679 -0.721 1.00 0.00 H new ATOM 0 HB ILE A 159 17.811 6.766 -2.406 1.00 0.00 H new ATOM 0 HG12 ILE A 159 17.622 9.752 -2.524 1.00 0.00 H new ATOM 0 HG13 ILE A 159 19.029 8.991 -3.241 1.00 0.00 H new ATOM 0 HG21 ILE A 159 15.834 7.951 -1.554 1.00 0.00 H new ATOM 0 HG22 ILE A 159 16.706 7.104 -0.255 1.00 0.00 H new ATOM 0 HG23 ILE A 159 16.871 8.867 -0.434 1.00 0.00 H new ATOM 0 HD11 ILE A 159 17.267 9.323 -4.908 1.00 0.00 H new ATOM 0 HD12 ILE A 159 17.566 7.588 -4.654 1.00 0.00 H new ATOM 0 HD13 ILE A 159 16.138 8.360 -3.926 1.00 0.00 H new ATOM 2374 N LEU A 160 19.178 5.441 -0.160 1.00 0.00 N ATOM 2375 CA LEU A 160 19.014 4.434 0.882 1.00 0.00 C ATOM 2376 C LEU A 160 20.211 4.398 1.825 1.00 0.00 C ATOM 2377 O LEU A 160 20.056 4.497 3.042 1.00 0.00 O ATOM 2378 CB LEU A 160 18.795 3.060 0.260 1.00 0.00 C ATOM 2379 CG LEU A 160 18.219 3.093 -1.151 1.00 0.00 C ATOM 2380 CD1 LEU A 160 17.683 1.727 -1.547 1.00 0.00 C ATOM 2381 CD2 LEU A 160 17.131 4.150 -1.260 1.00 0.00 C ATOM 0 H LEU A 160 19.384 5.061 -1.084 1.00 0.00 H new ATOM 0 HA LEU A 160 18.137 4.707 1.468 1.00 0.00 H new ATOM 0 HB2 LEU A 160 19.746 2.528 0.239 1.00 0.00 H new ATOM 0 HB3 LEU A 160 18.124 2.487 0.900 1.00 0.00 H new ATOM 0 HG LEU A 160 19.021 3.355 -1.841 1.00 0.00 H new ATOM 0 HD11 LEU A 160 17.277 1.774 -2.557 1.00 0.00 H new ATOM 0 HD12 LEU A 160 18.491 0.996 -1.514 1.00 0.00 H new ATOM 0 HD13 LEU A 160 16.896 1.430 -0.853 1.00 0.00 H new ATOM 0 HD21 LEU A 160 16.732 4.158 -2.274 1.00 0.00 H new ATOM 0 HD22 LEU A 160 16.330 3.921 -0.557 1.00 0.00 H new ATOM 0 HD23 LEU A 160 17.550 5.129 -1.027 1.00 0.00 H new ATOM 2393 N GLN A 161 21.405 4.253 1.258 1.00 0.00 N ATOM 2394 CA GLN A 161 22.622 4.200 2.050 1.00 0.00 C ATOM 2395 C GLN A 161 22.708 5.392 2.995 1.00 0.00 C ATOM 2396 O GLN A 161 23.359 5.325 4.038 1.00 0.00 O ATOM 2397 CB GLN A 161 23.838 4.168 1.126 1.00 0.00 C ATOM 2398 CG GLN A 161 24.215 5.528 0.563 1.00 0.00 C ATOM 2399 CD GLN A 161 25.670 5.878 0.805 1.00 0.00 C ATOM 2400 OE1 GLN A 161 26.514 4.997 0.969 1.00 0.00 O ATOM 2401 NE2 GLN A 161 25.972 7.172 0.830 1.00 0.00 N ATOM 0 H GLN A 161 21.552 4.170 0.252 1.00 0.00 H new ATOM 0 HA GLN A 161 22.605 3.292 2.653 1.00 0.00 H new ATOM 0 HB2 GLN A 161 24.689 3.763 1.674 1.00 0.00 H new ATOM 0 HB3 GLN A 161 23.637 3.486 0.300 1.00 0.00 H new ATOM 0 HG2 GLN A 161 24.016 5.541 -0.509 1.00 0.00 H new ATOM 0 HG3 GLN A 161 23.582 6.292 1.014 1.00 0.00 H new ATOM 0 HE21 GLN A 161 25.241 7.869 0.689 1.00 0.00 H new ATOM 0 HE22 GLN A 161 26.935 7.468 0.990 1.00 0.00 H new ATOM 2410 N GLY A 162 22.042 6.482 2.626 1.00 0.00 N ATOM 2411 CA GLY A 162 22.050 7.672 3.455 1.00 0.00 C ATOM 2412 C GLY A 162 21.201 7.511 4.700 1.00 0.00 C ATOM 2413 O GLY A 162 21.681 7.708 5.817 1.00 0.00 O ATOM 0 H GLY A 162 21.497 6.562 1.767 1.00 0.00 H new ATOM 0 HA2 GLY A 162 23.075 7.904 3.744 1.00 0.00 H new ATOM 0 HA3 GLY A 162 21.683 8.519 2.875 1.00 0.00 H new ATOM 2417 N HIS A 163 19.936 7.151 4.508 1.00 0.00 N ATOM 2418 CA HIS A 163 19.016 6.963 5.623 1.00 0.00 C ATOM 2419 C HIS A 163 19.337 5.678 6.381 1.00 0.00 C ATOM 2420 O HIS A 163 19.446 5.680 7.607 1.00 0.00 O ATOM 2421 CB HIS A 163 17.571 6.922 5.120 1.00 0.00 C ATOM 2422 CG HIS A 163 17.121 8.199 4.481 1.00 0.00 C ATOM 2423 ND1 HIS A 163 17.997 9.230 4.248 1.00 0.00 N ATOM 2424 CD2 HIS A 163 15.888 8.559 4.048 1.00 0.00 C ATOM 2425 CE1 HIS A 163 17.286 10.189 3.683 1.00 0.00 C ATOM 2426 NE2 HIS A 163 16.001 9.829 3.542 1.00 0.00 N ATOM 0 H HIS A 163 19.525 6.984 3.590 1.00 0.00 H new ATOM 0 HA HIS A 163 19.133 7.806 6.303 1.00 0.00 H new ATOM 0 HB2 HIS A 163 17.469 6.110 4.400 1.00 0.00 H new ATOM 0 HB3 HIS A 163 16.911 6.692 5.956 1.00 0.00 H new ATOM 0 HD2 HIS A 163 14.990 7.961 4.093 1.00 0.00 H new ATOM 0 HE1 HIS A 163 17.688 11.142 3.374 1.00 0.00 H new ATOM 0 HE2 HIS A 163 15.253 10.391 3.137 1.00 0.00 H new ATOM 2434 N MET A 164 19.488 4.584 5.642 1.00 0.00 N ATOM 2435 CA MET A 164 19.794 3.291 6.240 1.00 0.00 C ATOM 2436 C MET A 164 20.768 3.443 7.405 1.00 0.00 C ATOM 2437 O MET A 164 20.425 3.163 8.554 1.00 0.00 O ATOM 2438 CB MET A 164 20.382 2.345 5.191 1.00 0.00 C ATOM 2439 CG MET A 164 20.141 0.875 5.494 1.00 0.00 C ATOM 2440 SD MET A 164 21.665 -0.020 5.850 1.00 0.00 S ATOM 2441 CE MET A 164 22.405 -0.091 4.220 1.00 0.00 C ATOM 0 H MET A 164 19.403 4.568 4.626 1.00 0.00 H new ATOM 0 HA MET A 164 18.864 2.869 6.621 1.00 0.00 H new ATOM 0 HB2 MET A 164 19.952 2.582 4.218 1.00 0.00 H new ATOM 0 HB3 MET A 164 21.455 2.521 5.116 1.00 0.00 H new ATOM 0 HG2 MET A 164 19.467 0.790 6.346 1.00 0.00 H new ATOM 0 HG3 MET A 164 19.641 0.410 4.644 1.00 0.00 H new ATOM 0 HE1 MET A 164 23.106 -0.924 4.175 1.00 0.00 H new ATOM 0 HE2 MET A 164 21.625 -0.232 3.472 1.00 0.00 H new ATOM 0 HE3 MET A 164 22.935 0.840 4.020 1.00 0.00 H new