USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=23 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 85 THR OG1 : rot 174:sc= 0.632 USER MOD Set 1.2: A 123 GLN : amide:sc= 0.306 K(o=0.94,f=-0.0044) USER MOD Set 2.1: A 82 CYS SG : rot -11:sc= -0.962 USER MOD Set 2.2: A 102 THR OG1 : rot 106:sc= 0.825 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 17 ASN : amide:sc= 0.197 K(o=0.2,f=-2.6!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 70:sc= 1.23 USER MOD Single : A 32 SER OG : rot -93:sc= 1.27 USER MOD Single : A 33 GLN : amide:sc= -0.0322 X(o=-0.032,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot -103:sc= 0.245 USER MOD Single : A 40 TYR OH : rot -106:sc= 1.25 USER MOD Single : A 41 THR OG1 : rot 165:sc= 1.12 USER MOD Single : A 47 SER OG : rot 77:sc= 1.23 USER MOD Single : A 51 ASN : amide:sc= 0.023 X(o=0.023,f=0) USER MOD Single : A 54 THR OG1 : rot 20:sc= 1.07 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 THR OG1 : rot 161:sc= 1.37 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) USER MOD Single : A 75 LYS NZ :NH3+ 167:sc= 1.26 (180deg=0.57) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= 0.701 K(o=0.7,f=-1) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc= -1.07! C(o=-1.1!,f=-2.1!) USER MOD Single : A 90 GLN : amide:sc= 0.939 K(o=0.94,f=-0.43) USER MOD Single : A 91 GLN : amide:sc= 0.855 K(o=0.86,f=-1.8e-05) USER MOD Single : A 94 ASN :FLIP amide:sc= -0.172 F(o=-1.6!,f=-0.17) USER MOD Single : A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 113 GLN :FLIP amide:sc= -8.73! C(o=-10!,f=-8.7!) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 GLN : amide:sc= 0.938 K(o=0.94,f=-0.24) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 GLN :FLIP amide:sc= -0.0502 F(o=-1.4!,f=-0.05) USER MOD Single : A 129 THR OG1 : rot -82:sc= 1.27 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 146:sc= 1.43 (180deg=-0.107) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.150 9.445 3.022 1.00 0.00 N ATOM 2 CA PRO A 1 3.932 8.788 1.991 1.00 0.00 C ATOM 3 C PRO A 1 5.342 9.267 2.087 1.00 0.00 C ATOM 4 O PRO A 1 5.597 10.264 2.747 1.00 0.00 O ATOM 5 CB PRO A 1 3.354 9.156 0.642 1.00 0.00 C ATOM 6 CG PRO A 1 2.489 10.326 0.953 1.00 0.00 C ATOM 7 CD PRO A 1 2.047 10.157 2.392 1.00 0.00 C ATOM 0 H2 PRO A 1 3.734 10.094 3.549 1.00 0.00 H new ATOM 0 H3 PRO A 1 2.793 8.758 3.686 1.00 0.00 H new ATOM 0 HA PRO A 1 3.906 7.705 2.115 1.00 0.00 H new ATOM 0 HB2 PRO A 1 4.134 9.411 -0.075 1.00 0.00 H new ATOM 0 HB3 PRO A 1 2.781 8.335 0.211 1.00 0.00 H new ATOM 0 HG2 PRO A 1 3.036 11.260 0.821 1.00 0.00 H new ATOM 0 HG3 PRO A 1 1.629 10.363 0.284 1.00 0.00 H new ATOM 0 HD2 PRO A 1 1.870 11.120 2.870 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.117 9.592 2.460 1.00 0.00 H new ATOM 17 N VAL A 2 6.247 8.583 1.444 1.00 0.00 N ATOM 18 CA VAL A 2 7.637 8.973 1.463 1.00 0.00 C ATOM 19 C VAL A 2 7.863 9.924 0.310 1.00 0.00 C ATOM 20 O VAL A 2 7.242 9.765 -0.739 1.00 0.00 O ATOM 21 CB VAL A 2 8.574 7.740 1.271 1.00 0.00 C ATOM 22 CG1 VAL A 2 10.037 8.084 1.499 1.00 0.00 C ATOM 23 CG2 VAL A 2 8.164 6.597 2.156 1.00 0.00 C ATOM 0 H VAL A 2 6.049 7.746 0.895 1.00 0.00 H new ATOM 0 HA VAL A 2 7.864 9.434 2.424 1.00 0.00 H new ATOM 0 HB VAL A 2 8.466 7.431 0.231 1.00 0.00 H new ATOM 0 HG11 VAL A 2 10.647 7.193 1.353 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.344 8.854 0.791 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.170 8.453 2.516 1.00 0.00 H new ATOM 0 HG21 VAL A 2 8.837 5.754 1.997 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.213 6.909 3.199 1.00 0.00 H new ATOM 0 HG23 VAL A 2 7.144 6.297 1.914 1.00 0.00 H new ATOM 33 N THR A 3 8.691 10.900 0.499 1.00 0.00 N ATOM 34 CA THR A 3 9.052 11.778 -0.561 1.00 0.00 C ATOM 35 C THR A 3 10.582 11.878 -0.558 1.00 0.00 C ATOM 36 O THR A 3 11.198 11.843 0.524 1.00 0.00 O ATOM 37 CB THR A 3 8.351 13.168 -0.410 1.00 0.00 C ATOM 38 OG1 THR A 3 8.766 14.083 -1.432 1.00 0.00 O ATOM 39 CG2 THR A 3 8.577 13.769 0.977 1.00 0.00 C ATOM 0 H THR A 3 9.135 11.109 1.393 1.00 0.00 H new ATOM 0 HA THR A 3 8.714 11.394 -1.523 1.00 0.00 H new ATOM 0 HB THR A 3 7.281 12.995 -0.528 1.00 0.00 H new ATOM 0 HG1 THR A 3 8.308 14.941 -1.309 1.00 0.00 H new ATOM 0 HG21 THR A 3 8.074 14.734 1.042 1.00 0.00 H new ATOM 0 HG22 THR A 3 8.173 13.098 1.735 1.00 0.00 H new ATOM 0 HG23 THR A 3 9.645 13.904 1.145 1.00 0.00 H new ATOM 228 N HIS A 16 10.608 9.857 5.056 1.00 0.00 N ATOM 229 CA HIS A 16 9.407 9.066 5.024 1.00 0.00 C ATOM 230 C HIS A 16 8.471 9.996 5.732 1.00 0.00 C ATOM 231 O HIS A 16 8.879 10.607 6.732 1.00 0.00 O ATOM 232 CB HIS A 16 9.583 7.676 5.742 1.00 0.00 C ATOM 233 CG HIS A 16 9.590 7.672 7.260 1.00 0.00 C ATOM 234 ND1 HIS A 16 10.722 7.828 8.033 1.00 0.00 N ATOM 235 CD2 HIS A 16 8.574 7.492 8.128 1.00 0.00 C ATOM 236 CE1 HIS A 16 10.397 7.746 9.308 1.00 0.00 C ATOM 237 NE2 HIS A 16 9.101 7.545 9.389 1.00 0.00 N ATOM 0 HA HIS A 16 9.071 8.765 4.031 1.00 0.00 H new ATOM 0 HB2 HIS A 16 8.780 7.019 5.407 1.00 0.00 H new ATOM 0 HB3 HIS A 16 10.519 7.236 5.399 1.00 0.00 H new ATOM 0 HD2 HIS A 16 7.536 7.335 7.874 1.00 0.00 H new ATOM 0 HE1 HIS A 16 11.078 7.830 10.142 1.00 0.00 H new ATOM 0 HE2 HIS A 16 8.572 7.444 10.255 1.00 0.00 H new ATOM 246 N ASN A 17 7.284 10.152 5.313 1.00 0.00 N ATOM 247 CA ASN A 17 6.564 11.292 5.781 1.00 0.00 C ATOM 248 C ASN A 17 5.109 10.998 6.018 1.00 0.00 C ATOM 249 O ASN A 17 4.578 9.966 5.557 1.00 0.00 O ATOM 250 CB ASN A 17 6.800 12.385 4.711 1.00 0.00 C ATOM 251 CG ASN A 17 6.287 13.762 5.008 1.00 0.00 C ATOM 252 OD1 ASN A 17 6.126 14.169 6.161 1.00 0.00 O ATOM 253 ND2 ASN A 17 6.088 14.512 3.960 1.00 0.00 N ATOM 0 H ASN A 17 6.789 9.536 4.668 1.00 0.00 H new ATOM 0 HA ASN A 17 6.917 11.619 6.759 1.00 0.00 H new ATOM 0 HB2 ASN A 17 7.873 12.456 4.533 1.00 0.00 H new ATOM 0 HB3 ASN A 17 6.344 12.049 3.780 1.00 0.00 H new ATOM 0 HD21 ASN A 17 5.786 15.479 4.075 1.00 0.00 H new ATOM 0 HD22 ASN A 17 6.234 14.131 3.025 1.00 0.00 H new ATOM 260 N GLY A 18 4.481 11.911 6.745 1.00 0.00 N ATOM 261 CA GLY A 18 3.112 11.812 7.141 1.00 0.00 C ATOM 262 C GLY A 18 2.160 11.646 5.994 1.00 0.00 C ATOM 263 O GLY A 18 2.438 12.065 4.845 1.00 0.00 O ATOM 0 H GLY A 18 4.937 12.761 7.078 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.000 10.966 7.819 1.00 0.00 H new ATOM 0 HA3 GLY A 18 2.840 12.707 7.700 1.00 0.00 H new ATOM 267 N PHE A 19 1.056 11.043 6.306 1.00 0.00 N ATOM 268 CA PHE A 19 -0.002 10.738 5.380 1.00 0.00 C ATOM 269 C PHE A 19 -0.593 12.046 4.904 1.00 0.00 C ATOM 270 O PHE A 19 -0.911 12.908 5.729 1.00 0.00 O ATOM 271 CB PHE A 19 -1.072 9.932 6.131 1.00 0.00 C ATOM 272 CG PHE A 19 -0.484 8.934 7.107 1.00 0.00 C ATOM 273 CD1 PHE A 19 0.197 7.820 6.662 1.00 0.00 C ATOM 274 CD2 PHE A 19 -0.591 9.143 8.480 1.00 0.00 C ATOM 275 CE1 PHE A 19 0.758 6.929 7.556 1.00 0.00 C ATOM 276 CE2 PHE A 19 -0.029 8.251 9.375 1.00 0.00 C ATOM 277 CZ PHE A 19 0.645 7.145 8.911 1.00 0.00 C ATOM 0 H PHE A 19 0.853 10.733 7.257 1.00 0.00 H new ATOM 0 HA PHE A 19 0.364 10.164 4.529 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -1.724 10.619 6.671 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.694 9.403 5.409 1.00 0.00 H new ATOM 0 HD1 PHE A 19 0.293 7.642 5.601 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.118 10.010 8.849 1.00 0.00 H new ATOM 0 HE1 PHE A 19 1.287 6.061 7.191 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -0.119 8.422 10.437 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.085 6.447 9.608 1.00 0.00 H new ATOM 287 N ASP A 20 -0.731 12.224 3.603 1.00 0.00 N ATOM 288 CA ASP A 20 -1.249 13.475 3.078 1.00 0.00 C ATOM 289 C ASP A 20 -2.722 13.474 3.306 1.00 0.00 C ATOM 290 O ASP A 20 -3.420 12.587 2.796 1.00 0.00 O ATOM 291 CB ASP A 20 -0.987 13.585 1.587 1.00 0.00 C ATOM 292 CG ASP A 20 -1.285 14.975 1.080 1.00 0.00 C ATOM 293 OD1 ASP A 20 -2.465 15.299 0.823 1.00 0.00 O ATOM 294 OD2 ASP A 20 -0.341 15.778 0.953 1.00 0.00 O ATOM 0 H ASP A 20 -0.495 11.527 2.897 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.762 14.314 3.575 1.00 0.00 H new ATOM 0 HB2 ASP A 20 0.053 13.335 1.379 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.602 12.861 1.053 1.00 0.00 H new ATOM 299 N PHE A 21 -3.200 14.432 4.054 1.00 0.00 N ATOM 300 CA PHE A 21 -4.565 14.414 4.478 1.00 0.00 C ATOM 301 C PHE A 21 -5.527 14.580 3.332 1.00 0.00 C ATOM 302 O PHE A 21 -6.469 13.854 3.262 1.00 0.00 O ATOM 303 CB PHE A 21 -4.847 15.421 5.568 1.00 0.00 C ATOM 304 CG PHE A 21 -6.057 15.050 6.345 1.00 0.00 C ATOM 305 CD1 PHE A 21 -6.039 13.917 7.144 1.00 0.00 C ATOM 306 CD2 PHE A 21 -7.204 15.808 6.288 1.00 0.00 C ATOM 307 CE1 PHE A 21 -7.144 13.554 7.871 1.00 0.00 C ATOM 308 CE2 PHE A 21 -8.313 15.449 7.015 1.00 0.00 C ATOM 309 CZ PHE A 21 -8.285 14.321 7.807 1.00 0.00 C ATOM 0 H PHE A 21 -2.660 15.233 4.380 1.00 0.00 H new ATOM 0 HA PHE A 21 -4.727 13.422 4.900 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -3.989 15.486 6.237 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -4.984 16.409 5.127 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -5.145 13.313 7.195 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.233 16.691 5.667 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -7.119 12.670 8.491 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -9.208 16.051 6.966 1.00 0.00 H new ATOM 0 HZ PHE A 21 -9.158 14.039 8.377 1.00 0.00 H new ATOM 319 N ALA A 22 -5.282 15.541 2.455 1.00 0.00 N ATOM 320 CA ALA A 22 -6.119 15.767 1.272 1.00 0.00 C ATOM 321 C ALA A 22 -6.318 14.475 0.474 1.00 0.00 C ATOM 322 O ALA A 22 -7.449 14.132 0.102 1.00 0.00 O ATOM 323 CB ALA A 22 -5.529 16.868 0.400 1.00 0.00 C ATOM 0 H ALA A 22 -4.499 16.190 2.537 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.102 16.093 1.612 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.164 17.021 -0.473 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.470 17.794 0.973 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.530 16.578 0.075 1.00 0.00 H new ATOM 329 N VAL A 23 -5.232 13.743 0.269 1.00 0.00 N ATOM 330 CA VAL A 23 -5.276 12.465 -0.435 1.00 0.00 C ATOM 331 C VAL A 23 -6.114 11.437 0.361 1.00 0.00 C ATOM 332 O VAL A 23 -7.074 10.855 -0.175 1.00 0.00 O ATOM 333 CB VAL A 23 -3.838 11.916 -0.677 1.00 0.00 C ATOM 334 CG1 VAL A 23 -3.854 10.561 -1.361 1.00 0.00 C ATOM 335 CG2 VAL A 23 -3.016 12.905 -1.492 1.00 0.00 C ATOM 0 H VAL A 23 -4.300 14.014 0.583 1.00 0.00 H new ATOM 0 HA VAL A 23 -5.749 12.628 -1.403 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.375 11.787 0.301 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -2.831 10.217 -1.510 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.391 9.845 -0.738 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.352 10.647 -2.327 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.015 12.503 -1.650 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.497 13.071 -2.456 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -2.946 13.851 -0.954 1.00 0.00 H new ATOM 345 N ILE A 24 -5.715 11.215 1.608 1.00 0.00 N ATOM 346 CA ILE A 24 -6.452 10.303 2.533 1.00 0.00 C ATOM 347 C ILE A 24 -7.966 10.627 2.511 1.00 0.00 C ATOM 348 O ILE A 24 -8.802 9.760 2.330 1.00 0.00 O ATOM 349 CB ILE A 24 -5.943 10.435 4.018 1.00 0.00 C ATOM 350 CG1 ILE A 24 -4.458 10.054 4.167 1.00 0.00 C ATOM 351 CG2 ILE A 24 -6.809 9.625 4.996 1.00 0.00 C ATOM 352 CD1 ILE A 24 -4.124 8.639 3.753 1.00 0.00 C ATOM 0 H ILE A 24 -4.887 11.645 2.020 1.00 0.00 H new ATOM 0 HA ILE A 24 -6.271 9.286 2.185 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.038 11.490 4.276 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -3.859 10.743 3.572 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.164 10.193 5.207 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.423 9.744 6.008 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -7.837 9.984 4.955 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -6.782 8.571 4.719 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -3.058 8.461 3.892 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -4.692 7.937 4.364 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -4.382 8.497 2.703 1.00 0.00 H new ATOM 364 N LYS A 25 -8.258 11.888 2.652 1.00 0.00 N ATOM 365 CA LYS A 25 -9.590 12.457 2.696 1.00 0.00 C ATOM 366 C LYS A 25 -10.391 12.130 1.431 1.00 0.00 C ATOM 367 O LYS A 25 -11.555 11.704 1.518 1.00 0.00 O ATOM 368 CB LYS A 25 -9.431 13.967 2.839 1.00 0.00 C ATOM 369 CG LYS A 25 -10.691 14.786 2.949 1.00 0.00 C ATOM 370 CD LYS A 25 -10.348 16.267 2.831 1.00 0.00 C ATOM 371 CE LYS A 25 -10.000 16.645 1.389 1.00 0.00 C ATOM 372 NZ LYS A 25 -9.761 18.091 1.241 1.00 0.00 N ATOM 0 H LYS A 25 -7.531 12.598 2.746 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.142 12.034 3.535 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.824 14.160 3.724 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.866 14.330 1.980 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.392 14.501 2.165 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.182 14.591 3.902 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.192 16.866 3.172 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.507 16.501 3.483 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.112 16.097 1.074 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.812 16.342 0.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.529 18.305 0.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -10.616 18.614 1.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -8.969 18.376 1.852 1.00 0.00 H new ATOM 386 N GLU A 26 -9.786 12.326 0.261 1.00 0.00 N ATOM 387 CA GLU A 26 -10.486 12.064 -0.978 1.00 0.00 C ATOM 388 C GLU A 26 -10.737 10.575 -1.153 1.00 0.00 C ATOM 389 O GLU A 26 -11.846 10.176 -1.553 1.00 0.00 O ATOM 390 CB GLU A 26 -9.773 12.633 -2.195 1.00 0.00 C ATOM 391 CG GLU A 26 -10.646 12.577 -3.440 1.00 0.00 C ATOM 392 CD GLU A 26 -9.990 13.133 -4.656 1.00 0.00 C ATOM 393 OE1 GLU A 26 -9.466 14.265 -4.606 1.00 0.00 O ATOM 394 OE2 GLU A 26 -9.999 12.467 -5.696 1.00 0.00 O ATOM 0 H GLU A 26 -8.828 12.660 0.153 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.443 12.580 -0.906 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.487 13.666 -1.998 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.853 12.075 -2.371 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.926 11.541 -3.630 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.568 13.127 -3.252 1.00 0.00 H new ATOM 401 N LEU A 27 -9.727 9.742 -0.867 1.00 0.00 N ATOM 402 CA LEU A 27 -9.947 8.302 -0.948 1.00 0.00 C ATOM 403 C LEU A 27 -11.005 7.887 0.057 1.00 0.00 C ATOM 404 O LEU A 27 -11.795 7.033 -0.223 1.00 0.00 O ATOM 405 CB LEU A 27 -8.669 7.438 -0.781 1.00 0.00 C ATOM 406 CG LEU A 27 -8.868 5.930 -1.019 1.00 0.00 C ATOM 407 CD1 LEU A 27 -9.519 5.684 -2.356 1.00 0.00 C ATOM 408 CD2 LEU A 27 -7.539 5.193 -0.929 1.00 0.00 C ATOM 0 H LEU A 27 -8.789 10.029 -0.589 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.288 8.109 -1.965 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -7.909 7.803 -1.472 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -8.279 7.583 0.227 1.00 0.00 H new ATOM 0 HG LEU A 27 -9.527 5.546 -0.241 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.651 4.612 -2.505 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.491 6.176 -2.383 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -8.887 6.085 -3.148 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -7.701 4.129 -1.100 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -6.855 5.582 -1.684 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.108 5.340 0.061 1.00 0.00 H new ATOM 420 N LYS A 28 -11.029 8.543 1.213 1.00 0.00 N ATOM 421 CA LYS A 28 -12.037 8.284 2.239 1.00 0.00 C ATOM 422 C LYS A 28 -13.404 8.624 1.714 1.00 0.00 C ATOM 423 O LYS A 28 -14.388 7.933 1.991 1.00 0.00 O ATOM 424 CB LYS A 28 -11.753 9.100 3.509 1.00 0.00 C ATOM 425 CG LYS A 28 -12.707 8.823 4.666 1.00 0.00 C ATOM 426 CD LYS A 28 -12.352 9.647 5.891 1.00 0.00 C ATOM 427 CE LYS A 28 -13.279 9.336 7.054 1.00 0.00 C ATOM 428 NZ LYS A 28 -12.966 10.145 8.247 1.00 0.00 N ATOM 0 H LYS A 28 -10.355 9.266 1.466 1.00 0.00 H new ATOM 0 HA LYS A 28 -11.998 7.225 2.493 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -10.734 8.894 3.838 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -11.800 10.161 3.262 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -13.728 9.048 4.358 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -12.676 7.763 4.918 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -11.321 9.445 6.181 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -12.413 10.708 5.648 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -14.311 9.519 6.753 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -13.203 8.278 7.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -13.623 9.900 9.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -11.990 9.952 8.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -13.064 11.155 8.017 1.00 0.00 H new ATOM 442 N THR A 29 -13.466 9.668 0.923 1.00 0.00 N ATOM 443 CA THR A 29 -14.687 10.086 0.323 1.00 0.00 C ATOM 444 C THR A 29 -15.129 9.007 -0.643 1.00 0.00 C ATOM 445 O THR A 29 -16.125 8.351 -0.403 1.00 0.00 O ATOM 446 CB THR A 29 -14.519 11.450 -0.388 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.008 12.409 0.553 1.00 0.00 O ATOM 448 CG2 THR A 29 -15.850 11.961 -0.946 1.00 0.00 C ATOM 0 H THR A 29 -12.661 10.247 0.683 1.00 0.00 H new ATOM 0 HA THR A 29 -15.451 10.227 1.088 1.00 0.00 H new ATOM 0 HB THR A 29 -13.828 11.317 -1.220 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.080 12.185 0.777 1.00 0.00 H new ATOM 0 HG21 THR A 29 -15.694 12.921 -1.438 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.242 11.243 -1.667 1.00 0.00 H new ATOM 0 HG23 THR A 29 -16.563 12.083 -0.131 1.00 0.00 H new ATOM 456 N ALA A 30 -14.338 8.760 -1.692 1.00 0.00 N ATOM 457 CA ALA A 30 -14.597 7.763 -2.681 1.00 0.00 C ATOM 458 C ALA A 30 -14.924 6.407 -2.082 1.00 0.00 C ATOM 459 O ALA A 30 -15.881 5.788 -2.451 1.00 0.00 O ATOM 460 CB ALA A 30 -13.407 7.647 -3.594 1.00 0.00 C ATOM 0 H ALA A 30 -13.476 9.278 -1.862 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.478 8.080 -3.240 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -13.601 6.887 -4.350 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.227 8.605 -4.081 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -12.529 7.365 -3.013 1.00 0.00 H new ATOM 466 N ALA A 31 -14.151 5.977 -1.164 1.00 0.00 N ATOM 467 CA ALA A 31 -14.339 4.709 -0.542 1.00 0.00 C ATOM 468 C ALA A 31 -15.662 4.592 0.225 1.00 0.00 C ATOM 469 O ALA A 31 -16.288 3.542 0.178 1.00 0.00 O ATOM 470 CB ALA A 31 -13.150 4.388 0.330 1.00 0.00 C ATOM 0 H ALA A 31 -13.350 6.500 -0.809 1.00 0.00 H new ATOM 0 HA ALA A 31 -14.410 3.965 -1.336 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -13.298 3.418 0.804 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -12.248 4.360 -0.281 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -13.044 5.154 1.098 1.00 0.00 H new ATOM 476 N SER A 32 -16.107 5.662 0.869 1.00 0.00 N ATOM 477 CA SER A 32 -17.279 5.560 1.711 1.00 0.00 C ATOM 478 C SER A 32 -18.531 5.779 0.922 1.00 0.00 C ATOM 479 O SER A 32 -19.574 5.166 1.143 1.00 0.00 O ATOM 480 CB SER A 32 -17.179 6.507 2.902 1.00 0.00 C ATOM 481 OG SER A 32 -16.980 7.856 2.494 1.00 0.00 O ATOM 0 H SER A 32 -15.682 6.588 0.824 1.00 0.00 H new ATOM 0 HA SER A 32 -17.326 4.546 2.108 1.00 0.00 H new ATOM 0 HB2 SER A 32 -18.090 6.439 3.497 1.00 0.00 H new ATOM 0 HB3 SER A 32 -16.354 6.197 3.544 1.00 0.00 H new ATOM 0 HG SER A 32 -16.020 8.051 2.465 1.00 0.00 H new ATOM 487 N GLN A 33 -18.377 6.595 -0.066 1.00 0.00 N ATOM 488 CA GLN A 33 -19.383 7.140 -0.881 1.00 0.00 C ATOM 489 C GLN A 33 -19.601 6.321 -2.158 1.00 0.00 C ATOM 490 O GLN A 33 -20.697 5.856 -2.438 1.00 0.00 O ATOM 491 CB GLN A 33 -18.903 8.546 -1.174 1.00 0.00 C ATOM 492 CG GLN A 33 -19.485 9.214 -2.333 1.00 0.00 C ATOM 493 CD GLN A 33 -20.938 9.580 -2.158 1.00 0.00 C ATOM 494 OE1 GLN A 33 -21.246 10.666 -1.698 1.00 0.00 O ATOM 495 NE2 GLN A 33 -21.829 8.696 -2.507 1.00 0.00 N ATOM 0 H GLN A 33 -17.450 6.921 -0.340 1.00 0.00 H new ATOM 0 HA GLN A 33 -20.357 7.133 -0.393 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -19.097 9.161 -0.295 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -17.822 8.514 -1.308 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -18.915 10.119 -2.544 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -19.386 8.565 -3.203 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -21.534 7.797 -2.889 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -22.822 8.903 -2.399 1.00 0.00 H new ATOM 504 N TYR A 34 -18.539 6.149 -2.901 1.00 0.00 N ATOM 505 CA TYR A 34 -18.546 5.512 -4.205 1.00 0.00 C ATOM 506 C TYR A 34 -18.368 4.019 -4.038 1.00 0.00 C ATOM 507 O TYR A 34 -19.003 3.215 -4.726 1.00 0.00 O ATOM 508 CB TYR A 34 -17.405 6.150 -5.060 1.00 0.00 C ATOM 509 CG TYR A 34 -17.602 7.617 -5.351 1.00 0.00 C ATOM 510 CD1 TYR A 34 -18.854 8.137 -5.631 1.00 0.00 C ATOM 511 CD2 TYR A 34 -16.535 8.485 -5.318 1.00 0.00 C ATOM 512 CE1 TYR A 34 -19.024 9.484 -5.860 1.00 0.00 C ATOM 513 CE2 TYR A 34 -16.692 9.827 -5.554 1.00 0.00 C ATOM 514 CZ TYR A 34 -17.935 10.325 -5.819 1.00 0.00 C ATOM 515 OH TYR A 34 -18.096 11.671 -6.028 1.00 0.00 O ATOM 0 H TYR A 34 -17.611 6.457 -2.611 1.00 0.00 H new ATOM 0 HA TYR A 34 -19.495 5.667 -4.718 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -16.457 6.018 -4.538 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.327 5.610 -6.004 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -19.708 7.478 -5.670 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -15.550 8.100 -5.101 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -20.007 9.879 -6.071 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -15.837 10.486 -5.530 1.00 0.00 H new ATOM 0 HH TYR A 34 -17.227 12.118 -5.963 1.00 0.00 H new ATOM 525 N GLY A 35 -17.561 3.656 -3.072 1.00 0.00 N ATOM 526 CA GLY A 35 -17.300 2.279 -2.816 1.00 0.00 C ATOM 527 C GLY A 35 -16.111 1.845 -3.576 1.00 0.00 C ATOM 528 O GLY A 35 -15.764 2.456 -4.602 1.00 0.00 O ATOM 0 H GLY A 35 -17.076 4.305 -2.453 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.138 2.122 -1.750 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.163 1.677 -3.099 1.00 0.00 H new ATOM 532 N ALA A 36 -15.482 0.817 -3.140 1.00 0.00 N ATOM 533 CA ALA A 36 -14.352 0.359 -3.842 1.00 0.00 C ATOM 534 C ALA A 36 -14.777 -0.729 -4.784 1.00 0.00 C ATOM 535 O ALA A 36 -14.822 -1.895 -4.456 1.00 0.00 O ATOM 536 CB ALA A 36 -13.229 -0.011 -2.939 1.00 0.00 C ATOM 0 H ALA A 36 -15.731 0.283 -2.307 1.00 0.00 H new ATOM 0 HA ALA A 36 -13.937 1.170 -4.440 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -12.383 -0.357 -3.533 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -12.930 0.859 -2.355 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -13.550 -0.806 -2.266 1.00 0.00 H new ATOM 542 N THR A 37 -15.110 -0.273 -5.944 1.00 0.00 N ATOM 543 CA THR A 37 -15.705 -0.999 -7.039 1.00 0.00 C ATOM 544 C THR A 37 -15.930 0.018 -8.121 1.00 0.00 C ATOM 545 O THR A 37 -15.714 -0.253 -9.301 1.00 0.00 O ATOM 546 CB THR A 37 -17.052 -1.692 -6.680 1.00 0.00 C ATOM 547 OG1 THR A 37 -17.724 -1.012 -5.596 1.00 0.00 O ATOM 548 CG2 THR A 37 -16.883 -3.169 -6.361 1.00 0.00 C ATOM 0 H THR A 37 -14.963 0.708 -6.182 1.00 0.00 H new ATOM 0 HA THR A 37 -15.040 -1.810 -7.336 1.00 0.00 H new ATOM 0 HB THR A 37 -17.677 -1.624 -7.571 1.00 0.00 H new ATOM 0 HG1 THR A 37 -17.609 -1.523 -4.768 1.00 0.00 H new ATOM 0 HG21 THR A 37 -17.853 -3.602 -6.118 1.00 0.00 H new ATOM 0 HG22 THR A 37 -16.463 -3.682 -7.226 1.00 0.00 H new ATOM 0 HG23 THR A 37 -16.211 -3.283 -5.510 1.00 0.00 H new ATOM 556 N ALA A 38 -16.313 1.230 -7.681 1.00 0.00 N ATOM 557 CA ALA A 38 -16.439 2.360 -8.561 1.00 0.00 C ATOM 558 C ALA A 38 -15.044 2.717 -9.042 1.00 0.00 C ATOM 559 O ALA A 38 -14.136 2.864 -8.200 1.00 0.00 O ATOM 560 CB ALA A 38 -17.040 3.541 -7.813 1.00 0.00 C ATOM 0 H ALA A 38 -16.538 1.433 -6.707 1.00 0.00 H new ATOM 0 HA ALA A 38 -17.091 2.120 -9.400 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.131 4.391 -8.489 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.026 3.269 -7.437 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -16.394 3.809 -6.977 1.00 0.00 H new ATOM 566 N PRO A 39 -14.849 2.867 -10.372 1.00 0.00 N ATOM 567 CA PRO A 39 -13.526 3.116 -10.992 1.00 0.00 C ATOM 568 C PRO A 39 -12.740 4.251 -10.341 1.00 0.00 C ATOM 569 O PRO A 39 -11.515 4.221 -10.327 1.00 0.00 O ATOM 570 CB PRO A 39 -13.876 3.467 -12.435 1.00 0.00 C ATOM 571 CG PRO A 39 -15.134 2.720 -12.685 1.00 0.00 C ATOM 572 CD PRO A 39 -15.911 2.809 -11.403 1.00 0.00 C ATOM 0 HA PRO A 39 -12.873 2.250 -10.883 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -14.016 4.540 -12.563 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -13.087 3.164 -13.123 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -15.692 3.156 -13.514 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -14.929 1.683 -12.949 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -16.547 3.694 -11.377 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.561 1.945 -11.264 1.00 0.00 H new ATOM 580 N TYR A 40 -13.462 5.215 -9.788 1.00 0.00 N ATOM 581 CA TYR A 40 -12.882 6.359 -9.115 1.00 0.00 C ATOM 582 C TYR A 40 -11.989 5.904 -7.955 1.00 0.00 C ATOM 583 O TYR A 40 -10.760 6.011 -8.024 1.00 0.00 O ATOM 584 CB TYR A 40 -14.001 7.261 -8.579 1.00 0.00 C ATOM 585 CG TYR A 40 -13.544 8.628 -8.128 1.00 0.00 C ATOM 586 CD1 TYR A 40 -13.311 9.632 -9.053 1.00 0.00 C ATOM 587 CD2 TYR A 40 -13.360 8.913 -6.796 1.00 0.00 C ATOM 588 CE1 TYR A 40 -12.903 10.882 -8.657 1.00 0.00 C ATOM 589 CE2 TYR A 40 -12.951 10.159 -6.386 1.00 0.00 C ATOM 590 CZ TYR A 40 -12.722 11.144 -7.323 1.00 0.00 C ATOM 591 OH TYR A 40 -12.316 12.403 -6.918 1.00 0.00 O ATOM 0 H TYR A 40 -14.482 5.221 -9.797 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.273 6.914 -9.829 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.756 7.383 -9.356 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -14.485 6.759 -7.741 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -13.453 9.428 -10.104 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -13.540 8.144 -6.059 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.726 11.654 -9.391 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -12.810 10.366 -5.335 1.00 0.00 H new ATOM 0 HH TYR A 40 -11.374 12.372 -6.648 1.00 0.00 H new ATOM 601 N THR A 41 -12.625 5.410 -6.883 1.00 0.00 N ATOM 602 CA THR A 41 -12.016 4.933 -5.669 1.00 0.00 C ATOM 603 C THR A 41 -10.751 4.100 -5.897 1.00 0.00 C ATOM 604 O THR A 41 -9.693 4.421 -5.367 1.00 0.00 O ATOM 605 CB THR A 41 -13.051 4.070 -4.977 1.00 0.00 C ATOM 606 OG1 THR A 41 -14.330 4.706 -5.101 1.00 0.00 O ATOM 607 CG2 THR A 41 -12.730 3.911 -3.527 1.00 0.00 C ATOM 0 H THR A 41 -13.642 5.336 -6.856 1.00 0.00 H new ATOM 0 HA THR A 41 -11.707 5.796 -5.079 1.00 0.00 H new ATOM 0 HB THR A 41 -13.058 3.084 -5.442 1.00 0.00 H new ATOM 0 HG1 THR A 41 -15.037 4.066 -4.875 1.00 0.00 H new ATOM 0 HG21 THR A 41 -13.488 3.287 -3.053 1.00 0.00 H new ATOM 0 HG22 THR A 41 -11.753 3.439 -3.420 1.00 0.00 H new ATOM 0 HG23 THR A 41 -12.714 4.890 -3.048 1.00 0.00 H new ATOM 615 N LEU A 42 -10.838 3.065 -6.709 1.00 0.00 N ATOM 616 CA LEU A 42 -9.678 2.224 -6.887 1.00 0.00 C ATOM 617 C LEU A 42 -8.590 2.851 -7.714 1.00 0.00 C ATOM 618 O LEU A 42 -7.446 2.545 -7.509 1.00 0.00 O ATOM 619 CB LEU A 42 -9.929 0.721 -7.204 1.00 0.00 C ATOM 620 CG LEU A 42 -10.965 0.309 -8.264 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.368 0.483 -7.737 1.00 0.00 C ATOM 622 CD2 LEU A 42 -10.766 1.050 -9.579 1.00 0.00 C ATOM 0 H LEU A 42 -11.668 2.795 -7.237 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.289 2.169 -5.870 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.973 0.292 -7.504 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.216 0.239 -6.270 1.00 0.00 H new ATOM 0 HG LEU A 42 -10.812 -0.749 -8.476 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.084 0.186 -8.503 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.504 -0.139 -6.852 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -12.531 1.528 -7.474 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -11.520 0.727 -10.297 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -10.862 2.123 -9.410 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -9.773 0.832 -9.973 1.00 0.00 H new ATOM 634 N ALA A 43 -8.953 3.792 -8.585 1.00 0.00 N ATOM 635 CA ALA A 43 -7.963 4.525 -9.369 1.00 0.00 C ATOM 636 C ALA A 43 -7.080 5.309 -8.424 1.00 0.00 C ATOM 637 O ALA A 43 -5.887 5.487 -8.655 1.00 0.00 O ATOM 638 CB ALA A 43 -8.624 5.462 -10.367 1.00 0.00 C ATOM 0 H ALA A 43 -9.920 4.063 -8.764 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.367 3.812 -9.938 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.857 5.991 -10.933 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.246 4.885 -11.051 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.244 6.183 -9.834 1.00 0.00 H new ATOM 644 N ILE A 44 -7.674 5.716 -7.334 1.00 0.00 N ATOM 645 CA ILE A 44 -6.993 6.450 -6.293 1.00 0.00 C ATOM 646 C ILE A 44 -6.118 5.479 -5.472 1.00 0.00 C ATOM 647 O ILE A 44 -4.987 5.806 -5.122 1.00 0.00 O ATOM 648 CB ILE A 44 -8.012 7.134 -5.379 1.00 0.00 C ATOM 649 CG1 ILE A 44 -8.948 8.015 -6.201 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.309 7.973 -4.310 1.00 0.00 C ATOM 651 CD1 ILE A 44 -10.160 8.463 -5.439 1.00 0.00 C ATOM 0 H ILE A 44 -8.660 5.546 -7.138 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.361 7.214 -6.745 1.00 0.00 H new ATOM 0 HB ILE A 44 -8.596 6.360 -4.880 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.400 8.891 -6.547 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -9.267 7.467 -7.088 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.054 8.449 -3.673 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -6.671 7.330 -3.704 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -6.700 8.739 -4.791 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -10.784 9.086 -6.081 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -10.729 7.591 -5.115 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -9.849 9.038 -4.567 1.00 0.00 H new ATOM 663 N VAL A 45 -6.639 4.253 -5.222 1.00 0.00 N ATOM 664 CA VAL A 45 -5.882 3.195 -4.505 1.00 0.00 C ATOM 665 C VAL A 45 -4.626 2.860 -5.357 1.00 0.00 C ATOM 666 O VAL A 45 -3.527 2.624 -4.844 1.00 0.00 O ATOM 667 CB VAL A 45 -6.775 1.880 -4.252 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.051 0.810 -3.426 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.094 2.198 -3.554 1.00 0.00 C ATOM 0 H VAL A 45 -7.578 3.972 -5.505 1.00 0.00 H new ATOM 0 HA VAL A 45 -5.593 3.557 -3.518 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.969 1.490 -5.251 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -6.706 -0.050 -3.291 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.146 0.498 -3.947 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -5.785 1.220 -2.452 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.659 1.277 -3.407 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.892 2.659 -2.587 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -8.675 2.885 -4.169 1.00 0.00 H new ATOM 679 N GLU A 46 -4.797 2.937 -6.664 1.00 0.00 N ATOM 680 CA GLU A 46 -3.712 2.726 -7.604 1.00 0.00 C ATOM 681 C GLU A 46 -2.774 3.942 -7.649 1.00 0.00 C ATOM 682 O GLU A 46 -1.569 3.795 -7.841 1.00 0.00 O ATOM 683 CB GLU A 46 -4.262 2.436 -8.997 1.00 0.00 C ATOM 684 CG GLU A 46 -5.231 1.271 -9.031 1.00 0.00 C ATOM 685 CD GLU A 46 -5.659 0.916 -10.423 1.00 0.00 C ATOM 686 OE1 GLU A 46 -6.540 1.597 -10.995 1.00 0.00 O ATOM 687 OE2 GLU A 46 -5.113 -0.043 -10.993 1.00 0.00 O ATOM 0 H GLU A 46 -5.693 3.148 -7.104 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.138 1.864 -7.264 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -4.763 3.327 -9.374 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.431 2.228 -9.671 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.765 0.402 -8.566 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.111 1.518 -8.436 1.00 0.00 H new ATOM 694 N SER A 47 -3.325 5.130 -7.464 1.00 0.00 N ATOM 695 CA SER A 47 -2.538 6.351 -7.489 1.00 0.00 C ATOM 696 C SER A 47 -1.660 6.470 -6.251 1.00 0.00 C ATOM 697 O SER A 47 -0.501 6.912 -6.342 1.00 0.00 O ATOM 698 CB SER A 47 -3.433 7.574 -7.638 1.00 0.00 C ATOM 699 OG SER A 47 -4.174 7.490 -8.845 1.00 0.00 O ATOM 0 H SER A 47 -4.320 5.275 -7.294 1.00 0.00 H new ATOM 0 HA SER A 47 -1.882 6.302 -8.358 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.113 7.643 -6.789 1.00 0.00 H new ATOM 0 HB3 SER A 47 -2.827 8.480 -7.636 1.00 0.00 H new ATOM 0 HG SER A 47 -4.915 6.859 -8.731 1.00 0.00 H new ATOM 705 N VAL A 48 -2.192 6.074 -5.101 1.00 0.00 N ATOM 706 CA VAL A 48 -1.406 6.089 -3.887 1.00 0.00 C ATOM 707 C VAL A 48 -0.282 5.067 -3.970 1.00 0.00 C ATOM 708 O VAL A 48 0.849 5.356 -3.597 1.00 0.00 O ATOM 709 CB VAL A 48 -2.243 5.929 -2.578 1.00 0.00 C ATOM 710 CG1 VAL A 48 -3.114 7.146 -2.357 1.00 0.00 C ATOM 711 CG2 VAL A 48 -3.109 4.691 -2.611 1.00 0.00 C ATOM 0 H VAL A 48 -3.151 5.744 -4.990 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.973 7.087 -3.816 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.536 5.828 -1.755 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.691 7.019 -1.441 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -2.486 8.032 -2.270 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -3.794 7.265 -3.201 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.674 4.618 -1.682 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.800 4.752 -3.452 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.479 3.809 -2.723 1.00 0.00 H new ATOM 721 N ALA A 49 -0.585 3.918 -4.565 1.00 0.00 N ATOM 722 CA ALA A 49 0.382 2.829 -4.752 1.00 0.00 C ATOM 723 C ALA A 49 1.388 3.147 -5.855 1.00 0.00 C ATOM 724 O ALA A 49 2.344 2.424 -6.069 1.00 0.00 O ATOM 725 CB ALA A 49 -0.355 1.556 -5.089 1.00 0.00 C ATOM 0 H ALA A 49 -1.512 3.710 -4.935 1.00 0.00 H new ATOM 0 HA ALA A 49 0.937 2.708 -3.821 1.00 0.00 H new ATOM 0 HB1 ALA A 49 0.362 0.747 -5.228 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.035 1.303 -4.275 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.925 1.698 -6.007 1.00 0.00 H new ATOM 731 N ASP A 50 1.172 4.247 -6.531 1.00 0.00 N ATOM 732 CA ASP A 50 2.047 4.688 -7.610 1.00 0.00 C ATOM 733 C ASP A 50 3.161 5.565 -7.024 1.00 0.00 C ATOM 734 O ASP A 50 3.995 6.151 -7.719 1.00 0.00 O ATOM 735 CB ASP A 50 1.209 5.408 -8.668 1.00 0.00 C ATOM 736 CG ASP A 50 1.992 5.945 -9.843 1.00 0.00 C ATOM 737 OD1 ASP A 50 2.642 5.157 -10.571 1.00 0.00 O ATOM 738 OD2 ASP A 50 1.915 7.173 -10.104 1.00 0.00 O ATOM 0 H ASP A 50 0.384 4.870 -6.355 1.00 0.00 H new ATOM 0 HA ASP A 50 2.529 3.843 -8.102 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.450 4.719 -9.040 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.683 6.235 -8.192 1.00 0.00 H new ATOM 743 N ASN A 51 3.178 5.579 -5.725 1.00 0.00 N ATOM 744 CA ASN A 51 4.167 6.242 -4.922 1.00 0.00 C ATOM 745 C ASN A 51 4.787 5.156 -4.114 1.00 0.00 C ATOM 746 O ASN A 51 4.135 4.166 -3.892 1.00 0.00 O ATOM 747 CB ASN A 51 3.514 7.245 -3.958 1.00 0.00 C ATOM 748 CG ASN A 51 2.960 8.475 -4.626 1.00 0.00 C ATOM 749 OD1 ASN A 51 3.652 9.466 -4.779 1.00 0.00 O ATOM 750 ND2 ASN A 51 1.712 8.430 -5.015 1.00 0.00 N ATOM 0 H ASN A 51 2.468 5.105 -5.167 1.00 0.00 H new ATOM 0 HA ASN A 51 4.876 6.789 -5.543 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.709 6.744 -3.421 1.00 0.00 H new ATOM 0 HB3 ASN A 51 4.251 7.550 -3.215 1.00 0.00 H new ATOM 0 HD21 ASN A 51 1.288 9.242 -5.463 1.00 0.00 H new ATOM 0 HD22 ASN A 51 1.163 7.583 -4.870 1.00 0.00 H new ATOM 757 N TRP A 52 6.001 5.358 -3.615 1.00 0.00 N ATOM 758 CA TRP A 52 6.737 4.313 -2.845 1.00 0.00 C ATOM 759 C TRP A 52 6.109 4.026 -1.481 1.00 0.00 C ATOM 760 O TRP A 52 6.665 3.264 -0.709 1.00 0.00 O ATOM 761 CB TRP A 52 8.214 4.679 -2.678 1.00 0.00 C ATOM 762 CG TRP A 52 8.994 4.708 -3.962 1.00 0.00 C ATOM 763 CD1 TRP A 52 8.616 4.187 -5.169 1.00 0.00 C ATOM 764 CD2 TRP A 52 10.302 5.255 -4.153 1.00 0.00 C ATOM 765 NE1 TRP A 52 9.600 4.389 -6.096 1.00 0.00 N ATOM 766 CE2 TRP A 52 10.650 5.047 -5.497 1.00 0.00 C ATOM 767 CE3 TRP A 52 11.212 5.910 -3.314 1.00 0.00 C ATOM 768 CZ2 TRP A 52 11.870 5.467 -6.024 1.00 0.00 C ATOM 769 CZ3 TRP A 52 12.417 6.323 -3.835 1.00 0.00 C ATOM 770 CH2 TRP A 52 12.740 6.104 -5.174 1.00 0.00 C ATOM 0 H TRP A 52 6.514 6.233 -3.720 1.00 0.00 H new ATOM 0 HA TRP A 52 6.663 3.399 -3.435 1.00 0.00 H new ATOM 0 HB2 TRP A 52 8.282 5.658 -2.203 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.679 3.963 -2.000 1.00 0.00 H new ATOM 0 HD1 TRP A 52 7.677 3.689 -5.361 1.00 0.00 H new ATOM 0 HE1 TRP A 52 9.562 4.099 -7.073 1.00 0.00 H new ATOM 0 HE3 TRP A 52 10.972 6.088 -2.276 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 12.121 5.298 -7.061 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 13.126 6.826 -3.195 1.00 0.00 H new ATOM 0 HH2 TRP A 52 13.694 6.442 -5.550 1.00 0.00 H new ATOM 781 N LEU A 53 5.037 4.782 -1.210 1.00 0.00 N ATOM 782 CA LEU A 53 4.073 4.663 -0.094 1.00 0.00 C ATOM 783 C LEU A 53 4.414 3.516 0.887 1.00 0.00 C ATOM 784 O LEU A 53 4.294 2.338 0.534 1.00 0.00 O ATOM 785 CB LEU A 53 2.724 4.342 -0.760 1.00 0.00 C ATOM 786 CG LEU A 53 1.453 4.588 0.026 1.00 0.00 C ATOM 787 CD1 LEU A 53 1.201 6.073 0.165 1.00 0.00 C ATOM 788 CD2 LEU A 53 0.280 3.914 -0.649 1.00 0.00 C ATOM 0 H LEU A 53 4.795 5.565 -1.818 1.00 0.00 H new ATOM 0 HA LEU A 53 4.078 5.583 0.491 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.662 4.923 -1.680 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.738 3.291 -1.047 1.00 0.00 H new ATOM 0 HG LEU A 53 1.571 4.162 1.022 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.284 6.235 0.732 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.038 6.537 0.688 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.099 6.519 -0.824 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.627 4.099 -0.073 1.00 0.00 H new ATOM 0 HD22 LEU A 53 0.159 4.316 -1.655 1.00 0.00 H new ATOM 0 HD23 LEU A 53 0.461 2.841 -0.706 1.00 0.00 H new ATOM 800 N THR A 54 4.780 3.866 2.093 1.00 0.00 N ATOM 801 CA THR A 54 5.192 2.873 3.071 1.00 0.00 C ATOM 802 C THR A 54 3.988 2.110 3.629 1.00 0.00 C ATOM 803 O THR A 54 2.873 2.626 3.601 1.00 0.00 O ATOM 804 CB THR A 54 6.005 3.517 4.225 1.00 0.00 C ATOM 805 OG1 THR A 54 5.474 4.809 4.586 1.00 0.00 O ATOM 806 CG2 THR A 54 7.480 3.636 3.889 1.00 0.00 C ATOM 0 H THR A 54 4.804 4.829 2.428 1.00 0.00 H new ATOM 0 HA THR A 54 5.839 2.163 2.556 1.00 0.00 H new ATOM 0 HB THR A 54 5.909 2.848 5.080 1.00 0.00 H new ATOM 0 HG1 THR A 54 4.549 4.883 4.269 1.00 0.00 H new ATOM 0 HG21 THR A 54 8.008 4.092 4.726 1.00 0.00 H new ATOM 0 HG22 THR A 54 7.891 2.645 3.698 1.00 0.00 H new ATOM 0 HG23 THR A 54 7.602 4.257 3.001 1.00 0.00 H new ATOM 814 N PRO A 55 4.186 0.871 4.144 1.00 0.00 N ATOM 815 CA PRO A 55 3.104 0.059 4.718 1.00 0.00 C ATOM 816 C PRO A 55 2.306 0.783 5.816 1.00 0.00 C ATOM 817 O PRO A 55 1.140 0.476 6.034 1.00 0.00 O ATOM 818 CB PRO A 55 3.828 -1.164 5.275 1.00 0.00 C ATOM 819 CG PRO A 55 5.033 -1.281 4.412 1.00 0.00 C ATOM 820 CD PRO A 55 5.468 0.129 4.151 1.00 0.00 C ATOM 0 HA PRO A 55 2.350 -0.183 3.969 1.00 0.00 H new ATOM 0 HB2 PRO A 55 4.097 -1.028 6.323 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.207 -2.058 5.219 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.819 -1.850 4.908 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.802 -1.800 3.482 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.143 0.494 4.925 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.994 0.221 3.201 1.00 0.00 H new ATOM 828 N THR A 56 2.931 1.740 6.487 1.00 0.00 N ATOM 829 CA THR A 56 2.253 2.537 7.487 1.00 0.00 C ATOM 830 C THR A 56 1.184 3.436 6.808 1.00 0.00 C ATOM 831 O THR A 56 0.057 3.588 7.323 1.00 0.00 O ATOM 832 CB THR A 56 3.269 3.372 8.342 1.00 0.00 C ATOM 833 OG1 THR A 56 2.607 4.077 9.397 1.00 0.00 O ATOM 834 CG2 THR A 56 4.070 4.357 7.494 1.00 0.00 C ATOM 0 H THR A 56 3.913 1.981 6.352 1.00 0.00 H new ATOM 0 HA THR A 56 1.743 1.869 8.182 1.00 0.00 H new ATOM 0 HB THR A 56 3.965 2.653 8.774 1.00 0.00 H new ATOM 0 HG1 THR A 56 3.266 4.587 9.913 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.759 4.910 8.132 1.00 0.00 H new ATOM 0 HG22 THR A 56 4.635 3.811 6.738 1.00 0.00 H new ATOM 0 HG23 THR A 56 3.389 5.054 7.005 1.00 0.00 H new ATOM 842 N ASP A 57 1.518 3.959 5.620 1.00 0.00 N ATOM 843 CA ASP A 57 0.594 4.767 4.824 1.00 0.00 C ATOM 844 C ASP A 57 -0.555 3.904 4.407 1.00 0.00 C ATOM 845 O ASP A 57 -1.715 4.262 4.601 1.00 0.00 O ATOM 846 CB ASP A 57 1.247 5.322 3.555 1.00 0.00 C ATOM 847 CG ASP A 57 2.383 6.291 3.769 1.00 0.00 C ATOM 848 OD1 ASP A 57 2.148 7.405 4.248 1.00 0.00 O ATOM 849 OD2 ASP A 57 3.525 5.985 3.368 1.00 0.00 O ATOM 0 H ASP A 57 2.433 3.832 5.188 1.00 0.00 H new ATOM 0 HA ASP A 57 0.276 5.607 5.441 1.00 0.00 H new ATOM 0 HB2 ASP A 57 1.616 4.484 2.963 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.479 5.818 2.961 1.00 0.00 H new ATOM 854 N TRP A 58 -0.212 2.734 3.854 1.00 0.00 N ATOM 855 CA TRP A 58 -1.199 1.748 3.435 1.00 0.00 C ATOM 856 C TRP A 58 -2.137 1.411 4.605 1.00 0.00 C ATOM 857 O TRP A 58 -3.358 1.522 4.487 1.00 0.00 O ATOM 858 CB TRP A 58 -0.527 0.449 2.926 1.00 0.00 C ATOM 859 CG TRP A 58 0.211 0.518 1.598 1.00 0.00 C ATOM 860 CD1 TRP A 58 1.478 0.967 1.376 1.00 0.00 C ATOM 861 CD2 TRP A 58 -0.266 0.040 0.321 1.00 0.00 C ATOM 862 NE1 TRP A 58 1.817 0.805 0.051 1.00 0.00 N ATOM 863 CE2 TRP A 58 0.773 0.236 -0.614 1.00 0.00 C ATOM 864 CE3 TRP A 58 -1.463 -0.532 -0.122 1.00 0.00 C ATOM 865 CZ2 TRP A 58 0.656 -0.127 -1.957 1.00 0.00 C ATOM 866 CZ3 TRP A 58 -1.577 -0.892 -1.453 1.00 0.00 C ATOM 867 CH2 TRP A 58 -0.524 -0.695 -2.359 1.00 0.00 C ATOM 0 H TRP A 58 0.754 2.451 3.688 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.770 2.182 2.614 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.178 0.114 3.687 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -1.296 -0.319 2.845 1.00 0.00 H new ATOM 0 HD1 TRP A 58 2.124 1.390 2.131 1.00 0.00 H new ATOM 0 HE1 TRP A 58 2.709 1.069 -0.367 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -2.283 -0.690 0.562 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 1.466 0.034 -2.653 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -2.498 -1.335 -1.803 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -0.646 -0.996 -3.389 1.00 0.00 H new ATOM 878 N ASN A 59 -1.559 1.053 5.747 1.00 0.00 N ATOM 879 CA ASN A 59 -2.342 0.671 6.936 1.00 0.00 C ATOM 880 C ASN A 59 -3.319 1.782 7.291 1.00 0.00 C ATOM 881 O ASN A 59 -4.487 1.538 7.546 1.00 0.00 O ATOM 882 CB ASN A 59 -1.416 0.356 8.126 1.00 0.00 C ATOM 883 CG ASN A 59 -2.145 -0.253 9.325 1.00 0.00 C ATOM 884 OD1 ASN A 59 -2.603 0.449 10.227 1.00 0.00 O ATOM 885 ND2 ASN A 59 -2.222 -1.561 9.360 1.00 0.00 N ATOM 0 H ASN A 59 -0.549 1.017 5.883 1.00 0.00 H new ATOM 0 HA ASN A 59 -2.906 -0.233 6.707 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -0.637 -0.332 7.797 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -0.919 1.273 8.441 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -2.671 -2.024 10.150 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -1.833 -2.115 8.597 1.00 0.00 H new ATOM 892 N THR A 60 -2.861 2.995 7.154 1.00 0.00 N ATOM 893 CA THR A 60 -3.658 4.147 7.458 1.00 0.00 C ATOM 894 C THR A 60 -4.794 4.341 6.416 1.00 0.00 C ATOM 895 O THR A 60 -5.861 4.881 6.743 1.00 0.00 O ATOM 896 CB THR A 60 -2.748 5.388 7.560 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.799 5.169 8.620 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.529 6.683 7.796 1.00 0.00 C ATOM 0 H THR A 60 -1.920 3.212 6.827 1.00 0.00 H new ATOM 0 HA THR A 60 -4.147 3.999 8.421 1.00 0.00 H new ATOM 0 HB THR A 60 -2.237 5.516 6.606 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.037 5.774 8.507 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.834 7.521 7.859 1.00 0.00 H new ATOM 0 HG22 THR A 60 -4.221 6.846 6.970 1.00 0.00 H new ATOM 0 HG23 THR A 60 -4.089 6.605 8.728 1.00 0.00 H new ATOM 906 N LEU A 61 -4.595 3.825 5.193 1.00 0.00 N ATOM 907 CA LEU A 61 -5.599 3.953 4.157 1.00 0.00 C ATOM 908 C LEU A 61 -6.796 3.140 4.561 1.00 0.00 C ATOM 909 O LEU A 61 -7.850 3.685 4.760 1.00 0.00 O ATOM 910 CB LEU A 61 -5.109 3.484 2.775 1.00 0.00 C ATOM 911 CG LEU A 61 -3.922 4.210 2.137 1.00 0.00 C ATOM 912 CD1 LEU A 61 -3.519 3.495 0.859 1.00 0.00 C ATOM 913 CD2 LEU A 61 -4.273 5.658 1.825 1.00 0.00 C ATOM 0 H LEU A 61 -3.753 3.323 4.911 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.842 5.011 4.059 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -4.848 2.429 2.856 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -5.950 3.552 2.084 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.091 4.203 2.843 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.674 4.012 0.404 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.235 2.468 1.090 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -4.359 3.491 0.164 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.413 6.152 1.373 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.114 5.687 1.132 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.544 6.173 2.746 1.00 0.00 H new ATOM 925 N VAL A 62 -6.604 1.839 4.782 1.00 0.00 N ATOM 926 CA VAL A 62 -7.742 0.964 5.178 1.00 0.00 C ATOM 927 C VAL A 62 -8.370 1.394 6.468 1.00 0.00 C ATOM 928 O VAL A 62 -9.542 1.166 6.706 1.00 0.00 O ATOM 929 CB VAL A 62 -7.379 -0.523 5.306 1.00 0.00 C ATOM 930 CG1 VAL A 62 -7.308 -1.156 3.972 1.00 0.00 C ATOM 931 CG2 VAL A 62 -6.068 -0.712 6.037 1.00 0.00 C ATOM 0 H VAL A 62 -5.705 1.365 4.701 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.447 1.077 4.355 1.00 0.00 H new ATOM 0 HB VAL A 62 -8.165 -1.004 5.888 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -7.050 -2.209 4.082 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -8.275 -1.069 3.476 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.547 -0.657 3.372 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.842 -1.776 6.110 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -5.271 -0.208 5.491 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -6.145 -0.288 7.038 1.00 0.00 H new ATOM 941 N ARG A 63 -7.595 2.016 7.291 1.00 0.00 N ATOM 942 CA ARG A 63 -8.125 2.426 8.591 1.00 0.00 C ATOM 943 C ARG A 63 -9.008 3.642 8.507 1.00 0.00 C ATOM 944 O ARG A 63 -10.025 3.737 9.197 1.00 0.00 O ATOM 945 CB ARG A 63 -7.050 2.614 9.667 1.00 0.00 C ATOM 946 CG ARG A 63 -6.217 1.380 9.931 1.00 0.00 C ATOM 947 CD ARG A 63 -7.018 0.102 9.753 1.00 0.00 C ATOM 948 NE ARG A 63 -8.191 -0.014 10.651 1.00 0.00 N ATOM 949 CZ ARG A 63 -9.396 -0.526 10.285 1.00 0.00 C ATOM 950 NH1 ARG A 63 -9.603 -0.923 9.033 1.00 0.00 N ATOM 951 NH2 ARG A 63 -10.383 -0.609 11.173 1.00 0.00 N ATOM 0 H ARG A 63 -6.619 2.256 7.116 1.00 0.00 H new ATOM 0 HA ARG A 63 -8.743 1.584 8.905 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.390 3.428 9.367 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -7.531 2.920 10.596 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.362 1.369 9.255 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -5.821 1.421 10.946 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.359 0.042 8.720 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -6.361 -0.751 9.921 1.00 0.00 H new ATOM 0 HE ARG A 63 -8.087 0.313 11.611 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -8.856 -0.844 8.343 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -10.509 -1.307 8.763 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -10.236 -0.288 12.130 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -11.287 -0.993 10.897 1.00 0.00 H new ATOM 965 N ALA A 64 -8.649 4.544 7.677 1.00 0.00 N ATOM 966 CA ALA A 64 -9.391 5.782 7.565 1.00 0.00 C ATOM 967 C ALA A 64 -10.367 5.792 6.382 1.00 0.00 C ATOM 968 O ALA A 64 -11.573 6.016 6.559 1.00 0.00 O ATOM 969 CB ALA A 64 -8.420 6.949 7.445 1.00 0.00 C ATOM 0 H ALA A 64 -7.845 4.468 7.054 1.00 0.00 H new ATOM 0 HA ALA A 64 -9.992 5.878 8.469 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -8.979 7.881 7.361 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.785 6.986 8.330 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.800 6.817 6.558 1.00 0.00 H new ATOM 975 N VAL A 65 -9.826 5.553 5.224 1.00 0.00 N ATOM 976 CA VAL A 65 -10.565 5.737 3.977 1.00 0.00 C ATOM 977 C VAL A 65 -11.843 4.881 3.837 1.00 0.00 C ATOM 978 O VAL A 65 -12.927 5.426 3.638 1.00 0.00 O ATOM 979 CB VAL A 65 -9.671 5.689 2.681 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.439 6.568 2.832 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.298 4.279 2.239 1.00 0.00 C ATOM 0 H VAL A 65 -8.868 5.227 5.101 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.920 6.764 4.064 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.290 6.091 1.879 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.841 6.515 1.922 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.747 7.599 3.005 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.845 6.220 3.677 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.683 4.330 1.341 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.740 3.784 3.034 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.205 3.713 2.026 1.00 0.00 H new ATOM 991 N LEU A 66 -11.747 3.591 4.002 1.00 0.00 N ATOM 992 CA LEU A 66 -12.895 2.753 3.802 1.00 0.00 C ATOM 993 C LEU A 66 -13.170 2.073 5.122 1.00 0.00 C ATOM 994 O LEU A 66 -12.267 1.911 5.937 1.00 0.00 O ATOM 995 CB LEU A 66 -12.630 1.766 2.622 1.00 0.00 C ATOM 996 CG LEU A 66 -13.845 1.322 1.734 1.00 0.00 C ATOM 997 CD1 LEU A 66 -13.350 0.713 0.465 1.00 0.00 C ATOM 998 CD2 LEU A 66 -14.762 0.337 2.437 1.00 0.00 C ATOM 0 H LEU A 66 -10.894 3.101 4.272 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.783 3.315 3.512 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.889 2.224 1.966 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -12.176 0.866 3.037 1.00 0.00 H new ATOM 0 HG LEU A 66 -14.427 2.220 1.527 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -14.199 0.407 -0.147 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.754 1.444 -0.081 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -12.736 -0.158 0.695 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -15.583 0.067 1.773 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -14.200 -0.559 2.701 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -15.162 0.794 3.342 1.00 0.00 H new ATOM 1010 N SER A 67 -14.383 1.765 5.362 1.00 0.00 N ATOM 1011 CA SER A 67 -14.750 1.220 6.629 1.00 0.00 C ATOM 1012 C SER A 67 -15.634 -0.015 6.517 1.00 0.00 C ATOM 1013 O SER A 67 -16.672 -0.004 5.851 1.00 0.00 O ATOM 1014 CB SER A 67 -15.412 2.313 7.464 1.00 0.00 C ATOM 1015 OG SER A 67 -14.536 3.447 7.564 1.00 0.00 O ATOM 0 H SER A 67 -15.152 1.877 4.701 1.00 0.00 H new ATOM 0 HA SER A 67 -13.843 0.876 7.126 1.00 0.00 H new ATOM 0 HB2 SER A 67 -16.356 2.610 7.008 1.00 0.00 H new ATOM 0 HB3 SER A 67 -15.645 1.933 8.459 1.00 0.00 H new ATOM 0 HG SER A 67 -14.966 4.146 8.099 1.00 0.00 H new ATOM 1021 N GLY A 68 -15.148 -1.100 7.085 1.00 0.00 N ATOM 1022 CA GLY A 68 -15.907 -2.322 7.208 1.00 0.00 C ATOM 1023 C GLY A 68 -15.703 -3.210 6.029 1.00 0.00 C ATOM 1024 O GLY A 68 -15.258 -4.359 6.164 1.00 0.00 O ATOM 0 H GLY A 68 -14.208 -1.156 7.476 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -15.610 -2.847 8.116 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -16.966 -2.086 7.308 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.010 -2.675 4.864 1.00 0.00 N ATOM 1029 CA GLY A 69 -15.800 -3.388 3.639 1.00 0.00 C ATOM 1030 C GLY A 69 -14.326 -3.601 3.392 1.00 0.00 C ATOM 1031 O GLY A 69 -13.923 -4.628 2.824 1.00 0.00 O ATOM 0 H GLY A 69 -16.408 -1.743 4.749 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.310 -4.351 3.681 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.236 -2.832 2.809 1.00 0.00 H new ATOM 1035 N ASP A 70 -13.530 -2.621 3.861 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.066 -2.599 3.714 1.00 0.00 C ATOM 1037 C ASP A 70 -11.463 -3.937 4.088 1.00 0.00 C ATOM 1038 O ASP A 70 -10.844 -4.608 3.245 1.00 0.00 O ATOM 1039 CB ASP A 70 -11.397 -1.442 4.559 1.00 0.00 C ATOM 1040 CG ASP A 70 -11.377 -1.659 6.087 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -12.426 -1.458 6.751 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -10.321 -2.070 6.636 1.00 0.00 O ATOM 0 H ASP A 70 -13.895 -1.810 4.361 1.00 0.00 H new ATOM 0 HA ASP A 70 -11.859 -2.400 2.663 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -10.371 -1.312 4.215 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -11.924 -0.511 4.349 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.761 -4.376 5.304 1.00 0.00 N ATOM 1048 CA HIS A 71 -11.168 -5.542 5.859 1.00 0.00 C ATOM 1049 C HIS A 71 -11.532 -6.759 5.053 1.00 0.00 C ATOM 1050 O HIS A 71 -10.649 -7.447 4.543 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.545 -5.720 7.343 1.00 0.00 C ATOM 1052 CG HIS A 71 -10.800 -6.842 8.018 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -11.386 -8.021 8.390 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -9.503 -6.944 8.388 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -10.498 -8.802 8.953 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -9.344 -8.175 8.964 1.00 0.00 N ATOM 0 H HIS A 71 -12.429 -3.915 5.922 1.00 0.00 H new ATOM 0 HA HIS A 71 -10.086 -5.418 5.815 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -11.346 -4.790 7.875 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -12.616 -5.908 7.418 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -8.737 -6.195 8.254 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -10.683 -9.792 9.342 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -8.471 -8.545 9.341 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.814 -6.977 4.872 1.00 0.00 N ATOM 1066 CA LEU A 72 -13.263 -8.157 4.192 1.00 0.00 C ATOM 1067 C LEU A 72 -12.700 -8.349 2.763 1.00 0.00 C ATOM 1068 O LEU A 72 -12.003 -9.335 2.524 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.781 -8.480 4.406 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.830 -7.352 4.264 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -16.077 -6.976 2.824 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -17.133 -7.756 4.933 1.00 0.00 C ATOM 0 H LEU A 72 -13.557 -6.353 5.187 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.775 -8.980 4.714 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -15.050 -9.266 3.700 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.887 -8.900 5.406 1.00 0.00 H new ATOM 0 HG LEU A 72 -15.425 -6.471 4.763 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.821 -6.181 2.778 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -15.147 -6.629 2.374 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -16.442 -7.846 2.278 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.862 -6.953 4.825 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -17.518 -8.661 4.463 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.955 -7.945 5.992 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.873 -7.404 1.858 1.00 0.00 N ATOM 1085 CA LEU A 73 -12.320 -7.631 0.518 1.00 0.00 C ATOM 1086 C LEU A 73 -10.879 -7.200 0.339 1.00 0.00 C ATOM 1087 O LEU A 73 -10.020 -8.062 0.002 1.00 0.00 O ATOM 1088 CB LEU A 73 -13.202 -7.170 -0.639 1.00 0.00 C ATOM 1089 CG LEU A 73 -14.240 -8.184 -1.156 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -13.588 -9.507 -1.541 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -15.362 -8.397 -0.178 1.00 0.00 C ATOM 0 H LEU A 73 -13.360 -6.519 2.001 1.00 0.00 H new ATOM 0 HA LEU A 73 -12.315 -8.720 0.464 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.730 -6.269 -0.328 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.556 -6.889 -1.470 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.676 -7.753 -2.057 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -14.351 -10.197 -1.901 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.853 -9.335 -2.328 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -13.093 -9.936 -0.670 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -16.068 -9.120 -0.586 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.959 -8.775 0.762 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.873 -7.451 0.001 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.580 -5.901 0.582 1.00 0.00 N ATOM 1104 CA TRP A 74 -9.240 -5.386 0.426 1.00 0.00 C ATOM 1105 C TRP A 74 -8.269 -6.213 1.267 1.00 0.00 C ATOM 1106 O TRP A 74 -7.197 -6.609 0.847 1.00 0.00 O ATOM 1107 CB TRP A 74 -9.145 -3.913 0.910 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.771 -2.757 0.082 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.727 -2.762 -0.904 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.373 -1.392 0.194 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -10.979 -1.474 -1.329 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.172 -0.613 -0.652 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.438 -0.792 0.949 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.048 0.787 -0.736 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.283 0.600 0.886 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.100 1.385 0.054 1.00 0.00 C ATOM 0 H TRP A 74 -11.264 -5.208 0.886 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.988 -5.441 -0.633 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.593 -3.874 1.903 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -8.086 -3.684 1.029 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.211 -3.646 -1.291 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.662 -1.209 -2.039 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -7.809 -1.379 1.601 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -10.675 1.367 -1.397 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.523 1.077 1.487 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -8.981 2.458 0.037 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.661 -6.473 2.440 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.778 -7.062 3.371 1.00 0.00 C ATOM 1129 C LYS A 75 -7.694 -8.557 3.372 1.00 0.00 C ATOM 1130 O LYS A 75 -6.598 -9.075 3.612 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.846 -6.401 4.713 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.629 -4.905 4.563 1.00 0.00 C ATOM 1133 CD LYS A 75 -6.178 -4.577 4.196 1.00 0.00 C ATOM 1134 CE LYS A 75 -5.351 -4.553 5.481 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.943 -4.145 5.324 1.00 0.00 N ATOM 0 H LYS A 75 -9.600 -6.288 2.792 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.783 -6.836 2.987 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.815 -6.592 5.174 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -7.089 -6.823 5.375 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.296 -4.516 3.794 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.891 -4.404 5.495 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.784 -5.322 3.505 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.123 -3.613 3.691 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.830 -3.876 6.188 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.375 -5.548 5.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.532 -3.948 6.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.409 -4.910 4.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.893 -3.288 4.737 1.00 0.00 H new ATOM 1149 N SER A 76 -8.794 -9.286 3.096 1.00 0.00 N ATOM 1150 CA SER A 76 -8.649 -10.727 3.026 1.00 0.00 C ATOM 1151 C SER A 76 -7.675 -11.058 1.908 1.00 0.00 C ATOM 1152 O SER A 76 -6.744 -11.867 2.100 1.00 0.00 O ATOM 1153 CB SER A 76 -9.977 -11.458 2.835 1.00 0.00 C ATOM 1154 OG SER A 76 -9.806 -12.876 2.888 1.00 0.00 O ATOM 0 H SER A 76 -9.731 -8.918 2.929 1.00 0.00 H new ATOM 0 HA SER A 76 -8.263 -11.077 3.983 1.00 0.00 H new ATOM 0 HB2 SER A 76 -10.680 -11.146 3.608 1.00 0.00 H new ATOM 0 HB3 SER A 76 -10.413 -11.178 1.876 1.00 0.00 H new ATOM 0 HG SER A 76 -10.673 -13.315 2.764 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.807 -10.367 0.768 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.858 -10.593 -0.284 1.00 0.00 C ATOM 1162 C GLU A 77 -5.505 -9.978 -0.028 1.00 0.00 C ATOM 1163 O GLU A 77 -4.547 -10.355 -0.686 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.340 -10.255 -1.671 1.00 0.00 C ATOM 1165 CG GLU A 77 -8.162 -11.332 -2.317 1.00 0.00 C ATOM 1166 CD GLU A 77 -8.123 -11.225 -3.811 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -7.023 -11.243 -4.390 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -9.179 -11.156 -4.453 1.00 0.00 O ATOM 0 H GLU A 77 -8.535 -9.680 0.572 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.742 -11.677 -0.260 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.931 -9.341 -1.625 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.477 -10.045 -2.302 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -7.790 -12.310 -2.011 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.194 -11.261 -1.972 1.00 0.00 H new ATOM 1175 N PHE A 78 -5.391 -9.025 0.909 1.00 0.00 N ATOM 1176 CA PHE A 78 -4.077 -8.475 1.222 1.00 0.00 C ATOM 1177 C PHE A 78 -3.207 -9.575 1.744 1.00 0.00 C ATOM 1178 O PHE A 78 -2.103 -9.784 1.257 1.00 0.00 O ATOM 1179 CB PHE A 78 -4.173 -7.341 2.265 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.831 -6.834 2.760 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -2.013 -6.084 1.938 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -2.399 -7.111 4.053 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.793 -5.621 2.380 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -1.178 -6.650 4.504 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.374 -5.904 3.665 1.00 0.00 C ATOM 0 H PHE A 78 -6.167 -8.634 1.443 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.649 -8.051 0.314 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.725 -6.508 1.829 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.752 -7.695 3.118 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.335 -5.857 0.932 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -3.026 -7.693 4.712 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.165 -5.038 1.723 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.853 -6.872 5.510 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.582 -5.542 4.014 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.753 -10.315 2.689 1.00 0.00 N ATOM 1196 CA PHE A 79 -3.053 -11.414 3.303 1.00 0.00 C ATOM 1197 C PHE A 79 -2.772 -12.510 2.293 1.00 0.00 C ATOM 1198 O PHE A 79 -1.626 -12.995 2.178 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.832 -11.932 4.512 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.859 -10.939 5.648 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -2.753 -10.776 6.466 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -4.969 -10.143 5.875 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -2.756 -9.847 7.487 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -4.978 -9.205 6.889 1.00 0.00 C ATOM 1205 CZ PHE A 79 -3.871 -9.060 7.696 1.00 0.00 C ATOM 0 H PHE A 79 -4.696 -10.167 3.049 1.00 0.00 H new ATOM 0 HA PHE A 79 -2.087 -11.058 3.662 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.854 -12.163 4.211 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -3.384 -12.863 4.858 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.876 -11.384 6.303 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.842 -10.257 5.249 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.888 -9.736 8.121 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -5.850 -8.588 7.049 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.875 -8.331 8.492 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.777 -12.830 1.515 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.676 -13.858 0.512 1.00 0.00 C ATOM 1217 C GLU A 80 -2.631 -13.545 -0.543 1.00 0.00 C ATOM 1218 O GLU A 80 -1.755 -14.350 -0.804 1.00 0.00 O ATOM 1219 CB GLU A 80 -5.026 -14.100 -0.126 1.00 0.00 C ATOM 1220 CG GLU A 80 -6.032 -14.661 0.848 1.00 0.00 C ATOM 1221 CD GLU A 80 -5.621 -16.017 1.361 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -4.764 -16.096 2.252 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -6.151 -17.034 0.873 1.00 0.00 O ATOM 0 H GLU A 80 -4.692 -12.382 1.561 1.00 0.00 H new ATOM 0 HA GLU A 80 -3.348 -14.768 1.015 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.404 -13.163 -0.535 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.911 -14.790 -0.962 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -6.147 -13.975 1.687 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -7.005 -14.736 0.362 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.691 -12.364 -1.103 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.799 -11.999 -2.195 1.00 0.00 C ATOM 1232 C ASN A 81 -0.389 -11.737 -1.740 1.00 0.00 C ATOM 1233 O ASN A 81 0.551 -12.090 -2.452 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.330 -10.826 -3.026 1.00 0.00 C ATOM 1235 CG ASN A 81 -3.619 -11.168 -3.743 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -3.856 -12.320 -4.108 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.451 -10.191 -3.956 1.00 0.00 N ATOM 0 H ASN A 81 -3.346 -11.632 -0.827 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.771 -12.875 -2.843 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.496 -9.968 -2.375 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.577 -10.531 -3.757 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.332 -10.367 -4.439 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.223 -9.249 -3.640 1.00 0.00 H new ATOM 1244 N CYS A 82 -0.219 -11.155 -0.541 1.00 0.00 N ATOM 1245 CA CYS A 82 1.128 -10.870 -0.047 1.00 0.00 C ATOM 1246 C CYS A 82 1.906 -12.163 0.128 1.00 0.00 C ATOM 1247 O CYS A 82 3.063 -12.276 -0.276 1.00 0.00 O ATOM 1248 CB CYS A 82 1.112 -10.045 1.262 1.00 0.00 C ATOM 1249 SG CYS A 82 0.364 -10.848 2.709 1.00 0.00 S ATOM 0 H CYS A 82 -0.977 -10.881 0.085 1.00 0.00 H new ATOM 0 HA CYS A 82 1.630 -10.255 -0.794 1.00 0.00 H new ATOM 0 HB2 CYS A 82 2.139 -9.779 1.511 1.00 0.00 H new ATOM 0 HB3 CYS A 82 0.578 -9.114 1.073 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.260 -11.925 2.333 1.00 0.00 H new ATOM 1255 N ARG A 83 1.243 -13.165 0.658 1.00 0.00 N ATOM 1256 CA ARG A 83 1.878 -14.426 0.861 1.00 0.00 C ATOM 1257 C ARG A 83 1.905 -15.271 -0.390 1.00 0.00 C ATOM 1258 O ARG A 83 2.759 -16.151 -0.521 1.00 0.00 O ATOM 1259 CB ARG A 83 1.370 -15.157 2.096 1.00 0.00 C ATOM 1260 CG ARG A 83 1.777 -14.458 3.399 1.00 0.00 C ATOM 1261 CD ARG A 83 3.304 -14.487 3.600 1.00 0.00 C ATOM 1262 NE ARG A 83 3.753 -13.715 4.778 1.00 0.00 N ATOM 1263 CZ ARG A 83 3.902 -14.229 6.018 1.00 0.00 C ATOM 1264 NH1 ARG A 83 3.548 -15.495 6.261 1.00 0.00 N ATOM 1265 NH2 ARG A 83 4.401 -13.480 7.004 1.00 0.00 N ATOM 0 H ARG A 83 0.267 -13.122 0.952 1.00 0.00 H new ATOM 0 HA ARG A 83 2.924 -14.212 1.080 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.283 -15.230 2.050 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.758 -16.176 2.097 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.430 -13.425 3.383 1.00 0.00 H new ATOM 0 HG3 ARG A 83 1.288 -14.945 4.243 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.630 -15.522 3.706 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.789 -14.090 2.708 1.00 0.00 H new ATOM 0 HE ARG A 83 3.965 -12.726 4.645 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.166 -16.071 5.511 1.00 0.00 H new ATOM 0 HH12 ARG A 83 3.660 -15.885 7.197 1.00 0.00 H new ATOM 0 HH21 ARG A 83 4.672 -12.514 6.823 1.00 0.00 H new ATOM 0 HH22 ARG A 83 4.511 -13.874 7.938 1.00 0.00 H new ATOM 1279 N ASP A 84 0.985 -15.004 -1.303 1.00 0.00 N ATOM 1280 CA ASP A 84 0.925 -15.706 -2.589 1.00 0.00 C ATOM 1281 C ASP A 84 2.162 -15.401 -3.394 1.00 0.00 C ATOM 1282 O ASP A 84 2.820 -16.295 -3.951 1.00 0.00 O ATOM 1283 CB ASP A 84 -0.273 -15.251 -3.408 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.447 -16.063 -4.668 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -0.921 -17.215 -4.586 1.00 0.00 O ATOM 1286 OD2 ASP A 84 -0.132 -15.553 -5.767 1.00 0.00 O ATOM 0 H ASP A 84 0.258 -14.299 -1.181 1.00 0.00 H new ATOM 0 HA ASP A 84 0.845 -16.772 -2.376 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -1.175 -15.328 -2.801 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -0.153 -14.200 -3.670 1.00 0.00 H new ATOM 1291 N THR A 85 2.503 -14.142 -3.443 1.00 0.00 N ATOM 1292 CA THR A 85 3.659 -13.753 -4.168 1.00 0.00 C ATOM 1293 C THR A 85 4.905 -14.046 -3.354 1.00 0.00 C ATOM 1294 O THR A 85 5.953 -14.347 -3.913 1.00 0.00 O ATOM 1295 CB THR A 85 3.584 -12.299 -4.693 1.00 0.00 C ATOM 1296 OG1 THR A 85 4.737 -11.983 -5.468 1.00 0.00 O ATOM 1297 CG2 THR A 85 3.465 -11.296 -3.590 1.00 0.00 C ATOM 0 H THR A 85 1.996 -13.382 -2.991 1.00 0.00 H new ATOM 0 HA THR A 85 3.712 -14.357 -5.074 1.00 0.00 H new ATOM 0 HB THR A 85 2.686 -12.245 -5.308 1.00 0.00 H new ATOM 0 HG1 THR A 85 4.630 -11.094 -5.866 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.416 -10.293 -4.014 1.00 0.00 H new ATOM 0 HG22 THR A 85 2.559 -11.492 -3.016 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.333 -11.371 -2.935 1.00 0.00 H new ATOM 1305 N ALA A 86 4.773 -14.017 -2.013 1.00 0.00 N ATOM 1306 CA ALA A 86 5.840 -14.444 -1.132 1.00 0.00 C ATOM 1307 C ALA A 86 6.301 -15.818 -1.505 1.00 0.00 C ATOM 1308 O ALA A 86 7.465 -16.010 -1.797 1.00 0.00 O ATOM 1309 CB ALA A 86 5.407 -14.416 0.317 1.00 0.00 C ATOM 0 H ALA A 86 3.932 -13.700 -1.531 1.00 0.00 H new ATOM 0 HA ALA A 86 6.668 -13.744 -1.248 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.232 -14.742 0.950 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.119 -13.401 0.591 1.00 0.00 H new ATOM 0 HB3 ALA A 86 4.557 -15.084 0.456 1.00 0.00 H new ATOM 1315 N LYS A 87 5.374 -16.759 -1.572 1.00 0.00 N ATOM 1316 CA LYS A 87 5.721 -18.136 -1.921 1.00 0.00 C ATOM 1317 C LYS A 87 6.288 -18.243 -3.342 1.00 0.00 C ATOM 1318 O LYS A 87 7.166 -19.061 -3.594 1.00 0.00 O ATOM 1319 CB LYS A 87 4.556 -19.123 -1.663 1.00 0.00 C ATOM 1320 CG LYS A 87 3.233 -18.700 -2.254 1.00 0.00 C ATOM 1321 CD LYS A 87 2.128 -19.715 -2.034 1.00 0.00 C ATOM 1322 CE LYS A 87 2.337 -20.943 -2.888 1.00 0.00 C ATOM 1323 NZ LYS A 87 1.208 -21.885 -2.806 1.00 0.00 N ATOM 0 H LYS A 87 4.382 -16.602 -1.392 1.00 0.00 H new ATOM 0 HA LYS A 87 6.522 -18.439 -1.247 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.826 -20.098 -2.070 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.435 -19.249 -0.587 1.00 0.00 H new ATOM 0 HG2 LYS A 87 2.935 -17.747 -1.816 1.00 0.00 H new ATOM 0 HG3 LYS A 87 3.357 -18.534 -3.324 1.00 0.00 H new ATOM 0 HD2 LYS A 87 2.097 -20.001 -0.983 1.00 0.00 H new ATOM 0 HD3 LYS A 87 1.164 -19.264 -2.270 1.00 0.00 H new ATOM 0 HE2 LYS A 87 2.479 -20.640 -3.925 1.00 0.00 H new ATOM 0 HE3 LYS A 87 3.251 -21.448 -2.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 1.400 -22.710 -3.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 1.087 -22.197 -1.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.339 -21.414 -3.130 1.00 0.00 H new ATOM 1337 N ARG A 88 5.830 -17.383 -4.253 1.00 0.00 N ATOM 1338 CA ARG A 88 6.390 -17.346 -5.623 1.00 0.00 C ATOM 1339 C ARG A 88 7.828 -16.836 -5.632 1.00 0.00 C ATOM 1340 O ARG A 88 8.684 -17.389 -6.316 1.00 0.00 O ATOM 1341 CB ARG A 88 5.555 -16.498 -6.581 1.00 0.00 C ATOM 1342 CG ARG A 88 4.545 -17.261 -7.411 1.00 0.00 C ATOM 1343 CD ARG A 88 3.506 -17.964 -6.582 1.00 0.00 C ATOM 1344 NE ARG A 88 2.629 -18.757 -7.435 1.00 0.00 N ATOM 1345 CZ ARG A 88 1.440 -19.236 -7.096 1.00 0.00 C ATOM 1346 NH1 ARG A 88 0.887 -18.902 -5.947 1.00 0.00 N ATOM 1347 NH2 ARG A 88 0.788 -20.012 -7.937 1.00 0.00 N ATOM 0 H ARG A 88 5.084 -16.709 -4.080 1.00 0.00 H new ATOM 0 HA ARG A 88 6.369 -18.378 -5.972 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.026 -15.740 -6.002 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.230 -15.971 -7.255 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.050 -16.570 -8.093 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.068 -17.995 -8.024 1.00 0.00 H new ATOM 0 HD2 ARG A 88 3.991 -18.608 -5.849 1.00 0.00 H new ATOM 0 HD3 ARG A 88 2.919 -17.233 -6.025 1.00 0.00 H new ATOM 0 HE ARG A 88 2.960 -18.962 -8.378 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.374 -18.271 -5.311 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -0.028 -19.275 -5.694 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.198 -20.241 -8.842 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.127 -20.384 -7.683 1.00 0.00 H new ATOM 1361 N ASN A 89 8.099 -15.809 -4.881 1.00 0.00 N ATOM 1362 CA ASN A 89 9.426 -15.262 -4.860 1.00 0.00 C ATOM 1363 C ASN A 89 10.380 -16.046 -3.983 1.00 0.00 C ATOM 1364 O ASN A 89 11.578 -16.071 -4.253 1.00 0.00 O ATOM 1365 CB ASN A 89 9.456 -13.742 -4.585 1.00 0.00 C ATOM 1366 CG ASN A 89 9.145 -12.921 -5.845 1.00 0.00 C ATOM 1367 OD1 ASN A 89 9.386 -13.371 -6.971 1.00 0.00 O ATOM 1368 ND2 ASN A 89 8.681 -11.717 -5.688 1.00 0.00 N ATOM 0 H ASN A 89 7.426 -15.335 -4.279 1.00 0.00 H new ATOM 0 HA ASN A 89 9.803 -15.379 -5.876 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.731 -13.500 -3.807 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.438 -13.462 -4.204 1.00 0.00 H new ATOM 0 HD21 ASN A 89 8.510 -11.126 -6.502 1.00 0.00 H new ATOM 0 HD22 ASN A 89 8.488 -11.363 -4.751 1.00 0.00 H new ATOM 1375 N GLN A 90 9.881 -16.705 -2.920 1.00 0.00 N ATOM 1376 CA GLN A 90 10.743 -17.537 -2.076 1.00 0.00 C ATOM 1377 C GLN A 90 11.233 -18.745 -2.852 1.00 0.00 C ATOM 1378 O GLN A 90 12.391 -19.123 -2.737 1.00 0.00 O ATOM 1379 CB GLN A 90 10.071 -18.006 -0.763 1.00 0.00 C ATOM 1380 CG GLN A 90 9.499 -16.913 0.135 1.00 0.00 C ATOM 1381 CD GLN A 90 10.371 -15.692 0.228 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.269 -15.604 1.059 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.061 -14.720 -0.573 1.00 0.00 N ATOM 0 H GLN A 90 8.903 -16.676 -2.633 1.00 0.00 H new ATOM 0 HA GLN A 90 11.580 -16.901 -1.790 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.265 -18.694 -1.019 1.00 0.00 H new ATOM 0 HB3 GLN A 90 10.804 -18.572 -0.188 1.00 0.00 H new ATOM 0 HG2 GLN A 90 8.519 -16.621 -0.242 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.348 -17.318 1.135 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.306 -14.837 -1.249 1.00 0.00 H new ATOM 0 HE22 GLN A 90 10.572 -13.838 -0.527 1.00 0.00 H new ATOM 1392 N GLN A 91 10.361 -19.352 -3.666 1.00 0.00 N ATOM 1393 CA GLN A 91 10.786 -20.481 -4.508 1.00 0.00 C ATOM 1394 C GLN A 91 11.768 -20.021 -5.579 1.00 0.00 C ATOM 1395 O GLN A 91 12.558 -20.796 -6.085 1.00 0.00 O ATOM 1396 CB GLN A 91 9.588 -21.237 -5.111 1.00 0.00 C ATOM 1397 CG GLN A 91 8.717 -20.416 -6.041 1.00 0.00 C ATOM 1398 CD GLN A 91 7.415 -21.105 -6.388 1.00 0.00 C ATOM 1399 OE1 GLN A 91 7.309 -21.826 -7.381 1.00 0.00 O ATOM 1400 NE2 GLN A 91 6.423 -20.901 -5.566 1.00 0.00 N ATOM 0 H GLN A 91 9.380 -19.090 -3.761 1.00 0.00 H new ATOM 0 HA GLN A 91 11.306 -21.192 -3.866 1.00 0.00 H new ATOM 0 HB2 GLN A 91 9.961 -22.103 -5.657 1.00 0.00 H new ATOM 0 HB3 GLN A 91 8.969 -21.616 -4.297 1.00 0.00 H new ATOM 0 HG2 GLN A 91 8.501 -19.455 -5.574 1.00 0.00 H new ATOM 0 HG3 GLN A 91 9.268 -20.208 -6.958 1.00 0.00 H new ATOM 0 HE21 GLN A 91 6.550 -20.297 -4.754 1.00 0.00 H new ATOM 0 HE22 GLN A 91 5.521 -21.346 -5.735 1.00 0.00 H new ATOM 1409 N ALA A 92 11.724 -18.738 -5.894 1.00 0.00 N ATOM 1410 CA ALA A 92 12.670 -18.142 -6.821 1.00 0.00 C ATOM 1411 C ALA A 92 13.916 -17.690 -6.055 1.00 0.00 C ATOM 1412 O ALA A 92 14.854 -17.139 -6.622 1.00 0.00 O ATOM 1413 CB ALA A 92 12.031 -16.972 -7.556 1.00 0.00 C ATOM 0 H ALA A 92 11.037 -18.085 -5.518 1.00 0.00 H new ATOM 0 HA ALA A 92 12.962 -18.883 -7.565 1.00 0.00 H new ATOM 0 HB1 ALA A 92 12.754 -16.537 -8.246 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.163 -17.323 -8.113 1.00 0.00 H new ATOM 0 HB3 ALA A 92 11.718 -16.217 -6.835 1.00 0.00 H new ATOM 1419 N GLY A 93 13.886 -17.911 -4.754 1.00 0.00 N ATOM 1420 CA GLY A 93 14.990 -17.608 -3.872 1.00 0.00 C ATOM 1421 C GLY A 93 15.243 -16.130 -3.705 1.00 0.00 C ATOM 1422 O GLY A 93 16.382 -15.704 -3.615 1.00 0.00 O ATOM 0 H GLY A 93 13.079 -18.313 -4.276 1.00 0.00 H new ATOM 0 HA2 GLY A 93 14.793 -18.047 -2.894 1.00 0.00 H new ATOM 0 HA3 GLY A 93 15.893 -18.081 -4.258 1.00 0.00 H new ATOM 1426 N ASN A 94 14.194 -15.338 -3.709 1.00 0.00 N ATOM 1427 CA ASN A 94 14.329 -13.886 -3.540 1.00 0.00 C ATOM 1428 C ASN A 94 14.152 -13.515 -2.086 1.00 0.00 C ATOM 1429 O ASN A 94 13.250 -14.037 -1.410 1.00 0.00 O ATOM 1430 CB ASN A 94 13.294 -13.107 -4.377 1.00 0.00 C ATOM 1431 CG ASN A 94 13.491 -13.155 -5.896 1.00 0.00 C ATOM 1432 OD1 ASN A 94 14.088 -14.199 -6.410 1.00 0.00 O flip ATOM 1433 ND2 ASN A 94 13.100 -12.236 -6.604 1.00 0.00 N flip ATOM 0 H ASN A 94 13.234 -15.663 -3.826 1.00 0.00 H new ATOM 0 HA ASN A 94 15.327 -13.616 -3.885 1.00 0.00 H new ATOM 0 HB2 ASN A 94 12.302 -13.495 -4.146 1.00 0.00 H new ATOM 0 HB3 ASN A 94 13.310 -12.064 -4.060 1.00 0.00 H new ATOM 0 HD21 ASN A 94 12.637 -11.430 -6.184 1.00 0.00 H new ATOM 0 HD22 ASN A 94 13.238 -12.276 -7.614 1.00 0.00 H new ATOM 1440 N GLY A 95 14.973 -12.598 -1.609 1.00 0.00 N ATOM 1441 CA GLY A 95 14.882 -12.129 -0.233 1.00 0.00 C ATOM 1442 C GLY A 95 13.874 -10.996 -0.100 1.00 0.00 C ATOM 1443 O GLY A 95 14.150 -9.948 0.506 1.00 0.00 O ATOM 0 H GLY A 95 15.715 -12.160 -2.155 1.00 0.00 H new ATOM 0 HA2 GLY A 95 14.592 -12.955 0.416 1.00 0.00 H new ATOM 0 HA3 GLY A 95 15.861 -11.788 0.103 1.00 0.00 H new ATOM 1447 N TRP A 96 12.720 -11.208 -0.672 1.00 0.00 N ATOM 1448 CA TRP A 96 11.649 -10.246 -0.704 1.00 0.00 C ATOM 1449 C TRP A 96 10.362 -10.923 -0.414 1.00 0.00 C ATOM 1450 O TRP A 96 10.346 -12.121 -0.161 1.00 0.00 O ATOM 1451 CB TRP A 96 11.518 -9.588 -2.076 1.00 0.00 C ATOM 1452 CG TRP A 96 12.633 -8.708 -2.447 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.147 -7.704 -1.700 1.00 0.00 C ATOM 1454 CD2 TRP A 96 13.344 -8.715 -3.669 1.00 0.00 C ATOM 1455 NE1 TRP A 96 14.148 -7.097 -2.368 1.00 0.00 N ATOM 1456 CE2 TRP A 96 14.300 -7.701 -3.591 1.00 0.00 C ATOM 1457 CE3 TRP A 96 13.273 -9.490 -4.824 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 15.184 -7.440 -4.624 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 14.146 -9.229 -5.849 1.00 0.00 C ATOM 1460 CH2 TRP A 96 15.091 -8.214 -5.744 1.00 0.00 C ATOM 0 H TRP A 96 12.491 -12.083 -1.144 1.00 0.00 H new ATOM 0 HA TRP A 96 11.879 -9.485 0.042 1.00 0.00 H new ATOM 0 HB2 TRP A 96 11.424 -10.369 -2.830 1.00 0.00 H new ATOM 0 HB3 TRP A 96 10.594 -9.010 -2.099 1.00 0.00 H new ATOM 0 HD1 TRP A 96 12.805 -7.429 -0.713 1.00 0.00 H new ATOM 0 HE1 TRP A 96 14.703 -6.315 -2.021 1.00 0.00 H new ATOM 0 HE3 TRP A 96 12.544 -10.282 -4.911 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 15.920 -6.653 -4.546 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 14.099 -9.821 -6.751 1.00 0.00 H new ATOM 0 HH2 TRP A 96 15.766 -8.034 -6.567 1.00 0.00 H new ATOM 1471 N ASP A 97 9.312 -10.127 -0.333 1.00 0.00 N ATOM 1472 CA ASP A 97 7.924 -10.593 -0.302 1.00 0.00 C ATOM 1473 C ASP A 97 7.499 -11.144 1.029 1.00 0.00 C ATOM 1474 O ASP A 97 6.771 -10.506 1.729 1.00 0.00 O ATOM 1475 CB ASP A 97 7.590 -11.600 -1.414 1.00 0.00 C ATOM 1476 CG ASP A 97 7.640 -11.048 -2.823 1.00 0.00 C ATOM 1477 OD1 ASP A 97 8.704 -10.571 -3.241 1.00 0.00 O ATOM 1478 OD2 ASP A 97 6.644 -11.171 -3.558 1.00 0.00 O ATOM 0 H ASP A 97 9.395 -9.112 -0.285 1.00 0.00 H new ATOM 0 HA ASP A 97 7.347 -9.686 -0.484 1.00 0.00 H new ATOM 0 HB2 ASP A 97 8.285 -12.437 -1.344 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.592 -11.999 -1.233 1.00 0.00 H new ATOM 1483 N PHE A 98 8.013 -12.293 1.395 1.00 0.00 N ATOM 1484 CA PHE A 98 7.571 -13.001 2.595 1.00 0.00 C ATOM 1485 C PHE A 98 7.629 -12.127 3.857 1.00 0.00 C ATOM 1486 O PHE A 98 6.620 -11.931 4.524 1.00 0.00 O ATOM 1487 CB PHE A 98 8.350 -14.312 2.766 1.00 0.00 C ATOM 1488 CG PHE A 98 7.885 -15.143 3.922 1.00 0.00 C ATOM 1489 CD1 PHE A 98 6.750 -15.923 3.806 1.00 0.00 C ATOM 1490 CD2 PHE A 98 8.574 -15.145 5.119 1.00 0.00 C ATOM 1491 CE1 PHE A 98 6.313 -16.687 4.860 1.00 0.00 C ATOM 1492 CE2 PHE A 98 8.135 -15.907 6.176 1.00 0.00 C ATOM 1493 CZ PHE A 98 7.005 -16.679 6.048 1.00 0.00 C ATOM 0 H PHE A 98 8.750 -12.772 0.877 1.00 0.00 H new ATOM 0 HA PHE A 98 6.519 -13.248 2.456 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.263 -14.898 1.851 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.407 -14.081 2.898 1.00 0.00 H new ATOM 0 HD1 PHE A 98 6.201 -15.932 2.876 1.00 0.00 H new ATOM 0 HD2 PHE A 98 9.465 -14.543 5.226 1.00 0.00 H new ATOM 0 HE1 PHE A 98 5.426 -17.294 4.756 1.00 0.00 H new ATOM 0 HE2 PHE A 98 8.679 -15.899 7.109 1.00 0.00 H new ATOM 0 HZ PHE A 98 6.662 -17.278 6.879 1.00 0.00 H new ATOM 1503 N ASP A 99 8.802 -11.616 4.171 1.00 0.00 N ATOM 1504 CA ASP A 99 8.972 -10.739 5.340 1.00 0.00 C ATOM 1505 C ASP A 99 8.695 -9.277 5.027 1.00 0.00 C ATOM 1506 O ASP A 99 8.199 -8.524 5.878 1.00 0.00 O ATOM 1507 CB ASP A 99 10.389 -10.861 5.901 1.00 0.00 C ATOM 1508 CG ASP A 99 10.486 -11.799 7.063 1.00 0.00 C ATOM 1509 OD1 ASP A 99 10.709 -13.000 6.875 1.00 0.00 O ATOM 1510 OD2 ASP A 99 10.376 -11.326 8.195 1.00 0.00 O ATOM 0 H ASP A 99 9.658 -11.785 3.642 1.00 0.00 H new ATOM 0 HA ASP A 99 8.240 -11.071 6.077 1.00 0.00 H new ATOM 0 HB2 ASP A 99 11.057 -11.202 5.110 1.00 0.00 H new ATOM 0 HB3 ASP A 99 10.737 -9.875 6.209 1.00 0.00 H new ATOM 1515 N MET A 100 9.025 -8.874 3.822 1.00 0.00 N ATOM 1516 CA MET A 100 8.939 -7.467 3.434 1.00 0.00 C ATOM 1517 C MET A 100 7.494 -7.053 3.137 1.00 0.00 C ATOM 1518 O MET A 100 7.027 -6.004 3.582 1.00 0.00 O ATOM 1519 CB MET A 100 9.847 -7.184 2.201 1.00 0.00 C ATOM 1520 CG MET A 100 11.283 -7.681 2.350 1.00 0.00 C ATOM 1521 SD MET A 100 12.106 -7.010 3.794 1.00 0.00 S ATOM 1522 CE MET A 100 13.706 -7.811 3.678 1.00 0.00 C ATOM 0 H MET A 100 9.358 -9.495 3.085 1.00 0.00 H new ATOM 0 HA MET A 100 9.291 -6.871 4.276 1.00 0.00 H new ATOM 0 HB2 MET A 100 9.403 -7.652 1.322 1.00 0.00 H new ATOM 0 HB3 MET A 100 9.864 -6.110 2.016 1.00 0.00 H new ATOM 0 HG2 MET A 100 11.281 -8.769 2.412 1.00 0.00 H new ATOM 0 HG3 MET A 100 11.849 -7.413 1.458 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.333 -7.493 4.511 1.00 0.00 H new ATOM 0 HE2 MET A 100 13.575 -8.892 3.715 1.00 0.00 H new ATOM 0 HE3 MET A 100 14.184 -7.535 2.738 1.00 0.00 H new ATOM 1532 N LEU A 101 6.795 -7.903 2.443 1.00 0.00 N ATOM 1533 CA LEU A 101 5.469 -7.629 1.949 1.00 0.00 C ATOM 1534 C LEU A 101 4.393 -8.349 2.762 1.00 0.00 C ATOM 1535 O LEU A 101 4.042 -9.489 2.452 1.00 0.00 O ATOM 1536 CB LEU A 101 5.401 -8.070 0.503 1.00 0.00 C ATOM 1537 CG LEU A 101 4.045 -8.108 -0.150 1.00 0.00 C ATOM 1538 CD1 LEU A 101 3.536 -6.727 -0.453 1.00 0.00 C ATOM 1539 CD2 LEU A 101 4.094 -8.998 -1.356 1.00 0.00 C ATOM 0 H LEU A 101 7.137 -8.832 2.196 1.00 0.00 H new ATOM 0 HA LEU A 101 5.277 -6.560 2.040 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.037 -7.405 -0.081 1.00 0.00 H new ATOM 0 HB3 LEU A 101 5.835 -9.068 0.435 1.00 0.00 H new ATOM 0 HG LEU A 101 3.322 -8.534 0.545 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.555 -6.796 -0.924 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.455 -6.158 0.473 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.228 -6.224 -1.129 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.112 -9.025 -1.828 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.827 -8.611 -2.064 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.379 -10.006 -1.053 1.00 0.00 H new ATOM 1551 N THR A 102 3.963 -7.706 3.839 1.00 0.00 N ATOM 1552 CA THR A 102 2.852 -8.119 4.711 1.00 0.00 C ATOM 1553 C THR A 102 3.133 -7.511 6.080 1.00 0.00 C ATOM 1554 O THR A 102 4.012 -6.624 6.202 1.00 0.00 O ATOM 1555 CB THR A 102 2.678 -9.693 4.846 1.00 0.00 C ATOM 1556 OG1 THR A 102 1.478 -10.036 5.569 1.00 0.00 O ATOM 1557 CG2 THR A 102 3.882 -10.357 5.497 1.00 0.00 C ATOM 0 H THR A 102 4.396 -6.837 4.151 1.00 0.00 H new ATOM 0 HA THR A 102 1.918 -7.769 4.271 1.00 0.00 H new ATOM 0 HB THR A 102 2.595 -10.074 3.828 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.803 -10.371 4.942 1.00 0.00 H new ATOM 0 HG21 THR A 102 3.712 -11.432 5.565 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.771 -10.168 4.896 1.00 0.00 H new ATOM 0 HG23 THR A 102 4.027 -9.948 6.497 1.00 0.00 H new ATOM 1661 N ASP A 111 12.782 -0.720 5.913 1.00 0.00 N ATOM 1662 CA ASP A 111 14.014 -0.159 5.418 1.00 0.00 C ATOM 1663 C ASP A 111 14.252 -0.597 3.986 1.00 0.00 C ATOM 1664 O ASP A 111 14.352 0.231 3.108 1.00 0.00 O ATOM 1665 CB ASP A 111 15.187 -0.600 6.285 1.00 0.00 C ATOM 1666 CG ASP A 111 16.474 0.099 5.895 1.00 0.00 C ATOM 1667 OD1 ASP A 111 16.599 1.309 6.145 1.00 0.00 O ATOM 1668 OD2 ASP A 111 17.386 -0.551 5.341 1.00 0.00 O ATOM 0 HA ASP A 111 13.933 0.927 5.454 1.00 0.00 H new ATOM 0 HB2 ASP A 111 14.963 -0.391 7.331 1.00 0.00 H new ATOM 0 HB3 ASP A 111 15.319 -1.678 6.196 1.00 0.00 H new ATOM 1673 N ALA A 112 14.263 -1.908 3.758 1.00 0.00 N ATOM 1674 CA ALA A 112 14.512 -2.504 2.431 1.00 0.00 C ATOM 1675 C ALA A 112 13.534 -1.975 1.385 1.00 0.00 C ATOM 1676 O ALA A 112 13.909 -1.700 0.242 1.00 0.00 O ATOM 1677 CB ALA A 112 14.422 -4.017 2.516 1.00 0.00 C ATOM 0 H ALA A 112 14.099 -2.599 4.490 1.00 0.00 H new ATOM 0 HA ALA A 112 15.517 -2.219 2.119 1.00 0.00 H new ATOM 0 HB1 ALA A 112 14.607 -4.448 1.532 1.00 0.00 H new ATOM 0 HB2 ALA A 112 15.167 -4.387 3.220 1.00 0.00 H new ATOM 0 HB3 ALA A 112 13.427 -4.304 2.857 1.00 0.00 H new ATOM 1683 N GLN A 113 12.305 -1.806 1.798 1.00 0.00 N ATOM 1684 CA GLN A 113 11.259 -1.256 0.964 1.00 0.00 C ATOM 1685 C GLN A 113 11.627 0.159 0.563 1.00 0.00 C ATOM 1686 O GLN A 113 11.522 0.526 -0.586 1.00 0.00 O ATOM 1687 CB GLN A 113 9.992 -1.231 1.774 1.00 0.00 C ATOM 1688 CG GLN A 113 8.747 -0.691 1.091 1.00 0.00 C ATOM 1689 CD GLN A 113 8.334 0.708 1.563 1.00 0.00 C ATOM 1690 OE1 GLN A 113 9.273 1.550 1.954 1.00 0.00 O flip ATOM 1691 NE2 GLN A 113 7.173 1.020 1.579 1.00 0.00 N flip ATOM 0 H GLN A 113 11.994 -2.050 2.738 1.00 0.00 H new ATOM 0 HA GLN A 113 11.128 -1.858 0.065 1.00 0.00 H new ATOM 0 HB2 GLN A 113 9.782 -2.248 2.106 1.00 0.00 H new ATOM 0 HB3 GLN A 113 10.173 -0.635 2.668 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.918 -0.664 0.015 1.00 0.00 H new ATOM 0 HG3 GLN A 113 7.921 -1.381 1.266 1.00 0.00 H new ATOM 0 HE21 GLN A 113 6.462 0.356 1.273 1.00 0.00 H new ATOM 0 HE22 GLN A 113 6.899 1.949 1.899 1.00 0.00 H new ATOM 1700 N MET A 114 12.072 0.948 1.544 1.00 0.00 N ATOM 1701 CA MET A 114 12.429 2.346 1.325 1.00 0.00 C ATOM 1702 C MET A 114 13.717 2.452 0.523 1.00 0.00 C ATOM 1703 O MET A 114 13.986 3.473 -0.115 1.00 0.00 O ATOM 1704 CB MET A 114 12.558 3.086 2.674 1.00 0.00 C ATOM 1705 CG MET A 114 12.884 4.569 2.558 1.00 0.00 C ATOM 1706 SD MET A 114 12.968 5.397 4.160 1.00 0.00 S ATOM 1707 CE MET A 114 13.347 7.069 3.635 1.00 0.00 C ATOM 0 H MET A 114 12.194 0.635 2.507 1.00 0.00 H new ATOM 0 HA MET A 114 11.634 2.820 0.749 1.00 0.00 H new ATOM 0 HB2 MET A 114 11.624 2.975 3.224 1.00 0.00 H new ATOM 0 HB3 MET A 114 13.335 2.602 3.265 1.00 0.00 H new ATOM 0 HG2 MET A 114 13.837 4.687 2.043 1.00 0.00 H new ATOM 0 HG3 MET A 114 12.127 5.055 1.943 1.00 0.00 H new ATOM 0 HE1 MET A 114 13.433 7.714 4.509 1.00 0.00 H new ATOM 0 HE2 MET A 114 14.289 7.073 3.086 1.00 0.00 H new ATOM 0 HE3 MET A 114 12.550 7.437 2.990 1.00 0.00 H new ATOM 1717 N GLN A 115 14.519 1.389 0.547 1.00 0.00 N ATOM 1718 CA GLN A 115 15.727 1.378 -0.247 1.00 0.00 C ATOM 1719 C GLN A 115 15.312 1.198 -1.679 1.00 0.00 C ATOM 1720 O GLN A 115 15.970 1.689 -2.606 1.00 0.00 O ATOM 1721 CB GLN A 115 16.740 0.298 0.183 1.00 0.00 C ATOM 1722 CG GLN A 115 17.135 0.316 1.667 1.00 0.00 C ATOM 1723 CD GLN A 115 17.256 1.715 2.250 1.00 0.00 C ATOM 1724 OE1 GLN A 115 18.303 2.351 2.187 1.00 0.00 O ATOM 1725 NE2 GLN A 115 16.213 2.152 2.896 1.00 0.00 N ATOM 0 H GLN A 115 14.353 0.546 1.097 1.00 0.00 H new ATOM 0 HA GLN A 115 16.255 2.321 -0.102 1.00 0.00 H new ATOM 0 HB2 GLN A 115 16.323 -0.681 -0.052 1.00 0.00 H new ATOM 0 HB3 GLN A 115 17.643 0.412 -0.417 1.00 0.00 H new ATOM 0 HG2 GLN A 115 16.394 -0.243 2.238 1.00 0.00 H new ATOM 0 HG3 GLN A 115 18.087 -0.202 1.787 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.360 1.593 2.925 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.249 3.053 3.373 1.00 0.00 H new ATOM 1734 N TYR A 116 14.199 0.479 -1.840 1.00 0.00 N ATOM 1735 CA TYR A 116 13.486 0.345 -3.069 1.00 0.00 C ATOM 1736 C TYR A 116 14.191 -0.551 -4.082 1.00 0.00 C ATOM 1737 O TYR A 116 15.391 -0.412 -4.368 1.00 0.00 O ATOM 1738 CB TYR A 116 13.127 1.733 -3.679 1.00 0.00 C ATOM 1739 CG TYR A 116 12.451 1.674 -5.038 1.00 0.00 C ATOM 1740 CD1 TYR A 116 11.139 1.250 -5.170 1.00 0.00 C ATOM 1741 CD2 TYR A 116 13.138 2.034 -6.191 1.00 0.00 C ATOM 1742 CE1 TYR A 116 10.535 1.189 -6.411 1.00 0.00 C ATOM 1743 CE2 TYR A 116 12.534 1.973 -7.431 1.00 0.00 C ATOM 1744 CZ TYR A 116 11.234 1.550 -7.532 1.00 0.00 C ATOM 1745 OH TYR A 116 10.627 1.485 -8.766 1.00 0.00 O ATOM 0 H TYR A 116 13.769 -0.039 -1.074 1.00 0.00 H new ATOM 0 HA TYR A 116 12.553 -0.162 -2.821 1.00 0.00 H new ATOM 0 HB2 TYR A 116 12.472 2.261 -2.986 1.00 0.00 H new ATOM 0 HB3 TYR A 116 14.039 2.323 -3.768 1.00 0.00 H new ATOM 0 HD1 TYR A 116 10.581 0.963 -4.291 1.00 0.00 H new ATOM 0 HD2 TYR A 116 14.162 2.367 -6.116 1.00 0.00 H new ATOM 0 HE1 TYR A 116 9.511 0.856 -6.497 1.00 0.00 H new ATOM 0 HE2 TYR A 116 13.083 2.257 -8.317 1.00 0.00 H new ATOM 0 HH TYR A 116 11.258 1.776 -9.457 1.00 0.00 H new ATOM 1755 N ASP A 117 13.456 -1.468 -4.592 1.00 0.00 N ATOM 1756 CA ASP A 117 13.892 -2.301 -5.665 1.00 0.00 C ATOM 1757 C ASP A 117 12.653 -2.477 -6.480 1.00 0.00 C ATOM 1758 O ASP A 117 11.585 -2.712 -5.880 1.00 0.00 O ATOM 1759 CB ASP A 117 14.397 -3.652 -5.158 1.00 0.00 C ATOM 1760 CG ASP A 117 15.314 -4.338 -6.159 1.00 0.00 C ATOM 1761 OD1 ASP A 117 14.831 -4.971 -7.108 1.00 0.00 O ATOM 1762 OD2 ASP A 117 16.565 -4.232 -6.005 1.00 0.00 O ATOM 0 H ASP A 117 12.509 -1.671 -4.271 1.00 0.00 H new ATOM 0 HA ASP A 117 14.724 -1.869 -6.221 1.00 0.00 H new ATOM 0 HB2 ASP A 117 14.931 -3.509 -4.219 1.00 0.00 H new ATOM 0 HB3 ASP A 117 13.546 -4.299 -4.945 1.00 0.00 H new ATOM 1767 N PRO A 118 12.718 -2.277 -7.812 1.00 0.00 N ATOM 1768 CA PRO A 118 11.532 -2.307 -8.676 1.00 0.00 C ATOM 1769 C PRO A 118 10.626 -3.526 -8.424 1.00 0.00 C ATOM 1770 O PRO A 118 9.478 -3.351 -8.054 1.00 0.00 O ATOM 1771 CB PRO A 118 12.113 -2.326 -10.101 1.00 0.00 C ATOM 1772 CG PRO A 118 13.603 -2.454 -9.945 1.00 0.00 C ATOM 1773 CD PRO A 118 13.939 -1.981 -8.573 1.00 0.00 C ATOM 0 HA PRO A 118 10.881 -1.453 -8.487 1.00 0.00 H new ATOM 0 HB2 PRO A 118 11.709 -3.160 -10.675 1.00 0.00 H new ATOM 0 HB3 PRO A 118 11.855 -1.414 -10.639 1.00 0.00 H new ATOM 0 HG2 PRO A 118 13.918 -3.488 -10.084 1.00 0.00 H new ATOM 0 HG3 PRO A 118 14.122 -1.859 -10.696 1.00 0.00 H new ATOM 0 HD2 PRO A 118 14.804 -2.504 -8.167 1.00 0.00 H new ATOM 0 HD3 PRO A 118 14.175 -0.917 -8.560 1.00 0.00 H new ATOM 1781 N GLY A 119 11.168 -4.738 -8.585 1.00 0.00 N ATOM 1782 CA GLY A 119 10.452 -5.972 -8.239 1.00 0.00 C ATOM 1783 C GLY A 119 9.748 -5.953 -6.903 1.00 0.00 C ATOM 1784 O GLY A 119 8.545 -6.190 -6.850 1.00 0.00 O ATOM 0 H GLY A 119 12.106 -4.892 -8.955 1.00 0.00 H new ATOM 0 HA2 GLY A 119 9.716 -6.177 -9.017 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.162 -6.799 -8.246 1.00 0.00 H new ATOM 1788 N LEU A 120 10.494 -5.686 -5.831 1.00 0.00 N ATOM 1789 CA LEU A 120 9.921 -5.635 -4.479 1.00 0.00 C ATOM 1790 C LEU A 120 8.753 -4.672 -4.390 1.00 0.00 C ATOM 1791 O LEU A 120 7.667 -5.054 -3.941 1.00 0.00 O ATOM 1792 CB LEU A 120 10.980 -5.267 -3.433 1.00 0.00 C ATOM 1793 CG LEU A 120 10.458 -5.029 -1.999 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.808 -6.281 -1.420 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.572 -4.529 -1.098 1.00 0.00 C ATOM 0 H LEU A 120 11.496 -5.501 -5.869 1.00 0.00 H new ATOM 0 HA LEU A 120 9.551 -6.638 -4.265 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.723 -6.064 -3.401 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.494 -4.365 -3.766 1.00 0.00 H new ATOM 0 HG LEU A 120 9.688 -4.259 -2.053 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.454 -6.073 -0.410 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.966 -6.577 -2.046 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.539 -7.089 -1.389 1.00 0.00 H new ATOM 0 HD21 LEU A 120 11.182 -4.368 -0.093 1.00 0.00 H new ATOM 0 HD22 LEU A 120 12.371 -5.269 -1.063 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.963 -3.590 -1.490 1.00 0.00 H new ATOM 1807 N PHE A 121 8.947 -3.436 -4.816 1.00 0.00 N ATOM 1808 CA PHE A 121 7.869 -2.487 -4.709 1.00 0.00 C ATOM 1809 C PHE A 121 6.699 -2.842 -5.638 1.00 0.00 C ATOM 1810 O PHE A 121 5.534 -2.630 -5.280 1.00 0.00 O ATOM 1811 CB PHE A 121 8.308 -1.033 -4.888 1.00 0.00 C ATOM 1812 CG PHE A 121 7.163 -0.114 -4.650 1.00 0.00 C ATOM 1813 CD1 PHE A 121 6.591 -0.041 -3.390 1.00 0.00 C ATOM 1814 CD2 PHE A 121 6.607 0.612 -5.680 1.00 0.00 C ATOM 1815 CE1 PHE A 121 5.498 0.739 -3.165 1.00 0.00 C ATOM 1816 CE2 PHE A 121 5.502 1.391 -5.459 1.00 0.00 C ATOM 1817 CZ PHE A 121 4.950 1.449 -4.197 1.00 0.00 C ATOM 0 H PHE A 121 9.811 -3.081 -5.225 1.00 0.00 H new ATOM 0 HA PHE A 121 7.516 -2.565 -3.681 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.118 -0.803 -4.195 1.00 0.00 H new ATOM 0 HB3 PHE A 121 8.698 -0.885 -5.895 1.00 0.00 H new ATOM 0 HD1 PHE A 121 7.017 -0.610 -2.577 1.00 0.00 H new ATOM 0 HD2 PHE A 121 7.044 0.567 -6.667 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.066 0.797 -2.177 1.00 0.00 H new ATOM 0 HE2 PHE A 121 5.066 1.957 -6.269 1.00 0.00 H new ATOM 0 HZ PHE A 121 4.077 2.061 -4.022 1.00 0.00 H new ATOM 1827 N ALA A 122 7.006 -3.417 -6.796 1.00 0.00 N ATOM 1828 CA ALA A 122 5.980 -3.850 -7.736 1.00 0.00 C ATOM 1829 C ALA A 122 5.085 -4.883 -7.083 1.00 0.00 C ATOM 1830 O ALA A 122 3.876 -4.893 -7.314 1.00 0.00 O ATOM 1831 CB ALA A 122 6.592 -4.414 -9.019 1.00 0.00 C ATOM 0 H ALA A 122 7.961 -3.594 -7.106 1.00 0.00 H new ATOM 0 HA ALA A 122 5.386 -2.978 -8.010 1.00 0.00 H new ATOM 0 HB1 ALA A 122 5.796 -4.726 -9.695 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.198 -3.647 -9.501 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.219 -5.272 -8.776 1.00 0.00 H new ATOM 1837 N GLN A 123 5.674 -5.741 -6.257 1.00 0.00 N ATOM 1838 CA GLN A 123 4.901 -6.724 -5.524 1.00 0.00 C ATOM 1839 C GLN A 123 4.009 -6.017 -4.528 1.00 0.00 C ATOM 1840 O GLN A 123 2.831 -6.306 -4.442 1.00 0.00 O ATOM 1841 CB GLN A 123 5.785 -7.741 -4.787 1.00 0.00 C ATOM 1842 CG GLN A 123 6.788 -8.478 -5.658 1.00 0.00 C ATOM 1843 CD GLN A 123 6.180 -9.113 -6.894 1.00 0.00 C ATOM 1844 OE1 GLN A 123 5.005 -9.491 -6.933 1.00 0.00 O ATOM 1845 NE2 GLN A 123 6.984 -9.239 -7.919 1.00 0.00 N ATOM 0 H GLN A 123 6.678 -5.772 -6.082 1.00 0.00 H new ATOM 0 HA GLN A 123 4.306 -7.278 -6.250 1.00 0.00 H new ATOM 0 HB2 GLN A 123 6.327 -7.222 -3.997 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.141 -8.475 -4.303 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.568 -7.781 -5.966 1.00 0.00 H new ATOM 0 HG3 GLN A 123 7.270 -9.254 -5.063 1.00 0.00 H new ATOM 0 HE21 GLN A 123 7.949 -8.916 -7.853 1.00 0.00 H new ATOM 0 HE22 GLN A 123 6.645 -9.660 -8.784 1.00 0.00 H new ATOM 1854 N ILE A 124 4.577 -5.048 -3.821 1.00 0.00 N ATOM 1855 CA ILE A 124 3.856 -4.284 -2.812 1.00 0.00 C ATOM 1856 C ILE A 124 2.623 -3.606 -3.385 1.00 0.00 C ATOM 1857 O ILE A 124 1.507 -3.906 -2.968 1.00 0.00 O ATOM 1858 CB ILE A 124 4.772 -3.252 -2.088 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.958 -3.980 -1.427 1.00 0.00 C ATOM 1860 CG2 ILE A 124 3.969 -2.467 -1.045 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.968 -3.076 -0.762 1.00 0.00 C ATOM 0 H ILE A 124 5.552 -4.770 -3.932 1.00 0.00 H new ATOM 0 HA ILE A 124 3.521 -5.004 -2.065 1.00 0.00 H new ATOM 0 HB ILE A 124 5.160 -2.545 -2.821 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.570 -4.676 -0.683 1.00 0.00 H new ATOM 0 HG13 ILE A 124 6.468 -4.575 -2.184 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.622 -1.750 -0.547 1.00 0.00 H new ATOM 0 HG22 ILE A 124 3.155 -1.935 -1.537 1.00 0.00 H new ATOM 0 HG23 ILE A 124 3.558 -3.157 -0.307 1.00 0.00 H new ATOM 0 HD11 ILE A 124 7.764 -3.679 -0.326 1.00 0.00 H new ATOM 0 HD12 ILE A 124 7.391 -2.397 -1.502 1.00 0.00 H new ATOM 0 HD13 ILE A 124 6.479 -2.499 0.023 1.00 0.00 H new ATOM 1873 N GLN A 125 2.813 -2.750 -4.359 1.00 0.00 N ATOM 1874 CA GLN A 125 1.695 -2.030 -4.940 1.00 0.00 C ATOM 1875 C GLN A 125 0.679 -2.947 -5.626 1.00 0.00 C ATOM 1876 O GLN A 125 -0.508 -2.847 -5.355 1.00 0.00 O ATOM 1877 CB GLN A 125 2.141 -0.908 -5.872 1.00 0.00 C ATOM 1878 CG GLN A 125 3.169 -1.325 -6.880 1.00 0.00 C ATOM 1879 CD GLN A 125 3.411 -0.302 -7.969 1.00 0.00 C ATOM 1880 OE1 GLN A 125 2.387 0.413 -8.352 1.00 0.00 O flip ATOM 1881 NE2 GLN A 125 4.513 -0.202 -8.502 1.00 0.00 N flip ATOM 0 H GLN A 125 3.722 -2.532 -4.767 1.00 0.00 H new ATOM 0 HA GLN A 125 1.183 -1.569 -4.095 1.00 0.00 H new ATOM 0 HB2 GLN A 125 1.269 -0.518 -6.397 1.00 0.00 H new ATOM 0 HB3 GLN A 125 2.544 -0.091 -5.273 1.00 0.00 H new ATOM 0 HG2 GLN A 125 4.109 -1.522 -6.365 1.00 0.00 H new ATOM 0 HG3 GLN A 125 2.854 -2.262 -7.339 1.00 0.00 H new ATOM 0 HE21 GLN A 125 5.291 -0.776 -8.177 1.00 0.00 H new ATOM 0 HE22 GLN A 125 4.650 0.455 -9.270 1.00 0.00 H new ATOM 1890 N ALA A 126 1.144 -3.873 -6.451 1.00 0.00 N ATOM 1891 CA ALA A 126 0.243 -4.718 -7.233 1.00 0.00 C ATOM 1892 C ALA A 126 -0.549 -5.669 -6.362 1.00 0.00 C ATOM 1893 O ALA A 126 -1.764 -5.710 -6.443 1.00 0.00 O ATOM 1894 CB ALA A 126 1.001 -5.488 -8.304 1.00 0.00 C ATOM 0 H ALA A 126 2.136 -4.061 -6.599 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.467 -4.050 -7.721 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.304 -6.107 -8.869 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.491 -4.786 -8.978 1.00 0.00 H new ATOM 0 HB3 ALA A 126 1.751 -6.123 -7.833 1.00 0.00 H new ATOM 1900 N ALA A 127 0.136 -6.357 -5.474 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.498 -7.402 -4.664 1.00 0.00 C ATOM 1902 C ALA A 127 -1.492 -6.792 -3.731 1.00 0.00 C ATOM 1903 O ALA A 127 -2.618 -7.327 -3.523 1.00 0.00 O ATOM 1904 CB ALA A 127 0.530 -8.203 -3.884 1.00 0.00 C ATOM 0 H ALA A 127 1.129 -6.220 -5.287 1.00 0.00 H new ATOM 0 HA ALA A 127 -1.010 -8.087 -5.340 1.00 0.00 H new ATOM 0 HB1 ALA A 127 0.024 -8.968 -3.295 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.224 -8.678 -4.578 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.081 -7.538 -3.219 1.00 0.00 H new ATOM 1910 N ALA A 128 -1.126 -5.649 -3.212 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.952 -4.991 -2.300 1.00 0.00 C ATOM 1912 C ALA A 128 -3.095 -4.289 -2.983 1.00 0.00 C ATOM 1913 O ALA A 128 -4.117 -4.330 -2.502 1.00 0.00 O ATOM 1914 CB ALA A 128 -1.175 -4.087 -1.380 1.00 0.00 C ATOM 0 H ALA A 128 -0.250 -5.171 -3.423 1.00 0.00 H new ATOM 0 HA ALA A 128 -2.399 -5.754 -1.663 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.860 -3.596 -0.688 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.451 -4.676 -0.817 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.651 -3.333 -1.968 1.00 0.00 H new ATOM 1920 N THR A 129 -2.931 -3.713 -4.151 1.00 0.00 N ATOM 1921 CA THR A 129 -4.092 -3.044 -4.793 1.00 0.00 C ATOM 1922 C THR A 129 -5.155 -4.083 -5.196 1.00 0.00 C ATOM 1923 O THR A 129 -6.420 -3.854 -5.079 1.00 0.00 O ATOM 1924 CB THR A 129 -3.672 -2.190 -6.008 1.00 0.00 C ATOM 1925 OG1 THR A 129 -2.740 -2.925 -6.823 1.00 0.00 O ATOM 1926 CG2 THR A 129 -3.044 -0.884 -5.564 1.00 0.00 C ATOM 0 H THR A 129 -2.056 -3.680 -4.675 1.00 0.00 H new ATOM 0 HA THR A 129 -4.524 -2.364 -4.059 1.00 0.00 H new ATOM 0 HB THR A 129 -4.565 -1.961 -6.590 1.00 0.00 H new ATOM 0 HG1 THR A 129 -1.839 -2.839 -6.448 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.757 -0.302 -6.440 1.00 0.00 H new ATOM 0 HG22 THR A 129 -3.762 -0.318 -4.971 1.00 0.00 H new ATOM 0 HG23 THR A 129 -2.160 -1.092 -4.961 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.629 -5.263 -5.530 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.414 -6.409 -5.958 1.00 0.00 C ATOM 1936 C LYS A 130 -6.370 -6.730 -4.875 1.00 0.00 C ATOM 1937 O LYS A 130 -7.543 -6.918 -5.091 1.00 0.00 O ATOM 1938 CB LYS A 130 -4.499 -7.603 -6.238 1.00 0.00 C ATOM 1939 CG LYS A 130 -3.837 -7.589 -7.612 1.00 0.00 C ATOM 1940 CD LYS A 130 -2.836 -8.738 -7.797 1.00 0.00 C ATOM 1941 CE LYS A 130 -3.495 -10.114 -7.749 1.00 0.00 C ATOM 1942 NZ LYS A 130 -2.519 -11.207 -7.980 1.00 0.00 N ATOM 0 H LYS A 130 -3.626 -5.446 -5.508 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.951 -6.181 -6.879 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.721 -7.634 -5.475 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -5.080 -8.520 -6.139 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -4.606 -7.654 -8.382 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -3.323 -6.638 -7.754 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -2.326 -8.618 -8.753 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -2.074 -8.678 -7.020 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -3.972 -10.253 -6.779 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -4.282 -10.166 -8.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -3.008 -12.124 -7.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -2.081 -11.090 -8.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -1.782 -11.175 -7.247 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.829 -6.790 -3.718 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.535 -6.883 -2.503 1.00 0.00 C ATOM 1958 C ALA A 131 -7.422 -5.652 -2.295 1.00 0.00 C ATOM 1959 O ALA A 131 -8.644 -5.766 -2.354 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.464 -6.958 -1.469 1.00 0.00 C ATOM 0 H ALA A 131 -4.817 -6.774 -3.588 1.00 0.00 H new ATOM 0 HA ALA A 131 -7.206 -7.741 -2.468 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.917 -7.033 -0.481 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.843 -7.835 -1.651 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.847 -6.060 -1.518 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.790 -4.484 -2.210 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.375 -3.204 -1.801 1.00 0.00 C ATOM 1968 C TRP A 132 -8.356 -2.582 -2.809 1.00 0.00 C ATOM 1969 O TRP A 132 -8.424 -1.366 -2.959 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.321 -2.147 -1.353 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.487 -2.590 -0.189 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -5.111 -3.825 0.010 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -4.963 -1.852 0.933 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.307 -3.948 1.008 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.195 -2.774 1.649 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -5.005 -0.533 1.403 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.493 -2.439 2.777 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.314 -0.253 2.525 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.564 -1.195 3.187 1.00 0.00 C ATOM 0 H TRP A 132 -5.799 -4.398 -2.437 1.00 0.00 H new ATOM 0 HA TRP A 132 -7.965 -3.486 -0.929 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.666 -1.920 -2.194 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -6.835 -1.222 -1.091 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.440 -4.655 -0.598 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.827 -4.808 1.272 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.569 0.229 0.886 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.904 -3.171 3.308 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.351 0.752 2.920 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -3.017 -0.903 4.071 1.00 0.00 H new ATOM 1990 N ARG A 133 -9.008 -3.381 -3.573 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.165 -2.891 -4.307 1.00 0.00 C ATOM 1992 C ARG A 133 -11.598 -3.499 -3.957 1.00 0.00 C ATOM 1993 O ARG A 133 -12.450 -2.833 -3.428 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.981 -3.044 -5.774 1.00 0.00 C ATOM 1995 CG ARG A 133 -11.202 -2.607 -6.511 1.00 0.00 C ATOM 1996 CD ARG A 133 -11.372 -3.368 -7.749 1.00 0.00 C ATOM 1997 NE ARG A 133 -12.592 -2.935 -8.461 1.00 0.00 N ATOM 1998 CZ ARG A 133 -12.715 -2.866 -9.805 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -11.672 -3.127 -10.592 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -13.872 -2.514 -10.350 1.00 0.00 N ATOM 0 H ARG A 133 -8.782 -4.365 -3.719 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.191 -1.853 -3.974 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -9.124 -2.455 -6.101 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.761 -4.085 -6.011 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -12.079 -2.738 -5.877 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -11.130 -1.544 -6.741 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -10.501 -3.229 -8.390 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -11.435 -4.432 -7.523 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.400 -2.669 -7.898 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -10.774 -3.381 -10.181 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -11.772 -3.073 -11.606 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -14.671 -2.295 -9.754 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -13.963 -2.462 -11.365 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.766 -4.754 -4.224 1.00 0.00 N ATOM 2015 CA LYS A 134 -13.108 -5.381 -4.510 1.00 0.00 C ATOM 2016 C LYS A 134 -14.349 -5.489 -3.584 1.00 0.00 C ATOM 2017 O LYS A 134 -14.959 -6.553 -3.562 1.00 0.00 O ATOM 2018 CB LYS A 134 -13.137 -6.413 -5.605 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.904 -7.207 -5.763 1.00 0.00 C ATOM 2020 CD LYS A 134 -11.604 -7.973 -4.516 1.00 0.00 C ATOM 2021 CE LYS A 134 -10.147 -8.048 -4.373 1.00 0.00 C ATOM 2022 NZ LYS A 134 -9.512 -8.779 -5.488 1.00 0.00 N ATOM 0 H LYS A 134 -10.993 -5.419 -4.261 1.00 0.00 H new ATOM 0 HA LYS A 134 -13.327 -4.329 -4.691 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -13.966 -7.095 -5.415 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -13.348 -5.910 -6.549 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -12.014 -7.896 -6.601 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -11.069 -6.548 -6.000 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -12.048 -7.481 -3.650 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -12.034 -8.973 -4.570 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -9.737 -7.039 -4.322 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -9.901 -8.540 -3.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -8.581 -8.362 -5.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.393 -9.778 -5.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -10.114 -8.713 -6.334 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.734 -4.501 -2.835 1.00 0.00 N ATOM 2037 CA LEU A 135 -16.008 -4.661 -2.086 1.00 0.00 C ATOM 2038 C LEU A 135 -17.231 -4.038 -2.808 1.00 0.00 C ATOM 2039 O LEU A 135 -17.242 -2.850 -3.152 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.970 -4.341 -0.556 1.00 0.00 C ATOM 2041 CG LEU A 135 -15.133 -3.170 -0.047 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.680 -3.514 -0.074 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -15.361 -1.937 -0.851 1.00 0.00 C ATOM 0 H LEU A 135 -14.243 -3.616 -2.709 1.00 0.00 H new ATOM 0 HA LEU A 135 -16.148 -5.742 -2.100 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -16.997 -4.171 -0.234 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -15.620 -5.238 -0.045 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.446 -2.975 0.979 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -13.099 -2.668 0.292 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -13.499 -4.381 0.562 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -13.380 -3.745 -1.096 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -14.747 -1.127 -0.457 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -15.090 -2.125 -1.890 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -16.413 -1.656 -0.795 1.00 0.00 H new ATOM 2055 N PRO A 136 -18.284 -4.857 -3.048 1.00 0.00 N ATOM 2056 CA PRO A 136 -19.482 -4.437 -3.806 1.00 0.00 C ATOM 2057 C PRO A 136 -20.337 -3.390 -3.080 1.00 0.00 C ATOM 2058 O PRO A 136 -20.915 -2.500 -3.712 1.00 0.00 O ATOM 2059 CB PRO A 136 -20.272 -5.743 -3.973 1.00 0.00 C ATOM 2060 CG PRO A 136 -19.839 -6.592 -2.832 1.00 0.00 C ATOM 2061 CD PRO A 136 -18.388 -6.267 -2.607 1.00 0.00 C ATOM 0 HA PRO A 136 -19.203 -3.954 -4.742 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -21.347 -5.562 -3.947 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -20.052 -6.220 -4.928 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -20.430 -6.380 -1.941 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -19.972 -7.650 -3.059 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -18.107 -6.383 -1.560 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -17.735 -6.919 -3.187 1.00 0.00 H new