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 134 ASN : amide:sc= 0.45 K(o=0.94,f=-4.8) USER MOD Set 1.2: A 139 ASN : amide:sc= 0.488 K(o=0.94,f=-4.3!) USER MOD Set 2.1: A 52 TYR OH : rot 21:sc= 1.3 USER MOD Set 2.2: A 136 HIS : no HE2:sc= 0.745 K(o=2,f=-2.3) USER MOD Set 3.1: A 32 LYS NZ :NH3+ -166:sc= 0.319 (180deg=0) USER MOD Set 3.2: A 36 SER OG : rot 77:sc= 1.54 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN :FLIP amide:sc= -0.106 F(o=-0.82,f=-0.11) USER MOD Single : A 26 GLN : amide:sc= -0.108 X(o=-0.11,f=-0.07) USER MOD Single : A 29 THR OG1 : rot 78:sc= 1.28 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot -3:sc= 0.177 USER MOD Single : A 40 SER OG : rot 180:sc= 0.00202 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= 0.625 K(o=0.62,f=-3.3!) USER MOD Single : A 56 MET CE :methyl 133:sc= -0.337 (180deg=-1.61) USER MOD Single : A 62 TYR OH : rot -117:sc= -0.273 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+ -140:sc= 0.543 (180deg=-0.0857) USER MOD Single : A 72 THR OG1 : rot 123:sc= 0.875 USER MOD Single : A 77 LYS NZ :NH3+ -158:sc= 0.718 (180deg=0.463) USER MOD Single : A 78 THR OG1 : rot -165:sc= 0.174 USER MOD Single : A 79 LYS NZ :NH3+ -172:sc= -0.273 (180deg=-0.372) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 171:sc= -0.0168 (180deg=-0.11) USER MOD Single : A 90 THR OG1 : rot -6:sc= 0.324 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 154:sc= 0.495 (180deg=0.021) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc= 0.0685 K(o=0.068,f=-3.9!) USER MOD Single : A 103 THR OG1 : rot -157:sc= -1.49 USER MOD Single : A 107 THR OG1 : rot -55:sc= 0.83 USER MOD Single : A 110 SER OG : rot -38:sc= 0.402 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 GLN : amide:sc= -0.161 K(o=-0.16,f=-1.3) USER MOD Single : A 117 THR OG1 : rot -3:sc= 0.306 USER MOD Single : A 118 THR OG1 : rot -76:sc= 0.613 USER MOD Single : A 119 CYS SG : rot 14:sc= -0.211 USER MOD Single : A 125 GLN : amide:sc= -0.0346 X(o=-0.035,f=-0.47) USER MOD Single : A 127 TYR OH : rot 30:sc= -0.198 USER MOD Single : A 135 LYS NZ :NH3+ 179:sc= 0.836 (180deg=0.834) USER MOD Single : A 145 GLN : amide:sc= -0.339 X(o=-0.34,f=-0.17) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 200 N ILE A 15 12.282 9.221 -15.952 1.00 0.00 N ATOM 201 CA ILE A 15 11.095 8.990 -15.114 1.00 0.00 C ATOM 202 C ILE A 15 11.085 7.549 -14.569 1.00 0.00 C ATOM 203 O ILE A 15 10.838 7.336 -13.384 1.00 0.00 O ATOM 204 CB ILE A 15 9.776 9.300 -15.918 1.00 0.00 C ATOM 205 CG1 ILE A 15 9.803 10.767 -16.458 1.00 0.00 C ATOM 206 CG2 ILE A 15 8.507 9.039 -15.068 1.00 0.00 C ATOM 207 CD1 ILE A 15 9.972 11.827 -15.385 1.00 0.00 C ATOM 0 HA ILE A 15 11.138 9.671 -14.264 1.00 0.00 H new ATOM 0 HB ILE A 15 9.734 8.618 -16.767 1.00 0.00 H new ATOM 0 HG12 ILE A 15 10.617 10.862 -17.177 1.00 0.00 H new ATOM 0 HG13 ILE A 15 8.876 10.959 -16.999 1.00 0.00 H new ATOM 0 HG21 ILE A 15 7.620 9.265 -15.660 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.483 7.993 -14.762 1.00 0.00 H new ATOM 0 HG23 ILE A 15 8.525 9.675 -14.183 1.00 0.00 H new ATOM 0 HD11 ILE A 15 9.980 12.814 -15.847 1.00 0.00 H new ATOM 0 HD12 ILE A 15 9.145 11.764 -14.678 1.00 0.00 H new ATOM 0 HD13 ILE A 15 10.913 11.665 -14.859 1.00 0.00 H new ATOM 219 N GLU A 16 11.404 6.579 -15.436 1.00 0.00 N ATOM 220 CA GLU A 16 11.466 5.149 -15.061 1.00 0.00 C ATOM 221 C GLU A 16 12.641 4.887 -14.107 1.00 0.00 C ATOM 222 O GLU A 16 12.547 4.043 -13.231 1.00 0.00 O ATOM 223 CB GLU A 16 11.606 4.269 -16.327 1.00 0.00 C ATOM 224 CG GLU A 16 10.378 4.283 -17.250 1.00 0.00 C ATOM 225 CD GLU A 16 10.651 3.609 -18.600 1.00 0.00 C ATOM 226 OE1 GLU A 16 11.106 4.299 -19.536 1.00 0.00 O ATOM 227 OE2 GLU A 16 10.453 2.383 -18.723 1.00 0.00 O ATOM 0 H GLU A 16 11.627 6.756 -16.415 1.00 0.00 H new ATOM 0 HA GLU A 16 10.540 4.890 -14.548 1.00 0.00 H new ATOM 0 HB2 GLU A 16 12.475 4.605 -16.893 1.00 0.00 H new ATOM 0 HB3 GLU A 16 11.803 3.242 -16.020 1.00 0.00 H new ATOM 0 HG2 GLU A 16 9.550 3.776 -16.755 1.00 0.00 H new ATOM 0 HG3 GLU A 16 10.066 5.314 -17.419 1.00 0.00 H new ATOM 234 N LYS A 17 13.734 5.641 -14.299 1.00 0.00 N ATOM 235 CA LYS A 17 14.940 5.573 -13.455 1.00 0.00 C ATOM 236 C LYS A 17 14.636 6.102 -12.045 1.00 0.00 C ATOM 237 O LYS A 17 14.893 5.415 -11.048 1.00 0.00 O ATOM 238 CB LYS A 17 16.099 6.351 -14.162 1.00 0.00 C ATOM 239 CG LYS A 17 17.397 6.623 -13.348 1.00 0.00 C ATOM 240 CD LYS A 17 17.356 7.934 -12.516 1.00 0.00 C ATOM 241 CE LYS A 17 17.051 9.173 -13.377 1.00 0.00 C ATOM 242 NZ LYS A 17 18.146 9.495 -14.337 1.00 0.00 N ATOM 0 H LYS A 17 13.808 6.324 -15.053 1.00 0.00 H new ATOM 0 HA LYS A 17 15.261 4.539 -13.331 1.00 0.00 H new ATOM 0 HB2 LYS A 17 16.377 5.796 -15.058 1.00 0.00 H new ATOM 0 HB3 LYS A 17 15.704 7.312 -14.492 1.00 0.00 H new ATOM 0 HG2 LYS A 17 17.575 5.783 -12.676 1.00 0.00 H new ATOM 0 HG3 LYS A 17 18.242 6.667 -14.035 1.00 0.00 H new ATOM 0 HD2 LYS A 17 16.599 7.842 -11.737 1.00 0.00 H new ATOM 0 HD3 LYS A 17 18.314 8.072 -12.014 1.00 0.00 H new ATOM 0 HE2 LYS A 17 16.127 9.006 -13.930 1.00 0.00 H new ATOM 0 HE3 LYS A 17 16.882 10.030 -12.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 17.887 10.337 -14.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 19.024 9.682 -13.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 18.292 8.691 -14.980 1.00 0.00 H new ATOM 256 N GLN A 18 14.045 7.314 -11.985 1.00 0.00 N ATOM 257 CA GLN A 18 13.774 8.023 -10.714 1.00 0.00 C ATOM 258 C GLN A 18 12.674 7.291 -9.925 1.00 0.00 C ATOM 259 O GLN A 18 12.684 7.279 -8.694 1.00 0.00 O ATOM 260 CB GLN A 18 13.396 9.517 -10.975 1.00 0.00 C ATOM 261 CG GLN A 18 11.946 9.770 -11.462 1.00 0.00 C ATOM 262 CD GLN A 18 11.683 11.179 -12.007 1.00 0.00 C ATOM 263 OE1 GLN A 18 12.639 11.743 -12.732 1.00 0.00 O flip ATOM 264 NE2 GLN A 18 10.590 11.729 -11.836 1.00 0.00 N flip ATOM 0 H GLN A 18 13.743 7.828 -12.813 1.00 0.00 H new ATOM 0 HA GLN A 18 14.682 8.022 -10.112 1.00 0.00 H new ATOM 0 HB2 GLN A 18 13.553 10.078 -10.054 1.00 0.00 H new ATOM 0 HB3 GLN A 18 14.084 9.922 -11.717 1.00 0.00 H new ATOM 0 HG2 GLN A 18 11.708 9.045 -12.241 1.00 0.00 H new ATOM 0 HG3 GLN A 18 11.263 9.584 -10.634 1.00 0.00 H new ATOM 0 HE21 GLN A 18 9.872 11.273 -11.273 1.00 0.00 H new ATOM 0 HE22 GLN A 18 10.406 12.639 -12.257 1.00 0.00 H new ATOM 273 N PHE A 19 11.749 6.661 -10.670 1.00 0.00 N ATOM 274 CA PHE A 19 10.666 5.849 -10.108 1.00 0.00 C ATOM 275 C PHE A 19 11.212 4.516 -9.573 1.00 0.00 C ATOM 276 O PHE A 19 10.921 4.153 -8.440 1.00 0.00 O ATOM 277 CB PHE A 19 9.558 5.614 -11.174 1.00 0.00 C ATOM 278 CG PHE A 19 8.483 4.601 -10.765 1.00 0.00 C ATOM 279 CD1 PHE A 19 7.532 4.924 -9.797 1.00 0.00 C ATOM 280 CD2 PHE A 19 8.445 3.316 -11.322 1.00 0.00 C ATOM 281 CE1 PHE A 19 6.581 3.999 -9.399 1.00 0.00 C ATOM 282 CE2 PHE A 19 7.489 2.398 -10.923 1.00 0.00 C ATOM 283 CZ PHE A 19 6.562 2.741 -9.959 1.00 0.00 C ATOM 0 H PHE A 19 11.736 6.704 -11.689 1.00 0.00 H new ATOM 0 HA PHE A 19 10.223 6.388 -9.271 1.00 0.00 H new ATOM 0 HB2 PHE A 19 9.076 6.567 -11.394 1.00 0.00 H new ATOM 0 HB3 PHE A 19 10.027 5.273 -12.097 1.00 0.00 H new ATOM 0 HD1 PHE A 19 7.537 5.908 -9.352 1.00 0.00 H new ATOM 0 HD2 PHE A 19 9.171 3.038 -12.072 1.00 0.00 H new ATOM 0 HE1 PHE A 19 5.852 4.265 -8.647 1.00 0.00 H new ATOM 0 HE2 PHE A 19 7.468 1.413 -11.366 1.00 0.00 H new ATOM 0 HZ PHE A 19 5.821 2.022 -9.644 1.00 0.00 H new ATOM 293 N ALA A 20 12.031 3.818 -10.388 1.00 0.00 N ATOM 294 CA ALA A 20 12.543 2.468 -10.058 1.00 0.00 C ATOM 295 C ALA A 20 13.358 2.494 -8.765 1.00 0.00 C ATOM 296 O ALA A 20 13.176 1.639 -7.890 1.00 0.00 O ATOM 297 CB ALA A 20 13.387 1.900 -11.207 1.00 0.00 C ATOM 0 H ALA A 20 12.355 4.171 -11.289 1.00 0.00 H new ATOM 0 HA ALA A 20 11.682 1.816 -9.911 1.00 0.00 H new ATOM 0 HB1 ALA A 20 13.749 0.908 -10.936 1.00 0.00 H new ATOM 0 HB2 ALA A 20 12.776 1.830 -12.107 1.00 0.00 H new ATOM 0 HB3 ALA A 20 14.236 2.558 -11.395 1.00 0.00 H new ATOM 303 N VAL A 21 14.238 3.513 -8.644 1.00 0.00 N ATOM 304 CA VAL A 21 15.059 3.694 -7.442 1.00 0.00 C ATOM 305 C VAL A 21 14.163 4.027 -6.234 1.00 0.00 C ATOM 306 O VAL A 21 14.169 3.292 -5.262 1.00 0.00 O ATOM 307 CB VAL A 21 16.213 4.762 -7.619 1.00 0.00 C ATOM 308 CG1 VAL A 21 15.683 6.162 -7.991 1.00 0.00 C ATOM 309 CG2 VAL A 21 17.115 4.831 -6.361 1.00 0.00 C ATOM 0 H VAL A 21 14.392 4.217 -9.366 1.00 0.00 H new ATOM 0 HA VAL A 21 15.567 2.747 -7.261 1.00 0.00 H new ATOM 0 HB VAL A 21 16.817 4.421 -8.459 1.00 0.00 H new ATOM 0 HG11 VAL A 21 16.520 6.851 -8.099 1.00 0.00 H new ATOM 0 HG12 VAL A 21 15.136 6.106 -8.932 1.00 0.00 H new ATOM 0 HG13 VAL A 21 15.018 6.520 -7.205 1.00 0.00 H new ATOM 0 HG21 VAL A 21 17.898 5.574 -6.515 1.00 0.00 H new ATOM 0 HG22 VAL A 21 16.513 5.112 -5.497 1.00 0.00 H new ATOM 0 HG23 VAL A 21 17.570 3.856 -6.185 1.00 0.00 H new ATOM 319 N VAL A 22 13.308 5.067 -6.345 1.00 0.00 N ATOM 320 CA VAL A 22 12.537 5.576 -5.189 1.00 0.00 C ATOM 321 C VAL A 22 11.479 4.548 -4.713 1.00 0.00 C ATOM 322 O VAL A 22 11.099 4.538 -3.544 1.00 0.00 O ATOM 323 CB VAL A 22 11.865 6.971 -5.502 1.00 0.00 C ATOM 324 CG1 VAL A 22 10.575 6.838 -6.353 1.00 0.00 C ATOM 325 CG2 VAL A 22 11.609 7.775 -4.206 1.00 0.00 C ATOM 0 H VAL A 22 13.135 5.568 -7.217 1.00 0.00 H new ATOM 0 HA VAL A 22 13.247 5.726 -4.376 1.00 0.00 H new ATOM 0 HB VAL A 22 12.577 7.530 -6.109 1.00 0.00 H new ATOM 0 HG11 VAL A 22 10.157 7.828 -6.537 1.00 0.00 H new ATOM 0 HG12 VAL A 22 10.814 6.363 -7.304 1.00 0.00 H new ATOM 0 HG13 VAL A 22 9.846 6.230 -5.817 1.00 0.00 H new ATOM 0 HG21 VAL A 22 11.146 8.730 -4.456 1.00 0.00 H new ATOM 0 HG22 VAL A 22 10.945 7.210 -3.552 1.00 0.00 H new ATOM 0 HG23 VAL A 22 12.555 7.953 -3.695 1.00 0.00 H new ATOM 335 N ALA A 23 11.045 3.666 -5.634 1.00 0.00 N ATOM 336 CA ALA A 23 10.053 2.625 -5.353 1.00 0.00 C ATOM 337 C ALA A 23 10.671 1.523 -4.485 1.00 0.00 C ATOM 338 O ALA A 23 10.133 1.190 -3.419 1.00 0.00 O ATOM 339 CB ALA A 23 9.502 2.056 -6.669 1.00 0.00 C ATOM 0 H ALA A 23 11.378 3.661 -6.598 1.00 0.00 H new ATOM 0 HA ALA A 23 9.223 3.061 -4.798 1.00 0.00 H new ATOM 0 HB1 ALA A 23 8.765 1.283 -6.451 1.00 0.00 H new ATOM 0 HB2 ALA A 23 9.031 2.855 -7.242 1.00 0.00 H new ATOM 0 HB3 ALA A 23 10.318 1.626 -7.249 1.00 0.00 H new ATOM 345 N VAL A 24 11.833 0.989 -4.931 1.00 0.00 N ATOM 346 CA VAL A 24 12.544 -0.076 -4.195 1.00 0.00 C ATOM 347 C VAL A 24 13.097 0.471 -2.868 1.00 0.00 C ATOM 348 O VAL A 24 13.116 -0.249 -1.871 1.00 0.00 O ATOM 349 CB VAL A 24 13.702 -0.753 -5.032 1.00 0.00 C ATOM 350 CG1 VAL A 24 13.169 -1.331 -6.365 1.00 0.00 C ATOM 351 CG2 VAL A 24 14.886 0.214 -5.280 1.00 0.00 C ATOM 0 H VAL A 24 12.294 1.279 -5.794 1.00 0.00 H new ATOM 0 HA VAL A 24 11.809 -0.856 -3.996 1.00 0.00 H new ATOM 0 HB VAL A 24 14.082 -1.580 -4.433 1.00 0.00 H new ATOM 0 HG11 VAL A 24 13.990 -1.789 -6.917 1.00 0.00 H new ATOM 0 HG12 VAL A 24 12.407 -2.082 -6.157 1.00 0.00 H new ATOM 0 HG13 VAL A 24 12.734 -0.529 -6.961 1.00 0.00 H new ATOM 0 HG21 VAL A 24 15.657 -0.295 -5.859 1.00 0.00 H new ATOM 0 HG22 VAL A 24 14.534 1.086 -5.832 1.00 0.00 H new ATOM 0 HG23 VAL A 24 15.301 0.533 -4.324 1.00 0.00 H new ATOM 361 N GLU A 25 13.500 1.771 -2.871 1.00 0.00 N ATOM 362 CA GLU A 25 14.034 2.459 -1.681 1.00 0.00 C ATOM 363 C GLU A 25 12.987 2.487 -0.566 1.00 0.00 C ATOM 364 O GLU A 25 13.266 2.037 0.535 1.00 0.00 O ATOM 365 CB GLU A 25 14.511 3.901 -2.011 1.00 0.00 C ATOM 366 CG GLU A 25 15.832 3.986 -2.798 1.00 0.00 C ATOM 367 CD GLU A 25 17.022 3.357 -2.062 1.00 0.00 C ATOM 368 OE1 GLU A 25 17.599 4.030 -1.178 1.00 0.00 O ATOM 369 OE2 GLU A 25 17.387 2.199 -2.360 1.00 0.00 O ATOM 0 H GLU A 25 13.461 2.363 -3.701 1.00 0.00 H new ATOM 0 HA GLU A 25 14.903 1.896 -1.340 1.00 0.00 H new ATOM 0 HB2 GLU A 25 13.731 4.403 -2.584 1.00 0.00 H new ATOM 0 HB3 GLU A 25 14.626 4.452 -1.078 1.00 0.00 H new ATOM 0 HG2 GLU A 25 15.706 3.489 -3.760 1.00 0.00 H new ATOM 0 HG3 GLU A 25 16.055 5.032 -3.006 1.00 0.00 H new ATOM 376 N GLN A 26 11.768 2.972 -0.879 1.00 0.00 N ATOM 377 CA GLN A 26 10.647 3.008 0.088 1.00 0.00 C ATOM 378 C GLN A 26 10.357 1.603 0.645 1.00 0.00 C ATOM 379 O GLN A 26 10.246 1.428 1.855 1.00 0.00 O ATOM 380 CB GLN A 26 9.376 3.599 -0.573 1.00 0.00 C ATOM 381 CG GLN A 26 9.449 5.106 -0.893 1.00 0.00 C ATOM 382 CD GLN A 26 9.603 5.993 0.347 1.00 0.00 C ATOM 383 OE1 GLN A 26 8.615 6.413 0.956 1.00 0.00 O ATOM 384 NE2 GLN A 26 10.838 6.292 0.726 1.00 0.00 N ATOM 0 H GLN A 26 11.532 3.346 -1.798 1.00 0.00 H new ATOM 0 HA GLN A 26 10.938 3.651 0.918 1.00 0.00 H new ATOM 0 HB2 GLN A 26 9.179 3.056 -1.497 1.00 0.00 H new ATOM 0 HB3 GLN A 26 8.526 3.424 0.087 1.00 0.00 H new ATOM 0 HG2 GLN A 26 10.289 5.286 -1.564 1.00 0.00 H new ATOM 0 HG3 GLN A 26 8.546 5.399 -1.428 1.00 0.00 H new ATOM 0 HE21 GLN A 26 11.634 5.929 0.202 1.00 0.00 H new ATOM 0 HE22 GLN A 26 10.992 6.885 1.542 1.00 0.00 H new ATOM 393 N ALA A 27 10.305 0.606 -0.251 1.00 0.00 N ATOM 394 CA ALA A 27 9.998 -0.792 0.116 1.00 0.00 C ATOM 395 C ALA A 27 11.032 -1.369 1.115 1.00 0.00 C ATOM 396 O ALA A 27 10.651 -2.001 2.109 1.00 0.00 O ATOM 397 CB ALA A 27 9.917 -1.658 -1.149 1.00 0.00 C ATOM 0 H ALA A 27 10.473 0.741 -1.248 1.00 0.00 H new ATOM 0 HA ALA A 27 9.031 -0.803 0.619 1.00 0.00 H new ATOM 0 HB1 ALA A 27 9.690 -2.687 -0.871 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.131 -1.277 -1.801 1.00 0.00 H new ATOM 0 HB3 ALA A 27 10.872 -1.626 -1.674 1.00 0.00 H new ATOM 403 N GLU A 28 12.334 -1.111 0.860 1.00 0.00 N ATOM 404 CA GLU A 28 13.443 -1.623 1.703 1.00 0.00 C ATOM 405 C GLU A 28 13.664 -0.737 2.946 1.00 0.00 C ATOM 406 O GLU A 28 14.262 -1.190 3.926 1.00 0.00 O ATOM 407 CB GLU A 28 14.754 -1.770 0.867 1.00 0.00 C ATOM 408 CG GLU A 28 15.387 -0.444 0.376 1.00 0.00 C ATOM 409 CD GLU A 28 16.512 -0.646 -0.656 1.00 0.00 C ATOM 410 OE1 GLU A 28 16.206 -0.839 -1.857 1.00 0.00 O ATOM 411 OE2 GLU A 28 17.708 -0.634 -0.279 1.00 0.00 O ATOM 0 H GLU A 28 12.647 -0.546 0.070 1.00 0.00 H new ATOM 0 HA GLU A 28 13.160 -2.613 2.060 1.00 0.00 H new ATOM 0 HB2 GLU A 28 15.490 -2.302 1.470 1.00 0.00 H new ATOM 0 HB3 GLU A 28 14.542 -2.394 -0.001 1.00 0.00 H new ATOM 0 HG2 GLU A 28 14.609 0.180 -0.064 1.00 0.00 H new ATOM 0 HG3 GLU A 28 15.784 0.099 1.233 1.00 0.00 H new ATOM 418 N THR A 29 13.170 0.519 2.905 1.00 0.00 N ATOM 419 CA THR A 29 13.228 1.432 4.060 1.00 0.00 C ATOM 420 C THR A 29 12.180 1.014 5.096 1.00 0.00 C ATOM 421 O THR A 29 12.508 0.827 6.249 1.00 0.00 O ATOM 422 CB THR A 29 13.011 2.927 3.657 1.00 0.00 C ATOM 423 OG1 THR A 29 14.020 3.325 2.726 1.00 0.00 O ATOM 424 CG2 THR A 29 13.067 3.871 4.868 1.00 0.00 C ATOM 0 H THR A 29 12.726 0.922 2.080 1.00 0.00 H new ATOM 0 HA THR A 29 14.229 1.358 4.484 1.00 0.00 H new ATOM 0 HB THR A 29 12.018 2.998 3.212 1.00 0.00 H new ATOM 0 HG1 THR A 29 13.797 2.982 1.836 1.00 0.00 H new ATOM 0 HG21 THR A 29 12.911 4.898 4.537 1.00 0.00 H new ATOM 0 HG22 THR A 29 12.288 3.597 5.579 1.00 0.00 H new ATOM 0 HG23 THR A 29 14.042 3.789 5.348 1.00 0.00 H new ATOM 432 N TYR A 30 10.923 0.837 4.654 1.00 0.00 N ATOM 433 CA TYR A 30 9.815 0.416 5.532 1.00 0.00 C ATOM 434 C TYR A 30 10.039 -1.021 6.048 1.00 0.00 C ATOM 435 O TYR A 30 9.580 -1.364 7.142 1.00 0.00 O ATOM 436 CB TYR A 30 8.446 0.561 4.814 1.00 0.00 C ATOM 437 CG TYR A 30 8.004 2.026 4.616 1.00 0.00 C ATOM 438 CD1 TYR A 30 7.637 2.821 5.708 1.00 0.00 C ATOM 439 CD2 TYR A 30 7.962 2.617 3.352 1.00 0.00 C ATOM 440 CE1 TYR A 30 7.247 4.140 5.539 1.00 0.00 C ATOM 441 CE2 TYR A 30 7.577 3.931 3.177 1.00 0.00 C ATOM 442 CZ TYR A 30 7.218 4.690 4.268 1.00 0.00 C ATOM 443 OH TYR A 30 6.827 6.003 4.089 1.00 0.00 O ATOM 0 H TYR A 30 10.646 0.981 3.683 1.00 0.00 H new ATOM 0 HA TYR A 30 9.798 1.077 6.398 1.00 0.00 H new ATOM 0 HB2 TYR A 30 8.502 0.073 3.841 1.00 0.00 H new ATOM 0 HB3 TYR A 30 7.685 0.036 5.391 1.00 0.00 H new ATOM 0 HD1 TYR A 30 7.658 2.398 6.702 1.00 0.00 H new ATOM 0 HD2 TYR A 30 8.238 2.031 2.488 1.00 0.00 H new ATOM 0 HE1 TYR A 30 6.967 4.737 6.395 1.00 0.00 H new ATOM 0 HE2 TYR A 30 7.557 4.362 2.187 1.00 0.00 H new ATOM 0 HH TYR A 30 6.865 6.229 3.136 1.00 0.00 H new ATOM 453 N TRP A 31 10.761 -1.845 5.258 1.00 0.00 N ATOM 454 CA TRP A 31 11.220 -3.181 5.696 1.00 0.00 C ATOM 455 C TRP A 31 12.206 -3.032 6.875 1.00 0.00 C ATOM 456 O TRP A 31 11.996 -3.620 7.942 1.00 0.00 O ATOM 457 CB TRP A 31 11.885 -3.945 4.512 1.00 0.00 C ATOM 458 CG TRP A 31 12.404 -5.333 4.863 1.00 0.00 C ATOM 459 CD1 TRP A 31 13.624 -5.647 5.412 1.00 0.00 C ATOM 460 CD2 TRP A 31 11.722 -6.587 4.686 1.00 0.00 C ATOM 461 NE1 TRP A 31 13.723 -6.998 5.608 1.00 0.00 N ATOM 462 CE2 TRP A 31 12.578 -7.600 5.164 1.00 0.00 C ATOM 463 CE3 TRP A 31 10.467 -6.952 4.177 1.00 0.00 C ATOM 464 CZ2 TRP A 31 12.219 -8.947 5.150 1.00 0.00 C ATOM 465 CZ3 TRP A 31 10.116 -8.290 4.157 1.00 0.00 C ATOM 466 CH2 TRP A 31 10.986 -9.273 4.644 1.00 0.00 C ATOM 0 H TRP A 31 11.040 -1.606 4.307 1.00 0.00 H new ATOM 0 HA TRP A 31 10.360 -3.762 6.029 1.00 0.00 H new ATOM 0 HB2 TRP A 31 11.160 -4.037 3.703 1.00 0.00 H new ATOM 0 HB3 TRP A 31 12.713 -3.348 4.131 1.00 0.00 H new ATOM 0 HD1 TRP A 31 14.395 -4.930 5.654 1.00 0.00 H new ATOM 0 HE1 TRP A 31 14.523 -7.479 6.019 1.00 0.00 H new ATOM 0 HE3 TRP A 31 9.786 -6.200 3.807 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 12.888 -9.708 5.524 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 9.155 -8.581 3.759 1.00 0.00 H new ATOM 0 HH2 TRP A 31 10.680 -10.309 4.621 1.00 0.00 H new ATOM 477 N LYS A 32 13.274 -2.219 6.670 1.00 0.00 N ATOM 478 CA LYS A 32 14.353 -2.044 7.672 1.00 0.00 C ATOM 479 C LYS A 32 13.846 -1.288 8.912 1.00 0.00 C ATOM 480 O LYS A 32 14.384 -1.450 10.009 1.00 0.00 O ATOM 481 CB LYS A 32 15.646 -1.399 7.039 1.00 0.00 C ATOM 482 CG LYS A 32 15.667 0.143 6.811 1.00 0.00 C ATOM 483 CD LYS A 32 15.969 0.964 8.091 1.00 0.00 C ATOM 484 CE LYS A 32 17.348 0.654 8.708 1.00 0.00 C ATOM 485 NZ LYS A 32 17.515 1.278 10.046 1.00 0.00 N ATOM 0 H LYS A 32 13.409 -1.675 5.818 1.00 0.00 H new ATOM 0 HA LYS A 32 14.654 -3.034 8.015 1.00 0.00 H new ATOM 0 HB2 LYS A 32 16.491 -1.652 7.679 1.00 0.00 H new ATOM 0 HB3 LYS A 32 15.820 -1.880 6.076 1.00 0.00 H new ATOM 0 HG2 LYS A 32 16.416 0.378 6.055 1.00 0.00 H new ATOM 0 HG3 LYS A 32 14.702 0.454 6.411 1.00 0.00 H new ATOM 0 HD2 LYS A 32 15.917 2.026 7.853 1.00 0.00 H new ATOM 0 HD3 LYS A 32 15.195 0.765 8.832 1.00 0.00 H new ATOM 0 HE2 LYS A 32 17.472 -0.426 8.794 1.00 0.00 H new ATOM 0 HE3 LYS A 32 18.132 1.013 8.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 18.518 1.250 10.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 17.193 2.266 10.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 16.951 0.755 10.746 1.00 0.00 H new ATOM 499 N LEU A 33 12.816 -0.447 8.718 1.00 0.00 N ATOM 500 CA LEU A 33 12.196 0.328 9.794 1.00 0.00 C ATOM 501 C LEU A 33 11.418 -0.602 10.720 1.00 0.00 C ATOM 502 O LEU A 33 11.395 -0.374 11.920 1.00 0.00 O ATOM 503 CB LEU A 33 11.280 1.445 9.218 1.00 0.00 C ATOM 504 CG LEU A 33 11.988 2.739 8.712 1.00 0.00 C ATOM 505 CD1 LEU A 33 10.975 3.716 8.067 1.00 0.00 C ATOM 506 CD2 LEU A 33 12.767 3.411 9.860 1.00 0.00 C ATOM 0 H LEU A 33 12.392 -0.288 7.804 1.00 0.00 H new ATOM 0 HA LEU A 33 12.980 0.816 10.373 1.00 0.00 H new ATOM 0 HB2 LEU A 33 10.709 1.024 8.391 1.00 0.00 H new ATOM 0 HB3 LEU A 33 10.563 1.728 9.989 1.00 0.00 H new ATOM 0 HG LEU A 33 12.703 2.458 7.939 1.00 0.00 H new ATOM 0 HD11 LEU A 33 11.498 4.609 7.724 1.00 0.00 H new ATOM 0 HD12 LEU A 33 10.491 3.231 7.219 1.00 0.00 H new ATOM 0 HD13 LEU A 33 10.222 3.997 8.803 1.00 0.00 H new ATOM 0 HD21 LEU A 33 13.255 4.313 9.490 1.00 0.00 H new ATOM 0 HD22 LEU A 33 12.078 3.675 10.662 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.520 2.721 10.241 1.00 0.00 H new ATOM 518 N LEU A 34 10.773 -1.643 10.143 1.00 0.00 N ATOM 519 CA LEU A 34 10.123 -2.710 10.930 1.00 0.00 C ATOM 520 C LEU A 34 11.176 -3.510 11.720 1.00 0.00 C ATOM 521 O LEU A 34 11.016 -3.732 12.924 1.00 0.00 O ATOM 522 CB LEU A 34 9.281 -3.647 10.021 1.00 0.00 C ATOM 523 CG LEU A 34 7.974 -3.036 9.415 1.00 0.00 C ATOM 524 CD1 LEU A 34 7.304 -4.008 8.424 1.00 0.00 C ATOM 525 CD2 LEU A 34 6.989 -2.612 10.528 1.00 0.00 C ATOM 0 H LEU A 34 10.691 -1.764 9.134 1.00 0.00 H new ATOM 0 HA LEU A 34 9.441 -2.241 11.639 1.00 0.00 H new ATOM 0 HB2 LEU A 34 9.913 -3.985 9.200 1.00 0.00 H new ATOM 0 HB3 LEU A 34 9.009 -4.530 10.599 1.00 0.00 H new ATOM 0 HG LEU A 34 8.257 -2.142 8.859 1.00 0.00 H new ATOM 0 HD11 LEU A 34 6.399 -3.552 8.022 1.00 0.00 H new ATOM 0 HD12 LEU A 34 7.993 -4.228 7.608 1.00 0.00 H new ATOM 0 HD13 LEU A 34 7.046 -4.933 8.940 1.00 0.00 H new ATOM 0 HD21 LEU A 34 6.090 -2.191 10.077 1.00 0.00 H new ATOM 0 HD22 LEU A 34 6.721 -3.482 11.128 1.00 0.00 H new ATOM 0 HD23 LEU A 34 7.460 -1.864 11.165 1.00 0.00 H new ATOM 537 N THR A 35 12.275 -3.907 11.043 1.00 0.00 N ATOM 538 CA THR A 35 13.358 -4.696 11.675 1.00 0.00 C ATOM 539 C THR A 35 14.067 -3.893 12.801 1.00 0.00 C ATOM 540 O THR A 35 14.640 -4.483 13.717 1.00 0.00 O ATOM 541 CB THR A 35 14.410 -5.205 10.619 1.00 0.00 C ATOM 542 OG1 THR A 35 15.062 -4.109 9.971 1.00 0.00 O ATOM 543 CG2 THR A 35 13.773 -6.093 9.534 1.00 0.00 C ATOM 0 H THR A 35 12.437 -3.695 10.059 1.00 0.00 H new ATOM 0 HA THR A 35 12.885 -5.570 12.123 1.00 0.00 H new ATOM 0 HB THR A 35 15.132 -5.797 11.181 1.00 0.00 H new ATOM 0 HG1 THR A 35 14.673 -3.266 10.284 1.00 0.00 H new ATOM 0 HG21 THR A 35 14.541 -6.417 8.832 1.00 0.00 H new ATOM 0 HG22 THR A 35 13.316 -6.966 10.000 1.00 0.00 H new ATOM 0 HG23 THR A 35 13.010 -5.525 9.001 1.00 0.00 H new ATOM 551 N SER A 36 14.005 -2.541 12.725 1.00 0.00 N ATOM 552 CA SER A 36 14.549 -1.646 13.770 1.00 0.00 C ATOM 553 C SER A 36 13.545 -1.535 14.939 1.00 0.00 C ATOM 554 O SER A 36 13.827 -1.967 16.064 1.00 0.00 O ATOM 555 CB SER A 36 14.869 -0.245 13.178 1.00 0.00 C ATOM 556 OG SER A 36 15.787 -0.331 12.098 1.00 0.00 O ATOM 0 H SER A 36 13.579 -2.045 11.942 1.00 0.00 H new ATOM 0 HA SER A 36 15.480 -2.068 14.149 1.00 0.00 H new ATOM 0 HB2 SER A 36 13.947 0.225 12.836 1.00 0.00 H new ATOM 0 HB3 SER A 36 15.283 0.394 13.958 1.00 0.00 H new ATOM 0 HG SER A 36 15.321 -0.652 11.298 1.00 0.00 H new ATOM 562 N VAL A 37 12.358 -0.976 14.642 1.00 0.00 N ATOM 563 CA VAL A 37 11.269 -0.745 15.621 1.00 0.00 C ATOM 564 C VAL A 37 9.931 -1.260 15.035 1.00 0.00 C ATOM 565 O VAL A 37 9.784 -1.314 13.816 1.00 0.00 O ATOM 566 CB VAL A 37 11.123 0.785 15.996 1.00 0.00 C ATOM 567 CG1 VAL A 37 12.310 1.271 16.861 1.00 0.00 C ATOM 568 CG2 VAL A 37 10.942 1.665 14.730 1.00 0.00 C ATOM 0 H VAL A 37 12.120 -0.665 13.700 1.00 0.00 H new ATOM 0 HA VAL A 37 11.521 -1.289 16.532 1.00 0.00 H new ATOM 0 HB VAL A 37 10.219 0.890 16.596 1.00 0.00 H new ATOM 0 HG11 VAL A 37 12.178 2.326 17.100 1.00 0.00 H new ATOM 0 HG12 VAL A 37 12.349 0.692 17.783 1.00 0.00 H new ATOM 0 HG13 VAL A 37 13.241 1.138 16.309 1.00 0.00 H new ATOM 0 HG21 VAL A 37 10.845 2.710 15.024 1.00 0.00 H new ATOM 0 HG22 VAL A 37 11.809 1.550 14.080 1.00 0.00 H new ATOM 0 HG23 VAL A 37 10.044 1.353 14.196 1.00 0.00 H new ATOM 578 N PRO A 38 8.922 -1.637 15.882 1.00 0.00 N ATOM 579 CA PRO A 38 7.607 -2.106 15.378 1.00 0.00 C ATOM 580 C PRO A 38 6.835 -0.990 14.630 1.00 0.00 C ATOM 581 O PRO A 38 7.064 0.209 14.868 1.00 0.00 O ATOM 582 CB PRO A 38 6.864 -2.586 16.661 1.00 0.00 C ATOM 583 CG PRO A 38 7.537 -1.865 17.793 1.00 0.00 C ATOM 584 CD PRO A 38 8.980 -1.655 17.367 1.00 0.00 C ATOM 0 HA PRO A 38 7.704 -2.899 14.637 1.00 0.00 H new ATOM 0 HB2 PRO A 38 5.802 -2.345 16.615 1.00 0.00 H new ATOM 0 HB3 PRO A 38 6.941 -3.667 16.780 1.00 0.00 H new ATOM 0 HG2 PRO A 38 7.048 -0.912 17.992 1.00 0.00 H new ATOM 0 HG3 PRO A 38 7.484 -2.449 18.712 1.00 0.00 H new ATOM 0 HD2 PRO A 38 9.380 -0.721 17.761 1.00 0.00 H new ATOM 0 HD3 PRO A 38 9.623 -2.456 17.731 1.00 0.00 H new ATOM 592 N GLY A 39 5.893 -1.409 13.762 1.00 0.00 N ATOM 593 CA GLY A 39 5.100 -0.490 12.930 1.00 0.00 C ATOM 594 C GLY A 39 4.116 0.381 13.715 1.00 0.00 C ATOM 595 O GLY A 39 3.416 1.212 13.126 1.00 0.00 O ATOM 0 H GLY A 39 5.663 -2.392 13.620 1.00 0.00 H new ATOM 0 HA2 GLY A 39 5.779 0.158 12.377 1.00 0.00 H new ATOM 0 HA3 GLY A 39 4.545 -1.072 12.194 1.00 0.00 H new ATOM 599 N SER A 40 4.081 0.186 15.044 1.00 0.00 N ATOM 600 CA SER A 40 3.303 1.004 15.974 1.00 0.00 C ATOM 601 C SER A 40 3.791 2.476 15.968 1.00 0.00 C ATOM 602 O SER A 40 2.982 3.406 16.015 1.00 0.00 O ATOM 603 CB SER A 40 3.429 0.398 17.381 1.00 0.00 C ATOM 604 OG SER A 40 3.214 -1.000 17.333 1.00 0.00 O ATOM 0 H SER A 40 4.604 -0.559 15.505 1.00 0.00 H new ATOM 0 HA SER A 40 2.258 1.009 15.664 1.00 0.00 H new ATOM 0 HB2 SER A 40 4.418 0.607 17.788 1.00 0.00 H new ATOM 0 HB3 SER A 40 2.705 0.862 18.051 1.00 0.00 H new ATOM 0 HG SER A 40 3.298 -1.375 18.234 1.00 0.00 H new ATOM 610 N LYS A 41 5.130 2.659 15.893 1.00 0.00 N ATOM 611 CA LYS A 41 5.765 3.999 15.819 1.00 0.00 C ATOM 612 C LYS A 41 5.613 4.571 14.402 1.00 0.00 C ATOM 613 O LYS A 41 5.360 5.774 14.217 1.00 0.00 O ATOM 614 CB LYS A 41 7.286 3.955 16.181 1.00 0.00 C ATOM 615 CG LYS A 41 7.636 3.525 17.623 1.00 0.00 C ATOM 616 CD LYS A 41 7.505 2.004 17.861 1.00 0.00 C ATOM 617 CE LYS A 41 7.983 1.585 19.255 1.00 0.00 C ATOM 618 NZ LYS A 41 7.135 2.153 20.340 1.00 0.00 N ATOM 0 H LYS A 41 5.798 1.888 15.882 1.00 0.00 H new ATOM 0 HA LYS A 41 5.259 4.633 16.547 1.00 0.00 H new ATOM 0 HB2 LYS A 41 7.782 3.272 15.491 1.00 0.00 H new ATOM 0 HB3 LYS A 41 7.707 4.945 16.008 1.00 0.00 H new ATOM 0 HG2 LYS A 41 8.657 3.833 17.848 1.00 0.00 H new ATOM 0 HG3 LYS A 41 6.983 4.051 18.319 1.00 0.00 H new ATOM 0 HD2 LYS A 41 6.464 1.708 17.733 1.00 0.00 H new ATOM 0 HD3 LYS A 41 8.083 1.470 17.107 1.00 0.00 H new ATOM 0 HE2 LYS A 41 7.979 0.497 19.326 1.00 0.00 H new ATOM 0 HE3 LYS A 41 9.014 1.910 19.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 7.498 1.841 21.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 7.158 3.192 20.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 6.156 1.823 20.224 1.00 0.00 H new ATOM 632 N LEU A 42 5.783 3.680 13.415 1.00 0.00 N ATOM 633 CA LEU A 42 5.783 4.035 11.988 1.00 0.00 C ATOM 634 C LEU A 42 4.381 4.482 11.529 1.00 0.00 C ATOM 635 O LEU A 42 3.469 3.662 11.394 1.00 0.00 O ATOM 636 CB LEU A 42 6.279 2.828 11.150 1.00 0.00 C ATOM 637 CG LEU A 42 7.685 2.266 11.541 1.00 0.00 C ATOM 638 CD1 LEU A 42 8.050 1.047 10.673 1.00 0.00 C ATOM 639 CD2 LEU A 42 8.777 3.363 11.470 1.00 0.00 C ATOM 0 H LEU A 42 5.926 2.685 13.586 1.00 0.00 H new ATOM 0 HA LEU A 42 6.461 4.874 11.836 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.549 2.023 11.237 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.304 3.123 10.101 1.00 0.00 H new ATOM 0 HG LEU A 42 7.634 1.933 12.578 1.00 0.00 H new ATOM 0 HD11 LEU A 42 9.032 0.674 10.964 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.307 0.263 10.817 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.070 1.340 9.623 1.00 0.00 H new ATOM 0 HD21 LEU A 42 9.740 2.936 11.748 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.833 3.755 10.454 1.00 0.00 H new ATOM 0 HD23 LEU A 42 8.526 4.171 12.157 1.00 0.00 H new ATOM 651 N ARG A 43 4.238 5.792 11.318 1.00 0.00 N ATOM 652 CA ARG A 43 2.999 6.413 10.827 1.00 0.00 C ATOM 653 C ARG A 43 3.219 6.762 9.344 1.00 0.00 C ATOM 654 O ARG A 43 4.119 7.552 9.023 1.00 0.00 O ATOM 655 CB ARG A 43 2.656 7.679 11.699 1.00 0.00 C ATOM 656 CG ARG A 43 1.178 7.796 12.146 1.00 0.00 C ATOM 657 CD ARG A 43 0.701 6.563 12.943 1.00 0.00 C ATOM 658 NE ARG A 43 -0.646 6.752 13.534 1.00 0.00 N ATOM 659 CZ ARG A 43 -1.686 5.908 13.403 1.00 0.00 C ATOM 660 NH1 ARG A 43 -1.653 4.901 12.534 1.00 0.00 N ATOM 661 NH2 ARG A 43 -2.788 6.117 14.112 1.00 0.00 N ATOM 0 H ARG A 43 4.988 6.463 11.485 1.00 0.00 H new ATOM 0 HA ARG A 43 2.147 5.738 10.911 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.287 7.669 12.588 1.00 0.00 H new ATOM 0 HB3 ARG A 43 2.918 8.572 11.132 1.00 0.00 H new ATOM 0 HG2 ARG A 43 1.057 8.689 12.759 1.00 0.00 H new ATOM 0 HG3 ARG A 43 0.545 7.924 11.268 1.00 0.00 H new ATOM 0 HD2 ARG A 43 0.687 5.694 12.286 1.00 0.00 H new ATOM 0 HD3 ARG A 43 1.416 6.350 13.738 1.00 0.00 H new ATOM 0 HE ARG A 43 -0.797 7.595 14.088 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -0.828 4.757 11.951 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -2.452 4.273 12.451 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -2.841 6.912 14.749 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -3.582 5.483 14.020 1.00 0.00 H new ATOM 675 N LEU A 44 2.418 6.153 8.452 1.00 0.00 N ATOM 676 CA LEU A 44 2.629 6.213 6.997 1.00 0.00 C ATOM 677 C LEU A 44 2.384 7.643 6.475 1.00 0.00 C ATOM 678 O LEU A 44 3.152 8.162 5.656 1.00 0.00 O ATOM 679 CB LEU A 44 1.707 5.174 6.279 1.00 0.00 C ATOM 680 CG LEU A 44 2.094 3.659 6.401 1.00 0.00 C ATOM 681 CD1 LEU A 44 3.484 3.378 5.801 1.00 0.00 C ATOM 682 CD2 LEU A 44 1.980 3.127 7.849 1.00 0.00 C ATOM 0 H LEU A 44 1.603 5.603 8.723 1.00 0.00 H new ATOM 0 HA LEU A 44 3.665 5.955 6.775 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.696 5.296 6.668 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.674 5.429 5.220 1.00 0.00 H new ATOM 0 HG LEU A 44 1.362 3.106 5.812 1.00 0.00 H new ATOM 0 HD11 LEU A 44 3.717 2.318 5.904 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.486 3.649 4.745 1.00 0.00 H new ATOM 0 HD13 LEU A 44 4.234 3.968 6.328 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.260 2.074 7.873 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.647 3.694 8.499 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.953 3.237 8.197 1.00 0.00 H new ATOM 694 N THR A 45 1.307 8.263 6.978 1.00 0.00 N ATOM 695 CA THR A 45 0.966 9.682 6.744 1.00 0.00 C ATOM 696 C THR A 45 0.326 10.260 8.021 1.00 0.00 C ATOM 697 O THR A 45 0.220 9.569 9.041 1.00 0.00 O ATOM 698 CB THR A 45 -0.021 9.873 5.532 1.00 0.00 C ATOM 699 OG1 THR A 45 -1.170 9.034 5.699 1.00 0.00 O ATOM 700 CG2 THR A 45 0.636 9.588 4.176 1.00 0.00 C ATOM 0 H THR A 45 0.630 7.785 7.573 1.00 0.00 H new ATOM 0 HA THR A 45 1.888 10.209 6.497 1.00 0.00 H new ATOM 0 HB THR A 45 -0.318 10.922 5.530 1.00 0.00 H new ATOM 0 HG1 THR A 45 -1.780 9.160 4.942 1.00 0.00 H new ATOM 0 HG21 THR A 45 -0.094 9.736 3.380 1.00 0.00 H new ATOM 0 HG22 THR A 45 1.476 10.266 4.029 1.00 0.00 H new ATOM 0 HG23 THR A 45 0.993 8.558 4.154 1.00 0.00 H new ATOM 708 N LYS A 46 -0.114 11.528 7.946 1.00 0.00 N ATOM 709 CA LYS A 46 -0.846 12.199 9.037 1.00 0.00 C ATOM 710 C LYS A 46 -2.348 11.808 9.011 1.00 0.00 C ATOM 711 O LYS A 46 -3.110 12.139 9.926 1.00 0.00 O ATOM 712 CB LYS A 46 -0.652 13.740 8.921 1.00 0.00 C ATOM 713 CG LYS A 46 -1.086 14.539 10.169 1.00 0.00 C ATOM 714 CD LYS A 46 -0.818 16.056 10.039 1.00 0.00 C ATOM 715 CE LYS A 46 -1.222 16.827 11.309 1.00 0.00 C ATOM 716 NZ LYS A 46 -0.953 18.284 11.207 1.00 0.00 N ATOM 0 H LYS A 46 0.028 12.118 7.126 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.445 11.872 9.997 1.00 0.00 H new ATOM 0 HB2 LYS A 46 0.399 13.946 8.721 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -1.216 14.100 8.061 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -2.149 14.377 10.345 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -0.557 14.156 11.041 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.240 16.221 9.837 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -1.370 16.449 9.186 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -2.283 16.671 11.501 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -0.680 16.421 12.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -1.244 18.753 12.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 0.063 18.439 11.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -1.490 18.681 10.410 1.00 0.00 H new ATOM 730 N PHE A 47 -2.755 11.081 7.953 1.00 0.00 N ATOM 731 CA PHE A 47 -4.143 10.636 7.736 1.00 0.00 C ATOM 732 C PHE A 47 -4.184 9.109 7.543 1.00 0.00 C ATOM 733 O PHE A 47 -5.166 8.580 7.036 1.00 0.00 O ATOM 734 CB PHE A 47 -4.732 11.345 6.473 1.00 0.00 C ATOM 735 CG PHE A 47 -4.642 12.865 6.513 1.00 0.00 C ATOM 736 CD1 PHE A 47 -5.650 13.627 7.103 1.00 0.00 C ATOM 737 CD2 PHE A 47 -3.546 13.532 5.967 1.00 0.00 C ATOM 738 CE1 PHE A 47 -5.562 15.004 7.142 1.00 0.00 C ATOM 739 CE2 PHE A 47 -3.456 14.907 6.008 1.00 0.00 C ATOM 740 CZ PHE A 47 -4.464 15.644 6.595 1.00 0.00 C ATOM 0 H PHE A 47 -2.118 10.782 7.214 1.00 0.00 H new ATOM 0 HA PHE A 47 -4.741 10.898 8.609 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -4.206 10.984 5.589 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -5.777 11.057 6.362 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -6.509 13.134 7.534 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -2.754 12.962 5.504 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -6.351 15.582 7.600 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -2.598 15.406 5.582 1.00 0.00 H new ATOM 0 HZ PHE A 47 -4.396 16.721 6.628 1.00 0.00 H new ATOM 750 N ASP A 48 -3.139 8.394 7.992 1.00 0.00 N ATOM 751 CA ASP A 48 -2.950 6.966 7.640 1.00 0.00 C ATOM 752 C ASP A 48 -3.998 6.052 8.314 1.00 0.00 C ATOM 753 O ASP A 48 -4.485 5.097 7.704 1.00 0.00 O ATOM 754 CB ASP A 48 -1.494 6.508 7.958 1.00 0.00 C ATOM 755 CG ASP A 48 -1.155 6.341 9.448 1.00 0.00 C ATOM 756 OD1 ASP A 48 -1.574 7.189 10.252 1.00 0.00 O ATOM 757 OD2 ASP A 48 -0.424 5.380 9.799 1.00 0.00 O ATOM 0 H ASP A 48 -2.412 8.775 8.597 1.00 0.00 H new ATOM 0 HA ASP A 48 -3.107 6.871 6.566 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.314 5.558 7.455 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.803 7.232 7.527 1.00 0.00 H new ATOM 762 N ASP A 49 -4.384 6.382 9.553 1.00 0.00 N ATOM 763 CA ASP A 49 -5.321 5.558 10.346 1.00 0.00 C ATOM 764 C ASP A 49 -6.749 5.620 9.753 1.00 0.00 C ATOM 765 O ASP A 49 -7.463 4.604 9.690 1.00 0.00 O ATOM 766 CB ASP A 49 -5.302 6.021 11.822 1.00 0.00 C ATOM 767 CG ASP A 49 -5.788 4.943 12.805 1.00 0.00 C ATOM 768 OD1 ASP A 49 -4.967 4.074 13.180 1.00 0.00 O ATOM 769 OD2 ASP A 49 -6.966 4.969 13.224 1.00 0.00 O ATOM 0 H ASP A 49 -4.061 7.220 10.036 1.00 0.00 H new ATOM 0 HA ASP A 49 -5.000 4.517 10.306 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -4.287 6.316 12.090 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.929 6.906 11.926 1.00 0.00 H new ATOM 774 N GLU A 50 -7.144 6.821 9.292 1.00 0.00 N ATOM 775 CA GLU A 50 -8.436 7.017 8.608 1.00 0.00 C ATOM 776 C GLU A 50 -8.382 6.465 7.159 1.00 0.00 C ATOM 777 O GLU A 50 -9.424 6.101 6.615 1.00 0.00 O ATOM 778 CB GLU A 50 -8.875 8.511 8.611 1.00 0.00 C ATOM 779 CG GLU A 50 -7.865 9.465 7.962 1.00 0.00 C ATOM 780 CD GLU A 50 -8.384 10.884 7.704 1.00 0.00 C ATOM 781 OE1 GLU A 50 -8.643 11.628 8.678 1.00 0.00 O ATOM 782 OE2 GLU A 50 -8.517 11.269 6.526 1.00 0.00 O ATOM 0 H GLU A 50 -6.587 7.671 9.381 1.00 0.00 H new ATOM 0 HA GLU A 50 -9.186 6.456 9.166 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -9.828 8.599 8.089 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -9.045 8.826 9.641 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -6.985 9.528 8.602 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -7.540 9.036 7.014 1.00 0.00 H new ATOM 789 N ILE A 51 -7.170 6.393 6.539 1.00 0.00 N ATOM 790 CA ILE A 51 -6.997 5.742 5.207 1.00 0.00 C ATOM 791 C ILE A 51 -7.409 4.259 5.295 1.00 0.00 C ATOM 792 O ILE A 51 -8.103 3.751 4.407 1.00 0.00 O ATOM 793 CB ILE A 51 -5.530 5.894 4.614 1.00 0.00 C ATOM 794 CG1 ILE A 51 -5.250 7.379 4.208 1.00 0.00 C ATOM 795 CG2 ILE A 51 -5.280 4.948 3.403 1.00 0.00 C ATOM 796 CD1 ILE A 51 -3.817 7.679 3.766 1.00 0.00 C ATOM 0 H ILE A 51 -6.309 6.772 6.934 1.00 0.00 H new ATOM 0 HA ILE A 51 -7.651 6.263 4.508 1.00 0.00 H new ATOM 0 HB ILE A 51 -4.837 5.602 5.403 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -5.926 7.650 3.397 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -5.493 8.021 5.054 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -4.264 5.090 3.034 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -5.411 3.912 3.717 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -5.990 5.178 2.609 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -3.730 8.734 3.507 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -3.129 7.447 4.579 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -3.569 7.070 2.897 1.00 0.00 H new ATOM 808 N TYR A 52 -7.009 3.610 6.402 1.00 0.00 N ATOM 809 CA TYR A 52 -7.452 2.249 6.762 1.00 0.00 C ATOM 810 C TYR A 52 -8.998 2.165 6.820 1.00 0.00 C ATOM 811 O TYR A 52 -9.607 1.313 6.163 1.00 0.00 O ATOM 812 CB TYR A 52 -6.828 1.843 8.136 1.00 0.00 C ATOM 813 CG TYR A 52 -7.452 0.594 8.796 1.00 0.00 C ATOM 814 CD1 TYR A 52 -7.005 -0.691 8.495 1.00 0.00 C ATOM 815 CD2 TYR A 52 -8.509 0.713 9.706 1.00 0.00 C ATOM 816 CE1 TYR A 52 -7.589 -1.803 9.072 1.00 0.00 C ATOM 817 CE2 TYR A 52 -9.089 -0.394 10.281 1.00 0.00 C ATOM 818 CZ TYR A 52 -8.632 -1.649 9.960 1.00 0.00 C ATOM 819 OH TYR A 52 -9.224 -2.759 10.528 1.00 0.00 O ATOM 0 H TYR A 52 -6.364 4.017 7.079 1.00 0.00 H new ATOM 0 HA TYR A 52 -7.111 1.555 5.994 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.762 1.666 7.995 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -6.923 2.684 8.823 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -6.189 -0.820 7.800 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -8.877 1.695 9.962 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -7.229 -2.791 8.827 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -9.901 -0.277 10.983 1.00 0.00 H new ATOM 0 HH TYR A 52 -8.611 -3.522 10.472 1.00 0.00 H new ATOM 829 N GLU A 53 -9.608 3.063 7.621 1.00 0.00 N ATOM 830 CA GLU A 53 -11.060 3.027 7.930 1.00 0.00 C ATOM 831 C GLU A 53 -11.940 3.252 6.686 1.00 0.00 C ATOM 832 O GLU A 53 -12.826 2.445 6.411 1.00 0.00 O ATOM 833 CB GLU A 53 -11.394 4.068 9.028 1.00 0.00 C ATOM 834 CG GLU A 53 -10.659 3.815 10.355 1.00 0.00 C ATOM 835 CD GLU A 53 -10.991 4.847 11.441 1.00 0.00 C ATOM 836 OE1 GLU A 53 -12.009 4.681 12.146 1.00 0.00 O ATOM 837 OE2 GLU A 53 -10.253 5.843 11.580 1.00 0.00 O ATOM 0 H GLU A 53 -9.113 3.832 8.072 1.00 0.00 H new ATOM 0 HA GLU A 53 -11.287 2.025 8.295 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -11.139 5.063 8.664 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -12.469 4.061 9.210 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -10.914 2.820 10.719 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -9.584 3.822 10.174 1.00 0.00 H new ATOM 844 N ASN A 54 -11.676 4.327 5.920 1.00 0.00 N ATOM 845 CA ASN A 54 -12.474 4.657 4.711 1.00 0.00 C ATOM 846 C ASN A 54 -12.247 3.622 3.589 1.00 0.00 C ATOM 847 O ASN A 54 -13.123 3.425 2.747 1.00 0.00 O ATOM 848 CB ASN A 54 -12.176 6.088 4.191 1.00 0.00 C ATOM 849 CG ASN A 54 -12.526 7.195 5.194 1.00 0.00 C ATOM 850 OD1 ASN A 54 -13.684 7.596 5.321 1.00 0.00 O ATOM 851 ND2 ASN A 54 -11.522 7.745 5.860 1.00 0.00 N ATOM 0 H ASN A 54 -10.920 4.984 6.111 1.00 0.00 H new ATOM 0 HA ASN A 54 -13.522 4.622 5.008 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -11.118 6.160 3.939 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -12.735 6.254 3.270 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -11.698 8.521 6.498 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -10.573 7.392 5.735 1.00 0.00 H new ATOM 858 N PHE A 55 -11.073 2.957 3.588 1.00 0.00 N ATOM 859 CA PHE A 55 -10.800 1.833 2.663 1.00 0.00 C ATOM 860 C PHE A 55 -11.640 0.605 3.071 1.00 0.00 C ATOM 861 O PHE A 55 -12.145 -0.119 2.226 1.00 0.00 O ATOM 862 CB PHE A 55 -9.283 1.489 2.666 1.00 0.00 C ATOM 863 CG PHE A 55 -8.806 0.490 1.601 1.00 0.00 C ATOM 864 CD1 PHE A 55 -9.426 0.403 0.356 1.00 0.00 C ATOM 865 CD2 PHE A 55 -7.706 -0.331 1.833 1.00 0.00 C ATOM 866 CE1 PHE A 55 -8.971 -0.469 -0.611 1.00 0.00 C ATOM 867 CE2 PHE A 55 -7.256 -1.210 0.863 1.00 0.00 C ATOM 868 CZ PHE A 55 -7.888 -1.274 -0.359 1.00 0.00 C ATOM 0 H PHE A 55 -10.299 3.177 4.215 1.00 0.00 H new ATOM 0 HA PHE A 55 -11.080 2.126 1.651 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -8.723 2.415 2.540 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -9.025 1.091 3.647 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -10.279 1.030 0.144 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -7.196 -0.281 2.784 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -9.468 -0.519 -1.569 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -6.408 -1.847 1.065 1.00 0.00 H new ATOM 0 HZ PHE A 55 -7.532 -1.956 -1.117 1.00 0.00 H new ATOM 878 N MET A 56 -11.794 0.416 4.389 1.00 0.00 N ATOM 879 CA MET A 56 -12.574 -0.693 4.980 1.00 0.00 C ATOM 880 C MET A 56 -14.085 -0.536 4.692 1.00 0.00 C ATOM 881 O MET A 56 -14.784 -1.514 4.392 1.00 0.00 O ATOM 882 CB MET A 56 -12.288 -0.719 6.508 1.00 0.00 C ATOM 883 CG MET A 56 -13.050 -1.776 7.308 1.00 0.00 C ATOM 884 SD MET A 56 -12.652 -1.746 9.077 1.00 0.00 S ATOM 885 CE MET A 56 -13.141 -0.076 9.528 1.00 0.00 C ATOM 0 H MET A 56 -11.378 1.033 5.087 1.00 0.00 H new ATOM 0 HA MET A 56 -12.273 -1.639 4.530 1.00 0.00 H new ATOM 0 HB2 MET A 56 -11.220 -0.878 6.656 1.00 0.00 H new ATOM 0 HB3 MET A 56 -12.524 0.262 6.920 1.00 0.00 H new ATOM 0 HG2 MET A 56 -14.121 -1.620 7.179 1.00 0.00 H new ATOM 0 HG3 MET A 56 -12.821 -2.763 6.906 1.00 0.00 H new ATOM 0 HE1 MET A 56 -13.736 -0.105 10.441 1.00 0.00 H new ATOM 0 HE2 MET A 56 -12.251 0.531 9.694 1.00 0.00 H new ATOM 0 HE3 MET A 56 -13.733 0.360 8.723 1.00 0.00 H new ATOM 895 N GLU A 57 -14.553 0.716 4.778 1.00 0.00 N ATOM 896 CA GLU A 57 -15.965 1.091 4.578 1.00 0.00 C ATOM 897 C GLU A 57 -16.375 1.002 3.092 1.00 0.00 C ATOM 898 O GLU A 57 -17.361 0.337 2.754 1.00 0.00 O ATOM 899 CB GLU A 57 -16.203 2.524 5.116 1.00 0.00 C ATOM 900 CG GLU A 57 -15.989 2.671 6.634 1.00 0.00 C ATOM 901 CD GLU A 57 -16.067 4.130 7.099 1.00 0.00 C ATOM 902 OE1 GLU A 57 -15.039 4.835 7.044 1.00 0.00 O ATOM 903 OE2 GLU A 57 -17.164 4.593 7.483 1.00 0.00 O ATOM 0 H GLU A 57 -13.953 1.513 4.992 1.00 0.00 H new ATOM 0 HA GLU A 57 -16.585 0.385 5.130 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -15.534 3.211 4.598 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -17.221 2.827 4.873 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.740 2.084 7.162 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -15.016 2.259 6.902 1.00 0.00 H new ATOM 910 N ARG A 58 -15.603 1.669 2.214 1.00 0.00 N ATOM 911 CA ARG A 58 -15.934 1.774 0.770 1.00 0.00 C ATOM 912 C ARG A 58 -15.553 0.487 0.013 1.00 0.00 C ATOM 913 O ARG A 58 -16.156 0.172 -1.018 1.00 0.00 O ATOM 914 CB ARG A 58 -15.257 3.023 0.115 1.00 0.00 C ATOM 915 CG ARG A 58 -15.921 4.394 0.450 1.00 0.00 C ATOM 916 CD ARG A 58 -15.868 4.757 1.943 1.00 0.00 C ATOM 917 NE ARG A 58 -16.442 6.080 2.240 1.00 0.00 N ATOM 918 CZ ARG A 58 -16.479 6.642 3.460 1.00 0.00 C ATOM 919 NH1 ARG A 58 -15.978 6.011 4.516 1.00 0.00 N ATOM 920 NH2 ARG A 58 -17.009 7.844 3.612 1.00 0.00 N ATOM 0 H ARG A 58 -14.741 2.147 2.476 1.00 0.00 H new ATOM 0 HA ARG A 58 -17.014 1.903 0.695 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -14.214 3.057 0.429 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -15.260 2.891 -0.967 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -15.426 5.178 -0.123 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -16.962 4.372 0.127 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -16.405 3.999 2.514 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -14.831 4.734 2.279 1.00 0.00 H new ATOM 0 HE ARG A 58 -16.840 6.608 1.464 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -15.558 5.088 4.407 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -16.013 6.450 5.436 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -17.387 8.340 2.805 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -17.039 8.275 4.536 1.00 0.00 H new ATOM 934 N PHE A 59 -14.548 -0.247 0.526 1.00 0.00 N ATOM 935 CA PHE A 59 -14.127 -1.554 -0.030 1.00 0.00 C ATOM 936 C PHE A 59 -14.265 -2.632 1.073 1.00 0.00 C ATOM 937 O PHE A 59 -13.296 -2.917 1.791 1.00 0.00 O ATOM 938 CB PHE A 59 -12.662 -1.508 -0.569 1.00 0.00 C ATOM 939 CG PHE A 59 -12.415 -0.525 -1.717 1.00 0.00 C ATOM 940 CD1 PHE A 59 -12.362 0.853 -1.485 1.00 0.00 C ATOM 941 CD2 PHE A 59 -12.205 -0.979 -3.022 1.00 0.00 C ATOM 942 CE1 PHE A 59 -12.112 1.739 -2.513 1.00 0.00 C ATOM 943 CE2 PHE A 59 -11.959 -0.086 -4.049 1.00 0.00 C ATOM 944 CZ PHE A 59 -11.911 1.271 -3.794 1.00 0.00 C ATOM 0 H PHE A 59 -14.003 0.046 1.337 1.00 0.00 H new ATOM 0 HA PHE A 59 -14.770 -1.799 -0.875 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -11.997 -1.251 0.256 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -12.384 -2.508 -0.903 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -12.519 1.230 -0.485 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -12.235 -2.038 -3.231 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -12.074 2.800 -2.314 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -11.804 -0.451 -5.054 1.00 0.00 H new ATOM 0 HZ PHE A 59 -11.716 1.965 -4.598 1.00 0.00 H new ATOM 954 N PRO A 60 -15.487 -3.232 1.251 1.00 0.00 N ATOM 955 CA PRO A 60 -15.702 -4.335 2.222 1.00 0.00 C ATOM 956 C PRO A 60 -15.137 -5.678 1.708 1.00 0.00 C ATOM 957 O PRO A 60 -15.107 -6.669 2.438 1.00 0.00 O ATOM 958 CB PRO A 60 -17.241 -4.376 2.365 1.00 0.00 C ATOM 959 CG PRO A 60 -17.745 -3.933 1.024 1.00 0.00 C ATOM 960 CD PRO A 60 -16.759 -2.884 0.542 1.00 0.00 C ATOM 0 HA PRO A 60 -15.188 -4.173 3.169 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -17.592 -5.378 2.612 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -17.585 -3.713 3.159 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -17.797 -4.771 0.329 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -18.751 -3.520 1.100 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -16.636 -2.919 -0.540 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -17.093 -1.877 0.792 1.00 0.00 H new ATOM 968 N GLU A 61 -14.708 -5.677 0.432 1.00 0.00 N ATOM 969 CA GLU A 61 -13.948 -6.780 -0.180 1.00 0.00 C ATOM 970 C GLU A 61 -12.599 -6.990 0.539 1.00 0.00 C ATOM 971 O GLU A 61 -12.111 -8.110 0.634 1.00 0.00 O ATOM 972 CB GLU A 61 -13.688 -6.467 -1.682 1.00 0.00 C ATOM 973 CG GLU A 61 -12.927 -5.134 -1.929 1.00 0.00 C ATOM 974 CD GLU A 61 -12.451 -4.953 -3.373 1.00 0.00 C ATOM 975 OE1 GLU A 61 -11.351 -5.448 -3.705 1.00 0.00 O ATOM 976 OE2 GLU A 61 -13.166 -4.316 -4.182 1.00 0.00 O ATOM 0 H GLU A 61 -14.882 -4.902 -0.208 1.00 0.00 H new ATOM 0 HA GLU A 61 -14.537 -7.692 -0.086 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -13.117 -7.286 -2.119 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -14.643 -6.430 -2.205 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -13.577 -4.301 -1.663 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.065 -5.090 -1.264 1.00 0.00 H new ATOM 983 N TYR A 62 -12.023 -5.881 1.041 1.00 0.00 N ATOM 984 CA TYR A 62 -10.657 -5.831 1.582 1.00 0.00 C ATOM 985 C TYR A 62 -10.626 -6.180 3.093 1.00 0.00 C ATOM 986 O TYR A 62 -9.603 -6.653 3.590 1.00 0.00 O ATOM 987 CB TYR A 62 -10.023 -4.416 1.271 1.00 0.00 C ATOM 988 CG TYR A 62 -9.331 -3.732 2.459 1.00 0.00 C ATOM 989 CD1 TYR A 62 -8.012 -4.034 2.809 1.00 0.00 C ATOM 990 CD2 TYR A 62 -10.022 -2.814 3.255 1.00 0.00 C ATOM 991 CE1 TYR A 62 -7.412 -3.433 3.897 1.00 0.00 C ATOM 992 CE2 TYR A 62 -9.424 -2.220 4.341 1.00 0.00 C ATOM 993 CZ TYR A 62 -8.129 -2.526 4.660 1.00 0.00 C ATOM 994 OH TYR A 62 -7.550 -1.922 5.749 1.00 0.00 O ATOM 0 H TYR A 62 -12.504 -4.982 1.081 1.00 0.00 H new ATOM 0 HA TYR A 62 -10.049 -6.592 1.092 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -9.297 -4.530 0.466 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -10.809 -3.757 0.901 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -7.455 -4.747 2.220 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -11.045 -2.567 3.012 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -6.389 -3.669 4.152 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -9.976 -1.512 4.942 1.00 0.00 H new ATOM 0 HH TYR A 62 -8.029 -2.185 6.562 1.00 0.00 H new ATOM 1004 N LYS A 63 -11.739 -5.955 3.824 1.00 0.00 N ATOM 1005 CA LYS A 63 -11.752 -6.048 5.315 1.00 0.00 C ATOM 1006 C LYS A 63 -11.485 -7.489 5.844 1.00 0.00 C ATOM 1007 O LYS A 63 -11.298 -7.693 7.055 1.00 0.00 O ATOM 1008 CB LYS A 63 -13.090 -5.511 5.877 1.00 0.00 C ATOM 1009 CG LYS A 63 -14.310 -6.401 5.561 1.00 0.00 C ATOM 1010 CD LYS A 63 -15.615 -5.876 6.193 1.00 0.00 C ATOM 1011 CE LYS A 63 -16.795 -6.847 6.023 1.00 0.00 C ATOM 1012 NZ LYS A 63 -17.997 -6.373 6.754 1.00 0.00 N ATOM 0 H LYS A 63 -12.641 -5.708 3.416 1.00 0.00 H new ATOM 0 HA LYS A 63 -10.929 -5.428 5.670 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -13.001 -5.406 6.958 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -13.267 -4.514 5.473 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -14.436 -6.466 4.480 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -14.119 -7.412 5.921 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -15.451 -5.694 7.255 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -15.872 -4.918 5.741 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -17.030 -6.954 4.964 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -16.511 -7.834 6.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -18.775 -7.050 6.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -17.778 -6.294 7.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -18.281 -5.442 6.388 1.00 0.00 H new ATOM 1026 N ASP A 64 -11.497 -8.469 4.929 1.00 0.00 N ATOM 1027 CA ASP A 64 -11.146 -9.870 5.215 1.00 0.00 C ATOM 1028 C ASP A 64 -9.654 -10.005 5.553 1.00 0.00 C ATOM 1029 O ASP A 64 -8.834 -9.230 5.061 1.00 0.00 O ATOM 1030 CB ASP A 64 -11.492 -10.748 3.987 1.00 0.00 C ATOM 1031 CG ASP A 64 -12.988 -10.775 3.661 1.00 0.00 C ATOM 1032 OD1 ASP A 64 -13.508 -9.775 3.114 1.00 0.00 O ATOM 1033 OD2 ASP A 64 -13.658 -11.786 3.956 1.00 0.00 O ATOM 0 H ASP A 64 -11.754 -8.310 3.955 1.00 0.00 H new ATOM 0 HA ASP A 64 -11.720 -10.204 6.079 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -10.945 -10.378 3.120 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -11.149 -11.766 4.170 1.00 0.00 H new ATOM 1038 N VAL A 65 -9.314 -11.018 6.370 1.00 0.00 N ATOM 1039 CA VAL A 65 -7.925 -11.274 6.812 1.00 0.00 C ATOM 1040 C VAL A 65 -7.006 -11.520 5.599 1.00 0.00 C ATOM 1041 O VAL A 65 -5.957 -10.885 5.476 1.00 0.00 O ATOM 1042 CB VAL A 65 -7.860 -12.500 7.796 1.00 0.00 C ATOM 1043 CG1 VAL A 65 -6.405 -12.809 8.251 1.00 0.00 C ATOM 1044 CG2 VAL A 65 -8.796 -12.282 9.012 1.00 0.00 C ATOM 0 H VAL A 65 -9.991 -11.683 6.744 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.577 -10.389 7.344 1.00 0.00 H new ATOM 0 HB VAL A 65 -8.212 -13.374 7.248 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.409 -13.663 8.929 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -5.793 -13.041 7.380 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -5.992 -11.940 8.764 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.734 -13.143 9.678 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.491 -11.384 9.550 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -9.823 -12.165 8.665 1.00 0.00 H new ATOM 1054 N GLU A 66 -7.463 -12.413 4.694 1.00 0.00 N ATOM 1055 CA GLU A 66 -6.795 -12.729 3.407 1.00 0.00 C ATOM 1056 C GLU A 66 -6.548 -11.475 2.554 1.00 0.00 C ATOM 1057 O GLU A 66 -5.550 -11.390 1.841 1.00 0.00 O ATOM 1058 CB GLU A 66 -7.668 -13.740 2.605 1.00 0.00 C ATOM 1059 CG GLU A 66 -7.640 -15.182 3.142 1.00 0.00 C ATOM 1060 CD GLU A 66 -6.281 -15.858 2.911 1.00 0.00 C ATOM 1061 OE1 GLU A 66 -6.059 -16.386 1.801 1.00 0.00 O ATOM 1062 OE2 GLU A 66 -5.419 -15.837 3.816 1.00 0.00 O ATOM 0 H GLU A 66 -8.321 -12.945 4.838 1.00 0.00 H new ATOM 0 HA GLU A 66 -5.823 -13.164 3.639 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -8.699 -13.387 2.604 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -7.332 -13.746 1.568 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -7.865 -15.176 4.209 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -8.422 -15.765 2.655 1.00 0.00 H new ATOM 1069 N ARG A 67 -7.465 -10.517 2.659 1.00 0.00 N ATOM 1070 CA ARG A 67 -7.502 -9.317 1.810 1.00 0.00 C ATOM 1071 C ARG A 67 -6.761 -8.120 2.461 1.00 0.00 C ATOM 1072 O ARG A 67 -6.446 -7.133 1.788 1.00 0.00 O ATOM 1073 CB ARG A 67 -8.978 -9.001 1.536 1.00 0.00 C ATOM 1074 CG ARG A 67 -9.756 -10.129 0.812 1.00 0.00 C ATOM 1075 CD ARG A 67 -9.347 -10.277 -0.657 1.00 0.00 C ATOM 1076 NE ARG A 67 -9.638 -9.058 -1.430 1.00 0.00 N ATOM 1077 CZ ARG A 67 -9.137 -8.776 -2.637 1.00 0.00 C ATOM 1078 NH1 ARG A 67 -8.295 -9.616 -3.238 1.00 0.00 N ATOM 1079 NH2 ARG A 67 -9.488 -7.664 -3.248 1.00 0.00 N ATOM 0 H ARG A 67 -8.218 -10.548 3.346 1.00 0.00 H new ATOM 0 HA ARG A 67 -6.976 -9.502 0.873 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -9.472 -8.787 2.484 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -9.036 -8.094 0.935 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -9.586 -11.073 1.330 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -10.825 -9.923 0.869 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -8.282 -10.500 -0.717 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -9.875 -11.122 -1.098 1.00 0.00 H new ATOM 0 HE ARG A 67 -10.271 -8.376 -1.012 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -8.026 -10.485 -2.777 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -7.919 -9.390 -4.159 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -10.140 -7.020 -2.800 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -9.107 -7.446 -4.169 1.00 0.00 H new ATOM 1093 N VAL A 68 -6.502 -8.230 3.772 1.00 0.00 N ATOM 1094 CA VAL A 68 -5.708 -7.256 4.540 1.00 0.00 C ATOM 1095 C VAL A 68 -4.208 -7.558 4.361 1.00 0.00 C ATOM 1096 O VAL A 68 -3.392 -6.634 4.200 1.00 0.00 O ATOM 1097 CB VAL A 68 -6.127 -7.277 6.067 1.00 0.00 C ATOM 1098 CG1 VAL A 68 -5.045 -6.673 6.997 1.00 0.00 C ATOM 1099 CG2 VAL A 68 -7.477 -6.547 6.276 1.00 0.00 C ATOM 0 H VAL A 68 -6.842 -9.008 4.338 1.00 0.00 H new ATOM 0 HA VAL A 68 -5.904 -6.252 4.163 1.00 0.00 H new ATOM 0 HB VAL A 68 -6.237 -8.326 6.342 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -5.389 -6.715 8.030 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -4.121 -7.243 6.899 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -4.863 -5.635 6.717 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -7.745 -6.574 7.332 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -7.384 -5.511 5.951 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -8.253 -7.042 5.692 1.00 0.00 H new ATOM 1109 N LYS A 69 -3.856 -8.863 4.394 1.00 0.00 N ATOM 1110 CA LYS A 69 -2.467 -9.304 4.196 1.00 0.00 C ATOM 1111 C LYS A 69 -2.077 -9.218 2.709 1.00 0.00 C ATOM 1112 O LYS A 69 -1.030 -8.652 2.391 1.00 0.00 O ATOM 1113 CB LYS A 69 -2.207 -10.733 4.777 1.00 0.00 C ATOM 1114 CG LYS A 69 -3.171 -11.831 4.290 1.00 0.00 C ATOM 1115 CD LYS A 69 -2.864 -13.235 4.873 1.00 0.00 C ATOM 1116 CE LYS A 69 -1.466 -13.755 4.499 1.00 0.00 C ATOM 1117 NZ LYS A 69 -1.202 -15.105 5.046 1.00 0.00 N ATOM 0 H LYS A 69 -4.517 -9.623 4.556 1.00 0.00 H new ATOM 0 HA LYS A 69 -1.826 -8.623 4.757 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -1.189 -11.029 4.525 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -2.263 -10.680 5.864 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -4.190 -11.552 4.557 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.129 -11.882 3.202 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -2.952 -13.197 5.959 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -3.614 -13.941 4.517 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -1.369 -13.780 3.414 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -0.712 -13.061 4.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -0.248 -15.412 4.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -1.268 -15.078 6.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -1.904 -15.775 4.672 1.00 0.00 H new ATOM 1131 N LYS A 70 -2.944 -9.718 1.792 1.00 0.00 N ATOM 1132 CA LYS A 70 -2.652 -9.680 0.342 1.00 0.00 C ATOM 1133 C LYS A 70 -3.900 -9.456 -0.505 1.00 0.00 C ATOM 1134 O LYS A 70 -5.023 -9.475 -0.028 1.00 0.00 O ATOM 1135 CB LYS A 70 -1.878 -10.942 -0.184 1.00 0.00 C ATOM 1136 CG LYS A 70 -2.674 -12.254 -0.362 1.00 0.00 C ATOM 1137 CD LYS A 70 -2.886 -13.010 0.951 1.00 0.00 C ATOM 1138 CE LYS A 70 -3.529 -14.385 0.751 1.00 0.00 C ATOM 1139 NZ LYS A 70 -4.849 -14.300 0.070 1.00 0.00 N ATOM 0 H LYS A 70 -3.839 -10.146 2.030 1.00 0.00 H new ATOM 0 HA LYS A 70 -1.992 -8.820 0.229 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -1.435 -10.686 -1.147 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -1.055 -11.140 0.503 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -3.644 -12.026 -0.804 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -2.147 -12.899 -1.065 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -1.926 -13.133 1.452 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -3.516 -12.413 1.610 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -2.860 -15.014 0.164 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -3.653 -14.869 1.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -5.509 -14.975 0.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -5.227 -13.336 0.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -4.735 -14.529 -0.938 1.00 0.00 H new ATOM 1153 N PHE A 71 -3.636 -9.216 -1.778 1.00 0.00 N ATOM 1154 CA PHE A 71 -4.632 -9.074 -2.838 1.00 0.00 C ATOM 1155 C PHE A 71 -4.119 -9.832 -4.077 1.00 0.00 C ATOM 1156 O PHE A 71 -3.077 -10.502 -4.019 1.00 0.00 O ATOM 1157 CB PHE A 71 -4.863 -7.563 -3.132 1.00 0.00 C ATOM 1158 CG PHE A 71 -3.571 -6.785 -3.410 1.00 0.00 C ATOM 1159 CD1 PHE A 71 -3.061 -6.674 -4.701 1.00 0.00 C ATOM 1160 CD2 PHE A 71 -2.852 -6.192 -2.370 1.00 0.00 C ATOM 1161 CE1 PHE A 71 -1.885 -5.998 -4.946 1.00 0.00 C ATOM 1162 CE2 PHE A 71 -1.679 -5.509 -2.617 1.00 0.00 C ATOM 1163 CZ PHE A 71 -1.194 -5.412 -3.907 1.00 0.00 C ATOM 0 H PHE A 71 -2.681 -9.109 -2.121 1.00 0.00 H new ATOM 0 HA PHE A 71 -5.592 -9.497 -2.541 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -5.527 -7.466 -3.991 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -5.374 -7.110 -2.282 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -3.596 -7.125 -5.524 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -3.220 -6.269 -1.357 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -1.504 -5.927 -5.954 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -1.140 -5.050 -1.802 1.00 0.00 H new ATOM 0 HZ PHE A 71 -0.275 -4.878 -4.101 1.00 0.00 H new ATOM 1173 N THR A 72 -4.841 -9.723 -5.189 1.00 0.00 N ATOM 1174 CA THR A 72 -4.436 -10.307 -6.473 1.00 0.00 C ATOM 1175 C THR A 72 -4.136 -9.176 -7.478 1.00 0.00 C ATOM 1176 O THR A 72 -4.706 -8.090 -7.378 1.00 0.00 O ATOM 1177 CB THR A 72 -5.541 -11.284 -7.006 1.00 0.00 C ATOM 1178 OG1 THR A 72 -6.845 -10.743 -6.751 1.00 0.00 O ATOM 1179 CG2 THR A 72 -5.442 -12.674 -6.356 1.00 0.00 C ATOM 0 H THR A 72 -5.730 -9.225 -5.229 1.00 0.00 H new ATOM 0 HA THR A 72 -3.528 -10.894 -6.338 1.00 0.00 H new ATOM 0 HB THR A 72 -5.381 -11.394 -8.079 1.00 0.00 H new ATOM 0 HG1 THR A 72 -7.339 -10.668 -7.594 1.00 0.00 H new ATOM 0 HG21 THR A 72 -6.226 -13.318 -6.754 1.00 0.00 H new ATOM 0 HG22 THR A 72 -4.467 -13.110 -6.576 1.00 0.00 H new ATOM 0 HG23 THR A 72 -5.562 -12.580 -5.277 1.00 0.00 H new ATOM 1187 N GLU A 73 -3.207 -9.427 -8.416 1.00 0.00 N ATOM 1188 CA GLU A 73 -2.799 -8.439 -9.434 1.00 0.00 C ATOM 1189 C GLU A 73 -3.853 -8.335 -10.552 1.00 0.00 C ATOM 1190 O GLU A 73 -4.021 -7.275 -11.150 1.00 0.00 O ATOM 1191 CB GLU A 73 -1.411 -8.815 -10.029 1.00 0.00 C ATOM 1192 CG GLU A 73 -1.362 -10.190 -10.727 1.00 0.00 C ATOM 1193 CD GLU A 73 -0.030 -10.471 -11.435 1.00 0.00 C ATOM 1194 OE1 GLU A 73 0.951 -10.839 -10.757 1.00 0.00 O ATOM 1195 OE2 GLU A 73 0.036 -10.341 -12.677 1.00 0.00 O ATOM 0 H GLU A 73 -2.717 -10.319 -8.491 1.00 0.00 H new ATOM 0 HA GLU A 73 -2.719 -7.465 -8.951 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -1.118 -8.048 -10.746 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -0.672 -8.802 -9.228 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -1.543 -10.970 -9.988 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -2.171 -10.248 -11.456 1.00 0.00 H new ATOM 1202 N GLU A 74 -4.575 -9.443 -10.803 1.00 0.00 N ATOM 1203 CA GLU A 74 -5.536 -9.556 -11.925 1.00 0.00 C ATOM 1204 C GLU A 74 -6.730 -8.572 -11.799 1.00 0.00 C ATOM 1205 O GLU A 74 -7.284 -8.128 -12.813 1.00 0.00 O ATOM 1206 CB GLU A 74 -5.982 -11.044 -12.093 1.00 0.00 C ATOM 1207 CG GLU A 74 -6.414 -11.785 -10.797 1.00 0.00 C ATOM 1208 CD GLU A 74 -7.837 -11.453 -10.310 1.00 0.00 C ATOM 1209 OE1 GLU A 74 -8.810 -11.995 -10.869 1.00 0.00 O ATOM 1210 OE2 GLU A 74 -7.992 -10.663 -9.360 1.00 0.00 O ATOM 0 H GLU A 74 -4.511 -10.288 -10.235 1.00 0.00 H new ATOM 0 HA GLU A 74 -5.028 -9.253 -12.840 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -6.813 -11.074 -12.797 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -5.160 -11.598 -12.546 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -6.345 -12.859 -10.969 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -5.707 -11.543 -10.003 1.00 0.00 H new ATOM 1217 N GLU A 75 -7.085 -8.216 -10.553 1.00 0.00 N ATOM 1218 CA GLU A 75 -8.164 -7.243 -10.256 1.00 0.00 C ATOM 1219 C GLU A 75 -7.687 -5.795 -10.452 1.00 0.00 C ATOM 1220 O GLU A 75 -8.506 -4.878 -10.453 1.00 0.00 O ATOM 1221 CB GLU A 75 -8.656 -7.425 -8.800 1.00 0.00 C ATOM 1222 CG GLU A 75 -7.601 -7.067 -7.741 1.00 0.00 C ATOM 1223 CD GLU A 75 -8.078 -7.250 -6.303 1.00 0.00 C ATOM 1224 OE1 GLU A 75 -8.886 -6.423 -5.824 1.00 0.00 O ATOM 1225 OE2 GLU A 75 -7.663 -8.226 -5.648 1.00 0.00 O ATOM 0 H GLU A 75 -6.635 -8.592 -9.718 1.00 0.00 H new ATOM 0 HA GLU A 75 -8.981 -7.434 -10.952 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -9.539 -6.805 -8.644 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -8.964 -8.461 -8.657 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -6.717 -7.684 -7.901 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -7.296 -6.030 -7.883 1.00 0.00 H new ATOM 1232 N LEU A 76 -6.357 -5.601 -10.549 1.00 0.00 N ATOM 1233 CA LEU A 76 -5.732 -4.280 -10.766 1.00 0.00 C ATOM 1234 C LEU A 76 -5.538 -4.030 -12.271 1.00 0.00 C ATOM 1235 O LEU A 76 -5.511 -2.885 -12.729 1.00 0.00 O ATOM 1236 CB LEU A 76 -4.352 -4.212 -10.056 1.00 0.00 C ATOM 1237 CG LEU A 76 -4.303 -4.673 -8.569 1.00 0.00 C ATOM 1238 CD1 LEU A 76 -2.866 -4.573 -8.026 1.00 0.00 C ATOM 1239 CD2 LEU A 76 -5.296 -3.890 -7.686 1.00 0.00 C ATOM 0 H LEU A 76 -5.681 -6.362 -10.479 1.00 0.00 H new ATOM 0 HA LEU A 76 -6.389 -3.516 -10.350 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -3.648 -4.820 -10.624 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -3.996 -3.183 -10.104 1.00 0.00 H new ATOM 0 HG LEU A 76 -4.613 -5.717 -8.534 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -2.847 -4.898 -6.986 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -2.208 -5.210 -8.618 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -2.524 -3.540 -8.090 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.227 -4.245 -6.658 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -5.054 -2.828 -7.720 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -6.310 -4.043 -8.055 1.00 0.00 H new ATOM 1251 N LYS A 77 -5.425 -5.135 -13.031 1.00 0.00 N ATOM 1252 CA LYS A 77 -5.088 -5.120 -14.470 1.00 0.00 C ATOM 1253 C LYS A 77 -6.344 -5.003 -15.357 1.00 0.00 C ATOM 1254 O LYS A 77 -6.347 -5.445 -16.513 1.00 0.00 O ATOM 1255 CB LYS A 77 -4.283 -6.391 -14.806 1.00 0.00 C ATOM 1256 CG LYS A 77 -2.951 -6.484 -14.034 1.00 0.00 C ATOM 1257 CD LYS A 77 -2.048 -7.603 -14.559 1.00 0.00 C ATOM 1258 CE LYS A 77 -2.668 -9.007 -14.393 1.00 0.00 C ATOM 1259 NZ LYS A 77 -1.802 -10.074 -14.951 1.00 0.00 N ATOM 0 H LYS A 77 -5.566 -6.075 -12.661 1.00 0.00 H new ATOM 0 HA LYS A 77 -4.483 -4.238 -14.680 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -4.889 -7.268 -14.580 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -4.078 -6.412 -15.876 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -2.425 -5.532 -14.107 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -3.158 -6.654 -12.977 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -1.837 -7.427 -15.614 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -1.094 -7.569 -14.033 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -2.844 -9.201 -13.335 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -3.639 -9.034 -14.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -2.378 -10.914 -15.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -1.353 -9.735 -15.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -1.067 -10.323 -14.258 1.00 0.00 H new ATOM 1273 N THR A 78 -7.401 -4.377 -14.820 1.00 0.00 N ATOM 1274 CA THR A 78 -8.668 -4.159 -15.533 1.00 0.00 C ATOM 1275 C THR A 78 -9.071 -2.669 -15.455 1.00 0.00 C ATOM 1276 O THR A 78 -8.597 -1.935 -14.581 1.00 0.00 O ATOM 1277 CB THR A 78 -9.791 -5.088 -14.946 1.00 0.00 C ATOM 1278 OG1 THR A 78 -11.037 -4.874 -15.626 1.00 0.00 O ATOM 1279 CG2 THR A 78 -9.993 -4.884 -13.435 1.00 0.00 C ATOM 0 H THR A 78 -7.401 -4.005 -13.870 1.00 0.00 H new ATOM 0 HA THR A 78 -8.537 -4.418 -16.583 1.00 0.00 H new ATOM 0 HB THR A 78 -9.457 -6.113 -15.105 1.00 0.00 H new ATOM 0 HG1 THR A 78 -11.767 -5.269 -15.104 1.00 0.00 H new ATOM 0 HG21 THR A 78 -10.780 -5.550 -13.080 1.00 0.00 H new ATOM 0 HG22 THR A 78 -9.064 -5.108 -12.910 1.00 0.00 H new ATOM 0 HG23 THR A 78 -10.278 -3.850 -13.242 1.00 0.00 H new ATOM 1287 N LYS A 79 -9.945 -2.239 -16.382 1.00 0.00 N ATOM 1288 CA LYS A 79 -10.529 -0.878 -16.401 1.00 0.00 C ATOM 1289 C LYS A 79 -11.351 -0.622 -15.115 1.00 0.00 C ATOM 1290 O LYS A 79 -11.324 0.484 -14.556 1.00 0.00 O ATOM 1291 CB LYS A 79 -11.406 -0.718 -17.685 1.00 0.00 C ATOM 1292 CG LYS A 79 -12.495 0.373 -17.623 1.00 0.00 C ATOM 1293 CD LYS A 79 -13.286 0.519 -18.948 1.00 0.00 C ATOM 1294 CE LYS A 79 -14.579 1.334 -18.765 1.00 0.00 C ATOM 1295 NZ LYS A 79 -14.342 2.634 -18.086 1.00 0.00 N ATOM 0 H LYS A 79 -10.271 -2.829 -17.148 1.00 0.00 H new ATOM 0 HA LYS A 79 -9.732 -0.135 -16.427 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -10.748 -0.501 -18.527 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -11.887 -1.673 -17.895 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.190 0.139 -16.816 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.031 1.328 -17.377 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -12.656 1.003 -19.694 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -13.533 -0.470 -19.333 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -15.032 1.514 -19.740 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -15.294 0.750 -18.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -15.254 3.082 -17.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -13.813 2.474 -17.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -13.793 3.257 -18.712 1.00 0.00 H new ATOM 1309 N GLU A 80 -12.025 -1.695 -14.638 1.00 0.00 N ATOM 1310 CA GLU A 80 -12.873 -1.692 -13.414 1.00 0.00 C ATOM 1311 C GLU A 80 -12.060 -1.223 -12.188 1.00 0.00 C ATOM 1312 O GLU A 80 -12.577 -0.532 -11.301 1.00 0.00 O ATOM 1313 CB GLU A 80 -13.431 -3.126 -13.169 1.00 0.00 C ATOM 1314 CG GLU A 80 -14.115 -3.768 -14.392 1.00 0.00 C ATOM 1315 CD GLU A 80 -14.473 -5.249 -14.171 1.00 0.00 C ATOM 1316 OE1 GLU A 80 -13.546 -6.091 -14.171 1.00 0.00 O ATOM 1317 OE2 GLU A 80 -15.667 -5.575 -13.987 1.00 0.00 O ATOM 0 H GLU A 80 -11.997 -2.605 -15.098 1.00 0.00 H new ATOM 0 HA GLU A 80 -13.701 -0.998 -13.559 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -12.612 -3.770 -12.848 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -14.147 -3.087 -12.348 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -15.022 -3.212 -14.628 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -13.456 -3.684 -15.256 1.00 0.00 H new ATOM 1324 N ALA A 81 -10.765 -1.598 -12.191 1.00 0.00 N ATOM 1325 CA ALA A 81 -9.795 -1.222 -11.153 1.00 0.00 C ATOM 1326 C ALA A 81 -9.528 0.277 -11.155 1.00 0.00 C ATOM 1327 O ALA A 81 -9.689 0.937 -10.143 1.00 0.00 O ATOM 1328 CB ALA A 81 -8.481 -1.969 -11.352 1.00 0.00 C ATOM 0 H ALA A 81 -10.362 -2.179 -12.926 1.00 0.00 H new ATOM 0 HA ALA A 81 -10.228 -1.496 -10.191 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -7.775 -1.678 -10.574 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -8.661 -3.043 -11.295 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -8.066 -1.722 -12.329 1.00 0.00 H new ATOM 1334 N LYS A 82 -9.140 0.794 -12.328 1.00 0.00 N ATOM 1335 CA LYS A 82 -8.740 2.208 -12.505 1.00 0.00 C ATOM 1336 C LYS A 82 -9.870 3.169 -12.080 1.00 0.00 C ATOM 1337 O LYS A 82 -9.618 4.255 -11.544 1.00 0.00 O ATOM 1338 CB LYS A 82 -8.341 2.444 -13.979 1.00 0.00 C ATOM 1339 CG LYS A 82 -7.214 1.509 -14.470 1.00 0.00 C ATOM 1340 CD LYS A 82 -6.863 1.706 -15.961 1.00 0.00 C ATOM 1341 CE LYS A 82 -6.357 3.130 -16.282 1.00 0.00 C ATOM 1342 NZ LYS A 82 -5.957 3.268 -17.706 1.00 0.00 N ATOM 0 H LYS A 82 -9.092 0.247 -13.187 1.00 0.00 H new ATOM 0 HA LYS A 82 -7.884 2.415 -11.862 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -9.218 2.306 -14.611 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -8.022 3.479 -14.099 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -6.321 1.680 -13.868 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -7.514 0.474 -14.308 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -6.099 0.983 -16.247 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -7.744 1.495 -16.566 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -7.139 3.853 -16.053 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -5.507 3.366 -15.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -5.624 4.238 -17.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -5.193 2.595 -17.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -6.774 3.068 -18.317 1.00 0.00 H new ATOM 1356 N GLU A 83 -11.114 2.712 -12.301 1.00 0.00 N ATOM 1357 CA GLU A 83 -12.329 3.416 -11.887 1.00 0.00 C ATOM 1358 C GLU A 83 -12.467 3.449 -10.353 1.00 0.00 C ATOM 1359 O GLU A 83 -12.498 4.527 -9.767 1.00 0.00 O ATOM 1360 CB GLU A 83 -13.559 2.754 -12.556 1.00 0.00 C ATOM 1361 CG GLU A 83 -13.568 2.916 -14.088 1.00 0.00 C ATOM 1362 CD GLU A 83 -14.784 2.284 -14.784 1.00 0.00 C ATOM 1363 OE1 GLU A 83 -14.773 1.061 -15.035 1.00 0.00 O ATOM 1364 OE2 GLU A 83 -15.747 3.016 -15.108 1.00 0.00 O ATOM 0 H GLU A 83 -11.301 1.831 -12.779 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.266 4.453 -12.216 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -13.574 1.693 -12.308 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -14.469 3.190 -12.144 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -13.538 3.978 -14.329 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -12.660 2.471 -14.494 1.00 0.00 H new ATOM 1371 N ARG A 84 -12.487 2.267 -9.708 1.00 0.00 N ATOM 1372 CA ARG A 84 -12.681 2.167 -8.238 1.00 0.00 C ATOM 1373 C ARG A 84 -11.483 2.769 -7.460 1.00 0.00 C ATOM 1374 O ARG A 84 -11.646 3.208 -6.322 1.00 0.00 O ATOM 1375 CB ARG A 84 -12.932 0.695 -7.803 1.00 0.00 C ATOM 1376 CG ARG A 84 -11.766 -0.252 -8.109 1.00 0.00 C ATOM 1377 CD ARG A 84 -12.023 -1.709 -7.703 1.00 0.00 C ATOM 1378 NE ARG A 84 -10.859 -2.556 -8.018 1.00 0.00 N ATOM 1379 CZ ARG A 84 -10.382 -3.552 -7.258 1.00 0.00 C ATOM 1380 NH1 ARG A 84 -10.964 -3.885 -6.111 1.00 0.00 N ATOM 1381 NH2 ARG A 84 -9.323 -4.220 -7.663 1.00 0.00 N ATOM 0 H ARG A 84 -12.372 1.367 -10.175 1.00 0.00 H new ATOM 0 HA ARG A 84 -13.566 2.753 -7.990 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -13.134 0.673 -6.732 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -13.827 0.326 -8.304 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -11.552 -0.215 -9.177 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -10.875 0.106 -7.593 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -12.237 -1.761 -6.636 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -12.903 -2.086 -8.223 1.00 0.00 H new ATOM 0 HE ARG A 84 -10.372 -2.367 -8.894 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -11.791 -3.379 -5.793 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -10.584 -4.646 -5.549 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -8.874 -3.978 -8.546 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -8.951 -4.980 -7.093 1.00 0.00 H new ATOM 1395 N TRP A 85 -10.287 2.810 -8.088 1.00 0.00 N ATOM 1396 CA TRP A 85 -9.083 3.420 -7.486 1.00 0.00 C ATOM 1397 C TRP A 85 -9.114 4.952 -7.629 1.00 0.00 C ATOM 1398 O TRP A 85 -8.474 5.662 -6.849 1.00 0.00 O ATOM 1399 CB TRP A 85 -7.777 2.832 -8.086 1.00 0.00 C ATOM 1400 CG TRP A 85 -7.524 1.351 -7.791 1.00 0.00 C ATOM 1401 CD1 TRP A 85 -7.007 0.420 -8.661 1.00 0.00 C ATOM 1402 CD2 TRP A 85 -7.741 0.638 -6.546 1.00 0.00 C ATOM 1403 NE1 TRP A 85 -6.910 -0.801 -8.054 1.00 0.00 N ATOM 1404 CE2 TRP A 85 -7.341 -0.694 -6.759 1.00 0.00 C ATOM 1405 CE3 TRP A 85 -8.218 0.989 -5.273 1.00 0.00 C ATOM 1406 CZ2 TRP A 85 -7.423 -1.666 -5.765 1.00 0.00 C ATOM 1407 CZ3 TRP A 85 -8.297 0.023 -4.289 1.00 0.00 C ATOM 1408 CH2 TRP A 85 -7.893 -1.291 -4.535 1.00 0.00 C ATOM 0 H TRP A 85 -10.131 2.424 -9.019 1.00 0.00 H new ATOM 0 HA TRP A 85 -9.090 3.176 -6.424 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -7.800 2.970 -9.167 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -6.933 3.409 -7.709 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -6.718 0.625 -9.681 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -6.571 -1.656 -8.496 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -8.520 2.005 -5.065 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -7.125 -2.686 -5.959 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -8.677 0.288 -3.314 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -7.952 -2.023 -3.743 1.00 0.00 H new ATOM 1419 N ARG A 86 -9.853 5.449 -8.638 1.00 0.00 N ATOM 1420 CA ARG A 86 -10.190 6.881 -8.746 1.00 0.00 C ATOM 1421 C ARG A 86 -11.183 7.264 -7.633 1.00 0.00 C ATOM 1422 O ARG A 86 -11.039 8.314 -7.016 1.00 0.00 O ATOM 1423 CB ARG A 86 -10.782 7.209 -10.141 1.00 0.00 C ATOM 1424 CG ARG A 86 -11.382 8.630 -10.279 1.00 0.00 C ATOM 1425 CD ARG A 86 -11.892 8.923 -11.701 1.00 0.00 C ATOM 1426 NE ARG A 86 -12.920 7.956 -12.144 1.00 0.00 N ATOM 1427 CZ ARG A 86 -12.788 7.094 -13.164 1.00 0.00 C ATOM 1428 NH1 ARG A 86 -11.633 6.983 -13.826 1.00 0.00 N ATOM 1429 NH2 ARG A 86 -13.808 6.315 -13.493 1.00 0.00 N ATOM 0 H ARG A 86 -10.230 4.877 -9.394 1.00 0.00 H new ATOM 0 HA ARG A 86 -9.277 7.465 -8.627 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -9.999 7.087 -10.889 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -11.558 6.479 -10.370 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -12.204 8.743 -9.572 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -10.626 9.367 -10.009 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -12.307 9.930 -11.734 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -11.053 8.901 -12.396 1.00 0.00 H new ATOM 0 HE ARG A 86 -13.802 7.943 -11.632 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -10.834 7.558 -13.558 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -11.550 6.323 -14.599 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -14.683 6.374 -12.973 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -13.718 5.656 -14.267 1.00 0.00 H new ATOM 1443 N LYS A 87 -12.185 6.390 -7.392 1.00 0.00 N ATOM 1444 CA LYS A 87 -13.151 6.542 -6.271 1.00 0.00 C ATOM 1445 C LYS A 87 -12.419 6.523 -4.917 1.00 0.00 C ATOM 1446 O LYS A 87 -12.787 7.253 -3.992 1.00 0.00 O ATOM 1447 CB LYS A 87 -14.249 5.430 -6.300 1.00 0.00 C ATOM 1448 CG LYS A 87 -15.452 5.693 -7.235 1.00 0.00 C ATOM 1449 CD LYS A 87 -15.074 5.844 -8.725 1.00 0.00 C ATOM 1450 CE LYS A 87 -16.297 6.063 -9.620 1.00 0.00 C ATOM 1451 NZ LYS A 87 -17.072 7.278 -9.235 1.00 0.00 N ATOM 0 H LYS A 87 -12.350 5.562 -7.964 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.644 7.506 -6.396 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -13.781 4.492 -6.598 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -14.625 5.291 -5.286 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -16.163 4.873 -7.133 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -15.961 6.599 -6.907 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -14.389 6.684 -8.840 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -14.542 4.951 -9.054 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -15.973 6.155 -10.657 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -16.946 5.189 -9.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -17.797 7.470 -9.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -17.532 7.120 -8.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -16.429 8.092 -9.165 1.00 0.00 H new ATOM 1465 N PHE A 88 -11.386 5.676 -4.835 1.00 0.00 N ATOM 1466 CA PHE A 88 -10.521 5.550 -3.651 1.00 0.00 C ATOM 1467 C PHE A 88 -9.766 6.873 -3.406 1.00 0.00 C ATOM 1468 O PHE A 88 -9.694 7.360 -2.279 1.00 0.00 O ATOM 1469 CB PHE A 88 -9.543 4.367 -3.875 1.00 0.00 C ATOM 1470 CG PHE A 88 -8.705 3.948 -2.673 1.00 0.00 C ATOM 1471 CD1 PHE A 88 -9.216 4.020 -1.381 1.00 0.00 C ATOM 1472 CD2 PHE A 88 -7.415 3.446 -2.845 1.00 0.00 C ATOM 1473 CE1 PHE A 88 -8.465 3.613 -0.304 1.00 0.00 C ATOM 1474 CE2 PHE A 88 -6.665 3.038 -1.762 1.00 0.00 C ATOM 1475 CZ PHE A 88 -7.194 3.124 -0.492 1.00 0.00 C ATOM 0 H PHE A 88 -11.122 5.051 -5.597 1.00 0.00 H new ATOM 0 HA PHE A 88 -11.119 5.347 -2.763 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -10.120 3.504 -4.208 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.867 4.631 -4.688 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -10.214 4.400 -1.222 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.998 3.376 -3.839 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -8.875 3.678 0.693 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.667 2.653 -1.908 1.00 0.00 H new ATOM 0 HZ PHE A 88 -6.608 2.806 0.358 1.00 0.00 H new ATOM 1485 N PHE A 89 -9.241 7.453 -4.498 1.00 0.00 N ATOM 1486 CA PHE A 89 -8.590 8.776 -4.490 1.00 0.00 C ATOM 1487 C PHE A 89 -9.584 9.894 -4.097 1.00 0.00 C ATOM 1488 O PHE A 89 -9.236 10.763 -3.301 1.00 0.00 O ATOM 1489 CB PHE A 89 -7.947 9.070 -5.884 1.00 0.00 C ATOM 1490 CG PHE A 89 -7.663 10.552 -6.173 1.00 0.00 C ATOM 1491 CD1 PHE A 89 -6.818 11.297 -5.350 1.00 0.00 C ATOM 1492 CD2 PHE A 89 -8.268 11.206 -7.251 1.00 0.00 C ATOM 1493 CE1 PHE A 89 -6.587 12.636 -5.598 1.00 0.00 C ATOM 1494 CE2 PHE A 89 -8.030 12.544 -7.498 1.00 0.00 C ATOM 1495 CZ PHE A 89 -7.192 13.260 -6.668 1.00 0.00 C ATOM 0 H PHE A 89 -9.256 7.014 -5.419 1.00 0.00 H new ATOM 0 HA PHE A 89 -7.802 8.760 -3.737 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -7.011 8.516 -5.959 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -8.609 8.685 -6.660 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -6.338 10.820 -4.508 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -8.932 10.656 -7.901 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -5.929 13.197 -4.951 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -8.500 13.030 -8.341 1.00 0.00 H new ATOM 0 HZ PHE A 89 -7.010 14.308 -6.856 1.00 0.00 H new ATOM 1505 N THR A 90 -10.813 9.862 -4.646 1.00 0.00 N ATOM 1506 CA THR A 90 -11.805 10.947 -4.441 1.00 0.00 C ATOM 1507 C THR A 90 -12.261 11.048 -2.969 1.00 0.00 C ATOM 1508 O THR A 90 -12.883 12.040 -2.572 1.00 0.00 O ATOM 1509 CB THR A 90 -13.033 10.851 -5.409 1.00 0.00 C ATOM 1510 OG1 THR A 90 -13.678 9.577 -5.286 1.00 0.00 O ATOM 1511 CG2 THR A 90 -12.621 11.101 -6.876 1.00 0.00 C ATOM 0 H THR A 90 -11.147 9.099 -5.235 1.00 0.00 H new ATOM 0 HA THR A 90 -11.283 11.871 -4.692 1.00 0.00 H new ATOM 0 HB THR A 90 -13.737 11.631 -5.120 1.00 0.00 H new ATOM 0 HG1 THR A 90 -13.152 9.000 -4.694 1.00 0.00 H new ATOM 0 HG21 THR A 90 -13.499 11.026 -7.518 1.00 0.00 H new ATOM 0 HG22 THR A 90 -12.188 12.097 -6.968 1.00 0.00 H new ATOM 0 HG23 THR A 90 -11.885 10.356 -7.179 1.00 0.00 H new ATOM 1519 N ILE A 91 -11.974 10.006 -2.172 1.00 0.00 N ATOM 1520 CA ILE A 91 -12.126 10.054 -0.706 1.00 0.00 C ATOM 1521 C ILE A 91 -10.998 10.941 -0.098 1.00 0.00 C ATOM 1522 O ILE A 91 -11.250 11.825 0.724 1.00 0.00 O ATOM 1523 CB ILE A 91 -12.041 8.609 -0.074 1.00 0.00 C ATOM 1524 CG1 ILE A 91 -12.992 7.603 -0.796 1.00 0.00 C ATOM 1525 CG2 ILE A 91 -12.336 8.639 1.449 1.00 0.00 C ATOM 1526 CD1 ILE A 91 -12.775 6.142 -0.409 1.00 0.00 C ATOM 0 H ILE A 91 -11.632 9.111 -2.522 1.00 0.00 H new ATOM 0 HA ILE A 91 -13.106 10.475 -0.479 1.00 0.00 H new ATOM 0 HB ILE A 91 -11.018 8.261 -0.217 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -14.024 7.875 -0.575 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -12.859 7.705 -1.873 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -12.269 7.629 1.853 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -11.608 9.278 1.948 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -13.339 9.032 1.618 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -13.477 5.513 -0.956 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -11.755 5.848 -0.656 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -12.938 6.021 0.662 1.00 0.00 H new ATOM 1538 N PHE A 92 -9.751 10.689 -0.551 1.00 0.00 N ATOM 1539 CA PHE A 92 -8.512 11.233 0.068 1.00 0.00 C ATOM 1540 C PHE A 92 -7.906 12.404 -0.719 1.00 0.00 C ATOM 1541 O PHE A 92 -6.801 12.860 -0.399 1.00 0.00 O ATOM 1542 CB PHE A 92 -7.476 10.099 0.253 1.00 0.00 C ATOM 1543 CG PHE A 92 -8.030 8.944 1.075 1.00 0.00 C ATOM 1544 CD1 PHE A 92 -8.272 9.085 2.441 1.00 0.00 C ATOM 1545 CD2 PHE A 92 -8.346 7.737 0.474 1.00 0.00 C ATOM 1546 CE1 PHE A 92 -8.814 8.044 3.169 1.00 0.00 C ATOM 1547 CE2 PHE A 92 -8.875 6.701 1.199 1.00 0.00 C ATOM 1548 CZ PHE A 92 -9.114 6.850 2.545 1.00 0.00 C ATOM 0 H PHE A 92 -9.569 10.098 -1.362 1.00 0.00 H new ATOM 0 HA PHE A 92 -8.791 11.637 1.041 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -7.164 9.731 -0.724 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -6.587 10.497 0.742 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -8.034 10.016 2.934 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -8.173 7.610 -0.584 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -9.003 8.164 4.226 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -9.105 5.765 0.712 1.00 0.00 H new ATOM 0 HZ PHE A 92 -9.536 6.034 3.113 1.00 0.00 H new ATOM 1558 N GLU A 93 -8.643 12.907 -1.717 1.00 0.00 N ATOM 1559 CA GLU A 93 -8.215 14.062 -2.535 1.00 0.00 C ATOM 1560 C GLU A 93 -8.081 15.339 -1.676 1.00 0.00 C ATOM 1561 O GLU A 93 -7.242 16.202 -1.957 1.00 0.00 O ATOM 1562 CB GLU A 93 -9.213 14.293 -3.701 1.00 0.00 C ATOM 1563 CG GLU A 93 -10.682 14.460 -3.269 1.00 0.00 C ATOM 1564 CD GLU A 93 -11.586 15.006 -4.393 1.00 0.00 C ATOM 1565 OE1 GLU A 93 -11.411 16.176 -4.789 1.00 0.00 O ATOM 1566 OE2 GLU A 93 -12.451 14.265 -4.902 1.00 0.00 O ATOM 0 H GLU A 93 -9.552 12.530 -1.984 1.00 0.00 H new ATOM 0 HA GLU A 93 -7.233 13.836 -2.951 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -8.907 15.183 -4.252 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -9.145 13.452 -4.391 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -11.068 13.497 -2.936 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -10.728 15.134 -2.414 1.00 0.00 H new ATOM 1573 N LYS A 94 -8.897 15.428 -0.611 1.00 0.00 N ATOM 1574 CA LYS A 94 -8.945 16.605 0.279 1.00 0.00 C ATOM 1575 C LYS A 94 -7.779 16.620 1.291 1.00 0.00 C ATOM 1576 O LYS A 94 -7.601 17.606 2.021 1.00 0.00 O ATOM 1577 CB LYS A 94 -10.312 16.635 1.019 1.00 0.00 C ATOM 1578 CG LYS A 94 -11.593 16.626 0.124 1.00 0.00 C ATOM 1579 CD LYS A 94 -11.840 17.940 -0.677 1.00 0.00 C ATOM 1580 CE LYS A 94 -11.045 18.041 -1.996 1.00 0.00 C ATOM 1581 NZ LYS A 94 -11.240 19.340 -2.678 1.00 0.00 N ATOM 0 H LYS A 94 -9.543 14.686 -0.342 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.838 17.499 -0.336 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.357 15.774 1.687 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -10.341 17.526 1.646 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -11.522 15.796 -0.579 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.460 16.434 0.757 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -12.904 18.020 -0.901 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -11.582 18.790 -0.045 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -9.984 17.899 -1.789 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -11.350 17.235 -2.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -10.685 19.357 -3.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -12.248 19.467 -2.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -10.924 20.110 -2.055 1.00 0.00 H new ATOM 1595 N LYS A 95 -6.977 15.531 1.327 1.00 0.00 N ATOM 1596 CA LYS A 95 -5.892 15.358 2.318 1.00 0.00 C ATOM 1597 C LYS A 95 -4.563 14.949 1.643 1.00 0.00 C ATOM 1598 O LYS A 95 -3.607 15.731 1.649 1.00 0.00 O ATOM 1599 CB LYS A 95 -6.295 14.384 3.489 1.00 0.00 C ATOM 1600 CG LYS A 95 -7.144 13.133 3.138 1.00 0.00 C ATOM 1601 CD LYS A 95 -8.632 13.456 2.827 1.00 0.00 C ATOM 1602 CE LYS A 95 -9.359 14.195 3.957 1.00 0.00 C ATOM 1603 NZ LYS A 95 -9.566 13.335 5.139 1.00 0.00 N ATOM 0 H LYS A 95 -7.063 14.752 0.674 1.00 0.00 H new ATOM 0 HA LYS A 95 -5.728 16.332 2.780 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -5.378 14.041 3.968 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -6.845 14.963 4.231 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -6.701 12.635 2.275 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -7.100 12.430 3.970 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -8.680 14.061 1.921 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -9.159 12.525 2.617 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -8.782 15.074 4.245 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -10.323 14.551 3.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -9.637 13.927 5.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -10.444 12.789 5.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -8.763 12.682 5.238 1.00 0.00 H new ATOM 1617 N ILE A 96 -4.495 13.744 1.043 1.00 0.00 N ATOM 1618 CA ILE A 96 -3.235 13.210 0.477 1.00 0.00 C ATOM 1619 C ILE A 96 -2.994 13.725 -0.964 1.00 0.00 C ATOM 1620 O ILE A 96 -3.624 13.256 -1.921 1.00 0.00 O ATOM 1621 CB ILE A 96 -3.195 11.635 0.513 1.00 0.00 C ATOM 1622 CG1 ILE A 96 -3.581 11.091 1.930 1.00 0.00 C ATOM 1623 CG2 ILE A 96 -1.799 11.106 0.084 1.00 0.00 C ATOM 1624 CD1 ILE A 96 -2.657 11.519 3.067 1.00 0.00 C ATOM 0 H ILE A 96 -5.296 13.121 0.937 1.00 0.00 H new ATOM 0 HA ILE A 96 -2.428 13.579 1.110 1.00 0.00 H new ATOM 0 HB ILE A 96 -3.933 11.268 -0.200 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -4.594 11.420 2.164 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.600 10.002 1.890 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -1.797 10.017 0.117 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -1.580 11.439 -0.931 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -1.039 11.491 0.764 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -3.011 11.090 4.004 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -1.645 11.167 2.866 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.654 12.606 3.144 1.00 0.00 H new ATOM 1636 N GLU A 97 -2.094 14.721 -1.082 1.00 0.00 N ATOM 1637 CA GLU A 97 -1.595 15.247 -2.373 1.00 0.00 C ATOM 1638 C GLU A 97 -0.585 14.274 -3.012 1.00 0.00 C ATOM 1639 O GLU A 97 -0.506 14.155 -4.239 1.00 0.00 O ATOM 1640 CB GLU A 97 -0.926 16.638 -2.159 1.00 0.00 C ATOM 1641 CG GLU A 97 -1.903 17.778 -1.805 1.00 0.00 C ATOM 1642 CD GLU A 97 -2.866 18.129 -2.958 1.00 0.00 C ATOM 1643 OE1 GLU A 97 -2.480 18.916 -3.853 1.00 0.00 O ATOM 1644 OE2 GLU A 97 -4.006 17.616 -2.983 1.00 0.00 O ATOM 0 H GLU A 97 -1.686 15.191 -0.274 1.00 0.00 H new ATOM 0 HA GLU A 97 -2.444 15.354 -3.048 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -0.187 16.551 -1.363 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -0.386 16.909 -3.066 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -2.484 17.491 -0.929 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -1.333 18.666 -1.533 1.00 0.00 H new ATOM 1651 N ASP A 98 0.158 13.553 -2.157 1.00 0.00 N ATOM 1652 CA ASP A 98 1.269 12.656 -2.565 1.00 0.00 C ATOM 1653 C ASP A 98 0.778 11.291 -3.094 1.00 0.00 C ATOM 1654 O ASP A 98 1.596 10.403 -3.352 1.00 0.00 O ATOM 1655 CB ASP A 98 2.218 12.422 -1.353 1.00 0.00 C ATOM 1656 CG ASP A 98 2.943 13.693 -0.876 1.00 0.00 C ATOM 1657 OD1 ASP A 98 2.320 14.514 -0.171 1.00 0.00 O ATOM 1658 OD2 ASP A 98 4.142 13.865 -1.198 1.00 0.00 O ATOM 0 H ASP A 98 0.008 13.572 -1.148 1.00 0.00 H new ATOM 0 HA ASP A 98 1.794 13.151 -3.382 1.00 0.00 H new ATOM 0 HB2 ASP A 98 1.640 12.013 -0.525 1.00 0.00 H new ATOM 0 HB3 ASP A 98 2.961 11.672 -1.625 1.00 0.00 H new ATOM 1663 N TYR A 99 -0.543 11.158 -3.313 1.00 0.00 N ATOM 1664 CA TYR A 99 -1.220 9.864 -3.549 1.00 0.00 C ATOM 1665 C TYR A 99 -0.642 9.071 -4.749 1.00 0.00 C ATOM 1666 O TYR A 99 -0.694 7.849 -4.747 1.00 0.00 O ATOM 1667 CB TYR A 99 -2.749 10.094 -3.747 1.00 0.00 C ATOM 1668 CG TYR A 99 -3.143 10.672 -5.115 1.00 0.00 C ATOM 1669 CD1 TYR A 99 -2.919 12.013 -5.429 1.00 0.00 C ATOM 1670 CD2 TYR A 99 -3.720 9.859 -6.101 1.00 0.00 C ATOM 1671 CE1 TYR A 99 -3.257 12.522 -6.666 1.00 0.00 C ATOM 1672 CE2 TYR A 99 -4.054 10.363 -7.340 1.00 0.00 C ATOM 1673 CZ TYR A 99 -3.822 11.697 -7.619 1.00 0.00 C ATOM 1674 OH TYR A 99 -4.148 12.207 -8.853 1.00 0.00 O ATOM 0 H TYR A 99 -1.180 11.954 -3.332 1.00 0.00 H new ATOM 0 HA TYR A 99 -1.040 9.254 -2.664 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -3.266 9.145 -3.607 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -3.104 10.768 -2.968 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -2.473 12.664 -4.691 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -3.906 8.817 -5.886 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -3.080 13.564 -6.889 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -4.494 9.720 -8.088 1.00 0.00 H new ATOM 0 HH TYR A 99 -4.535 11.498 -9.408 1.00 0.00 H new ATOM 1684 N ASN A 100 -0.090 9.780 -5.754 1.00 0.00 N ATOM 1685 CA ASN A 100 0.325 9.176 -7.045 1.00 0.00 C ATOM 1686 C ASN A 100 1.817 9.393 -7.349 1.00 0.00 C ATOM 1687 O ASN A 100 2.220 9.307 -8.515 1.00 0.00 O ATOM 1688 CB ASN A 100 -0.539 9.755 -8.203 1.00 0.00 C ATOM 1689 CG ASN A 100 -0.354 11.266 -8.434 1.00 0.00 C ATOM 1690 OD1 ASN A 100 -0.127 12.033 -7.494 1.00 0.00 O ATOM 1691 ND2 ASN A 100 -0.454 11.704 -9.684 1.00 0.00 N ATOM 0 H ASN A 100 0.082 10.784 -5.698 1.00 0.00 H new ATOM 0 HA ASN A 100 0.167 8.101 -6.961 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -0.294 9.225 -9.124 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -1.590 9.557 -7.991 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -0.342 12.697 -9.887 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -0.642 11.047 -10.441 1.00 0.00 H new ATOM 1698 N PHE A 101 2.641 9.637 -6.313 1.00 0.00 N ATOM 1699 CA PHE A 101 4.100 9.846 -6.509 1.00 0.00 C ATOM 1700 C PHE A 101 4.753 8.562 -7.074 1.00 0.00 C ATOM 1701 O PHE A 101 5.601 8.625 -7.972 1.00 0.00 O ATOM 1702 CB PHE A 101 4.793 10.278 -5.190 1.00 0.00 C ATOM 1703 CG PHE A 101 6.301 10.551 -5.332 1.00 0.00 C ATOM 1704 CD1 PHE A 101 6.771 11.787 -5.770 1.00 0.00 C ATOM 1705 CD2 PHE A 101 7.248 9.565 -5.043 1.00 0.00 C ATOM 1706 CE1 PHE A 101 8.128 12.028 -5.910 1.00 0.00 C ATOM 1707 CE2 PHE A 101 8.600 9.808 -5.183 1.00 0.00 C ATOM 1708 CZ PHE A 101 9.041 11.039 -5.617 1.00 0.00 C ATOM 0 H PHE A 101 2.334 9.695 -5.342 1.00 0.00 H new ATOM 0 HA PHE A 101 4.231 10.654 -7.229 1.00 0.00 H new ATOM 0 HB2 PHE A 101 4.306 11.178 -4.814 1.00 0.00 H new ATOM 0 HB3 PHE A 101 4.645 9.499 -4.442 1.00 0.00 H new ATOM 0 HD1 PHE A 101 6.066 12.571 -6.004 1.00 0.00 H new ATOM 0 HD2 PHE A 101 6.916 8.595 -4.704 1.00 0.00 H new ATOM 0 HE1 PHE A 101 8.471 12.994 -6.250 1.00 0.00 H new ATOM 0 HE2 PHE A 101 9.314 9.031 -4.952 1.00 0.00 H new ATOM 0 HZ PHE A 101 10.099 11.228 -5.727 1.00 0.00 H new ATOM 1718 N GLY A 102 4.340 7.408 -6.520 1.00 0.00 N ATOM 1719 CA GLY A 102 4.793 6.096 -6.986 1.00 0.00 C ATOM 1720 C GLY A 102 5.642 5.388 -5.944 1.00 0.00 C ATOM 1721 O GLY A 102 6.735 5.855 -5.603 1.00 0.00 O ATOM 0 H GLY A 102 3.685 7.364 -5.739 1.00 0.00 H new ATOM 0 HA2 GLY A 102 3.928 5.479 -7.230 1.00 0.00 H new ATOM 0 HA3 GLY A 102 5.369 6.215 -7.904 1.00 0.00 H new ATOM 1725 N THR A 103 5.123 4.271 -5.415 1.00 0.00 N ATOM 1726 CA THR A 103 5.790 3.458 -4.395 1.00 0.00 C ATOM 1727 C THR A 103 5.569 1.963 -4.693 1.00 0.00 C ATOM 1728 O THR A 103 4.485 1.564 -5.134 1.00 0.00 O ATOM 1729 CB THR A 103 5.255 3.818 -2.968 1.00 0.00 C ATOM 1730 OG1 THR A 103 5.449 5.218 -2.727 1.00 0.00 O ATOM 1731 CG2 THR A 103 5.951 3.023 -1.858 1.00 0.00 C ATOM 0 H THR A 103 4.212 3.903 -5.690 1.00 0.00 H new ATOM 0 HA THR A 103 6.859 3.669 -4.420 1.00 0.00 H new ATOM 0 HB THR A 103 4.196 3.559 -2.947 1.00 0.00 H new ATOM 0 HG1 THR A 103 5.469 5.384 -1.761 1.00 0.00 H new ATOM 0 HG21 THR A 103 5.541 3.313 -0.891 1.00 0.00 H new ATOM 0 HG22 THR A 103 5.788 1.957 -2.017 1.00 0.00 H new ATOM 0 HG23 THR A 103 7.020 3.233 -1.876 1.00 0.00 H new ATOM 1739 N LEU A 104 6.609 1.152 -4.454 1.00 0.00 N ATOM 1740 CA LEU A 104 6.558 -0.305 -4.627 1.00 0.00 C ATOM 1741 C LEU A 104 5.896 -0.923 -3.383 1.00 0.00 C ATOM 1742 O LEU A 104 6.359 -0.711 -2.255 1.00 0.00 O ATOM 1743 CB LEU A 104 8.004 -0.830 -4.865 1.00 0.00 C ATOM 1744 CG LEU A 104 8.198 -2.321 -5.311 1.00 0.00 C ATOM 1745 CD1 LEU A 104 9.557 -2.507 -6.027 1.00 0.00 C ATOM 1746 CD2 LEU A 104 8.088 -3.305 -4.124 1.00 0.00 C ATOM 0 H LEU A 104 7.515 1.492 -4.133 1.00 0.00 H new ATOM 0 HA LEU A 104 5.961 -0.589 -5.493 1.00 0.00 H new ATOM 0 HB2 LEU A 104 8.466 -0.196 -5.621 1.00 0.00 H new ATOM 0 HB3 LEU A 104 8.565 -0.685 -3.942 1.00 0.00 H new ATOM 0 HG LEU A 104 7.391 -2.550 -6.007 1.00 0.00 H new ATOM 0 HD11 LEU A 104 9.670 -3.549 -6.328 1.00 0.00 H new ATOM 0 HD12 LEU A 104 9.594 -1.869 -6.910 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.366 -2.235 -5.349 1.00 0.00 H new ATOM 0 HD21 LEU A 104 8.229 -4.325 -4.482 1.00 0.00 H new ATOM 0 HD22 LEU A 104 8.854 -3.071 -3.385 1.00 0.00 H new ATOM 0 HD23 LEU A 104 7.103 -3.214 -3.666 1.00 0.00 H new ATOM 1758 N LEU A 105 4.813 -1.676 -3.607 1.00 0.00 N ATOM 1759 CA LEU A 105 4.051 -2.354 -2.550 1.00 0.00 C ATOM 1760 C LEU A 105 4.253 -3.867 -2.657 1.00 0.00 C ATOM 1761 O LEU A 105 4.036 -4.453 -3.723 1.00 0.00 O ATOM 1762 CB LEU A 105 2.542 -2.004 -2.672 1.00 0.00 C ATOM 1763 CG LEU A 105 1.553 -2.717 -1.683 1.00 0.00 C ATOM 1764 CD1 LEU A 105 1.885 -2.428 -0.203 1.00 0.00 C ATOM 1765 CD2 LEU A 105 0.090 -2.342 -2.009 1.00 0.00 C ATOM 0 H LEU A 105 4.435 -1.834 -4.541 1.00 0.00 H new ATOM 0 HA LEU A 105 4.410 -2.016 -1.578 1.00 0.00 H new ATOM 0 HB2 LEU A 105 2.434 -0.928 -2.539 1.00 0.00 H new ATOM 0 HB3 LEU A 105 2.224 -2.233 -3.689 1.00 0.00 H new ATOM 0 HG LEU A 105 1.677 -3.791 -1.826 1.00 0.00 H new ATOM 0 HD11 LEU A 105 1.171 -2.945 0.438 1.00 0.00 H new ATOM 0 HD12 LEU A 105 2.893 -2.780 0.019 1.00 0.00 H new ATOM 0 HD13 LEU A 105 1.826 -1.355 -0.020 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -0.579 -2.847 -1.312 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.038 -1.263 -1.918 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.147 -2.651 -3.027 1.00 0.00 H new ATOM 1777 N ARG A 106 4.709 -4.474 -1.549 1.00 0.00 N ATOM 1778 CA ARG A 106 4.657 -5.930 -1.357 1.00 0.00 C ATOM 1779 C ARG A 106 3.174 -6.359 -1.332 1.00 0.00 C ATOM 1780 O ARG A 106 2.402 -5.859 -0.499 1.00 0.00 O ATOM 1781 CB ARG A 106 5.410 -6.339 -0.044 1.00 0.00 C ATOM 1782 CG ARG A 106 5.043 -5.508 1.212 1.00 0.00 C ATOM 1783 CD ARG A 106 5.896 -5.869 2.448 1.00 0.00 C ATOM 1784 NE ARG A 106 5.744 -4.868 3.528 1.00 0.00 N ATOM 1785 CZ ARG A 106 6.725 -4.451 4.349 1.00 0.00 C ATOM 1786 NH1 ARG A 106 7.955 -4.942 4.253 1.00 0.00 N ATOM 1787 NH2 ARG A 106 6.460 -3.537 5.265 1.00 0.00 N ATOM 0 H ARG A 106 5.122 -3.970 -0.765 1.00 0.00 H new ATOM 0 HA ARG A 106 5.161 -6.442 -2.176 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.204 -7.389 0.162 1.00 0.00 H new ATOM 0 HB3 ARG A 106 6.483 -6.252 -0.217 1.00 0.00 H new ATOM 0 HG2 ARG A 106 5.168 -4.449 0.989 1.00 0.00 H new ATOM 0 HG3 ARG A 106 3.990 -5.662 1.447 1.00 0.00 H new ATOM 0 HD2 ARG A 106 5.603 -6.851 2.818 1.00 0.00 H new ATOM 0 HD3 ARG A 106 6.945 -5.937 2.159 1.00 0.00 H new ATOM 0 HE ARG A 106 4.818 -4.460 3.661 1.00 0.00 H new ATOM 0 HH11 ARG A 106 8.169 -5.647 3.548 1.00 0.00 H new ATOM 0 HH12 ARG A 106 8.686 -4.614 4.884 1.00 0.00 H new ATOM 0 HH21 ARG A 106 5.518 -3.154 5.345 1.00 0.00 H new ATOM 0 HH22 ARG A 106 7.197 -3.215 5.892 1.00 0.00 H new ATOM 1801 N THR A 107 2.770 -7.224 -2.290 1.00 0.00 N ATOM 1802 CA THR A 107 1.366 -7.650 -2.451 1.00 0.00 C ATOM 1803 C THR A 107 0.851 -8.289 -1.159 1.00 0.00 C ATOM 1804 O THR A 107 -0.226 -7.944 -0.672 1.00 0.00 O ATOM 1805 CB THR A 107 1.183 -8.649 -3.645 1.00 0.00 C ATOM 1806 OG1 THR A 107 1.987 -9.823 -3.432 1.00 0.00 O ATOM 1807 CG2 THR A 107 1.566 -8.016 -4.991 1.00 0.00 C ATOM 0 H THR A 107 3.406 -7.643 -2.968 1.00 0.00 H new ATOM 0 HA THR A 107 0.785 -6.756 -2.675 1.00 0.00 H new ATOM 0 HB THR A 107 0.127 -8.916 -3.683 1.00 0.00 H new ATOM 0 HG1 THR A 107 2.921 -9.559 -3.295 1.00 0.00 H new ATOM 0 HG21 THR A 107 1.423 -8.744 -5.789 1.00 0.00 H new ATOM 0 HG22 THR A 107 0.936 -7.146 -5.177 1.00 0.00 H new ATOM 0 HG23 THR A 107 2.611 -7.708 -4.964 1.00 0.00 H new ATOM 1815 N ASP A 108 1.678 -9.178 -0.591 1.00 0.00 N ATOM 1816 CA ASP A 108 1.370 -9.903 0.644 1.00 0.00 C ATOM 1817 C ASP A 108 2.145 -9.300 1.825 1.00 0.00 C ATOM 1818 O ASP A 108 3.187 -8.656 1.649 1.00 0.00 O ATOM 1819 CB ASP A 108 1.682 -11.424 0.461 1.00 0.00 C ATOM 1820 CG ASP A 108 1.193 -12.354 1.599 1.00 0.00 C ATOM 1821 OD1 ASP A 108 0.300 -11.961 2.383 1.00 0.00 O ATOM 1822 OD2 ASP A 108 1.691 -13.496 1.692 1.00 0.00 O ATOM 0 H ASP A 108 2.589 -9.415 -0.983 1.00 0.00 H new ATOM 0 HA ASP A 108 0.308 -9.804 0.866 1.00 0.00 H new ATOM 0 HB2 ASP A 108 1.232 -11.758 -0.474 1.00 0.00 H new ATOM 0 HB3 ASP A 108 2.760 -11.544 0.357 1.00 0.00 H new ATOM 1827 N ALA A 109 1.587 -9.487 3.022 1.00 0.00 N ATOM 1828 CA ALA A 109 2.243 -9.162 4.287 1.00 0.00 C ATOM 1829 C ALA A 109 3.433 -10.104 4.510 1.00 0.00 C ATOM 1830 O ALA A 109 4.478 -9.694 5.024 1.00 0.00 O ATOM 1831 CB ALA A 109 1.227 -9.275 5.428 1.00 0.00 C ATOM 0 H ALA A 109 0.651 -9.875 3.140 1.00 0.00 H new ATOM 0 HA ALA A 109 2.621 -8.140 4.259 1.00 0.00 H new ATOM 0 HB1 ALA A 109 1.713 -9.033 6.373 1.00 0.00 H new ATOM 0 HB2 ALA A 109 0.406 -8.580 5.254 1.00 0.00 H new ATOM 0 HB3 ALA A 109 0.838 -10.293 5.470 1.00 0.00 H new ATOM 1837 N SER A 110 3.259 -11.369 4.074 1.00 0.00 N ATOM 1838 CA SER A 110 4.286 -12.416 4.158 1.00 0.00 C ATOM 1839 C SER A 110 5.080 -12.521 2.820 1.00 0.00 C ATOM 1840 O SER A 110 5.670 -13.565 2.515 1.00 0.00 O ATOM 1841 CB SER A 110 3.611 -13.762 4.530 1.00 0.00 C ATOM 1842 OG SER A 110 4.566 -14.779 4.805 1.00 0.00 O ATOM 0 H SER A 110 2.389 -11.691 3.649 1.00 0.00 H new ATOM 0 HA SER A 110 5.006 -12.160 4.936 1.00 0.00 H new ATOM 0 HB2 SER A 110 2.973 -13.619 5.402 1.00 0.00 H new ATOM 0 HB3 SER A 110 2.966 -14.082 3.712 1.00 0.00 H new ATOM 0 HG SER A 110 5.322 -14.694 4.187 1.00 0.00 H new ATOM 1848 N ALA A 111 5.120 -11.413 2.045 1.00 0.00 N ATOM 1849 CA ALA A 111 5.822 -11.357 0.739 1.00 0.00 C ATOM 1850 C ALA A 111 7.309 -11.023 0.902 1.00 0.00 C ATOM 1851 O ALA A 111 7.792 -10.699 1.993 1.00 0.00 O ATOM 1852 CB ALA A 111 5.159 -10.324 -0.196 1.00 0.00 C ATOM 0 H ALA A 111 4.669 -10.536 2.304 1.00 0.00 H new ATOM 0 HA ALA A 111 5.743 -12.349 0.295 1.00 0.00 H new ATOM 0 HB1 ALA A 111 5.691 -10.300 -1.147 1.00 0.00 H new ATOM 0 HB2 ALA A 111 4.120 -10.603 -0.368 1.00 0.00 H new ATOM 0 HB3 ALA A 111 5.198 -9.337 0.266 1.00 0.00 H new ATOM 1858 N GLU A 112 8.012 -11.109 -0.225 1.00 0.00 N ATOM 1859 CA GLU A 112 9.419 -10.717 -0.353 1.00 0.00 C ATOM 1860 C GLU A 112 9.522 -9.538 -1.346 1.00 0.00 C ATOM 1861 O GLU A 112 8.503 -8.974 -1.761 1.00 0.00 O ATOM 1862 CB GLU A 112 10.247 -11.942 -0.822 1.00 0.00 C ATOM 1863 CG GLU A 112 9.777 -12.540 -2.163 1.00 0.00 C ATOM 1864 CD GLU A 112 10.574 -13.769 -2.603 1.00 0.00 C ATOM 1865 OE1 GLU A 112 11.708 -13.600 -3.093 1.00 0.00 O ATOM 1866 OE2 GLU A 112 10.085 -14.908 -2.440 1.00 0.00 O ATOM 0 H GLU A 112 7.613 -11.461 -1.095 1.00 0.00 H new ATOM 0 HA GLU A 112 9.820 -10.389 0.606 1.00 0.00 H new ATOM 0 HB2 GLU A 112 11.292 -11.647 -0.914 1.00 0.00 H new ATOM 0 HB3 GLU A 112 10.200 -12.715 -0.055 1.00 0.00 H new ATOM 0 HG2 GLU A 112 8.725 -12.811 -2.080 1.00 0.00 H new ATOM 0 HG3 GLU A 112 9.849 -11.775 -2.936 1.00 0.00 H new ATOM 1873 N TYR A 113 10.759 -9.192 -1.738 1.00 0.00 N ATOM 1874 CA TYR A 113 11.047 -8.079 -2.681 1.00 0.00 C ATOM 1875 C TYR A 113 11.075 -8.562 -4.155 1.00 0.00 C ATOM 1876 O TYR A 113 11.589 -7.861 -5.035 1.00 0.00 O ATOM 1877 CB TYR A 113 12.391 -7.389 -2.280 1.00 0.00 C ATOM 1878 CG TYR A 113 13.604 -8.340 -2.178 1.00 0.00 C ATOM 1879 CD1 TYR A 113 14.397 -8.633 -3.293 1.00 0.00 C ATOM 1880 CD2 TYR A 113 13.940 -8.956 -0.965 1.00 0.00 C ATOM 1881 CE1 TYR A 113 15.473 -9.497 -3.206 1.00 0.00 C ATOM 1882 CE2 TYR A 113 15.015 -9.823 -0.875 1.00 0.00 C ATOM 1883 CZ TYR A 113 15.779 -10.090 -1.997 1.00 0.00 C ATOM 1884 OH TYR A 113 16.847 -10.962 -1.911 1.00 0.00 O ATOM 0 H TYR A 113 11.597 -9.674 -1.413 1.00 0.00 H new ATOM 0 HA TYR A 113 10.240 -7.350 -2.611 1.00 0.00 H new ATOM 0 HB2 TYR A 113 12.617 -6.613 -3.011 1.00 0.00 H new ATOM 0 HB3 TYR A 113 12.255 -6.892 -1.319 1.00 0.00 H new ATOM 0 HD1 TYR A 113 14.163 -8.174 -4.242 1.00 0.00 H new ATOM 0 HD2 TYR A 113 13.349 -8.750 -0.084 1.00 0.00 H new ATOM 0 HE1 TYR A 113 16.072 -9.707 -4.080 1.00 0.00 H new ATOM 0 HE2 TYR A 113 15.257 -10.290 0.068 1.00 0.00 H new ATOM 0 HH TYR A 113 16.928 -11.291 -0.991 1.00 0.00 H new ATOM 1894 N GLY A 114 10.478 -9.738 -4.415 1.00 0.00 N ATOM 1895 CA GLY A 114 10.473 -10.340 -5.748 1.00 0.00 C ATOM 1896 C GLY A 114 9.350 -9.774 -6.604 1.00 0.00 C ATOM 1897 O GLY A 114 8.258 -9.532 -6.083 1.00 0.00 O ATOM 0 H GLY A 114 9.990 -10.290 -3.709 1.00 0.00 H new ATOM 0 HA2 GLY A 114 11.431 -10.159 -6.235 1.00 0.00 H new ATOM 0 HA3 GLY A 114 10.358 -11.420 -5.661 1.00 0.00 H new ATOM 1901 N GLN A 115 9.608 -9.591 -7.917 1.00 0.00 N ATOM 1902 CA GLN A 115 8.639 -8.975 -8.870 1.00 0.00 C ATOM 1903 C GLN A 115 7.295 -9.746 -8.955 1.00 0.00 C ATOM 1904 O GLN A 115 6.269 -9.181 -9.349 1.00 0.00 O ATOM 1905 CB GLN A 115 9.292 -8.787 -10.287 1.00 0.00 C ATOM 1906 CG GLN A 115 10.154 -9.961 -10.839 1.00 0.00 C ATOM 1907 CD GLN A 115 9.411 -11.275 -11.115 1.00 0.00 C ATOM 1908 OE1 GLN A 115 9.325 -12.148 -10.248 1.00 0.00 O ATOM 1909 NE2 GLN A 115 8.833 -11.397 -12.304 1.00 0.00 N ATOM 0 H GLN A 115 10.489 -9.863 -8.352 1.00 0.00 H new ATOM 0 HA GLN A 115 8.391 -7.990 -8.474 1.00 0.00 H new ATOM 0 HB2 GLN A 115 8.494 -8.589 -11.002 1.00 0.00 H new ATOM 0 HB3 GLN A 115 9.918 -7.895 -10.254 1.00 0.00 H new ATOM 0 HG2 GLN A 115 10.626 -9.633 -11.765 1.00 0.00 H new ATOM 0 HG3 GLN A 115 10.954 -10.163 -10.127 1.00 0.00 H new ATOM 0 HE21 GLN A 115 8.927 -10.653 -12.995 1.00 0.00 H new ATOM 0 HE22 GLN A 115 8.295 -12.235 -12.526 1.00 0.00 H new ATOM 1918 N PHE A 116 7.331 -11.033 -8.584 1.00 0.00 N ATOM 1919 CA PHE A 116 6.149 -11.906 -8.517 1.00 0.00 C ATOM 1920 C PHE A 116 5.261 -11.529 -7.307 1.00 0.00 C ATOM 1921 O PHE A 116 4.034 -11.462 -7.418 1.00 0.00 O ATOM 1922 CB PHE A 116 6.626 -13.385 -8.422 1.00 0.00 C ATOM 1923 CG PHE A 116 5.508 -14.424 -8.412 1.00 0.00 C ATOM 1924 CD1 PHE A 116 4.719 -14.628 -9.545 1.00 0.00 C ATOM 1925 CD2 PHE A 116 5.258 -15.204 -7.283 1.00 0.00 C ATOM 1926 CE1 PHE A 116 3.716 -15.576 -9.547 1.00 0.00 C ATOM 1927 CE2 PHE A 116 4.252 -16.150 -7.286 1.00 0.00 C ATOM 1928 CZ PHE A 116 3.481 -16.337 -8.419 1.00 0.00 C ATOM 0 H PHE A 116 8.195 -11.505 -8.318 1.00 0.00 H new ATOM 0 HA PHE A 116 5.545 -11.779 -9.415 1.00 0.00 H new ATOM 0 HB2 PHE A 116 7.287 -13.593 -9.264 1.00 0.00 H new ATOM 0 HB3 PHE A 116 7.219 -13.502 -7.515 1.00 0.00 H new ATOM 0 HD1 PHE A 116 4.896 -14.037 -10.431 1.00 0.00 H new ATOM 0 HD2 PHE A 116 5.858 -15.066 -6.396 1.00 0.00 H new ATOM 0 HE1 PHE A 116 3.114 -15.723 -10.432 1.00 0.00 H new ATOM 0 HE2 PHE A 116 4.067 -16.744 -6.403 1.00 0.00 H new ATOM 0 HZ PHE A 116 2.695 -17.078 -8.421 1.00 0.00 H new ATOM 1938 N THR A 117 5.912 -11.256 -6.164 1.00 0.00 N ATOM 1939 CA THR A 117 5.244 -10.981 -4.876 1.00 0.00 C ATOM 1940 C THR A 117 5.117 -9.468 -4.607 1.00 0.00 C ATOM 1941 O THR A 117 4.740 -9.062 -3.501 1.00 0.00 O ATOM 1942 CB THR A 117 6.046 -11.651 -3.713 1.00 0.00 C ATOM 1943 OG1 THR A 117 7.384 -11.118 -3.682 1.00 0.00 O ATOM 1944 CG2 THR A 117 6.106 -13.183 -3.865 1.00 0.00 C ATOM 0 H THR A 117 6.930 -11.219 -6.105 1.00 0.00 H new ATOM 0 HA THR A 117 4.238 -11.398 -4.928 1.00 0.00 H new ATOM 0 HB THR A 117 5.529 -11.428 -2.780 1.00 0.00 H new ATOM 0 HG1 THR A 117 7.506 -10.496 -4.429 1.00 0.00 H new ATOM 0 HG21 THR A 117 6.672 -13.609 -3.037 1.00 0.00 H new ATOM 0 HG22 THR A 117 5.094 -13.589 -3.860 1.00 0.00 H new ATOM 0 HG23 THR A 117 6.594 -13.436 -4.806 1.00 0.00 H new ATOM 1952 N THR A 118 5.466 -8.631 -5.597 1.00 0.00 N ATOM 1953 CA THR A 118 5.340 -7.166 -5.488 1.00 0.00 C ATOM 1954 C THR A 118 4.603 -6.586 -6.709 1.00 0.00 C ATOM 1955 O THR A 118 4.530 -7.222 -7.764 1.00 0.00 O ATOM 1956 CB THR A 118 6.733 -6.474 -5.337 1.00 0.00 C ATOM 1957 OG1 THR A 118 7.558 -6.736 -6.480 1.00 0.00 O ATOM 1958 CG2 THR A 118 7.469 -6.917 -4.057 1.00 0.00 C ATOM 0 H THR A 118 5.842 -8.947 -6.491 1.00 0.00 H new ATOM 0 HA THR A 118 4.758 -6.963 -4.589 1.00 0.00 H new ATOM 0 HB THR A 118 6.544 -5.403 -5.263 1.00 0.00 H new ATOM 0 HG1 THR A 118 7.902 -7.652 -6.432 1.00 0.00 H new ATOM 0 HG21 THR A 118 8.432 -6.409 -3.997 1.00 0.00 H new ATOM 0 HG22 THR A 118 6.868 -6.661 -3.185 1.00 0.00 H new ATOM 0 HG23 THR A 118 7.628 -7.995 -4.084 1.00 0.00 H new ATOM 1966 N CYS A 119 4.046 -5.377 -6.529 1.00 0.00 N ATOM 1967 CA CYS A 119 3.351 -4.616 -7.576 1.00 0.00 C ATOM 1968 C CYS A 119 3.697 -3.126 -7.418 1.00 0.00 C ATOM 1969 O CYS A 119 3.608 -2.578 -6.308 1.00 0.00 O ATOM 1970 CB CYS A 119 1.816 -4.842 -7.487 1.00 0.00 C ATOM 1971 SG CYS A 119 1.285 -6.502 -7.972 1.00 0.00 S ATOM 0 H CYS A 119 4.068 -4.893 -5.632 1.00 0.00 H new ATOM 0 HA CYS A 119 3.677 -4.960 -8.558 1.00 0.00 H new ATOM 0 HB2 CYS A 119 1.490 -4.652 -6.464 1.00 0.00 H new ATOM 0 HB3 CYS A 119 1.315 -4.112 -8.122 1.00 0.00 H new ATOM 0 HG CYS A 119 2.318 -7.289 -8.027 1.00 0.00 H new ATOM 1977 N PHE A 120 4.123 -2.492 -8.526 1.00 0.00 N ATOM 1978 CA PHE A 120 4.413 -1.049 -8.571 1.00 0.00 C ATOM 1979 C PHE A 120 3.082 -0.284 -8.604 1.00 0.00 C ATOM 1980 O PHE A 120 2.368 -0.314 -9.615 1.00 0.00 O ATOM 1981 CB PHE A 120 5.266 -0.703 -9.820 1.00 0.00 C ATOM 1982 CG PHE A 120 6.623 -1.399 -9.880 1.00 0.00 C ATOM 1983 CD1 PHE A 120 6.769 -2.640 -10.503 1.00 0.00 C ATOM 1984 CD2 PHE A 120 7.758 -0.801 -9.330 1.00 0.00 C ATOM 1985 CE1 PHE A 120 8.003 -3.259 -10.571 1.00 0.00 C ATOM 1986 CE2 PHE A 120 8.990 -1.417 -9.406 1.00 0.00 C ATOM 1987 CZ PHE A 120 9.114 -2.647 -10.025 1.00 0.00 C ATOM 0 H PHE A 120 4.276 -2.967 -9.416 1.00 0.00 H new ATOM 0 HA PHE A 120 4.983 -0.762 -7.688 1.00 0.00 H new ATOM 0 HB2 PHE A 120 4.699 -0.964 -10.714 1.00 0.00 H new ATOM 0 HB3 PHE A 120 5.425 0.375 -9.847 1.00 0.00 H new ATOM 0 HD1 PHE A 120 5.906 -3.123 -10.938 1.00 0.00 H new ATOM 0 HD2 PHE A 120 7.671 0.157 -8.838 1.00 0.00 H new ATOM 0 HE1 PHE A 120 8.098 -4.222 -11.051 1.00 0.00 H new ATOM 0 HE2 PHE A 120 9.859 -0.937 -8.981 1.00 0.00 H new ATOM 0 HZ PHE A 120 10.079 -3.129 -10.081 1.00 0.00 H new ATOM 1997 N VAL A 121 2.738 0.367 -7.482 1.00 0.00 N ATOM 1998 CA VAL A 121 1.458 1.092 -7.323 1.00 0.00 C ATOM 1999 C VAL A 121 1.708 2.575 -7.005 1.00 0.00 C ATOM 2000 O VAL A 121 2.855 3.037 -6.953 1.00 0.00 O ATOM 2001 CB VAL A 121 0.554 0.435 -6.200 1.00 0.00 C ATOM 2002 CG1 VAL A 121 0.166 -1.021 -6.565 1.00 0.00 C ATOM 2003 CG2 VAL A 121 1.242 0.503 -4.814 1.00 0.00 C ATOM 0 H VAL A 121 3.336 0.408 -6.657 1.00 0.00 H new ATOM 0 HA VAL A 121 0.923 1.022 -8.270 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.367 1.014 -6.140 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -0.454 -1.442 -5.773 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.390 -1.025 -7.502 1.00 0.00 H new ATOM 0 HG13 VAL A 121 1.069 -1.621 -6.676 1.00 0.00 H new ATOM 0 HG21 VAL A 121 0.597 0.044 -4.065 1.00 0.00 H new ATOM 0 HG22 VAL A 121 2.191 -0.032 -4.852 1.00 0.00 H new ATOM 0 HG23 VAL A 121 1.423 1.545 -4.548 1.00 0.00 H new ATOM 2013 N VAL A 122 0.609 3.319 -6.845 1.00 0.00 N ATOM 2014 CA VAL A 122 0.631 4.695 -6.328 1.00 0.00 C ATOM 2015 C VAL A 122 0.772 4.670 -4.790 1.00 0.00 C ATOM 2016 O VAL A 122 0.499 3.638 -4.157 1.00 0.00 O ATOM 2017 CB VAL A 122 -0.664 5.477 -6.775 1.00 0.00 C ATOM 2018 CG1 VAL A 122 -0.788 5.520 -8.324 1.00 0.00 C ATOM 2019 CG2 VAL A 122 -1.947 4.891 -6.122 1.00 0.00 C ATOM 0 H VAL A 122 -0.327 2.983 -7.071 1.00 0.00 H new ATOM 0 HA VAL A 122 1.490 5.222 -6.744 1.00 0.00 H new ATOM 0 HB VAL A 122 -0.562 6.502 -6.420 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -1.690 6.065 -8.602 1.00 0.00 H new ATOM 0 HG12 VAL A 122 0.083 6.022 -8.745 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -0.845 4.503 -8.713 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -2.816 5.458 -6.456 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -2.060 3.847 -6.415 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.866 4.957 -5.037 1.00 0.00 H new ATOM 2029 N ARG A 123 1.183 5.808 -4.192 1.00 0.00 N ATOM 2030 CA ARG A 123 1.397 5.901 -2.728 1.00 0.00 C ATOM 2031 C ARG A 123 0.127 5.546 -1.941 1.00 0.00 C ATOM 2032 O ARG A 123 0.220 4.869 -0.929 1.00 0.00 O ATOM 2033 CB ARG A 123 1.893 7.308 -2.289 1.00 0.00 C ATOM 2034 CG ARG A 123 3.387 7.582 -2.553 1.00 0.00 C ATOM 2035 CD ARG A 123 3.919 8.816 -1.793 1.00 0.00 C ATOM 2036 NE ARG A 123 5.377 8.971 -1.931 1.00 0.00 N ATOM 2037 CZ ARG A 123 6.076 10.064 -1.580 1.00 0.00 C ATOM 2038 NH1 ARG A 123 5.475 11.149 -1.102 1.00 0.00 N ATOM 2039 NH2 ARG A 123 7.384 10.060 -1.722 1.00 0.00 N ATOM 0 H ARG A 123 1.373 6.674 -4.696 1.00 0.00 H new ATOM 0 HA ARG A 123 2.175 5.173 -2.498 1.00 0.00 H new ATOM 0 HB2 ARG A 123 1.303 8.063 -2.808 1.00 0.00 H new ATOM 0 HB3 ARG A 123 1.699 7.429 -1.223 1.00 0.00 H new ATOM 0 HG2 ARG A 123 3.968 6.706 -2.264 1.00 0.00 H new ATOM 0 HG3 ARG A 123 3.540 7.727 -3.622 1.00 0.00 H new ATOM 0 HD2 ARG A 123 3.424 9.712 -2.167 1.00 0.00 H new ATOM 0 HD3 ARG A 123 3.663 8.728 -0.737 1.00 0.00 H new ATOM 0 HE ARG A 123 5.898 8.187 -2.324 1.00 0.00 H new ATOM 0 HH11 ARG A 123 4.461 11.165 -0.994 1.00 0.00 H new ATOM 0 HH12 ARG A 123 6.028 11.966 -0.843 1.00 0.00 H new ATOM 0 HH21 ARG A 123 7.854 9.235 -2.094 1.00 0.00 H new ATOM 0 HH22 ARG A 123 7.928 10.882 -1.460 1.00 0.00 H new ATOM 2053 N LEU A 124 -1.046 5.984 -2.439 1.00 0.00 N ATOM 2054 CA LEU A 124 -2.339 5.798 -1.733 1.00 0.00 C ATOM 2055 C LEU A 124 -2.652 4.291 -1.532 1.00 0.00 C ATOM 2056 O LEU A 124 -3.086 3.889 -0.451 1.00 0.00 O ATOM 2057 CB LEU A 124 -3.502 6.523 -2.510 1.00 0.00 C ATOM 2058 CG LEU A 124 -4.628 7.205 -1.649 1.00 0.00 C ATOM 2059 CD1 LEU A 124 -5.431 6.207 -0.817 1.00 0.00 C ATOM 2060 CD2 LEU A 124 -4.045 8.302 -0.749 1.00 0.00 C ATOM 0 H LEU A 124 -1.129 6.472 -3.331 1.00 0.00 H new ATOM 0 HA LEU A 124 -2.258 6.252 -0.745 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -3.057 7.286 -3.149 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -3.975 5.793 -3.167 1.00 0.00 H new ATOM 0 HG LEU A 124 -5.321 7.657 -2.359 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -6.192 6.739 -0.246 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -5.912 5.486 -1.478 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -4.763 5.683 -0.133 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -4.845 8.757 -0.165 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -3.307 7.866 -0.076 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -3.568 9.064 -1.366 1.00 0.00 H new ATOM 2072 N GLN A 125 -2.393 3.472 -2.576 1.00 0.00 N ATOM 2073 CA GLN A 125 -2.634 2.009 -2.534 1.00 0.00 C ATOM 2074 C GLN A 125 -1.575 1.294 -1.672 1.00 0.00 C ATOM 2075 O GLN A 125 -1.907 0.325 -0.962 1.00 0.00 O ATOM 2076 CB GLN A 125 -2.660 1.409 -3.955 1.00 0.00 C ATOM 2077 CG GLN A 125 -3.836 1.889 -4.829 1.00 0.00 C ATOM 2078 CD GLN A 125 -3.864 1.242 -6.216 1.00 0.00 C ATOM 2079 OE1 GLN A 125 -3.432 0.103 -6.402 1.00 0.00 O ATOM 2080 NE2 GLN A 125 -4.386 1.950 -7.203 1.00 0.00 N ATOM 0 H GLN A 125 -2.015 3.801 -3.464 1.00 0.00 H new ATOM 0 HA GLN A 125 -3.611 1.852 -2.076 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -1.725 1.657 -4.458 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -2.702 0.323 -3.877 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -4.773 1.672 -4.316 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -3.777 2.972 -4.942 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -4.737 2.891 -7.025 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -4.437 1.555 -8.142 1.00 0.00 H new ATOM 2089 N PHE A 126 -0.309 1.781 -1.740 1.00 0.00 N ATOM 2090 CA PHE A 126 0.777 1.286 -0.870 1.00 0.00 C ATOM 2091 C PHE A 126 0.370 1.419 0.599 1.00 0.00 C ATOM 2092 O PHE A 126 0.344 0.427 1.330 1.00 0.00 O ATOM 2093 CB PHE A 126 2.112 2.043 -1.122 1.00 0.00 C ATOM 2094 CG PHE A 126 3.204 1.722 -0.086 1.00 0.00 C ATOM 2095 CD1 PHE A 126 3.908 0.521 -0.137 1.00 0.00 C ATOM 2096 CD2 PHE A 126 3.504 2.610 0.954 1.00 0.00 C ATOM 2097 CE1 PHE A 126 4.870 0.214 0.809 1.00 0.00 C ATOM 2098 CE2 PHE A 126 4.467 2.303 1.897 1.00 0.00 C ATOM 2099 CZ PHE A 126 5.149 1.104 1.824 1.00 0.00 C ATOM 0 H PHE A 126 -0.021 2.514 -2.388 1.00 0.00 H new ATOM 0 HA PHE A 126 0.942 0.236 -1.111 1.00 0.00 H new ATOM 0 HB2 PHE A 126 2.481 1.792 -2.117 1.00 0.00 H new ATOM 0 HB3 PHE A 126 1.919 3.116 -1.115 1.00 0.00 H new ATOM 0 HD1 PHE A 126 3.699 -0.183 -0.929 1.00 0.00 H new ATOM 0 HD2 PHE A 126 2.975 3.549 1.021 1.00 0.00 H new ATOM 0 HE1 PHE A 126 5.403 -0.724 0.752 1.00 0.00 H new ATOM 0 HE2 PHE A 126 4.686 3.001 2.691 1.00 0.00 H new ATOM 0 HZ PHE A 126 5.900 0.864 2.562 1.00 0.00 H new ATOM 2109 N TYR A 127 0.014 2.664 0.979 1.00 0.00 N ATOM 2110 CA TYR A 127 -0.423 3.013 2.333 1.00 0.00 C ATOM 2111 C TYR A 127 -1.600 2.120 2.739 1.00 0.00 C ATOM 2112 O TYR A 127 -1.516 1.442 3.733 1.00 0.00 O ATOM 2113 CB TYR A 127 -0.809 4.523 2.433 1.00 0.00 C ATOM 2114 CG TYR A 127 0.353 5.508 2.208 1.00 0.00 C ATOM 2115 CD1 TYR A 127 1.632 5.235 2.697 1.00 0.00 C ATOM 2116 CD2 TYR A 127 0.167 6.710 1.518 1.00 0.00 C ATOM 2117 CE1 TYR A 127 2.678 6.116 2.505 1.00 0.00 C ATOM 2118 CE2 TYR A 127 1.213 7.590 1.321 1.00 0.00 C ATOM 2119 CZ TYR A 127 2.464 7.288 1.814 1.00 0.00 C ATOM 2120 OH TYR A 127 3.503 8.171 1.619 1.00 0.00 O ATOM 0 H TYR A 127 0.025 3.460 0.341 1.00 0.00 H new ATOM 0 HA TYR A 127 0.406 2.845 3.021 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -1.590 4.732 1.702 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -1.237 4.709 3.418 1.00 0.00 H new ATOM 0 HD1 TYR A 127 1.807 4.316 3.237 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -0.812 6.954 1.132 1.00 0.00 H new ATOM 0 HE1 TYR A 127 3.659 5.887 2.895 1.00 0.00 H new ATOM 0 HE2 TYR A 127 1.051 8.512 0.782 1.00 0.00 H new ATOM 0 HH TYR A 127 4.348 7.677 1.576 1.00 0.00 H new ATOM 2130 N ALA A 128 -2.622 2.054 1.877 1.00 0.00 N ATOM 2131 CA ALA A 128 -3.885 1.313 2.124 1.00 0.00 C ATOM 2132 C ALA A 128 -3.674 -0.095 2.743 1.00 0.00 C ATOM 2133 O ALA A 128 -4.060 -0.353 3.903 1.00 0.00 O ATOM 2134 CB ALA A 128 -4.630 1.200 0.793 1.00 0.00 C ATOM 0 H ALA A 128 -2.603 2.519 0.969 1.00 0.00 H new ATOM 0 HA ALA A 128 -4.462 1.870 2.862 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -5.564 0.659 0.944 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -4.846 2.198 0.411 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -4.011 0.663 0.074 1.00 0.00 H new ATOM 2140 N PHE A 129 -2.994 -0.966 1.986 1.00 0.00 N ATOM 2141 CA PHE A 129 -2.771 -2.369 2.386 1.00 0.00 C ATOM 2142 C PHE A 129 -1.681 -2.490 3.477 1.00 0.00 C ATOM 2143 O PHE A 129 -1.720 -3.429 4.280 1.00 0.00 O ATOM 2144 CB PHE A 129 -2.401 -3.227 1.153 1.00 0.00 C ATOM 2145 CG PHE A 129 -3.518 -3.343 0.119 1.00 0.00 C ATOM 2146 CD1 PHE A 129 -4.571 -4.237 0.315 1.00 0.00 C ATOM 2147 CD2 PHE A 129 -3.524 -2.562 -1.039 1.00 0.00 C ATOM 2148 CE1 PHE A 129 -5.587 -4.349 -0.614 1.00 0.00 C ATOM 2149 CE2 PHE A 129 -4.540 -2.673 -1.969 1.00 0.00 C ATOM 2150 CZ PHE A 129 -5.575 -3.565 -1.755 1.00 0.00 C ATOM 0 H PHE A 129 -2.584 -0.724 1.084 1.00 0.00 H new ATOM 0 HA PHE A 129 -3.702 -2.742 2.812 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -1.521 -2.797 0.675 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -2.125 -4.227 1.488 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -4.592 -4.849 1.204 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -2.721 -1.860 -1.210 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -6.392 -5.050 -0.450 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -4.526 -2.064 -2.861 1.00 0.00 H new ATOM 0 HZ PHE A 129 -6.373 -3.650 -2.477 1.00 0.00 H new ATOM 2160 N GLU A 130 -0.729 -1.526 3.512 1.00 0.00 N ATOM 2161 CA GLU A 130 0.416 -1.560 4.451 1.00 0.00 C ATOM 2162 C GLU A 130 -0.044 -1.188 5.882 1.00 0.00 C ATOM 2163 O GLU A 130 0.312 -1.858 6.842 1.00 0.00 O ATOM 2164 CB GLU A 130 1.555 -0.615 3.970 1.00 0.00 C ATOM 2165 CG GLU A 130 2.941 -0.911 4.578 1.00 0.00 C ATOM 2166 CD GLU A 130 3.458 -2.327 4.242 1.00 0.00 C ATOM 2167 OE1 GLU A 130 3.707 -2.626 3.049 1.00 0.00 O ATOM 2168 OE2 GLU A 130 3.625 -3.153 5.163 1.00 0.00 O ATOM 0 H GLU A 130 -0.733 -0.712 2.897 1.00 0.00 H new ATOM 0 HA GLU A 130 0.811 -2.576 4.473 1.00 0.00 H new ATOM 0 HB2 GLU A 130 1.628 -0.681 2.884 1.00 0.00 H new ATOM 0 HB3 GLU A 130 1.281 0.412 4.209 1.00 0.00 H new ATOM 0 HG2 GLU A 130 3.656 -0.173 4.214 1.00 0.00 H new ATOM 0 HG3 GLU A 130 2.888 -0.797 5.661 1.00 0.00 H new ATOM 2175 N ILE A 131 -0.865 -0.130 5.993 1.00 0.00 N ATOM 2176 CA ILE A 131 -1.470 0.329 7.267 1.00 0.00 C ATOM 2177 C ILE A 131 -2.362 -0.779 7.844 1.00 0.00 C ATOM 2178 O ILE A 131 -2.351 -1.030 9.047 1.00 0.00 O ATOM 2179 CB ILE A 131 -2.339 1.631 7.058 1.00 0.00 C ATOM 2180 CG1 ILE A 131 -1.492 2.780 6.437 1.00 0.00 C ATOM 2181 CG2 ILE A 131 -3.009 2.101 8.379 1.00 0.00 C ATOM 2182 CD1 ILE A 131 -2.309 3.863 5.756 1.00 0.00 C ATOM 0 H ILE A 131 -1.134 0.442 5.193 1.00 0.00 H new ATOM 0 HA ILE A 131 -0.659 0.561 7.957 1.00 0.00 H new ATOM 0 HB ILE A 131 -3.134 1.372 6.359 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -0.889 3.236 7.222 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -0.800 2.353 5.711 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -3.597 2.999 8.189 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -3.661 1.313 8.756 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -2.240 2.321 9.119 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -1.640 4.623 5.352 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -2.892 3.424 4.946 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -2.982 4.321 6.481 1.00 0.00 H new ATOM 2194 N ALA A 132 -3.120 -1.435 6.945 1.00 0.00 N ATOM 2195 CA ALA A 132 -4.000 -2.563 7.287 1.00 0.00 C ATOM 2196 C ALA A 132 -3.238 -3.681 8.029 1.00 0.00 C ATOM 2197 O ALA A 132 -3.539 -3.999 9.187 1.00 0.00 O ATOM 2198 CB ALA A 132 -4.637 -3.110 6.006 1.00 0.00 C ATOM 0 H ALA A 132 -3.137 -1.193 5.954 1.00 0.00 H new ATOM 0 HA ALA A 132 -4.776 -2.202 7.962 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -5.291 -3.947 6.253 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -5.220 -2.324 5.525 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -3.855 -3.449 5.327 1.00 0.00 H new ATOM 2204 N ARG A 133 -2.224 -4.241 7.346 1.00 0.00 N ATOM 2205 CA ARG A 133 -1.396 -5.345 7.876 1.00 0.00 C ATOM 2206 C ARG A 133 -0.532 -4.900 9.088 1.00 0.00 C ATOM 2207 O ARG A 133 -0.146 -5.741 9.892 1.00 0.00 O ATOM 2208 CB ARG A 133 -0.518 -5.947 6.741 1.00 0.00 C ATOM 2209 CG ARG A 133 0.460 -4.948 6.103 1.00 0.00 C ATOM 2210 CD ARG A 133 1.254 -5.522 4.918 1.00 0.00 C ATOM 2211 NE ARG A 133 0.396 -5.891 3.772 1.00 0.00 N ATOM 2212 CZ ARG A 133 0.689 -5.650 2.480 1.00 0.00 C ATOM 2213 NH1 ARG A 133 1.726 -4.879 2.147 1.00 0.00 N ATOM 2214 NH2 ARG A 133 -0.094 -6.143 1.529 1.00 0.00 N ATOM 0 H ARG A 133 -1.953 -3.942 6.409 1.00 0.00 H new ATOM 0 HA ARG A 133 -2.068 -6.120 8.245 1.00 0.00 H new ATOM 0 HB2 ARG A 133 0.049 -6.787 7.142 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -1.171 -6.345 5.964 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -0.098 -4.075 5.765 1.00 0.00 H new ATOM 0 HG3 ARG A 133 1.160 -4.604 6.864 1.00 0.00 H new ATOM 0 HD2 ARG A 133 1.991 -4.788 4.592 1.00 0.00 H new ATOM 0 HD3 ARG A 133 1.806 -6.402 5.250 1.00 0.00 H new ATOM 0 HE ARG A 133 -0.485 -6.364 3.975 1.00 0.00 H new ATOM 0 HH11 ARG A 133 2.308 -4.464 2.875 1.00 0.00 H new ATOM 0 HH12 ARG A 133 1.937 -4.704 1.164 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -0.911 -6.700 1.779 1.00 0.00 H new ATOM 0 HH22 ARG A 133 0.121 -5.965 0.548 1.00 0.00 H new ATOM 2228 N ASN A 134 -0.233 -3.583 9.210 1.00 0.00 N ATOM 2229 CA ASN A 134 0.465 -3.018 10.403 1.00 0.00 C ATOM 2230 C ASN A 134 -0.450 -3.067 11.643 1.00 0.00 C ATOM 2231 O ASN A 134 -0.054 -3.571 12.701 1.00 0.00 O ATOM 2232 CB ASN A 134 0.935 -1.542 10.155 1.00 0.00 C ATOM 2233 CG ASN A 134 2.227 -1.409 9.335 1.00 0.00 C ATOM 2234 OD1 ASN A 134 2.556 -2.256 8.514 1.00 0.00 O ATOM 2235 ND2 ASN A 134 2.962 -0.315 9.546 1.00 0.00 N ATOM 0 H ASN A 134 -0.462 -2.888 8.499 1.00 0.00 H new ATOM 0 HA ASN A 134 1.347 -3.633 10.580 1.00 0.00 H new ATOM 0 HB2 ASN A 134 0.138 -1.003 9.642 1.00 0.00 H new ATOM 0 HB3 ASN A 134 1.081 -1.055 11.119 1.00 0.00 H new ATOM 0 HD21 ASN A 134 3.822 -0.168 9.017 1.00 0.00 H new ATOM 0 HD22 ASN A 134 2.664 0.374 10.236 1.00 0.00 H new ATOM 2242 N LYS A 135 -1.685 -2.549 11.481 1.00 0.00 N ATOM 2243 CA LYS A 135 -2.682 -2.439 12.571 1.00 0.00 C ATOM 2244 C LYS A 135 -3.187 -3.822 13.031 1.00 0.00 C ATOM 2245 O LYS A 135 -3.564 -3.999 14.194 1.00 0.00 O ATOM 2246 CB LYS A 135 -3.885 -1.568 12.115 1.00 0.00 C ATOM 2247 CG LYS A 135 -3.569 -0.077 11.867 1.00 0.00 C ATOM 2248 CD LYS A 135 -4.815 0.721 11.400 1.00 0.00 C ATOM 2249 CE LYS A 135 -5.972 0.699 12.419 1.00 0.00 C ATOM 2250 NZ LYS A 135 -5.584 1.269 13.735 1.00 0.00 N ATOM 0 H LYS A 135 -2.022 -2.193 10.587 1.00 0.00 H new ATOM 0 HA LYS A 135 -2.186 -1.964 13.417 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -4.292 -1.993 11.197 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -4.667 -1.635 12.871 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -3.179 0.366 12.783 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -2.785 0.005 11.114 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -4.526 1.755 11.212 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -5.166 0.311 10.453 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -6.815 1.261 12.018 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -6.310 -0.328 12.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -6.401 1.246 14.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -4.808 0.708 14.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -5.270 2.253 13.608 1.00 0.00 H new ATOM 2264 N HIS A 136 -3.222 -4.789 12.103 1.00 0.00 N ATOM 2265 CA HIS A 136 -3.617 -6.185 12.402 1.00 0.00 C ATOM 2266 C HIS A 136 -2.386 -7.047 12.761 1.00 0.00 C ATOM 2267 O HIS A 136 -2.542 -8.162 13.276 1.00 0.00 O ATOM 2268 CB HIS A 136 -4.391 -6.794 11.202 1.00 0.00 C ATOM 2269 CG HIS A 136 -5.775 -6.227 11.016 1.00 0.00 C ATOM 2270 ND1 HIS A 136 -6.854 -6.641 11.767 1.00 0.00 N ATOM 2271 CD2 HIS A 136 -6.253 -5.283 10.172 1.00 0.00 C ATOM 2272 CE1 HIS A 136 -7.930 -5.978 11.398 1.00 0.00 C ATOM 2273 NE2 HIS A 136 -7.593 -5.148 10.430 1.00 0.00 N ATOM 0 H HIS A 136 -2.979 -4.633 11.125 1.00 0.00 H new ATOM 0 HA HIS A 136 -4.277 -6.176 13.270 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -3.816 -6.629 10.291 1.00 0.00 H new ATOM 0 HB3 HIS A 136 -4.467 -7.872 11.341 1.00 0.00 H new ATOM 0 HD1 HIS A 136 -6.824 -7.352 12.497 1.00 0.00 H new ATOM 0 HD2 HIS A 136 -5.685 -4.738 9.433 1.00 0.00 H new ATOM 0 HE1 HIS A 136 -8.919 -6.094 11.816 1.00 0.00 H new ATOM 2282 N GLY A 137 -1.171 -6.523 12.486 1.00 0.00 N ATOM 2283 CA GLY A 137 0.089 -7.221 12.806 1.00 0.00 C ATOM 2284 C GLY A 137 0.369 -8.431 11.914 1.00 0.00 C ATOM 2285 O GLY A 137 1.108 -9.339 12.301 1.00 0.00 O ATOM 0 H GLY A 137 -1.039 -5.615 12.041 1.00 0.00 H new ATOM 0 HA2 GLY A 137 0.916 -6.517 12.717 1.00 0.00 H new ATOM 0 HA3 GLY A 137 0.059 -7.547 13.846 1.00 0.00 H new ATOM 2289 N LEU A 138 -0.211 -8.426 10.705 1.00 0.00 N ATOM 2290 CA LEU A 138 -0.064 -9.521 9.719 1.00 0.00 C ATOM 2291 C LEU A 138 1.328 -9.500 9.045 1.00 0.00 C ATOM 2292 O LEU A 138 1.765 -10.514 8.489 1.00 0.00 O ATOM 2293 CB LEU A 138 -1.243 -9.464 8.684 1.00 0.00 C ATOM 2294 CG LEU A 138 -2.530 -10.303 9.043 1.00 0.00 C ATOM 2295 CD1 LEU A 138 -2.944 -10.162 10.523 1.00 0.00 C ATOM 2296 CD2 LEU A 138 -3.707 -9.940 8.115 1.00 0.00 C ATOM 0 H LEU A 138 -0.800 -7.661 10.376 1.00 0.00 H new ATOM 0 HA LEU A 138 -0.124 -10.477 10.239 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -1.538 -8.422 8.558 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -0.869 -9.808 7.720 1.00 0.00 H new ATOM 0 HG LEU A 138 -2.267 -11.349 8.885 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.835 -10.761 10.710 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -2.132 -10.509 11.162 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -3.157 -9.116 10.743 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -4.580 -10.534 8.386 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -3.941 -8.881 8.222 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -3.433 -10.149 7.081 1.00 0.00 H new ATOM 2308 N ASN A 139 2.031 -8.349 9.108 1.00 0.00 N ATOM 2309 CA ASN A 139 3.423 -8.212 8.607 1.00 0.00 C ATOM 2310 C ASN A 139 4.407 -8.015 9.775 1.00 0.00 C ATOM 2311 O ASN A 139 5.575 -7.681 9.560 1.00 0.00 O ATOM 2312 CB ASN A 139 3.533 -7.027 7.612 1.00 0.00 C ATOM 2313 CG ASN A 139 3.359 -5.639 8.250 1.00 0.00 C ATOM 2314 OD1 ASN A 139 2.674 -5.483 9.260 1.00 0.00 O ATOM 2315 ND2 ASN A 139 3.972 -4.632 7.653 1.00 0.00 N ATOM 0 H ASN A 139 1.654 -7.489 9.506 1.00 0.00 H new ATOM 0 HA ASN A 139 3.684 -9.132 8.084 1.00 0.00 H new ATOM 0 HB2 ASN A 139 4.507 -7.069 7.124 1.00 0.00 H new ATOM 0 HB3 ASN A 139 2.780 -7.152 6.834 1.00 0.00 H new ATOM 0 HD21 ASN A 139 3.885 -3.688 8.028 1.00 0.00 H new ATOM 0 HD22 ASN A 139 4.532 -4.799 6.817 1.00 0.00 H new ATOM 2322 N ASP A 140 3.929 -8.241 11.013 1.00 0.00 N ATOM 2323 CA ASP A 140 4.724 -7.997 12.237 1.00 0.00 C ATOM 2324 C ASP A 140 5.937 -8.950 12.328 1.00 0.00 C ATOM 2325 O ASP A 140 6.896 -8.659 13.035 1.00 0.00 O ATOM 2326 CB ASP A 140 3.833 -8.134 13.498 1.00 0.00 C ATOM 2327 CG ASP A 140 4.540 -7.743 14.816 1.00 0.00 C ATOM 2328 OD1 ASP A 140 4.627 -6.533 15.117 1.00 0.00 O ATOM 2329 OD2 ASP A 140 5.009 -8.643 15.550 1.00 0.00 O ATOM 0 H ASP A 140 2.990 -8.595 11.195 1.00 0.00 H new ATOM 0 HA ASP A 140 5.107 -6.978 12.184 1.00 0.00 H new ATOM 0 HB2 ASP A 140 2.948 -7.510 13.374 1.00 0.00 H new ATOM 0 HB3 ASP A 140 3.488 -9.165 13.575 1.00 0.00 H new ATOM 2334 N TRP A 141 5.900 -10.075 11.584 1.00 0.00 N ATOM 2335 CA TRP A 141 7.017 -11.052 11.532 1.00 0.00 C ATOM 2336 C TRP A 141 8.342 -10.391 11.069 1.00 0.00 C ATOM 2337 O TRP A 141 9.438 -10.856 11.418 1.00 0.00 O ATOM 2338 CB TRP A 141 6.646 -12.258 10.622 1.00 0.00 C ATOM 2339 CG TRP A 141 6.375 -11.891 9.176 1.00 0.00 C ATOM 2340 CD1 TRP A 141 5.189 -11.456 8.653 1.00 0.00 C ATOM 2341 CD2 TRP A 141 7.303 -11.930 8.085 1.00 0.00 C ATOM 2342 NE1 TRP A 141 5.334 -11.203 7.321 1.00 0.00 N ATOM 2343 CE2 TRP A 141 6.619 -11.489 6.945 1.00 0.00 C ATOM 2344 CE3 TRP A 141 8.653 -12.284 7.961 1.00 0.00 C ATOM 2345 CZ2 TRP A 141 7.229 -11.397 5.697 1.00 0.00 C ATOM 2346 CZ3 TRP A 141 9.255 -12.198 6.720 1.00 0.00 C ATOM 2347 CH2 TRP A 141 8.543 -11.743 5.603 1.00 0.00 C ATOM 0 H TRP A 141 5.102 -10.334 11.004 1.00 0.00 H new ATOM 0 HA TRP A 141 7.180 -11.421 12.545 1.00 0.00 H new ATOM 0 HB2 TRP A 141 7.458 -12.985 10.654 1.00 0.00 H new ATOM 0 HB3 TRP A 141 5.763 -12.748 11.031 1.00 0.00 H new ATOM 0 HD1 TRP A 141 4.273 -11.331 9.212 1.00 0.00 H new ATOM 0 HE1 TRP A 141 4.601 -10.856 6.703 1.00 0.00 H new ATOM 0 HE3 TRP A 141 9.214 -12.619 8.821 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 6.678 -11.062 4.831 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 10.290 -12.486 6.610 1.00 0.00 H new ATOM 0 HH2 TRP A 141 9.045 -11.665 4.650 1.00 0.00 H new ATOM 2358 N ILE A 142 8.213 -9.291 10.309 1.00 0.00 N ATOM 2359 CA ILE A 142 9.354 -8.517 9.787 1.00 0.00 C ATOM 2360 C ILE A 142 10.093 -7.774 10.927 1.00 0.00 C ATOM 2361 O ILE A 142 11.307 -7.581 10.852 1.00 0.00 O ATOM 2362 CB ILE A 142 8.874 -7.508 8.676 1.00 0.00 C ATOM 2363 CG1 ILE A 142 8.075 -8.270 7.569 1.00 0.00 C ATOM 2364 CG2 ILE A 142 10.053 -6.707 8.052 1.00 0.00 C ATOM 2365 CD1 ILE A 142 7.269 -7.389 6.632 1.00 0.00 C ATOM 0 H ILE A 142 7.307 -8.910 10.037 1.00 0.00 H new ATOM 0 HA ILE A 142 10.059 -9.215 9.335 1.00 0.00 H new ATOM 0 HB ILE A 142 8.219 -6.780 9.156 1.00 0.00 H new ATOM 0 HG12 ILE A 142 8.776 -8.857 6.976 1.00 0.00 H new ATOM 0 HG13 ILE A 142 7.398 -8.974 8.052 1.00 0.00 H new ATOM 0 HG21 ILE A 142 9.669 -6.026 7.292 1.00 0.00 H new ATOM 0 HG22 ILE A 142 10.557 -6.135 8.831 1.00 0.00 H new ATOM 0 HG23 ILE A 142 10.761 -7.398 7.595 1.00 0.00 H new ATOM 0 HD11 ILE A 142 6.752 -8.012 5.902 1.00 0.00 H new ATOM 0 HD12 ILE A 142 6.538 -6.820 7.206 1.00 0.00 H new ATOM 0 HD13 ILE A 142 7.938 -6.701 6.114 1.00 0.00 H new ATOM 2377 N VAL A 143 9.370 -7.405 12.009 1.00 0.00 N ATOM 2378 CA VAL A 143 9.992 -6.712 13.165 1.00 0.00 C ATOM 2379 C VAL A 143 10.925 -7.669 13.943 1.00 0.00 C ATOM 2380 O VAL A 143 11.834 -7.221 14.660 1.00 0.00 O ATOM 2381 CB VAL A 143 8.934 -6.029 14.136 1.00 0.00 C ATOM 2382 CG1 VAL A 143 7.821 -5.310 13.329 1.00 0.00 C ATOM 2383 CG2 VAL A 143 8.345 -7.014 15.184 1.00 0.00 C ATOM 0 H VAL A 143 8.369 -7.572 12.108 1.00 0.00 H new ATOM 0 HA VAL A 143 10.588 -5.899 12.750 1.00 0.00 H new ATOM 0 HB VAL A 143 9.475 -5.276 14.709 1.00 0.00 H new ATOM 0 HG11 VAL A 143 7.111 -4.852 14.017 1.00 0.00 H new ATOM 0 HG12 VAL A 143 8.267 -4.539 12.701 1.00 0.00 H new ATOM 0 HG13 VAL A 143 7.302 -6.034 12.701 1.00 0.00 H new ATOM 0 HG21 VAL A 143 7.630 -6.488 15.816 1.00 0.00 H new ATOM 0 HG22 VAL A 143 7.841 -7.833 14.671 1.00 0.00 H new ATOM 0 HG23 VAL A 143 9.150 -7.413 15.801 1.00 0.00 H new ATOM 2393 N GLY A 144 10.702 -8.993 13.771 1.00 0.00 N ATOM 2394 CA GLY A 144 11.494 -10.031 14.441 1.00 0.00 C ATOM 2395 C GLY A 144 12.350 -10.847 13.482 1.00 0.00 C ATOM 2396 O GLY A 144 12.531 -12.059 13.679 1.00 0.00 O ATOM 0 H GLY A 144 9.969 -9.362 13.165 1.00 0.00 H new ATOM 0 HA2 GLY A 144 12.139 -9.563 15.185 1.00 0.00 H new ATOM 0 HA3 GLY A 144 10.822 -10.701 14.978 1.00 0.00 H new ATOM 2400 N GLN A 145 12.879 -10.194 12.431 1.00 0.00 N ATOM 2401 CA GLN A 145 13.787 -10.850 11.465 1.00 0.00 C ATOM 2402 C GLN A 145 15.171 -11.131 12.092 1.00 0.00 C ATOM 2403 O GLN A 145 15.531 -10.556 13.129 1.00 0.00 O ATOM 2404 CB GLN A 145 13.926 -10.015 10.160 1.00 0.00 C ATOM 2405 CG GLN A 145 12.691 -10.042 9.239 1.00 0.00 C ATOM 2406 CD GLN A 145 12.300 -11.455 8.797 1.00 0.00 C ATOM 2407 OE1 GLN A 145 12.771 -11.952 7.774 1.00 0.00 O ATOM 2408 NE2 GLN A 145 11.441 -12.112 9.564 1.00 0.00 N ATOM 0 H GLN A 145 12.695 -9.212 12.227 1.00 0.00 H new ATOM 0 HA GLN A 145 13.341 -11.809 11.201 1.00 0.00 H new ATOM 0 HB2 GLN A 145 14.138 -8.980 10.429 1.00 0.00 H new ATOM 0 HB3 GLN A 145 14.787 -10.382 9.601 1.00 0.00 H new ATOM 0 HG2 GLN A 145 11.849 -9.584 9.758 1.00 0.00 H new ATOM 0 HG3 GLN A 145 12.890 -9.434 8.356 1.00 0.00 H new ATOM 0 HE21 GLN A 145 11.069 -11.672 10.406 1.00 0.00 H new ATOM 0 HE22 GLN A 145 11.152 -13.057 9.312 1.00 0.00 H new ATOM 2417 N LYS A 146 15.927 -12.021 11.433 1.00 0.00 N ATOM 2418 CA LYS A 146 17.239 -12.504 11.906 1.00 0.00 C ATOM 2419 C LYS A 146 18.288 -11.361 11.846 1.00 0.00 C ATOM 2420 O LYS A 146 18.730 -11.018 10.732 1.00 0.00 O ATOM 2421 CB LYS A 146 17.684 -13.719 11.041 1.00 0.00 C ATOM 2422 CG LYS A 146 16.649 -14.865 10.983 1.00 0.00 C ATOM 2423 CD LYS A 146 16.997 -15.941 9.929 1.00 0.00 C ATOM 2424 CE LYS A 146 15.927 -17.045 9.835 1.00 0.00 C ATOM 2425 NZ LYS A 146 16.204 -17.992 8.724 1.00 0.00 N ATOM 2426 OXT LYS A 146 18.641 -10.798 12.905 1.00 0.00 O ATOM 0 H LYS A 146 15.643 -12.433 10.544 1.00 0.00 H new ATOM 0 HA LYS A 146 17.157 -12.825 12.944 1.00 0.00 H new ATOM 0 HB2 LYS A 146 17.886 -13.375 10.027 1.00 0.00 H new ATOM 0 HB3 LYS A 146 18.621 -14.110 11.438 1.00 0.00 H new ATOM 0 HG2 LYS A 146 16.580 -15.335 11.964 1.00 0.00 H new ATOM 0 HG3 LYS A 146 15.667 -14.449 10.759 1.00 0.00 H new ATOM 0 HD2 LYS A 146 17.111 -15.466 8.954 1.00 0.00 H new ATOM 0 HD3 LYS A 146 17.958 -16.391 10.178 1.00 0.00 H new ATOM 0 HE2 LYS A 146 15.886 -17.592 10.777 1.00 0.00 H new ATOM 0 HE3 LYS A 146 14.948 -16.590 9.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 15.461 -18.719 8.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 16.218 -17.474 7.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 17.127 -18.446 8.877 1.00 0.00 H new