USER MOD reduce.3.24.130724 H: found=0, std=0, add=1111, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1112 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 30 TYR OH : rot 88:sc= 0.975 USER MOD Set 1.2: A 134 ASN :FLIP amide:sc= 0.0759 F(o=-1.6,f=0.18) USER MOD Set 1.3: A 139 ASN : amide:sc= -0.871 K(o=0.18,f=-5.9!) USER MOD Set 2.1: A 52 TYR OH : rot 23:sc= 1.19 USER MOD Set 2.2: A 136 HIS : no HE2:sc= 0.826 K(o=2,f=-2.4) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN :FLIP amide:sc= 0.348 F(o=-0.18,f=0.35) USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 29 THR OG1 : rot 84:sc= 0.604 USER MOD Single : A 32 LYS NZ :NH3+ 162:sc= -0.0784 (180deg=-0.405) USER MOD Single : A 35 THR OG1 : rot 170:sc= -0.848 USER MOD Single : A 36 SER OG : rot 94:sc= 0.983 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -169:sc= -0.0258 (180deg=-0.189) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0.827 K(o=0.83,f=-1.7) USER MOD Single : A 56 MET CE :methyl -146:sc= -0.2 (180deg=-0.785) USER MOD Single : A 62 TYR OH : rot 71:sc= 0.0933 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0202) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 160:sc= 0.884 (180deg=0.531) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -12:sc= 0.619 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ -147:sc= 1.02 (180deg=0.452) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc=-0.00275 K(o=-0.0028,f=-1.1) USER MOD Single : A 103 THR OG1 : rot -120:sc= -0.619 USER MOD Single : A 107 THR OG1 : rot -170:sc= 0.423 USER MOD Single : A 110 SER OG : rot -1:sc= 0.655 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 GLN : amide:sc= -0.364 X(o=-0.36,f=0) USER MOD Single : A 117 THR OG1 : rot 105:sc= 0.452 USER MOD Single : A 118 THR OG1 : rot -15:sc= 1.09 USER MOD Single : A 119 CYS SG : rot 150:sc= -1.2 USER MOD Single : A 125 GLN : amide:sc= -0.117 X(o=-0.12,f=-0.53) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ 176:sc= 0.718 (180deg=0.676) USER MOD Single : A 145 GLN : amide:sc= -0.413 K(o=-0.41,f=-1.3) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 200 N ILE A 15 11.408 9.012 -15.861 1.00 0.00 N ATOM 201 CA ILE A 15 10.242 8.761 -14.990 1.00 0.00 C ATOM 202 C ILE A 15 10.391 7.390 -14.292 1.00 0.00 C ATOM 203 O ILE A 15 10.192 7.289 -13.085 1.00 0.00 O ATOM 204 CB ILE A 15 8.880 8.847 -15.785 1.00 0.00 C ATOM 205 CG1 ILE A 15 8.668 10.280 -16.383 1.00 0.00 C ATOM 206 CG2 ILE A 15 7.665 8.424 -14.912 1.00 0.00 C ATOM 207 CD1 ILE A 15 8.609 11.406 -15.360 1.00 0.00 C ATOM 0 HA ILE A 15 10.214 9.544 -14.232 1.00 0.00 H new ATOM 0 HB ILE A 15 8.946 8.137 -16.610 1.00 0.00 H new ATOM 0 HG12 ILE A 15 9.478 10.488 -17.083 1.00 0.00 H new ATOM 0 HG13 ILE A 15 7.742 10.283 -16.957 1.00 0.00 H new ATOM 0 HG21 ILE A 15 6.751 8.499 -15.500 1.00 0.00 H new ATOM 0 HG22 ILE A 15 7.798 7.395 -14.578 1.00 0.00 H new ATOM 0 HG23 ILE A 15 7.594 9.081 -14.045 1.00 0.00 H new ATOM 0 HD11 ILE A 15 8.460 12.356 -15.873 1.00 0.00 H new ATOM 0 HD12 ILE A 15 7.781 11.231 -14.673 1.00 0.00 H new ATOM 0 HD13 ILE A 15 9.544 11.438 -14.800 1.00 0.00 H new ATOM 219 N GLU A 16 10.799 6.359 -15.062 1.00 0.00 N ATOM 220 CA GLU A 16 11.063 5.003 -14.521 1.00 0.00 C ATOM 221 C GLU A 16 12.257 5.021 -13.555 1.00 0.00 C ATOM 222 O GLU A 16 12.288 4.241 -12.613 1.00 0.00 O ATOM 223 CB GLU A 16 11.329 3.978 -15.659 1.00 0.00 C ATOM 224 CG GLU A 16 10.099 3.595 -16.502 1.00 0.00 C ATOM 225 CD GLU A 16 10.466 2.680 -17.687 1.00 0.00 C ATOM 226 OE1 GLU A 16 10.635 1.455 -17.475 1.00 0.00 O ATOM 227 OE2 GLU A 16 10.618 3.179 -18.825 1.00 0.00 O ATOM 0 H GLU A 16 10.954 6.438 -16.067 1.00 0.00 H new ATOM 0 HA GLU A 16 10.169 4.694 -13.979 1.00 0.00 H new ATOM 0 HB2 GLU A 16 12.091 4.387 -16.323 1.00 0.00 H new ATOM 0 HB3 GLU A 16 11.744 3.071 -15.219 1.00 0.00 H new ATOM 0 HG2 GLU A 16 9.369 3.091 -15.868 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.623 4.500 -16.878 1.00 0.00 H new ATOM 234 N LYS A 17 13.232 5.916 -13.811 1.00 0.00 N ATOM 235 CA LYS A 17 14.429 6.076 -12.958 1.00 0.00 C ATOM 236 C LYS A 17 14.030 6.571 -11.550 1.00 0.00 C ATOM 237 O LYS A 17 14.250 5.869 -10.555 1.00 0.00 O ATOM 238 CB LYS A 17 15.414 7.086 -13.598 1.00 0.00 C ATOM 239 CG LYS A 17 16.713 7.318 -12.781 1.00 0.00 C ATOM 240 CD LYS A 17 17.405 8.655 -13.114 1.00 0.00 C ATOM 241 CE LYS A 17 17.797 8.800 -14.591 1.00 0.00 C ATOM 242 NZ LYS A 17 18.379 10.135 -14.863 1.00 0.00 N ATOM 0 H LYS A 17 13.213 6.547 -14.612 1.00 0.00 H new ATOM 0 HA LYS A 17 14.915 5.104 -12.870 1.00 0.00 H new ATOM 0 HB2 LYS A 17 15.683 6.732 -14.593 1.00 0.00 H new ATOM 0 HB3 LYS A 17 14.904 8.041 -13.726 1.00 0.00 H new ATOM 0 HG2 LYS A 17 16.476 7.293 -11.717 1.00 0.00 H new ATOM 0 HG3 LYS A 17 17.407 6.499 -12.972 1.00 0.00 H new ATOM 0 HD2 LYS A 17 16.740 9.475 -12.842 1.00 0.00 H new ATOM 0 HD3 LYS A 17 18.300 8.753 -12.499 1.00 0.00 H new ATOM 0 HE2 LYS A 17 18.517 8.026 -14.856 1.00 0.00 H new ATOM 0 HE3 LYS A 17 16.919 8.648 -15.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 18.634 10.204 -15.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 17.682 10.871 -14.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 19.230 10.268 -14.280 1.00 0.00 H new ATOM 256 N GLN A 18 13.413 7.777 -11.506 1.00 0.00 N ATOM 257 CA GLN A 18 13.025 8.457 -10.247 1.00 0.00 C ATOM 258 C GLN A 18 11.995 7.620 -9.461 1.00 0.00 C ATOM 259 O GLN A 18 11.997 7.601 -8.226 1.00 0.00 O ATOM 260 CB GLN A 18 12.480 9.881 -10.547 1.00 0.00 C ATOM 261 CG GLN A 18 11.219 9.927 -11.440 1.00 0.00 C ATOM 262 CD GLN A 18 10.853 11.333 -11.923 1.00 0.00 C ATOM 263 OE1 GLN A 18 11.417 11.753 -13.052 1.00 0.00 O flip ATOM 264 NE2 GLN A 18 10.096 12.046 -11.271 1.00 0.00 N flip ATOM 0 H GLN A 18 13.170 8.306 -12.344 1.00 0.00 H new ATOM 0 HA GLN A 18 13.913 8.557 -9.622 1.00 0.00 H new ATOM 0 HB2 GLN A 18 12.254 10.373 -9.601 1.00 0.00 H new ATOM 0 HB3 GLN A 18 13.268 10.461 -11.028 1.00 0.00 H new ATOM 0 HG2 GLN A 18 11.376 9.285 -12.307 1.00 0.00 H new ATOM 0 HG3 GLN A 18 10.377 9.513 -10.885 1.00 0.00 H new ATOM 0 HE21 GLN A 18 9.680 11.694 -10.409 1.00 0.00 H new ATOM 0 HE22 GLN A 18 9.883 12.991 -11.591 1.00 0.00 H new ATOM 273 N PHE A 19 11.141 6.914 -10.217 1.00 0.00 N ATOM 274 CA PHE A 19 10.146 5.982 -9.678 1.00 0.00 C ATOM 275 C PHE A 19 10.827 4.761 -9.033 1.00 0.00 C ATOM 276 O PHE A 19 10.508 4.408 -7.898 1.00 0.00 O ATOM 277 CB PHE A 19 9.178 5.548 -10.810 1.00 0.00 C ATOM 278 CG PHE A 19 8.262 4.382 -10.455 1.00 0.00 C ATOM 279 CD1 PHE A 19 7.319 4.510 -9.445 1.00 0.00 C ATOM 280 CD2 PHE A 19 8.371 3.150 -11.108 1.00 0.00 C ATOM 281 CE1 PHE A 19 6.509 3.449 -9.101 1.00 0.00 C ATOM 282 CE2 PHE A 19 7.563 2.094 -10.754 1.00 0.00 C ATOM 283 CZ PHE A 19 6.631 2.251 -9.749 1.00 0.00 C ATOM 0 H PHE A 19 11.124 6.977 -11.235 1.00 0.00 H new ATOM 0 HA PHE A 19 9.574 6.485 -8.898 1.00 0.00 H new ATOM 0 HB2 PHE A 19 8.563 6.403 -11.091 1.00 0.00 H new ATOM 0 HB3 PHE A 19 9.765 5.276 -11.687 1.00 0.00 H new ATOM 0 HD1 PHE A 19 7.219 5.450 -8.923 1.00 0.00 H new ATOM 0 HD2 PHE A 19 9.097 3.026 -11.898 1.00 0.00 H new ATOM 0 HE1 PHE A 19 5.775 3.564 -8.317 1.00 0.00 H new ATOM 0 HE2 PHE A 19 7.658 1.145 -11.261 1.00 0.00 H new ATOM 0 HZ PHE A 19 5.994 1.423 -9.473 1.00 0.00 H new ATOM 293 N ALA A 20 11.778 4.149 -9.761 1.00 0.00 N ATOM 294 CA ALA A 20 12.431 2.894 -9.337 1.00 0.00 C ATOM 295 C ALA A 20 13.205 3.089 -8.031 1.00 0.00 C ATOM 296 O ALA A 20 13.063 2.296 -7.097 1.00 0.00 O ATOM 297 CB ALA A 20 13.366 2.366 -10.435 1.00 0.00 C ATOM 0 H ALA A 20 12.115 4.506 -10.655 1.00 0.00 H new ATOM 0 HA ALA A 20 11.648 2.156 -9.164 1.00 0.00 H new ATOM 0 HB1 ALA A 20 13.835 1.441 -10.100 1.00 0.00 H new ATOM 0 HB2 ALA A 20 12.791 2.173 -11.341 1.00 0.00 H new ATOM 0 HB3 ALA A 20 14.136 3.108 -10.645 1.00 0.00 H new ATOM 303 N VAL A 21 13.995 4.176 -7.968 1.00 0.00 N ATOM 304 CA VAL A 21 14.837 4.475 -6.798 1.00 0.00 C ATOM 305 C VAL A 21 13.974 4.818 -5.559 1.00 0.00 C ATOM 306 O VAL A 21 14.182 4.238 -4.499 1.00 0.00 O ATOM 307 CB VAL A 21 15.902 5.601 -7.097 1.00 0.00 C ATOM 308 CG1 VAL A 21 15.240 6.896 -7.590 1.00 0.00 C ATOM 309 CG2 VAL A 21 16.812 5.878 -5.872 1.00 0.00 C ATOM 0 H VAL A 21 14.067 4.864 -8.718 1.00 0.00 H new ATOM 0 HA VAL A 21 15.399 3.570 -6.570 1.00 0.00 H new ATOM 0 HB VAL A 21 16.535 5.225 -7.900 1.00 0.00 H new ATOM 0 HG11 VAL A 21 16.007 7.646 -7.784 1.00 0.00 H new ATOM 0 HG12 VAL A 21 14.688 6.696 -8.508 1.00 0.00 H new ATOM 0 HG13 VAL A 21 14.555 7.267 -6.828 1.00 0.00 H new ATOM 0 HG21 VAL A 21 17.530 6.659 -6.121 1.00 0.00 H new ATOM 0 HG22 VAL A 21 16.200 6.203 -5.030 1.00 0.00 H new ATOM 0 HG23 VAL A 21 17.346 4.967 -5.602 1.00 0.00 H new ATOM 319 N VAL A 22 12.954 5.701 -5.715 1.00 0.00 N ATOM 320 CA VAL A 22 12.095 6.119 -4.576 1.00 0.00 C ATOM 321 C VAL A 22 11.255 4.935 -4.051 1.00 0.00 C ATOM 322 O VAL A 22 10.920 4.874 -2.862 1.00 0.00 O ATOM 323 CB VAL A 22 11.149 7.326 -4.945 1.00 0.00 C ATOM 324 CG1 VAL A 22 9.944 6.911 -5.827 1.00 0.00 C ATOM 325 CG2 VAL A 22 10.693 8.090 -3.678 1.00 0.00 C ATOM 0 H VAL A 22 12.708 6.132 -6.606 1.00 0.00 H new ATOM 0 HA VAL A 22 12.770 6.456 -3.789 1.00 0.00 H new ATOM 0 HB VAL A 22 11.744 8.006 -5.554 1.00 0.00 H new ATOM 0 HG11 VAL A 22 9.333 7.787 -6.045 1.00 0.00 H new ATOM 0 HG12 VAL A 22 10.307 6.481 -6.760 1.00 0.00 H new ATOM 0 HG13 VAL A 22 9.343 6.172 -5.297 1.00 0.00 H new ATOM 0 HG21 VAL A 22 10.042 8.916 -3.966 1.00 0.00 H new ATOM 0 HG22 VAL A 22 10.149 7.412 -3.020 1.00 0.00 H new ATOM 0 HG23 VAL A 22 11.566 8.481 -3.155 1.00 0.00 H new ATOM 335 N ALA A 23 10.934 3.996 -4.961 1.00 0.00 N ATOM 336 CA ALA A 23 10.155 2.808 -4.648 1.00 0.00 C ATOM 337 C ALA A 23 10.986 1.845 -3.791 1.00 0.00 C ATOM 338 O ALA A 23 10.583 1.493 -2.674 1.00 0.00 O ATOM 339 CB ALA A 23 9.685 2.139 -5.949 1.00 0.00 C ATOM 0 H ALA A 23 11.216 4.052 -5.940 1.00 0.00 H new ATOM 0 HA ALA A 23 9.273 3.090 -4.073 1.00 0.00 H new ATOM 0 HB1 ALA A 23 9.102 1.249 -5.711 1.00 0.00 H new ATOM 0 HB2 ALA A 23 9.068 2.837 -6.515 1.00 0.00 H new ATOM 0 HB3 ALA A 23 10.552 1.855 -6.546 1.00 0.00 H new ATOM 345 N VAL A 24 12.173 1.461 -4.308 1.00 0.00 N ATOM 346 CA VAL A 24 13.033 0.455 -3.658 1.00 0.00 C ATOM 347 C VAL A 24 13.589 0.971 -2.319 1.00 0.00 C ATOM 348 O VAL A 24 13.761 0.181 -1.393 1.00 0.00 O ATOM 349 CB VAL A 24 14.212 -0.044 -4.579 1.00 0.00 C ATOM 350 CG1 VAL A 24 13.663 -0.703 -5.869 1.00 0.00 C ATOM 351 CG2 VAL A 24 15.217 1.097 -4.904 1.00 0.00 C ATOM 0 H VAL A 24 12.556 1.835 -5.176 1.00 0.00 H new ATOM 0 HA VAL A 24 12.389 -0.404 -3.468 1.00 0.00 H new ATOM 0 HB VAL A 24 14.765 -0.802 -4.024 1.00 0.00 H new ATOM 0 HG11 VAL A 24 14.495 -1.039 -6.488 1.00 0.00 H new ATOM 0 HG12 VAL A 24 13.039 -1.557 -5.604 1.00 0.00 H new ATOM 0 HG13 VAL A 24 13.068 0.023 -6.423 1.00 0.00 H new ATOM 0 HG21 VAL A 24 16.013 0.710 -5.540 1.00 0.00 H new ATOM 0 HG22 VAL A 24 14.697 1.903 -5.422 1.00 0.00 H new ATOM 0 HG23 VAL A 24 15.646 1.479 -3.978 1.00 0.00 H new ATOM 361 N GLU A 25 13.841 2.306 -2.226 1.00 0.00 N ATOM 362 CA GLU A 25 14.286 2.956 -0.969 1.00 0.00 C ATOM 363 C GLU A 25 13.192 2.847 0.092 1.00 0.00 C ATOM 364 O GLU A 25 13.456 2.410 1.197 1.00 0.00 O ATOM 365 CB GLU A 25 14.657 4.452 -1.173 1.00 0.00 C ATOM 366 CG GLU A 25 15.959 4.701 -1.956 1.00 0.00 C ATOM 367 CD GLU A 25 16.290 6.196 -2.106 1.00 0.00 C ATOM 368 OE1 GLU A 25 15.526 6.915 -2.788 1.00 0.00 O ATOM 369 OE2 GLU A 25 17.319 6.661 -1.549 1.00 0.00 O ATOM 0 H GLU A 25 13.742 2.951 -3.010 1.00 0.00 H new ATOM 0 HA GLU A 25 15.184 2.433 -0.641 1.00 0.00 H new ATOM 0 HB2 GLU A 25 13.837 4.946 -1.695 1.00 0.00 H new ATOM 0 HB3 GLU A 25 14.743 4.926 -0.195 1.00 0.00 H new ATOM 0 HG2 GLU A 25 16.784 4.200 -1.449 1.00 0.00 H new ATOM 0 HG3 GLU A 25 15.874 4.252 -2.945 1.00 0.00 H new ATOM 376 N GLN A 26 11.957 3.229 -0.275 1.00 0.00 N ATOM 377 CA GLN A 26 10.793 3.173 0.637 1.00 0.00 C ATOM 378 C GLN A 26 10.542 1.724 1.115 1.00 0.00 C ATOM 379 O GLN A 26 10.137 1.501 2.254 1.00 0.00 O ATOM 380 CB GLN A 26 9.534 3.741 -0.073 1.00 0.00 C ATOM 381 CG GLN A 26 8.254 3.839 0.794 1.00 0.00 C ATOM 382 CD GLN A 26 8.335 4.839 1.952 1.00 0.00 C ATOM 383 OE1 GLN A 26 9.042 5.846 1.880 1.00 0.00 O ATOM 384 NE2 GLN A 26 7.587 4.580 3.019 1.00 0.00 N ATOM 0 H GLN A 26 11.734 3.584 -1.205 1.00 0.00 H new ATOM 0 HA GLN A 26 11.007 3.785 1.513 1.00 0.00 H new ATOM 0 HB2 GLN A 26 9.771 4.736 -0.450 1.00 0.00 H new ATOM 0 HB3 GLN A 26 9.316 3.116 -0.939 1.00 0.00 H new ATOM 0 HG2 GLN A 26 7.418 4.116 0.152 1.00 0.00 H new ATOM 0 HG3 GLN A 26 8.031 2.852 1.200 1.00 0.00 H new ATOM 0 HE21 GLN A 26 7.013 3.737 3.047 1.00 0.00 H new ATOM 0 HE22 GLN A 26 7.587 5.224 3.810 1.00 0.00 H new ATOM 393 N ALA A 27 10.837 0.749 0.236 1.00 0.00 N ATOM 394 CA ALA A 27 10.650 -0.682 0.523 1.00 0.00 C ATOM 395 C ALA A 27 11.697 -1.210 1.524 1.00 0.00 C ATOM 396 O ALA A 27 11.332 -1.793 2.559 1.00 0.00 O ATOM 397 CB ALA A 27 10.693 -1.487 -0.781 1.00 0.00 C ATOM 0 H ALA A 27 11.212 0.933 -0.694 1.00 0.00 H new ATOM 0 HA ALA A 27 9.672 -0.805 0.988 1.00 0.00 H new ATOM 0 HB1 ALA A 27 10.554 -2.545 -0.560 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.898 -1.147 -1.445 1.00 0.00 H new ATOM 0 HB3 ALA A 27 11.658 -1.342 -1.267 1.00 0.00 H new ATOM 403 N GLU A 28 12.989 -0.980 1.209 1.00 0.00 N ATOM 404 CA GLU A 28 14.127 -1.525 1.984 1.00 0.00 C ATOM 405 C GLU A 28 14.284 -0.794 3.324 1.00 0.00 C ATOM 406 O GLU A 28 14.648 -1.415 4.325 1.00 0.00 O ATOM 407 CB GLU A 28 15.449 -1.452 1.167 1.00 0.00 C ATOM 408 CG GLU A 28 15.952 -0.026 0.839 1.00 0.00 C ATOM 409 CD GLU A 28 17.188 -0.010 -0.070 1.00 0.00 C ATOM 410 OE1 GLU A 28 17.034 -0.203 -1.297 1.00 0.00 O ATOM 411 OE2 GLU A 28 18.317 0.167 0.440 1.00 0.00 O ATOM 0 H GLU A 28 13.274 -0.412 0.411 1.00 0.00 H new ATOM 0 HA GLU A 28 13.911 -2.573 2.190 1.00 0.00 H new ATOM 0 HB2 GLU A 28 16.228 -1.974 1.722 1.00 0.00 H new ATOM 0 HB3 GLU A 28 15.308 -1.993 0.231 1.00 0.00 H new ATOM 0 HG2 GLU A 28 15.149 0.533 0.358 1.00 0.00 H new ATOM 0 HG3 GLU A 28 16.187 0.491 1.769 1.00 0.00 H new ATOM 418 N THR A 29 13.998 0.527 3.326 1.00 0.00 N ATOM 419 CA THR A 29 14.051 1.356 4.539 1.00 0.00 C ATOM 420 C THR A 29 12.947 0.920 5.512 1.00 0.00 C ATOM 421 O THR A 29 13.219 0.698 6.683 1.00 0.00 O ATOM 422 CB THR A 29 13.945 2.890 4.233 1.00 0.00 C ATOM 423 OG1 THR A 29 15.036 3.290 3.384 1.00 0.00 O ATOM 424 CG2 THR A 29 13.967 3.755 5.511 1.00 0.00 C ATOM 0 H THR A 29 13.726 1.041 2.488 1.00 0.00 H new ATOM 0 HA THR A 29 15.028 1.201 4.997 1.00 0.00 H new ATOM 0 HB THR A 29 12.987 3.050 3.739 1.00 0.00 H new ATOM 0 HG1 THR A 29 14.807 3.106 2.449 1.00 0.00 H new ATOM 0 HG21 THR A 29 13.891 4.808 5.239 1.00 0.00 H new ATOM 0 HG22 THR A 29 13.126 3.483 6.149 1.00 0.00 H new ATOM 0 HG23 THR A 29 14.900 3.586 6.049 1.00 0.00 H new ATOM 432 N TYR A 30 11.717 0.745 4.992 1.00 0.00 N ATOM 433 CA TYR A 30 10.568 0.261 5.789 1.00 0.00 C ATOM 434 C TYR A 30 10.894 -1.094 6.467 1.00 0.00 C ATOM 435 O TYR A 30 10.548 -1.315 7.634 1.00 0.00 O ATOM 436 CB TYR A 30 9.324 0.128 4.881 1.00 0.00 C ATOM 437 CG TYR A 30 8.089 -0.437 5.585 1.00 0.00 C ATOM 438 CD1 TYR A 30 7.386 0.327 6.520 1.00 0.00 C ATOM 439 CD2 TYR A 30 7.646 -1.740 5.339 1.00 0.00 C ATOM 440 CE1 TYR A 30 6.295 -0.189 7.180 1.00 0.00 C ATOM 441 CE2 TYR A 30 6.552 -2.252 5.989 1.00 0.00 C ATOM 442 CZ TYR A 30 5.883 -1.474 6.910 1.00 0.00 C ATOM 443 OH TYR A 30 4.807 -1.991 7.573 1.00 0.00 O ATOM 0 H TYR A 30 11.490 0.933 4.015 1.00 0.00 H new ATOM 0 HA TYR A 30 10.360 0.985 6.576 1.00 0.00 H new ATOM 0 HB2 TYR A 30 9.079 1.109 4.474 1.00 0.00 H new ATOM 0 HB3 TYR A 30 9.572 -0.515 4.036 1.00 0.00 H new ATOM 0 HD1 TYR A 30 7.704 1.338 6.728 1.00 0.00 H new ATOM 0 HD2 TYR A 30 8.174 -2.354 4.625 1.00 0.00 H new ATOM 0 HE1 TYR A 30 5.765 0.410 7.905 1.00 0.00 H new ATOM 0 HE2 TYR A 30 6.217 -3.257 5.781 1.00 0.00 H new ATOM 0 HH TYR A 30 3.985 -1.766 7.089 1.00 0.00 H new ATOM 453 N TRP A 31 11.579 -1.969 5.710 1.00 0.00 N ATOM 454 CA TRP A 31 12.021 -3.294 6.184 1.00 0.00 C ATOM 455 C TRP A 31 12.990 -3.149 7.380 1.00 0.00 C ATOM 456 O TRP A 31 12.731 -3.683 8.459 1.00 0.00 O ATOM 457 CB TRP A 31 12.688 -4.067 5.011 1.00 0.00 C ATOM 458 CG TRP A 31 13.175 -5.464 5.352 1.00 0.00 C ATOM 459 CD1 TRP A 31 14.393 -5.812 5.884 1.00 0.00 C ATOM 460 CD2 TRP A 31 12.451 -6.692 5.183 1.00 0.00 C ATOM 461 NE1 TRP A 31 14.463 -7.168 6.054 1.00 0.00 N ATOM 462 CE2 TRP A 31 13.288 -7.733 5.627 1.00 0.00 C ATOM 463 CE3 TRP A 31 11.173 -7.011 4.700 1.00 0.00 C ATOM 464 CZ2 TRP A 31 12.890 -9.067 5.605 1.00 0.00 C ATOM 465 CZ3 TRP A 31 10.782 -8.339 4.675 1.00 0.00 C ATOM 466 CH2 TRP A 31 11.639 -9.352 5.124 1.00 0.00 C ATOM 0 H TRP A 31 11.844 -1.776 4.744 1.00 0.00 H new ATOM 0 HA TRP A 31 11.156 -3.860 6.530 1.00 0.00 H new ATOM 0 HB2 TRP A 31 11.973 -4.139 4.191 1.00 0.00 H new ATOM 0 HB3 TRP A 31 13.534 -3.484 4.647 1.00 0.00 H new ATOM 0 HD1 TRP A 31 15.181 -5.116 6.132 1.00 0.00 H new ATOM 0 HE1 TRP A 31 15.260 -7.677 6.436 1.00 0.00 H new ATOM 0 HE3 TRP A 31 10.506 -6.235 4.354 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 13.545 -9.851 5.955 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 9.801 -8.598 4.304 1.00 0.00 H new ATOM 0 HH2 TRP A 31 11.307 -10.379 5.090 1.00 0.00 H new ATOM 477 N LYS A 32 14.087 -2.384 7.177 1.00 0.00 N ATOM 478 CA LYS A 32 15.162 -2.230 8.187 1.00 0.00 C ATOM 479 C LYS A 32 14.713 -1.396 9.407 1.00 0.00 C ATOM 480 O LYS A 32 15.344 -1.458 10.466 1.00 0.00 O ATOM 481 CB LYS A 32 16.477 -1.696 7.526 1.00 0.00 C ATOM 482 CG LYS A 32 16.375 -0.337 6.786 1.00 0.00 C ATOM 483 CD LYS A 32 16.410 0.903 7.714 1.00 0.00 C ATOM 484 CE LYS A 32 17.808 1.176 8.281 1.00 0.00 C ATOM 485 NZ LYS A 32 18.806 1.419 7.201 1.00 0.00 N ATOM 0 H LYS A 32 14.252 -1.860 6.317 1.00 0.00 H new ATOM 0 HA LYS A 32 15.386 -3.219 8.586 1.00 0.00 H new ATOM 0 HB2 LYS A 32 17.237 -1.606 8.302 1.00 0.00 H new ATOM 0 HB3 LYS A 32 16.832 -2.445 6.818 1.00 0.00 H new ATOM 0 HG2 LYS A 32 17.195 -0.264 6.072 1.00 0.00 H new ATOM 0 HG3 LYS A 32 15.449 -0.319 6.211 1.00 0.00 H new ATOM 0 HD2 LYS A 32 16.070 1.777 7.159 1.00 0.00 H new ATOM 0 HD3 LYS A 32 15.711 0.756 8.537 1.00 0.00 H new ATOM 0 HE2 LYS A 32 17.769 2.042 8.942 1.00 0.00 H new ATOM 0 HE3 LYS A 32 18.127 0.327 8.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 19.643 1.890 7.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 19.088 0.512 6.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 18.384 2.025 6.469 1.00 0.00 H new ATOM 499 N LEU A 33 13.626 -0.614 9.241 1.00 0.00 N ATOM 500 CA LEU A 33 12.997 0.125 10.349 1.00 0.00 C ATOM 501 C LEU A 33 12.259 -0.859 11.270 1.00 0.00 C ATOM 502 O LEU A 33 12.383 -0.770 12.493 1.00 0.00 O ATOM 503 CB LEU A 33 12.014 1.214 9.828 1.00 0.00 C ATOM 504 CG LEU A 33 12.644 2.466 9.135 1.00 0.00 C ATOM 505 CD1 LEU A 33 11.553 3.438 8.621 1.00 0.00 C ATOM 506 CD2 LEU A 33 13.636 3.181 10.074 1.00 0.00 C ATOM 0 H LEU A 33 13.165 -0.479 8.341 1.00 0.00 H new ATOM 0 HA LEU A 33 13.783 0.633 10.908 1.00 0.00 H new ATOM 0 HB2 LEU A 33 11.331 0.743 9.121 1.00 0.00 H new ATOM 0 HB3 LEU A 33 11.414 1.559 10.670 1.00 0.00 H new ATOM 0 HG LEU A 33 13.203 2.116 8.267 1.00 0.00 H new ATOM 0 HD11 LEU A 33 12.026 4.297 8.145 1.00 0.00 H new ATOM 0 HD12 LEU A 33 10.920 2.925 7.897 1.00 0.00 H new ATOM 0 HD13 LEU A 33 10.944 3.777 9.459 1.00 0.00 H new ATOM 0 HD21 LEU A 33 14.058 4.048 9.565 1.00 0.00 H new ATOM 0 HD22 LEU A 33 13.115 3.507 10.974 1.00 0.00 H new ATOM 0 HD23 LEU A 33 14.437 2.495 10.347 1.00 0.00 H new ATOM 518 N LEU A 34 11.504 -1.801 10.660 1.00 0.00 N ATOM 519 CA LEU A 34 10.736 -2.819 11.407 1.00 0.00 C ATOM 520 C LEU A 34 11.671 -3.807 12.126 1.00 0.00 C ATOM 521 O LEU A 34 11.505 -4.055 13.324 1.00 0.00 O ATOM 522 CB LEU A 34 9.762 -3.596 10.486 1.00 0.00 C ATOM 523 CG LEU A 34 8.551 -2.800 9.905 1.00 0.00 C ATOM 524 CD1 LEU A 34 7.634 -3.725 9.085 1.00 0.00 C ATOM 525 CD2 LEU A 34 7.760 -2.082 11.015 1.00 0.00 C ATOM 0 H LEU A 34 11.411 -1.876 9.647 1.00 0.00 H new ATOM 0 HA LEU A 34 10.148 -2.283 12.152 1.00 0.00 H new ATOM 0 HB2 LEU A 34 10.334 -4.000 9.651 1.00 0.00 H new ATOM 0 HB3 LEU A 34 9.372 -4.446 11.046 1.00 0.00 H new ATOM 0 HG LEU A 34 8.948 -2.033 9.239 1.00 0.00 H new ATOM 0 HD11 LEU A 34 6.797 -3.150 8.690 1.00 0.00 H new ATOM 0 HD12 LEU A 34 8.199 -4.158 8.260 1.00 0.00 H new ATOM 0 HD13 LEU A 34 7.256 -4.523 9.724 1.00 0.00 H new ATOM 0 HD21 LEU A 34 6.925 -1.538 10.573 1.00 0.00 H new ATOM 0 HD22 LEU A 34 7.380 -2.817 11.725 1.00 0.00 H new ATOM 0 HD23 LEU A 34 8.415 -1.382 11.534 1.00 0.00 H new ATOM 537 N THR A 35 12.673 -4.336 11.390 1.00 0.00 N ATOM 538 CA THR A 35 13.624 -5.349 11.915 1.00 0.00 C ATOM 539 C THR A 35 14.348 -4.853 13.185 1.00 0.00 C ATOM 540 O THR A 35 14.739 -5.654 14.044 1.00 0.00 O ATOM 541 CB THR A 35 14.682 -5.758 10.834 1.00 0.00 C ATOM 542 OG1 THR A 35 15.386 -4.596 10.376 1.00 0.00 O ATOM 543 CG2 THR A 35 14.041 -6.478 9.631 1.00 0.00 C ATOM 0 H THR A 35 12.848 -4.076 10.419 1.00 0.00 H new ATOM 0 HA THR A 35 13.029 -6.225 12.175 1.00 0.00 H new ATOM 0 HB THR A 35 15.374 -6.455 11.307 1.00 0.00 H new ATOM 0 HG1 THR A 35 16.149 -4.871 9.826 1.00 0.00 H new ATOM 0 HG21 THR A 35 14.815 -6.741 8.910 1.00 0.00 H new ATOM 0 HG22 THR A 35 13.541 -7.384 9.973 1.00 0.00 H new ATOM 0 HG23 THR A 35 13.313 -5.819 9.158 1.00 0.00 H new ATOM 551 N SER A 36 14.493 -3.520 13.292 1.00 0.00 N ATOM 552 CA SER A 36 15.111 -2.857 14.443 1.00 0.00 C ATOM 553 C SER A 36 14.072 -2.586 15.557 1.00 0.00 C ATOM 554 O SER A 36 14.258 -3.019 16.701 1.00 0.00 O ATOM 555 CB SER A 36 15.776 -1.549 13.967 1.00 0.00 C ATOM 556 OG SER A 36 16.705 -1.803 12.921 1.00 0.00 O ATOM 0 H SER A 36 14.179 -2.870 12.571 1.00 0.00 H new ATOM 0 HA SER A 36 15.870 -3.511 14.872 1.00 0.00 H new ATOM 0 HB2 SER A 36 15.012 -0.854 13.619 1.00 0.00 H new ATOM 0 HB3 SER A 36 16.286 -1.070 14.803 1.00 0.00 H new ATOM 0 HG SER A 36 16.260 -1.693 12.055 1.00 0.00 H new ATOM 562 N VAL A 37 12.966 -1.887 15.211 1.00 0.00 N ATOM 563 CA VAL A 37 11.926 -1.449 16.184 1.00 0.00 C ATOM 564 C VAL A 37 10.501 -1.747 15.635 1.00 0.00 C ATOM 565 O VAL A 37 10.299 -1.714 14.419 1.00 0.00 O ATOM 566 CB VAL A 37 12.053 0.096 16.529 1.00 0.00 C ATOM 567 CG1 VAL A 37 13.374 0.402 17.285 1.00 0.00 C ATOM 568 CG2 VAL A 37 11.913 0.987 15.263 1.00 0.00 C ATOM 0 H VAL A 37 12.765 -1.609 14.251 1.00 0.00 H new ATOM 0 HA VAL A 37 12.086 -2.016 17.101 1.00 0.00 H new ATOM 0 HB VAL A 37 11.224 0.343 17.192 1.00 0.00 H new ATOM 0 HG11 VAL A 37 13.428 1.468 17.505 1.00 0.00 H new ATOM 0 HG12 VAL A 37 13.399 -0.163 18.217 1.00 0.00 H new ATOM 0 HG13 VAL A 37 14.223 0.116 16.664 1.00 0.00 H new ATOM 0 HG21 VAL A 37 12.006 2.036 15.544 1.00 0.00 H new ATOM 0 HG22 VAL A 37 12.697 0.732 14.550 1.00 0.00 H new ATOM 0 HG23 VAL A 37 10.938 0.819 14.806 1.00 0.00 H new ATOM 578 N PRO A 38 9.484 -2.037 16.533 1.00 0.00 N ATOM 579 CA PRO A 38 8.072 -2.280 16.117 1.00 0.00 C ATOM 580 C PRO A 38 7.448 -1.080 15.370 1.00 0.00 C ATOM 581 O PRO A 38 7.793 0.077 15.639 1.00 0.00 O ATOM 582 CB PRO A 38 7.327 -2.561 17.458 1.00 0.00 C ATOM 583 CG PRO A 38 8.411 -2.965 18.412 1.00 0.00 C ATOM 584 CD PRO A 38 9.633 -2.172 18.005 1.00 0.00 C ATOM 0 HA PRO A 38 8.002 -3.104 15.406 1.00 0.00 H new ATOM 0 HB2 PRO A 38 6.797 -1.676 17.811 1.00 0.00 H new ATOM 0 HB3 PRO A 38 6.585 -3.351 17.342 1.00 0.00 H new ATOM 0 HG2 PRO A 38 8.128 -2.746 19.442 1.00 0.00 H new ATOM 0 HG3 PRO A 38 8.603 -4.036 18.355 1.00 0.00 H new ATOM 0 HD2 PRO A 38 9.662 -1.199 18.496 1.00 0.00 H new ATOM 0 HD3 PRO A 38 10.555 -2.691 18.269 1.00 0.00 H new ATOM 592 N GLY A 39 6.509 -1.374 14.451 1.00 0.00 N ATOM 593 CA GLY A 39 5.873 -0.356 13.604 1.00 0.00 C ATOM 594 C GLY A 39 4.678 0.331 14.253 1.00 0.00 C ATOM 595 O GLY A 39 3.617 0.469 13.634 1.00 0.00 O ATOM 0 H GLY A 39 6.173 -2.321 14.278 1.00 0.00 H new ATOM 0 HA2 GLY A 39 6.615 0.399 13.342 1.00 0.00 H new ATOM 0 HA3 GLY A 39 5.550 -0.823 12.673 1.00 0.00 H new ATOM 599 N SER A 40 4.855 0.764 15.510 1.00 0.00 N ATOM 600 CA SER A 40 3.830 1.500 16.264 1.00 0.00 C ATOM 601 C SER A 40 3.950 3.006 15.961 1.00 0.00 C ATOM 602 O SER A 40 2.968 3.664 15.601 1.00 0.00 O ATOM 603 CB SER A 40 4.005 1.227 17.774 1.00 0.00 C ATOM 604 OG SER A 40 4.053 -0.169 18.043 1.00 0.00 O ATOM 0 H SER A 40 5.717 0.613 16.034 1.00 0.00 H new ATOM 0 HA SER A 40 2.837 1.165 15.964 1.00 0.00 H new ATOM 0 HB2 SER A 40 4.921 1.700 18.128 1.00 0.00 H new ATOM 0 HB3 SER A 40 3.180 1.678 18.326 1.00 0.00 H new ATOM 0 HG SER A 40 4.166 -0.313 19.006 1.00 0.00 H new ATOM 610 N LYS A 41 5.186 3.525 16.105 1.00 0.00 N ATOM 611 CA LYS A 41 5.520 4.935 15.805 1.00 0.00 C ATOM 612 C LYS A 41 5.619 5.163 14.289 1.00 0.00 C ATOM 613 O LYS A 41 5.402 6.282 13.800 1.00 0.00 O ATOM 614 CB LYS A 41 6.850 5.373 16.503 1.00 0.00 C ATOM 615 CG LYS A 41 8.171 4.803 15.918 1.00 0.00 C ATOM 616 CD LYS A 41 8.400 3.299 16.193 1.00 0.00 C ATOM 617 CE LYS A 41 8.529 2.972 17.690 1.00 0.00 C ATOM 618 NZ LYS A 41 9.579 3.797 18.346 1.00 0.00 N ATOM 0 H LYS A 41 5.983 2.979 16.433 1.00 0.00 H new ATOM 0 HA LYS A 41 4.712 5.550 16.201 1.00 0.00 H new ATOM 0 HB2 LYS A 41 6.907 6.461 16.472 1.00 0.00 H new ATOM 0 HB3 LYS A 41 6.792 5.086 17.553 1.00 0.00 H new ATOM 0 HG2 LYS A 41 8.176 4.967 14.840 1.00 0.00 H new ATOM 0 HG3 LYS A 41 9.008 5.366 16.330 1.00 0.00 H new ATOM 0 HD2 LYS A 41 7.572 2.729 15.773 1.00 0.00 H new ATOM 0 HD3 LYS A 41 9.304 2.975 15.677 1.00 0.00 H new ATOM 0 HE2 LYS A 41 7.572 3.142 18.183 1.00 0.00 H new ATOM 0 HE3 LYS A 41 8.767 1.915 17.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 9.768 3.425 19.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 10.452 3.761 17.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 9.253 4.782 18.417 1.00 0.00 H new ATOM 632 N LEU A 42 5.958 4.082 13.555 1.00 0.00 N ATOM 633 CA LEU A 42 6.159 4.137 12.108 1.00 0.00 C ATOM 634 C LEU A 42 4.793 4.238 11.416 1.00 0.00 C ATOM 635 O LEU A 42 4.051 3.255 11.322 1.00 0.00 O ATOM 636 CB LEU A 42 6.957 2.890 11.644 1.00 0.00 C ATOM 637 CG LEU A 42 8.363 2.699 12.317 1.00 0.00 C ATOM 638 CD1 LEU A 42 9.006 1.355 11.915 1.00 0.00 C ATOM 639 CD2 LEU A 42 9.302 3.891 12.003 1.00 0.00 C ATOM 0 H LEU A 42 6.097 3.154 13.955 1.00 0.00 H new ATOM 0 HA LEU A 42 6.742 5.017 11.836 1.00 0.00 H new ATOM 0 HB2 LEU A 42 6.356 2.002 11.840 1.00 0.00 H new ATOM 0 HB3 LEU A 42 7.095 2.950 10.564 1.00 0.00 H new ATOM 0 HG LEU A 42 8.209 2.675 13.396 1.00 0.00 H new ATOM 0 HD11 LEU A 42 9.978 1.257 12.399 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.360 0.535 12.228 1.00 0.00 H new ATOM 0 HD13 LEU A 42 9.135 1.323 10.833 1.00 0.00 H new ATOM 0 HD21 LEU A 42 10.267 3.730 12.483 1.00 0.00 H new ATOM 0 HD22 LEU A 42 9.441 3.970 10.925 1.00 0.00 H new ATOM 0 HD23 LEU A 42 8.859 4.813 12.380 1.00 0.00 H new ATOM 651 N ARG A 43 4.470 5.463 10.971 1.00 0.00 N ATOM 652 CA ARG A 43 3.205 5.796 10.304 1.00 0.00 C ATOM 653 C ARG A 43 3.535 6.486 8.976 1.00 0.00 C ATOM 654 O ARG A 43 4.395 7.378 8.932 1.00 0.00 O ATOM 655 CB ARG A 43 2.331 6.718 11.212 1.00 0.00 C ATOM 656 CG ARG A 43 1.911 6.092 12.571 1.00 0.00 C ATOM 657 CD ARG A 43 1.138 4.771 12.396 1.00 0.00 C ATOM 658 NE ARG A 43 0.656 4.215 13.680 1.00 0.00 N ATOM 659 CZ ARG A 43 -0.493 3.543 13.848 1.00 0.00 C ATOM 660 NH1 ARG A 43 -1.339 3.380 12.831 1.00 0.00 N ATOM 661 NH2 ARG A 43 -0.806 3.070 15.049 1.00 0.00 N ATOM 0 H ARG A 43 5.094 6.264 11.068 1.00 0.00 H new ATOM 0 HA ARG A 43 2.629 4.890 10.116 1.00 0.00 H new ATOM 0 HB2 ARG A 43 2.882 7.638 11.407 1.00 0.00 H new ATOM 0 HB3 ARG A 43 1.431 6.996 10.663 1.00 0.00 H new ATOM 0 HG2 ARG A 43 2.800 5.912 13.175 1.00 0.00 H new ATOM 0 HG3 ARG A 43 1.292 6.802 13.119 1.00 0.00 H new ATOM 0 HD2 ARG A 43 0.287 4.938 11.735 1.00 0.00 H new ATOM 0 HD3 ARG A 43 1.782 4.040 11.908 1.00 0.00 H new ATOM 0 HE ARG A 43 1.244 4.354 14.502 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -1.115 3.768 11.914 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -2.210 2.867 12.969 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -0.175 3.219 15.836 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -1.678 2.558 15.184 1.00 0.00 H new ATOM 675 N LEU A 44 2.865 6.057 7.901 1.00 0.00 N ATOM 676 CA LEU A 44 3.168 6.513 6.535 1.00 0.00 C ATOM 677 C LEU A 44 2.774 7.991 6.342 1.00 0.00 C ATOM 678 O LEU A 44 3.523 8.771 5.739 1.00 0.00 O ATOM 679 CB LEU A 44 2.451 5.597 5.514 1.00 0.00 C ATOM 680 CG LEU A 44 2.786 4.070 5.625 1.00 0.00 C ATOM 681 CD1 LEU A 44 2.050 3.260 4.548 1.00 0.00 C ATOM 682 CD2 LEU A 44 4.311 3.804 5.573 1.00 0.00 C ATOM 0 H LEU A 44 2.099 5.386 7.950 1.00 0.00 H new ATOM 0 HA LEU A 44 4.243 6.447 6.368 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.375 5.724 5.631 1.00 0.00 H new ATOM 0 HB3 LEU A 44 2.704 5.934 4.509 1.00 0.00 H new ATOM 0 HG LEU A 44 2.433 3.737 6.601 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.302 2.205 4.651 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.974 3.389 4.667 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.350 3.610 3.561 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.496 2.733 5.653 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.713 4.172 4.629 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.799 4.320 6.400 1.00 0.00 H new ATOM 694 N THR A 45 1.593 8.352 6.873 1.00 0.00 N ATOM 695 CA THR A 45 1.075 9.734 6.889 1.00 0.00 C ATOM 696 C THR A 45 0.442 10.020 8.268 1.00 0.00 C ATOM 697 O THR A 45 0.458 9.157 9.151 1.00 0.00 O ATOM 698 CB THR A 45 0.011 9.956 5.749 1.00 0.00 C ATOM 699 OG1 THR A 45 -1.016 8.956 5.831 1.00 0.00 O ATOM 700 CG2 THR A 45 0.638 9.930 4.343 1.00 0.00 C ATOM 0 H THR A 45 0.960 7.682 7.310 1.00 0.00 H new ATOM 0 HA THR A 45 1.902 10.421 6.711 1.00 0.00 H new ATOM 0 HB THR A 45 -0.415 10.947 5.903 1.00 0.00 H new ATOM 0 HG1 THR A 45 -1.674 9.103 5.119 1.00 0.00 H new ATOM 0 HG21 THR A 45 -0.139 10.088 3.595 1.00 0.00 H new ATOM 0 HG22 THR A 45 1.385 10.720 4.263 1.00 0.00 H new ATOM 0 HG23 THR A 45 1.113 8.964 4.174 1.00 0.00 H new ATOM 708 N LYS A 46 -0.071 11.250 8.462 1.00 0.00 N ATOM 709 CA LYS A 46 -0.922 11.595 9.632 1.00 0.00 C ATOM 710 C LYS A 46 -2.371 11.153 9.366 1.00 0.00 C ATOM 711 O LYS A 46 -3.162 10.950 10.288 1.00 0.00 O ATOM 712 CB LYS A 46 -0.862 13.119 9.933 1.00 0.00 C ATOM 713 CG LYS A 46 -1.594 13.546 11.225 1.00 0.00 C ATOM 714 CD LYS A 46 -1.554 15.069 11.479 1.00 0.00 C ATOM 715 CE LYS A 46 -2.254 15.450 12.796 1.00 0.00 C ATOM 716 NZ LYS A 46 -2.277 16.916 13.023 1.00 0.00 N ATOM 0 H LYS A 46 0.087 12.030 7.823 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.543 11.068 10.508 1.00 0.00 H new ATOM 0 HB2 LYS A 46 0.183 13.421 10.005 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -1.293 13.660 9.091 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -2.633 13.222 11.169 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -1.145 13.032 12.075 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -0.517 15.405 11.508 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.034 15.588 10.649 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -3.276 15.071 12.783 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -1.744 14.965 13.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -2.759 17.121 13.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -1.302 17.276 13.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -2.786 17.380 12.244 1.00 0.00 H new ATOM 730 N PHE A 47 -2.691 10.985 8.078 1.00 0.00 N ATOM 731 CA PHE A 47 -4.011 10.546 7.608 1.00 0.00 C ATOM 732 C PHE A 47 -4.037 9.012 7.467 1.00 0.00 C ATOM 733 O PHE A 47 -4.962 8.463 6.883 1.00 0.00 O ATOM 734 CB PHE A 47 -4.322 11.234 6.240 1.00 0.00 C ATOM 735 CG PHE A 47 -4.018 12.732 6.229 1.00 0.00 C ATOM 736 CD1 PHE A 47 -4.840 13.630 6.903 1.00 0.00 C ATOM 737 CD2 PHE A 47 -2.904 13.238 5.557 1.00 0.00 C ATOM 738 CE1 PHE A 47 -4.561 14.986 6.903 1.00 0.00 C ATOM 739 CE2 PHE A 47 -2.627 14.592 5.556 1.00 0.00 C ATOM 740 CZ PHE A 47 -3.456 15.465 6.230 1.00 0.00 C ATOM 0 H PHE A 47 -2.029 11.153 7.320 1.00 0.00 H new ATOM 0 HA PHE A 47 -4.775 10.833 8.331 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -3.741 10.747 5.457 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -5.374 11.083 5.997 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -5.707 13.264 7.433 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -2.248 12.561 5.030 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -5.209 15.670 7.431 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -1.762 14.966 5.028 1.00 0.00 H new ATOM 0 HZ PHE A 47 -3.240 16.523 6.231 1.00 0.00 H new ATOM 750 N ASP A 48 -3.027 8.328 8.044 1.00 0.00 N ATOM 751 CA ASP A 48 -2.803 6.884 7.838 1.00 0.00 C ATOM 752 C ASP A 48 -4.002 6.040 8.330 1.00 0.00 C ATOM 753 O ASP A 48 -4.486 5.144 7.615 1.00 0.00 O ATOM 754 CB ASP A 48 -1.475 6.439 8.525 1.00 0.00 C ATOM 755 CG ASP A 48 -1.540 6.416 10.062 1.00 0.00 C ATOM 756 OD1 ASP A 48 -1.488 7.499 10.681 1.00 0.00 O ATOM 757 OD2 ASP A 48 -1.680 5.319 10.648 1.00 0.00 O ATOM 0 H ASP A 48 -2.345 8.762 8.665 1.00 0.00 H new ATOM 0 HA ASP A 48 -2.713 6.708 6.766 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.210 5.444 8.168 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.675 7.112 8.216 1.00 0.00 H new ATOM 762 N ASP A 49 -4.503 6.391 9.528 1.00 0.00 N ATOM 763 CA ASP A 49 -5.586 5.660 10.202 1.00 0.00 C ATOM 764 C ASP A 49 -6.887 5.731 9.379 1.00 0.00 C ATOM 765 O ASP A 49 -7.567 4.716 9.208 1.00 0.00 O ATOM 766 CB ASP A 49 -5.789 6.220 11.637 1.00 0.00 C ATOM 767 CG ASP A 49 -6.865 5.478 12.460 1.00 0.00 C ATOM 768 OD1 ASP A 49 -6.747 4.247 12.620 1.00 0.00 O ATOM 769 OD2 ASP A 49 -7.825 6.122 12.955 1.00 0.00 O ATOM 0 H ASP A 49 -4.164 7.195 10.057 1.00 0.00 H new ATOM 0 HA ASP A 49 -5.309 4.609 10.282 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -4.840 6.171 12.172 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -6.062 7.273 11.569 1.00 0.00 H new ATOM 774 N GLU A 50 -7.185 6.928 8.825 1.00 0.00 N ATOM 775 CA GLU A 50 -8.413 7.151 8.033 1.00 0.00 C ATOM 776 C GLU A 50 -8.314 6.488 6.649 1.00 0.00 C ATOM 777 O GLU A 50 -9.333 6.093 6.096 1.00 0.00 O ATOM 778 CB GLU A 50 -8.762 8.662 7.874 1.00 0.00 C ATOM 779 CG GLU A 50 -7.824 9.459 6.945 1.00 0.00 C ATOM 780 CD GLU A 50 -8.353 10.847 6.585 1.00 0.00 C ATOM 781 OE1 GLU A 50 -9.368 10.915 5.871 1.00 0.00 O ATOM 782 OE2 GLU A 50 -7.763 11.875 6.997 1.00 0.00 O ATOM 0 H GLU A 50 -6.592 7.753 8.912 1.00 0.00 H new ATOM 0 HA GLU A 50 -9.222 6.684 8.595 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -9.780 8.745 7.494 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -8.751 9.127 8.860 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -6.852 9.564 7.427 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -7.666 8.891 6.028 1.00 0.00 H new ATOM 789 N ILE A 51 -7.087 6.375 6.084 1.00 0.00 N ATOM 790 CA ILE A 51 -6.872 5.666 4.798 1.00 0.00 C ATOM 791 C ILE A 51 -7.356 4.209 4.919 1.00 0.00 C ATOM 792 O ILE A 51 -8.067 3.714 4.043 1.00 0.00 O ATOM 793 CB ILE A 51 -5.371 5.720 4.321 1.00 0.00 C ATOM 794 CG1 ILE A 51 -4.944 7.196 4.037 1.00 0.00 C ATOM 795 CG2 ILE A 51 -5.131 4.834 3.068 1.00 0.00 C ATOM 796 CD1 ILE A 51 -3.459 7.398 3.780 1.00 0.00 C ATOM 0 H ILE A 51 -6.237 6.762 6.494 1.00 0.00 H new ATOM 0 HA ILE A 51 -7.457 6.181 4.036 1.00 0.00 H new ATOM 0 HB ILE A 51 -4.755 5.321 5.127 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -5.500 7.559 3.172 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -5.237 7.813 4.886 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -4.084 4.899 2.771 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -5.378 3.798 3.302 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -5.762 5.182 2.250 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -3.262 8.454 3.593 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -2.891 7.072 4.651 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -3.157 6.814 2.911 1.00 0.00 H new ATOM 808 N TYR A 52 -7.001 3.567 6.048 1.00 0.00 N ATOM 809 CA TYR A 52 -7.497 2.223 6.404 1.00 0.00 C ATOM 810 C TYR A 52 -9.039 2.200 6.540 1.00 0.00 C ATOM 811 O TYR A 52 -9.701 1.320 5.977 1.00 0.00 O ATOM 812 CB TYR A 52 -6.851 1.742 7.729 1.00 0.00 C ATOM 813 CG TYR A 52 -7.471 0.448 8.292 1.00 0.00 C ATOM 814 CD1 TYR A 52 -7.135 -0.791 7.770 1.00 0.00 C ATOM 815 CD2 TYR A 52 -8.408 0.477 9.332 1.00 0.00 C ATOM 816 CE1 TYR A 52 -7.694 -1.954 8.255 1.00 0.00 C ATOM 817 CE2 TYR A 52 -8.971 -0.684 9.816 1.00 0.00 C ATOM 818 CZ TYR A 52 -8.613 -1.897 9.277 1.00 0.00 C ATOM 819 OH TYR A 52 -9.182 -3.058 9.756 1.00 0.00 O ATOM 0 H TYR A 52 -6.364 3.964 6.738 1.00 0.00 H new ATOM 0 HA TYR A 52 -7.216 1.548 5.595 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.785 1.581 7.565 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -6.943 2.532 8.475 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -6.418 -0.847 6.964 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -8.694 1.425 9.762 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -7.411 -2.907 7.834 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -9.693 -0.641 10.618 1.00 0.00 H new ATOM 0 HH TYR A 52 -8.598 -3.818 9.550 1.00 0.00 H new ATOM 829 N GLU A 53 -9.581 3.154 7.325 1.00 0.00 N ATOM 830 CA GLU A 53 -11.021 3.199 7.662 1.00 0.00 C ATOM 831 C GLU A 53 -11.867 3.348 6.390 1.00 0.00 C ATOM 832 O GLU A 53 -12.633 2.456 6.057 1.00 0.00 O ATOM 833 CB GLU A 53 -11.325 4.357 8.657 1.00 0.00 C ATOM 834 CG GLU A 53 -10.611 4.242 10.013 1.00 0.00 C ATOM 835 CD GLU A 53 -10.884 5.437 10.950 1.00 0.00 C ATOM 836 OE1 GLU A 53 -10.588 6.590 10.564 1.00 0.00 O ATOM 837 OE2 GLU A 53 -11.427 5.238 12.061 1.00 0.00 O ATOM 0 H GLU A 53 -9.038 3.911 7.741 1.00 0.00 H new ATOM 0 HA GLU A 53 -11.284 2.259 8.146 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -11.042 5.301 8.192 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -12.400 4.396 8.830 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -10.928 3.323 10.506 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -9.537 4.159 9.845 1.00 0.00 H new ATOM 844 N ASN A 54 -11.660 4.446 5.646 1.00 0.00 N ATOM 845 CA ASN A 54 -12.392 4.723 4.391 1.00 0.00 C ATOM 846 C ASN A 54 -12.127 3.637 3.322 1.00 0.00 C ATOM 847 O ASN A 54 -12.922 3.497 2.394 1.00 0.00 O ATOM 848 CB ASN A 54 -12.058 6.130 3.832 1.00 0.00 C ATOM 849 CG ASN A 54 -12.488 7.274 4.759 1.00 0.00 C ATOM 850 OD1 ASN A 54 -13.628 7.734 4.718 1.00 0.00 O ATOM 851 ND2 ASN A 54 -11.567 7.780 5.564 1.00 0.00 N ATOM 0 H ASN A 54 -10.983 5.168 5.893 1.00 0.00 H new ATOM 0 HA ASN A 54 -13.454 4.701 4.636 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -10.984 6.198 3.658 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -12.546 6.253 2.865 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -11.796 8.569 6.169 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -10.628 7.381 5.580 1.00 0.00 H new ATOM 858 N PHE A 55 -11.016 2.869 3.453 1.00 0.00 N ATOM 859 CA PHE A 55 -10.779 1.699 2.584 1.00 0.00 C ATOM 860 C PHE A 55 -11.772 0.574 2.925 1.00 0.00 C ATOM 861 O PHE A 55 -12.411 0.044 2.042 1.00 0.00 O ATOM 862 CB PHE A 55 -9.310 1.183 2.672 1.00 0.00 C ATOM 863 CG PHE A 55 -8.841 0.267 1.513 1.00 0.00 C ATOM 864 CD1 PHE A 55 -9.591 0.106 0.337 1.00 0.00 C ATOM 865 CD2 PHE A 55 -7.631 -0.413 1.601 1.00 0.00 C ATOM 866 CE1 PHE A 55 -9.145 -0.701 -0.691 1.00 0.00 C ATOM 867 CE2 PHE A 55 -7.189 -1.225 0.568 1.00 0.00 C ATOM 868 CZ PHE A 55 -7.945 -1.367 -0.575 1.00 0.00 C ATOM 0 H PHE A 55 -10.283 3.039 4.142 1.00 0.00 H new ATOM 0 HA PHE A 55 -10.941 2.019 1.555 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -8.645 2.045 2.719 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -9.193 0.639 3.609 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -10.534 0.623 0.235 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -7.026 -0.307 2.489 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -9.738 -0.810 -1.587 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -6.249 -1.748 0.660 1.00 0.00 H new ATOM 0 HZ PHE A 55 -7.597 -1.999 -1.379 1.00 0.00 H new ATOM 878 N MET A 56 -11.917 0.237 4.220 1.00 0.00 N ATOM 879 CA MET A 56 -12.803 -0.876 4.651 1.00 0.00 C ATOM 880 C MET A 56 -14.293 -0.466 4.643 1.00 0.00 C ATOM 881 O MET A 56 -15.176 -1.325 4.552 1.00 0.00 O ATOM 882 CB MET A 56 -12.368 -1.422 6.042 1.00 0.00 C ATOM 883 CG MET A 56 -12.446 -0.431 7.198 1.00 0.00 C ATOM 884 SD MET A 56 -11.941 -1.157 8.773 1.00 0.00 S ATOM 885 CE MET A 56 -13.062 -2.546 8.929 1.00 0.00 C ATOM 0 H MET A 56 -11.439 0.712 4.986 1.00 0.00 H new ATOM 0 HA MET A 56 -12.695 -1.681 3.924 1.00 0.00 H new ATOM 0 HB2 MET A 56 -12.991 -2.283 6.284 1.00 0.00 H new ATOM 0 HB3 MET A 56 -11.342 -1.782 5.965 1.00 0.00 H new ATOM 0 HG2 MET A 56 -11.812 0.428 6.978 1.00 0.00 H new ATOM 0 HG3 MET A 56 -13.467 -0.059 7.285 1.00 0.00 H new ATOM 0 HE1 MET A 56 -13.307 -2.700 9.980 1.00 0.00 H new ATOM 0 HE2 MET A 56 -13.975 -2.341 8.370 1.00 0.00 H new ATOM 0 HE3 MET A 56 -12.587 -3.443 8.532 1.00 0.00 H new ATOM 895 N GLU A 57 -14.563 0.848 4.721 1.00 0.00 N ATOM 896 CA GLU A 57 -15.932 1.396 4.706 1.00 0.00 C ATOM 897 C GLU A 57 -16.472 1.447 3.266 1.00 0.00 C ATOM 898 O GLU A 57 -17.566 0.949 2.986 1.00 0.00 O ATOM 899 CB GLU A 57 -15.964 2.808 5.358 1.00 0.00 C ATOM 900 CG GLU A 57 -15.616 2.832 6.860 1.00 0.00 C ATOM 901 CD GLU A 57 -15.556 4.255 7.451 1.00 0.00 C ATOM 902 OE1 GLU A 57 -14.647 5.024 7.077 1.00 0.00 O ATOM 903 OE2 GLU A 57 -16.431 4.620 8.268 1.00 0.00 O ATOM 0 H GLU A 57 -13.838 1.562 4.796 1.00 0.00 H new ATOM 0 HA GLU A 57 -16.575 0.739 5.291 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -15.266 3.455 4.827 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -16.958 3.233 5.222 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.358 2.250 7.407 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -14.654 2.343 7.010 1.00 0.00 H new ATOM 910 N ARG A 58 -15.683 2.042 2.351 1.00 0.00 N ATOM 911 CA ARG A 58 -16.091 2.205 0.933 1.00 0.00 C ATOM 912 C ARG A 58 -15.808 0.924 0.123 1.00 0.00 C ATOM 913 O ARG A 58 -16.453 0.685 -0.903 1.00 0.00 O ATOM 914 CB ARG A 58 -15.402 3.444 0.279 1.00 0.00 C ATOM 915 CG ARG A 58 -15.984 4.824 0.702 1.00 0.00 C ATOM 916 CD ARG A 58 -15.741 5.191 2.182 1.00 0.00 C ATOM 917 NE ARG A 58 -16.363 6.478 2.552 1.00 0.00 N ATOM 918 CZ ARG A 58 -16.571 6.916 3.808 1.00 0.00 C ATOM 919 NH1 ARG A 58 -16.188 6.203 4.864 1.00 0.00 N ATOM 920 NH2 ARG A 58 -17.158 8.088 3.997 1.00 0.00 N ATOM 0 H ARG A 58 -14.759 2.419 2.563 1.00 0.00 H new ATOM 0 HA ARG A 58 -17.167 2.381 0.920 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -14.341 3.423 0.528 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -15.477 3.352 -0.805 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -15.546 5.598 0.072 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -17.057 4.826 0.511 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -16.139 4.402 2.819 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -14.668 5.242 2.370 1.00 0.00 H new ATOM 0 HE ARG A 58 -16.661 7.088 1.790 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -15.726 5.303 4.732 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -16.357 6.556 5.806 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -17.447 8.649 3.196 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -17.321 8.430 4.944 1.00 0.00 H new ATOM 934 N PHE A 59 -14.828 0.118 0.582 1.00 0.00 N ATOM 935 CA PHE A 59 -14.511 -1.209 -0.008 1.00 0.00 C ATOM 936 C PHE A 59 -14.586 -2.289 1.102 1.00 0.00 C ATOM 937 O PHE A 59 -13.547 -2.699 1.643 1.00 0.00 O ATOM 938 CB PHE A 59 -13.084 -1.240 -0.659 1.00 0.00 C ATOM 939 CG PHE A 59 -12.830 -0.253 -1.798 1.00 0.00 C ATOM 940 CD1 PHE A 59 -12.737 1.120 -1.563 1.00 0.00 C ATOM 941 CD2 PHE A 59 -12.655 -0.706 -3.100 1.00 0.00 C ATOM 942 CE1 PHE A 59 -12.482 1.998 -2.597 1.00 0.00 C ATOM 943 CE2 PHE A 59 -12.402 0.172 -4.127 1.00 0.00 C ATOM 944 CZ PHE A 59 -12.317 1.525 -3.879 1.00 0.00 C ATOM 0 H PHE A 59 -14.232 0.365 1.372 1.00 0.00 H new ATOM 0 HA PHE A 59 -15.240 -1.408 -0.793 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -12.348 -1.054 0.124 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -12.902 -2.247 -1.034 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -12.866 1.500 -0.560 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -12.719 -1.764 -3.308 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -12.412 3.058 -2.400 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -12.269 -0.200 -5.132 1.00 0.00 H new ATOM 0 HZ PHE A 59 -12.121 2.212 -4.689 1.00 0.00 H new ATOM 954 N PRO A 60 -15.809 -2.769 1.494 1.00 0.00 N ATOM 955 CA PRO A 60 -15.939 -3.928 2.407 1.00 0.00 C ATOM 956 C PRO A 60 -15.720 -5.270 1.671 1.00 0.00 C ATOM 957 O PRO A 60 -15.877 -6.347 2.253 1.00 0.00 O ATOM 958 CB PRO A 60 -17.373 -3.778 2.952 1.00 0.00 C ATOM 959 CG PRO A 60 -18.126 -3.156 1.821 1.00 0.00 C ATOM 960 CD PRO A 60 -17.147 -2.219 1.127 1.00 0.00 C ATOM 0 HA PRO A 60 -15.189 -3.941 3.198 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -17.797 -4.743 3.231 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -17.398 -3.149 3.842 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -18.493 -3.917 1.132 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -18.996 -2.610 2.186 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -17.295 -2.214 0.047 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -17.265 -1.191 1.470 1.00 0.00 H new ATOM 968 N GLU A 61 -15.375 -5.188 0.374 1.00 0.00 N ATOM 969 CA GLU A 61 -14.919 -6.340 -0.418 1.00 0.00 C ATOM 970 C GLU A 61 -13.469 -6.725 -0.039 1.00 0.00 C ATOM 971 O GLU A 61 -13.020 -7.837 -0.322 1.00 0.00 O ATOM 972 CB GLU A 61 -15.015 -6.007 -1.928 1.00 0.00 C ATOM 973 CG GLU A 61 -14.090 -4.859 -2.407 1.00 0.00 C ATOM 974 CD GLU A 61 -14.176 -4.569 -3.918 1.00 0.00 C ATOM 975 OE1 GLU A 61 -14.484 -5.495 -4.706 1.00 0.00 O ATOM 976 OE2 GLU A 61 -13.942 -3.412 -4.328 1.00 0.00 O ATOM 0 H GLU A 61 -15.405 -4.316 -0.155 1.00 0.00 H new ATOM 0 HA GLU A 61 -15.562 -7.193 -0.201 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -14.779 -6.905 -2.498 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -16.047 -5.743 -2.161 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -14.342 -3.951 -1.859 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -13.059 -5.108 -2.154 1.00 0.00 H new ATOM 983 N TYR A 62 -12.741 -5.783 0.594 1.00 0.00 N ATOM 984 CA TYR A 62 -11.350 -5.993 1.042 1.00 0.00 C ATOM 985 C TYR A 62 -11.304 -6.272 2.577 1.00 0.00 C ATOM 986 O TYR A 62 -10.255 -6.655 3.098 1.00 0.00 O ATOM 987 CB TYR A 62 -10.462 -4.748 0.614 1.00 0.00 C ATOM 988 CG TYR A 62 -9.731 -4.024 1.764 1.00 0.00 C ATOM 989 CD1 TYR A 62 -10.407 -3.107 2.576 1.00 0.00 C ATOM 990 CD2 TYR A 62 -8.391 -4.295 2.070 1.00 0.00 C ATOM 991 CE1 TYR A 62 -9.781 -2.489 3.629 1.00 0.00 C ATOM 992 CE2 TYR A 62 -7.766 -3.674 3.137 1.00 0.00 C ATOM 993 CZ TYR A 62 -8.473 -2.771 3.912 1.00 0.00 C ATOM 994 OH TYR A 62 -7.876 -2.146 4.977 1.00 0.00 O ATOM 0 H TYR A 62 -13.102 -4.854 0.809 1.00 0.00 H new ATOM 0 HA TYR A 62 -10.933 -6.876 0.557 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -9.720 -5.085 -0.109 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -11.101 -4.028 0.103 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -11.443 -2.881 2.370 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -7.838 -4.998 1.465 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -10.322 -1.778 4.236 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -6.733 -3.893 3.364 1.00 0.00 H new ATOM 0 HH TYR A 62 -8.242 -2.503 5.813 1.00 0.00 H new ATOM 1004 N LYS A 63 -12.453 -6.109 3.279 1.00 0.00 N ATOM 1005 CA LYS A 63 -12.506 -6.066 4.773 1.00 0.00 C ATOM 1006 C LYS A 63 -11.911 -7.327 5.451 1.00 0.00 C ATOM 1007 O LYS A 63 -11.464 -7.257 6.600 1.00 0.00 O ATOM 1008 CB LYS A 63 -13.966 -5.854 5.264 1.00 0.00 C ATOM 1009 CG LYS A 63 -14.893 -7.091 5.112 1.00 0.00 C ATOM 1010 CD LYS A 63 -16.366 -6.813 5.509 1.00 0.00 C ATOM 1011 CE LYS A 63 -16.521 -6.297 6.953 1.00 0.00 C ATOM 1012 NZ LYS A 63 -17.939 -6.165 7.356 1.00 0.00 N ATOM 0 H LYS A 63 -13.365 -6.004 2.835 1.00 0.00 H new ATOM 0 HA LYS A 63 -11.884 -5.221 5.067 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -13.942 -5.563 6.314 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -14.402 -5.021 4.712 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -14.862 -7.433 4.078 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -14.506 -7.903 5.728 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -16.788 -6.080 4.821 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -16.945 -7.729 5.394 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -16.014 -6.979 7.636 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -16.028 -5.329 7.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -17.991 -5.815 8.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -18.419 -5.494 6.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -18.405 -7.093 7.295 1.00 0.00 H new ATOM 1026 N ASP A 64 -11.938 -8.464 4.732 1.00 0.00 N ATOM 1027 CA ASP A 64 -11.404 -9.755 5.210 1.00 0.00 C ATOM 1028 C ASP A 64 -9.884 -9.670 5.432 1.00 0.00 C ATOM 1029 O ASP A 64 -9.192 -9.013 4.660 1.00 0.00 O ATOM 1030 CB ASP A 64 -11.723 -10.875 4.178 1.00 0.00 C ATOM 1031 CG ASP A 64 -13.221 -10.995 3.830 1.00 0.00 C ATOM 1032 OD1 ASP A 64 -13.738 -10.127 3.087 1.00 0.00 O ATOM 1033 OD2 ASP A 64 -13.890 -11.946 4.296 1.00 0.00 O ATOM 0 H ASP A 64 -12.335 -8.514 3.794 1.00 0.00 H new ATOM 0 HA ASP A 64 -11.880 -9.992 6.162 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -11.162 -10.684 3.263 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -11.374 -11.829 4.572 1.00 0.00 H new ATOM 1038 N VAL A 65 -9.376 -10.364 6.468 1.00 0.00 N ATOM 1039 CA VAL A 65 -7.936 -10.355 6.816 1.00 0.00 C ATOM 1040 C VAL A 65 -7.075 -10.892 5.647 1.00 0.00 C ATOM 1041 O VAL A 65 -5.946 -10.436 5.448 1.00 0.00 O ATOM 1042 CB VAL A 65 -7.651 -11.195 8.113 1.00 0.00 C ATOM 1043 CG1 VAL A 65 -6.140 -11.245 8.471 1.00 0.00 C ATOM 1044 CG2 VAL A 65 -8.477 -10.667 9.307 1.00 0.00 C ATOM 0 H VAL A 65 -9.945 -10.944 7.085 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.662 -9.318 7.008 1.00 0.00 H new ATOM 0 HB VAL A 65 -7.962 -12.217 7.898 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.000 -11.838 9.375 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -5.586 -11.699 7.649 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -5.772 -10.233 8.640 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.261 -11.266 10.192 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.214 -9.627 9.500 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -9.539 -10.735 9.073 1.00 0.00 H new ATOM 1054 N GLU A 66 -7.633 -11.852 4.875 1.00 0.00 N ATOM 1055 CA GLU A 66 -6.971 -12.398 3.676 1.00 0.00 C ATOM 1056 C GLU A 66 -6.962 -11.364 2.537 1.00 0.00 C ATOM 1057 O GLU A 66 -5.962 -11.197 1.840 1.00 0.00 O ATOM 1058 CB GLU A 66 -7.652 -13.713 3.234 1.00 0.00 C ATOM 1059 CG GLU A 66 -7.548 -14.843 4.276 1.00 0.00 C ATOM 1060 CD GLU A 66 -8.251 -16.144 3.846 1.00 0.00 C ATOM 1061 OE1 GLU A 66 -7.681 -16.891 3.015 1.00 0.00 O ATOM 1062 OE2 GLU A 66 -9.365 -16.428 4.340 1.00 0.00 O ATOM 0 H GLU A 66 -8.546 -12.264 5.066 1.00 0.00 H new ATOM 0 HA GLU A 66 -5.934 -12.623 3.926 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -8.704 -13.516 3.028 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -7.202 -14.049 2.300 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.496 -15.054 4.467 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -7.980 -14.500 5.216 1.00 0.00 H new ATOM 1069 N ARG A 67 -8.074 -10.651 2.378 1.00 0.00 N ATOM 1070 CA ARG A 67 -8.190 -9.560 1.389 1.00 0.00 C ATOM 1071 C ARG A 67 -7.314 -8.329 1.788 1.00 0.00 C ATOM 1072 O ARG A 67 -7.025 -7.464 0.954 1.00 0.00 O ATOM 1073 CB ARG A 67 -9.675 -9.168 1.262 1.00 0.00 C ATOM 1074 CG ARG A 67 -10.600 -10.251 0.656 1.00 0.00 C ATOM 1075 CD ARG A 67 -10.365 -10.447 -0.851 1.00 0.00 C ATOM 1076 NE ARG A 67 -10.652 -9.201 -1.602 1.00 0.00 N ATOM 1077 CZ ARG A 67 -9.874 -8.658 -2.552 1.00 0.00 C ATOM 1078 NH1 ARG A 67 -8.758 -9.246 -2.944 1.00 0.00 N ATOM 1079 NH2 ARG A 67 -10.233 -7.524 -3.127 1.00 0.00 N ATOM 0 H ARG A 67 -8.922 -10.805 2.924 1.00 0.00 H new ATOM 0 HA ARG A 67 -7.819 -9.907 0.425 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -10.050 -8.907 2.252 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -9.745 -8.270 0.648 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -10.435 -11.196 1.173 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -11.640 -9.973 0.825 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -9.333 -10.751 -1.025 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -11.000 -11.252 -1.220 1.00 0.00 H new ATOM 0 HE ARG A 67 -11.519 -8.712 -1.377 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -8.472 -10.130 -2.523 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -8.182 -8.816 -3.667 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -11.099 -7.063 -2.849 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -9.644 -7.109 -3.849 1.00 0.00 H new ATOM 1093 N VAL A 68 -6.930 -8.277 3.082 1.00 0.00 N ATOM 1094 CA VAL A 68 -5.993 -7.284 3.639 1.00 0.00 C ATOM 1095 C VAL A 68 -4.532 -7.725 3.403 1.00 0.00 C ATOM 1096 O VAL A 68 -3.683 -6.899 3.029 1.00 0.00 O ATOM 1097 CB VAL A 68 -6.252 -7.077 5.191 1.00 0.00 C ATOM 1098 CG1 VAL A 68 -5.109 -6.300 5.883 1.00 0.00 C ATOM 1099 CG2 VAL A 68 -7.600 -6.364 5.446 1.00 0.00 C ATOM 0 H VAL A 68 -7.271 -8.938 3.780 1.00 0.00 H new ATOM 0 HA VAL A 68 -6.162 -6.336 3.127 1.00 0.00 H new ATOM 0 HB VAL A 68 -6.289 -8.075 5.628 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -5.336 -6.186 6.943 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -4.175 -6.850 5.769 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.009 -5.316 5.425 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -7.747 -6.237 6.519 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -7.592 -5.387 4.963 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -8.412 -6.964 5.036 1.00 0.00 H new ATOM 1109 N LYS A 69 -4.254 -9.035 3.621 1.00 0.00 N ATOM 1110 CA LYS A 69 -2.874 -9.557 3.646 1.00 0.00 C ATOM 1111 C LYS A 69 -2.252 -9.534 2.251 1.00 0.00 C ATOM 1112 O LYS A 69 -1.117 -9.094 2.095 1.00 0.00 O ATOM 1113 CB LYS A 69 -2.772 -10.992 4.266 1.00 0.00 C ATOM 1114 CG LYS A 69 -3.336 -12.150 3.419 1.00 0.00 C ATOM 1115 CD LYS A 69 -3.071 -13.551 4.025 1.00 0.00 C ATOM 1116 CE LYS A 69 -1.570 -13.882 4.121 1.00 0.00 C ATOM 1117 NZ LYS A 69 -1.322 -15.233 4.680 1.00 0.00 N ATOM 0 H LYS A 69 -4.970 -9.744 3.781 1.00 0.00 H new ATOM 0 HA LYS A 69 -2.310 -8.890 4.298 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -1.722 -11.200 4.472 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -3.290 -10.987 5.225 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -4.411 -12.012 3.301 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -2.898 -12.106 2.422 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -3.515 -13.602 5.019 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -3.567 -14.306 3.415 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -1.122 -13.814 3.130 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -1.076 -13.137 4.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -0.298 -15.408 4.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -1.725 -15.292 5.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -1.769 -15.948 4.071 1.00 0.00 H new ATOM 1131 N LYS A 70 -3.018 -9.962 1.225 1.00 0.00 N ATOM 1132 CA LYS A 70 -2.488 -10.103 -0.136 1.00 0.00 C ATOM 1133 C LYS A 70 -3.464 -9.548 -1.171 1.00 0.00 C ATOM 1134 O LYS A 70 -4.659 -9.366 -0.902 1.00 0.00 O ATOM 1135 CB LYS A 70 -2.087 -11.596 -0.468 1.00 0.00 C ATOM 1136 CG LYS A 70 -3.187 -12.537 -1.037 1.00 0.00 C ATOM 1137 CD LYS A 70 -4.229 -12.977 0.003 1.00 0.00 C ATOM 1138 CE LYS A 70 -5.293 -13.930 -0.574 1.00 0.00 C ATOM 1139 NZ LYS A 70 -6.089 -13.311 -1.670 1.00 0.00 N ATOM 0 H LYS A 70 -4.002 -10.214 1.319 1.00 0.00 H new ATOM 0 HA LYS A 70 -1.575 -9.510 -0.185 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -1.266 -11.570 -1.185 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -1.699 -12.049 0.445 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -3.697 -12.030 -1.856 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -2.711 -13.423 -1.458 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -3.721 -13.469 0.832 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -4.723 -12.094 0.410 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.804 -14.829 -0.949 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -5.965 -14.243 0.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -6.854 -13.957 -1.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -6.498 -12.414 -1.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -5.472 -13.129 -2.487 1.00 0.00 H new ATOM 1153 N PHE A 71 -2.904 -9.265 -2.341 1.00 0.00 N ATOM 1154 CA PHE A 71 -3.625 -8.937 -3.570 1.00 0.00 C ATOM 1155 C PHE A 71 -2.761 -9.415 -4.743 1.00 0.00 C ATOM 1156 O PHE A 71 -1.615 -9.828 -4.550 1.00 0.00 O ATOM 1157 CB PHE A 71 -3.931 -7.410 -3.664 1.00 0.00 C ATOM 1158 CG PHE A 71 -2.696 -6.515 -3.784 1.00 0.00 C ATOM 1159 CD1 PHE A 71 -2.015 -6.075 -2.653 1.00 0.00 C ATOM 1160 CD2 PHE A 71 -2.219 -6.120 -5.035 1.00 0.00 C ATOM 1161 CE1 PHE A 71 -0.901 -5.272 -2.770 1.00 0.00 C ATOM 1162 CE2 PHE A 71 -1.104 -5.319 -5.152 1.00 0.00 C ATOM 1163 CZ PHE A 71 -0.442 -4.894 -4.020 1.00 0.00 C ATOM 0 H PHE A 71 -1.892 -9.257 -2.467 1.00 0.00 H new ATOM 0 HA PHE A 71 -4.594 -9.436 -3.587 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -4.574 -7.235 -4.526 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -4.494 -7.111 -2.780 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.363 -6.366 -1.673 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.733 -6.448 -5.927 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -0.384 -4.936 -1.883 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -0.749 -5.025 -6.129 1.00 0.00 H new ATOM 0 HZ PHE A 71 0.433 -4.267 -4.108 1.00 0.00 H new ATOM 1173 N THR A 72 -3.301 -9.368 -5.951 1.00 0.00 N ATOM 1174 CA THR A 72 -2.533 -9.647 -7.175 1.00 0.00 C ATOM 1175 C THR A 72 -2.958 -8.633 -8.243 1.00 0.00 C ATOM 1176 O THR A 72 -4.028 -8.029 -8.127 1.00 0.00 O ATOM 1177 CB THR A 72 -2.745 -11.127 -7.669 1.00 0.00 C ATOM 1178 OG1 THR A 72 -2.667 -12.025 -6.548 1.00 0.00 O ATOM 1179 CG2 THR A 72 -1.690 -11.560 -8.707 1.00 0.00 C ATOM 0 H THR A 72 -4.280 -9.137 -6.120 1.00 0.00 H new ATOM 0 HA THR A 72 -1.467 -9.546 -6.971 1.00 0.00 H new ATOM 0 HB THR A 72 -3.727 -11.166 -8.141 1.00 0.00 H new ATOM 0 HG1 THR A 72 -2.801 -12.946 -6.856 1.00 0.00 H new ATOM 0 HG21 THR A 72 -1.882 -12.588 -9.014 1.00 0.00 H new ATOM 0 HG22 THR A 72 -1.745 -10.905 -9.577 1.00 0.00 H new ATOM 0 HG23 THR A 72 -0.696 -11.493 -8.265 1.00 0.00 H new ATOM 1187 N GLU A 73 -2.125 -8.454 -9.281 1.00 0.00 N ATOM 1188 CA GLU A 73 -2.395 -7.492 -10.365 1.00 0.00 C ATOM 1189 C GLU A 73 -3.668 -7.878 -11.146 1.00 0.00 C ATOM 1190 O GLU A 73 -4.342 -7.016 -11.689 1.00 0.00 O ATOM 1191 CB GLU A 73 -1.165 -7.385 -11.308 1.00 0.00 C ATOM 1192 CG GLU A 73 -0.813 -8.683 -12.076 1.00 0.00 C ATOM 1193 CD GLU A 73 0.447 -8.565 -12.958 1.00 0.00 C ATOM 1194 OE1 GLU A 73 0.475 -7.697 -13.856 1.00 0.00 O ATOM 1195 OE2 GLU A 73 1.417 -9.333 -12.754 1.00 0.00 O ATOM 0 H GLU A 73 -1.251 -8.968 -9.393 1.00 0.00 H new ATOM 0 HA GLU A 73 -2.571 -6.512 -9.921 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -1.349 -6.591 -12.032 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -0.299 -7.084 -10.718 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -0.668 -9.490 -11.358 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -1.659 -8.963 -12.704 1.00 0.00 H new ATOM 1202 N GLU A 74 -3.989 -9.186 -11.121 1.00 0.00 N ATOM 1203 CA GLU A 74 -5.130 -9.803 -11.832 1.00 0.00 C ATOM 1204 C GLU A 74 -6.469 -9.108 -11.515 1.00 0.00 C ATOM 1205 O GLU A 74 -7.204 -8.709 -12.426 1.00 0.00 O ATOM 1206 CB GLU A 74 -5.199 -11.300 -11.435 1.00 0.00 C ATOM 1207 CG GLU A 74 -3.872 -12.063 -11.627 1.00 0.00 C ATOM 1208 CD GLU A 74 -3.435 -12.187 -13.095 1.00 0.00 C ATOM 1209 OE1 GLU A 74 -3.981 -13.051 -13.817 1.00 0.00 O ATOM 1210 OE2 GLU A 74 -2.549 -11.421 -13.538 1.00 0.00 O ATOM 0 H GLU A 74 -3.445 -9.865 -10.589 1.00 0.00 H new ATOM 0 HA GLU A 74 -4.969 -9.692 -12.904 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -5.501 -11.374 -10.390 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -5.975 -11.787 -12.026 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -3.087 -11.556 -11.066 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -3.973 -13.062 -11.202 1.00 0.00 H new ATOM 1217 N GLU A 75 -6.746 -8.943 -10.210 1.00 0.00 N ATOM 1218 CA GLU A 75 -7.984 -8.297 -9.722 1.00 0.00 C ATOM 1219 C GLU A 75 -7.980 -6.777 -10.012 1.00 0.00 C ATOM 1220 O GLU A 75 -9.028 -6.137 -10.000 1.00 0.00 O ATOM 1221 CB GLU A 75 -8.170 -8.548 -8.199 1.00 0.00 C ATOM 1222 CG GLU A 75 -7.085 -7.921 -7.296 1.00 0.00 C ATOM 1223 CD GLU A 75 -7.359 -8.104 -5.795 1.00 0.00 C ATOM 1224 OE1 GLU A 75 -8.219 -7.380 -5.253 1.00 0.00 O ATOM 1225 OE2 GLU A 75 -6.735 -8.987 -5.157 1.00 0.00 O ATOM 0 H GLU A 75 -6.123 -9.251 -9.464 1.00 0.00 H new ATOM 0 HA GLU A 75 -8.821 -8.743 -10.259 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -9.142 -8.157 -7.898 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -8.190 -9.624 -8.023 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -6.120 -8.366 -7.538 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -7.010 -6.856 -7.517 1.00 0.00 H new ATOM 1232 N LEU A 76 -6.783 -6.226 -10.269 1.00 0.00 N ATOM 1233 CA LEU A 76 -6.572 -4.790 -10.512 1.00 0.00 C ATOM 1234 C LEU A 76 -6.693 -4.446 -12.014 1.00 0.00 C ATOM 1235 O LEU A 76 -6.870 -3.282 -12.364 1.00 0.00 O ATOM 1236 CB LEU A 76 -5.175 -4.385 -9.973 1.00 0.00 C ATOM 1237 CG LEU A 76 -4.877 -4.762 -8.484 1.00 0.00 C ATOM 1238 CD1 LEU A 76 -3.407 -4.464 -8.119 1.00 0.00 C ATOM 1239 CD2 LEU A 76 -5.861 -4.073 -7.510 1.00 0.00 C ATOM 0 H LEU A 76 -5.923 -6.773 -10.314 1.00 0.00 H new ATOM 0 HA LEU A 76 -7.346 -4.229 -9.988 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -4.416 -4.849 -10.603 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -5.064 -3.306 -10.083 1.00 0.00 H new ATOM 0 HG LEU A 76 -5.030 -5.836 -8.380 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -3.228 -4.736 -7.079 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -2.747 -5.044 -8.764 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -3.206 -3.401 -8.256 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.621 -4.360 -6.486 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -5.777 -2.991 -7.613 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -6.880 -4.381 -7.744 1.00 0.00 H new ATOM 1251 N LYS A 77 -6.597 -5.472 -12.892 1.00 0.00 N ATOM 1252 CA LYS A 77 -6.593 -5.287 -14.370 1.00 0.00 C ATOM 1253 C LYS A 77 -7.999 -5.013 -14.936 1.00 0.00 C ATOM 1254 O LYS A 77 -8.122 -4.553 -16.082 1.00 0.00 O ATOM 1255 CB LYS A 77 -5.988 -6.533 -15.074 1.00 0.00 C ATOM 1256 CG LYS A 77 -4.494 -6.759 -14.785 1.00 0.00 C ATOM 1257 CD LYS A 77 -3.587 -5.635 -15.334 1.00 0.00 C ATOM 1258 CE LYS A 77 -2.111 -5.852 -14.969 1.00 0.00 C ATOM 1259 NZ LYS A 77 -1.233 -4.790 -15.515 1.00 0.00 N ATOM 0 H LYS A 77 -6.520 -6.447 -12.602 1.00 0.00 H new ATOM 0 HA LYS A 77 -5.977 -4.411 -14.571 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -6.544 -7.417 -14.763 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -6.127 -6.431 -16.150 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -4.348 -6.840 -13.708 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -4.187 -7.710 -15.221 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -3.688 -5.585 -16.418 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -3.920 -4.675 -14.939 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -2.008 -5.883 -13.884 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -1.784 -6.820 -15.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -0.248 -4.980 -15.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -1.309 -4.776 -16.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -1.526 -3.868 -15.134 1.00 0.00 H new ATOM 1273 N THR A 78 -9.052 -5.304 -14.146 1.00 0.00 N ATOM 1274 CA THR A 78 -10.445 -5.138 -14.597 1.00 0.00 C ATOM 1275 C THR A 78 -10.837 -3.648 -14.643 1.00 0.00 C ATOM 1276 O THR A 78 -10.258 -2.819 -13.918 1.00 0.00 O ATOM 1277 CB THR A 78 -11.457 -5.953 -13.707 1.00 0.00 C ATOM 1278 OG1 THR A 78 -12.808 -5.768 -14.180 1.00 0.00 O ATOM 1279 CG2 THR A 78 -11.382 -5.569 -12.223 1.00 0.00 C ATOM 0 H THR A 78 -8.962 -5.655 -13.193 1.00 0.00 H new ATOM 0 HA THR A 78 -10.503 -5.542 -15.608 1.00 0.00 H new ATOM 0 HB THR A 78 -11.171 -7.001 -13.794 1.00 0.00 H new ATOM 0 HG1 THR A 78 -13.425 -6.282 -13.618 1.00 0.00 H new ATOM 0 HG21 THR A 78 -12.101 -6.162 -11.657 1.00 0.00 H new ATOM 0 HG22 THR A 78 -10.377 -5.762 -11.848 1.00 0.00 H new ATOM 0 HG23 THR A 78 -11.615 -4.510 -12.109 1.00 0.00 H new ATOM 1287 N LYS A 79 -11.815 -3.340 -15.521 1.00 0.00 N ATOM 1288 CA LYS A 79 -12.391 -1.985 -15.706 1.00 0.00 C ATOM 1289 C LYS A 79 -12.764 -1.346 -14.360 1.00 0.00 C ATOM 1290 O LYS A 79 -12.478 -0.164 -14.115 1.00 0.00 O ATOM 1291 CB LYS A 79 -13.655 -2.071 -16.612 1.00 0.00 C ATOM 1292 CG LYS A 79 -14.471 -0.757 -16.720 1.00 0.00 C ATOM 1293 CD LYS A 79 -15.735 -0.880 -17.598 1.00 0.00 C ATOM 1294 CE LYS A 79 -16.553 0.425 -17.639 1.00 0.00 C ATOM 1295 NZ LYS A 79 -15.747 1.587 -18.111 1.00 0.00 N ATOM 0 H LYS A 79 -12.237 -4.038 -16.134 1.00 0.00 H new ATOM 0 HA LYS A 79 -11.636 -1.359 -16.181 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -13.347 -2.374 -17.613 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -14.307 -2.856 -16.228 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -14.764 -0.439 -15.720 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -13.831 0.025 -17.128 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -15.444 -1.155 -18.612 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -16.362 -1.686 -17.217 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -17.412 0.291 -18.296 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -16.943 0.637 -16.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -16.384 2.339 -18.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -15.165 1.947 -17.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -15.129 1.287 -18.892 1.00 0.00 H new ATOM 1309 N GLU A 80 -13.366 -2.179 -13.501 1.00 0.00 N ATOM 1310 CA GLU A 80 -13.808 -1.791 -12.166 1.00 0.00 C ATOM 1311 C GLU A 80 -12.655 -1.228 -11.329 1.00 0.00 C ATOM 1312 O GLU A 80 -12.657 -0.051 -11.026 1.00 0.00 O ATOM 1313 CB GLU A 80 -14.460 -3.005 -11.458 1.00 0.00 C ATOM 1314 CG GLU A 80 -15.790 -3.458 -12.085 1.00 0.00 C ATOM 1315 CD GLU A 80 -16.858 -2.347 -12.067 1.00 0.00 C ATOM 1316 OE1 GLU A 80 -17.458 -2.106 -10.992 1.00 0.00 O ATOM 1317 OE2 GLU A 80 -17.090 -1.701 -13.112 1.00 0.00 O ATOM 0 H GLU A 80 -13.560 -3.155 -13.723 1.00 0.00 H new ATOM 0 HA GLU A 80 -14.547 -0.997 -12.269 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -13.760 -3.840 -11.474 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -14.631 -2.753 -10.412 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -15.615 -3.773 -13.114 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -16.165 -4.327 -11.545 1.00 0.00 H new ATOM 1324 N ALA A 81 -11.645 -2.072 -11.055 1.00 0.00 N ATOM 1325 CA ALA A 81 -10.601 -1.808 -10.050 1.00 0.00 C ATOM 1326 C ALA A 81 -9.846 -0.498 -10.308 1.00 0.00 C ATOM 1327 O ALA A 81 -9.762 0.331 -9.421 1.00 0.00 O ATOM 1328 CB ALA A 81 -9.634 -2.980 -9.979 1.00 0.00 C ATOM 0 H ALA A 81 -11.530 -2.967 -11.531 1.00 0.00 H new ATOM 0 HA ALA A 81 -11.102 -1.694 -9.089 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -8.867 -2.774 -9.233 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -10.177 -3.883 -9.701 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -9.165 -3.124 -10.952 1.00 0.00 H new ATOM 1334 N LYS A 82 -9.358 -0.309 -11.543 1.00 0.00 N ATOM 1335 CA LYS A 82 -8.578 0.894 -11.929 1.00 0.00 C ATOM 1336 C LYS A 82 -9.377 2.192 -11.696 1.00 0.00 C ATOM 1337 O LYS A 82 -8.856 3.181 -11.144 1.00 0.00 O ATOM 1338 CB LYS A 82 -8.144 0.780 -13.406 1.00 0.00 C ATOM 1339 CG LYS A 82 -7.175 -0.391 -13.672 1.00 0.00 C ATOM 1340 CD LYS A 82 -6.943 -0.661 -15.172 1.00 0.00 C ATOM 1341 CE LYS A 82 -8.220 -1.136 -15.894 1.00 0.00 C ATOM 1342 NZ LYS A 82 -7.987 -1.400 -17.333 1.00 0.00 N ATOM 0 H LYS A 82 -9.487 -0.976 -12.303 1.00 0.00 H new ATOM 0 HA LYS A 82 -7.693 0.943 -11.295 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -9.030 0.657 -14.029 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -7.668 1.712 -13.710 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -6.218 -0.177 -13.196 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -7.569 -1.293 -13.204 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -6.578 0.249 -15.649 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -6.164 -1.415 -15.285 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -8.589 -2.043 -15.416 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -8.998 -0.380 -15.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -8.873 -1.717 -17.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -7.660 -0.529 -17.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -7.264 -2.140 -17.438 1.00 0.00 H new ATOM 1356 N GLU A 83 -10.662 2.167 -12.084 1.00 0.00 N ATOM 1357 CA GLU A 83 -11.575 3.286 -11.838 1.00 0.00 C ATOM 1358 C GLU A 83 -11.873 3.414 -10.337 1.00 0.00 C ATOM 1359 O GLU A 83 -11.961 4.509 -9.837 1.00 0.00 O ATOM 1360 CB GLU A 83 -12.872 3.138 -12.665 1.00 0.00 C ATOM 1361 CG GLU A 83 -12.644 3.276 -14.181 1.00 0.00 C ATOM 1362 CD GLU A 83 -13.942 3.319 -14.998 1.00 0.00 C ATOM 1363 OE1 GLU A 83 -14.706 4.301 -14.860 1.00 0.00 O ATOM 1364 OE2 GLU A 83 -14.206 2.390 -15.781 1.00 0.00 O ATOM 0 H GLU A 83 -11.090 1.379 -12.571 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.089 4.206 -12.163 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -13.318 2.165 -12.458 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -13.589 3.892 -12.342 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -12.074 4.185 -14.373 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -12.036 2.440 -14.526 1.00 0.00 H new ATOM 1371 N ARG A 84 -11.954 2.284 -9.616 1.00 0.00 N ATOM 1372 CA ARG A 84 -12.187 2.266 -8.153 1.00 0.00 C ATOM 1373 C ARG A 84 -10.995 2.881 -7.398 1.00 0.00 C ATOM 1374 O ARG A 84 -11.182 3.442 -6.324 1.00 0.00 O ATOM 1375 CB ARG A 84 -12.457 0.829 -7.644 1.00 0.00 C ATOM 1376 CG ARG A 84 -13.801 0.226 -8.101 1.00 0.00 C ATOM 1377 CD ARG A 84 -13.980 -1.243 -7.673 1.00 0.00 C ATOM 1378 NE ARG A 84 -15.210 -1.841 -8.237 1.00 0.00 N ATOM 1379 CZ ARG A 84 -15.721 -3.035 -7.886 1.00 0.00 C ATOM 1380 NH1 ARG A 84 -15.172 -3.762 -6.922 1.00 0.00 N ATOM 1381 NH2 ARG A 84 -16.802 -3.485 -8.501 1.00 0.00 N ATOM 0 H ARG A 84 -11.861 1.355 -10.026 1.00 0.00 H new ATOM 0 HA ARG A 84 -13.073 2.870 -7.956 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -11.649 0.180 -7.983 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -12.427 0.832 -6.554 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -14.617 0.820 -7.690 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -13.872 0.293 -9.187 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -13.115 -1.822 -7.996 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -14.015 -1.302 -6.585 1.00 0.00 H new ATOM 0 HE ARG A 84 -15.710 -1.306 -8.947 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -14.347 -3.418 -6.431 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -15.575 -4.665 -6.671 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -17.241 -2.928 -9.234 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -17.197 -4.389 -8.242 1.00 0.00 H new ATOM 1395 N TRP A 85 -9.775 2.768 -7.986 1.00 0.00 N ATOM 1396 CA TRP A 85 -8.557 3.456 -7.489 1.00 0.00 C ATOM 1397 C TRP A 85 -8.774 4.980 -7.560 1.00 0.00 C ATOM 1398 O TRP A 85 -8.371 5.716 -6.659 1.00 0.00 O ATOM 1399 CB TRP A 85 -7.294 3.091 -8.333 1.00 0.00 C ATOM 1400 CG TRP A 85 -6.743 1.679 -8.199 1.00 0.00 C ATOM 1401 CD1 TRP A 85 -7.382 0.534 -7.796 1.00 0.00 C ATOM 1402 CD2 TRP A 85 -5.398 1.286 -8.509 1.00 0.00 C ATOM 1403 NE1 TRP A 85 -6.520 -0.531 -7.848 1.00 0.00 N ATOM 1404 CE2 TRP A 85 -5.297 -0.090 -8.268 1.00 0.00 C ATOM 1405 CE3 TRP A 85 -4.265 1.979 -8.961 1.00 0.00 C ATOM 1406 CZ2 TRP A 85 -4.120 -0.796 -8.472 1.00 0.00 C ATOM 1407 CZ3 TRP A 85 -3.090 1.274 -9.158 1.00 0.00 C ATOM 1408 CH2 TRP A 85 -3.025 -0.103 -8.908 1.00 0.00 C ATOM 0 H TRP A 85 -9.610 2.198 -8.816 1.00 0.00 H new ATOM 0 HA TRP A 85 -8.387 3.131 -6.463 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -7.531 3.261 -9.383 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -6.499 3.789 -8.068 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -8.414 0.479 -7.483 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -6.754 -1.495 -7.612 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -4.309 3.041 -9.151 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -4.070 -1.860 -8.292 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -2.211 1.793 -9.510 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -2.093 -0.627 -9.062 1.00 0.00 H new ATOM 1419 N ARG A 86 -9.399 5.426 -8.670 1.00 0.00 N ATOM 1420 CA ARG A 86 -9.758 6.846 -8.888 1.00 0.00 C ATOM 1421 C ARG A 86 -10.863 7.317 -7.911 1.00 0.00 C ATOM 1422 O ARG A 86 -10.729 8.377 -7.307 1.00 0.00 O ATOM 1423 CB ARG A 86 -10.201 7.073 -10.356 1.00 0.00 C ATOM 1424 CG ARG A 86 -10.627 8.520 -10.678 1.00 0.00 C ATOM 1425 CD ARG A 86 -11.000 8.712 -12.151 1.00 0.00 C ATOM 1426 NE ARG A 86 -11.280 10.125 -12.471 1.00 0.00 N ATOM 1427 CZ ARG A 86 -11.816 10.567 -13.616 1.00 0.00 C ATOM 1428 NH1 ARG A 86 -12.266 9.717 -14.529 1.00 0.00 N ATOM 1429 NH2 ARG A 86 -11.914 11.870 -13.829 1.00 0.00 N ATOM 0 H ARG A 86 -9.669 4.814 -9.440 1.00 0.00 H new ATOM 0 HA ARG A 86 -8.868 7.443 -8.690 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -9.381 6.793 -11.017 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -11.033 6.404 -10.579 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -11.478 8.791 -10.053 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -9.814 9.199 -10.422 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -10.186 8.352 -12.781 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -11.876 8.107 -12.385 1.00 0.00 H new ATOM 0 HE ARG A 86 -11.047 10.821 -11.763 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -12.206 8.712 -14.364 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -12.672 10.068 -15.396 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -11.583 12.528 -13.124 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -12.321 12.215 -14.698 1.00 0.00 H new ATOM 1443 N LYS A 87 -11.950 6.521 -7.763 1.00 0.00 N ATOM 1444 CA LYS A 87 -13.050 6.805 -6.790 1.00 0.00 C ATOM 1445 C LYS A 87 -12.493 6.853 -5.346 1.00 0.00 C ATOM 1446 O LYS A 87 -12.994 7.597 -4.498 1.00 0.00 O ATOM 1447 CB LYS A 87 -14.208 5.747 -6.865 1.00 0.00 C ATOM 1448 CG LYS A 87 -15.248 5.912 -8.014 1.00 0.00 C ATOM 1449 CD LYS A 87 -14.661 5.669 -9.418 1.00 0.00 C ATOM 1450 CE LYS A 87 -15.716 5.495 -10.519 1.00 0.00 C ATOM 1451 NZ LYS A 87 -16.510 6.720 -10.756 1.00 0.00 N ATOM 0 H LYS A 87 -12.095 5.670 -8.306 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.467 7.775 -7.063 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -13.758 4.759 -6.956 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -14.746 5.766 -5.917 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -16.072 5.218 -7.849 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -15.665 6.918 -7.973 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -14.014 6.507 -9.679 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -14.033 4.779 -9.388 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -15.222 5.204 -11.446 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -16.387 4.681 -10.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -17.205 6.543 -11.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -17.007 6.986 -9.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -15.877 7.493 -11.044 1.00 0.00 H new ATOM 1465 N PHE A 88 -11.452 6.049 -5.095 1.00 0.00 N ATOM 1466 CA PHE A 88 -10.778 5.970 -3.791 1.00 0.00 C ATOM 1467 C PHE A 88 -9.907 7.226 -3.568 1.00 0.00 C ATOM 1468 O PHE A 88 -9.872 7.781 -2.469 1.00 0.00 O ATOM 1469 CB PHE A 88 -9.935 4.669 -3.741 1.00 0.00 C ATOM 1470 CG PHE A 88 -9.427 4.267 -2.366 1.00 0.00 C ATOM 1471 CD1 PHE A 88 -10.262 4.325 -1.251 1.00 0.00 C ATOM 1472 CD2 PHE A 88 -8.128 3.809 -2.191 1.00 0.00 C ATOM 1473 CE1 PHE A 88 -9.808 3.945 -0.014 1.00 0.00 C ATOM 1474 CE2 PHE A 88 -7.676 3.427 -0.946 1.00 0.00 C ATOM 1475 CZ PHE A 88 -8.512 3.498 0.139 1.00 0.00 C ATOM 0 H PHE A 88 -11.049 5.429 -5.798 1.00 0.00 H new ATOM 0 HA PHE A 88 -11.513 5.938 -2.987 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -10.537 3.852 -4.139 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -9.078 4.787 -4.405 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -11.278 4.673 -1.363 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -7.464 3.751 -3.041 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -10.466 3.996 0.841 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -6.663 3.072 -0.825 1.00 0.00 H new ATOM 0 HZ PHE A 88 -8.155 3.203 1.115 1.00 0.00 H new ATOM 1485 N PHE A 89 -9.225 7.671 -4.643 1.00 0.00 N ATOM 1486 CA PHE A 89 -8.453 8.927 -4.661 1.00 0.00 C ATOM 1487 C PHE A 89 -9.366 10.147 -4.414 1.00 0.00 C ATOM 1488 O PHE A 89 -8.998 11.032 -3.652 1.00 0.00 O ATOM 1489 CB PHE A 89 -7.674 9.075 -6.012 1.00 0.00 C ATOM 1490 CG PHE A 89 -7.311 10.520 -6.408 1.00 0.00 C ATOM 1491 CD1 PHE A 89 -6.556 11.339 -5.560 1.00 0.00 C ATOM 1492 CD2 PHE A 89 -7.763 11.067 -7.611 1.00 0.00 C ATOM 1493 CE1 PHE A 89 -6.265 12.642 -5.906 1.00 0.00 C ATOM 1494 CE2 PHE A 89 -7.470 12.372 -7.953 1.00 0.00 C ATOM 1495 CZ PHE A 89 -6.722 13.160 -7.100 1.00 0.00 C ATOM 0 H PHE A 89 -9.195 7.165 -5.528 1.00 0.00 H new ATOM 0 HA PHE A 89 -7.727 8.888 -3.849 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -6.756 8.491 -5.949 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -8.275 8.637 -6.809 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -6.196 10.945 -4.621 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -8.351 10.460 -8.284 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -5.678 13.258 -5.241 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -7.826 12.777 -8.889 1.00 0.00 H new ATOM 0 HZ PHE A 89 -6.495 14.181 -7.368 1.00 0.00 H new ATOM 1505 N THR A 90 -10.548 10.187 -5.052 1.00 0.00 N ATOM 1506 CA THR A 90 -11.469 11.348 -4.960 1.00 0.00 C ATOM 1507 C THR A 90 -11.969 11.580 -3.508 1.00 0.00 C ATOM 1508 O THR A 90 -12.528 12.635 -3.190 1.00 0.00 O ATOM 1509 CB THR A 90 -12.665 11.233 -5.961 1.00 0.00 C ATOM 1510 OG1 THR A 90 -13.409 10.038 -5.705 1.00 0.00 O ATOM 1511 CG2 THR A 90 -12.187 11.246 -7.433 1.00 0.00 C ATOM 0 H THR A 90 -10.895 9.429 -5.640 1.00 0.00 H new ATOM 0 HA THR A 90 -10.890 12.225 -5.249 1.00 0.00 H new ATOM 0 HB THR A 90 -13.304 12.103 -5.809 1.00 0.00 H new ATOM 0 HG1 THR A 90 -12.903 9.462 -5.094 1.00 0.00 H new ATOM 0 HG21 THR A 90 -13.048 11.164 -8.096 1.00 0.00 H new ATOM 0 HG22 THR A 90 -11.660 12.178 -7.636 1.00 0.00 H new ATOM 0 HG23 THR A 90 -11.516 10.405 -7.605 1.00 0.00 H new ATOM 1519 N ILE A 91 -11.784 10.568 -2.645 1.00 0.00 N ATOM 1520 CA ILE A 91 -11.986 10.693 -1.193 1.00 0.00 C ATOM 1521 C ILE A 91 -10.783 11.447 -0.558 1.00 0.00 C ATOM 1522 O ILE A 91 -10.958 12.392 0.215 1.00 0.00 O ATOM 1523 CB ILE A 91 -12.146 9.268 -0.538 1.00 0.00 C ATOM 1524 CG1 ILE A 91 -13.249 8.445 -1.280 1.00 0.00 C ATOM 1525 CG2 ILE A 91 -12.451 9.359 0.981 1.00 0.00 C ATOM 1526 CD1 ILE A 91 -13.346 6.983 -0.861 1.00 0.00 C ATOM 0 H ILE A 91 -11.489 9.636 -2.936 1.00 0.00 H new ATOM 0 HA ILE A 91 -12.898 11.261 -1.009 1.00 0.00 H new ATOM 0 HB ILE A 91 -11.193 8.749 -0.644 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -14.214 8.922 -1.110 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -13.056 8.489 -2.352 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -12.554 8.355 1.392 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -11.635 9.876 1.486 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -13.379 9.910 1.133 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -14.137 6.494 -1.429 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -12.397 6.484 -1.058 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -13.573 6.924 0.203 1.00 0.00 H new ATOM 1538 N PHE A 92 -9.555 11.043 -0.944 1.00 0.00 N ATOM 1539 CA PHE A 92 -8.293 11.510 -0.308 1.00 0.00 C ATOM 1540 C PHE A 92 -7.597 12.607 -1.110 1.00 0.00 C ATOM 1541 O PHE A 92 -6.475 12.978 -0.784 1.00 0.00 O ATOM 1542 CB PHE A 92 -7.323 10.333 -0.089 1.00 0.00 C ATOM 1543 CG PHE A 92 -7.895 9.241 0.792 1.00 0.00 C ATOM 1544 CD1 PHE A 92 -8.093 9.446 2.161 1.00 0.00 C ATOM 1545 CD2 PHE A 92 -8.250 8.023 0.250 1.00 0.00 C ATOM 1546 CE1 PHE A 92 -8.631 8.448 2.947 1.00 0.00 C ATOM 1547 CE2 PHE A 92 -8.779 7.036 1.030 1.00 0.00 C ATOM 1548 CZ PHE A 92 -8.974 7.242 2.379 1.00 0.00 C ATOM 0 H PHE A 92 -9.404 10.383 -1.706 1.00 0.00 H new ATOM 0 HA PHE A 92 -8.575 11.937 0.655 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -7.055 9.907 -1.056 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -6.403 10.708 0.360 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -7.823 10.392 2.606 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -8.107 7.848 -0.806 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -8.782 8.612 4.004 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -9.046 6.088 0.588 1.00 0.00 H new ATOM 0 HZ PHE A 92 -9.396 6.458 2.990 1.00 0.00 H new ATOM 1558 N GLU A 93 -8.268 13.142 -2.135 1.00 0.00 N ATOM 1559 CA GLU A 93 -7.780 14.328 -2.878 1.00 0.00 C ATOM 1560 C GLU A 93 -7.669 15.543 -1.929 1.00 0.00 C ATOM 1561 O GLU A 93 -6.880 16.461 -2.162 1.00 0.00 O ATOM 1562 CB GLU A 93 -8.731 14.653 -4.063 1.00 0.00 C ATOM 1563 CG GLU A 93 -10.204 14.834 -3.652 1.00 0.00 C ATOM 1564 CD GLU A 93 -11.079 15.453 -4.753 1.00 0.00 C ATOM 1565 OE1 GLU A 93 -11.564 14.710 -5.633 1.00 0.00 O ATOM 1566 OE2 GLU A 93 -11.275 16.687 -4.754 1.00 0.00 O ATOM 0 H GLU A 93 -9.157 12.776 -2.477 1.00 0.00 H new ATOM 0 HA GLU A 93 -6.791 14.106 -3.279 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -8.387 15.564 -4.553 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -8.666 13.851 -4.799 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -10.617 13.864 -3.374 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -10.250 15.466 -2.765 1.00 0.00 H new ATOM 1573 N LYS A 94 -8.463 15.498 -0.840 1.00 0.00 N ATOM 1574 CA LYS A 94 -8.563 16.566 0.159 1.00 0.00 C ATOM 1575 C LYS A 94 -7.423 16.496 1.202 1.00 0.00 C ATOM 1576 O LYS A 94 -7.230 17.447 1.974 1.00 0.00 O ATOM 1577 CB LYS A 94 -9.943 16.468 0.868 1.00 0.00 C ATOM 1578 CG LYS A 94 -11.169 16.322 -0.074 1.00 0.00 C ATOM 1579 CD LYS A 94 -11.331 17.489 -1.084 1.00 0.00 C ATOM 1580 CE LYS A 94 -11.536 18.855 -0.409 1.00 0.00 C ATOM 1581 NZ LYS A 94 -11.756 19.934 -1.399 1.00 0.00 N ATOM 0 H LYS A 94 -9.062 14.699 -0.632 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.469 17.523 -0.354 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -9.924 15.615 1.546 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -10.081 17.359 1.481 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -11.080 15.387 -0.626 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.073 16.251 0.531 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -10.447 17.535 -1.720 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -12.181 17.282 -1.734 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -12.391 18.802 0.266 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -10.664 19.093 0.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -11.890 20.838 -0.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -10.930 20.003 -2.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -12.603 19.720 -1.963 1.00 0.00 H new ATOM 1595 N LYS A 95 -6.683 15.362 1.244 1.00 0.00 N ATOM 1596 CA LYS A 95 -5.600 15.146 2.234 1.00 0.00 C ATOM 1597 C LYS A 95 -4.335 14.566 1.565 1.00 0.00 C ATOM 1598 O LYS A 95 -3.269 15.190 1.624 1.00 0.00 O ATOM 1599 CB LYS A 95 -6.059 14.289 3.471 1.00 0.00 C ATOM 1600 CG LYS A 95 -6.895 13.011 3.214 1.00 0.00 C ATOM 1601 CD LYS A 95 -8.368 13.293 2.819 1.00 0.00 C ATOM 1602 CE LYS A 95 -9.117 14.199 3.813 1.00 0.00 C ATOM 1603 NZ LYS A 95 -9.327 13.566 5.133 1.00 0.00 N ATOM 0 H LYS A 95 -6.817 14.581 0.602 1.00 0.00 H new ATOM 0 HA LYS A 95 -5.343 16.128 2.633 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -5.165 13.995 4.021 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -6.639 14.938 4.127 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -6.421 12.432 2.422 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -6.882 12.393 4.112 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -8.387 13.758 1.833 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -8.899 12.345 2.735 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -8.556 15.124 3.946 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -10.084 14.471 3.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -10.227 13.895 5.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -9.355 12.532 5.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -8.547 13.825 5.770 1.00 0.00 H new ATOM 1617 N ILE A 96 -4.447 13.383 0.930 1.00 0.00 N ATOM 1618 CA ILE A 96 -3.317 12.746 0.223 1.00 0.00 C ATOM 1619 C ILE A 96 -3.223 13.282 -1.222 1.00 0.00 C ATOM 1620 O ILE A 96 -3.818 12.730 -2.158 1.00 0.00 O ATOM 1621 CB ILE A 96 -3.410 11.172 0.228 1.00 0.00 C ATOM 1622 CG1 ILE A 96 -3.665 10.627 1.672 1.00 0.00 C ATOM 1623 CG2 ILE A 96 -2.123 10.547 -0.380 1.00 0.00 C ATOM 1624 CD1 ILE A 96 -2.599 10.987 2.702 1.00 0.00 C ATOM 0 H ILE A 96 -5.313 12.846 0.892 1.00 0.00 H new ATOM 0 HA ILE A 96 -2.408 13.008 0.764 1.00 0.00 H new ATOM 0 HB ILE A 96 -4.258 10.882 -0.392 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -4.626 11.005 2.021 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.748 9.541 1.623 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.206 9.460 -0.368 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.002 10.890 -1.407 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -1.258 10.852 0.209 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -2.869 10.562 3.669 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -1.637 10.585 2.385 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.528 12.071 2.789 1.00 0.00 H new ATOM 1636 N GLU A 97 -2.514 14.407 -1.365 1.00 0.00 N ATOM 1637 CA GLU A 97 -2.244 15.044 -2.670 1.00 0.00 C ATOM 1638 C GLU A 97 -1.092 14.338 -3.410 1.00 0.00 C ATOM 1639 O GLU A 97 -0.958 14.470 -4.629 1.00 0.00 O ATOM 1640 CB GLU A 97 -1.921 16.542 -2.462 1.00 0.00 C ATOM 1641 CG GLU A 97 -3.067 17.339 -1.819 1.00 0.00 C ATOM 1642 CD GLU A 97 -2.694 18.806 -1.563 1.00 0.00 C ATOM 1643 OE1 GLU A 97 -2.826 19.640 -2.483 1.00 0.00 O ATOM 1644 OE2 GLU A 97 -2.252 19.126 -0.439 1.00 0.00 O ATOM 0 H GLU A 97 -2.106 14.909 -0.576 1.00 0.00 H new ATOM 0 HA GLU A 97 -3.136 14.953 -3.290 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -1.034 16.629 -1.835 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -1.676 16.989 -3.426 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -3.942 17.298 -2.468 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -3.347 16.869 -0.876 1.00 0.00 H new ATOM 1651 N ASP A 98 -0.270 13.582 -2.659 1.00 0.00 N ATOM 1652 CA ASP A 98 0.905 12.847 -3.193 1.00 0.00 C ATOM 1653 C ASP A 98 0.523 11.457 -3.736 1.00 0.00 C ATOM 1654 O ASP A 98 1.407 10.639 -3.988 1.00 0.00 O ATOM 1655 CB ASP A 98 1.977 12.701 -2.073 1.00 0.00 C ATOM 1656 CG ASP A 98 2.579 14.045 -1.639 1.00 0.00 C ATOM 1657 OD1 ASP A 98 1.954 14.756 -0.819 1.00 0.00 O ATOM 1658 OD2 ASP A 98 3.670 14.416 -2.132 1.00 0.00 O ATOM 0 H ASP A 98 -0.399 13.459 -1.655 1.00 0.00 H new ATOM 0 HA ASP A 98 1.308 13.422 -4.027 1.00 0.00 H new ATOM 0 HB2 ASP A 98 1.526 12.215 -1.208 1.00 0.00 H new ATOM 0 HB3 ASP A 98 2.776 12.048 -2.425 1.00 0.00 H new ATOM 1663 N TYR A 99 -0.785 11.243 -3.983 1.00 0.00 N ATOM 1664 CA TYR A 99 -1.385 9.917 -4.276 1.00 0.00 C ATOM 1665 C TYR A 99 -0.690 9.164 -5.436 1.00 0.00 C ATOM 1666 O TYR A 99 -0.643 7.933 -5.430 1.00 0.00 O ATOM 1667 CB TYR A 99 -2.898 10.082 -4.593 1.00 0.00 C ATOM 1668 CG TYR A 99 -3.213 10.571 -6.018 1.00 0.00 C ATOM 1669 CD1 TYR A 99 -2.899 11.869 -6.430 1.00 0.00 C ATOM 1670 CD2 TYR A 99 -3.812 9.716 -6.952 1.00 0.00 C ATOM 1671 CE1 TYR A 99 -3.172 12.295 -7.718 1.00 0.00 C ATOM 1672 CE2 TYR A 99 -4.086 10.134 -8.236 1.00 0.00 C ATOM 1673 CZ TYR A 99 -3.765 11.425 -8.619 1.00 0.00 C ATOM 1674 OH TYR A 99 -4.035 11.847 -9.905 1.00 0.00 O ATOM 0 H TYR A 99 -1.470 11.998 -3.985 1.00 0.00 H new ATOM 0 HA TYR A 99 -1.243 9.310 -3.382 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -3.394 9.124 -4.436 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -3.329 10.785 -3.880 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -2.436 12.551 -5.732 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -4.064 8.708 -6.659 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -2.924 13.302 -8.020 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -4.549 9.458 -8.940 1.00 0.00 H new ATOM 0 HH TYR A 99 -4.450 11.116 -10.409 1.00 0.00 H new ATOM 1684 N ASN A 100 -0.160 9.920 -6.415 1.00 0.00 N ATOM 1685 CA ASN A 100 0.435 9.370 -7.635 1.00 0.00 C ATOM 1686 C ASN A 100 1.825 9.971 -7.845 1.00 0.00 C ATOM 1687 O ASN A 100 1.977 11.052 -8.420 1.00 0.00 O ATOM 1688 CB ASN A 100 -0.476 9.652 -8.863 1.00 0.00 C ATOM 1689 CG ASN A 100 0.074 9.123 -10.197 1.00 0.00 C ATOM 1690 OD1 ASN A 100 0.763 8.101 -10.237 1.00 0.00 O ATOM 1691 ND2 ASN A 100 -0.203 9.825 -11.288 1.00 0.00 N ATOM 0 H ASN A 100 -0.135 10.939 -6.376 1.00 0.00 H new ATOM 0 HA ASN A 100 0.529 8.289 -7.528 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -1.454 9.205 -8.685 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -0.628 10.728 -8.948 1.00 0.00 H new ATOM 0 HD21 ASN A 100 0.157 9.524 -12.193 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -0.776 10.666 -11.221 1.00 0.00 H new ATOM 1698 N PHE A 101 2.819 9.298 -7.282 1.00 0.00 N ATOM 1699 CA PHE A 101 4.223 9.450 -7.682 1.00 0.00 C ATOM 1700 C PHE A 101 4.749 8.041 -7.965 1.00 0.00 C ATOM 1701 O PHE A 101 5.343 7.772 -9.018 1.00 0.00 O ATOM 1702 CB PHE A 101 5.069 10.167 -6.592 1.00 0.00 C ATOM 1703 CG PHE A 101 6.449 10.604 -7.099 1.00 0.00 C ATOM 1704 CD1 PHE A 101 7.543 9.735 -7.072 1.00 0.00 C ATOM 1705 CD2 PHE A 101 6.637 11.873 -7.643 1.00 0.00 C ATOM 1706 CE1 PHE A 101 8.775 10.124 -7.563 1.00 0.00 C ATOM 1707 CE2 PHE A 101 7.866 12.256 -8.139 1.00 0.00 C ATOM 1708 CZ PHE A 101 8.934 11.384 -8.100 1.00 0.00 C ATOM 0 H PHE A 101 2.679 8.625 -6.529 1.00 0.00 H new ATOM 0 HA PHE A 101 4.300 10.082 -8.567 1.00 0.00 H new ATOM 0 HB2 PHE A 101 4.525 11.041 -6.234 1.00 0.00 H new ATOM 0 HB3 PHE A 101 5.195 9.499 -5.740 1.00 0.00 H new ATOM 0 HD1 PHE A 101 7.424 8.743 -6.661 1.00 0.00 H new ATOM 0 HD2 PHE A 101 5.809 12.566 -7.677 1.00 0.00 H new ATOM 0 HE1 PHE A 101 9.612 9.442 -7.526 1.00 0.00 H new ATOM 0 HE2 PHE A 101 7.992 13.243 -8.560 1.00 0.00 H new ATOM 0 HZ PHE A 101 9.894 11.688 -8.490 1.00 0.00 H new ATOM 1718 N GLY A 102 4.530 7.152 -6.982 1.00 0.00 N ATOM 1719 CA GLY A 102 4.799 5.733 -7.131 1.00 0.00 C ATOM 1720 C GLY A 102 5.609 5.170 -5.981 1.00 0.00 C ATOM 1721 O GLY A 102 6.538 5.828 -5.489 1.00 0.00 O ATOM 0 H GLY A 102 4.161 7.408 -6.066 1.00 0.00 H new ATOM 0 HA2 GLY A 102 3.855 5.194 -7.204 1.00 0.00 H new ATOM 0 HA3 GLY A 102 5.335 5.565 -8.065 1.00 0.00 H new ATOM 1725 N THR A 103 5.229 3.962 -5.532 1.00 0.00 N ATOM 1726 CA THR A 103 5.898 3.251 -4.438 1.00 0.00 C ATOM 1727 C THR A 103 5.943 1.727 -4.716 1.00 0.00 C ATOM 1728 O THR A 103 5.112 1.188 -5.465 1.00 0.00 O ATOM 1729 CB THR A 103 5.190 3.539 -3.077 1.00 0.00 C ATOM 1730 OG1 THR A 103 5.071 4.943 -2.888 1.00 0.00 O ATOM 1731 CG2 THR A 103 5.960 2.959 -1.888 1.00 0.00 C ATOM 0 H THR A 103 4.440 3.449 -5.925 1.00 0.00 H new ATOM 0 HA THR A 103 6.923 3.616 -4.376 1.00 0.00 H new ATOM 0 HB THR A 103 4.210 3.063 -3.119 1.00 0.00 H new ATOM 0 HG1 THR A 103 5.544 5.204 -2.071 1.00 0.00 H new ATOM 0 HG21 THR A 103 5.428 3.186 -0.964 1.00 0.00 H new ATOM 0 HG22 THR A 103 6.045 1.878 -2.002 1.00 0.00 H new ATOM 0 HG23 THR A 103 6.956 3.400 -1.850 1.00 0.00 H new ATOM 1739 N LEU A 104 6.932 1.057 -4.106 1.00 0.00 N ATOM 1740 CA LEU A 104 7.095 -0.401 -4.135 1.00 0.00 C ATOM 1741 C LEU A 104 6.228 -1.000 -3.000 1.00 0.00 C ATOM 1742 O LEU A 104 6.527 -0.789 -1.815 1.00 0.00 O ATOM 1743 CB LEU A 104 8.612 -0.726 -3.925 1.00 0.00 C ATOM 1744 CG LEU A 104 9.187 -2.044 -4.510 1.00 0.00 C ATOM 1745 CD1 LEU A 104 8.641 -3.285 -3.804 1.00 0.00 C ATOM 1746 CD2 LEU A 104 8.983 -2.100 -6.028 1.00 0.00 C ATOM 0 H LEU A 104 7.658 1.528 -3.566 1.00 0.00 H new ATOM 0 HA LEU A 104 6.776 -0.829 -5.085 1.00 0.00 H new ATOM 0 HB2 LEU A 104 9.187 0.099 -4.346 1.00 0.00 H new ATOM 0 HB3 LEU A 104 8.802 -0.732 -2.852 1.00 0.00 H new ATOM 0 HG LEU A 104 10.260 -2.045 -4.321 1.00 0.00 H new ATOM 0 HD11 LEU A 104 9.075 -4.179 -4.252 1.00 0.00 H new ATOM 0 HD12 LEU A 104 8.901 -3.246 -2.746 1.00 0.00 H new ATOM 0 HD13 LEU A 104 7.557 -3.316 -3.910 1.00 0.00 H new ATOM 0 HD21 LEU A 104 9.394 -3.032 -6.416 1.00 0.00 H new ATOM 0 HD22 LEU A 104 7.918 -2.051 -6.254 1.00 0.00 H new ATOM 0 HD23 LEU A 104 9.492 -1.257 -6.495 1.00 0.00 H new ATOM 1758 N LEU A 105 5.149 -1.709 -3.360 1.00 0.00 N ATOM 1759 CA LEU A 105 4.234 -2.345 -2.388 1.00 0.00 C ATOM 1760 C LEU A 105 4.309 -3.871 -2.513 1.00 0.00 C ATOM 1761 O LEU A 105 4.581 -4.408 -3.590 1.00 0.00 O ATOM 1762 CB LEU A 105 2.785 -1.842 -2.608 1.00 0.00 C ATOM 1763 CG LEU A 105 1.662 -2.426 -1.684 1.00 0.00 C ATOM 1764 CD1 LEU A 105 1.912 -2.132 -0.186 1.00 0.00 C ATOM 1765 CD2 LEU A 105 0.282 -1.914 -2.127 1.00 0.00 C ATOM 0 H LEU A 105 4.882 -1.861 -4.333 1.00 0.00 H new ATOM 0 HA LEU A 105 4.540 -2.069 -1.379 1.00 0.00 H new ATOM 0 HB2 LEU A 105 2.785 -0.758 -2.491 1.00 0.00 H new ATOM 0 HB3 LEU A 105 2.511 -2.051 -3.642 1.00 0.00 H new ATOM 0 HG LEU A 105 1.686 -3.510 -1.794 1.00 0.00 H new ATOM 0 HD11 LEU A 105 1.104 -2.559 0.408 1.00 0.00 H new ATOM 0 HD12 LEU A 105 2.860 -2.575 0.119 1.00 0.00 H new ATOM 0 HD13 LEU A 105 1.948 -1.054 -0.028 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -0.487 -2.329 -1.475 1.00 0.00 H new ATOM 0 HD22 LEU A 105 0.261 -0.826 -2.066 1.00 0.00 H new ATOM 0 HD23 LEU A 105 0.092 -2.224 -3.155 1.00 0.00 H new ATOM 1777 N ARG A 106 4.049 -4.549 -1.388 1.00 0.00 N ATOM 1778 CA ARG A 106 4.092 -6.019 -1.280 1.00 0.00 C ATOM 1779 C ARG A 106 2.697 -6.567 -1.594 1.00 0.00 C ATOM 1780 O ARG A 106 1.702 -6.075 -1.053 1.00 0.00 O ATOM 1781 CB ARG A 106 4.585 -6.499 0.147 1.00 0.00 C ATOM 1782 CG ARG A 106 4.894 -5.377 1.171 1.00 0.00 C ATOM 1783 CD ARG A 106 6.181 -4.585 0.852 1.00 0.00 C ATOM 1784 NE ARG A 106 6.190 -3.274 1.526 1.00 0.00 N ATOM 1785 CZ ARG A 106 7.274 -2.536 1.799 1.00 0.00 C ATOM 1786 NH1 ARG A 106 8.505 -3.019 1.621 1.00 0.00 N ATOM 1787 NH2 ARG A 106 7.097 -1.319 2.301 1.00 0.00 N ATOM 0 H ARG A 106 3.799 -4.088 -0.513 1.00 0.00 H new ATOM 0 HA ARG A 106 4.816 -6.406 -1.997 1.00 0.00 H new ATOM 0 HB2 ARG A 106 3.823 -7.152 0.572 1.00 0.00 H new ATOM 0 HB3 ARG A 106 5.484 -7.101 0.015 1.00 0.00 H new ATOM 0 HG2 ARG A 106 4.052 -4.686 1.205 1.00 0.00 H new ATOM 0 HG3 ARG A 106 4.985 -5.818 2.164 1.00 0.00 H new ATOM 0 HD2 ARG A 106 7.051 -5.162 1.165 1.00 0.00 H new ATOM 0 HD3 ARG A 106 6.264 -4.442 -0.225 1.00 0.00 H new ATOM 0 HE ARG A 106 5.287 -2.894 1.811 1.00 0.00 H new ATOM 0 HH11 ARG A 106 8.635 -3.968 1.270 1.00 0.00 H new ATOM 0 HH12 ARG A 106 9.316 -2.439 1.835 1.00 0.00 H new ATOM 0 HH21 ARG A 106 6.154 -0.969 2.469 1.00 0.00 H new ATOM 0 HH22 ARG A 106 7.904 -0.735 2.519 1.00 0.00 H new ATOM 1801 N THR A 107 2.642 -7.593 -2.451 1.00 0.00 N ATOM 1802 CA THR A 107 1.390 -8.232 -2.867 1.00 0.00 C ATOM 1803 C THR A 107 0.963 -9.333 -1.873 1.00 0.00 C ATOM 1804 O THR A 107 0.029 -10.076 -2.159 1.00 0.00 O ATOM 1805 CB THR A 107 1.540 -8.834 -4.304 1.00 0.00 C ATOM 1806 OG1 THR A 107 2.570 -9.829 -4.299 1.00 0.00 O ATOM 1807 CG2 THR A 107 1.878 -7.754 -5.345 1.00 0.00 C ATOM 0 H THR A 107 3.471 -8.006 -2.878 1.00 0.00 H new ATOM 0 HA THR A 107 0.613 -7.468 -2.878 1.00 0.00 H new ATOM 0 HB THR A 107 0.584 -9.279 -4.581 1.00 0.00 H new ATOM 0 HG1 THR A 107 2.778 -10.089 -5.221 1.00 0.00 H new ATOM 0 HG21 THR A 107 1.973 -8.214 -6.329 1.00 0.00 H new ATOM 0 HG22 THR A 107 1.082 -7.009 -5.368 1.00 0.00 H new ATOM 0 HG23 THR A 107 2.818 -7.272 -5.077 1.00 0.00 H new ATOM 1815 N ASP A 108 1.659 -9.433 -0.715 1.00 0.00 N ATOM 1816 CA ASP A 108 1.327 -10.392 0.362 1.00 0.00 C ATOM 1817 C ASP A 108 1.870 -9.898 1.719 1.00 0.00 C ATOM 1818 O ASP A 108 2.758 -9.030 1.769 1.00 0.00 O ATOM 1819 CB ASP A 108 1.853 -11.822 0.018 1.00 0.00 C ATOM 1820 CG ASP A 108 1.531 -12.886 1.093 1.00 0.00 C ATOM 1821 OD1 ASP A 108 0.350 -13.020 1.478 1.00 0.00 O ATOM 1822 OD2 ASP A 108 2.459 -13.558 1.584 1.00 0.00 O ATOM 0 H ASP A 108 2.468 -8.849 -0.503 1.00 0.00 H new ATOM 0 HA ASP A 108 0.242 -10.455 0.443 1.00 0.00 H new ATOM 0 HB2 ASP A 108 1.422 -12.138 -0.932 1.00 0.00 H new ATOM 0 HB3 ASP A 108 2.933 -11.777 -0.122 1.00 0.00 H new ATOM 1827 N ALA A 109 1.288 -10.432 2.816 1.00 0.00 N ATOM 1828 CA ALA A 109 1.729 -10.166 4.190 1.00 0.00 C ATOM 1829 C ALA A 109 3.160 -10.669 4.394 1.00 0.00 C ATOM 1830 O ALA A 109 4.055 -9.892 4.726 1.00 0.00 O ATOM 1831 CB ALA A 109 0.782 -10.833 5.196 1.00 0.00 C ATOM 0 H ALA A 109 0.491 -11.066 2.764 1.00 0.00 H new ATOM 0 HA ALA A 109 1.709 -9.089 4.358 1.00 0.00 H new ATOM 0 HB1 ALA A 109 1.124 -10.626 6.210 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -0.225 -10.438 5.065 1.00 0.00 H new ATOM 0 HB3 ALA A 109 0.774 -11.910 5.029 1.00 0.00 H new ATOM 1837 N SER A 110 3.375 -11.971 4.122 1.00 0.00 N ATOM 1838 CA SER A 110 4.681 -12.630 4.304 1.00 0.00 C ATOM 1839 C SER A 110 5.518 -12.560 3.001 1.00 0.00 C ATOM 1840 O SER A 110 6.214 -13.516 2.636 1.00 0.00 O ATOM 1841 CB SER A 110 4.477 -14.086 4.777 1.00 0.00 C ATOM 1842 OG SER A 110 3.704 -14.846 3.863 1.00 0.00 O ATOM 0 H SER A 110 2.648 -12.594 3.770 1.00 0.00 H new ATOM 0 HA SER A 110 5.242 -12.102 5.075 1.00 0.00 H new ATOM 0 HB2 SER A 110 5.449 -14.562 4.911 1.00 0.00 H new ATOM 0 HB3 SER A 110 3.986 -14.084 5.750 1.00 0.00 H new ATOM 0 HG SER A 110 3.438 -14.279 3.109 1.00 0.00 H new ATOM 1848 N ALA A 111 5.452 -11.398 2.323 1.00 0.00 N ATOM 1849 CA ALA A 111 6.130 -11.170 1.039 1.00 0.00 C ATOM 1850 C ALA A 111 7.549 -10.624 1.233 1.00 0.00 C ATOM 1851 O ALA A 111 7.810 -9.834 2.149 1.00 0.00 O ATOM 1852 CB ALA A 111 5.309 -10.200 0.177 1.00 0.00 C ATOM 0 H ALA A 111 4.924 -10.590 2.654 1.00 0.00 H new ATOM 0 HA ALA A 111 6.211 -12.132 0.532 1.00 0.00 H new ATOM 0 HB1 ALA A 111 5.819 -10.037 -0.773 1.00 0.00 H new ATOM 0 HB2 ALA A 111 4.322 -10.624 -0.009 1.00 0.00 H new ATOM 0 HB3 ALA A 111 5.202 -9.250 0.700 1.00 0.00 H new ATOM 1858 N GLU A 112 8.452 -11.070 0.351 1.00 0.00 N ATOM 1859 CA GLU A 112 9.797 -10.502 0.210 1.00 0.00 C ATOM 1860 C GLU A 112 9.778 -9.495 -0.955 1.00 0.00 C ATOM 1861 O GLU A 112 8.715 -9.220 -1.526 1.00 0.00 O ATOM 1862 CB GLU A 112 10.832 -11.632 -0.059 1.00 0.00 C ATOM 1863 CG GLU A 112 10.591 -12.423 -1.366 1.00 0.00 C ATOM 1864 CD GLU A 112 11.729 -13.399 -1.711 1.00 0.00 C ATOM 1865 OE1 GLU A 112 11.723 -14.547 -1.214 1.00 0.00 O ATOM 1866 OE2 GLU A 112 12.628 -13.027 -2.498 1.00 0.00 O ATOM 0 H GLU A 112 8.267 -11.842 -0.290 1.00 0.00 H new ATOM 0 HA GLU A 112 10.088 -9.995 1.130 1.00 0.00 H new ATOM 0 HB2 GLU A 112 11.829 -11.194 -0.093 1.00 0.00 H new ATOM 0 HB3 GLU A 112 10.818 -12.328 0.780 1.00 0.00 H new ATOM 0 HG2 GLU A 112 9.659 -12.981 -1.277 1.00 0.00 H new ATOM 0 HG3 GLU A 112 10.464 -11.720 -2.189 1.00 0.00 H new ATOM 1873 N TYR A 113 10.951 -8.961 -1.310 1.00 0.00 N ATOM 1874 CA TYR A 113 11.113 -8.093 -2.488 1.00 0.00 C ATOM 1875 C TYR A 113 11.480 -8.966 -3.708 1.00 0.00 C ATOM 1876 O TYR A 113 12.626 -9.387 -3.876 1.00 0.00 O ATOM 1877 CB TYR A 113 12.141 -6.940 -2.216 1.00 0.00 C ATOM 1878 CG TYR A 113 13.436 -7.353 -1.487 1.00 0.00 C ATOM 1879 CD1 TYR A 113 13.463 -7.479 -0.094 1.00 0.00 C ATOM 1880 CD2 TYR A 113 14.621 -7.622 -2.184 1.00 0.00 C ATOM 1881 CE1 TYR A 113 14.610 -7.859 0.572 1.00 0.00 C ATOM 1882 CE2 TYR A 113 15.770 -8.002 -1.519 1.00 0.00 C ATOM 1883 CZ TYR A 113 15.758 -8.121 -0.143 1.00 0.00 C ATOM 1884 OH TYR A 113 16.903 -8.499 0.523 1.00 0.00 O ATOM 0 H TYR A 113 11.816 -9.116 -0.792 1.00 0.00 H new ATOM 0 HA TYR A 113 10.172 -7.589 -2.709 1.00 0.00 H new ATOM 0 HB2 TYR A 113 12.412 -6.488 -3.170 1.00 0.00 H new ATOM 0 HB3 TYR A 113 11.645 -6.168 -1.627 1.00 0.00 H new ATOM 0 HD1 TYR A 113 12.566 -7.274 0.472 1.00 0.00 H new ATOM 0 HD2 TYR A 113 14.636 -7.531 -3.260 1.00 0.00 H new ATOM 0 HE1 TYR A 113 14.608 -7.951 1.648 1.00 0.00 H new ATOM 0 HE2 TYR A 113 16.675 -8.205 -2.073 1.00 0.00 H new ATOM 0 HH TYR A 113 17.624 -8.648 -0.124 1.00 0.00 H new ATOM 1894 N GLY A 114 10.450 -9.296 -4.507 1.00 0.00 N ATOM 1895 CA GLY A 114 10.596 -10.069 -5.744 1.00 0.00 C ATOM 1896 C GLY A 114 9.449 -9.782 -6.705 1.00 0.00 C ATOM 1897 O GLY A 114 8.388 -9.340 -6.273 1.00 0.00 O ATOM 0 H GLY A 114 9.486 -9.029 -4.307 1.00 0.00 H new ATOM 0 HA2 GLY A 114 11.545 -9.823 -6.221 1.00 0.00 H new ATOM 0 HA3 GLY A 114 10.622 -11.133 -5.511 1.00 0.00 H new ATOM 1901 N GLN A 115 9.643 -10.092 -8.000 1.00 0.00 N ATOM 1902 CA GLN A 115 8.710 -9.691 -9.094 1.00 0.00 C ATOM 1903 C GLN A 115 7.253 -10.215 -8.908 1.00 0.00 C ATOM 1904 O GLN A 115 6.316 -9.634 -9.464 1.00 0.00 O ATOM 1905 CB GLN A 115 9.277 -10.143 -10.473 1.00 0.00 C ATOM 1906 CG GLN A 115 9.439 -11.668 -10.632 1.00 0.00 C ATOM 1907 CD GLN A 115 10.012 -12.116 -11.986 1.00 0.00 C ATOM 1908 OE1 GLN A 115 10.721 -13.121 -12.064 1.00 0.00 O ATOM 1909 NE2 GLN A 115 9.676 -11.417 -13.065 1.00 0.00 N ATOM 0 H GLN A 115 10.447 -10.627 -8.328 1.00 0.00 H new ATOM 0 HA GLN A 115 8.644 -8.604 -9.054 1.00 0.00 H new ATOM 0 HB2 GLN A 115 8.617 -9.777 -11.260 1.00 0.00 H new ATOM 0 HB3 GLN A 115 10.247 -9.670 -10.625 1.00 0.00 H new ATOM 0 HG2 GLN A 115 10.090 -12.035 -9.838 1.00 0.00 H new ATOM 0 HG3 GLN A 115 8.467 -12.140 -10.491 1.00 0.00 H new ATOM 0 HE21 GLN A 115 9.088 -10.589 -12.973 1.00 0.00 H new ATOM 0 HE22 GLN A 115 10.006 -11.709 -13.985 1.00 0.00 H new ATOM 1918 N PHE A 116 7.077 -11.305 -8.130 1.00 0.00 N ATOM 1919 CA PHE A 116 5.748 -11.909 -7.865 1.00 0.00 C ATOM 1920 C PHE A 116 5.204 -11.488 -6.479 1.00 0.00 C ATOM 1921 O PHE A 116 3.990 -11.326 -6.308 1.00 0.00 O ATOM 1922 CB PHE A 116 5.837 -13.456 -7.950 1.00 0.00 C ATOM 1923 CG PHE A 116 6.405 -13.986 -9.265 1.00 0.00 C ATOM 1924 CD1 PHE A 116 5.759 -13.736 -10.475 1.00 0.00 C ATOM 1925 CD2 PHE A 116 7.580 -14.739 -9.290 1.00 0.00 C ATOM 1926 CE1 PHE A 116 6.271 -14.219 -11.664 1.00 0.00 C ATOM 1927 CE2 PHE A 116 8.091 -15.221 -10.479 1.00 0.00 C ATOM 1928 CZ PHE A 116 7.436 -14.960 -11.666 1.00 0.00 C ATOM 0 H PHE A 116 7.846 -11.791 -7.669 1.00 0.00 H new ATOM 0 HA PHE A 116 5.057 -11.544 -8.625 1.00 0.00 H new ATOM 0 HB2 PHE A 116 6.457 -13.817 -7.129 1.00 0.00 H new ATOM 0 HB3 PHE A 116 4.841 -13.873 -7.805 1.00 0.00 H new ATOM 0 HD1 PHE A 116 4.847 -13.158 -10.483 1.00 0.00 H new ATOM 0 HD2 PHE A 116 8.097 -14.948 -8.365 1.00 0.00 H new ATOM 0 HE1 PHE A 116 5.759 -14.017 -12.593 1.00 0.00 H new ATOM 0 HE2 PHE A 116 9.002 -15.801 -10.480 1.00 0.00 H new ATOM 0 HZ PHE A 116 7.835 -15.336 -12.597 1.00 0.00 H new ATOM 1938 N THR A 117 6.119 -11.323 -5.499 1.00 0.00 N ATOM 1939 CA THR A 117 5.768 -11.013 -4.095 1.00 0.00 C ATOM 1940 C THR A 117 5.651 -9.493 -3.854 1.00 0.00 C ATOM 1941 O THR A 117 5.164 -9.065 -2.807 1.00 0.00 O ATOM 1942 CB THR A 117 6.825 -11.631 -3.119 1.00 0.00 C ATOM 1943 OG1 THR A 117 8.150 -11.308 -3.575 1.00 0.00 O ATOM 1944 CG2 THR A 117 6.680 -13.161 -2.992 1.00 0.00 C ATOM 0 H THR A 117 7.123 -11.401 -5.659 1.00 0.00 H new ATOM 0 HA THR A 117 4.792 -11.457 -3.898 1.00 0.00 H new ATOM 0 HB THR A 117 6.650 -11.202 -2.132 1.00 0.00 H new ATOM 0 HG1 THR A 117 8.529 -10.606 -3.007 1.00 0.00 H new ATOM 0 HG21 THR A 117 7.435 -13.542 -2.305 1.00 0.00 H new ATOM 0 HG22 THR A 117 5.688 -13.402 -2.611 1.00 0.00 H new ATOM 0 HG23 THR A 117 6.815 -13.622 -3.971 1.00 0.00 H new ATOM 1952 N THR A 118 6.097 -8.689 -4.826 1.00 0.00 N ATOM 1953 CA THR A 118 5.980 -7.222 -4.798 1.00 0.00 C ATOM 1954 C THR A 118 5.688 -6.712 -6.213 1.00 0.00 C ATOM 1955 O THR A 118 6.226 -7.244 -7.191 1.00 0.00 O ATOM 1956 CB THR A 118 7.273 -6.511 -4.249 1.00 0.00 C ATOM 1957 OG1 THR A 118 8.453 -7.024 -4.885 1.00 0.00 O ATOM 1958 CG2 THR A 118 7.428 -6.634 -2.724 1.00 0.00 C ATOM 0 H THR A 118 6.556 -9.041 -5.666 1.00 0.00 H new ATOM 0 HA THR A 118 5.165 -6.978 -4.116 1.00 0.00 H new ATOM 0 HB THR A 118 7.152 -5.454 -4.487 1.00 0.00 H new ATOM 0 HG1 THR A 118 8.237 -7.859 -5.350 1.00 0.00 H new ATOM 0 HG21 THR A 118 8.338 -6.124 -2.408 1.00 0.00 H new ATOM 0 HG22 THR A 118 6.568 -6.179 -2.233 1.00 0.00 H new ATOM 0 HG23 THR A 118 7.488 -7.687 -2.448 1.00 0.00 H new ATOM 1966 N CYS A 119 4.845 -5.675 -6.310 1.00 0.00 N ATOM 1967 CA CYS A 119 4.503 -5.025 -7.580 1.00 0.00 C ATOM 1968 C CYS A 119 4.525 -3.501 -7.414 1.00 0.00 C ATOM 1969 O CYS A 119 4.551 -2.973 -6.291 1.00 0.00 O ATOM 1970 CB CYS A 119 3.124 -5.508 -8.092 1.00 0.00 C ATOM 1971 SG CYS A 119 3.065 -7.267 -8.510 1.00 0.00 S ATOM 0 H CYS A 119 4.378 -5.261 -5.503 1.00 0.00 H new ATOM 0 HA CYS A 119 5.248 -5.302 -8.325 1.00 0.00 H new ATOM 0 HB2 CYS A 119 2.373 -5.302 -7.330 1.00 0.00 H new ATOM 0 HB3 CYS A 119 2.852 -4.927 -8.973 1.00 0.00 H new ATOM 0 HG CYS A 119 1.864 -7.721 -8.308 1.00 0.00 H new ATOM 1977 N PHE A 120 4.517 -2.812 -8.558 1.00 0.00 N ATOM 1978 CA PHE A 120 4.603 -1.353 -8.637 1.00 0.00 C ATOM 1979 C PHE A 120 3.195 -0.740 -8.572 1.00 0.00 C ATOM 1980 O PHE A 120 2.327 -1.089 -9.380 1.00 0.00 O ATOM 1981 CB PHE A 120 5.298 -0.957 -9.957 1.00 0.00 C ATOM 1982 CG PHE A 120 6.652 -1.630 -10.198 1.00 0.00 C ATOM 1983 CD1 PHE A 120 7.746 -1.362 -9.372 1.00 0.00 C ATOM 1984 CD2 PHE A 120 6.830 -2.524 -11.257 1.00 0.00 C ATOM 1985 CE1 PHE A 120 8.970 -1.964 -9.602 1.00 0.00 C ATOM 1986 CE2 PHE A 120 8.056 -3.120 -11.483 1.00 0.00 C ATOM 1987 CZ PHE A 120 9.124 -2.840 -10.656 1.00 0.00 C ATOM 0 H PHE A 120 4.449 -3.261 -9.471 1.00 0.00 H new ATOM 0 HA PHE A 120 5.184 -0.975 -7.796 1.00 0.00 H new ATOM 0 HB2 PHE A 120 4.635 -1.200 -10.787 1.00 0.00 H new ATOM 0 HB3 PHE A 120 5.439 0.124 -9.967 1.00 0.00 H new ATOM 0 HD1 PHE A 120 7.635 -0.677 -8.544 1.00 0.00 H new ATOM 0 HD2 PHE A 120 5.999 -2.752 -11.907 1.00 0.00 H new ATOM 0 HE1 PHE A 120 9.807 -1.748 -8.955 1.00 0.00 H new ATOM 0 HE2 PHE A 120 8.178 -3.806 -12.308 1.00 0.00 H new ATOM 0 HZ PHE A 120 10.081 -3.307 -10.834 1.00 0.00 H new ATOM 1997 N VAL A 121 2.969 0.155 -7.596 1.00 0.00 N ATOM 1998 CA VAL A 121 1.677 0.852 -7.402 1.00 0.00 C ATOM 1999 C VAL A 121 1.917 2.364 -7.233 1.00 0.00 C ATOM 2000 O VAL A 121 3.060 2.833 -7.291 1.00 0.00 O ATOM 2001 CB VAL A 121 0.889 0.301 -6.141 1.00 0.00 C ATOM 2002 CG1 VAL A 121 0.553 -1.209 -6.279 1.00 0.00 C ATOM 2003 CG2 VAL A 121 1.670 0.588 -4.833 1.00 0.00 C ATOM 0 H VAL A 121 3.679 0.420 -6.913 1.00 0.00 H new ATOM 0 HA VAL A 121 1.069 0.665 -8.287 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.061 0.833 -6.092 1.00 0.00 H new ATOM 0 HG11 VAL A 121 0.013 -1.544 -5.393 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.067 -1.365 -7.162 1.00 0.00 H new ATOM 0 HG13 VAL A 121 1.476 -1.780 -6.379 1.00 0.00 H new ATOM 0 HG21 VAL A 121 1.109 0.201 -3.982 1.00 0.00 H new ATOM 0 HG22 VAL A 121 2.645 0.102 -4.877 1.00 0.00 H new ATOM 0 HG23 VAL A 121 1.806 1.663 -4.719 1.00 0.00 H new ATOM 2013 N VAL A 122 0.822 3.115 -7.046 1.00 0.00 N ATOM 2014 CA VAL A 122 0.875 4.534 -6.648 1.00 0.00 C ATOM 2015 C VAL A 122 0.946 4.658 -5.108 1.00 0.00 C ATOM 2016 O VAL A 122 0.758 3.676 -4.386 1.00 0.00 O ATOM 2017 CB VAL A 122 -0.358 5.336 -7.215 1.00 0.00 C ATOM 2018 CG1 VAL A 122 -0.368 5.339 -8.765 1.00 0.00 C ATOM 2019 CG2 VAL A 122 -1.701 4.804 -6.648 1.00 0.00 C ATOM 0 H VAL A 122 -0.126 2.758 -7.166 1.00 0.00 H new ATOM 0 HA VAL A 122 1.778 4.970 -7.076 1.00 0.00 H new ATOM 0 HB VAL A 122 -0.249 6.368 -6.881 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -1.231 5.901 -9.122 1.00 0.00 H new ATOM 0 HG12 VAL A 122 0.546 5.805 -9.134 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -0.426 4.314 -9.130 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -2.526 5.383 -7.063 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -1.821 3.755 -6.920 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.701 4.900 -5.562 1.00 0.00 H new ATOM 2029 N ARG A 123 1.195 5.885 -4.628 1.00 0.00 N ATOM 2030 CA ARG A 123 1.353 6.180 -3.187 1.00 0.00 C ATOM 2031 C ARG A 123 0.070 5.860 -2.395 1.00 0.00 C ATOM 2032 O ARG A 123 0.156 5.315 -1.301 1.00 0.00 O ATOM 2033 CB ARG A 123 1.736 7.663 -2.992 1.00 0.00 C ATOM 2034 CG ARG A 123 3.114 8.055 -3.577 1.00 0.00 C ATOM 2035 CD ARG A 123 4.268 7.821 -2.595 1.00 0.00 C ATOM 2036 NE ARG A 123 5.565 7.802 -3.287 1.00 0.00 N ATOM 2037 CZ ARG A 123 6.396 8.840 -3.429 1.00 0.00 C ATOM 2038 NH1 ARG A 123 6.097 10.040 -2.925 1.00 0.00 N ATOM 2039 NH2 ARG A 123 7.532 8.667 -4.081 1.00 0.00 N ATOM 0 H ARG A 123 1.294 6.706 -5.225 1.00 0.00 H new ATOM 0 HA ARG A 123 2.149 5.543 -2.802 1.00 0.00 H new ATOM 0 HB2 ARG A 123 0.970 8.286 -3.453 1.00 0.00 H new ATOM 0 HB3 ARG A 123 1.731 7.889 -1.926 1.00 0.00 H new ATOM 0 HG2 ARG A 123 3.294 7.480 -4.485 1.00 0.00 H new ATOM 0 HG3 ARG A 123 3.095 9.106 -3.864 1.00 0.00 H new ATOM 0 HD2 ARG A 123 4.269 8.606 -1.838 1.00 0.00 H new ATOM 0 HD3 ARG A 123 4.118 6.876 -2.074 1.00 0.00 H new ATOM 0 HE ARG A 123 5.858 6.915 -3.697 1.00 0.00 H new ATOM 0 HH11 ARG A 123 5.221 10.178 -2.421 1.00 0.00 H new ATOM 0 HH12 ARG A 123 6.745 10.819 -3.044 1.00 0.00 H new ATOM 0 HH21 ARG A 123 7.764 7.752 -4.467 1.00 0.00 H new ATOM 0 HH22 ARG A 123 8.177 9.449 -4.198 1.00 0.00 H new ATOM 2053 N LEU A 124 -1.111 6.178 -2.981 1.00 0.00 N ATOM 2054 CA LEU A 124 -2.426 5.951 -2.326 1.00 0.00 C ATOM 2055 C LEU A 124 -2.608 4.442 -2.030 1.00 0.00 C ATOM 2056 O LEU A 124 -2.932 4.061 -0.903 1.00 0.00 O ATOM 2057 CB LEU A 124 -3.611 6.479 -3.220 1.00 0.00 C ATOM 2058 CG LEU A 124 -4.897 7.030 -2.485 1.00 0.00 C ATOM 2059 CD1 LEU A 124 -5.471 6.063 -1.446 1.00 0.00 C ATOM 2060 CD2 LEU A 124 -4.630 8.396 -1.845 1.00 0.00 C ATOM 0 H LEU A 124 -1.181 6.594 -3.910 1.00 0.00 H new ATOM 0 HA LEU A 124 -2.443 6.509 -1.390 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -3.222 7.274 -3.857 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -3.922 5.667 -3.878 1.00 0.00 H new ATOM 0 HG LEU A 124 -5.653 7.139 -3.263 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -6.351 6.508 -0.982 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -5.750 5.129 -1.933 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -4.720 5.863 -0.681 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -5.534 8.748 -1.348 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -3.826 8.305 -1.115 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -4.340 9.109 -2.617 1.00 0.00 H new ATOM 2072 N GLN A 125 -2.362 3.606 -3.055 1.00 0.00 N ATOM 2073 CA GLN A 125 -2.546 2.144 -2.960 1.00 0.00 C ATOM 2074 C GLN A 125 -1.500 1.503 -2.044 1.00 0.00 C ATOM 2075 O GLN A 125 -1.798 0.489 -1.397 1.00 0.00 O ATOM 2076 CB GLN A 125 -2.528 1.489 -4.359 1.00 0.00 C ATOM 2077 CG GLN A 125 -3.687 1.925 -5.275 1.00 0.00 C ATOM 2078 CD GLN A 125 -5.073 1.680 -4.663 1.00 0.00 C ATOM 2079 OE1 GLN A 125 -5.642 2.556 -4.011 1.00 0.00 O ATOM 2080 NE2 GLN A 125 -5.612 0.484 -4.855 1.00 0.00 N ATOM 0 H GLN A 125 -2.032 3.921 -3.967 1.00 0.00 H new ATOM 0 HA GLN A 125 -3.526 1.968 -2.516 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -1.584 1.728 -4.848 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -2.560 0.406 -4.241 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -3.581 2.986 -5.503 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -3.615 1.387 -6.220 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -5.113 -0.219 -5.401 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -6.526 0.267 -4.457 1.00 0.00 H new ATOM 2089 N PHE A 126 -0.282 2.095 -1.990 1.00 0.00 N ATOM 2090 CA PHE A 126 0.732 1.702 -1.000 1.00 0.00 C ATOM 2091 C PHE A 126 0.154 1.857 0.408 1.00 0.00 C ATOM 2092 O PHE A 126 0.051 0.884 1.138 1.00 0.00 O ATOM 2093 CB PHE A 126 2.025 2.536 -1.141 1.00 0.00 C ATOM 2094 CG PHE A 126 3.086 2.239 -0.066 1.00 0.00 C ATOM 2095 CD1 PHE A 126 3.699 0.986 0.004 1.00 0.00 C ATOM 2096 CD2 PHE A 126 3.477 3.211 0.861 1.00 0.00 C ATOM 2097 CE1 PHE A 126 4.662 0.714 0.960 1.00 0.00 C ATOM 2098 CE2 PHE A 126 4.440 2.933 1.819 1.00 0.00 C ATOM 2099 CZ PHE A 126 5.031 1.686 1.867 1.00 0.00 C ATOM 0 H PHE A 126 0.014 2.841 -2.619 1.00 0.00 H new ATOM 0 HA PHE A 126 0.996 0.660 -1.179 1.00 0.00 H new ATOM 0 HB2 PHE A 126 2.458 2.351 -2.124 1.00 0.00 H new ATOM 0 HB3 PHE A 126 1.768 3.594 -1.100 1.00 0.00 H new ATOM 0 HD1 PHE A 126 3.417 0.217 -0.700 1.00 0.00 H new ATOM 0 HD2 PHE A 126 3.023 4.190 0.830 1.00 0.00 H new ATOM 0 HE1 PHE A 126 5.125 -0.261 0.996 1.00 0.00 H new ATOM 0 HE2 PHE A 126 4.729 3.694 2.529 1.00 0.00 H new ATOM 0 HZ PHE A 126 5.781 1.472 2.614 1.00 0.00 H new ATOM 2109 N TYR A 127 -0.292 3.090 0.718 1.00 0.00 N ATOM 2110 CA TYR A 127 -0.863 3.450 2.029 1.00 0.00 C ATOM 2111 C TYR A 127 -2.036 2.514 2.394 1.00 0.00 C ATOM 2112 O TYR A 127 -2.106 2.006 3.505 1.00 0.00 O ATOM 2113 CB TYR A 127 -1.339 4.934 2.038 1.00 0.00 C ATOM 2114 CG TYR A 127 -0.258 5.995 1.741 1.00 0.00 C ATOM 2115 CD1 TYR A 127 1.078 5.794 2.088 1.00 0.00 C ATOM 2116 CD2 TYR A 127 -0.584 7.198 1.102 1.00 0.00 C ATOM 2117 CE1 TYR A 127 2.045 6.741 1.813 1.00 0.00 C ATOM 2118 CE2 TYR A 127 0.382 8.145 0.821 1.00 0.00 C ATOM 2119 CZ TYR A 127 1.695 7.913 1.177 1.00 0.00 C ATOM 2120 OH TYR A 127 2.661 8.859 0.898 1.00 0.00 O ATOM 0 H TYR A 127 -0.266 3.869 0.060 1.00 0.00 H new ATOM 0 HA TYR A 127 -0.079 3.332 2.777 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -2.137 5.043 1.304 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -1.772 5.150 3.015 1.00 0.00 H new ATOM 0 HD1 TYR A 127 1.363 4.877 2.583 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -1.610 7.389 0.824 1.00 0.00 H new ATOM 0 HE1 TYR A 127 3.072 6.564 2.095 1.00 0.00 H new ATOM 0 HE2 TYR A 127 0.110 9.065 0.324 1.00 0.00 H new ATOM 0 HH TYR A 127 2.248 9.625 0.447 1.00 0.00 H new ATOM 2130 N ALA A 128 -2.891 2.245 1.402 1.00 0.00 N ATOM 2131 CA ALA A 128 -4.122 1.454 1.572 1.00 0.00 C ATOM 2132 C ALA A 128 -3.842 0.038 2.146 1.00 0.00 C ATOM 2133 O ALA A 128 -4.217 -0.265 3.293 1.00 0.00 O ATOM 2134 CB ALA A 128 -4.838 1.389 0.211 1.00 0.00 C ATOM 0 H ALA A 128 -2.749 2.572 0.446 1.00 0.00 H new ATOM 0 HA ALA A 128 -4.764 1.940 2.307 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -5.755 0.808 0.310 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -5.082 2.398 -0.120 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -4.185 0.915 -0.522 1.00 0.00 H new ATOM 2140 N PHE A 129 -3.106 -0.782 1.377 1.00 0.00 N ATOM 2141 CA PHE A 129 -2.839 -2.199 1.726 1.00 0.00 C ATOM 2142 C PHE A 129 -1.763 -2.327 2.829 1.00 0.00 C ATOM 2143 O PHE A 129 -1.801 -3.276 3.627 1.00 0.00 O ATOM 2144 CB PHE A 129 -2.409 -2.994 0.470 1.00 0.00 C ATOM 2145 CG PHE A 129 -3.485 -3.109 -0.609 1.00 0.00 C ATOM 2146 CD1 PHE A 129 -4.527 -4.029 -0.476 1.00 0.00 C ATOM 2147 CD2 PHE A 129 -3.458 -2.305 -1.753 1.00 0.00 C ATOM 2148 CE1 PHE A 129 -5.501 -4.142 -1.452 1.00 0.00 C ATOM 2149 CE2 PHE A 129 -4.432 -2.419 -2.727 1.00 0.00 C ATOM 2150 CZ PHE A 129 -5.454 -3.337 -2.576 1.00 0.00 C ATOM 0 H PHE A 129 -2.678 -0.489 0.499 1.00 0.00 H new ATOM 0 HA PHE A 129 -3.767 -2.618 2.116 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -1.529 -2.517 0.038 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -2.111 -3.997 0.775 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -4.573 -4.660 0.399 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -2.664 -1.584 -1.877 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -6.299 -4.860 -1.336 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -4.394 -1.791 -3.605 1.00 0.00 H new ATOM 0 HZ PHE A 129 -6.216 -3.426 -3.336 1.00 0.00 H new ATOM 2160 N GLU A 130 -0.814 -1.363 2.869 1.00 0.00 N ATOM 2161 CA GLU A 130 0.291 -1.371 3.853 1.00 0.00 C ATOM 2162 C GLU A 130 -0.267 -1.113 5.267 1.00 0.00 C ATOM 2163 O GLU A 130 -0.217 -2.002 6.110 1.00 0.00 O ATOM 2164 CB GLU A 130 1.374 -0.320 3.487 1.00 0.00 C ATOM 2165 CG GLU A 130 2.663 -0.370 4.331 1.00 0.00 C ATOM 2166 CD GLU A 130 3.464 -1.669 4.154 1.00 0.00 C ATOM 2167 OE1 GLU A 130 4.213 -1.801 3.162 1.00 0.00 O ATOM 2168 OE2 GLU A 130 3.361 -2.562 5.011 1.00 0.00 O ATOM 0 H GLU A 130 -0.793 -0.569 2.229 1.00 0.00 H new ATOM 0 HA GLU A 130 0.766 -2.352 3.834 1.00 0.00 H new ATOM 0 HB2 GLU A 130 1.642 -0.451 2.439 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.937 0.674 3.582 1.00 0.00 H new ATOM 0 HG2 GLU A 130 3.296 0.476 4.063 1.00 0.00 H new ATOM 0 HG3 GLU A 130 2.403 -0.254 5.383 1.00 0.00 H new ATOM 2175 N ILE A 131 -0.872 0.082 5.479 1.00 0.00 N ATOM 2176 CA ILE A 131 -1.441 0.499 6.793 1.00 0.00 C ATOM 2177 C ILE A 131 -2.444 -0.543 7.320 1.00 0.00 C ATOM 2178 O ILE A 131 -2.487 -0.820 8.528 1.00 0.00 O ATOM 2179 CB ILE A 131 -2.150 1.900 6.692 1.00 0.00 C ATOM 2180 CG1 ILE A 131 -1.122 2.998 6.275 1.00 0.00 C ATOM 2181 CG2 ILE A 131 -2.879 2.283 8.013 1.00 0.00 C ATOM 2182 CD1 ILE A 131 -1.737 4.271 5.727 1.00 0.00 C ATOM 0 H ILE A 131 -0.981 0.785 4.748 1.00 0.00 H new ATOM 0 HA ILE A 131 -0.607 0.576 7.491 1.00 0.00 H new ATOM 0 HB ILE A 131 -2.916 1.829 5.920 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -0.510 3.251 7.141 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -0.452 2.582 5.522 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -3.354 3.257 7.897 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -3.638 1.534 8.240 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -2.156 2.326 8.828 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -0.946 4.974 5.465 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -2.325 4.038 4.839 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -2.383 4.718 6.483 1.00 0.00 H new ATOM 2194 N ALA A 132 -3.221 -1.120 6.382 1.00 0.00 N ATOM 2195 CA ALA A 132 -4.149 -2.216 6.672 1.00 0.00 C ATOM 2196 C ALA A 132 -3.436 -3.378 7.380 1.00 0.00 C ATOM 2197 O ALA A 132 -3.740 -3.688 8.538 1.00 0.00 O ATOM 2198 CB ALA A 132 -4.828 -2.686 5.375 1.00 0.00 C ATOM 0 H ALA A 132 -3.218 -0.834 5.403 1.00 0.00 H new ATOM 0 HA ALA A 132 -4.917 -1.848 7.352 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -5.516 -3.501 5.599 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -5.380 -1.857 4.932 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -4.070 -3.034 4.673 1.00 0.00 H new ATOM 2204 N ARG A 133 -2.442 -3.970 6.697 1.00 0.00 N ATOM 2205 CA ARG A 133 -1.672 -5.108 7.235 1.00 0.00 C ATOM 2206 C ARG A 133 -0.771 -4.698 8.436 1.00 0.00 C ATOM 2207 O ARG A 133 -0.339 -5.560 9.197 1.00 0.00 O ATOM 2208 CB ARG A 133 -0.850 -5.808 6.113 1.00 0.00 C ATOM 2209 CG ARG A 133 0.424 -5.076 5.658 1.00 0.00 C ATOM 2210 CD ARG A 133 1.265 -5.900 4.664 1.00 0.00 C ATOM 2211 NE ARG A 133 2.570 -5.249 4.442 1.00 0.00 N ATOM 2212 CZ ARG A 133 3.776 -5.822 4.595 1.00 0.00 C ATOM 2213 NH1 ARG A 133 3.894 -7.133 4.796 1.00 0.00 N ATOM 2214 NH2 ARG A 133 4.866 -5.062 4.524 1.00 0.00 N ATOM 0 H ARG A 133 -2.150 -3.678 5.764 1.00 0.00 H new ATOM 0 HA ARG A 133 -2.393 -5.829 7.621 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -0.570 -6.802 6.461 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -1.497 -5.944 5.246 1.00 0.00 H new ATOM 0 HG2 ARG A 133 0.147 -4.129 5.195 1.00 0.00 H new ATOM 0 HG3 ARG A 133 1.032 -4.838 6.531 1.00 0.00 H new ATOM 0 HD2 ARG A 133 1.414 -6.908 5.050 1.00 0.00 H new ATOM 0 HD3 ARG A 133 0.732 -5.997 3.718 1.00 0.00 H new ATOM 0 HE ARG A 133 2.556 -4.273 4.145 1.00 0.00 H new ATOM 0 HH11 ARG A 133 3.061 -7.720 4.836 1.00 0.00 H new ATOM 0 HH12 ARG A 133 4.818 -7.550 4.910 1.00 0.00 H new ATOM 0 HH21 ARG A 133 4.779 -4.060 4.356 1.00 0.00 H new ATOM 0 HH22 ARG A 133 5.789 -5.482 4.638 1.00 0.00 H new ATOM 2228 N ASN A 134 -0.495 -3.382 8.597 1.00 0.00 N ATOM 2229 CA ASN A 134 0.292 -2.860 9.746 1.00 0.00 C ATOM 2230 C ASN A 134 -0.477 -3.041 11.061 1.00 0.00 C ATOM 2231 O ASN A 134 0.008 -3.695 11.993 1.00 0.00 O ATOM 2232 CB ASN A 134 0.686 -1.362 9.548 1.00 0.00 C ATOM 2233 CG ASN A 134 1.850 -1.122 8.570 1.00 0.00 C ATOM 2234 OD1 ASN A 134 1.987 -1.955 7.551 1.00 0.00 O flip ATOM 2235 ND2 ASN A 134 2.613 -0.163 8.720 1.00 0.00 N flip ATOM 0 H ASN A 134 -0.805 -2.660 7.947 1.00 0.00 H new ATOM 0 HA ASN A 134 1.213 -3.441 9.796 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -0.187 -0.816 9.192 1.00 0.00 H new ATOM 0 HB3 ASN A 134 0.952 -0.940 10.517 1.00 0.00 H new ATOM 0 HD21 ASN A 134 2.490 0.467 9.512 1.00 0.00 H new ATOM 0 HD22 ASN A 134 3.366 -0.001 8.051 1.00 0.00 H new ATOM 2242 N LYS A 135 -1.693 -2.474 11.115 1.00 0.00 N ATOM 2243 CA LYS A 135 -2.543 -2.518 12.323 1.00 0.00 C ATOM 2244 C LYS A 135 -3.286 -3.867 12.452 1.00 0.00 C ATOM 2245 O LYS A 135 -3.882 -4.160 13.491 1.00 0.00 O ATOM 2246 CB LYS A 135 -3.509 -1.309 12.331 1.00 0.00 C ATOM 2247 CG LYS A 135 -4.437 -1.194 11.102 1.00 0.00 C ATOM 2248 CD LYS A 135 -5.255 0.117 11.108 1.00 0.00 C ATOM 2249 CE LYS A 135 -6.206 0.231 12.316 1.00 0.00 C ATOM 2250 NZ LYS A 135 -6.996 1.489 12.300 1.00 0.00 N ATOM 0 H LYS A 135 -2.115 -1.975 10.331 1.00 0.00 H new ATOM 0 HA LYS A 135 -1.904 -2.443 13.203 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -4.127 -1.365 13.227 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -2.920 -0.395 12.407 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -3.839 -1.243 10.192 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -5.118 -2.045 11.082 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -4.571 0.965 11.111 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -5.837 0.180 10.188 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -6.886 -0.621 12.321 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -5.626 0.182 13.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -7.668 1.487 13.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -6.355 2.303 12.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -7.520 1.559 11.404 1.00 0.00 H new ATOM 2264 N HIS A 136 -3.242 -4.687 11.387 1.00 0.00 N ATOM 2265 CA HIS A 136 -3.687 -6.100 11.447 1.00 0.00 C ATOM 2266 C HIS A 136 -2.568 -7.010 12.009 1.00 0.00 C ATOM 2267 O HIS A 136 -2.837 -8.159 12.379 1.00 0.00 O ATOM 2268 CB HIS A 136 -4.152 -6.603 10.042 1.00 0.00 C ATOM 2269 CG HIS A 136 -5.600 -6.316 9.717 1.00 0.00 C ATOM 2270 ND1 HIS A 136 -6.544 -7.312 9.557 1.00 0.00 N ATOM 2271 CD2 HIS A 136 -6.255 -5.151 9.507 1.00 0.00 C ATOM 2272 CE1 HIS A 136 -7.710 -6.768 9.276 1.00 0.00 C ATOM 2273 NE2 HIS A 136 -7.567 -5.461 9.234 1.00 0.00 N ATOM 0 H HIS A 136 -2.902 -4.399 10.469 1.00 0.00 H new ATOM 0 HA HIS A 136 -4.540 -6.151 12.124 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -3.524 -6.142 9.280 1.00 0.00 H new ATOM 0 HB3 HIS A 136 -3.987 -7.679 9.983 1.00 0.00 H new ATOM 0 HD1 HIS A 136 -6.366 -8.313 9.643 1.00 0.00 H new ATOM 0 HD2 HIS A 136 -5.827 -4.160 9.546 1.00 0.00 H new ATOM 0 HE1 HIS A 136 -8.631 -7.306 9.108 1.00 0.00 H new ATOM 2282 N GLY A 137 -1.318 -6.493 12.062 1.00 0.00 N ATOM 2283 CA GLY A 137 -0.160 -7.258 12.578 1.00 0.00 C ATOM 2284 C GLY A 137 0.414 -8.258 11.569 1.00 0.00 C ATOM 2285 O GLY A 137 1.191 -9.147 11.928 1.00 0.00 O ATOM 0 H GLY A 137 -1.086 -5.549 11.753 1.00 0.00 H new ATOM 0 HA2 GLY A 137 0.624 -6.560 12.871 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -0.462 -7.795 13.477 1.00 0.00 H new ATOM 2289 N LEU A 138 0.039 -8.074 10.299 1.00 0.00 N ATOM 2290 CA LEU A 138 0.456 -8.923 9.155 1.00 0.00 C ATOM 2291 C LEU A 138 1.848 -8.496 8.610 1.00 0.00 C ATOM 2292 O LEU A 138 2.347 -9.076 7.642 1.00 0.00 O ATOM 2293 CB LEU A 138 -0.638 -8.836 8.045 1.00 0.00 C ATOM 2294 CG LEU A 138 -1.929 -9.728 8.193 1.00 0.00 C ATOM 2295 CD1 LEU A 138 -2.369 -9.943 9.653 1.00 0.00 C ATOM 2296 CD2 LEU A 138 -3.091 -9.138 7.358 1.00 0.00 C ATOM 0 H LEU A 138 -0.580 -7.312 10.020 1.00 0.00 H new ATOM 0 HA LEU A 138 0.555 -9.956 9.488 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -0.959 -7.797 7.976 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -0.167 -9.088 7.095 1.00 0.00 H new ATOM 0 HG LEU A 138 -1.664 -10.713 7.809 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.263 -10.566 9.676 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -1.569 -10.436 10.205 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -2.587 -8.979 10.113 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -3.975 -9.765 7.471 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -3.314 -8.130 7.707 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -2.803 -9.103 6.307 1.00 0.00 H new ATOM 2308 N ASN A 139 2.447 -7.462 9.225 1.00 0.00 N ATOM 2309 CA ASN A 139 3.830 -7.007 8.935 1.00 0.00 C ATOM 2310 C ASN A 139 4.747 -7.249 10.155 1.00 0.00 C ATOM 2311 O ASN A 139 5.957 -7.022 10.085 1.00 0.00 O ATOM 2312 CB ASN A 139 3.832 -5.492 8.589 1.00 0.00 C ATOM 2313 CG ASN A 139 3.448 -4.600 9.783 1.00 0.00 C ATOM 2314 OD1 ASN A 139 2.630 -4.982 10.626 1.00 0.00 O ATOM 2315 ND2 ASN A 139 4.049 -3.426 9.873 1.00 0.00 N ATOM 0 H ASN A 139 1.985 -6.908 9.946 1.00 0.00 H new ATOM 0 HA ASN A 139 4.205 -7.577 8.085 1.00 0.00 H new ATOM 0 HB2 ASN A 139 4.823 -5.208 8.234 1.00 0.00 H new ATOM 0 HB3 ASN A 139 3.136 -5.312 7.770 1.00 0.00 H new ATOM 0 HD21 ASN A 139 3.842 -2.806 10.656 1.00 0.00 H new ATOM 0 HD22 ASN A 139 4.720 -3.140 9.160 1.00 0.00 H new ATOM 2322 N ASP A 140 4.147 -7.698 11.274 1.00 0.00 N ATOM 2323 CA ASP A 140 4.835 -7.799 12.582 1.00 0.00 C ATOM 2324 C ASP A 140 5.919 -8.899 12.583 1.00 0.00 C ATOM 2325 O ASP A 140 6.830 -8.874 13.406 1.00 0.00 O ATOM 2326 CB ASP A 140 3.792 -8.046 13.704 1.00 0.00 C ATOM 2327 CG ASP A 140 4.392 -8.027 15.128 1.00 0.00 C ATOM 2328 OD1 ASP A 140 4.852 -6.954 15.567 1.00 0.00 O ATOM 2329 OD2 ASP A 140 4.406 -9.082 15.807 1.00 0.00 O ATOM 0 H ASP A 140 3.173 -8.001 11.300 1.00 0.00 H new ATOM 0 HA ASP A 140 5.346 -6.855 12.769 1.00 0.00 H new ATOM 0 HB2 ASP A 140 3.014 -7.286 13.638 1.00 0.00 H new ATOM 0 HB3 ASP A 140 3.312 -9.010 13.535 1.00 0.00 H new ATOM 2334 N TRP A 141 5.822 -9.850 11.637 1.00 0.00 N ATOM 2335 CA TRP A 141 6.842 -10.903 11.444 1.00 0.00 C ATOM 2336 C TRP A 141 8.226 -10.304 11.082 1.00 0.00 C ATOM 2337 O TRP A 141 9.266 -10.882 11.410 1.00 0.00 O ATOM 2338 CB TRP A 141 6.373 -11.920 10.366 1.00 0.00 C ATOM 2339 CG TRP A 141 6.130 -11.306 9.003 1.00 0.00 C ATOM 2340 CD1 TRP A 141 5.020 -10.620 8.599 1.00 0.00 C ATOM 2341 CD2 TRP A 141 7.021 -11.316 7.878 1.00 0.00 C ATOM 2342 NE1 TRP A 141 5.180 -10.183 7.316 1.00 0.00 N ATOM 2343 CE2 TRP A 141 6.396 -10.608 6.846 1.00 0.00 C ATOM 2344 CE3 TRP A 141 8.287 -11.860 7.648 1.00 0.00 C ATOM 2345 CZ2 TRP A 141 6.999 -10.413 5.602 1.00 0.00 C ATOM 2346 CZ3 TRP A 141 8.883 -11.671 6.413 1.00 0.00 C ATOM 2347 CH2 TRP A 141 8.236 -10.954 5.403 1.00 0.00 C ATOM 0 H TRP A 141 5.039 -9.913 10.986 1.00 0.00 H new ATOM 0 HA TRP A 141 6.960 -11.431 12.390 1.00 0.00 H new ATOM 0 HB2 TRP A 141 7.124 -12.705 10.271 1.00 0.00 H new ATOM 0 HB3 TRP A 141 5.454 -12.397 10.707 1.00 0.00 H new ATOM 0 HD1 TRP A 141 4.144 -10.448 9.206 1.00 0.00 H new ATOM 0 HE1 TRP A 141 4.503 -9.629 6.791 1.00 0.00 H new ATOM 0 HE3 TRP A 141 8.793 -12.419 8.421 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 6.503 -9.853 4.823 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 9.863 -12.084 6.227 1.00 0.00 H new ATOM 0 HH2 TRP A 141 8.724 -10.826 4.448 1.00 0.00 H new ATOM 2358 N ILE A 142 8.211 -9.124 10.433 1.00 0.00 N ATOM 2359 CA ILE A 142 9.431 -8.428 9.976 1.00 0.00 C ATOM 2360 C ILE A 142 10.239 -7.879 11.171 1.00 0.00 C ATOM 2361 O ILE A 142 11.471 -7.844 11.120 1.00 0.00 O ATOM 2362 CB ILE A 142 9.082 -7.264 8.969 1.00 0.00 C ATOM 2363 CG1 ILE A 142 8.188 -7.805 7.813 1.00 0.00 C ATOM 2364 CG2 ILE A 142 10.354 -6.575 8.397 1.00 0.00 C ATOM 2365 CD1 ILE A 142 7.507 -6.748 6.959 1.00 0.00 C ATOM 0 H ILE A 142 7.350 -8.624 10.210 1.00 0.00 H new ATOM 0 HA ILE A 142 10.047 -9.159 9.452 1.00 0.00 H new ATOM 0 HB ILE A 142 8.532 -6.505 9.526 1.00 0.00 H new ATOM 0 HG12 ILE A 142 8.802 -8.430 7.165 1.00 0.00 H new ATOM 0 HG13 ILE A 142 7.421 -8.449 8.242 1.00 0.00 H new ATOM 0 HG21 ILE A 142 10.060 -5.782 7.710 1.00 0.00 H new ATOM 0 HG22 ILE A 142 10.936 -6.150 9.214 1.00 0.00 H new ATOM 0 HG23 ILE A 142 10.958 -7.310 7.865 1.00 0.00 H new ATOM 0 HD11 ILE A 142 6.911 -7.233 6.186 1.00 0.00 H new ATOM 0 HD12 ILE A 142 6.859 -6.136 7.586 1.00 0.00 H new ATOM 0 HD13 ILE A 142 8.262 -6.116 6.492 1.00 0.00 H new ATOM 2377 N VAL A 143 9.544 -7.495 12.268 1.00 0.00 N ATOM 2378 CA VAL A 143 10.222 -6.944 13.463 1.00 0.00 C ATOM 2379 C VAL A 143 11.061 -8.034 14.167 1.00 0.00 C ATOM 2380 O VAL A 143 12.044 -7.729 14.854 1.00 0.00 O ATOM 2381 CB VAL A 143 9.231 -6.227 14.479 1.00 0.00 C ATOM 2382 CG1 VAL A 143 8.214 -5.326 13.724 1.00 0.00 C ATOM 2383 CG2 VAL A 143 8.519 -7.213 15.446 1.00 0.00 C ATOM 0 H VAL A 143 8.529 -7.556 12.349 1.00 0.00 H new ATOM 0 HA VAL A 143 10.893 -6.163 13.105 1.00 0.00 H new ATOM 0 HB VAL A 143 9.848 -5.589 15.112 1.00 0.00 H new ATOM 0 HG11 VAL A 143 7.548 -4.848 14.442 1.00 0.00 H new ATOM 0 HG12 VAL A 143 8.752 -4.562 13.163 1.00 0.00 H new ATOM 0 HG13 VAL A 143 7.628 -5.936 13.037 1.00 0.00 H new ATOM 0 HG21 VAL A 143 7.858 -6.657 16.111 1.00 0.00 H new ATOM 0 HG22 VAL A 143 7.934 -7.930 14.869 1.00 0.00 H new ATOM 0 HG23 VAL A 143 9.264 -7.745 16.037 1.00 0.00 H new ATOM 2393 N GLY A 144 10.689 -9.309 13.944 1.00 0.00 N ATOM 2394 CA GLY A 144 11.395 -10.454 14.521 1.00 0.00 C ATOM 2395 C GLY A 144 11.942 -11.393 13.456 1.00 0.00 C ATOM 2396 O GLY A 144 11.768 -12.617 13.551 1.00 0.00 O ATOM 0 H GLY A 144 9.893 -9.567 13.360 1.00 0.00 H new ATOM 0 HA2 GLY A 144 12.216 -10.096 15.143 1.00 0.00 H new ATOM 0 HA3 GLY A 144 10.717 -11.004 15.174 1.00 0.00 H new ATOM 2400 N GLN A 145 12.599 -10.814 12.422 1.00 0.00 N ATOM 2401 CA GLN A 145 13.284 -11.599 11.373 1.00 0.00 C ATOM 2402 C GLN A 145 14.491 -12.341 11.963 1.00 0.00 C ATOM 2403 O GLN A 145 14.438 -13.556 12.205 1.00 0.00 O ATOM 2404 CB GLN A 145 13.733 -10.694 10.172 1.00 0.00 C ATOM 2405 CG GLN A 145 12.604 -10.267 9.228 1.00 0.00 C ATOM 2406 CD GLN A 145 11.888 -11.457 8.596 1.00 0.00 C ATOM 2407 OE1 GLN A 145 10.927 -11.976 9.153 1.00 0.00 O ATOM 2408 NE2 GLN A 145 12.358 -11.913 7.439 1.00 0.00 N ATOM 0 H GLN A 145 12.667 -9.804 12.294 1.00 0.00 H new ATOM 0 HA GLN A 145 12.572 -12.329 10.989 1.00 0.00 H new ATOM 0 HB2 GLN A 145 14.212 -9.799 10.570 1.00 0.00 H new ATOM 0 HB3 GLN A 145 14.487 -11.229 9.595 1.00 0.00 H new ATOM 0 HG2 GLN A 145 11.882 -9.664 9.779 1.00 0.00 H new ATOM 0 HG3 GLN A 145 13.013 -9.634 8.441 1.00 0.00 H new ATOM 0 HE21 GLN A 145 13.159 -11.460 7.000 1.00 0.00 H new ATOM 0 HE22 GLN A 145 11.917 -12.716 6.990 1.00 0.00 H new ATOM 2417 N LYS A 146 15.560 -11.576 12.233 1.00 0.00 N ATOM 2418 CA LYS A 146 16.862 -12.110 12.645 1.00 0.00 C ATOM 2419 C LYS A 146 17.680 -10.980 13.336 1.00 0.00 C ATOM 2420 O LYS A 146 17.278 -10.568 14.445 1.00 0.00 O ATOM 2421 CB LYS A 146 17.566 -12.760 11.395 1.00 0.00 C ATOM 2422 CG LYS A 146 17.596 -11.872 10.112 1.00 0.00 C ATOM 2423 CD LYS A 146 18.027 -12.644 8.841 1.00 0.00 C ATOM 2424 CE LYS A 146 17.011 -13.733 8.427 1.00 0.00 C ATOM 2425 NZ LYS A 146 17.410 -14.417 7.170 1.00 0.00 N ATOM 2426 OXT LYS A 146 18.696 -10.496 12.784 1.00 0.00 O ATOM 0 H LYS A 146 15.542 -10.558 12.170 1.00 0.00 H new ATOM 0 HA LYS A 146 16.763 -12.904 13.385 1.00 0.00 H new ATOM 0 HB2 LYS A 146 18.591 -13.013 11.666 1.00 0.00 H new ATOM 0 HB3 LYS A 146 17.059 -13.695 11.158 1.00 0.00 H new ATOM 0 HG2 LYS A 146 16.606 -11.445 9.951 1.00 0.00 H new ATOM 0 HG3 LYS A 146 18.280 -11.039 10.272 1.00 0.00 H new ATOM 0 HD2 LYS A 146 18.152 -11.939 8.019 1.00 0.00 H new ATOM 0 HD3 LYS A 146 18.998 -13.107 9.015 1.00 0.00 H new ATOM 0 HE2 LYS A 146 16.921 -14.468 9.227 1.00 0.00 H new ATOM 0 HE3 LYS A 146 16.028 -13.281 8.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 16.702 -15.139 6.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 17.471 -13.721 6.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 18.337 -14.871 7.301 1.00 0.00 H new