USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 877 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 114 MET CE :methyl -177:sc= -0.18 (180deg=0) USER MOD Set 1.2: A 115 GLN :FLIP amide:sc= -0.39 F(o=-1.7,f=-0.57) USER MOD Set 2.1: A 59 ASN : amide:sc= 0.885 K(o=3.2,f=-7.2!) USER MOD Set 2.2: A 75 LYS NZ :NH3+ 151:sc= 2.31 (180deg=0.598) USER MOD Set 3.1: A 16 HIS : no HD1:sc= -0.347 X(o=0.15,f=0.41) USER MOD Set 3.2: A 54 THR OG1 : rot 0:sc= 0.498 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 ASN :FLIP amide:sc= 0 F(o=-0.68,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 171:sc= 1.15 (180deg=1.09) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 80:sc= 1.29 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 110:sc= 1.25 USER MOD Single : A 51 ASN : amide:sc= 0.444 X(o=0.44,f=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 88:sc= 1.34 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=-0.0097) USER MOD Single : A 76 SER OG : rot 89:sc= 1.22 USER MOD Single : A 81 ASN : amide:sc= -0.133 K(o=-0.13,f=-0.78) USER MOD Single : A 82 CYS SG : rot 90:sc= 1.01 USER MOD Single : A 85 THR OG1 : rot 92:sc= 1.22 USER MOD Single : A 87 LYS NZ :NH3+ -169:sc= -0.03 (180deg=-0.195) USER MOD Single : A 89 ASN : amide:sc= -0.48! C(o=-0.48!,f=-2.3!) USER MOD Single : A 90 GLN : amide:sc= 1.68 K(o=1.7,f=-0.34) USER MOD Single : A 91 GLN : amide:sc= 0.045 X(o=0.045,f=0) USER MOD Single : A 94 ASN : amide:sc= -0.159 K(o=-0.16,f=-1.4) USER MOD Single : A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 40:sc= 0.375 USER MOD Single : A 113 GLN : amide:sc= -4.09! C(o=-4.1!,f=-3.8!) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 1.17 K(o=1.2,f=-0.22) USER MOD Single : A 125 GLN : amide:sc= -0.833 X(o=-0.83,f=-0.49) USER MOD Single : A 129 THR OG1 : rot -130:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 169:sc= -0.0189 (180deg=-0.198) USER MOD Single : A 134 LYS NZ :NH3+ -168:sc= 1.41 (180deg=1.21) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.210 9.650 2.541 1.00 0.00 N ATOM 2 CA PRO A 1 3.897 9.173 1.356 1.00 0.00 C ATOM 3 C PRO A 1 5.397 9.343 1.536 1.00 0.00 C ATOM 4 O PRO A 1 5.853 9.792 2.590 1.00 0.00 O ATOM 5 CB PRO A 1 3.417 9.975 0.170 1.00 0.00 C ATOM 6 CG PRO A 1 2.093 10.492 0.619 1.00 0.00 C ATOM 7 CD PRO A 1 2.146 10.576 2.140 1.00 0.00 C ATOM 0 H2 PRO A 1 3.868 10.119 3.164 1.00 0.00 H new ATOM 0 H3 PRO A 1 2.816 8.865 3.059 1.00 0.00 H new ATOM 0 HA PRO A 1 3.685 8.116 1.193 1.00 0.00 H new ATOM 0 HB2 PRO A 1 4.104 10.786 -0.072 1.00 0.00 H new ATOM 0 HB3 PRO A 1 3.326 9.357 -0.723 1.00 0.00 H new ATOM 0 HG2 PRO A 1 1.893 11.471 0.184 1.00 0.00 H new ATOM 0 HG3 PRO A 1 1.290 9.830 0.296 1.00 0.00 H new ATOM 0 HD2 PRO A 1 2.363 11.592 2.471 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.191 10.294 2.583 1.00 0.00 H new ATOM 17 N VAL A 2 6.135 8.955 0.534 1.00 0.00 N ATOM 18 CA VAL A 2 7.579 9.066 0.491 1.00 0.00 C ATOM 19 C VAL A 2 7.988 9.848 -0.753 1.00 0.00 C ATOM 20 O VAL A 2 7.451 9.629 -1.823 1.00 0.00 O ATOM 21 CB VAL A 2 8.245 7.654 0.455 1.00 0.00 C ATOM 22 CG1 VAL A 2 9.747 7.745 0.294 1.00 0.00 C ATOM 23 CG2 VAL A 2 7.915 6.870 1.709 1.00 0.00 C ATOM 0 H VAL A 2 5.740 8.537 -0.309 1.00 0.00 H new ATOM 0 HA VAL A 2 7.914 9.585 1.389 1.00 0.00 H new ATOM 0 HB VAL A 2 7.839 7.133 -0.412 1.00 0.00 H new ATOM 0 HG11 VAL A 2 10.172 6.742 0.274 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.983 8.258 -0.638 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.170 8.301 1.131 1.00 0.00 H new ATOM 0 HG21 VAL A 2 8.390 5.890 1.661 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.283 7.409 2.582 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.835 6.746 1.787 1.00 0.00 H new ATOM 33 N THR A 3 8.898 10.755 -0.591 1.00 0.00 N ATOM 34 CA THR A 3 9.416 11.513 -1.691 1.00 0.00 C ATOM 35 C THR A 3 10.936 11.336 -1.692 1.00 0.00 C ATOM 36 O THR A 3 11.503 10.793 -0.717 1.00 0.00 O ATOM 37 CB THR A 3 8.978 13.006 -1.601 1.00 0.00 C ATOM 38 OG1 THR A 3 9.410 13.747 -2.750 1.00 0.00 O ATOM 39 CG2 THR A 3 9.492 13.663 -0.341 1.00 0.00 C ATOM 0 H THR A 3 9.307 10.994 0.312 1.00 0.00 H new ATOM 0 HA THR A 3 9.013 11.153 -2.638 1.00 0.00 H new ATOM 0 HB THR A 3 7.888 13.014 -1.571 1.00 0.00 H new ATOM 0 HG1 THR A 3 9.119 14.679 -2.666 1.00 0.00 H new ATOM 0 HG21 THR A 3 9.166 14.703 -0.314 1.00 0.00 H new ATOM 0 HG22 THR A 3 9.100 13.137 0.530 1.00 0.00 H new ATOM 0 HG23 THR A 3 10.581 13.624 -0.328 1.00 0.00 H new ATOM 228 N HIS A 16 10.731 10.733 4.149 1.00 0.00 N ATOM 229 CA HIS A 16 9.460 10.151 4.426 1.00 0.00 C ATOM 230 C HIS A 16 8.567 11.262 4.902 1.00 0.00 C ATOM 231 O HIS A 16 8.914 11.989 5.816 1.00 0.00 O ATOM 232 CB HIS A 16 9.584 9.035 5.494 1.00 0.00 C ATOM 233 CG HIS A 16 8.289 8.335 5.855 1.00 0.00 C ATOM 234 ND1 HIS A 16 7.995 7.939 7.127 1.00 0.00 N ATOM 235 CD2 HIS A 16 7.237 7.929 5.094 1.00 0.00 C ATOM 236 CE1 HIS A 16 6.836 7.324 7.149 1.00 0.00 C ATOM 237 NE2 HIS A 16 6.350 7.306 5.927 1.00 0.00 N ATOM 0 HA HIS A 16 9.045 9.681 3.534 1.00 0.00 H new ATOM 0 HB2 HIS A 16 10.293 8.289 5.135 1.00 0.00 H new ATOM 0 HB3 HIS A 16 10.008 9.468 6.400 1.00 0.00 H new ATOM 0 HD2 HIS A 16 7.124 8.072 4.030 1.00 0.00 H new ATOM 0 HE1 HIS A 16 6.361 6.904 8.023 1.00 0.00 H new ATOM 0 HE2 HIS A 16 5.459 6.895 5.647 1.00 0.00 H new ATOM 246 N ASN A 17 7.454 11.405 4.262 1.00 0.00 N ATOM 247 CA ASN A 17 6.515 12.434 4.620 1.00 0.00 C ATOM 248 C ASN A 17 5.610 11.885 5.680 1.00 0.00 C ATOM 249 O ASN A 17 5.784 10.733 6.113 1.00 0.00 O ATOM 250 CB ASN A 17 5.693 12.854 3.375 1.00 0.00 C ATOM 251 CG ASN A 17 6.517 13.499 2.259 1.00 0.00 C ATOM 252 OD1 ASN A 17 7.570 14.207 2.613 1.00 0.00 O flip ATOM 253 ND2 ASN A 17 6.189 13.360 1.078 1.00 0.00 N flip ATOM 0 H ASN A 17 7.164 10.819 3.479 1.00 0.00 H new ATOM 0 HA ASN A 17 7.038 13.314 4.994 1.00 0.00 H new ATOM 0 HB2 ASN A 17 5.188 11.975 2.975 1.00 0.00 H new ATOM 0 HB3 ASN A 17 4.917 13.553 3.687 1.00 0.00 H new ATOM 0 HD21 ASN A 17 5.367 12.805 0.839 1.00 0.00 H new ATOM 0 HD22 ASN A 17 6.739 13.800 0.341 1.00 0.00 H new ATOM 260 N GLY A 18 4.666 12.654 6.105 1.00 0.00 N ATOM 261 CA GLY A 18 3.745 12.176 7.081 1.00 0.00 C ATOM 262 C GLY A 18 2.571 11.515 6.409 1.00 0.00 C ATOM 263 O GLY A 18 2.706 10.953 5.305 1.00 0.00 O ATOM 0 H GLY A 18 4.511 13.613 5.794 1.00 0.00 H new ATOM 0 HA2 GLY A 18 4.241 11.466 7.743 1.00 0.00 H new ATOM 0 HA3 GLY A 18 3.400 13.003 7.702 1.00 0.00 H new ATOM 267 N PHE A 19 1.456 11.538 7.047 1.00 0.00 N ATOM 268 CA PHE A 19 0.255 11.013 6.477 1.00 0.00 C ATOM 269 C PHE A 19 -0.540 12.190 6.012 1.00 0.00 C ATOM 270 O PHE A 19 -0.966 13.007 6.835 1.00 0.00 O ATOM 271 CB PHE A 19 -0.557 10.220 7.516 1.00 0.00 C ATOM 272 CG PHE A 19 0.204 9.092 8.165 1.00 0.00 C ATOM 273 CD1 PHE A 19 0.484 7.933 7.459 1.00 0.00 C ATOM 274 CD2 PHE A 19 0.640 9.194 9.478 1.00 0.00 C ATOM 275 CE1 PHE A 19 1.184 6.903 8.050 1.00 0.00 C ATOM 276 CE2 PHE A 19 1.341 8.162 10.074 1.00 0.00 C ATOM 277 CZ PHE A 19 1.610 7.015 9.356 1.00 0.00 C ATOM 0 H PHE A 19 1.344 11.923 7.985 1.00 0.00 H new ATOM 0 HA PHE A 19 0.490 10.329 5.661 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -0.901 10.905 8.291 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.445 9.813 7.033 1.00 0.00 H new ATOM 0 HD1 PHE A 19 0.151 7.836 6.436 1.00 0.00 H new ATOM 0 HD2 PHE A 19 0.429 10.091 10.042 1.00 0.00 H new ATOM 0 HE1 PHE A 19 1.399 6.006 7.488 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.676 8.253 11.097 1.00 0.00 H new ATOM 0 HZ PHE A 19 2.155 6.205 9.818 1.00 0.00 H new ATOM 287 N ASP A 20 -0.694 12.342 4.728 1.00 0.00 N ATOM 288 CA ASP A 20 -1.423 13.462 4.194 1.00 0.00 C ATOM 289 C ASP A 20 -2.869 13.189 4.314 1.00 0.00 C ATOM 290 O ASP A 20 -3.381 12.226 3.707 1.00 0.00 O ATOM 291 CB ASP A 20 -1.063 13.720 2.727 1.00 0.00 C ATOM 292 CG ASP A 20 0.325 14.260 2.550 1.00 0.00 C ATOM 293 OD1 ASP A 20 1.289 13.497 2.662 1.00 0.00 O ATOM 294 OD2 ASP A 20 0.462 15.468 2.282 1.00 0.00 O ATOM 0 H ASP A 20 -0.323 11.702 4.026 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.156 14.354 4.761 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.159 12.790 2.166 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.778 14.424 2.302 1.00 0.00 H new ATOM 299 N PHE A 21 -3.543 14.008 5.081 1.00 0.00 N ATOM 300 CA PHE A 21 -4.929 13.810 5.305 1.00 0.00 C ATOM 301 C PHE A 21 -5.701 14.056 4.032 1.00 0.00 C ATOM 302 O PHE A 21 -6.700 13.432 3.811 1.00 0.00 O ATOM 303 CB PHE A 21 -5.483 14.649 6.460 1.00 0.00 C ATOM 304 CG PHE A 21 -6.869 14.208 6.803 1.00 0.00 C ATOM 305 CD1 PHE A 21 -7.070 12.944 7.327 1.00 0.00 C ATOM 306 CD2 PHE A 21 -7.971 15.009 6.543 1.00 0.00 C ATOM 307 CE1 PHE A 21 -8.334 12.482 7.598 1.00 0.00 C ATOM 308 CE2 PHE A 21 -9.248 14.550 6.806 1.00 0.00 C ATOM 309 CZ PHE A 21 -9.430 13.284 7.336 1.00 0.00 C ATOM 0 H PHE A 21 -3.142 14.816 5.556 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.056 12.771 5.607 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.837 14.551 7.332 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.488 15.703 6.183 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -6.219 12.310 7.526 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.830 15.998 6.132 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.472 11.495 8.015 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -10.102 15.178 6.598 1.00 0.00 H new ATOM 0 HZ PHE A 21 -10.426 12.923 7.545 1.00 0.00 H new ATOM 319 N ALA A 22 -5.194 14.958 3.193 1.00 0.00 N ATOM 320 CA ALA A 22 -5.756 15.238 1.870 1.00 0.00 C ATOM 321 C ALA A 22 -6.090 13.939 1.102 1.00 0.00 C ATOM 322 O ALA A 22 -7.179 13.803 0.543 1.00 0.00 O ATOM 323 CB ALA A 22 -4.783 16.084 1.060 1.00 0.00 C ATOM 0 H ALA A 22 -4.373 15.522 3.414 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.686 15.787 2.015 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.209 16.288 0.077 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -4.600 17.025 1.579 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -3.842 15.546 0.943 1.00 0.00 H new ATOM 329 N VAL A 23 -5.168 12.979 1.126 1.00 0.00 N ATOM 330 CA VAL A 23 -5.359 11.693 0.456 1.00 0.00 C ATOM 331 C VAL A 23 -6.476 10.892 1.150 1.00 0.00 C ATOM 332 O VAL A 23 -7.444 10.472 0.496 1.00 0.00 O ATOM 333 CB VAL A 23 -4.045 10.860 0.450 1.00 0.00 C ATOM 334 CG1 VAL A 23 -4.224 9.544 -0.290 1.00 0.00 C ATOM 335 CG2 VAL A 23 -2.901 11.663 -0.160 1.00 0.00 C ATOM 0 H VAL A 23 -4.273 13.069 1.607 1.00 0.00 H new ATOM 0 HA VAL A 23 -5.644 11.894 -0.577 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.796 10.630 1.486 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.287 8.988 -0.275 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -5.003 8.956 0.196 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.511 9.743 -1.323 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -1.991 11.062 -0.155 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.152 11.932 -1.186 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -2.741 12.569 0.424 1.00 0.00 H new ATOM 345 N ILE A 24 -6.312 10.701 2.463 1.00 0.00 N ATOM 346 CA ILE A 24 -7.287 9.955 3.294 1.00 0.00 C ATOM 347 C ILE A 24 -8.709 10.512 3.066 1.00 0.00 C ATOM 348 O ILE A 24 -9.661 9.776 2.850 1.00 0.00 O ATOM 349 CB ILE A 24 -6.942 10.057 4.816 1.00 0.00 C ATOM 350 CG1 ILE A 24 -5.506 9.574 5.086 1.00 0.00 C ATOM 351 CG2 ILE A 24 -7.947 9.261 5.659 1.00 0.00 C ATOM 352 CD1 ILE A 24 -5.100 9.591 6.549 1.00 0.00 C ATOM 0 H ILE A 24 -5.509 11.053 2.985 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.239 8.908 2.995 1.00 0.00 H new ATOM 0 HB ILE A 24 -7.009 11.106 5.106 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -5.400 8.558 4.705 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.814 10.200 4.523 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.686 9.347 6.714 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.950 9.657 5.500 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -7.920 8.212 5.363 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.074 9.235 6.646 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.169 10.608 6.934 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.765 8.941 7.119 1.00 0.00 H new ATOM 364 N LYS A 25 -8.780 11.814 3.073 1.00 0.00 N ATOM 365 CA LYS A 25 -9.977 12.611 2.888 1.00 0.00 C ATOM 366 C LYS A 25 -10.662 12.283 1.568 1.00 0.00 C ATOM 367 O LYS A 25 -11.853 11.957 1.540 1.00 0.00 O ATOM 368 CB LYS A 25 -9.536 14.072 2.914 1.00 0.00 C ATOM 369 CG LYS A 25 -10.591 15.129 2.689 1.00 0.00 C ATOM 370 CD LYS A 25 -9.940 16.507 2.743 1.00 0.00 C ATOM 371 CE LYS A 25 -9.074 16.809 1.506 1.00 0.00 C ATOM 372 NZ LYS A 25 -9.864 17.106 0.284 1.00 0.00 N ATOM 0 H LYS A 25 -7.952 12.392 3.217 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.701 12.402 3.675 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.070 14.264 3.880 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.764 14.203 2.156 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.073 14.979 1.723 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.369 15.051 3.449 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.716 17.267 2.831 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.323 16.577 3.639 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -8.426 17.658 1.725 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -8.425 15.955 1.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.229 17.447 -0.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -10.345 16.242 -0.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.572 17.838 0.497 1.00 0.00 H new ATOM 386 N GLU A 26 -9.912 12.344 0.484 1.00 0.00 N ATOM 387 CA GLU A 26 -10.465 12.088 -0.827 1.00 0.00 C ATOM 388 C GLU A 26 -10.904 10.652 -1.001 1.00 0.00 C ATOM 389 O GLU A 26 -12.012 10.391 -1.494 1.00 0.00 O ATOM 390 CB GLU A 26 -9.505 12.509 -1.937 1.00 0.00 C ATOM 391 CG GLU A 26 -9.314 14.005 -2.011 1.00 0.00 C ATOM 392 CD GLU A 26 -10.633 14.711 -2.092 1.00 0.00 C ATOM 393 OE1 GLU A 26 -11.268 14.682 -3.160 1.00 0.00 O ATOM 394 OE2 GLU A 26 -11.084 15.252 -1.072 1.00 0.00 O ATOM 0 H GLU A 26 -8.917 12.569 0.488 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.360 12.705 -0.907 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -8.538 12.032 -1.775 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -9.883 12.148 -2.894 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -8.766 14.349 -1.134 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.709 14.255 -2.883 1.00 0.00 H new ATOM 401 N LEU A 27 -10.056 9.733 -0.609 1.00 0.00 N ATOM 402 CA LEU A 27 -10.372 8.323 -0.734 1.00 0.00 C ATOM 403 C LEU A 27 -11.564 7.945 0.174 1.00 0.00 C ATOM 404 O LEU A 27 -12.394 7.132 -0.206 1.00 0.00 O ATOM 405 CB LEU A 27 -9.125 7.433 -0.485 1.00 0.00 C ATOM 406 CG LEU A 27 -9.252 5.952 -0.874 1.00 0.00 C ATOM 407 CD1 LEU A 27 -9.710 5.822 -2.309 1.00 0.00 C ATOM 408 CD2 LEU A 27 -7.912 5.250 -0.710 1.00 0.00 C ATOM 0 H LEU A 27 -9.142 9.931 -0.201 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.680 8.133 -1.762 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.286 7.860 -1.035 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -8.873 7.487 0.574 1.00 0.00 H new ATOM 0 HG LEU A 27 -9.988 5.488 -0.218 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.795 4.767 -2.570 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.680 6.304 -2.426 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -8.985 6.301 -2.967 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.014 4.201 -0.989 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.171 5.726 -1.353 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.589 5.320 0.329 1.00 0.00 H new ATOM 420 N LYS A 28 -11.683 8.592 1.342 1.00 0.00 N ATOM 421 CA LYS A 28 -12.828 8.348 2.224 1.00 0.00 C ATOM 422 C LYS A 28 -14.104 8.945 1.618 1.00 0.00 C ATOM 423 O LYS A 28 -15.212 8.454 1.850 1.00 0.00 O ATOM 424 CB LYS A 28 -12.609 8.903 3.640 1.00 0.00 C ATOM 425 CG LYS A 28 -13.688 8.447 4.613 1.00 0.00 C ATOM 426 CD LYS A 28 -13.377 8.789 6.050 1.00 0.00 C ATOM 427 CE LYS A 28 -14.411 8.140 6.956 1.00 0.00 C ATOM 428 NZ LYS A 28 -14.173 8.413 8.380 1.00 0.00 N ATOM 0 H LYS A 28 -11.012 9.276 1.692 1.00 0.00 H new ATOM 0 HA LYS A 28 -12.936 7.267 2.313 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.634 8.583 4.006 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.594 9.992 3.603 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -14.637 8.906 4.334 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -13.817 7.368 4.523 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -12.378 8.440 6.311 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -13.383 9.870 6.188 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -15.403 8.499 6.683 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -14.406 7.062 6.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -14.907 7.947 8.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -13.238 8.047 8.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -14.205 9.439 8.547 1.00 0.00 H new ATOM 442 N THR A 29 -13.939 9.989 0.830 1.00 0.00 N ATOM 443 CA THR A 29 -15.051 10.595 0.147 1.00 0.00 C ATOM 444 C THR A 29 -15.613 9.595 -0.871 1.00 0.00 C ATOM 445 O THR A 29 -16.834 9.341 -0.909 1.00 0.00 O ATOM 446 CB THR A 29 -14.641 11.927 -0.522 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.144 12.832 0.494 1.00 0.00 O ATOM 448 CG2 THR A 29 -15.822 12.577 -1.238 1.00 0.00 C ATOM 0 H THR A 29 -13.038 10.433 0.650 1.00 0.00 H new ATOM 0 HA THR A 29 -15.830 10.840 0.869 1.00 0.00 H new ATOM 0 HB THR A 29 -13.868 11.717 -1.261 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.217 12.602 0.712 1.00 0.00 H new ATOM 0 HG21 THR A 29 -15.499 13.511 -1.697 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.195 11.903 -2.009 1.00 0.00 H new ATOM 0 HG23 THR A 29 -16.616 12.781 -0.519 1.00 0.00 H new ATOM 456 N ALA A 30 -14.722 8.983 -1.672 1.00 0.00 N ATOM 457 CA ALA A 30 -15.069 7.940 -2.568 1.00 0.00 C ATOM 458 C ALA A 30 -15.636 6.760 -1.810 1.00 0.00 C ATOM 459 O ALA A 30 -16.552 6.148 -2.242 1.00 0.00 O ATOM 460 CB ALA A 30 -13.844 7.518 -3.340 1.00 0.00 C ATOM 0 H ALA A 30 -13.732 9.226 -1.692 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.829 8.302 -3.260 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.107 6.716 -4.030 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.457 8.368 -3.902 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.081 7.164 -2.647 1.00 0.00 H new ATOM 466 N ALA A 31 -15.054 6.433 -0.706 1.00 0.00 N ATOM 467 CA ALA A 31 -15.548 5.347 0.114 1.00 0.00 C ATOM 468 C ALA A 31 -16.997 5.575 0.550 1.00 0.00 C ATOM 469 O ALA A 31 -17.766 4.638 0.638 1.00 0.00 O ATOM 470 CB ALA A 31 -14.705 5.208 1.321 1.00 0.00 C ATOM 0 H ALA A 31 -14.226 6.900 -0.336 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.508 4.440 -0.489 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -15.081 4.389 1.935 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.677 4.997 1.025 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -14.735 6.135 1.894 1.00 0.00 H new ATOM 476 N SER A 32 -17.338 6.819 0.809 1.00 0.00 N ATOM 477 CA SER A 32 -18.651 7.181 1.265 1.00 0.00 C ATOM 478 C SER A 32 -19.669 7.098 0.119 1.00 0.00 C ATOM 479 O SER A 32 -20.613 6.310 0.160 1.00 0.00 O ATOM 480 CB SER A 32 -18.609 8.610 1.867 1.00 0.00 C ATOM 481 OG SER A 32 -19.843 8.978 2.472 1.00 0.00 O ATOM 0 H SER A 32 -16.702 7.610 0.706 1.00 0.00 H new ATOM 0 HA SER A 32 -18.968 6.479 2.036 1.00 0.00 H new ATOM 0 HB2 SER A 32 -17.812 8.666 2.609 1.00 0.00 H new ATOM 0 HB3 SER A 32 -18.364 9.325 1.082 1.00 0.00 H new ATOM 0 HG SER A 32 -19.770 9.884 2.839 1.00 0.00 H new ATOM 487 N GLN A 33 -19.431 7.874 -0.913 1.00 0.00 N ATOM 488 CA GLN A 33 -20.351 8.011 -2.044 1.00 0.00 C ATOM 489 C GLN A 33 -20.279 6.820 -2.997 1.00 0.00 C ATOM 490 O GLN A 33 -21.275 6.389 -3.572 1.00 0.00 O ATOM 491 CB GLN A 33 -19.914 9.226 -2.838 1.00 0.00 C ATOM 492 CG GLN A 33 -19.754 10.487 -2.050 1.00 0.00 C ATOM 493 CD GLN A 33 -21.036 11.204 -1.874 1.00 0.00 C ATOM 494 OE1 GLN A 33 -21.760 10.994 -0.899 1.00 0.00 O ATOM 495 NE2 GLN A 33 -21.334 12.047 -2.809 1.00 0.00 N ATOM 0 H GLN A 33 -18.586 8.439 -1.002 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.364 8.087 -1.649 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -18.965 8.999 -3.324 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -20.643 9.403 -3.629 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -19.335 10.251 -1.072 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -19.041 11.140 -2.554 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -20.698 12.183 -3.595 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -22.205 12.576 -2.760 1.00 0.00 H new ATOM 504 N TYR A 34 -19.112 6.304 -3.144 1.00 0.00 N ATOM 505 CA TYR A 34 -18.810 5.364 -4.217 1.00 0.00 C ATOM 506 C TYR A 34 -18.615 3.924 -3.731 1.00 0.00 C ATOM 507 O TYR A 34 -19.132 2.990 -4.353 1.00 0.00 O ATOM 508 CB TYR A 34 -17.610 5.916 -5.037 1.00 0.00 C ATOM 509 CG TYR A 34 -17.975 7.151 -5.836 1.00 0.00 C ATOM 510 CD1 TYR A 34 -18.569 7.047 -7.084 1.00 0.00 C ATOM 511 CD2 TYR A 34 -17.770 8.418 -5.320 1.00 0.00 C ATOM 512 CE1 TYR A 34 -18.934 8.180 -7.791 1.00 0.00 C ATOM 513 CE2 TYR A 34 -18.140 9.546 -6.012 1.00 0.00 C ATOM 514 CZ TYR A 34 -18.718 9.423 -7.243 1.00 0.00 C ATOM 515 OH TYR A 34 -19.089 10.554 -7.930 1.00 0.00 O ATOM 0 H TYR A 34 -18.322 6.508 -2.533 1.00 0.00 H new ATOM 0 HA TYR A 34 -19.676 5.289 -4.875 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -16.790 6.154 -4.360 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.250 5.142 -5.714 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -18.749 6.071 -7.510 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -17.308 8.523 -4.350 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -19.386 8.088 -8.768 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -17.975 10.524 -5.585 1.00 0.00 H new ATOM 0 HH TYR A 34 -18.866 11.347 -7.399 1.00 0.00 H new ATOM 525 N GLY A 35 -17.938 3.752 -2.607 1.00 0.00 N ATOM 526 CA GLY A 35 -17.644 2.411 -2.084 1.00 0.00 C ATOM 527 C GLY A 35 -16.549 1.713 -2.914 1.00 0.00 C ATOM 528 O GLY A 35 -16.223 2.153 -4.026 1.00 0.00 O ATOM 0 H GLY A 35 -17.579 4.516 -2.035 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.323 2.486 -1.045 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.551 1.807 -2.095 1.00 0.00 H new ATOM 532 N ALA A 36 -16.006 0.618 -2.415 1.00 0.00 N ATOM 533 CA ALA A 36 -14.863 -0.015 -3.057 1.00 0.00 C ATOM 534 C ALA A 36 -15.263 -1.112 -3.965 1.00 0.00 C ATOM 535 O ALA A 36 -15.267 -2.260 -3.604 1.00 0.00 O ATOM 536 CB ALA A 36 -13.833 -0.449 -2.072 1.00 0.00 C ATOM 0 H ALA A 36 -16.334 0.148 -1.571 1.00 0.00 H new ATOM 0 HA ALA A 36 -14.398 0.749 -3.680 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -13.000 -0.915 -2.598 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.472 0.417 -1.517 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -14.272 -1.167 -1.379 1.00 0.00 H new ATOM 542 N THR A 37 -15.442 -0.725 -5.182 1.00 0.00 N ATOM 543 CA THR A 37 -16.004 -1.506 -6.246 1.00 0.00 C ATOM 544 C THR A 37 -16.174 -0.563 -7.419 1.00 0.00 C ATOM 545 O THR A 37 -15.875 -0.900 -8.560 1.00 0.00 O ATOM 546 CB THR A 37 -17.390 -2.116 -5.903 1.00 0.00 C ATOM 547 OG1 THR A 37 -18.163 -1.207 -5.089 1.00 0.00 O ATOM 548 CG2 THR A 37 -17.334 -3.509 -5.260 1.00 0.00 C ATOM 0 H THR A 37 -15.182 0.213 -5.488 1.00 0.00 H new ATOM 0 HA THR A 37 -15.339 -2.345 -6.450 1.00 0.00 H new ATOM 0 HB THR A 37 -17.886 -2.261 -6.863 1.00 0.00 H new ATOM 0 HG1 THR A 37 -19.033 -1.609 -4.885 1.00 0.00 H new ATOM 0 HG21 THR A 37 -18.347 -3.856 -5.055 1.00 0.00 H new ATOM 0 HG22 THR A 37 -16.843 -4.204 -5.941 1.00 0.00 H new ATOM 0 HG23 THR A 37 -16.773 -3.457 -4.327 1.00 0.00 H new ATOM 556 N ALA A 38 -16.612 0.647 -7.098 1.00 0.00 N ATOM 557 CA ALA A 38 -16.810 1.691 -8.078 1.00 0.00 C ATOM 558 C ALA A 38 -15.464 2.230 -8.556 1.00 0.00 C ATOM 559 O ALA A 38 -14.643 2.671 -7.733 1.00 0.00 O ATOM 560 CB ALA A 38 -17.664 2.803 -7.506 1.00 0.00 C ATOM 0 H ALA A 38 -16.839 0.927 -6.144 1.00 0.00 H new ATOM 0 HA ALA A 38 -17.335 1.269 -8.935 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.802 3.580 -8.258 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.635 2.403 -7.215 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -17.170 3.228 -6.632 1.00 0.00 H new ATOM 566 N PRO A 39 -15.255 2.222 -9.906 1.00 0.00 N ATOM 567 CA PRO A 39 -13.992 2.607 -10.592 1.00 0.00 C ATOM 568 C PRO A 39 -13.251 3.792 -9.984 1.00 0.00 C ATOM 569 O PRO A 39 -12.026 3.771 -9.866 1.00 0.00 O ATOM 570 CB PRO A 39 -14.473 2.967 -11.987 1.00 0.00 C ATOM 571 CG PRO A 39 -15.610 2.046 -12.234 1.00 0.00 C ATOM 572 CD PRO A 39 -16.277 1.812 -10.901 1.00 0.00 C ATOM 0 HA PRO A 39 -13.265 1.798 -10.529 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -14.787 4.009 -12.043 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -13.684 2.832 -12.727 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -16.311 2.480 -12.947 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -15.261 1.106 -12.662 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -17.188 2.402 -10.802 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.559 0.767 -10.775 1.00 0.00 H new ATOM 580 N TYR A 40 -13.998 4.797 -9.590 1.00 0.00 N ATOM 581 CA TYR A 40 -13.453 6.008 -9.025 1.00 0.00 C ATOM 582 C TYR A 40 -12.522 5.741 -7.827 1.00 0.00 C ATOM 583 O TYR A 40 -11.356 6.129 -7.855 1.00 0.00 O ATOM 584 CB TYR A 40 -14.586 6.977 -8.643 1.00 0.00 C ATOM 585 CG TYR A 40 -14.114 8.274 -7.997 1.00 0.00 C ATOM 586 CD1 TYR A 40 -13.444 9.246 -8.728 1.00 0.00 C ATOM 587 CD2 TYR A 40 -14.353 8.519 -6.657 1.00 0.00 C ATOM 588 CE1 TYR A 40 -13.026 10.420 -8.135 1.00 0.00 C ATOM 589 CE2 TYR A 40 -13.933 9.690 -6.057 1.00 0.00 C ATOM 590 CZ TYR A 40 -13.273 10.631 -6.802 1.00 0.00 C ATOM 591 OH TYR A 40 -12.871 11.799 -6.211 1.00 0.00 O ATOM 0 H TYR A 40 -15.016 4.796 -9.654 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.835 6.472 -9.794 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -15.158 7.219 -9.539 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.265 6.470 -7.958 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -13.247 9.081 -9.777 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -14.878 7.781 -6.069 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.508 11.168 -8.717 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -14.124 9.862 -5.008 1.00 0.00 H new ATOM 0 HH TYR A 40 -13.123 11.790 -5.264 1.00 0.00 H new ATOM 601 N THR A 41 -13.006 5.030 -6.803 1.00 0.00 N ATOM 602 CA THR A 41 -12.239 4.864 -5.585 1.00 0.00 C ATOM 603 C THR A 41 -10.992 4.006 -5.816 1.00 0.00 C ATOM 604 O THR A 41 -9.915 4.332 -5.333 1.00 0.00 O ATOM 605 CB THR A 41 -13.110 4.293 -4.415 1.00 0.00 C ATOM 606 OG1 THR A 41 -12.431 4.441 -3.175 1.00 0.00 O ATOM 607 CG2 THR A 41 -13.403 2.835 -4.608 1.00 0.00 C ATOM 0 H THR A 41 -13.916 4.569 -6.802 1.00 0.00 H new ATOM 0 HA THR A 41 -11.907 5.858 -5.285 1.00 0.00 H new ATOM 0 HB THR A 41 -14.044 4.854 -4.411 1.00 0.00 H new ATOM 0 HG1 THR A 41 -12.987 4.082 -2.453 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.009 2.473 -3.778 1.00 0.00 H new ATOM 0 HG22 THR A 41 -13.946 2.694 -5.542 1.00 0.00 H new ATOM 0 HG23 THR A 41 -12.467 2.278 -4.644 1.00 0.00 H new ATOM 615 N LEU A 42 -11.111 2.952 -6.615 1.00 0.00 N ATOM 616 CA LEU A 42 -9.975 2.111 -6.833 1.00 0.00 C ATOM 617 C LEU A 42 -8.962 2.712 -7.745 1.00 0.00 C ATOM 618 O LEU A 42 -7.798 2.347 -7.686 1.00 0.00 O ATOM 619 CB LEU A 42 -10.236 0.598 -7.049 1.00 0.00 C ATOM 620 CG LEU A 42 -11.346 0.123 -8.003 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.711 0.302 -7.383 1.00 0.00 C ATOM 622 CD2 LEU A 42 -11.242 0.773 -9.379 1.00 0.00 C ATOM 0 H LEU A 42 -11.963 2.677 -7.103 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.510 2.085 -5.847 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.302 0.158 -7.398 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.446 0.165 -6.071 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.203 -0.945 -8.164 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.475 -0.042 -8.080 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.771 -0.279 -6.463 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -12.873 1.356 -7.158 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.047 0.406 -10.016 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.324 1.855 -9.277 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.281 0.523 -9.828 1.00 0.00 H new ATOM 634 N ALA A 43 -9.406 3.665 -8.567 1.00 0.00 N ATOM 635 CA ALA A 43 -8.498 4.439 -9.386 1.00 0.00 C ATOM 636 C ALA A 43 -7.603 5.227 -8.468 1.00 0.00 C ATOM 637 O ALA A 43 -6.407 5.352 -8.685 1.00 0.00 O ATOM 638 CB ALA A 43 -9.251 5.363 -10.329 1.00 0.00 C ATOM 0 H ALA A 43 -10.390 3.912 -8.676 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.905 3.769 -10.009 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.539 5.929 -10.929 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.889 4.771 -10.985 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.866 6.052 -9.750 1.00 0.00 H new ATOM 644 N ILE A 44 -8.193 5.699 -7.411 1.00 0.00 N ATOM 645 CA ILE A 44 -7.475 6.415 -6.408 1.00 0.00 C ATOM 646 C ILE A 44 -6.540 5.446 -5.642 1.00 0.00 C ATOM 647 O ILE A 44 -5.359 5.716 -5.543 1.00 0.00 O ATOM 648 CB ILE A 44 -8.440 7.144 -5.461 1.00 0.00 C ATOM 649 CG1 ILE A 44 -9.355 8.057 -6.279 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.662 7.970 -4.437 1.00 0.00 C ATOM 651 CD1 ILE A 44 -10.523 8.591 -5.506 1.00 0.00 C ATOM 0 H ILE A 44 -9.190 5.596 -7.222 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.858 7.177 -6.884 1.00 0.00 H new ATOM 0 HB ILE A 44 -9.039 6.407 -4.926 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.771 8.894 -6.661 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -9.725 7.506 -7.143 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.361 8.480 -3.774 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -7.020 7.312 -3.851 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -7.049 8.708 -4.955 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -11.126 9.230 -6.152 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -11.131 7.761 -5.147 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -10.163 9.171 -4.657 1.00 0.00 H new ATOM 663 N VAL A 45 -7.079 4.290 -5.176 1.00 0.00 N ATOM 664 CA VAL A 45 -6.293 3.242 -4.431 1.00 0.00 C ATOM 665 C VAL A 45 -4.956 2.931 -5.152 1.00 0.00 C ATOM 666 O VAL A 45 -3.845 3.084 -4.574 1.00 0.00 O ATOM 667 CB VAL A 45 -7.121 1.892 -4.267 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.359 0.820 -3.487 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.451 2.134 -3.589 1.00 0.00 C ATOM 0 H VAL A 45 -8.062 4.048 -5.299 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.086 3.650 -3.442 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.286 1.528 -5.281 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -6.973 -0.077 -3.407 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.432 0.580 -4.008 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.128 1.192 -2.489 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.988 1.190 -3.494 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.283 2.557 -2.599 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.042 2.830 -4.185 1.00 0.00 H new ATOM 679 N GLU A 46 -5.058 2.576 -6.424 1.00 0.00 N ATOM 680 CA GLU A 46 -3.894 2.234 -7.230 1.00 0.00 C ATOM 681 C GLU A 46 -2.972 3.438 -7.460 1.00 0.00 C ATOM 682 O GLU A 46 -1.757 3.285 -7.494 1.00 0.00 O ATOM 683 CB GLU A 46 -4.312 1.621 -8.563 1.00 0.00 C ATOM 684 CG GLU A 46 -5.295 2.470 -9.327 1.00 0.00 C ATOM 685 CD GLU A 46 -5.569 1.973 -10.704 1.00 0.00 C ATOM 686 OE1 GLU A 46 -4.853 2.385 -11.648 1.00 0.00 O ATOM 687 OE2 GLU A 46 -6.516 1.174 -10.883 1.00 0.00 O ATOM 0 H GLU A 46 -5.944 2.517 -6.925 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.328 1.493 -6.666 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -3.425 1.463 -9.177 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -4.753 0.641 -8.382 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -6.232 2.514 -8.772 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -4.912 3.489 -9.387 1.00 0.00 H new ATOM 694 N SER A 47 -3.541 4.636 -7.567 1.00 0.00 N ATOM 695 CA SER A 47 -2.751 5.826 -7.825 1.00 0.00 C ATOM 696 C SER A 47 -2.050 6.329 -6.563 1.00 0.00 C ATOM 697 O SER A 47 -1.004 6.959 -6.639 1.00 0.00 O ATOM 698 CB SER A 47 -3.607 6.908 -8.460 1.00 0.00 C ATOM 699 OG SER A 47 -4.227 6.407 -9.631 1.00 0.00 O ATOM 0 H SER A 47 -4.543 4.803 -7.479 1.00 0.00 H new ATOM 0 HA SER A 47 -1.966 5.558 -8.532 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.365 7.246 -7.753 1.00 0.00 H new ATOM 0 HB3 SER A 47 -2.992 7.773 -8.706 1.00 0.00 H new ATOM 0 HG SER A 47 -5.188 6.301 -9.472 1.00 0.00 H new ATOM 705 N VAL A 48 -2.609 6.034 -5.405 1.00 0.00 N ATOM 706 CA VAL A 48 -1.970 6.392 -4.157 1.00 0.00 C ATOM 707 C VAL A 48 -0.717 5.547 -4.007 1.00 0.00 C ATOM 708 O VAL A 48 0.349 6.052 -3.631 1.00 0.00 O ATOM 709 CB VAL A 48 -2.909 6.201 -2.923 1.00 0.00 C ATOM 710 CG1 VAL A 48 -2.198 6.575 -1.626 1.00 0.00 C ATOM 711 CG2 VAL A 48 -4.165 7.039 -3.074 1.00 0.00 C ATOM 0 H VAL A 48 -3.501 5.549 -5.304 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.721 7.453 -4.187 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.183 5.147 -2.878 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.876 6.432 -0.785 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.321 5.942 -1.496 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.888 7.619 -1.669 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.807 6.893 -2.205 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.893 8.092 -3.151 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.699 6.735 -3.974 1.00 0.00 H new ATOM 721 N ALA A 49 -0.831 4.279 -4.410 1.00 0.00 N ATOM 722 CA ALA A 49 0.283 3.341 -4.346 1.00 0.00 C ATOM 723 C ALA A 49 1.212 3.485 -5.541 1.00 0.00 C ATOM 724 O ALA A 49 2.241 2.852 -5.607 1.00 0.00 O ATOM 725 CB ALA A 49 -0.218 1.912 -4.169 1.00 0.00 C ATOM 0 H ALA A 49 -1.691 3.880 -4.786 1.00 0.00 H new ATOM 0 HA ALA A 49 0.877 3.587 -3.466 1.00 0.00 H new ATOM 0 HB1 ALA A 49 0.632 1.231 -4.124 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.790 1.839 -3.244 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.854 1.643 -5.012 1.00 0.00 H new ATOM 731 N ASP A 50 0.840 4.358 -6.451 1.00 0.00 N ATOM 732 CA ASP A 50 1.634 4.660 -7.645 1.00 0.00 C ATOM 733 C ASP A 50 2.828 5.531 -7.255 1.00 0.00 C ATOM 734 O ASP A 50 3.829 5.640 -7.986 1.00 0.00 O ATOM 735 CB ASP A 50 0.740 5.375 -8.658 1.00 0.00 C ATOM 736 CG ASP A 50 1.450 5.879 -9.885 1.00 0.00 C ATOM 737 OD1 ASP A 50 1.556 5.133 -10.880 1.00 0.00 O ATOM 738 OD2 ASP A 50 1.846 7.069 -9.908 1.00 0.00 O ATOM 0 H ASP A 50 -0.029 4.889 -6.392 1.00 0.00 H new ATOM 0 HA ASP A 50 2.015 3.743 -8.094 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -0.051 4.692 -8.968 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.257 6.218 -8.163 1.00 0.00 H new ATOM 743 N ASN A 51 2.701 6.132 -6.088 1.00 0.00 N ATOM 744 CA ASN A 51 3.745 6.951 -5.488 1.00 0.00 C ATOM 745 C ASN A 51 4.522 6.062 -4.575 1.00 0.00 C ATOM 746 O ASN A 51 4.060 4.983 -4.247 1.00 0.00 O ATOM 747 CB ASN A 51 3.162 8.053 -4.587 1.00 0.00 C ATOM 748 CG ASN A 51 2.175 8.976 -5.240 1.00 0.00 C ATOM 749 OD1 ASN A 51 2.542 9.978 -5.852 1.00 0.00 O ATOM 750 ND2 ASN A 51 0.922 8.680 -5.071 1.00 0.00 N ATOM 0 H ASN A 51 1.857 6.066 -5.518 1.00 0.00 H new ATOM 0 HA ASN A 51 4.332 7.401 -6.289 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.678 7.580 -3.733 1.00 0.00 H new ATOM 0 HB3 ASN A 51 3.986 8.650 -4.196 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.198 9.289 -5.453 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.662 7.839 -4.557 1.00 0.00 H new ATOM 757 N TRP A 52 5.662 6.499 -4.130 1.00 0.00 N ATOM 758 CA TRP A 52 6.397 5.724 -3.174 1.00 0.00 C ATOM 759 C TRP A 52 5.830 5.981 -1.792 1.00 0.00 C ATOM 760 O TRP A 52 5.659 7.130 -1.384 1.00 0.00 O ATOM 761 CB TRP A 52 7.904 6.011 -3.233 1.00 0.00 C ATOM 762 CG TRP A 52 8.499 5.683 -4.568 1.00 0.00 C ATOM 763 CD1 TRP A 52 8.261 4.568 -5.308 1.00 0.00 C ATOM 764 CD2 TRP A 52 9.446 6.456 -5.306 1.00 0.00 C ATOM 765 NE1 TRP A 52 8.969 4.618 -6.474 1.00 0.00 N ATOM 766 CE2 TRP A 52 9.712 5.756 -6.496 1.00 0.00 C ATOM 767 CE3 TRP A 52 10.087 7.672 -5.088 1.00 0.00 C ATOM 768 CZ2 TRP A 52 10.587 6.228 -7.459 1.00 0.00 C ATOM 769 CZ3 TRP A 52 10.959 8.134 -6.046 1.00 0.00 C ATOM 770 CH2 TRP A 52 11.200 7.414 -7.216 1.00 0.00 C ATOM 0 H TRP A 52 6.100 7.377 -4.409 1.00 0.00 H new ATOM 0 HA TRP A 52 6.285 4.667 -3.417 1.00 0.00 H new ATOM 0 HB2 TRP A 52 8.079 7.063 -3.010 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.411 5.433 -2.461 1.00 0.00 H new ATOM 0 HD1 TRP A 52 7.607 3.760 -5.016 1.00 0.00 H new ATOM 0 HE1 TRP A 52 8.944 3.914 -7.211 1.00 0.00 H new ATOM 0 HE3 TRP A 52 9.904 8.240 -4.188 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 10.774 5.675 -8.367 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 11.468 9.074 -5.889 1.00 0.00 H new ATOM 0 HH2 TRP A 52 11.891 7.810 -7.946 1.00 0.00 H new ATOM 781 N LEU A 53 5.464 4.929 -1.122 1.00 0.00 N ATOM 782 CA LEU A 53 4.898 5.023 0.196 1.00 0.00 C ATOM 783 C LEU A 53 5.230 3.773 0.984 1.00 0.00 C ATOM 784 O LEU A 53 5.706 2.795 0.421 1.00 0.00 O ATOM 785 CB LEU A 53 3.365 5.313 0.151 1.00 0.00 C ATOM 786 CG LEU A 53 2.391 4.206 -0.328 1.00 0.00 C ATOM 787 CD1 LEU A 53 0.969 4.737 -0.325 1.00 0.00 C ATOM 788 CD2 LEU A 53 2.731 3.667 -1.712 1.00 0.00 C ATOM 0 H LEU A 53 5.549 3.975 -1.474 1.00 0.00 H new ATOM 0 HA LEU A 53 5.344 5.875 0.710 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.059 5.605 1.155 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.216 6.180 -0.493 1.00 0.00 H new ATOM 0 HG LEU A 53 2.491 3.375 0.371 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.288 3.956 -0.662 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.697 5.044 0.685 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.899 5.593 -0.996 1.00 0.00 H new ATOM 0 HD21 LEU A 53 2.012 2.896 -1.989 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.690 4.478 -2.439 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.734 3.241 -1.700 1.00 0.00 H new ATOM 800 N THR A 54 4.985 3.796 2.262 1.00 0.00 N ATOM 801 CA THR A 54 5.364 2.691 3.113 1.00 0.00 C ATOM 802 C THR A 54 4.111 1.972 3.653 1.00 0.00 C ATOM 803 O THR A 54 3.005 2.522 3.569 1.00 0.00 O ATOM 804 CB THR A 54 6.281 3.175 4.272 1.00 0.00 C ATOM 805 OG1 THR A 54 5.652 4.235 5.024 1.00 0.00 O ATOM 806 CG2 THR A 54 7.618 3.664 3.733 1.00 0.00 C ATOM 0 H THR A 54 4.524 4.567 2.745 1.00 0.00 H new ATOM 0 HA THR A 54 5.933 1.976 2.519 1.00 0.00 H new ATOM 0 HB THR A 54 6.449 2.325 4.933 1.00 0.00 H new ATOM 0 HG1 THR A 54 4.771 4.429 4.642 1.00 0.00 H new ATOM 0 HG21 THR A 54 8.244 3.998 4.561 1.00 0.00 H new ATOM 0 HG22 THR A 54 8.117 2.851 3.206 1.00 0.00 H new ATOM 0 HG23 THR A 54 7.452 4.494 3.046 1.00 0.00 H new ATOM 814 N PRO A 55 4.250 0.728 4.207 1.00 0.00 N ATOM 815 CA PRO A 55 3.108 -0.039 4.753 1.00 0.00 C ATOM 816 C PRO A 55 2.321 0.713 5.836 1.00 0.00 C ATOM 817 O PRO A 55 1.134 0.433 6.053 1.00 0.00 O ATOM 818 CB PRO A 55 3.761 -1.297 5.332 1.00 0.00 C ATOM 819 CG PRO A 55 4.990 -1.461 4.517 1.00 0.00 C ATOM 820 CD PRO A 55 5.501 -0.066 4.289 1.00 0.00 C ATOM 0 HA PRO A 55 2.366 -0.241 3.980 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.995 -1.176 6.390 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.106 -2.164 5.247 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.729 -2.071 5.037 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.773 -1.960 3.573 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.141 0.270 5.105 1.00 0.00 H new ATOM 0 HD3 PRO A 55 6.088 0.006 3.373 1.00 0.00 H new ATOM 828 N THR A 56 2.959 1.668 6.501 1.00 0.00 N ATOM 829 CA THR A 56 2.271 2.425 7.511 1.00 0.00 C ATOM 830 C THR A 56 1.273 3.411 6.859 1.00 0.00 C ATOM 831 O THR A 56 0.149 3.578 7.359 1.00 0.00 O ATOM 832 CB THR A 56 3.238 3.127 8.524 1.00 0.00 C ATOM 833 OG1 THR A 56 2.496 3.667 9.628 1.00 0.00 O ATOM 834 CG2 THR A 56 4.042 4.240 7.864 1.00 0.00 C ATOM 0 H THR A 56 3.935 1.926 6.355 1.00 0.00 H new ATOM 0 HA THR A 56 1.701 1.718 8.115 1.00 0.00 H new ATOM 0 HB THR A 56 3.935 2.369 8.882 1.00 0.00 H new ATOM 0 HG1 THR A 56 3.112 4.102 10.254 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.700 4.700 8.601 1.00 0.00 H new ATOM 0 HG22 THR A 56 4.640 3.825 7.053 1.00 0.00 H new ATOM 0 HG23 THR A 56 3.362 4.992 7.465 1.00 0.00 H new ATOM 842 N ASP A 57 1.673 4.023 5.710 1.00 0.00 N ATOM 843 CA ASP A 57 0.777 4.898 4.931 1.00 0.00 C ATOM 844 C ASP A 57 -0.416 4.066 4.524 1.00 0.00 C ATOM 845 O ASP A 57 -1.574 4.479 4.663 1.00 0.00 O ATOM 846 CB ASP A 57 1.462 5.433 3.637 1.00 0.00 C ATOM 847 CG ASP A 57 2.714 6.265 3.857 1.00 0.00 C ATOM 848 OD1 ASP A 57 3.824 5.693 3.905 1.00 0.00 O ATOM 849 OD2 ASP A 57 2.624 7.507 3.943 1.00 0.00 O ATOM 0 H ASP A 57 2.607 3.922 5.312 1.00 0.00 H new ATOM 0 HA ASP A 57 0.501 5.757 5.543 1.00 0.00 H new ATOM 0 HB2 ASP A 57 1.718 4.583 3.004 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.739 6.035 3.086 1.00 0.00 H new ATOM 854 N TRP A 58 -0.101 2.859 4.078 1.00 0.00 N ATOM 855 CA TRP A 58 -1.078 1.874 3.677 1.00 0.00 C ATOM 856 C TRP A 58 -2.106 1.590 4.761 1.00 0.00 C ATOM 857 O TRP A 58 -3.292 1.854 4.576 1.00 0.00 O ATOM 858 CB TRP A 58 -0.400 0.574 3.277 1.00 0.00 C ATOM 859 CG TRP A 58 0.213 0.569 1.928 1.00 0.00 C ATOM 860 CD1 TRP A 58 0.265 1.587 1.031 1.00 0.00 C ATOM 861 CD2 TRP A 58 0.831 -0.543 1.309 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.890 1.170 -0.112 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.245 -0.136 0.032 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.076 -1.850 1.717 1.00 0.00 C ATOM 865 CZ2 TRP A 58 1.889 -0.989 -0.843 1.00 0.00 C ATOM 866 CZ3 TRP A 58 1.713 -2.697 0.850 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.110 -2.264 -0.414 1.00 0.00 C ATOM 0 H TRP A 58 0.862 2.536 3.985 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.604 2.298 2.821 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.373 0.346 4.010 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -1.134 -0.230 3.328 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -0.129 2.579 1.196 1.00 0.00 H new ATOM 0 HE1 TRP A 58 1.062 1.744 -0.937 1.00 0.00 H new ATOM 0 HE3 TRP A 58 0.771 -2.189 2.696 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 2.203 -0.661 -1.823 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 1.911 -3.715 1.150 1.00 0.00 H new ATOM 0 HH2 TRP A 58 2.608 -2.960 -1.073 1.00 0.00 H new ATOM 878 N ASN A 59 -1.668 1.045 5.885 1.00 0.00 N ATOM 879 CA ASN A 59 -2.599 0.668 6.965 1.00 0.00 C ATOM 880 C ASN A 59 -3.438 1.836 7.425 1.00 0.00 C ATOM 881 O ASN A 59 -4.624 1.679 7.716 1.00 0.00 O ATOM 882 CB ASN A 59 -1.889 -0.018 8.140 1.00 0.00 C ATOM 883 CG ASN A 59 -1.468 -1.436 7.799 1.00 0.00 C ATOM 884 OD1 ASN A 59 -2.119 -2.111 6.982 1.00 0.00 O ATOM 885 ND2 ASN A 59 -0.395 -1.899 8.393 1.00 0.00 N ATOM 0 H ASN A 59 -0.686 0.851 6.083 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.280 -0.068 6.538 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.011 0.563 8.423 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.552 -0.035 9.005 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.067 -2.844 8.191 1.00 0.00 H new ATOM 0 HD22 ASN A 59 0.112 -1.315 9.058 1.00 0.00 H new ATOM 892 N THR A 60 -2.834 3.009 7.372 1.00 0.00 N ATOM 893 CA THR A 60 -3.541 4.222 7.729 1.00 0.00 C ATOM 894 C THR A 60 -4.727 4.467 6.755 1.00 0.00 C ATOM 895 O THR A 60 -5.820 4.904 7.176 1.00 0.00 O ATOM 896 CB THR A 60 -2.581 5.437 7.757 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.533 5.182 8.708 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.309 6.718 8.156 1.00 0.00 C ATOM 0 H THR A 60 -1.864 3.146 7.088 1.00 0.00 H new ATOM 0 HA THR A 60 -3.946 4.099 8.733 1.00 0.00 H new ATOM 0 HB THR A 60 -2.174 5.573 6.755 1.00 0.00 H new ATOM 0 HG1 THR A 60 -0.801 4.703 8.267 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.604 7.549 8.165 1.00 0.00 H new ATOM 0 HG22 THR A 60 -4.103 6.924 7.439 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.740 6.597 9.150 1.00 0.00 H new ATOM 906 N LEU A 61 -4.539 4.097 5.479 1.00 0.00 N ATOM 907 CA LEU A 61 -5.572 4.285 4.482 1.00 0.00 C ATOM 908 C LEU A 61 -6.730 3.404 4.772 1.00 0.00 C ATOM 909 O LEU A 61 -7.752 3.887 5.154 1.00 0.00 O ATOM 910 CB LEU A 61 -5.095 4.000 3.058 1.00 0.00 C ATOM 911 CG LEU A 61 -3.974 4.858 2.543 1.00 0.00 C ATOM 912 CD1 LEU A 61 -3.565 4.431 1.141 1.00 0.00 C ATOM 913 CD2 LEU A 61 -4.344 6.333 2.593 1.00 0.00 C ATOM 0 H LEU A 61 -3.682 3.670 5.127 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.855 5.336 4.537 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -4.779 2.958 3.006 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -5.945 4.109 2.385 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.113 4.717 3.196 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.752 5.067 0.790 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.232 3.393 1.159 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -4.417 4.527 0.468 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.514 6.929 2.214 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.227 6.508 1.978 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.557 6.620 3.623 1.00 0.00 H new ATOM 925 N VAL A 62 -6.520 2.097 4.679 1.00 0.00 N ATOM 926 CA VAL A 62 -7.612 1.110 4.807 1.00 0.00 C ATOM 927 C VAL A 62 -8.464 1.331 6.068 1.00 0.00 C ATOM 928 O VAL A 62 -9.692 1.269 6.022 1.00 0.00 O ATOM 929 CB VAL A 62 -7.077 -0.361 4.746 1.00 0.00 C ATOM 930 CG1 VAL A 62 -6.080 -0.662 5.854 1.00 0.00 C ATOM 931 CG2 VAL A 62 -8.219 -1.364 4.762 1.00 0.00 C ATOM 0 H VAL A 62 -5.602 1.683 4.515 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.264 1.268 3.948 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.545 -0.460 3.800 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.740 -1.694 5.767 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.226 0.010 5.768 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.558 -0.518 6.823 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.815 -2.376 4.719 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.797 -1.243 5.678 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.865 -1.194 3.901 1.00 0.00 H new ATOM 941 N ARG A 63 -7.799 1.664 7.152 1.00 0.00 N ATOM 942 CA ARG A 63 -8.489 1.840 8.430 1.00 0.00 C ATOM 943 C ARG A 63 -9.309 3.139 8.511 1.00 0.00 C ATOM 944 O ARG A 63 -10.338 3.186 9.189 1.00 0.00 O ATOM 945 CB ARG A 63 -7.528 1.727 9.608 1.00 0.00 C ATOM 946 CG ARG A 63 -6.518 2.849 9.737 1.00 0.00 C ATOM 947 CD ARG A 63 -5.505 2.485 10.780 1.00 0.00 C ATOM 948 NE ARG A 63 -4.515 3.528 11.040 1.00 0.00 N ATOM 949 CZ ARG A 63 -3.280 3.288 11.512 1.00 0.00 C ATOM 950 NH1 ARG A 63 -2.892 2.032 11.779 1.00 0.00 N ATOM 951 NH2 ARG A 63 -2.455 4.299 11.746 1.00 0.00 N ATOM 0 H ARG A 63 -6.791 1.819 7.185 1.00 0.00 H new ATOM 0 HA ARG A 63 -9.206 1.021 8.491 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -8.112 1.680 10.527 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.988 0.784 9.525 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.026 3.023 8.780 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.021 3.777 10.010 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -6.024 2.252 11.710 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.988 1.578 10.468 1.00 0.00 H new ATOM 0 HE ARG A 63 -4.777 4.496 10.852 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -3.535 1.256 11.624 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -1.954 1.853 12.137 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -2.758 5.256 11.568 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -1.517 4.119 12.104 1.00 0.00 H new ATOM 965 N ALA A 64 -8.867 4.181 7.839 1.00 0.00 N ATOM 966 CA ALA A 64 -9.573 5.445 7.903 1.00 0.00 C ATOM 967 C ALA A 64 -10.469 5.662 6.681 1.00 0.00 C ATOM 968 O ALA A 64 -11.656 5.966 6.822 1.00 0.00 O ATOM 969 CB ALA A 64 -8.586 6.590 8.064 1.00 0.00 C ATOM 0 H ALA A 64 -8.034 4.181 7.250 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.226 5.418 8.776 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -9.129 7.534 8.111 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.016 6.453 8.983 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.904 6.605 7.214 1.00 0.00 H new ATOM 975 N VAL A 65 -9.877 5.540 5.529 1.00 0.00 N ATOM 976 CA VAL A 65 -10.585 5.783 4.259 1.00 0.00 C ATOM 977 C VAL A 65 -11.848 4.929 4.097 1.00 0.00 C ATOM 978 O VAL A 65 -12.864 5.425 3.657 1.00 0.00 O ATOM 979 CB VAL A 65 -9.694 5.682 2.972 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.448 6.535 3.091 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.358 4.248 2.584 1.00 0.00 C ATOM 0 H VAL A 65 -8.899 5.273 5.419 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.883 6.828 4.345 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.296 6.080 2.155 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.854 6.441 2.182 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.733 7.578 3.232 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.859 6.201 3.945 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.740 4.249 1.686 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.814 3.769 3.398 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.279 3.698 2.390 1.00 0.00 H new ATOM 991 N LEU A 66 -11.809 3.678 4.503 1.00 0.00 N ATOM 992 CA LEU A 66 -12.970 2.829 4.350 1.00 0.00 C ATOM 993 C LEU A 66 -13.474 2.347 5.685 1.00 0.00 C ATOM 994 O LEU A 66 -12.835 2.550 6.726 1.00 0.00 O ATOM 995 CB LEU A 66 -12.722 1.620 3.449 1.00 0.00 C ATOM 996 CG LEU A 66 -13.239 1.664 1.999 1.00 0.00 C ATOM 997 CD1 LEU A 66 -12.517 2.692 1.157 1.00 0.00 C ATOM 998 CD2 LEU A 66 -13.111 0.291 1.389 1.00 0.00 C ATOM 0 H LEU A 66 -11.000 3.232 4.935 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.722 3.455 3.870 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.646 1.450 3.412 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -13.166 0.750 3.933 1.00 0.00 H new ATOM 0 HG LEU A 66 -14.286 1.966 2.022 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -12.920 2.681 0.144 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.656 3.682 1.592 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.453 2.455 1.126 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -13.475 0.314 0.362 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -12.065 -0.014 1.396 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -13.701 -0.420 1.967 1.00 0.00 H new ATOM 1010 N SER A 67 -14.617 1.697 5.641 1.00 0.00 N ATOM 1011 CA SER A 67 -15.249 1.154 6.793 1.00 0.00 C ATOM 1012 C SER A 67 -16.270 0.077 6.383 1.00 0.00 C ATOM 1013 O SER A 67 -16.987 0.221 5.359 1.00 0.00 O ATOM 1014 CB SER A 67 -15.919 2.295 7.580 1.00 0.00 C ATOM 1015 OG SER A 67 -16.693 3.142 6.711 1.00 0.00 O ATOM 0 H SER A 67 -15.133 1.535 4.776 1.00 0.00 H new ATOM 0 HA SER A 67 -14.509 0.674 7.433 1.00 0.00 H new ATOM 0 HB2 SER A 67 -16.563 1.877 8.354 1.00 0.00 H new ATOM 0 HB3 SER A 67 -15.157 2.888 8.086 1.00 0.00 H new ATOM 0 HG SER A 67 -17.109 3.857 7.237 1.00 0.00 H new ATOM 1021 N GLY A 68 -16.285 -1.012 7.115 1.00 0.00 N ATOM 1022 CA GLY A 68 -17.281 -2.032 6.924 1.00 0.00 C ATOM 1023 C GLY A 68 -16.750 -3.252 6.235 1.00 0.00 C ATOM 1024 O GLY A 68 -16.467 -4.265 6.877 1.00 0.00 O ATOM 0 H GLY A 68 -15.611 -1.212 7.854 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -17.689 -2.318 7.893 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -18.105 -1.622 6.340 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.627 -3.165 4.942 1.00 0.00 N ATOM 1029 CA GLY A 69 -16.174 -4.283 4.142 1.00 0.00 C ATOM 1030 C GLY A 69 -14.661 -4.362 3.980 1.00 0.00 C ATOM 1031 O GLY A 69 -14.112 -5.431 3.637 1.00 0.00 O ATOM 0 H GLY A 69 -16.836 -2.322 4.407 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.528 -5.208 4.597 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.631 -4.218 3.155 1.00 0.00 H new ATOM 1035 N ASP A 70 -14.012 -3.231 4.194 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.577 -2.995 3.878 1.00 0.00 C ATOM 1037 C ASP A 70 -11.660 -4.146 4.235 1.00 0.00 C ATOM 1038 O ASP A 70 -10.981 -4.696 3.343 1.00 0.00 O ATOM 1039 CB ASP A 70 -12.076 -1.708 4.566 1.00 0.00 C ATOM 1040 CG ASP A 70 -12.172 -1.740 6.094 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -13.295 -1.643 6.634 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -11.141 -1.934 6.777 1.00 0.00 O ATOM 0 H ASP A 70 -14.465 -2.414 4.604 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.536 -2.892 2.794 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -11.038 -1.537 4.281 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.653 -0.861 4.194 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.695 -4.560 5.467 1.00 0.00 N ATOM 1048 CA HIS A 71 -10.837 -5.588 5.962 1.00 0.00 C ATOM 1049 C HIS A 71 -11.091 -6.893 5.227 1.00 0.00 C ATOM 1050 O HIS A 71 -10.143 -7.556 4.804 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.053 -5.758 7.468 1.00 0.00 C ATOM 1052 CG HIS A 71 -10.190 -6.791 8.116 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -10.678 -7.977 8.594 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -8.867 -6.803 8.375 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -9.699 -8.672 9.112 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -8.591 -7.983 8.994 1.00 0.00 N ATOM 0 H HIS A 71 -12.334 -4.183 6.167 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.800 -5.303 5.787 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -10.875 -4.800 7.956 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -12.097 -6.016 7.643 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -8.159 -6.023 8.136 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -9.789 -9.650 9.562 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -7.670 -8.283 9.314 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.370 -7.195 5.007 1.00 0.00 N ATOM 1066 CA LEU A 72 -12.787 -8.460 4.415 1.00 0.00 C ATOM 1067 C LEU A 72 -12.093 -8.660 3.082 1.00 0.00 C ATOM 1068 O LEU A 72 -11.263 -9.547 2.941 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.287 -8.435 4.120 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.232 -8.025 5.236 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -16.590 -7.760 4.634 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -15.338 -9.114 6.286 1.00 0.00 C ATOM 0 H LEU A 72 -13.143 -6.569 5.234 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.537 -9.254 5.118 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.450 -7.759 3.281 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.577 -9.432 3.787 1.00 0.00 H new ATOM 0 HG LEU A 72 -14.848 -7.128 5.723 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -17.285 -7.464 5.420 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -16.512 -6.960 3.898 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -16.956 -8.665 4.149 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -16.021 -8.795 7.074 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -15.716 -10.027 5.826 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -14.354 -9.304 6.714 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.334 -7.768 2.147 1.00 0.00 N ATOM 1085 CA LEU A 73 -11.760 -7.984 0.827 1.00 0.00 C ATOM 1086 C LEU A 73 -10.378 -7.398 0.617 1.00 0.00 C ATOM 1087 O LEU A 73 -9.451 -8.150 0.306 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.723 -7.743 -0.346 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.777 -8.853 -0.661 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -13.100 -10.173 -1.005 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -14.782 -9.061 0.464 1.00 0.00 C ATOM 0 H LEU A 73 -12.895 -6.923 2.259 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.590 -9.061 0.819 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.261 -6.815 -0.153 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.125 -7.584 -1.243 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.334 -8.497 -1.528 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.858 -10.926 -1.219 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.464 -10.039 -1.880 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.492 -10.501 -0.162 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -15.486 -9.844 0.183 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.256 -9.355 1.372 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.325 -8.133 0.643 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.217 -6.061 0.799 1.00 0.00 N ATOM 1104 CA TRP A 74 -8.927 -5.404 0.660 1.00 0.00 C ATOM 1105 C TRP A 74 -7.857 -6.152 1.476 1.00 0.00 C ATOM 1106 O TRP A 74 -6.751 -6.395 1.038 1.00 0.00 O ATOM 1107 CB TRP A 74 -8.979 -3.937 1.190 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.666 -2.786 0.373 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.673 -2.794 -0.608 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.289 -1.417 0.505 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -10.944 -1.489 -1.007 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.114 -0.631 -0.318 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.332 -0.808 1.268 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.004 0.767 -0.373 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.196 0.597 1.228 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.045 1.366 0.415 1.00 0.00 C ATOM 0 H TRP A 74 -10.980 -5.430 1.043 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.679 -5.407 -0.401 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.471 -3.970 2.162 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -7.948 -3.628 1.364 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.161 -3.677 -0.993 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.643 -1.212 -1.697 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -7.683 -1.398 1.898 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -10.649 1.353 -1.011 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.437 1.082 1.824 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -8.945 2.441 0.407 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.211 -6.501 2.648 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.263 -7.042 3.572 1.00 0.00 C ATOM 1129 C LYS A 75 -7.033 -8.525 3.560 1.00 0.00 C ATOM 1130 O LYS A 75 -5.879 -8.937 3.640 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.341 -6.402 4.917 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.227 -4.900 4.786 1.00 0.00 C ATOM 1133 CD LYS A 75 -5.832 -4.434 4.358 1.00 0.00 C ATOM 1134 CE LYS A 75 -4.936 -4.286 5.604 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.585 -3.763 5.319 1.00 0.00 N ATOM 0 H LYS A 75 -9.163 -6.425 3.008 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.306 -6.734 3.150 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.284 -6.662 5.398 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.543 -6.781 5.555 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -7.959 -4.549 4.059 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.480 -4.439 5.741 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.394 -5.152 3.665 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -5.900 -3.482 3.831 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.428 -3.622 6.315 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -4.842 -5.258 6.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.232 -3.243 6.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -2.944 -4.554 5.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.626 -3.123 4.500 1.00 0.00 H new ATOM 1149 N SER A 76 -8.079 -9.351 3.454 1.00 0.00 N ATOM 1150 CA SER A 76 -7.828 -10.793 3.436 1.00 0.00 C ATOM 1151 C SER A 76 -7.015 -11.141 2.202 1.00 0.00 C ATOM 1152 O SER A 76 -6.082 -11.961 2.258 1.00 0.00 O ATOM 1153 CB SER A 76 -9.118 -11.595 3.496 1.00 0.00 C ATOM 1154 OG SER A 76 -9.928 -11.139 4.582 1.00 0.00 O ATOM 0 H SER A 76 -9.056 -9.067 3.383 1.00 0.00 H new ATOM 0 HA SER A 76 -7.260 -11.060 4.327 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.663 -11.493 2.558 1.00 0.00 H new ATOM 0 HB3 SER A 76 -8.892 -12.654 3.620 1.00 0.00 H new ATOM 0 HG SER A 76 -10.509 -10.412 4.274 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.310 -10.437 1.124 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.595 -10.602 -0.110 1.00 0.00 C ATOM 1162 C GLU A 77 -5.210 -9.989 -0.009 1.00 0.00 C ATOM 1163 O GLU A 77 -4.305 -10.448 -0.689 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.361 -9.972 -1.250 1.00 0.00 C ATOM 1165 CG GLU A 77 -8.696 -10.619 -1.544 1.00 0.00 C ATOM 1166 CD GLU A 77 -8.622 -11.616 -2.657 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -8.209 -12.773 -2.439 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -8.987 -11.251 -3.800 1.00 0.00 O ATOM 0 H GLU A 77 -8.052 -9.738 1.088 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.489 -11.669 -0.306 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.525 -8.919 -1.022 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.747 -10.012 -2.149 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.062 -11.112 -0.644 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.421 -9.847 -1.801 1.00 0.00 H new ATOM 1175 N PHE A 78 -5.039 -8.939 0.839 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.728 -8.328 1.016 1.00 0.00 C ATOM 1177 C PHE A 78 -2.744 -9.362 1.473 1.00 0.00 C ATOM 1178 O PHE A 78 -1.648 -9.470 0.940 1.00 0.00 O ATOM 1179 CB PHE A 78 -3.797 -7.166 2.015 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.474 -6.533 2.337 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.804 -5.770 1.399 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -1.913 -6.689 3.592 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.600 -5.179 1.702 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -0.706 -6.102 3.902 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.048 -5.344 2.957 1.00 0.00 C ATOM 0 H PHE A 78 -5.786 -8.518 1.392 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.398 -7.925 0.059 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.462 -6.401 1.615 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.246 -7.527 2.940 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.231 -5.636 0.416 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.427 -7.278 4.337 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.087 -4.586 0.959 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.276 -6.235 4.884 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.897 -4.880 3.198 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.168 -10.137 2.413 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.360 -11.172 2.966 1.00 0.00 C ATOM 1197 C PHE A 79 -2.097 -12.280 1.981 1.00 0.00 C ATOM 1198 O PHE A 79 -0.958 -12.724 1.841 1.00 0.00 O ATOM 1199 CB PHE A 79 -2.984 -11.667 4.246 1.00 0.00 C ATOM 1200 CG PHE A 79 -2.835 -10.641 5.325 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -1.593 -10.392 5.889 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -3.909 -9.863 5.715 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -1.432 -9.399 6.831 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -3.752 -8.859 6.645 1.00 0.00 C ATOM 1205 CZ PHE A 79 -2.516 -8.626 7.205 1.00 0.00 C ATOM 0 H PHE A 79 -4.099 -10.069 2.825 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.378 -10.761 3.201 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.040 -11.884 4.084 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.510 -12.599 4.553 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -0.741 -10.983 5.586 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -4.883 -10.045 5.285 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.463 -9.225 7.275 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -4.599 -8.254 6.935 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.393 -7.840 7.936 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.120 -12.666 1.259 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.011 -13.731 0.286 1.00 0.00 C ATOM 1217 C GLU A 80 -2.050 -13.355 -0.839 1.00 0.00 C ATOM 1218 O GLU A 80 -1.067 -14.045 -1.062 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.388 -14.089 -0.259 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.320 -14.646 0.799 1.00 0.00 C ATOM 1221 CD GLU A 80 -4.829 -15.947 1.380 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -5.134 -17.006 0.810 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -4.154 -15.936 2.429 1.00 0.00 O ATOM 0 H GLU A 80 -4.050 -12.254 1.327 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.600 -14.610 0.782 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.839 -13.201 -0.701 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.277 -14.821 -1.059 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.433 -13.915 1.600 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.308 -14.797 0.364 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.302 -12.218 -1.477 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.492 -11.739 -2.609 1.00 0.00 C ATOM 1232 C ASN A 81 -0.038 -11.550 -2.236 1.00 0.00 C ATOM 1233 O ASN A 81 0.857 -11.890 -3.022 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.049 -10.428 -3.188 1.00 0.00 C ATOM 1235 CG ASN A 81 -3.387 -10.596 -3.875 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -3.681 -11.643 -4.454 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.205 -9.580 -3.824 1.00 0.00 N ATOM 0 H ASN A 81 -3.072 -11.596 -1.230 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.550 -12.516 -3.371 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.150 -9.699 -2.384 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.332 -10.020 -3.900 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.119 -9.638 -4.272 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -3.930 -8.728 -3.336 1.00 0.00 H new ATOM 1244 N CYS A 82 0.209 -11.025 -1.044 1.00 0.00 N ATOM 1245 CA CYS A 82 1.573 -10.810 -0.595 1.00 0.00 C ATOM 1246 C CYS A 82 2.313 -12.131 -0.435 1.00 0.00 C ATOM 1247 O CYS A 82 3.350 -12.340 -1.044 1.00 0.00 O ATOM 1248 CB CYS A 82 1.622 -10.013 0.717 1.00 0.00 C ATOM 1249 SG CYS A 82 0.970 -8.330 0.604 1.00 0.00 S ATOM 0 H CYS A 82 -0.510 -10.743 -0.378 1.00 0.00 H new ATOM 0 HA CYS A 82 2.072 -10.222 -1.365 1.00 0.00 H new ATOM 0 HB2 CYS A 82 1.060 -10.556 1.477 1.00 0.00 H new ATOM 0 HB3 CYS A 82 2.656 -9.965 1.059 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.304 -8.340 0.861 1.00 0.00 H new ATOM 1255 N ARG A 83 1.733 -13.043 0.312 1.00 0.00 N ATOM 1256 CA ARG A 83 2.406 -14.291 0.624 1.00 0.00 C ATOM 1257 C ARG A 83 2.486 -15.192 -0.607 1.00 0.00 C ATOM 1258 O ARG A 83 3.461 -15.888 -0.784 1.00 0.00 O ATOM 1259 CB ARG A 83 1.708 -14.997 1.795 1.00 0.00 C ATOM 1260 CG ARG A 83 1.545 -14.107 3.031 1.00 0.00 C ATOM 1261 CD ARG A 83 2.875 -13.685 3.646 1.00 0.00 C ATOM 1262 NE ARG A 83 2.685 -12.627 4.658 1.00 0.00 N ATOM 1263 CZ ARG A 83 2.932 -12.751 5.985 1.00 0.00 C ATOM 1264 NH1 ARG A 83 3.390 -13.886 6.478 1.00 0.00 N ATOM 1265 NH2 ARG A 83 2.702 -11.727 6.808 1.00 0.00 N ATOM 0 H ARG A 83 0.801 -12.948 0.715 1.00 0.00 H new ATOM 0 HA ARG A 83 3.428 -14.067 0.929 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.725 -15.339 1.470 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.280 -15.884 2.068 1.00 0.00 H new ATOM 0 HG2 ARG A 83 0.979 -13.216 2.757 1.00 0.00 H new ATOM 0 HG3 ARG A 83 0.958 -14.640 3.780 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.356 -14.548 4.105 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.543 -13.327 2.863 1.00 0.00 H new ATOM 0 HE ARG A 83 2.338 -11.725 4.331 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.561 -14.679 5.859 1.00 0.00 H new ATOM 0 HH12 ARG A 83 3.573 -13.971 7.478 1.00 0.00 H new ATOM 0 HH21 ARG A 83 2.339 -10.848 6.439 1.00 0.00 H new ATOM 0 HH22 ARG A 83 2.889 -11.823 7.806 1.00 0.00 H new ATOM 1279 N ASP A 84 1.471 -15.123 -1.468 1.00 0.00 N ATOM 1280 CA ASP A 84 1.399 -15.895 -2.739 1.00 0.00 C ATOM 1281 C ASP A 84 2.623 -15.613 -3.573 1.00 0.00 C ATOM 1282 O ASP A 84 3.425 -16.511 -3.908 1.00 0.00 O ATOM 1283 CB ASP A 84 0.193 -15.411 -3.546 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.114 -16.269 -4.761 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -0.581 -17.400 -4.588 1.00 0.00 O ATOM 1286 OD2 ASP A 84 0.097 -15.809 -5.908 1.00 0.00 O ATOM 0 H ASP A 84 0.658 -14.526 -1.314 1.00 0.00 H new ATOM 0 HA ASP A 84 1.324 -16.957 -2.503 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.682 -15.390 -2.897 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.373 -14.387 -3.872 1.00 0.00 H new ATOM 1291 N THR A 85 2.782 -14.349 -3.842 1.00 0.00 N ATOM 1292 CA THR A 85 3.841 -13.823 -4.632 1.00 0.00 C ATOM 1293 C THR A 85 5.201 -14.060 -3.936 1.00 0.00 C ATOM 1294 O THR A 85 6.216 -14.369 -4.584 1.00 0.00 O ATOM 1295 CB THR A 85 3.556 -12.333 -4.795 1.00 0.00 C ATOM 1296 OG1 THR A 85 2.226 -12.184 -5.344 1.00 0.00 O ATOM 1297 CG2 THR A 85 4.575 -11.634 -5.672 1.00 0.00 C ATOM 0 H THR A 85 2.145 -13.631 -3.498 1.00 0.00 H new ATOM 0 HA THR A 85 3.897 -14.313 -5.604 1.00 0.00 H new ATOM 0 HB THR A 85 3.625 -11.859 -3.816 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.578 -12.097 -4.614 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.322 -10.577 -5.752 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.566 -11.737 -5.231 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.571 -12.084 -6.665 1.00 0.00 H new ATOM 1305 N ALA A 86 5.180 -14.004 -2.608 1.00 0.00 N ATOM 1306 CA ALA A 86 6.359 -14.224 -1.806 1.00 0.00 C ATOM 1307 C ALA A 86 6.837 -15.656 -1.978 1.00 0.00 C ATOM 1308 O ALA A 86 8.032 -15.896 -2.154 1.00 0.00 O ATOM 1309 CB ALA A 86 6.063 -13.936 -0.355 1.00 0.00 C ATOM 0 H ALA A 86 4.340 -13.804 -2.065 1.00 0.00 H new ATOM 0 HA ALA A 86 7.148 -13.548 -2.136 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.960 -14.106 0.240 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.747 -12.898 -0.247 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.268 -14.596 -0.008 1.00 0.00 H new ATOM 1315 N LYS A 87 5.880 -16.599 -1.978 1.00 0.00 N ATOM 1316 CA LYS A 87 6.141 -18.038 -2.193 1.00 0.00 C ATOM 1317 C LYS A 87 6.870 -18.245 -3.496 1.00 0.00 C ATOM 1318 O LYS A 87 7.832 -19.008 -3.564 1.00 0.00 O ATOM 1319 CB LYS A 87 4.829 -18.825 -2.258 1.00 0.00 C ATOM 1320 CG LYS A 87 4.009 -18.824 -0.982 1.00 0.00 C ATOM 1321 CD LYS A 87 4.663 -19.613 0.149 1.00 0.00 C ATOM 1322 CE LYS A 87 4.790 -21.103 -0.173 1.00 0.00 C ATOM 1323 NZ LYS A 87 3.482 -21.729 -0.463 1.00 0.00 N ATOM 0 H LYS A 87 4.894 -16.385 -1.828 1.00 0.00 H new ATOM 0 HA LYS A 87 6.744 -18.392 -1.357 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.219 -18.416 -3.063 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.056 -19.857 -2.523 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.854 -17.795 -0.657 1.00 0.00 H new ATOM 0 HG3 LYS A 87 3.025 -19.245 -1.189 1.00 0.00 H new ATOM 0 HD2 LYS A 87 5.653 -19.202 0.349 1.00 0.00 H new ATOM 0 HD3 LYS A 87 4.077 -19.490 1.060 1.00 0.00 H new ATOM 0 HE2 LYS A 87 5.450 -21.232 -1.031 1.00 0.00 H new ATOM 0 HE3 LYS A 87 5.257 -21.616 0.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 3.591 -22.763 -0.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 2.802 -21.472 0.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 3.132 -21.393 -1.383 1.00 0.00 H new ATOM 1337 N ARG A 88 6.425 -17.534 -4.525 1.00 0.00 N ATOM 1338 CA ARG A 88 7.035 -17.638 -5.851 1.00 0.00 C ATOM 1339 C ARG A 88 8.480 -17.177 -5.825 1.00 0.00 C ATOM 1340 O ARG A 88 9.353 -17.810 -6.417 1.00 0.00 O ATOM 1341 CB ARG A 88 6.236 -16.898 -6.940 1.00 0.00 C ATOM 1342 CG ARG A 88 5.059 -17.689 -7.518 1.00 0.00 C ATOM 1343 CD ARG A 88 4.033 -18.065 -6.474 1.00 0.00 C ATOM 1344 NE ARG A 88 2.932 -18.833 -7.037 1.00 0.00 N ATOM 1345 CZ ARG A 88 1.967 -19.443 -6.338 1.00 0.00 C ATOM 1346 NH1 ARG A 88 1.944 -19.371 -5.002 1.00 0.00 N ATOM 1347 NH2 ARG A 88 1.017 -20.105 -6.984 1.00 0.00 N ATOM 0 H ARG A 88 5.645 -16.879 -4.470 1.00 0.00 H new ATOM 0 HA ARG A 88 7.014 -18.695 -6.118 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.859 -15.964 -6.523 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.913 -16.634 -7.752 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.578 -17.097 -8.296 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.435 -18.595 -7.993 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.514 -18.646 -5.687 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.642 -17.160 -6.009 1.00 0.00 H new ATOM 0 HE ARG A 88 2.892 -18.913 -8.053 1.00 0.00 H new ATOM 0 HH11 ARG A 88 2.666 -18.848 -4.507 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.204 -19.839 -4.479 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.027 -20.146 -8.003 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.277 -20.574 -6.462 1.00 0.00 H new ATOM 1361 N ASN A 89 8.748 -16.118 -5.093 1.00 0.00 N ATOM 1362 CA ASN A 89 10.107 -15.643 -4.985 1.00 0.00 C ATOM 1363 C ASN A 89 10.954 -16.506 -4.053 1.00 0.00 C ATOM 1364 O ASN A 89 12.157 -16.599 -4.232 1.00 0.00 O ATOM 1365 CB ASN A 89 10.229 -14.122 -4.682 1.00 0.00 C ATOM 1366 CG ASN A 89 9.859 -13.260 -5.890 1.00 0.00 C ATOM 1367 OD1 ASN A 89 9.884 -13.730 -7.026 1.00 0.00 O ATOM 1368 ND2 ASN A 89 9.650 -11.991 -5.689 1.00 0.00 N ATOM 0 H ASN A 89 8.056 -15.579 -4.573 1.00 0.00 H new ATOM 0 HA ASN A 89 10.528 -15.757 -5.984 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.580 -13.867 -3.844 1.00 0.00 H new ATOM 0 HB3 ASN A 89 11.250 -13.895 -4.375 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.503 -11.366 -6.482 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.633 -11.621 -4.739 1.00 0.00 H new ATOM 1375 N GLN A 90 10.344 -17.161 -3.057 1.00 0.00 N ATOM 1376 CA GLN A 90 11.120 -18.058 -2.175 1.00 0.00 C ATOM 1377 C GLN A 90 11.544 -19.292 -2.927 1.00 0.00 C ATOM 1378 O GLN A 90 12.664 -19.740 -2.786 1.00 0.00 O ATOM 1379 CB GLN A 90 10.361 -18.509 -0.920 1.00 0.00 C ATOM 1380 CG GLN A 90 9.721 -17.428 -0.070 1.00 0.00 C ATOM 1381 CD GLN A 90 10.608 -16.252 0.187 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.388 -16.226 1.134 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.449 -15.252 -0.623 1.00 0.00 N ATOM 0 H GLN A 90 9.349 -17.095 -2.841 1.00 0.00 H new ATOM 0 HA GLN A 90 11.978 -17.469 -1.852 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.579 -19.202 -1.229 1.00 0.00 H new ATOM 0 HB3 GLN A 90 11.052 -19.069 -0.290 1.00 0.00 H new ATOM 0 HG2 GLN A 90 8.812 -17.084 -0.563 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.422 -17.860 0.885 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.788 -15.322 -1.396 1.00 0.00 H new ATOM 0 HE22 GLN A 90 10.985 -14.395 -0.487 1.00 0.00 H new ATOM 1392 N GLN A 91 10.654 -19.855 -3.727 1.00 0.00 N ATOM 1393 CA GLN A 91 11.002 -21.035 -4.512 1.00 0.00 C ATOM 1394 C GLN A 91 11.980 -20.701 -5.630 1.00 0.00 C ATOM 1395 O GLN A 91 12.674 -21.570 -6.142 1.00 0.00 O ATOM 1396 CB GLN A 91 9.762 -21.771 -5.011 1.00 0.00 C ATOM 1397 CG GLN A 91 8.815 -20.938 -5.829 1.00 0.00 C ATOM 1398 CD GLN A 91 7.516 -21.642 -6.075 1.00 0.00 C ATOM 1399 OE1 GLN A 91 7.347 -22.357 -7.063 1.00 0.00 O ATOM 1400 NE2 GLN A 91 6.594 -21.474 -5.167 1.00 0.00 N ATOM 0 H GLN A 91 9.698 -19.523 -3.852 1.00 0.00 H new ATOM 0 HA GLN A 91 11.520 -21.727 -3.848 1.00 0.00 H new ATOM 0 HB2 GLN A 91 10.081 -22.625 -5.609 1.00 0.00 H new ATOM 0 HB3 GLN A 91 9.223 -22.168 -4.151 1.00 0.00 H new ATOM 0 HG2 GLN A 91 8.625 -19.996 -5.315 1.00 0.00 H new ATOM 0 HG3 GLN A 91 9.280 -20.692 -6.784 1.00 0.00 H new ATOM 0 HE21 GLN A 91 6.774 -20.873 -4.363 1.00 0.00 H new ATOM 0 HE22 GLN A 91 5.694 -21.944 -5.261 1.00 0.00 H new ATOM 1409 N ALA A 92 12.054 -19.423 -5.978 1.00 0.00 N ATOM 1410 CA ALA A 92 13.037 -18.953 -6.936 1.00 0.00 C ATOM 1411 C ALA A 92 14.341 -18.642 -6.189 1.00 0.00 C ATOM 1412 O ALA A 92 15.362 -18.310 -6.782 1.00 0.00 O ATOM 1413 CB ALA A 92 12.524 -17.730 -7.679 1.00 0.00 C ATOM 0 H ALA A 92 11.443 -18.695 -5.609 1.00 0.00 H new ATOM 0 HA ALA A 92 13.224 -19.726 -7.681 1.00 0.00 H new ATOM 0 HB1 ALA A 92 13.277 -17.395 -8.392 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.608 -17.986 -8.212 1.00 0.00 H new ATOM 0 HB3 ALA A 92 12.318 -16.931 -6.966 1.00 0.00 H new ATOM 1419 N GLY A 93 14.268 -18.756 -4.872 1.00 0.00 N ATOM 1420 CA GLY A 93 15.400 -18.580 -3.995 1.00 0.00 C ATOM 1421 C GLY A 93 15.832 -17.149 -3.828 1.00 0.00 C ATOM 1422 O GLY A 93 17.002 -16.873 -3.565 1.00 0.00 O ATOM 0 H GLY A 93 13.402 -18.977 -4.380 1.00 0.00 H new ATOM 0 HA2 GLY A 93 15.154 -18.991 -3.016 1.00 0.00 H new ATOM 0 HA3 GLY A 93 16.239 -19.159 -4.382 1.00 0.00 H new ATOM 1426 N ASN A 94 14.903 -16.241 -3.977 1.00 0.00 N ATOM 1427 CA ASN A 94 15.183 -14.810 -3.826 1.00 0.00 C ATOM 1428 C ASN A 94 15.472 -14.452 -2.395 1.00 0.00 C ATOM 1429 O ASN A 94 16.334 -13.627 -2.133 1.00 0.00 O ATOM 1430 CB ASN A 94 14.013 -13.923 -4.308 1.00 0.00 C ATOM 1431 CG ASN A 94 13.750 -13.965 -5.798 1.00 0.00 C ATOM 1432 OD1 ASN A 94 13.988 -14.966 -6.463 1.00 0.00 O ATOM 1433 ND2 ASN A 94 13.232 -12.887 -6.333 1.00 0.00 N ATOM 0 H ASN A 94 13.932 -16.456 -4.205 1.00 0.00 H new ATOM 0 HA ASN A 94 16.058 -14.620 -4.448 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.106 -14.228 -3.786 1.00 0.00 H new ATOM 0 HB3 ASN A 94 14.216 -12.892 -4.019 1.00 0.00 H new ATOM 0 HD21 ASN A 94 13.016 -12.866 -7.330 1.00 0.00 H new ATOM 0 HD22 ASN A 94 13.045 -12.069 -5.753 1.00 0.00 H new ATOM 1440 N GLY A 95 14.755 -15.092 -1.465 1.00 0.00 N ATOM 1441 CA GLY A 95 14.857 -14.721 -0.057 1.00 0.00 C ATOM 1442 C GLY A 95 14.480 -13.265 0.127 1.00 0.00 C ATOM 1443 O GLY A 95 15.128 -12.518 0.867 1.00 0.00 O ATOM 0 H GLY A 95 14.109 -15.857 -1.661 1.00 0.00 H new ATOM 0 HA2 GLY A 95 14.201 -15.353 0.542 1.00 0.00 H new ATOM 0 HA3 GLY A 95 15.874 -14.889 0.299 1.00 0.00 H new ATOM 1447 N TRP A 96 13.426 -12.888 -0.535 1.00 0.00 N ATOM 1448 CA TRP A 96 12.998 -11.522 -0.637 1.00 0.00 C ATOM 1449 C TRP A 96 11.493 -11.579 -0.633 1.00 0.00 C ATOM 1450 O TRP A 96 10.961 -12.679 -0.736 1.00 0.00 O ATOM 1451 CB TRP A 96 13.513 -11.052 -1.995 1.00 0.00 C ATOM 1452 CG TRP A 96 13.641 -9.588 -2.224 1.00 0.00 C ATOM 1453 CD1 TRP A 96 14.009 -8.624 -1.334 1.00 0.00 C ATOM 1454 CD2 TRP A 96 13.492 -8.939 -3.481 1.00 0.00 C ATOM 1455 NE1 TRP A 96 14.069 -7.409 -1.969 1.00 0.00 N ATOM 1456 CE2 TRP A 96 13.757 -7.587 -3.290 1.00 0.00 C ATOM 1457 CE3 TRP A 96 13.142 -9.382 -4.753 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 13.700 -6.676 -4.327 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 13.083 -8.478 -5.780 1.00 0.00 C ATOM 1460 CH2 TRP A 96 13.361 -7.139 -5.564 1.00 0.00 C ATOM 0 H TRP A 96 12.822 -13.541 -1.034 1.00 0.00 H new ATOM 0 HA TRP A 96 13.351 -10.861 0.154 1.00 0.00 H new ATOM 0 HB2 TRP A 96 14.493 -11.502 -2.155 1.00 0.00 H new ATOM 0 HB3 TRP A 96 12.849 -11.453 -2.761 1.00 0.00 H new ATOM 0 HD1 TRP A 96 14.221 -8.791 -0.288 1.00 0.00 H new ATOM 0 HE1 TRP A 96 14.307 -6.520 -1.529 1.00 0.00 H new ATOM 0 HE3 TRP A 96 12.920 -10.424 -4.928 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 13.917 -5.631 -4.163 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 12.816 -8.814 -6.771 1.00 0.00 H new ATOM 0 HH2 TRP A 96 13.308 -6.447 -6.392 1.00 0.00 H new ATOM 1471 N ASP A 97 10.815 -10.452 -0.446 1.00 0.00 N ATOM 1472 CA ASP A 97 9.332 -10.361 -0.544 1.00 0.00 C ATOM 1473 C ASP A 97 8.572 -10.951 0.642 1.00 0.00 C ATOM 1474 O ASP A 97 7.707 -10.319 1.150 1.00 0.00 O ATOM 1475 CB ASP A 97 8.773 -10.938 -1.853 1.00 0.00 C ATOM 1476 CG ASP A 97 9.293 -10.241 -3.071 1.00 0.00 C ATOM 1477 OD1 ASP A 97 10.347 -10.651 -3.571 1.00 0.00 O ATOM 1478 OD2 ASP A 97 8.651 -9.309 -3.561 1.00 0.00 O ATOM 0 H ASP A 97 11.264 -9.564 -0.221 1.00 0.00 H new ATOM 0 HA ASP A 97 9.156 -9.285 -0.531 1.00 0.00 H new ATOM 0 HB2 ASP A 97 9.024 -11.997 -1.913 1.00 0.00 H new ATOM 0 HB3 ASP A 97 7.685 -10.869 -1.838 1.00 0.00 H new ATOM 1483 N PHE A 98 8.896 -12.149 1.073 1.00 0.00 N ATOM 1484 CA PHE A 98 8.148 -12.801 2.158 1.00 0.00 C ATOM 1485 C PHE A 98 8.023 -11.951 3.443 1.00 0.00 C ATOM 1486 O PHE A 98 6.935 -11.883 4.040 1.00 0.00 O ATOM 1487 CB PHE A 98 8.635 -14.237 2.420 1.00 0.00 C ATOM 1488 CG PHE A 98 7.889 -14.936 3.523 1.00 0.00 C ATOM 1489 CD1 PHE A 98 6.549 -15.257 3.363 1.00 0.00 C ATOM 1490 CD2 PHE A 98 8.518 -15.272 4.711 1.00 0.00 C ATOM 1491 CE1 PHE A 98 5.853 -15.892 4.366 1.00 0.00 C ATOM 1492 CE2 PHE A 98 7.821 -15.912 5.719 1.00 0.00 C ATOM 1493 CZ PHE A 98 6.488 -16.223 5.545 1.00 0.00 C ATOM 0 H PHE A 98 9.668 -12.701 0.699 1.00 0.00 H new ATOM 0 HA PHE A 98 7.124 -12.884 1.795 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.537 -14.817 1.503 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.696 -14.212 2.670 1.00 0.00 H new ATOM 0 HD1 PHE A 98 6.046 -15.006 2.441 1.00 0.00 H new ATOM 0 HD2 PHE A 98 9.562 -15.032 4.851 1.00 0.00 H new ATOM 0 HE1 PHE A 98 4.809 -16.131 4.230 1.00 0.00 H new ATOM 0 HE2 PHE A 98 8.320 -16.168 6.642 1.00 0.00 H new ATOM 0 HZ PHE A 98 5.943 -16.725 6.331 1.00 0.00 H new ATOM 1503 N ASP A 99 9.106 -11.346 3.898 1.00 0.00 N ATOM 1504 CA ASP A 99 8.982 -10.422 5.027 1.00 0.00 C ATOM 1505 C ASP A 99 8.672 -9.030 4.480 1.00 0.00 C ATOM 1506 O ASP A 99 7.719 -8.396 4.880 1.00 0.00 O ATOM 1507 CB ASP A 99 10.242 -10.363 5.895 1.00 0.00 C ATOM 1508 CG ASP A 99 9.982 -9.943 7.361 1.00 0.00 C ATOM 1509 OD1 ASP A 99 9.757 -8.749 7.651 1.00 0.00 O ATOM 1510 OD2 ASP A 99 10.031 -10.826 8.255 1.00 0.00 O ATOM 0 H ASP A 99 10.048 -11.465 3.526 1.00 0.00 H new ATOM 0 HA ASP A 99 8.179 -10.785 5.668 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.720 -11.342 5.889 1.00 0.00 H new ATOM 0 HB3 ASP A 99 10.946 -9.662 5.447 1.00 0.00 H new ATOM 1515 N MET A 100 9.499 -8.616 3.506 1.00 0.00 N ATOM 1516 CA MET A 100 9.452 -7.281 2.842 1.00 0.00 C ATOM 1517 C MET A 100 8.048 -6.871 2.358 1.00 0.00 C ATOM 1518 O MET A 100 7.554 -5.789 2.681 1.00 0.00 O ATOM 1519 CB MET A 100 10.385 -7.282 1.622 1.00 0.00 C ATOM 1520 CG MET A 100 11.881 -7.360 1.904 1.00 0.00 C ATOM 1521 SD MET A 100 12.548 -5.843 2.605 1.00 0.00 S ATOM 1522 CE MET A 100 14.284 -6.263 2.737 1.00 0.00 C ATOM 0 H MET A 100 10.244 -9.210 3.141 1.00 0.00 H new ATOM 0 HA MET A 100 9.763 -6.562 3.600 1.00 0.00 H new ATOM 0 HB2 MET A 100 10.114 -8.126 0.987 1.00 0.00 H new ATOM 0 HB3 MET A 100 10.194 -6.376 1.047 1.00 0.00 H new ATOM 0 HG2 MET A 100 12.073 -8.185 2.590 1.00 0.00 H new ATOM 0 HG3 MET A 100 12.408 -7.587 0.977 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.832 -5.419 3.157 1.00 0.00 H new ATOM 0 HE2 MET A 100 14.400 -7.130 3.387 1.00 0.00 H new ATOM 0 HE3 MET A 100 14.678 -6.495 1.748 1.00 0.00 H new ATOM 1532 N LEU A 101 7.442 -7.727 1.580 1.00 0.00 N ATOM 1533 CA LEU A 101 6.153 -7.485 0.980 1.00 0.00 C ATOM 1534 C LEU A 101 5.046 -7.931 1.913 1.00 0.00 C ATOM 1535 O LEU A 101 4.628 -9.098 1.866 1.00 0.00 O ATOM 1536 CB LEU A 101 6.065 -8.249 -0.362 1.00 0.00 C ATOM 1537 CG LEU A 101 4.676 -8.495 -0.951 1.00 0.00 C ATOM 1538 CD1 LEU A 101 4.031 -7.258 -1.459 1.00 0.00 C ATOM 1539 CD2 LEU A 101 4.731 -9.566 -1.986 1.00 0.00 C ATOM 0 H LEU A 101 7.839 -8.635 1.339 1.00 0.00 H new ATOM 0 HA LEU A 101 6.035 -6.417 0.797 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.649 -7.699 -1.100 1.00 0.00 H new ATOM 0 HB3 LEU A 101 6.549 -9.217 -0.229 1.00 0.00 H new ATOM 0 HG LEU A 101 4.038 -8.839 -0.137 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.048 -7.500 -1.864 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.921 -6.543 -0.643 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.649 -6.821 -2.243 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.734 -9.728 -2.395 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.407 -9.264 -2.786 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.093 -10.490 -1.535 1.00 0.00 H new ATOM 1551 N THR A 102 4.696 -7.018 2.829 1.00 0.00 N ATOM 1552 CA THR A 102 3.574 -7.077 3.758 1.00 0.00 C ATOM 1553 C THR A 102 4.107 -6.598 5.130 1.00 0.00 C ATOM 1554 O THR A 102 5.256 -6.182 5.221 1.00 0.00 O ATOM 1555 CB THR A 102 2.919 -8.516 3.907 1.00 0.00 C ATOM 1556 OG1 THR A 102 1.628 -8.430 4.527 1.00 0.00 O ATOM 1557 CG2 THR A 102 3.789 -9.468 4.716 1.00 0.00 C ATOM 0 H THR A 102 5.233 -6.158 2.943 1.00 0.00 H new ATOM 0 HA THR A 102 2.776 -6.445 3.368 1.00 0.00 H new ATOM 0 HB THR A 102 2.821 -8.912 2.896 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.150 -7.649 4.179 1.00 0.00 H new ATOM 0 HG21 THR A 102 3.297 -10.438 4.789 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.754 -9.587 4.223 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.940 -9.062 5.716 1.00 0.00 H new ATOM 1661 N ASP A 111 10.340 0.613 7.454 1.00 0.00 N ATOM 1662 CA ASP A 111 11.727 0.638 6.970 1.00 0.00 C ATOM 1663 C ASP A 111 11.923 -0.069 5.659 1.00 0.00 C ATOM 1664 O ASP A 111 12.385 0.552 4.683 1.00 0.00 O ATOM 1665 CB ASP A 111 12.703 0.066 7.997 1.00 0.00 C ATOM 1666 CG ASP A 111 12.829 0.915 9.225 1.00 0.00 C ATOM 1667 OD1 ASP A 111 13.589 1.904 9.215 1.00 0.00 O ATOM 1668 OD2 ASP A 111 12.185 0.608 10.242 1.00 0.00 O ATOM 0 HA ASP A 111 11.941 1.695 6.812 1.00 0.00 H new ATOM 0 HB2 ASP A 111 12.374 -0.932 8.285 1.00 0.00 H new ATOM 0 HB3 ASP A 111 13.684 -0.043 7.535 1.00 0.00 H new ATOM 1673 N ALA A 112 11.537 -1.346 5.610 1.00 0.00 N ATOM 1674 CA ALA A 112 11.760 -2.211 4.442 1.00 0.00 C ATOM 1675 C ALA A 112 11.373 -1.539 3.153 1.00 0.00 C ATOM 1676 O ALA A 112 12.099 -1.607 2.165 1.00 0.00 O ATOM 1677 CB ALA A 112 11.017 -3.512 4.589 1.00 0.00 C ATOM 0 H ALA A 112 11.059 -1.814 6.380 1.00 0.00 H new ATOM 0 HA ALA A 112 12.830 -2.414 4.400 1.00 0.00 H new ATOM 0 HB1 ALA A 112 11.197 -4.135 3.713 1.00 0.00 H new ATOM 0 HB2 ALA A 112 11.366 -4.031 5.482 1.00 0.00 H new ATOM 0 HB3 ALA A 112 9.949 -3.313 4.679 1.00 0.00 H new ATOM 1683 N GLN A 113 10.261 -0.860 3.162 1.00 0.00 N ATOM 1684 CA GLN A 113 9.848 -0.172 2.001 1.00 0.00 C ATOM 1685 C GLN A 113 10.367 1.177 1.720 1.00 0.00 C ATOM 1686 O GLN A 113 10.346 1.621 0.576 1.00 0.00 O ATOM 1687 CB GLN A 113 8.590 -0.618 1.316 1.00 0.00 C ATOM 1688 CG GLN A 113 8.911 -1.826 0.451 1.00 0.00 C ATOM 1689 CD GLN A 113 9.870 -1.438 -0.694 1.00 0.00 C ATOM 1690 OE1 GLN A 113 9.453 -1.109 -1.795 1.00 0.00 O ATOM 1691 NE2 GLN A 113 11.161 -1.406 -0.411 1.00 0.00 N ATOM 0 H GLN A 113 9.635 -0.776 3.963 1.00 0.00 H new ATOM 0 HA GLN A 113 10.570 -0.662 1.347 1.00 0.00 H new ATOM 0 HB2 GLN A 113 7.828 -0.872 2.053 1.00 0.00 H new ATOM 0 HB3 GLN A 113 8.186 0.189 0.704 1.00 0.00 H new ATOM 0 HG2 GLN A 113 9.363 -2.607 1.062 1.00 0.00 H new ATOM 0 HG3 GLN A 113 7.991 -2.238 0.037 1.00 0.00 H new ATOM 0 HE21 GLN A 113 11.487 -1.685 0.514 1.00 0.00 H new ATOM 0 HE22 GLN A 113 11.831 -1.102 -1.118 1.00 0.00 H new ATOM 1700 N MET A 114 10.904 1.836 2.715 1.00 0.00 N ATOM 1701 CA MET A 114 11.505 3.112 2.453 1.00 0.00 C ATOM 1702 C MET A 114 12.853 2.927 1.744 1.00 0.00 C ATOM 1703 O MET A 114 13.392 3.874 1.164 1.00 0.00 O ATOM 1704 CB MET A 114 11.677 3.925 3.727 1.00 0.00 C ATOM 1705 CG MET A 114 12.931 3.588 4.513 1.00 0.00 C ATOM 1706 SD MET A 114 13.159 4.606 5.958 1.00 0.00 S ATOM 1707 CE MET A 114 14.705 3.927 6.554 1.00 0.00 C ATOM 0 H MET A 114 10.937 1.521 3.684 1.00 0.00 H new ATOM 0 HA MET A 114 10.834 3.669 1.799 1.00 0.00 H new ATOM 0 HB2 MET A 114 11.696 4.984 3.470 1.00 0.00 H new ATOM 0 HB3 MET A 114 10.808 3.768 4.366 1.00 0.00 H new ATOM 0 HG2 MET A 114 12.889 2.542 4.818 1.00 0.00 H new ATOM 0 HG3 MET A 114 13.798 3.696 3.862 1.00 0.00 H new ATOM 0 HE1 MET A 114 14.978 4.412 7.491 1.00 0.00 H new ATOM 0 HE2 MET A 114 14.592 2.855 6.719 1.00 0.00 H new ATOM 0 HE3 MET A 114 15.487 4.100 5.815 1.00 0.00 H new ATOM 1717 N GLN A 115 13.433 1.716 1.827 1.00 0.00 N ATOM 1718 CA GLN A 115 14.644 1.466 1.045 1.00 0.00 C ATOM 1719 C GLN A 115 14.372 1.441 -0.445 1.00 0.00 C ATOM 1720 O GLN A 115 15.214 1.875 -1.222 1.00 0.00 O ATOM 1721 CB GLN A 115 15.496 0.269 1.503 1.00 0.00 C ATOM 1722 CG GLN A 115 16.537 0.662 2.545 1.00 0.00 C ATOM 1723 CD GLN A 115 15.967 1.028 3.888 1.00 0.00 C ATOM 1724 OE1 GLN A 115 15.002 0.299 4.326 1.00 0.00 O flip ATOM 1725 NE2 GLN A 115 16.487 1.906 4.570 1.00 0.00 N flip ATOM 0 H GLN A 115 13.102 0.937 2.396 1.00 0.00 H new ATOM 0 HA GLN A 115 15.273 2.331 1.255 1.00 0.00 H new ATOM 0 HB2 GLN A 115 14.844 -0.500 1.917 1.00 0.00 H new ATOM 0 HB3 GLN A 115 15.997 -0.168 0.640 1.00 0.00 H new ATOM 0 HG2 GLN A 115 17.234 -0.166 2.674 1.00 0.00 H new ATOM 0 HG3 GLN A 115 17.112 1.507 2.166 1.00 0.00 H new ATOM 0 HE21 GLN A 115 17.251 2.464 4.188 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.156 2.078 5.519 1.00 0.00 H new ATOM 1734 N TYR A 116 13.175 0.974 -0.828 1.00 0.00 N ATOM 1735 CA TYR A 116 12.711 0.999 -2.209 1.00 0.00 C ATOM 1736 C TYR A 116 13.594 0.248 -3.221 1.00 0.00 C ATOM 1737 O TYR A 116 14.688 0.677 -3.589 1.00 0.00 O ATOM 1738 CB TYR A 116 12.423 2.447 -2.678 1.00 0.00 C ATOM 1739 CG TYR A 116 12.289 2.590 -4.176 1.00 0.00 C ATOM 1740 CD1 TYR A 116 11.199 2.074 -4.861 1.00 0.00 C ATOM 1741 CD2 TYR A 116 13.295 3.205 -4.913 1.00 0.00 C ATOM 1742 CE1 TYR A 116 11.117 2.173 -6.234 1.00 0.00 C ATOM 1743 CE2 TYR A 116 13.223 3.299 -6.278 1.00 0.00 C ATOM 1744 CZ TYR A 116 12.135 2.787 -6.937 1.00 0.00 C ATOM 1745 OH TYR A 116 12.074 2.873 -8.307 1.00 0.00 O ATOM 0 H TYR A 116 12.502 0.567 -0.178 1.00 0.00 H new ATOM 0 HA TYR A 116 11.780 0.433 -2.192 1.00 0.00 H new ATOM 0 HB2 TYR A 116 11.504 2.795 -2.206 1.00 0.00 H new ATOM 0 HB3 TYR A 116 13.226 3.097 -2.331 1.00 0.00 H new ATOM 0 HD1 TYR A 116 10.405 1.589 -4.313 1.00 0.00 H new ATOM 0 HD2 TYR A 116 14.151 3.617 -4.399 1.00 0.00 H new ATOM 0 HE1 TYR A 116 10.261 1.772 -6.757 1.00 0.00 H new ATOM 0 HE2 TYR A 116 14.019 3.774 -6.832 1.00 0.00 H new ATOM 0 HH TYR A 116 12.870 3.336 -8.641 1.00 0.00 H new ATOM 1755 N ASP A 117 13.099 -0.845 -3.674 1.00 0.00 N ATOM 1756 CA ASP A 117 13.692 -1.530 -4.785 1.00 0.00 C ATOM 1757 C ASP A 117 12.614 -1.548 -5.827 1.00 0.00 C ATOM 1758 O ASP A 117 11.499 -1.898 -5.499 1.00 0.00 O ATOM 1759 CB ASP A 117 14.100 -2.965 -4.434 1.00 0.00 C ATOM 1760 CG ASP A 117 14.741 -3.679 -5.615 1.00 0.00 C ATOM 1761 OD1 ASP A 117 14.011 -4.136 -6.514 1.00 0.00 O ATOM 1762 OD2 ASP A 117 15.992 -3.791 -5.655 1.00 0.00 O ATOM 0 H ASP A 117 12.270 -1.299 -3.291 1.00 0.00 H new ATOM 0 HA ASP A 117 14.606 -1.034 -5.111 1.00 0.00 H new ATOM 0 HB2 ASP A 117 14.798 -2.949 -3.597 1.00 0.00 H new ATOM 0 HB3 ASP A 117 13.222 -3.522 -4.106 1.00 0.00 H new ATOM 1767 N PRO A 118 12.888 -1.137 -7.067 1.00 0.00 N ATOM 1768 CA PRO A 118 11.868 -1.059 -8.132 1.00 0.00 C ATOM 1769 C PRO A 118 11.121 -2.381 -8.389 1.00 0.00 C ATOM 1770 O PRO A 118 9.934 -2.375 -8.770 1.00 0.00 O ATOM 1771 CB PRO A 118 12.660 -0.630 -9.372 1.00 0.00 C ATOM 1772 CG PRO A 118 14.093 -0.860 -9.024 1.00 0.00 C ATOM 1773 CD PRO A 118 14.201 -0.695 -7.547 1.00 0.00 C ATOM 0 HA PRO A 118 11.075 -0.366 -7.852 1.00 0.00 H new ATOM 0 HB2 PRO A 118 12.369 -1.213 -10.246 1.00 0.00 H new ATOM 0 HB3 PRO A 118 12.477 0.417 -9.613 1.00 0.00 H new ATOM 0 HG2 PRO A 118 14.411 -1.858 -9.327 1.00 0.00 H new ATOM 0 HG3 PRO A 118 14.737 -0.149 -9.542 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.007 -1.300 -7.132 1.00 0.00 H new ATOM 0 HD3 PRO A 118 14.404 0.340 -7.271 1.00 0.00 H new ATOM 1781 N GLY A 119 11.753 -3.492 -8.051 1.00 0.00 N ATOM 1782 CA GLY A 119 11.152 -4.764 -8.317 1.00 0.00 C ATOM 1783 C GLY A 119 10.282 -5.135 -7.153 1.00 0.00 C ATOM 1784 O GLY A 119 9.138 -5.520 -7.321 1.00 0.00 O ATOM 0 H GLY A 119 12.667 -3.528 -7.600 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.561 -4.719 -9.232 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.921 -5.521 -8.471 1.00 0.00 H new ATOM 1788 N LEU A 120 10.829 -4.947 -5.971 1.00 0.00 N ATOM 1789 CA LEU A 120 10.106 -5.207 -4.717 1.00 0.00 C ATOM 1790 C LEU A 120 8.879 -4.302 -4.654 1.00 0.00 C ATOM 1791 O LEU A 120 7.768 -4.740 -4.351 1.00 0.00 O ATOM 1792 CB LEU A 120 11.012 -4.869 -3.541 1.00 0.00 C ATOM 1793 CG LEU A 120 10.454 -5.112 -2.146 1.00 0.00 C ATOM 1794 CD1 LEU A 120 10.082 -6.577 -1.959 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.467 -4.675 -1.105 1.00 0.00 C ATOM 0 H LEU A 120 11.783 -4.611 -5.838 1.00 0.00 H new ATOM 0 HA LEU A 120 9.808 -6.255 -4.676 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.930 -5.447 -3.644 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.287 -3.817 -3.617 1.00 0.00 H new ATOM 0 HG LEU A 120 9.546 -4.521 -2.023 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.686 -6.726 -0.955 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.326 -6.857 -2.693 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.968 -7.198 -2.096 1.00 0.00 H new ATOM 0 HD21 LEU A 120 11.063 -4.851 -0.108 1.00 0.00 H new ATOM 0 HD22 LEU A 120 12.387 -5.246 -1.230 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.680 -3.613 -1.228 1.00 0.00 H new ATOM 1807 N PHE A 121 9.118 -3.024 -4.956 1.00 0.00 N ATOM 1808 CA PHE A 121 8.054 -2.043 -4.970 1.00 0.00 C ATOM 1809 C PHE A 121 6.947 -2.455 -5.950 1.00 0.00 C ATOM 1810 O PHE A 121 5.768 -2.241 -5.685 1.00 0.00 O ATOM 1811 CB PHE A 121 8.567 -0.634 -5.313 1.00 0.00 C ATOM 1812 CG PHE A 121 7.540 0.430 -5.039 1.00 0.00 C ATOM 1813 CD1 PHE A 121 7.458 1.007 -3.785 1.00 0.00 C ATOM 1814 CD2 PHE A 121 6.631 0.822 -6.009 1.00 0.00 C ATOM 1815 CE1 PHE A 121 6.494 1.948 -3.504 1.00 0.00 C ATOM 1816 CE2 PHE A 121 5.669 1.768 -5.734 1.00 0.00 C ATOM 1817 CZ PHE A 121 5.598 2.327 -4.480 1.00 0.00 C ATOM 0 H PHE A 121 10.039 -2.654 -5.192 1.00 0.00 H new ATOM 0 HA PHE A 121 7.643 -2.007 -3.961 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.466 -0.426 -4.733 1.00 0.00 H new ATOM 0 HB3 PHE A 121 8.851 -0.599 -6.365 1.00 0.00 H new ATOM 0 HD1 PHE A 121 8.159 0.716 -3.017 1.00 0.00 H new ATOM 0 HD2 PHE A 121 6.678 0.380 -6.993 1.00 0.00 H new ATOM 0 HE1 PHE A 121 6.440 2.389 -2.520 1.00 0.00 H new ATOM 0 HE2 PHE A 121 4.972 2.070 -6.502 1.00 0.00 H new ATOM 0 HZ PHE A 121 4.840 3.064 -4.260 1.00 0.00 H new ATOM 1827 N ALA A 122 7.336 -3.052 -7.079 1.00 0.00 N ATOM 1828 CA ALA A 122 6.364 -3.527 -8.052 1.00 0.00 C ATOM 1829 C ALA A 122 5.419 -4.546 -7.430 1.00 0.00 C ATOM 1830 O ALA A 122 4.196 -4.386 -7.531 1.00 0.00 O ATOM 1831 CB ALA A 122 7.035 -4.105 -9.273 1.00 0.00 C ATOM 0 H ALA A 122 8.310 -3.215 -7.336 1.00 0.00 H new ATOM 0 HA ALA A 122 5.779 -2.664 -8.370 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.277 -4.449 -9.976 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.649 -3.340 -9.747 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.665 -4.945 -8.979 1.00 0.00 H new ATOM 1837 N GLN A 123 5.981 -5.589 -6.777 1.00 0.00 N ATOM 1838 CA GLN A 123 5.151 -6.578 -6.078 1.00 0.00 C ATOM 1839 C GLN A 123 4.204 -5.913 -5.105 1.00 0.00 C ATOM 1840 O GLN A 123 2.993 -6.131 -5.171 1.00 0.00 O ATOM 1841 CB GLN A 123 5.946 -7.628 -5.277 1.00 0.00 C ATOM 1842 CG GLN A 123 6.632 -8.740 -6.049 1.00 0.00 C ATOM 1843 CD GLN A 123 7.866 -8.320 -6.770 1.00 0.00 C ATOM 1844 OE1 GLN A 123 7.821 -7.946 -7.943 1.00 0.00 O ATOM 1845 NE2 GLN A 123 8.977 -8.391 -6.092 1.00 0.00 N ATOM 0 H GLN A 123 6.985 -5.760 -6.723 1.00 0.00 H new ATOM 0 HA GLN A 123 4.618 -7.084 -6.883 1.00 0.00 H new ATOM 0 HB2 GLN A 123 6.707 -7.103 -4.700 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.265 -8.089 -4.561 1.00 0.00 H new ATOM 0 HG2 GLN A 123 6.886 -9.543 -5.357 1.00 0.00 H new ATOM 0 HG3 GLN A 123 5.927 -9.153 -6.771 1.00 0.00 H new ATOM 0 HE21 GLN A 123 8.963 -8.707 -5.122 1.00 0.00 H new ATOM 0 HE22 GLN A 123 9.860 -8.131 -6.531 1.00 0.00 H new ATOM 1854 N ILE A 124 4.756 -5.089 -4.213 1.00 0.00 N ATOM 1855 CA ILE A 124 3.978 -4.491 -3.143 1.00 0.00 C ATOM 1856 C ILE A 124 2.832 -3.630 -3.673 1.00 0.00 C ATOM 1857 O ILE A 124 1.716 -3.712 -3.172 1.00 0.00 O ATOM 1858 CB ILE A 124 4.861 -3.690 -2.095 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.294 -2.347 -2.649 1.00 0.00 C ATOM 1860 CG2 ILE A 124 6.087 -4.500 -1.668 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.100 -1.515 -1.697 1.00 0.00 C ATOM 0 H ILE A 124 5.741 -4.824 -4.216 1.00 0.00 H new ATOM 0 HA ILE A 124 3.540 -5.330 -2.602 1.00 0.00 H new ATOM 0 HB ILE A 124 4.238 -3.516 -1.218 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.880 -2.512 -3.553 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.407 -1.785 -2.942 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.671 -3.924 -0.950 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.764 -5.434 -1.207 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.700 -4.720 -2.542 1.00 0.00 H new ATOM 0 HD11 ILE A 124 6.367 -0.572 -2.174 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.512 -1.314 -0.801 1.00 0.00 H new ATOM 0 HD13 ILE A 124 7.007 -2.053 -1.422 1.00 0.00 H new ATOM 1873 N GLN A 125 3.096 -2.870 -4.724 1.00 0.00 N ATOM 1874 CA GLN A 125 2.115 -1.959 -5.269 1.00 0.00 C ATOM 1875 C GLN A 125 0.953 -2.723 -5.879 1.00 0.00 C ATOM 1876 O GLN A 125 -0.227 -2.479 -5.537 1.00 0.00 O ATOM 1877 CB GLN A 125 2.739 -1.076 -6.332 1.00 0.00 C ATOM 1878 CG GLN A 125 1.831 0.050 -6.746 1.00 0.00 C ATOM 1879 CD GLN A 125 2.326 0.829 -7.931 1.00 0.00 C ATOM 1880 OE1 GLN A 125 3.527 0.903 -8.207 1.00 0.00 O ATOM 1881 NE2 GLN A 125 1.419 1.459 -8.606 1.00 0.00 N ATOM 0 H GLN A 125 3.989 -2.870 -5.216 1.00 0.00 H new ATOM 0 HA GLN A 125 1.749 -1.338 -4.451 1.00 0.00 H new ATOM 0 HB2 GLN A 125 3.675 -0.665 -5.955 1.00 0.00 H new ATOM 0 HB3 GLN A 125 2.985 -1.681 -7.205 1.00 0.00 H new ATOM 0 HG2 GLN A 125 0.847 -0.357 -6.977 1.00 0.00 H new ATOM 0 HG3 GLN A 125 1.705 0.730 -5.904 1.00 0.00 H new ATOM 0 HE21 GLN A 125 0.437 1.372 -8.346 1.00 0.00 H new ATOM 0 HE22 GLN A 125 1.687 2.043 -9.398 1.00 0.00 H new ATOM 1890 N ALA A 126 1.292 -3.657 -6.764 1.00 0.00 N ATOM 1891 CA ALA A 126 0.313 -4.458 -7.462 1.00 0.00 C ATOM 1892 C ALA A 126 -0.512 -5.255 -6.482 1.00 0.00 C ATOM 1893 O ALA A 126 -1.739 -5.176 -6.491 1.00 0.00 O ATOM 1894 CB ALA A 126 0.995 -5.391 -8.451 1.00 0.00 C ATOM 0 H ALA A 126 2.257 -3.873 -7.012 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.348 -3.788 -8.012 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.242 -5.987 -8.968 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.555 -4.804 -9.179 1.00 0.00 H new ATOM 0 HB3 ALA A 126 1.677 -6.052 -7.916 1.00 0.00 H new ATOM 1900 N ALA A 127 0.173 -5.968 -5.590 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.477 -6.822 -4.612 1.00 0.00 C ATOM 1902 C ALA A 127 -1.422 -6.033 -3.722 1.00 0.00 C ATOM 1903 O ALA A 127 -2.539 -6.504 -3.418 1.00 0.00 O ATOM 1904 CB ALA A 127 0.557 -7.555 -3.765 1.00 0.00 C ATOM 0 H ALA A 127 1.191 -5.967 -5.529 1.00 0.00 H new ATOM 0 HA ALA A 127 -1.067 -7.556 -5.160 1.00 0.00 H new ATOM 0 HB1 ALA A 127 0.049 -8.189 -3.039 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.184 -8.171 -4.409 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.178 -6.829 -3.241 1.00 0.00 H new ATOM 1910 N ALA A 128 -0.997 -4.824 -3.325 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.796 -4.003 -2.462 1.00 0.00 C ATOM 1912 C ALA A 128 -3.114 -3.629 -3.092 1.00 0.00 C ATOM 1913 O ALA A 128 -4.084 -4.059 -2.618 1.00 0.00 O ATOM 1914 CB ALA A 128 -1.053 -2.771 -1.981 1.00 0.00 C ATOM 0 H ALA A 128 -0.105 -4.412 -3.598 1.00 0.00 H new ATOM 0 HA ALA A 128 -2.012 -4.612 -1.584 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.703 -2.185 -1.331 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.165 -3.075 -1.427 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.757 -2.167 -2.839 1.00 0.00 H new ATOM 1920 N THR A 129 -3.133 -2.902 -4.195 1.00 0.00 N ATOM 1921 CA THR A 129 -4.457 -2.496 -4.782 1.00 0.00 C ATOM 1922 C THR A 129 -5.323 -3.724 -5.200 1.00 0.00 C ATOM 1923 O THR A 129 -6.601 -3.707 -5.091 1.00 0.00 O ATOM 1924 CB THR A 129 -4.323 -1.438 -5.942 1.00 0.00 C ATOM 1925 OG1 THR A 129 -5.614 -1.087 -6.493 1.00 0.00 O ATOM 1926 CG2 THR A 129 -3.394 -1.912 -7.055 1.00 0.00 C ATOM 0 H THR A 129 -2.309 -2.580 -4.702 1.00 0.00 H new ATOM 0 HA THR A 129 -4.994 -1.991 -3.979 1.00 0.00 H new ATOM 0 HB THR A 129 -3.880 -0.549 -5.492 1.00 0.00 H new ATOM 0 HG1 THR A 129 -5.583 -1.159 -7.470 1.00 0.00 H new ATOM 0 HG21 THR A 129 -3.335 -1.148 -7.830 1.00 0.00 H new ATOM 0 HG22 THR A 129 -2.399 -2.092 -6.647 1.00 0.00 H new ATOM 0 HG23 THR A 129 -3.782 -2.835 -7.485 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.617 -4.831 -5.466 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.241 -6.058 -5.980 1.00 0.00 C ATOM 1936 C LYS A 130 -6.095 -6.652 -4.888 1.00 0.00 C ATOM 1937 O LYS A 130 -7.079 -7.340 -5.132 1.00 0.00 O ATOM 1938 CB LYS A 130 -4.156 -7.054 -6.424 1.00 0.00 C ATOM 1939 CG LYS A 130 -4.674 -8.332 -7.058 1.00 0.00 C ATOM 1940 CD LYS A 130 -5.379 -8.053 -8.372 1.00 0.00 C ATOM 1941 CE LYS A 130 -5.864 -9.334 -9.028 1.00 0.00 C ATOM 1942 NZ LYS A 130 -6.833 -10.058 -8.187 1.00 0.00 N ATOM 0 H LYS A 130 -3.608 -4.902 -5.333 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.863 -5.831 -6.846 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.497 -6.556 -7.135 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.550 -7.317 -5.557 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -3.844 -9.018 -7.227 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -5.362 -8.827 -6.372 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -6.226 -7.389 -8.198 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -4.700 -7.532 -9.047 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -6.324 -9.097 -9.987 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -5.011 -9.980 -9.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -7.275 -10.818 -8.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -6.342 -10.469 -7.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -7.567 -9.399 -7.857 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.658 -6.406 -3.700 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.333 -6.701 -2.488 1.00 0.00 C ATOM 1958 C ALA A 131 -7.281 -5.568 -2.170 1.00 0.00 C ATOM 1959 O ALA A 131 -8.499 -5.756 -2.182 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.259 -6.828 -1.466 1.00 0.00 C ATOM 0 H ALA A 131 -4.754 -5.961 -3.542 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.929 -7.613 -2.533 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.704 -7.057 -0.497 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.578 -7.630 -1.751 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.707 -5.890 -1.400 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.707 -4.374 -2.035 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.341 -3.127 -1.586 1.00 0.00 C ATOM 1968 C TRP A 132 -8.358 -2.551 -2.577 1.00 0.00 C ATOM 1969 O TRP A 132 -8.517 -1.347 -2.693 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.322 -2.028 -1.203 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.406 -2.411 -0.101 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -4.910 -3.609 0.082 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -4.892 -1.617 0.972 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.061 -3.644 1.067 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.031 -2.447 1.674 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -5.042 -0.300 1.407 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.321 -2.024 2.756 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.346 0.090 2.486 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.494 -0.772 3.144 1.00 0.00 C ATOM 0 H TRP A 132 -5.719 -4.239 -2.250 1.00 0.00 H new ATOM 0 HA TRP A 132 -7.883 -3.429 -0.690 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.730 -1.774 -2.082 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -6.865 -1.128 -0.914 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.175 -4.469 -0.516 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.504 -4.455 1.336 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.698 0.385 0.891 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.644 -2.685 3.276 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.456 1.102 2.847 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -2.950 -0.412 4.005 1.00 0.00 H new ATOM 1990 N ARG A 133 -8.963 -3.379 -3.330 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.071 -2.952 -4.147 1.00 0.00 C ATOM 1992 C ARG A 133 -11.518 -3.527 -3.866 1.00 0.00 C ATOM 1993 O ARG A 133 -12.471 -2.779 -3.882 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.696 -2.992 -5.644 1.00 0.00 C ATOM 1995 CG ARG A 133 -10.851 -2.785 -6.621 1.00 0.00 C ATOM 1996 CD ARG A 133 -11.600 -4.057 -6.917 1.00 0.00 C ATOM 1997 NE ARG A 133 -12.994 -3.810 -7.331 1.00 0.00 N ATOM 1998 CZ ARG A 133 -13.427 -3.885 -8.611 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -12.552 -3.854 -9.623 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -14.723 -3.917 -8.875 1.00 0.00 N ATOM 0 H ARG A 133 -8.724 -4.367 -3.412 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.216 -1.926 -3.810 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -8.944 -2.226 -5.832 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.231 -3.955 -5.858 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.542 -2.049 -6.209 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.464 -2.372 -7.552 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.082 -4.604 -7.705 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -11.595 -4.692 -6.031 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.673 -3.568 -6.609 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -11.553 -3.774 -9.431 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -12.884 -3.911 -10.586 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -15.400 -3.885 -8.112 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -15.045 -3.974 -9.841 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.662 -4.810 -3.614 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.966 -5.488 -3.977 1.00 0.00 C ATOM 2016 C LYS A 134 -14.173 -5.742 -2.980 1.00 0.00 C ATOM 2017 O LYS A 134 -14.821 -6.780 -3.098 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.725 -6.719 -4.834 1.00 0.00 C ATOM 2019 CG LYS A 134 -12.302 -8.016 -4.139 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.998 -7.935 -3.367 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.808 -7.774 -4.258 1.00 0.00 C ATOM 2022 NZ LYS A 134 -9.566 -8.948 -5.135 1.00 0.00 N ATOM 0 H LYS A 134 -10.957 -5.409 -3.184 1.00 0.00 H new ATOM 0 HA LYS A 134 -13.395 -4.622 -4.481 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -13.641 -6.923 -5.389 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -11.958 -6.469 -5.567 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -13.094 -8.318 -3.454 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.214 -8.801 -4.890 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -11.043 -7.096 -2.673 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -10.879 -8.838 -2.768 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -9.945 -6.888 -4.878 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -8.924 -7.600 -3.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -8.627 -8.865 -5.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.608 -9.819 -4.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -10.294 -8.983 -5.877 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.549 -4.858 -2.112 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.684 -5.227 -1.194 1.00 0.00 C ATOM 2038 C LEU A 135 -16.953 -4.394 -1.337 1.00 0.00 C ATOM 2039 O LEU A 135 -16.925 -3.276 -1.805 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.313 -5.318 0.306 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.436 -4.244 0.928 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.020 -4.467 0.594 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.848 -2.841 0.562 1.00 0.00 C ATOM 0 H LEU A 135 -14.148 -3.928 -1.988 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.905 -6.230 -1.558 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -16.244 -5.346 0.871 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -14.816 -6.276 0.462 1.00 0.00 H new ATOM 0 HG LEU A 135 -14.573 -4.333 2.006 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -12.411 -3.686 1.050 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -12.706 -5.440 0.973 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -12.893 -4.441 -0.488 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -14.177 -2.128 1.042 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -14.796 -2.717 -0.520 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.869 -2.662 0.899 1.00 0.00 H new ATOM 2055 N PRO A 136 -18.100 -4.958 -0.939 1.00 0.00 N ATOM 2056 CA PRO A 136 -19.321 -4.201 -0.784 1.00 0.00 C ATOM 2057 C PRO A 136 -19.383 -3.640 0.658 1.00 0.00 C ATOM 2058 O PRO A 136 -18.362 -3.664 1.380 1.00 0.00 O ATOM 2059 CB PRO A 136 -20.401 -5.263 -0.996 1.00 0.00 C ATOM 2060 CG PRO A 136 -19.800 -6.527 -0.485 1.00 0.00 C ATOM 2061 CD PRO A 136 -18.308 -6.391 -0.638 1.00 0.00 C ATOM 0 HA PRO A 136 -19.419 -3.354 -1.462 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -21.313 -5.012 -0.455 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -20.668 -5.350 -2.049 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -20.069 -6.689 0.559 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -20.170 -7.385 -1.046 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -17.786 -6.686 0.273 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -17.931 -7.025 -1.441 1.00 0.00 H new