USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1027 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 48 CYS SG : rot 162:sc= -0.245 USER MOD Set 1.2: A 147 THR OG1 : rot -124:sc= 0.00314 USER MOD Set 2.1: A 65 THR OG1 : rot 115:sc= 0.853 USER MOD Set 2.2: A 67 SER OG : rot 180:sc= 0.832 USER MOD Set 3.1: A 51 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 3.2: A 145 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 41 MET CE :methyl 167:sc= 0 (180deg=0) USER MOD Set 4.2: A 45 GLN : amide:sc= -0.233 K(o=-0.23,f=-2.7!) USER MOD Single : A 18 THR OG1 : rot -71:sc= 0.035 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 72:sc= 1.14 USER MOD Single : A 25 MET CE :methyl -108:sc= -0.533 (180deg=-3.08!) USER MOD Single : A 26 MET CE :methyl 171:sc= -1.86 (180deg=-2.08) USER MOD Single : A 27 THR OG1 : rot -71:sc= 0.97 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl 143:sc= -2 (180deg=-3.02!) USER MOD Single : A 42 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 83:sc= 1.11 USER MOD Single : A 52 SER OG : rot 160:sc= -0.827 USER MOD Single : A 54 SER OG : rot -140:sc= -1.51 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 72 HIS : no HD1:sc= -0.147 X(o=-0.15,f=0.024) USER MOD Single : A 77 SER OG : rot 151:sc= 1.23 USER MOD Single : A 78 LYS NZ :NH3+ 138:sc= 0.00345 (180deg=-0.0109) USER MOD Single : A 80 THR OG1 : rot -170:sc= -0.086 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 ASN : amide:sc= -0.0731 K(o=-0.073,f=-1.4) USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= -0.842 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 THR OG1 : rot -81:sc= -0.736 USER MOD Single : A 107 THR OG1 : rot 120:sc= -0.932 USER MOD Single : A 110 SER OG : rot -80:sc= 0.427 USER MOD Single : A 112 LYS NZ :NH3+ -109:sc= -0.126 (180deg=-1.69!) USER MOD Single : A 117 LYS NZ :NH3+ -168:sc= 0.0867 (180deg=0.0561) USER MOD Single : A 126 ASN : amide:sc= -1.98 K(o=-2,f=-2.8!) USER MOD Single : A 135 TYR OH : rot 26:sc= -0.949 USER MOD Single : A 137 ASN : amide:sc= -1.32 X(o=-1.3,f=-1.4) USER MOD Single : A 141 CYS SG : rot 180:sc= 0 USER MOD Single : A 142 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 GLN : amide:sc= -0.643 X(o=-0.64,f=-0.32) USER MOD Single : A 146 THR OG1 : rot -97:sc= -0.728 USER MOD Single : A 148 ASN : amide:sc= -0.0848 X(o=-0.085,f=0) USER MOD ----------------------------------------------------------------- ATOM 196 N ALA A 16 8.987 -3.995 3.818 1.00 0.00 N ATOM 197 CA ALA A 16 8.909 -2.540 3.787 1.00 0.00 C ATOM 198 C ALA A 16 9.262 -2.001 2.406 1.00 0.00 C ATOM 199 O ALA A 16 10.277 -2.380 1.821 1.00 0.00 O ATOM 200 CB ALA A 16 9.828 -1.941 4.840 1.00 0.00 C ATOM 0 HA ALA A 16 7.882 -2.251 4.009 1.00 0.00 H new ATOM 0 HB1 ALA A 16 9.760 -0.854 4.806 1.00 0.00 H new ATOM 0 HB2 ALA A 16 9.528 -2.293 5.827 1.00 0.00 H new ATOM 0 HB3 ALA A 16 10.855 -2.247 4.643 1.00 0.00 H new ATOM 206 N ILE A 17 8.417 -1.115 1.888 1.00 0.00 N ATOM 207 CA ILE A 17 8.640 -0.523 0.574 1.00 0.00 C ATOM 208 C ILE A 17 8.755 0.994 0.669 1.00 0.00 C ATOM 209 O ILE A 17 8.186 1.615 1.568 1.00 0.00 O ATOM 210 CB ILE A 17 7.505 -0.889 -0.405 1.00 0.00 C ATOM 211 CG1 ILE A 17 7.815 -0.352 -1.805 1.00 0.00 C ATOM 212 CG2 ILE A 17 6.173 -0.348 0.094 1.00 0.00 C ATOM 213 CD1 ILE A 17 6.857 -0.847 -2.867 1.00 0.00 C ATOM 0 H ILE A 17 7.572 -0.791 2.358 1.00 0.00 H new ATOM 0 HA ILE A 17 9.578 -0.929 0.195 1.00 0.00 H new ATOM 0 HB ILE A 17 7.433 -1.975 -0.460 1.00 0.00 H new ATOM 0 HG12 ILE A 17 7.788 0.737 -1.782 1.00 0.00 H new ATOM 0 HG13 ILE A 17 8.830 -0.640 -2.080 1.00 0.00 H new ATOM 0 HG21 ILE A 17 5.385 -0.616 -0.610 1.00 0.00 H new ATOM 0 HG22 ILE A 17 5.949 -0.777 1.071 1.00 0.00 H new ATOM 0 HG23 ILE A 17 6.230 0.737 0.179 1.00 0.00 H new ATOM 0 HD11 ILE A 17 7.136 -0.427 -3.833 1.00 0.00 H new ATOM 0 HD12 ILE A 17 6.901 -1.935 -2.918 1.00 0.00 H new ATOM 0 HD13 ILE A 17 5.843 -0.536 -2.616 1.00 0.00 H new ATOM 225 N THR A 18 9.493 1.587 -0.264 1.00 0.00 N ATOM 226 CA THR A 18 9.681 3.032 -0.286 1.00 0.00 C ATOM 227 C THR A 18 8.660 3.701 -1.199 1.00 0.00 C ATOM 228 O THR A 18 7.897 3.028 -1.892 1.00 0.00 O ATOM 229 CB THR A 18 11.098 3.375 -0.750 1.00 0.00 C ATOM 230 OG1 THR A 18 11.295 2.976 -2.095 1.00 0.00 O ATOM 231 CG2 THR A 18 12.177 2.721 0.085 1.00 0.00 C ATOM 0 H THR A 18 9.971 1.088 -1.015 1.00 0.00 H new ATOM 0 HA THR A 18 9.536 3.407 0.727 1.00 0.00 H new ATOM 0 HB THR A 18 11.183 4.456 -0.641 1.00 0.00 H new ATOM 0 HG1 THR A 18 11.331 1.998 -2.144 1.00 0.00 H new ATOM 0 HG21 THR A 18 13.157 3.006 -0.298 1.00 0.00 H new ATOM 0 HG22 THR A 18 12.083 3.047 1.121 1.00 0.00 H new ATOM 0 HG23 THR A 18 12.069 1.637 0.035 1.00 0.00 H new ATOM 239 N ALA A 19 8.651 5.031 -1.194 1.00 0.00 N ATOM 240 CA ALA A 19 7.723 5.791 -2.022 1.00 0.00 C ATOM 241 C ALA A 19 8.138 5.747 -3.489 1.00 0.00 C ATOM 242 O ALA A 19 7.295 5.792 -4.385 1.00 0.00 O ATOM 243 CB ALA A 19 7.641 7.231 -1.538 1.00 0.00 C ATOM 0 H ALA A 19 9.276 5.603 -0.626 1.00 0.00 H new ATOM 0 HA ALA A 19 6.737 5.334 -1.935 1.00 0.00 H new ATOM 0 HB1 ALA A 19 6.944 7.787 -2.166 1.00 0.00 H new ATOM 0 HB2 ALA A 19 7.292 7.248 -0.505 1.00 0.00 H new ATOM 0 HB3 ALA A 19 8.628 7.691 -1.596 1.00 0.00 H new ATOM 249 N LYS A 20 9.442 5.659 -3.726 1.00 0.00 N ATOM 250 CA LYS A 20 9.972 5.608 -5.084 1.00 0.00 C ATOM 251 C LYS A 20 9.598 4.295 -5.765 1.00 0.00 C ATOM 252 O LYS A 20 9.161 4.283 -6.916 1.00 0.00 O ATOM 253 CB LYS A 20 11.492 5.773 -5.067 1.00 0.00 C ATOM 254 CG LYS A 20 12.021 6.660 -6.182 1.00 0.00 C ATOM 255 CD LYS A 20 12.514 5.838 -7.361 1.00 0.00 C ATOM 256 CE LYS A 20 13.325 6.685 -8.329 1.00 0.00 C ATOM 257 NZ LYS A 20 12.460 7.380 -9.321 1.00 0.00 N ATOM 0 H LYS A 20 10.152 5.621 -2.995 1.00 0.00 H new ATOM 0 HA LYS A 20 9.531 6.428 -5.651 1.00 0.00 H new ATOM 0 HB2 LYS A 20 11.793 6.193 -4.107 1.00 0.00 H new ATOM 0 HB3 LYS A 20 11.957 4.790 -5.145 1.00 0.00 H new ATOM 0 HG2 LYS A 20 11.234 7.338 -6.513 1.00 0.00 H new ATOM 0 HG3 LYS A 20 12.835 7.278 -5.802 1.00 0.00 H new ATOM 0 HD2 LYS A 20 13.125 5.011 -6.999 1.00 0.00 H new ATOM 0 HD3 LYS A 20 11.663 5.401 -7.883 1.00 0.00 H new ATOM 0 HE2 LYS A 20 13.901 7.423 -7.770 1.00 0.00 H new ATOM 0 HE3 LYS A 20 14.041 6.052 -8.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 13.052 7.946 -9.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 11.929 6.676 -9.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 11.794 8.004 -8.823 1.00 0.00 H new ATOM 271 N GLU A 21 9.773 3.191 -5.046 1.00 0.00 N ATOM 272 CA GLU A 21 9.456 1.872 -5.580 1.00 0.00 C ATOM 273 C GLU A 21 7.975 1.769 -5.931 1.00 0.00 C ATOM 274 O GLU A 21 7.608 1.177 -6.946 1.00 0.00 O ATOM 275 CB GLU A 21 9.831 0.787 -4.569 1.00 0.00 C ATOM 276 CG GLU A 21 11.167 0.121 -4.860 1.00 0.00 C ATOM 277 CD GLU A 21 11.660 -0.727 -3.705 1.00 0.00 C ATOM 278 OE1 GLU A 21 11.504 -0.297 -2.543 1.00 0.00 O ATOM 279 OE2 GLU A 21 12.201 -1.823 -3.962 1.00 0.00 O ATOM 0 H GLU A 21 10.133 3.184 -4.092 1.00 0.00 H new ATOM 0 HA GLU A 21 10.037 1.726 -6.491 1.00 0.00 H new ATOM 0 HB2 GLU A 21 9.863 1.226 -3.572 1.00 0.00 H new ATOM 0 HB3 GLU A 21 9.050 0.027 -4.558 1.00 0.00 H new ATOM 0 HG2 GLU A 21 11.072 -0.503 -5.749 1.00 0.00 H new ATOM 0 HG3 GLU A 21 11.909 0.887 -5.086 1.00 0.00 H new ATOM 286 N LEU A 22 7.129 2.350 -5.086 1.00 0.00 N ATOM 287 CA LEU A 22 5.688 2.322 -5.309 1.00 0.00 C ATOM 288 C LEU A 22 5.321 3.072 -6.585 1.00 0.00 C ATOM 289 O LEU A 22 4.494 2.611 -7.372 1.00 0.00 O ATOM 290 CB LEU A 22 4.953 2.935 -4.115 1.00 0.00 C ATOM 291 CG LEU A 22 3.435 2.749 -4.126 1.00 0.00 C ATOM 292 CD1 LEU A 22 3.045 1.494 -3.362 1.00 0.00 C ATOM 293 CD2 LEU A 22 2.746 3.971 -3.537 1.00 0.00 C ATOM 0 H LEU A 22 7.416 2.845 -4.242 1.00 0.00 H new ATOM 0 HA LEU A 22 5.383 1.281 -5.419 1.00 0.00 H new ATOM 0 HB2 LEU A 22 5.351 2.498 -3.199 1.00 0.00 H new ATOM 0 HB3 LEU A 22 5.173 4.002 -4.081 1.00 0.00 H new ATOM 0 HG LEU A 22 3.109 2.635 -5.160 1.00 0.00 H new ATOM 0 HD11 LEU A 22 1.961 1.379 -3.381 1.00 0.00 H new ATOM 0 HD12 LEU A 22 3.511 0.625 -3.827 1.00 0.00 H new ATOM 0 HD13 LEU A 22 3.383 1.577 -2.329 1.00 0.00 H new ATOM 0 HD21 LEU A 22 1.666 3.823 -3.552 1.00 0.00 H new ATOM 0 HD22 LEU A 22 3.078 4.116 -2.509 1.00 0.00 H new ATOM 0 HD23 LEU A 22 2.999 4.852 -4.127 1.00 0.00 H new ATOM 305 N TYR A 23 5.940 4.231 -6.784 1.00 0.00 N ATOM 306 CA TYR A 23 5.679 5.045 -7.965 1.00 0.00 C ATOM 307 C TYR A 23 6.146 4.333 -9.230 1.00 0.00 C ATOM 308 O TYR A 23 5.536 4.467 -10.291 1.00 0.00 O ATOM 309 CB TYR A 23 6.378 6.400 -7.841 1.00 0.00 C ATOM 310 CG TYR A 23 5.839 7.449 -8.788 1.00 0.00 C ATOM 311 CD1 TYR A 23 6.242 7.484 -10.117 1.00 0.00 C ATOM 312 CD2 TYR A 23 4.928 8.402 -8.353 1.00 0.00 C ATOM 313 CE1 TYR A 23 5.752 8.441 -10.986 1.00 0.00 C ATOM 314 CE2 TYR A 23 4.433 9.362 -9.216 1.00 0.00 C ATOM 315 CZ TYR A 23 4.848 9.377 -10.531 1.00 0.00 C ATOM 316 OH TYR A 23 4.357 10.330 -11.392 1.00 0.00 O ATOM 0 H TYR A 23 6.626 4.628 -6.142 1.00 0.00 H new ATOM 0 HA TYR A 23 4.603 5.204 -8.035 1.00 0.00 H new ATOM 0 HB2 TYR A 23 6.275 6.760 -6.817 1.00 0.00 H new ATOM 0 HB3 TYR A 23 7.444 6.268 -8.027 1.00 0.00 H new ATOM 0 HD1 TYR A 23 6.950 6.752 -10.477 1.00 0.00 H new ATOM 0 HD2 TYR A 23 4.601 8.393 -7.324 1.00 0.00 H new ATOM 0 HE1 TYR A 23 6.076 8.455 -12.016 1.00 0.00 H new ATOM 0 HE2 TYR A 23 3.725 10.097 -8.862 1.00 0.00 H new ATOM 0 HH TYR A 23 3.730 10.912 -10.913 1.00 0.00 H new ATOM 326 N THR A 24 7.230 3.575 -9.110 1.00 0.00 N ATOM 327 CA THR A 24 7.780 2.840 -10.244 1.00 0.00 C ATOM 328 C THR A 24 6.822 1.744 -10.698 1.00 0.00 C ATOM 329 O THR A 24 6.525 1.619 -11.886 1.00 0.00 O ATOM 330 CB THR A 24 9.133 2.231 -9.875 1.00 0.00 C ATOM 331 OG1 THR A 24 9.993 3.212 -9.324 1.00 0.00 O ATOM 332 CG2 THR A 24 9.848 1.604 -11.054 1.00 0.00 C ATOM 0 H THR A 24 7.746 3.453 -8.239 1.00 0.00 H new ATOM 0 HA THR A 24 7.917 3.541 -11.068 1.00 0.00 H new ATOM 0 HB THR A 24 8.909 1.450 -9.148 1.00 0.00 H new ATOM 0 HG1 THR A 24 9.681 3.454 -8.427 1.00 0.00 H new ATOM 0 HG21 THR A 24 10.801 1.191 -10.724 1.00 0.00 H new ATOM 0 HG22 THR A 24 9.232 0.807 -11.471 1.00 0.00 H new ATOM 0 HG23 THR A 24 10.026 2.362 -11.817 1.00 0.00 H new ATOM 340 N MET A 25 6.341 0.952 -9.745 1.00 0.00 N ATOM 341 CA MET A 25 5.417 -0.134 -10.047 1.00 0.00 C ATOM 342 C MET A 25 4.066 0.409 -10.501 1.00 0.00 C ATOM 343 O MET A 25 3.375 -0.213 -11.307 1.00 0.00 O ATOM 344 CB MET A 25 5.232 -1.030 -8.821 1.00 0.00 C ATOM 345 CG MET A 25 6.421 -1.935 -8.544 1.00 0.00 C ATOM 346 SD MET A 25 6.001 -3.327 -7.478 1.00 0.00 S ATOM 347 CE MET A 25 5.779 -2.495 -5.907 1.00 0.00 C ATOM 0 H MET A 25 6.576 1.043 -8.757 1.00 0.00 H new ATOM 0 HA MET A 25 5.843 -0.723 -10.859 1.00 0.00 H new ATOM 0 HB2 MET A 25 5.052 -0.404 -7.947 1.00 0.00 H new ATOM 0 HB3 MET A 25 4.343 -1.645 -8.961 1.00 0.00 H new ATOM 0 HG2 MET A 25 6.814 -2.311 -9.488 1.00 0.00 H new ATOM 0 HG3 MET A 25 7.215 -1.352 -8.078 1.00 0.00 H new ATOM 0 HE1 MET A 25 6.613 -2.734 -5.247 1.00 0.00 H new ATOM 0 HE2 MET A 25 5.741 -1.418 -6.068 1.00 0.00 H new ATOM 0 HE3 MET A 25 4.847 -2.826 -5.448 1.00 0.00 H new ATOM 357 N MET A 26 3.696 1.574 -9.979 1.00 0.00 N ATOM 358 CA MET A 26 2.428 2.201 -10.331 1.00 0.00 C ATOM 359 C MET A 26 2.433 2.662 -11.786 1.00 0.00 C ATOM 360 O MET A 26 1.395 2.674 -12.447 1.00 0.00 O ATOM 361 CB MET A 26 2.147 3.388 -9.407 1.00 0.00 C ATOM 362 CG MET A 26 1.474 2.997 -8.103 1.00 0.00 C ATOM 363 SD MET A 26 0.513 4.344 -7.387 1.00 0.00 S ATOM 364 CE MET A 26 1.800 5.546 -7.063 1.00 0.00 C ATOM 0 H MET A 26 4.257 2.103 -9.311 1.00 0.00 H new ATOM 0 HA MET A 26 1.639 1.460 -10.207 1.00 0.00 H new ATOM 0 HB2 MET A 26 3.086 3.894 -9.184 1.00 0.00 H new ATOM 0 HB3 MET A 26 1.515 4.105 -9.932 1.00 0.00 H new ATOM 0 HG2 MET A 26 0.820 2.142 -8.278 1.00 0.00 H new ATOM 0 HG3 MET A 26 2.233 2.677 -7.389 1.00 0.00 H new ATOM 0 HE1 MET A 26 1.348 6.493 -6.769 1.00 0.00 H new ATOM 0 HE2 MET A 26 2.441 5.185 -6.259 1.00 0.00 H new ATOM 0 HE3 MET A 26 2.396 5.693 -7.964 1.00 0.00 H new ATOM 374 N THR A 27 3.608 3.042 -12.277 1.00 0.00 N ATOM 375 CA THR A 27 3.749 3.504 -13.652 1.00 0.00 C ATOM 376 C THR A 27 4.577 2.521 -14.475 1.00 0.00 C ATOM 377 O THR A 27 5.403 2.922 -15.294 1.00 0.00 O ATOM 378 CB THR A 27 4.400 4.888 -13.684 1.00 0.00 C ATOM 379 OG1 THR A 27 5.687 4.850 -13.095 1.00 0.00 O ATOM 380 CG2 THR A 27 3.594 5.945 -12.960 1.00 0.00 C ATOM 0 H THR A 27 4.477 3.039 -11.742 1.00 0.00 H new ATOM 0 HA THR A 27 2.753 3.568 -14.090 1.00 0.00 H new ATOM 0 HB THR A 27 4.457 5.157 -14.739 1.00 0.00 H new ATOM 0 HG1 THR A 27 5.600 4.734 -12.126 1.00 0.00 H new ATOM 0 HG21 THR A 27 4.112 6.902 -13.021 1.00 0.00 H new ATOM 0 HG22 THR A 27 2.611 6.034 -13.423 1.00 0.00 H new ATOM 0 HG23 THR A 27 3.478 5.661 -11.914 1.00 0.00 H new ATOM 388 N ASP A 28 4.348 1.231 -14.251 1.00 0.00 N ATOM 389 CA ASP A 28 5.071 0.190 -14.971 1.00 0.00 C ATOM 390 C ASP A 28 4.208 -0.406 -16.078 1.00 0.00 C ATOM 391 O ASP A 28 4.716 -0.816 -17.123 1.00 0.00 O ATOM 392 CB ASP A 28 5.516 -0.911 -14.006 1.00 0.00 C ATOM 393 CG ASP A 28 6.830 -1.546 -14.419 1.00 0.00 C ATOM 394 OD1 ASP A 28 7.893 -1.014 -14.035 1.00 0.00 O ATOM 395 OD2 ASP A 28 6.796 -2.573 -15.128 1.00 0.00 O ATOM 0 H ASP A 28 3.667 0.882 -13.576 1.00 0.00 H new ATOM 0 HA ASP A 28 5.952 0.643 -15.426 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.617 -0.493 -13.004 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.745 -1.679 -13.955 1.00 0.00 H new ATOM 400 N LYS A 29 2.901 -0.451 -15.843 1.00 0.00 N ATOM 401 CA LYS A 29 1.966 -0.997 -16.821 1.00 0.00 C ATOM 402 C LYS A 29 2.296 -2.454 -17.135 1.00 0.00 C ATOM 403 O LYS A 29 2.052 -2.930 -18.244 1.00 0.00 O ATOM 404 CB LYS A 29 1.997 -0.167 -18.106 1.00 0.00 C ATOM 405 CG LYS A 29 1.043 1.016 -18.088 1.00 0.00 C ATOM 406 CD LYS A 29 1.630 2.195 -17.330 1.00 0.00 C ATOM 407 CE LYS A 29 1.265 3.519 -17.983 1.00 0.00 C ATOM 408 NZ LYS A 29 2.469 4.333 -18.301 1.00 0.00 N ATOM 0 H LYS A 29 2.465 -0.116 -14.984 1.00 0.00 H new ATOM 0 HA LYS A 29 0.965 -0.954 -16.393 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.011 0.197 -18.269 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.749 -0.810 -18.950 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.816 1.317 -19.111 1.00 0.00 H new ATOM 0 HG3 LYS A 29 0.101 0.718 -17.627 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.268 2.184 -16.302 1.00 0.00 H new ATOM 0 HD3 LYS A 29 2.715 2.097 -17.287 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.703 3.330 -18.898 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.611 4.083 -17.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 2.176 5.227 -18.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 2.992 4.536 -17.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 3.081 3.806 -18.956 1.00 0.00 H new ATOM 422 N ASN A 30 2.851 -3.155 -16.152 1.00 0.00 N ATOM 423 CA ASN A 30 3.214 -4.557 -16.325 1.00 0.00 C ATOM 424 C ASN A 30 3.000 -5.335 -15.030 1.00 0.00 C ATOM 425 O ASN A 30 2.385 -6.401 -15.030 1.00 0.00 O ATOM 426 CB ASN A 30 4.673 -4.675 -16.773 1.00 0.00 C ATOM 427 CG ASN A 30 4.822 -5.493 -18.042 1.00 0.00 C ATOM 428 OD1 ASN A 30 5.158 -4.962 -19.101 1.00 0.00 O ATOM 429 ND2 ASN A 30 4.572 -6.793 -17.941 1.00 0.00 N ATOM 0 H ASN A 30 3.059 -2.776 -15.228 1.00 0.00 H new ATOM 0 HA ASN A 30 2.571 -4.984 -17.095 1.00 0.00 H new ATOM 0 HB2 ASN A 30 5.082 -3.678 -16.936 1.00 0.00 H new ATOM 0 HB3 ASN A 30 5.259 -5.134 -15.977 1.00 0.00 H new ATOM 0 HD21 ASN A 30 4.656 -7.394 -18.761 1.00 0.00 H new ATOM 0 HD22 ASN A 30 4.296 -7.191 -17.043 1.00 0.00 H new ATOM 436 N ILE A 31 3.511 -4.794 -13.929 1.00 0.00 N ATOM 437 CA ILE A 31 3.373 -5.437 -12.628 1.00 0.00 C ATOM 438 C ILE A 31 2.234 -4.816 -11.827 1.00 0.00 C ATOM 439 O ILE A 31 2.324 -3.670 -11.385 1.00 0.00 O ATOM 440 CB ILE A 31 4.676 -5.335 -11.810 1.00 0.00 C ATOM 441 CG1 ILE A 31 5.870 -5.793 -12.649 1.00 0.00 C ATOM 442 CG2 ILE A 31 4.569 -6.162 -10.537 1.00 0.00 C ATOM 443 CD1 ILE A 31 7.194 -5.237 -12.170 1.00 0.00 C ATOM 0 H ILE A 31 4.024 -3.913 -13.912 1.00 0.00 H new ATOM 0 HA ILE A 31 3.152 -6.488 -12.816 1.00 0.00 H new ATOM 0 HB ILE A 31 4.831 -4.292 -11.532 1.00 0.00 H new ATOM 0 HG12 ILE A 31 5.916 -6.882 -12.636 1.00 0.00 H new ATOM 0 HG13 ILE A 31 5.712 -5.493 -13.685 1.00 0.00 H new ATOM 0 HG21 ILE A 31 5.497 -6.080 -9.971 1.00 0.00 H new ATOM 0 HG22 ILE A 31 3.741 -5.793 -9.932 1.00 0.00 H new ATOM 0 HG23 ILE A 31 4.393 -7.206 -10.795 1.00 0.00 H new ATOM 0 HD11 ILE A 31 7.996 -5.603 -12.811 1.00 0.00 H new ATOM 0 HD12 ILE A 31 7.167 -4.148 -12.209 1.00 0.00 H new ATOM 0 HD13 ILE A 31 7.374 -5.559 -11.144 1.00 0.00 H new ATOM 455 N SER A 32 1.161 -5.580 -11.644 1.00 0.00 N ATOM 456 CA SER A 32 0.003 -5.103 -10.896 1.00 0.00 C ATOM 457 C SER A 32 0.390 -4.728 -9.469 1.00 0.00 C ATOM 458 O SER A 32 1.424 -5.161 -8.962 1.00 0.00 O ATOM 459 CB SER A 32 -1.091 -6.173 -10.876 1.00 0.00 C ATOM 460 OG SER A 32 -1.775 -6.227 -12.116 1.00 0.00 O ATOM 0 H SER A 32 1.070 -6.530 -12.003 1.00 0.00 H new ATOM 0 HA SER A 32 -0.377 -4.211 -11.394 1.00 0.00 H new ATOM 0 HB2 SER A 32 -0.649 -7.145 -10.658 1.00 0.00 H new ATOM 0 HB3 SER A 32 -1.799 -5.958 -10.076 1.00 0.00 H new ATOM 0 HG SER A 32 -2.467 -6.919 -12.078 1.00 0.00 H new ATOM 466 N LEU A 33 -0.447 -3.919 -8.829 1.00 0.00 N ATOM 467 CA LEU A 33 -0.193 -3.483 -7.461 1.00 0.00 C ATOM 468 C LEU A 33 -1.428 -2.812 -6.867 1.00 0.00 C ATOM 469 O LEU A 33 -2.172 -2.129 -7.569 1.00 0.00 O ATOM 470 CB LEU A 33 0.994 -2.520 -7.423 1.00 0.00 C ATOM 471 CG LEU A 33 1.375 -2.016 -6.029 1.00 0.00 C ATOM 472 CD1 LEU A 33 1.741 -3.180 -5.123 1.00 0.00 C ATOM 473 CD2 LEU A 33 2.526 -1.025 -6.119 1.00 0.00 C ATOM 0 H LEU A 33 -1.307 -3.552 -9.236 1.00 0.00 H new ATOM 0 HA LEU A 33 0.044 -4.363 -6.863 1.00 0.00 H new ATOM 0 HB2 LEU A 33 1.859 -3.016 -7.862 1.00 0.00 H new ATOM 0 HB3 LEU A 33 0.765 -1.661 -8.053 1.00 0.00 H new ATOM 0 HG LEU A 33 0.514 -1.505 -5.599 1.00 0.00 H new ATOM 0 HD11 LEU A 33 2.009 -2.803 -4.136 1.00 0.00 H new ATOM 0 HD12 LEU A 33 0.889 -3.854 -5.035 1.00 0.00 H new ATOM 0 HD13 LEU A 33 2.588 -3.719 -5.548 1.00 0.00 H new ATOM 0 HD21 LEU A 33 2.785 -0.676 -5.119 1.00 0.00 H new ATOM 0 HD22 LEU A 33 3.391 -1.512 -6.569 1.00 0.00 H new ATOM 0 HD23 LEU A 33 2.228 -0.176 -6.734 1.00 0.00 H new ATOM 485 N ILE A 34 -1.640 -3.015 -5.571 1.00 0.00 N ATOM 486 CA ILE A 34 -2.787 -2.429 -4.885 1.00 0.00 C ATOM 487 C ILE A 34 -2.388 -1.866 -3.526 1.00 0.00 C ATOM 488 O ILE A 34 -1.626 -2.488 -2.785 1.00 0.00 O ATOM 489 CB ILE A 34 -3.913 -3.462 -4.688 1.00 0.00 C ATOM 490 CG1 ILE A 34 -4.174 -4.222 -5.991 1.00 0.00 C ATOM 491 CG2 ILE A 34 -5.182 -2.777 -4.205 1.00 0.00 C ATOM 492 CD1 ILE A 34 -5.263 -5.266 -5.873 1.00 0.00 C ATOM 0 H ILE A 34 -1.034 -3.579 -4.975 1.00 0.00 H new ATOM 0 HA ILE A 34 -3.152 -1.620 -5.518 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.599 -4.178 -3.929 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -4.447 -3.510 -6.769 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -3.251 -4.706 -6.311 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -5.968 -3.520 -4.071 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.988 -2.279 -3.255 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.501 -2.041 -4.942 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -5.394 -5.765 -6.833 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.983 -6.000 -5.118 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -6.198 -4.786 -5.583 1.00 0.00 H new ATOM 504 N ILE A 35 -2.908 -0.687 -3.205 1.00 0.00 N ATOM 505 CA ILE A 35 -2.608 -0.040 -1.933 1.00 0.00 C ATOM 506 C ILE A 35 -3.786 -0.150 -0.972 1.00 0.00 C ATOM 507 O ILE A 35 -4.933 -0.294 -1.394 1.00 0.00 O ATOM 508 CB ILE A 35 -2.257 1.448 -2.128 1.00 0.00 C ATOM 509 CG1 ILE A 35 -1.214 1.609 -3.235 1.00 0.00 C ATOM 510 CG2 ILE A 35 -1.751 2.049 -0.825 1.00 0.00 C ATOM 511 CD1 ILE A 35 -1.000 3.046 -3.660 1.00 0.00 C ATOM 0 H ILE A 35 -3.539 -0.160 -3.808 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.746 -0.556 -1.510 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.160 1.982 -2.425 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -0.266 1.195 -2.893 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.523 1.024 -4.102 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -1.507 3.100 -0.980 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.524 1.964 -0.061 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -0.859 1.514 -0.500 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.248 3.084 -4.448 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.937 3.458 -4.033 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.661 3.631 -2.805 1.00 0.00 H new ATOM 523 N MET A 36 -3.495 -0.083 0.324 1.00 0.00 N ATOM 524 CA MET A 36 -4.533 -0.176 1.344 1.00 0.00 C ATOM 525 C MET A 36 -4.295 0.839 2.457 1.00 0.00 C ATOM 526 O MET A 36 -3.166 1.031 2.907 1.00 0.00 O ATOM 527 CB MET A 36 -4.577 -1.589 1.929 1.00 0.00 C ATOM 528 CG MET A 36 -4.761 -2.674 0.881 1.00 0.00 C ATOM 529 SD MET A 36 -5.307 -4.240 1.591 1.00 0.00 S ATOM 530 CE MET A 36 -5.888 -5.092 0.127 1.00 0.00 C ATOM 0 H MET A 36 -2.551 0.035 0.691 1.00 0.00 H new ATOM 0 HA MET A 36 -5.491 0.046 0.873 1.00 0.00 H new ATOM 0 HB2 MET A 36 -3.653 -1.776 2.476 1.00 0.00 H new ATOM 0 HB3 MET A 36 -5.392 -1.650 2.650 1.00 0.00 H new ATOM 0 HG2 MET A 36 -5.490 -2.341 0.142 1.00 0.00 H new ATOM 0 HG3 MET A 36 -3.820 -2.827 0.353 1.00 0.00 H new ATOM 0 HE1 MET A 36 -5.643 -6.151 0.201 1.00 0.00 H new ATOM 0 HE2 MET A 36 -6.968 -4.975 0.042 1.00 0.00 H new ATOM 0 HE3 MET A 36 -5.407 -4.669 -0.755 1.00 0.00 H new ATOM 540 N ASP A 37 -5.369 1.488 2.896 1.00 0.00 N ATOM 541 CA ASP A 37 -5.279 2.484 3.957 1.00 0.00 C ATOM 542 C ASP A 37 -5.603 1.866 5.313 1.00 0.00 C ATOM 543 O ASP A 37 -6.762 1.830 5.728 1.00 0.00 O ATOM 544 CB ASP A 37 -6.230 3.649 3.674 1.00 0.00 C ATOM 545 CG ASP A 37 -5.665 4.623 2.658 1.00 0.00 C ATOM 546 OD1 ASP A 37 -5.606 4.268 1.463 1.00 0.00 O ATOM 547 OD2 ASP A 37 -5.281 5.743 3.059 1.00 0.00 O ATOM 0 H ASP A 37 -6.311 1.342 2.533 1.00 0.00 H new ATOM 0 HA ASP A 37 -4.255 2.858 3.984 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -7.180 3.258 3.310 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -6.439 4.178 4.604 1.00 0.00 H new ATOM 552 N ALA A 38 -4.574 1.381 5.998 1.00 0.00 N ATOM 553 CA ALA A 38 -4.750 0.764 7.307 1.00 0.00 C ATOM 554 C ALA A 38 -5.019 1.814 8.378 1.00 0.00 C ATOM 555 O ALA A 38 -4.227 1.992 9.304 1.00 0.00 O ATOM 556 CB ALA A 38 -3.526 -0.064 7.669 1.00 0.00 C ATOM 0 H ALA A 38 -3.609 1.403 5.669 1.00 0.00 H new ATOM 0 HA ALA A 38 -5.617 0.106 7.257 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -3.671 -0.519 8.649 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -3.382 -0.846 6.924 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -2.646 0.579 7.694 1.00 0.00 H new ATOM 562 N ARG A 39 -6.144 2.509 8.246 1.00 0.00 N ATOM 563 CA ARG A 39 -6.522 3.542 9.202 1.00 0.00 C ATOM 564 C ARG A 39 -8.036 3.598 9.372 1.00 0.00 C ATOM 565 O ARG A 39 -8.763 2.773 8.818 1.00 0.00 O ATOM 566 CB ARG A 39 -5.999 4.905 8.743 1.00 0.00 C ATOM 567 CG ARG A 39 -4.497 4.938 8.517 1.00 0.00 C ATOM 568 CD ARG A 39 -4.144 4.612 7.075 1.00 0.00 C ATOM 569 NE ARG A 39 -4.525 5.688 6.161 1.00 0.00 N ATOM 570 CZ ARG A 39 -3.920 6.872 6.119 1.00 0.00 C ATOM 571 NH1 ARG A 39 -2.907 7.139 6.934 1.00 0.00 N ATOM 572 NH2 ARG A 39 -4.329 7.795 5.259 1.00 0.00 N ATOM 0 H ARG A 39 -6.810 2.375 7.485 1.00 0.00 H new ATOM 0 HA ARG A 39 -6.075 3.293 10.165 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -6.503 5.185 7.818 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -6.262 5.655 9.489 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -4.111 5.925 8.773 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -4.012 4.223 9.182 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -3.072 4.432 6.996 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -4.645 3.690 6.779 1.00 0.00 H new ATOM 0 HE ARG A 39 -5.299 5.521 5.519 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -2.587 6.434 7.598 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -2.448 8.049 6.896 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -5.107 7.597 4.630 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -3.865 8.703 5.227 1.00 0.00 H new ATOM 586 N ARG A 40 -8.505 4.574 10.142 1.00 0.00 N ATOM 587 CA ARG A 40 -9.934 4.735 10.384 1.00 0.00 C ATOM 588 C ARG A 40 -10.682 4.986 9.079 1.00 0.00 C ATOM 589 O ARG A 40 -10.093 5.414 8.087 1.00 0.00 O ATOM 590 CB ARG A 40 -10.181 5.889 11.357 1.00 0.00 C ATOM 591 CG ARG A 40 -10.209 5.460 12.816 1.00 0.00 C ATOM 592 CD ARG A 40 -11.532 4.803 13.177 1.00 0.00 C ATOM 593 NE ARG A 40 -11.649 4.563 14.614 1.00 0.00 N ATOM 594 CZ ARG A 40 -11.955 5.507 15.500 1.00 0.00 C ATOM 595 NH1 ARG A 40 -12.176 6.754 15.103 1.00 0.00 N ATOM 596 NH2 ARG A 40 -12.041 5.203 16.788 1.00 0.00 N ATOM 0 H ARG A 40 -7.917 5.265 10.609 1.00 0.00 H new ATOM 0 HA ARG A 40 -10.309 3.811 10.825 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -9.402 6.640 11.223 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -11.129 6.366 11.109 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -9.392 4.765 13.008 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -10.046 6.328 13.455 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -12.354 5.438 12.847 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -11.625 3.858 12.643 1.00 0.00 H new ATOM 0 HE ARG A 40 -11.487 3.616 14.958 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -12.112 6.993 14.114 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -12.410 7.473 15.787 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -11.873 4.246 17.099 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -12.276 5.926 17.468 1.00 0.00 H new ATOM 610 N MET A 41 -11.984 4.716 9.087 1.00 0.00 N ATOM 611 CA MET A 41 -12.812 4.913 7.903 1.00 0.00 C ATOM 612 C MET A 41 -12.991 6.398 7.604 1.00 0.00 C ATOM 613 O MET A 41 -13.126 6.797 6.447 1.00 0.00 O ATOM 614 CB MET A 41 -14.178 4.251 8.095 1.00 0.00 C ATOM 615 CG MET A 41 -14.792 3.739 6.803 1.00 0.00 C ATOM 616 SD MET A 41 -16.412 2.989 7.053 1.00 0.00 S ATOM 617 CE MET A 41 -17.306 3.637 5.643 1.00 0.00 C ATOM 0 H MET A 41 -12.488 4.361 9.900 1.00 0.00 H new ATOM 0 HA MET A 41 -12.307 4.449 7.056 1.00 0.00 H new ATOM 0 HB2 MET A 41 -14.075 3.420 8.793 1.00 0.00 H new ATOM 0 HB3 MET A 41 -14.859 4.969 8.552 1.00 0.00 H new ATOM 0 HG2 MET A 41 -14.883 4.564 6.097 1.00 0.00 H new ATOM 0 HG3 MET A 41 -14.122 3.006 6.353 1.00 0.00 H new ATOM 0 HE1 MET A 41 -18.242 3.092 5.524 1.00 0.00 H new ATOM 0 HE2 MET A 41 -17.519 4.694 5.802 1.00 0.00 H new ATOM 0 HE3 MET A 41 -16.701 3.520 4.744 1.00 0.00 H new ATOM 627 N GLN A 42 -12.994 7.211 8.655 1.00 0.00 N ATOM 628 CA GLN A 42 -13.157 8.652 8.506 1.00 0.00 C ATOM 629 C GLN A 42 -11.948 9.269 7.810 1.00 0.00 C ATOM 630 O GLN A 42 -12.070 10.266 7.098 1.00 0.00 O ATOM 631 CB GLN A 42 -13.364 9.307 9.874 1.00 0.00 C ATOM 632 CG GLN A 42 -14.514 10.301 9.905 1.00 0.00 C ATOM 633 CD GLN A 42 -14.900 10.701 11.316 1.00 0.00 C ATOM 634 OE1 GLN A 42 -14.293 10.254 12.288 1.00 0.00 O ATOM 635 NE2 GLN A 42 -15.916 11.548 11.433 1.00 0.00 N ATOM 0 H GLN A 42 -12.885 6.896 9.619 1.00 0.00 H new ATOM 0 HA GLN A 42 -14.037 8.831 7.888 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -13.547 8.530 10.616 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -12.446 9.817 10.166 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -14.235 11.192 9.342 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -15.379 9.866 9.405 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -16.391 11.893 10.599 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -16.222 11.853 12.357 1.00 0.00 H new ATOM 644 N ASP A 43 -10.780 8.670 8.020 1.00 0.00 N ATOM 645 CA ASP A 43 -9.548 9.162 7.413 1.00 0.00 C ATOM 646 C ASP A 43 -9.601 9.036 5.893 1.00 0.00 C ATOM 647 O ASP A 43 -9.239 9.964 5.171 1.00 0.00 O ATOM 648 CB ASP A 43 -8.344 8.393 7.958 1.00 0.00 C ATOM 649 CG ASP A 43 -7.026 9.046 7.589 1.00 0.00 C ATOM 650 OD1 ASP A 43 -7.013 10.274 7.365 1.00 0.00 O ATOM 651 OD2 ASP A 43 -6.006 8.328 7.521 1.00 0.00 O ATOM 0 H ASP A 43 -10.661 7.843 8.606 1.00 0.00 H new ATOM 0 HA ASP A 43 -9.443 10.216 7.668 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -8.421 8.324 9.043 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -8.362 7.374 7.572 1.00 0.00 H new ATOM 656 N TYR A 44 -10.055 7.881 5.415 1.00 0.00 N ATOM 657 CA TYR A 44 -10.155 7.634 3.981 1.00 0.00 C ATOM 658 C TYR A 44 -11.078 8.649 3.317 1.00 0.00 C ATOM 659 O TYR A 44 -10.761 9.193 2.259 1.00 0.00 O ATOM 660 CB TYR A 44 -10.665 6.216 3.721 1.00 0.00 C ATOM 661 CG TYR A 44 -10.737 5.857 2.254 1.00 0.00 C ATOM 662 CD1 TYR A 44 -9.610 5.925 1.446 1.00 0.00 C ATOM 663 CD2 TYR A 44 -11.934 5.450 1.677 1.00 0.00 C ATOM 664 CE1 TYR A 44 -9.671 5.599 0.105 1.00 0.00 C ATOM 665 CE2 TYR A 44 -12.003 5.121 0.337 1.00 0.00 C ATOM 666 CZ TYR A 44 -10.870 5.197 -0.445 1.00 0.00 C ATOM 667 OH TYR A 44 -10.936 4.871 -1.779 1.00 0.00 O ATOM 0 H TYR A 44 -10.359 7.102 5.999 1.00 0.00 H new ATOM 0 HA TYR A 44 -9.160 7.739 3.549 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -10.012 5.506 4.228 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -11.656 6.109 4.162 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -8.669 6.238 1.873 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -12.824 5.390 2.286 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -8.785 5.659 -0.509 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -12.941 4.806 -0.096 1.00 0.00 H new ATOM 0 HH TYR A 44 -11.852 4.608 -2.006 1.00 0.00 H new ATOM 677 N GLN A 45 -12.223 8.900 3.944 1.00 0.00 N ATOM 678 CA GLN A 45 -13.193 9.851 3.413 1.00 0.00 C ATOM 679 C GLN A 45 -12.610 11.260 3.376 1.00 0.00 C ATOM 680 O GLN A 45 -12.955 12.062 2.508 1.00 0.00 O ATOM 681 CB GLN A 45 -14.468 9.836 4.259 1.00 0.00 C ATOM 682 CG GLN A 45 -15.049 8.446 4.460 1.00 0.00 C ATOM 683 CD GLN A 45 -16.565 8.447 4.488 1.00 0.00 C ATOM 684 OE1 GLN A 45 -17.202 9.467 4.228 1.00 0.00 O ATOM 685 NE2 GLN A 45 -17.152 7.299 4.805 1.00 0.00 N ATOM 0 H GLN A 45 -12.502 8.458 4.820 1.00 0.00 H new ATOM 0 HA GLN A 45 -13.437 9.552 2.394 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -14.253 10.275 5.233 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -15.217 10.468 3.783 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -14.704 7.793 3.658 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -14.672 8.030 5.394 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -16.585 6.477 5.014 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -18.170 7.239 4.840 1.00 0.00 H new ATOM 694 N ASP A 46 -11.725 11.554 4.322 1.00 0.00 N ATOM 695 CA ASP A 46 -11.094 12.867 4.398 1.00 0.00 C ATOM 696 C ASP A 46 -9.952 12.979 3.394 1.00 0.00 C ATOM 697 O ASP A 46 -9.952 13.859 2.533 1.00 0.00 O ATOM 698 CB ASP A 46 -10.573 13.125 5.813 1.00 0.00 C ATOM 699 CG ASP A 46 -10.739 14.572 6.234 1.00 0.00 C ATOM 700 OD1 ASP A 46 -11.833 15.133 6.014 1.00 0.00 O ATOM 701 OD2 ASP A 46 -9.774 15.145 6.783 1.00 0.00 O ATOM 0 H ASP A 46 -11.428 10.901 5.047 1.00 0.00 H new ATOM 0 HA ASP A 46 -11.844 13.619 4.153 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -11.103 12.482 6.515 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -9.519 12.853 5.865 1.00 0.00 H new ATOM 706 N SER A 47 -8.977 12.083 3.512 1.00 0.00 N ATOM 707 CA SER A 47 -7.828 12.082 2.613 1.00 0.00 C ATOM 708 C SER A 47 -7.434 10.658 2.233 1.00 0.00 C ATOM 709 O SER A 47 -7.469 9.751 3.065 1.00 0.00 O ATOM 710 CB SER A 47 -6.642 12.793 3.268 1.00 0.00 C ATOM 711 OG SER A 47 -6.059 11.989 4.279 1.00 0.00 O ATOM 0 H SER A 47 -8.959 11.349 4.220 1.00 0.00 H new ATOM 0 HA SER A 47 -8.109 12.616 1.705 1.00 0.00 H new ATOM 0 HB2 SER A 47 -5.894 13.031 2.512 1.00 0.00 H new ATOM 0 HB3 SER A 47 -6.973 13.739 3.697 1.00 0.00 H new ATOM 0 HG SER A 47 -5.432 11.355 3.872 1.00 0.00 H new ATOM 717 N CYS A 48 -7.060 10.470 0.972 1.00 0.00 N ATOM 718 CA CYS A 48 -6.661 9.157 0.481 1.00 0.00 C ATOM 719 C CYS A 48 -6.017 9.266 -0.897 1.00 0.00 C ATOM 720 O CYS A 48 -6.216 10.250 -1.610 1.00 0.00 O ATOM 721 CB CYS A 48 -7.869 8.222 0.420 1.00 0.00 C ATOM 722 SG CYS A 48 -9.151 8.746 -0.743 1.00 0.00 S ATOM 0 H CYS A 48 -7.025 11.211 0.272 1.00 0.00 H new ATOM 0 HA CYS A 48 -5.928 8.745 1.174 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -7.529 7.224 0.144 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -8.306 8.145 1.416 1.00 0.00 H new ATOM 0 HG CYS A 48 -9.929 7.740 -1.013 1.00 0.00 H new ATOM 728 N ILE A 49 -5.244 8.250 -1.267 1.00 0.00 N ATOM 729 CA ILE A 49 -4.573 8.233 -2.561 1.00 0.00 C ATOM 730 C ILE A 49 -5.568 7.999 -3.692 1.00 0.00 C ATOM 731 O ILE A 49 -6.657 7.467 -3.475 1.00 0.00 O ATOM 732 CB ILE A 49 -3.484 7.144 -2.615 1.00 0.00 C ATOM 733 CG1 ILE A 49 -2.573 7.241 -1.389 1.00 0.00 C ATOM 734 CG2 ILE A 49 -2.673 7.269 -3.896 1.00 0.00 C ATOM 735 CD1 ILE A 49 -1.480 6.196 -1.364 1.00 0.00 C ATOM 0 H ILE A 49 -5.067 7.428 -0.689 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.105 9.209 -2.688 1.00 0.00 H new ATOM 0 HB ILE A 49 -3.967 6.167 -2.608 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -2.118 8.231 -1.362 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -3.178 7.143 -0.488 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -1.908 6.493 -3.919 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -3.332 7.155 -4.757 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -2.197 8.249 -3.931 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -0.874 6.325 -0.468 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -1.927 5.202 -1.360 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -0.850 6.307 -2.247 1.00 0.00 H new ATOM 747 N LEU A 50 -5.187 8.400 -4.901 1.00 0.00 N ATOM 748 CA LEU A 50 -6.047 8.236 -6.067 1.00 0.00 C ATOM 749 C LEU A 50 -6.331 6.760 -6.332 1.00 0.00 C ATOM 750 O LEU A 50 -7.421 6.267 -6.043 1.00 0.00 O ATOM 751 CB LEU A 50 -5.399 8.873 -7.298 1.00 0.00 C ATOM 752 CG LEU A 50 -5.593 10.386 -7.420 1.00 0.00 C ATOM 753 CD1 LEU A 50 -4.367 11.033 -8.047 1.00 0.00 C ATOM 754 CD2 LEU A 50 -6.839 10.698 -8.237 1.00 0.00 C ATOM 0 H LEU A 50 -4.289 8.841 -5.098 1.00 0.00 H new ATOM 0 HA LEU A 50 -6.993 8.737 -5.863 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.330 8.659 -7.279 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -5.804 8.397 -8.191 1.00 0.00 H new ATOM 0 HG LEU A 50 -5.724 10.799 -6.420 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.523 12.109 -8.126 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -3.494 10.838 -7.424 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.204 10.616 -9.041 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.962 11.778 -8.314 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.736 10.272 -9.235 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -7.712 10.267 -7.747 1.00 0.00 H new ATOM 766 N HIS A 51 -5.344 6.062 -6.883 1.00 0.00 N ATOM 767 CA HIS A 51 -5.491 4.642 -7.187 1.00 0.00 C ATOM 768 C HIS A 51 -5.051 3.784 -6.005 1.00 0.00 C ATOM 769 O HIS A 51 -3.955 3.223 -6.006 1.00 0.00 O ATOM 770 CB HIS A 51 -4.674 4.277 -8.428 1.00 0.00 C ATOM 771 CG HIS A 51 -4.962 5.148 -9.611 1.00 0.00 C ATOM 772 ND1 HIS A 51 -6.230 5.427 -10.070 1.00 0.00 N ATOM 773 CD2 HIS A 51 -4.112 5.810 -10.436 1.00 0.00 C ATOM 774 CE1 HIS A 51 -6.114 6.231 -11.136 1.00 0.00 C ATOM 775 NE2 HIS A 51 -4.849 6.494 -11.399 1.00 0.00 N ATOM 0 H HIS A 51 -4.435 6.455 -7.128 1.00 0.00 H new ATOM 0 HA HIS A 51 -6.545 4.446 -7.383 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -3.613 4.344 -8.187 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -4.876 3.239 -8.693 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -3.035 5.807 -10.358 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -6.948 6.614 -11.705 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -4.486 7.078 -12.152 1.00 0.00 H new ATOM 783 N SER A 52 -5.913 3.687 -4.997 1.00 0.00 N ATOM 784 CA SER A 52 -5.613 2.898 -3.808 1.00 0.00 C ATOM 785 C SER A 52 -6.883 2.283 -3.228 1.00 0.00 C ATOM 786 O SER A 52 -7.992 2.614 -3.648 1.00 0.00 O ATOM 787 CB SER A 52 -4.926 3.767 -2.754 1.00 0.00 C ATOM 788 OG SER A 52 -5.751 4.855 -2.375 1.00 0.00 O ATOM 0 H SER A 52 -6.824 4.145 -4.980 1.00 0.00 H new ATOM 0 HA SER A 52 -4.940 2.091 -4.098 1.00 0.00 H new ATOM 0 HB2 SER A 52 -4.690 3.163 -1.878 1.00 0.00 H new ATOM 0 HB3 SER A 52 -3.981 4.142 -3.147 1.00 0.00 H new ATOM 0 HG SER A 52 -5.458 5.201 -1.506 1.00 0.00 H new ATOM 794 N LEU A 53 -6.712 1.387 -2.262 1.00 0.00 N ATOM 795 CA LEU A 53 -7.843 0.726 -1.623 1.00 0.00 C ATOM 796 C LEU A 53 -8.049 1.250 -0.205 1.00 0.00 C ATOM 797 O LEU A 53 -7.157 1.870 0.373 1.00 0.00 O ATOM 798 CB LEU A 53 -7.627 -0.787 -1.594 1.00 0.00 C ATOM 799 CG LEU A 53 -8.901 -1.621 -1.450 1.00 0.00 C ATOM 800 CD1 LEU A 53 -9.907 -1.249 -2.529 1.00 0.00 C ATOM 801 CD2 LEU A 53 -8.576 -3.105 -1.511 1.00 0.00 C ATOM 0 H LEU A 53 -5.800 1.102 -1.904 1.00 0.00 H new ATOM 0 HA LEU A 53 -8.737 0.946 -2.206 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -7.119 -1.084 -2.512 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -6.958 -1.027 -0.767 1.00 0.00 H new ATOM 0 HG LEU A 53 -9.345 -1.406 -0.478 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -10.807 -1.852 -2.411 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -10.163 -0.193 -2.439 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -9.472 -1.434 -3.511 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -9.494 -3.683 -1.407 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -8.108 -3.336 -2.468 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -7.892 -3.361 -0.702 1.00 0.00 H new ATOM 813 N SER A 54 -9.231 0.997 0.349 1.00 0.00 N ATOM 814 CA SER A 54 -9.553 1.444 1.700 1.00 0.00 C ATOM 815 C SER A 54 -9.820 0.255 2.617 1.00 0.00 C ATOM 816 O SER A 54 -10.236 -0.811 2.165 1.00 0.00 O ATOM 817 CB SER A 54 -10.770 2.369 1.677 1.00 0.00 C ATOM 818 OG SER A 54 -11.965 1.635 1.476 1.00 0.00 O ATOM 0 H SER A 54 -9.981 0.485 -0.116 1.00 0.00 H new ATOM 0 HA SER A 54 -8.695 1.994 2.088 1.00 0.00 H new ATOM 0 HB2 SER A 54 -10.831 2.918 2.616 1.00 0.00 H new ATOM 0 HB3 SER A 54 -10.655 3.107 0.883 1.00 0.00 H new ATOM 0 HG SER A 54 -12.555 2.131 0.871 1.00 0.00 H new ATOM 824 N VAL A 55 -9.579 0.448 3.910 1.00 0.00 N ATOM 825 CA VAL A 55 -9.792 -0.607 4.894 1.00 0.00 C ATOM 826 C VAL A 55 -9.853 -0.032 6.309 1.00 0.00 C ATOM 827 O VAL A 55 -8.853 0.469 6.825 1.00 0.00 O ATOM 828 CB VAL A 55 -8.677 -1.670 4.826 1.00 0.00 C ATOM 829 CG1 VAL A 55 -7.321 -1.046 5.128 1.00 0.00 C ATOM 830 CG2 VAL A 55 -8.969 -2.817 5.783 1.00 0.00 C ATOM 0 H VAL A 55 -9.236 1.326 4.301 1.00 0.00 H new ATOM 0 HA VAL A 55 -10.745 -1.079 4.656 1.00 0.00 H new ATOM 0 HB VAL A 55 -8.648 -2.072 3.813 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -6.548 -1.812 5.075 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.109 -0.265 4.397 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -7.334 -0.613 6.128 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -8.170 -3.556 5.720 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -9.029 -2.434 6.802 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -9.917 -3.283 5.514 1.00 0.00 H new ATOM 840 N PRO A 56 -11.029 -0.095 6.962 1.00 0.00 N ATOM 841 CA PRO A 56 -11.201 0.425 8.323 1.00 0.00 C ATOM 842 C PRO A 56 -10.422 -0.382 9.354 1.00 0.00 C ATOM 843 O PRO A 56 -10.185 -1.576 9.174 1.00 0.00 O ATOM 844 CB PRO A 56 -12.708 0.297 8.569 1.00 0.00 C ATOM 845 CG PRO A 56 -13.153 -0.783 7.647 1.00 0.00 C ATOM 846 CD PRO A 56 -12.277 -0.674 6.431 1.00 0.00 C ATOM 0 HA PRO A 56 -10.827 1.444 8.418 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -12.919 0.042 9.608 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -13.224 1.234 8.359 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -13.052 -1.762 8.115 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -14.204 -0.663 7.383 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -12.105 -1.647 5.971 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -12.724 -0.036 5.669 1.00 0.00 H new ATOM 854 N GLU A 57 -10.025 0.279 10.437 1.00 0.00 N ATOM 855 CA GLU A 57 -9.270 -0.376 11.498 1.00 0.00 C ATOM 856 C GLU A 57 -10.193 -1.182 12.408 1.00 0.00 C ATOM 857 O GLU A 57 -9.804 -2.222 12.938 1.00 0.00 O ATOM 858 CB GLU A 57 -8.505 0.662 12.322 1.00 0.00 C ATOM 859 CG GLU A 57 -7.645 0.056 13.419 1.00 0.00 C ATOM 860 CD GLU A 57 -6.737 1.076 14.076 1.00 0.00 C ATOM 861 OE1 GLU A 57 -6.225 1.963 13.362 1.00 0.00 O ATOM 862 OE2 GLU A 57 -6.536 0.987 15.307 1.00 0.00 O ATOM 0 H GLU A 57 -10.214 1.268 10.602 1.00 0.00 H new ATOM 0 HA GLU A 57 -8.560 -1.060 11.034 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -7.870 1.246 11.656 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -9.218 1.354 12.771 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -8.289 -0.392 14.175 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -7.040 -0.747 12.999 1.00 0.00 H new ATOM 869 N GLU A 58 -11.417 -0.694 12.581 1.00 0.00 N ATOM 870 CA GLU A 58 -12.396 -1.369 13.425 1.00 0.00 C ATOM 871 C GLU A 58 -12.738 -2.747 12.868 1.00 0.00 C ATOM 872 O GLU A 58 -13.040 -3.674 13.619 1.00 0.00 O ATOM 873 CB GLU A 58 -13.666 -0.525 13.544 1.00 0.00 C ATOM 874 CG GLU A 58 -14.671 -1.074 14.544 1.00 0.00 C ATOM 875 CD GLU A 58 -15.781 -0.089 14.856 1.00 0.00 C ATOM 876 OE1 GLU A 58 -15.489 1.120 14.965 1.00 0.00 O ATOM 877 OE2 GLU A 58 -16.943 -0.527 14.989 1.00 0.00 O ATOM 0 H GLU A 58 -11.754 0.166 12.148 1.00 0.00 H new ATOM 0 HA GLU A 58 -11.958 -1.496 14.415 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -13.392 0.489 13.836 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -14.140 -0.457 12.565 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -15.106 -1.993 14.150 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -14.153 -1.337 15.467 1.00 0.00 H new ATOM 884 N ALA A 59 -12.687 -2.874 11.546 1.00 0.00 N ATOM 885 CA ALA A 59 -12.992 -4.139 10.887 1.00 0.00 C ATOM 886 C ALA A 59 -11.839 -5.127 11.036 1.00 0.00 C ATOM 887 O ALA A 59 -12.050 -6.338 11.088 1.00 0.00 O ATOM 888 CB ALA A 59 -13.302 -3.905 9.417 1.00 0.00 C ATOM 0 H ALA A 59 -12.437 -2.117 10.910 1.00 0.00 H new ATOM 0 HA ALA A 59 -13.870 -4.570 11.368 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -13.528 -4.857 8.937 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -14.161 -3.241 9.328 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -12.439 -3.449 8.931 1.00 0.00 H new ATOM 894 N ILE A 60 -10.621 -4.600 11.103 1.00 0.00 N ATOM 895 CA ILE A 60 -9.435 -5.436 11.246 1.00 0.00 C ATOM 896 C ILE A 60 -9.147 -5.734 12.714 1.00 0.00 C ATOM 897 O ILE A 60 -9.204 -4.844 13.561 1.00 0.00 O ATOM 898 CB ILE A 60 -8.198 -4.769 10.616 1.00 0.00 C ATOM 899 CG1 ILE A 60 -8.519 -4.276 9.204 1.00 0.00 C ATOM 900 CG2 ILE A 60 -7.027 -5.741 10.591 1.00 0.00 C ATOM 901 CD1 ILE A 60 -7.426 -3.424 8.599 1.00 0.00 C ATOM 0 H ILE A 60 -10.429 -3.599 11.061 1.00 0.00 H new ATOM 0 HA ILE A 60 -9.641 -6.369 10.722 1.00 0.00 H new ATOM 0 HB ILE A 60 -7.918 -3.909 11.225 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -8.697 -5.137 8.559 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -9.444 -3.701 9.230 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -6.160 -5.255 10.143 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.786 -6.046 11.609 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.295 -6.619 10.003 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -7.722 -3.110 7.598 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -7.263 -2.545 9.222 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -6.504 -4.003 8.540 1.00 0.00 H new ATOM 913 N SER A 61 -8.836 -6.993 13.007 1.00 0.00 N ATOM 914 CA SER A 61 -8.538 -7.409 14.373 1.00 0.00 C ATOM 915 C SER A 61 -7.199 -8.142 14.439 1.00 0.00 C ATOM 916 O SER A 61 -6.761 -8.741 13.457 1.00 0.00 O ATOM 917 CB SER A 61 -9.653 -8.309 14.908 1.00 0.00 C ATOM 918 OG SER A 61 -10.577 -7.568 15.687 1.00 0.00 O ATOM 0 H SER A 61 -8.784 -7.742 12.317 1.00 0.00 H new ATOM 0 HA SER A 61 -8.473 -6.515 14.993 1.00 0.00 H new ATOM 0 HB2 SER A 61 -10.173 -8.783 14.076 1.00 0.00 H new ATOM 0 HB3 SER A 61 -9.222 -9.108 15.512 1.00 0.00 H new ATOM 0 HG SER A 61 -11.281 -8.165 16.016 1.00 0.00 H new ATOM 924 N PRO A 62 -6.531 -8.104 15.604 1.00 0.00 N ATOM 925 CA PRO A 62 -5.237 -8.767 15.794 1.00 0.00 C ATOM 926 C PRO A 62 -5.360 -10.287 15.789 1.00 0.00 C ATOM 927 O PRO A 62 -5.576 -10.906 16.831 1.00 0.00 O ATOM 928 CB PRO A 62 -4.781 -8.273 17.169 1.00 0.00 C ATOM 929 CG PRO A 62 -6.040 -7.918 17.882 1.00 0.00 C ATOM 930 CD PRO A 62 -6.984 -7.413 16.826 1.00 0.00 C ATOM 0 HA PRO A 62 -4.539 -8.534 14.990 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -4.228 -9.045 17.703 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -4.120 -7.411 17.080 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -6.456 -8.785 18.395 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -5.858 -7.156 18.640 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -8.020 -7.655 17.064 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -6.926 -6.330 16.720 1.00 0.00 H new ATOM 938 N GLY A 63 -5.220 -10.883 14.609 1.00 0.00 N ATOM 939 CA GLY A 63 -5.319 -12.326 14.491 1.00 0.00 C ATOM 940 C GLY A 63 -6.611 -12.767 13.832 1.00 0.00 C ATOM 941 O GLY A 63 -7.472 -13.365 14.476 1.00 0.00 O ATOM 0 H GLY A 63 -5.040 -10.393 13.733 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -4.474 -12.699 13.912 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -5.249 -12.774 15.482 1.00 0.00 H new ATOM 945 N VAL A 64 -6.748 -12.470 12.543 1.00 0.00 N ATOM 946 CA VAL A 64 -7.943 -12.839 11.796 1.00 0.00 C ATOM 947 C VAL A 64 -7.588 -13.335 10.399 1.00 0.00 C ATOM 948 O VAL A 64 -6.417 -13.368 10.020 1.00 0.00 O ATOM 949 CB VAL A 64 -8.918 -11.652 11.673 1.00 0.00 C ATOM 950 CG1 VAL A 64 -9.497 -11.292 13.032 1.00 0.00 C ATOM 951 CG2 VAL A 64 -8.223 -10.454 11.046 1.00 0.00 C ATOM 0 H VAL A 64 -6.045 -11.974 11.995 1.00 0.00 H new ATOM 0 HA VAL A 64 -8.427 -13.642 12.352 1.00 0.00 H new ATOM 0 HB VAL A 64 -9.741 -11.947 11.022 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -10.183 -10.452 12.924 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.034 -12.149 13.437 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.689 -11.016 13.710 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -8.927 -9.625 10.967 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -7.380 -10.156 11.669 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -7.864 -10.721 10.052 1.00 0.00 H new ATOM 961 N THR A 65 -8.606 -13.721 9.636 1.00 0.00 N ATOM 962 CA THR A 65 -8.400 -14.216 8.280 1.00 0.00 C ATOM 963 C THR A 65 -8.915 -13.214 7.251 1.00 0.00 C ATOM 964 O THR A 65 -9.526 -12.205 7.605 1.00 0.00 O ATOM 965 CB THR A 65 -9.102 -15.562 8.094 1.00 0.00 C ATOM 966 OG1 THR A 65 -10.466 -15.471 8.458 1.00 0.00 O ATOM 967 CG2 THR A 65 -8.482 -16.676 8.910 1.00 0.00 C ATOM 0 H THR A 65 -9.581 -13.700 9.934 1.00 0.00 H new ATOM 0 HA THR A 65 -7.329 -14.349 8.127 1.00 0.00 H new ATOM 0 HB THR A 65 -8.992 -15.802 7.036 1.00 0.00 H new ATOM 0 HG1 THR A 65 -11.026 -15.608 7.665 1.00 0.00 H new ATOM 0 HG21 THR A 65 -9.027 -17.603 8.733 1.00 0.00 H new ATOM 0 HG22 THR A 65 -7.440 -16.805 8.617 1.00 0.00 H new ATOM 0 HG23 THR A 65 -8.532 -16.423 9.969 1.00 0.00 H new ATOM 975 N ALA A 66 -8.665 -13.498 5.977 1.00 0.00 N ATOM 976 CA ALA A 66 -9.104 -12.622 4.899 1.00 0.00 C ATOM 977 C ALA A 66 -10.626 -12.539 4.842 1.00 0.00 C ATOM 978 O ALA A 66 -11.189 -11.490 4.527 1.00 0.00 O ATOM 979 CB ALA A 66 -8.550 -13.108 3.567 1.00 0.00 C ATOM 0 H ALA A 66 -8.160 -14.328 5.667 1.00 0.00 H new ATOM 0 HA ALA A 66 -8.720 -11.622 5.098 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -8.885 -12.445 2.770 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -7.461 -13.108 3.604 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -8.907 -14.119 3.372 1.00 0.00 H new ATOM 985 N SER A 67 -11.286 -13.651 5.149 1.00 0.00 N ATOM 986 CA SER A 67 -12.743 -13.703 5.134 1.00 0.00 C ATOM 987 C SER A 67 -13.333 -12.704 6.125 1.00 0.00 C ATOM 988 O SER A 67 -14.417 -12.165 5.906 1.00 0.00 O ATOM 989 CB SER A 67 -13.227 -15.116 5.465 1.00 0.00 C ATOM 990 OG SER A 67 -12.286 -15.801 6.274 1.00 0.00 O ATOM 0 H SER A 67 -10.835 -14.528 5.411 1.00 0.00 H new ATOM 0 HA SER A 67 -13.082 -13.436 4.133 1.00 0.00 H new ATOM 0 HB2 SER A 67 -14.185 -15.064 5.981 1.00 0.00 H new ATOM 0 HB3 SER A 67 -13.392 -15.673 4.543 1.00 0.00 H new ATOM 0 HG SER A 67 -12.619 -16.701 6.473 1.00 0.00 H new ATOM 996 N TRP A 68 -12.612 -12.464 7.215 1.00 0.00 N ATOM 997 CA TRP A 68 -13.063 -11.530 8.240 1.00 0.00 C ATOM 998 C TRP A 68 -13.143 -10.112 7.685 1.00 0.00 C ATOM 999 O TRP A 68 -14.199 -9.482 7.717 1.00 0.00 O ATOM 1000 CB TRP A 68 -12.119 -11.568 9.444 1.00 0.00 C ATOM 1001 CG TRP A 68 -12.669 -10.872 10.651 1.00 0.00 C ATOM 1002 CD1 TRP A 68 -13.137 -9.591 10.716 1.00 0.00 C ATOM 1003 CD2 TRP A 68 -12.807 -11.416 11.968 1.00 0.00 C ATOM 1004 NE1 TRP A 68 -13.558 -9.306 11.992 1.00 0.00 N ATOM 1005 CE2 TRP A 68 -13.366 -10.411 12.779 1.00 0.00 C ATOM 1006 CE3 TRP A 68 -12.514 -12.657 12.540 1.00 0.00 C ATOM 1007 CZ2 TRP A 68 -13.636 -10.609 14.131 1.00 0.00 C ATOM 1008 CZ3 TRP A 68 -12.782 -12.853 13.882 1.00 0.00 C ATOM 1009 CH2 TRP A 68 -13.339 -11.833 14.665 1.00 0.00 C ATOM 0 H TRP A 68 -11.713 -12.903 7.411 1.00 0.00 H new ATOM 0 HA TRP A 68 -14.060 -11.832 8.560 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -11.907 -12.607 9.698 1.00 0.00 H new ATOM 0 HB3 TRP A 68 -11.171 -11.107 9.168 1.00 0.00 H new ATOM 0 HD1 TRP A 68 -13.171 -8.902 9.885 1.00 0.00 H new ATOM 0 HE1 TRP A 68 -13.950 -8.417 12.303 1.00 0.00 H new ATOM 0 HE3 TRP A 68 -12.086 -13.449 11.944 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 -14.065 -9.824 14.736 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 -12.558 -13.808 14.334 1.00 0.00 H new ATOM 0 HH2 TRP A 68 -13.538 -12.017 15.711 1.00 0.00 H new ATOM 1020 N ILE A 69 -12.019 -9.617 7.177 1.00 0.00 N ATOM 1021 CA ILE A 69 -11.962 -8.274 6.614 1.00 0.00 C ATOM 1022 C ILE A 69 -12.805 -8.174 5.347 1.00 0.00 C ATOM 1023 O ILE A 69 -13.368 -7.121 5.046 1.00 0.00 O ATOM 1024 CB ILE A 69 -10.514 -7.861 6.287 1.00 0.00 C ATOM 1025 CG1 ILE A 69 -9.597 -8.146 7.479 1.00 0.00 C ATOM 1026 CG2 ILE A 69 -10.456 -6.390 5.904 1.00 0.00 C ATOM 1027 CD1 ILE A 69 -8.763 -9.398 7.314 1.00 0.00 C ATOM 0 H ILE A 69 -11.136 -10.126 7.144 1.00 0.00 H new ATOM 0 HA ILE A 69 -12.362 -7.598 7.369 1.00 0.00 H new ATOM 0 HB ILE A 69 -10.167 -8.450 5.438 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -8.933 -7.294 7.628 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -10.204 -8.239 8.380 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -9.427 -6.114 5.676 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -11.081 -6.217 5.028 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -10.819 -5.783 6.734 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -8.138 -9.537 8.196 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -9.420 -10.260 7.195 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -8.130 -9.300 6.432 1.00 0.00 H new ATOM 1039 N GLU A 70 -12.888 -9.276 4.610 1.00 0.00 N ATOM 1040 CA GLU A 70 -13.662 -9.314 3.376 1.00 0.00 C ATOM 1041 C GLU A 70 -15.141 -9.065 3.654 1.00 0.00 C ATOM 1042 O GLU A 70 -15.822 -8.388 2.884 1.00 0.00 O ATOM 1043 CB GLU A 70 -13.481 -10.664 2.679 1.00 0.00 C ATOM 1044 CG GLU A 70 -14.160 -10.743 1.320 1.00 0.00 C ATOM 1045 CD GLU A 70 -15.139 -11.896 1.221 1.00 0.00 C ATOM 1046 OE1 GLU A 70 -14.699 -13.059 1.341 1.00 0.00 O ATOM 1047 OE2 GLU A 70 -16.345 -11.636 1.026 1.00 0.00 O ATOM 0 H GLU A 70 -12.428 -10.155 4.846 1.00 0.00 H new ATOM 0 HA GLU A 70 -13.297 -8.523 2.721 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.416 -10.860 2.556 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.878 -11.451 3.320 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -14.686 -9.808 1.126 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -13.401 -10.849 0.545 1.00 0.00 H new ATOM 1054 N ALA A 71 -15.632 -9.617 4.758 1.00 0.00 N ATOM 1055 CA ALA A 71 -17.030 -9.454 5.138 1.00 0.00 C ATOM 1056 C ALA A 71 -17.309 -8.031 5.609 1.00 0.00 C ATOM 1057 O ALA A 71 -18.392 -7.492 5.384 1.00 0.00 O ATOM 1058 CB ALA A 71 -17.402 -10.454 6.223 1.00 0.00 C ATOM 0 H ALA A 71 -15.082 -10.181 5.406 1.00 0.00 H new ATOM 0 HA ALA A 71 -17.644 -9.644 4.258 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -18.449 -10.321 6.497 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -17.250 -11.467 5.851 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -16.774 -10.291 7.099 1.00 0.00 H new ATOM 1064 N HIS A 72 -16.324 -7.426 6.266 1.00 0.00 N ATOM 1065 CA HIS A 72 -16.464 -6.066 6.771 1.00 0.00 C ATOM 1066 C HIS A 72 -15.592 -5.098 5.976 1.00 0.00 C ATOM 1067 O HIS A 72 -14.471 -4.785 6.375 1.00 0.00 O ATOM 1068 CB HIS A 72 -16.089 -6.007 8.253 1.00 0.00 C ATOM 1069 CG HIS A 72 -16.833 -6.997 9.095 1.00 0.00 C ATOM 1070 ND1 HIS A 72 -18.120 -6.809 9.546 1.00 0.00 N ATOM 1071 CD2 HIS A 72 -16.445 -8.209 9.569 1.00 0.00 C ATOM 1072 CE1 HIS A 72 -18.466 -7.886 10.264 1.00 0.00 C ATOM 1073 NE2 HIS A 72 -17.484 -8.766 10.308 1.00 0.00 N ATOM 0 H HIS A 72 -15.420 -7.857 6.461 1.00 0.00 H new ATOM 0 HA HIS A 72 -17.506 -5.769 6.655 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -15.019 -6.185 8.357 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -16.283 -5.003 8.629 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -15.482 -8.668 9.399 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -19.424 -8.017 10.744 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -17.486 -9.668 10.785 1.00 0.00 H new ATOM 1081 N LEU A 73 -16.117 -4.626 4.850 1.00 0.00 N ATOM 1082 CA LEU A 73 -15.390 -3.692 3.999 1.00 0.00 C ATOM 1083 C LEU A 73 -16.352 -2.871 3.144 1.00 0.00 C ATOM 1084 O LEU A 73 -17.456 -3.320 2.832 1.00 0.00 O ATOM 1085 CB LEU A 73 -14.406 -4.448 3.102 1.00 0.00 C ATOM 1086 CG LEU A 73 -12.983 -4.558 3.650 1.00 0.00 C ATOM 1087 CD1 LEU A 73 -12.163 -5.529 2.816 1.00 0.00 C ATOM 1088 CD2 LEU A 73 -12.319 -3.188 3.684 1.00 0.00 C ATOM 0 H LEU A 73 -17.044 -4.875 4.506 1.00 0.00 H new ATOM 0 HA LEU A 73 -14.834 -3.010 4.642 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -14.792 -5.453 2.932 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -14.368 -3.952 2.132 1.00 0.00 H new ATOM 0 HG LEU A 73 -13.034 -4.941 4.669 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -11.153 -5.594 3.221 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.629 -6.514 2.842 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.118 -5.176 1.786 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.307 -3.284 4.077 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.279 -2.778 2.675 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -12.895 -2.520 4.325 1.00 0.00 H new ATOM 1100 N PRO A 74 -15.945 -1.652 2.751 1.00 0.00 N ATOM 1101 CA PRO A 74 -16.778 -0.768 1.929 1.00 0.00 C ATOM 1102 C PRO A 74 -17.289 -1.461 0.670 1.00 0.00 C ATOM 1103 O PRO A 74 -16.915 -2.597 0.379 1.00 0.00 O ATOM 1104 CB PRO A 74 -15.830 0.376 1.562 1.00 0.00 C ATOM 1105 CG PRO A 74 -14.815 0.392 2.652 1.00 0.00 C ATOM 1106 CD PRO A 74 -14.643 -1.039 3.079 1.00 0.00 C ATOM 0 HA PRO A 74 -17.673 -0.443 2.459 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -15.365 0.208 0.591 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -16.361 1.326 1.502 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -13.872 0.810 2.301 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -15.147 1.011 3.486 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -13.825 -1.522 2.545 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -14.419 -1.117 4.143 1.00 0.00 H new ATOM 1114 N ASP A 75 -18.147 -0.769 -0.073 1.00 0.00 N ATOM 1115 CA ASP A 75 -18.710 -1.317 -1.301 1.00 0.00 C ATOM 1116 C ASP A 75 -17.760 -1.107 -2.477 1.00 0.00 C ATOM 1117 O ASP A 75 -17.717 -1.913 -3.405 1.00 0.00 O ATOM 1118 CB ASP A 75 -20.064 -0.668 -1.600 1.00 0.00 C ATOM 1119 CG ASP A 75 -21.229 -1.546 -1.184 1.00 0.00 C ATOM 1120 OD1 ASP A 75 -21.115 -2.231 -0.147 1.00 0.00 O ATOM 1121 OD2 ASP A 75 -22.254 -1.547 -1.898 1.00 0.00 O ATOM 0 H ASP A 75 -18.467 0.172 0.154 1.00 0.00 H new ATOM 0 HA ASP A 75 -18.852 -2.388 -1.160 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -20.129 0.288 -1.080 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -20.135 -0.456 -2.667 1.00 0.00 H new ATOM 1126 N ASP A 76 -17.002 -0.016 -2.430 1.00 0.00 N ATOM 1127 CA ASP A 76 -16.053 0.301 -3.491 1.00 0.00 C ATOM 1128 C ASP A 76 -14.726 -0.420 -3.269 1.00 0.00 C ATOM 1129 O ASP A 76 -14.032 -0.771 -4.222 1.00 0.00 O ATOM 1130 CB ASP A 76 -15.821 1.811 -3.562 1.00 0.00 C ATOM 1131 CG ASP A 76 -15.158 2.234 -4.859 1.00 0.00 C ATOM 1132 OD1 ASP A 76 -15.886 2.507 -5.836 1.00 0.00 O ATOM 1133 OD2 ASP A 76 -13.911 2.292 -4.898 1.00 0.00 O ATOM 0 H ASP A 76 -17.027 0.663 -1.669 1.00 0.00 H new ATOM 0 HA ASP A 76 -16.476 -0.039 -4.436 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -16.775 2.328 -3.460 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -15.199 2.120 -2.722 1.00 0.00 H new ATOM 1138 N SER A 77 -14.381 -0.636 -2.004 1.00 0.00 N ATOM 1139 CA SER A 77 -13.139 -1.314 -1.656 1.00 0.00 C ATOM 1140 C SER A 77 -13.261 -2.819 -1.867 1.00 0.00 C ATOM 1141 O SER A 77 -12.285 -3.492 -2.198 1.00 0.00 O ATOM 1142 CB SER A 77 -12.762 -1.021 -0.203 1.00 0.00 C ATOM 1143 OG SER A 77 -11.775 -1.926 0.262 1.00 0.00 O ATOM 0 H SER A 77 -14.945 -0.351 -1.203 1.00 0.00 H new ATOM 0 HA SER A 77 -12.354 -0.936 -2.311 1.00 0.00 H new ATOM 0 HB2 SER A 77 -12.391 0.001 -0.120 1.00 0.00 H new ATOM 0 HB3 SER A 77 -13.649 -1.091 0.427 1.00 0.00 H new ATOM 0 HG SER A 77 -11.231 -1.491 0.951 1.00 0.00 H new ATOM 1149 N LYS A 78 -14.468 -3.343 -1.674 1.00 0.00 N ATOM 1150 CA LYS A 78 -14.718 -4.770 -1.843 1.00 0.00 C ATOM 1151 C LYS A 78 -14.388 -5.218 -3.264 1.00 0.00 C ATOM 1152 O LYS A 78 -14.003 -6.365 -3.490 1.00 0.00 O ATOM 1153 CB LYS A 78 -16.180 -5.092 -1.517 1.00 0.00 C ATOM 1154 CG LYS A 78 -16.343 -6.032 -0.332 1.00 0.00 C ATOM 1155 CD LYS A 78 -17.362 -5.503 0.666 1.00 0.00 C ATOM 1156 CE LYS A 78 -18.277 -6.608 1.170 1.00 0.00 C ATOM 1157 NZ LYS A 78 -18.507 -6.514 2.638 1.00 0.00 N ATOM 0 H LYS A 78 -15.288 -2.801 -1.401 1.00 0.00 H new ATOM 0 HA LYS A 78 -14.070 -5.313 -1.154 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -16.711 -4.163 -1.310 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -16.650 -5.539 -2.393 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -16.656 -7.014 -0.686 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -15.381 -6.163 0.164 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -16.843 -5.046 1.509 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -17.959 -4.721 0.197 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -19.233 -6.553 0.649 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -17.839 -7.578 0.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -19.509 -6.698 2.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -17.918 -7.217 3.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -18.255 -5.561 2.969 1.00 0.00 H new ATOM 1171 N ASP A 79 -14.543 -4.305 -4.219 1.00 0.00 N ATOM 1172 CA ASP A 79 -14.262 -4.607 -5.617 1.00 0.00 C ATOM 1173 C ASP A 79 -12.794 -4.973 -5.813 1.00 0.00 C ATOM 1174 O ASP A 79 -12.474 -6.049 -6.318 1.00 0.00 O ATOM 1175 CB ASP A 79 -14.624 -3.412 -6.501 1.00 0.00 C ATOM 1176 CG ASP A 79 -15.236 -3.835 -7.823 1.00 0.00 C ATOM 1177 OD1 ASP A 79 -15.839 -4.927 -7.875 1.00 0.00 O ATOM 1178 OD2 ASP A 79 -15.111 -3.073 -8.805 1.00 0.00 O ATOM 0 H ASP A 79 -14.861 -3.351 -4.049 1.00 0.00 H new ATOM 0 HA ASP A 79 -14.872 -5.463 -5.906 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -15.325 -2.769 -5.969 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -13.729 -2.820 -6.691 1.00 0.00 H new ATOM 1183 N THR A 80 -11.905 -4.070 -5.413 1.00 0.00 N ATOM 1184 CA THR A 80 -10.471 -4.298 -5.545 1.00 0.00 C ATOM 1185 C THR A 80 -9.990 -5.348 -4.550 1.00 0.00 C ATOM 1186 O THR A 80 -9.041 -6.084 -4.819 1.00 0.00 O ATOM 1187 CB THR A 80 -9.703 -2.993 -5.336 1.00 0.00 C ATOM 1188 OG1 THR A 80 -10.522 -1.875 -5.634 1.00 0.00 O ATOM 1189 CG2 THR A 80 -8.456 -2.888 -6.187 1.00 0.00 C ATOM 0 H THR A 80 -12.153 -3.173 -4.995 1.00 0.00 H new ATOM 0 HA THR A 80 -10.281 -4.666 -6.553 1.00 0.00 H new ATOM 0 HB THR A 80 -9.407 -2.998 -4.287 1.00 0.00 H new ATOM 0 HG1 THR A 80 -9.974 -1.063 -5.648 1.00 0.00 H new ATOM 0 HG21 THR A 80 -7.959 -1.938 -5.989 1.00 0.00 H new ATOM 0 HG22 THR A 80 -7.780 -3.708 -5.945 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.729 -2.942 -7.241 1.00 0.00 H new ATOM 1197 N TRP A 81 -10.651 -5.412 -3.398 1.00 0.00 N ATOM 1198 CA TRP A 81 -10.289 -6.373 -2.361 1.00 0.00 C ATOM 1199 C TRP A 81 -10.345 -7.800 -2.896 1.00 0.00 C ATOM 1200 O TRP A 81 -9.591 -8.668 -2.456 1.00 0.00 O ATOM 1201 CB TRP A 81 -11.223 -6.231 -1.158 1.00 0.00 C ATOM 1202 CG TRP A 81 -10.849 -7.115 -0.008 1.00 0.00 C ATOM 1203 CD1 TRP A 81 -11.332 -8.364 0.257 1.00 0.00 C ATOM 1204 CD2 TRP A 81 -9.914 -6.815 1.036 1.00 0.00 C ATOM 1205 NE1 TRP A 81 -10.753 -8.861 1.400 1.00 0.00 N ATOM 1206 CE2 TRP A 81 -9.880 -7.929 1.897 1.00 0.00 C ATOM 1207 CE3 TRP A 81 -9.102 -5.715 1.325 1.00 0.00 C ATOM 1208 CZ2 TRP A 81 -9.066 -7.974 3.025 1.00 0.00 C ATOM 1209 CZ3 TRP A 81 -8.295 -5.760 2.446 1.00 0.00 C ATOM 1210 CH2 TRP A 81 -8.281 -6.882 3.284 1.00 0.00 C ATOM 0 H TRP A 81 -11.439 -4.810 -3.159 1.00 0.00 H new ATOM 0 HA TRP A 81 -9.267 -6.162 -2.047 1.00 0.00 H new ATOM 0 HB2 TRP A 81 -11.220 -5.193 -0.825 1.00 0.00 H new ATOM 0 HB3 TRP A 81 -12.242 -6.463 -1.469 1.00 0.00 H new ATOM 0 HD1 TRP A 81 -12.062 -8.885 -0.344 1.00 0.00 H new ATOM 0 HE1 TRP A 81 -10.942 -9.775 1.811 1.00 0.00 H new ATOM 0 HE3 TRP A 81 -9.105 -4.846 0.684 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 -9.054 -8.838 3.672 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 -7.664 -4.915 2.680 1.00 0.00 H new ATOM 0 HH2 TRP A 81 -7.638 -6.886 4.152 1.00 0.00 H new ATOM 1221 N LYS A 82 -11.240 -8.035 -3.849 1.00 0.00 N ATOM 1222 CA LYS A 82 -11.394 -9.356 -4.446 1.00 0.00 C ATOM 1223 C LYS A 82 -10.396 -9.568 -5.583 1.00 0.00 C ATOM 1224 O LYS A 82 -10.111 -10.702 -5.966 1.00 0.00 O ATOM 1225 CB LYS A 82 -12.821 -9.538 -4.967 1.00 0.00 C ATOM 1226 CG LYS A 82 -13.865 -9.607 -3.865 1.00 0.00 C ATOM 1227 CD LYS A 82 -15.267 -9.766 -4.433 1.00 0.00 C ATOM 1228 CE LYS A 82 -16.089 -10.757 -3.624 1.00 0.00 C ATOM 1229 NZ LYS A 82 -16.996 -10.072 -2.663 1.00 0.00 N ATOM 0 H LYS A 82 -11.871 -7.327 -4.225 1.00 0.00 H new ATOM 0 HA LYS A 82 -11.195 -10.098 -3.673 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -13.064 -8.711 -5.635 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -12.869 -10.451 -5.560 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -13.642 -10.444 -3.204 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -13.817 -8.702 -3.260 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -15.768 -8.798 -4.442 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -15.205 -10.103 -5.468 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -16.678 -11.377 -4.300 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -15.421 -11.424 -3.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -17.539 -10.782 -2.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -16.433 -9.500 -2.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -17.651 -9.455 -3.184 1.00 0.00 H new ATOM 1243 N LYS A 83 -9.868 -8.471 -6.120 1.00 0.00 N ATOM 1244 CA LYS A 83 -8.903 -8.544 -7.212 1.00 0.00 C ATOM 1245 C LYS A 83 -7.471 -8.664 -6.689 1.00 0.00 C ATOM 1246 O LYS A 83 -6.514 -8.554 -7.453 1.00 0.00 O ATOM 1247 CB LYS A 83 -9.025 -7.309 -8.108 1.00 0.00 C ATOM 1248 CG LYS A 83 -10.416 -7.114 -8.690 1.00 0.00 C ATOM 1249 CD LYS A 83 -10.356 -6.618 -10.126 1.00 0.00 C ATOM 1250 CE LYS A 83 -10.354 -5.099 -10.191 1.00 0.00 C ATOM 1251 NZ LYS A 83 -9.467 -4.591 -11.274 1.00 0.00 N ATOM 0 H LYS A 83 -10.092 -7.523 -5.817 1.00 0.00 H new ATOM 0 HA LYS A 83 -9.128 -9.439 -7.793 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -8.754 -6.424 -7.532 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -8.307 -7.390 -8.924 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -10.962 -8.056 -8.652 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.970 -6.400 -8.080 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -9.459 -7.005 -10.609 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -11.209 -7.006 -10.682 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -11.370 -4.741 -10.356 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -10.026 -4.695 -9.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -9.493 -3.551 -11.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -8.492 -4.911 -11.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -9.795 -4.956 -12.191 1.00 0.00 H new ATOM 1265 N ARG A 84 -7.329 -8.892 -5.385 1.00 0.00 N ATOM 1266 CA ARG A 84 -6.011 -9.026 -4.776 1.00 0.00 C ATOM 1267 C ARG A 84 -5.254 -10.211 -5.369 1.00 0.00 C ATOM 1268 O ARG A 84 -4.027 -10.199 -5.449 1.00 0.00 O ATOM 1269 CB ARG A 84 -6.140 -9.196 -3.260 1.00 0.00 C ATOM 1270 CG ARG A 84 -7.059 -10.338 -2.853 1.00 0.00 C ATOM 1271 CD ARG A 84 -6.275 -11.531 -2.327 1.00 0.00 C ATOM 1272 NE ARG A 84 -6.783 -11.994 -1.038 1.00 0.00 N ATOM 1273 CZ ARG A 84 -7.995 -12.516 -0.863 1.00 0.00 C ATOM 1274 NH1 ARG A 84 -8.825 -12.646 -1.891 1.00 0.00 N ATOM 1275 NH2 ARG A 84 -8.379 -12.912 0.344 1.00 0.00 N ATOM 0 H ARG A 84 -8.108 -8.987 -4.733 1.00 0.00 H new ATOM 0 HA ARG A 84 -5.448 -8.116 -4.986 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -5.151 -9.368 -2.836 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -6.515 -8.268 -2.829 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -7.752 -9.992 -2.087 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -7.659 -10.646 -3.710 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -6.325 -12.345 -3.050 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -5.224 -11.259 -2.226 1.00 0.00 H new ATOM 0 HE ARG A 84 -6.173 -11.913 -0.224 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -8.535 -12.345 -2.822 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -9.752 -13.047 -1.750 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -7.745 -12.816 1.138 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -9.308 -13.312 0.478 1.00 0.00 H new ATOM 1289 N GLY A 85 -5.997 -11.232 -5.785 1.00 0.00 N ATOM 1290 CA GLY A 85 -5.380 -12.409 -6.367 1.00 0.00 C ATOM 1291 C GLY A 85 -4.972 -12.199 -7.813 1.00 0.00 C ATOM 1292 O GLY A 85 -4.086 -12.887 -8.319 1.00 0.00 O ATOM 0 H GLY A 85 -7.015 -11.265 -5.729 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -4.502 -12.682 -5.781 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -6.075 -13.246 -6.307 1.00 0.00 H new ATOM 1296 N ASN A 86 -5.618 -11.246 -8.478 1.00 0.00 N ATOM 1297 CA ASN A 86 -5.315 -10.949 -9.873 1.00 0.00 C ATOM 1298 C ASN A 86 -4.040 -10.121 -9.987 1.00 0.00 C ATOM 1299 O ASN A 86 -3.300 -10.234 -10.965 1.00 0.00 O ATOM 1300 CB ASN A 86 -6.481 -10.201 -10.521 1.00 0.00 C ATOM 1301 CG ASN A 86 -6.579 -10.462 -12.012 1.00 0.00 C ATOM 1302 OD1 ASN A 86 -5.696 -11.083 -12.605 1.00 0.00 O ATOM 1303 ND2 ASN A 86 -7.656 -9.989 -12.626 1.00 0.00 N ATOM 0 H ASN A 86 -6.354 -10.667 -8.073 1.00 0.00 H new ATOM 0 HA ASN A 86 -5.162 -11.893 -10.395 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -7.413 -10.500 -10.041 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -6.363 -9.131 -10.349 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -7.777 -10.135 -13.628 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -8.363 -9.480 -12.096 1.00 0.00 H new ATOM 1310 N VAL A 87 -3.789 -9.291 -8.981 1.00 0.00 N ATOM 1311 CA VAL A 87 -2.604 -8.443 -8.966 1.00 0.00 C ATOM 1312 C VAL A 87 -1.361 -9.243 -8.591 1.00 0.00 C ATOM 1313 O VAL A 87 -1.433 -10.452 -8.367 1.00 0.00 O ATOM 1314 CB VAL A 87 -2.765 -7.272 -7.979 1.00 0.00 C ATOM 1315 CG1 VAL A 87 -3.843 -6.313 -8.460 1.00 0.00 C ATOM 1316 CG2 VAL A 87 -3.085 -7.789 -6.585 1.00 0.00 C ATOM 0 H VAL A 87 -4.391 -9.188 -8.164 1.00 0.00 H new ATOM 0 HA VAL A 87 -2.486 -8.045 -9.974 1.00 0.00 H new ATOM 0 HB VAL A 87 -1.822 -6.728 -7.932 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -3.943 -5.492 -7.750 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.567 -5.916 -9.437 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -4.793 -6.842 -8.538 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -3.195 -6.947 -5.901 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -4.014 -8.358 -6.612 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.275 -8.432 -6.241 1.00 0.00 H new ATOM 1326 N GLU A 88 -0.220 -8.563 -8.525 1.00 0.00 N ATOM 1327 CA GLU A 88 1.039 -9.213 -8.179 1.00 0.00 C ATOM 1328 C GLU A 88 1.531 -8.756 -6.809 1.00 0.00 C ATOM 1329 O GLU A 88 1.471 -9.506 -5.835 1.00 0.00 O ATOM 1330 CB GLU A 88 2.098 -8.919 -9.244 1.00 0.00 C ATOM 1331 CG GLU A 88 2.796 -10.164 -9.767 1.00 0.00 C ATOM 1332 CD GLU A 88 2.950 -10.157 -11.275 1.00 0.00 C ATOM 1333 OE1 GLU A 88 1.945 -10.398 -11.976 1.00 0.00 O ATOM 1334 OE2 GLU A 88 4.077 -9.910 -11.755 1.00 0.00 O ATOM 0 H GLU A 88 -0.142 -7.562 -8.707 1.00 0.00 H new ATOM 0 HA GLU A 88 0.865 -10.288 -8.139 1.00 0.00 H new ATOM 0 HB2 GLU A 88 1.628 -8.399 -10.078 1.00 0.00 H new ATOM 0 HB3 GLU A 88 2.844 -8.243 -8.826 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.780 -10.245 -9.306 1.00 0.00 H new ATOM 0 HG3 GLU A 88 2.230 -11.046 -9.468 1.00 0.00 H new ATOM 1341 N TYR A 89 2.021 -7.522 -6.743 1.00 0.00 N ATOM 1342 CA TYR A 89 2.526 -6.968 -5.491 1.00 0.00 C ATOM 1343 C TYR A 89 1.403 -6.328 -4.682 1.00 0.00 C ATOM 1344 O TYR A 89 0.280 -6.185 -5.165 1.00 0.00 O ATOM 1345 CB TYR A 89 3.618 -5.933 -5.773 1.00 0.00 C ATOM 1346 CG TYR A 89 4.980 -6.540 -6.020 1.00 0.00 C ATOM 1347 CD1 TYR A 89 5.221 -7.322 -7.141 1.00 0.00 C ATOM 1348 CD2 TYR A 89 6.026 -6.328 -5.130 1.00 0.00 C ATOM 1349 CE1 TYR A 89 6.466 -7.878 -7.370 1.00 0.00 C ATOM 1350 CE2 TYR A 89 7.274 -6.880 -5.352 1.00 0.00 C ATOM 1351 CZ TYR A 89 7.489 -7.653 -6.473 1.00 0.00 C ATOM 1352 OH TYR A 89 8.729 -8.204 -6.696 1.00 0.00 O ATOM 0 H TYR A 89 2.079 -6.888 -7.540 1.00 0.00 H new ATOM 0 HA TYR A 89 2.948 -7.786 -4.907 1.00 0.00 H new ATOM 0 HB2 TYR A 89 3.330 -5.342 -6.642 1.00 0.00 H new ATOM 0 HB3 TYR A 89 3.683 -5.247 -4.928 1.00 0.00 H new ATOM 0 HD1 TYR A 89 4.423 -7.499 -7.846 1.00 0.00 H new ATOM 0 HD2 TYR A 89 5.861 -5.722 -4.251 1.00 0.00 H new ATOM 0 HE1 TYR A 89 6.636 -8.485 -8.247 1.00 0.00 H new ATOM 0 HE2 TYR A 89 8.077 -6.706 -4.651 1.00 0.00 H new ATOM 0 HH TYR A 89 9.336 -7.948 -5.971 1.00 0.00 H new ATOM 1362 N VAL A 90 1.716 -5.945 -3.449 1.00 0.00 N ATOM 1363 CA VAL A 90 0.734 -5.319 -2.570 1.00 0.00 C ATOM 1364 C VAL A 90 1.412 -4.398 -1.561 1.00 0.00 C ATOM 1365 O VAL A 90 2.412 -4.765 -0.945 1.00 0.00 O ATOM 1366 CB VAL A 90 -0.094 -6.372 -1.812 1.00 0.00 C ATOM 1367 CG1 VAL A 90 -1.233 -5.709 -1.051 1.00 0.00 C ATOM 1368 CG2 VAL A 90 -0.628 -7.425 -2.771 1.00 0.00 C ATOM 0 H VAL A 90 2.642 -6.057 -3.035 1.00 0.00 H new ATOM 0 HA VAL A 90 0.068 -4.734 -3.204 1.00 0.00 H new ATOM 0 HB VAL A 90 0.556 -6.867 -1.091 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -1.807 -6.469 -0.521 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -0.825 -4.997 -0.334 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -1.883 -5.186 -1.752 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -1.211 -8.160 -2.216 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -1.262 -6.948 -3.518 1.00 0.00 H new ATOM 0 HG23 VAL A 90 0.206 -7.922 -3.267 1.00 0.00 H new ATOM 1378 N VAL A 91 0.863 -3.199 -1.398 1.00 0.00 N ATOM 1379 CA VAL A 91 1.416 -2.224 -0.465 1.00 0.00 C ATOM 1380 C VAL A 91 0.339 -1.681 0.469 1.00 0.00 C ATOM 1381 O VAL A 91 -0.852 -1.748 0.164 1.00 0.00 O ATOM 1382 CB VAL A 91 2.076 -1.047 -1.208 1.00 0.00 C ATOM 1383 CG1 VAL A 91 2.813 -0.143 -0.231 1.00 0.00 C ATOM 1384 CG2 VAL A 91 3.017 -1.557 -2.292 1.00 0.00 C ATOM 0 H VAL A 91 0.035 -2.879 -1.900 1.00 0.00 H new ATOM 0 HA VAL A 91 2.173 -2.744 0.122 1.00 0.00 H new ATOM 0 HB VAL A 91 1.293 -0.460 -1.688 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.273 0.682 -0.775 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.109 0.252 0.501 1.00 0.00 H new ATOM 0 HG13 VAL A 91 3.586 -0.715 0.281 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.473 -0.711 -2.805 1.00 0.00 H new ATOM 0 HG22 VAL A 91 3.796 -2.170 -1.839 1.00 0.00 H new ATOM 0 HG23 VAL A 91 2.456 -2.156 -3.009 1.00 0.00 H new ATOM 1394 N LEU A 92 0.766 -1.141 1.606 1.00 0.00 N ATOM 1395 CA LEU A 92 -0.161 -0.585 2.585 1.00 0.00 C ATOM 1396 C LEU A 92 0.201 0.859 2.916 1.00 0.00 C ATOM 1397 O LEU A 92 1.166 1.406 2.383 1.00 0.00 O ATOM 1398 CB LEU A 92 -0.157 -1.430 3.860 1.00 0.00 C ATOM 1399 CG LEU A 92 -0.307 -2.936 3.640 1.00 0.00 C ATOM 1400 CD1 LEU A 92 0.250 -3.706 4.827 1.00 0.00 C ATOM 1401 CD2 LEU A 92 -1.766 -3.295 3.404 1.00 0.00 C ATOM 0 H LEU A 92 1.749 -1.077 1.872 1.00 0.00 H new ATOM 0 HA LEU A 92 -1.161 -0.600 2.152 1.00 0.00 H new ATOM 0 HB2 LEU A 92 0.775 -1.248 4.395 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -0.967 -1.090 4.505 1.00 0.00 H new ATOM 0 HG LEU A 92 0.263 -3.215 2.754 1.00 0.00 H new ATOM 0 HD11 LEU A 92 0.135 -4.776 4.653 1.00 0.00 H new ATOM 0 HD12 LEU A 92 1.307 -3.470 4.950 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.292 -3.425 5.730 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -1.856 -4.370 3.249 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -2.358 -3.003 4.272 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -2.132 -2.770 2.522 1.00 0.00 H new ATOM 1413 N LEU A 93 -0.581 1.472 3.801 1.00 0.00 N ATOM 1414 CA LEU A 93 -0.342 2.853 4.204 1.00 0.00 C ATOM 1415 C LEU A 93 -0.404 2.998 5.721 1.00 0.00 C ATOM 1416 O LEU A 93 -0.631 2.023 6.438 1.00 0.00 O ATOM 1417 CB LEU A 93 -1.368 3.782 3.549 1.00 0.00 C ATOM 1418 CG LEU A 93 -1.206 3.962 2.038 1.00 0.00 C ATOM 1419 CD1 LEU A 93 -2.376 4.747 1.467 1.00 0.00 C ATOM 1420 CD2 LEU A 93 0.109 4.658 1.724 1.00 0.00 C ATOM 0 H LEU A 93 -1.384 1.034 4.252 1.00 0.00 H new ATOM 0 HA LEU A 93 0.658 3.133 3.872 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.367 3.394 3.748 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -1.306 4.761 4.025 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.194 2.977 1.572 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.244 4.866 0.392 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -3.304 4.210 1.662 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -2.419 5.729 1.938 1.00 0.00 H new ATOM 0 HD21 LEU A 93 0.209 4.778 0.645 1.00 0.00 H new ATOM 0 HD22 LEU A 93 0.125 5.638 2.201 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.937 4.058 2.100 1.00 0.00 H new ATOM 1432 N ASP A 94 -0.201 4.219 6.203 1.00 0.00 N ATOM 1433 CA ASP A 94 -0.233 4.492 7.635 1.00 0.00 C ATOM 1434 C ASP A 94 -0.048 5.982 7.908 1.00 0.00 C ATOM 1435 O ASP A 94 0.102 6.779 6.983 1.00 0.00 O ATOM 1436 CB ASP A 94 0.855 3.691 8.354 1.00 0.00 C ATOM 1437 CG ASP A 94 2.236 3.954 7.788 1.00 0.00 C ATOM 1438 OD1 ASP A 94 2.867 4.949 8.201 1.00 0.00 O ATOM 1439 OD2 ASP A 94 2.687 3.164 6.931 1.00 0.00 O ATOM 0 H ASP A 94 -0.012 5.036 5.622 1.00 0.00 H new ATOM 0 HA ASP A 94 -1.208 4.189 8.016 1.00 0.00 H new ATOM 0 HB2 ASP A 94 0.846 3.942 9.415 1.00 0.00 H new ATOM 0 HB3 ASP A 94 0.630 2.627 8.277 1.00 0.00 H new ATOM 1444 N TRP A 95 -0.059 6.351 9.185 1.00 0.00 N ATOM 1445 CA TRP A 95 0.107 7.746 9.579 1.00 0.00 C ATOM 1446 C TRP A 95 1.520 8.001 10.094 1.00 0.00 C ATOM 1447 O TRP A 95 2.177 8.959 9.685 1.00 0.00 O ATOM 1448 CB TRP A 95 -0.915 8.120 10.653 1.00 0.00 C ATOM 1449 CG TRP A 95 -2.159 8.745 10.098 1.00 0.00 C ATOM 1450 CD1 TRP A 95 -3.446 8.356 10.333 1.00 0.00 C ATOM 1451 CD2 TRP A 95 -2.233 9.872 9.217 1.00 0.00 C ATOM 1452 NE1 TRP A 95 -4.317 9.170 9.650 1.00 0.00 N ATOM 1453 CE2 TRP A 95 -3.597 10.110 8.959 1.00 0.00 C ATOM 1454 CE3 TRP A 95 -1.280 10.702 8.622 1.00 0.00 C ATOM 1455 CZ2 TRP A 95 -4.029 11.142 8.131 1.00 0.00 C ATOM 1456 CZ3 TRP A 95 -1.711 11.729 7.801 1.00 0.00 C ATOM 1457 CH2 TRP A 95 -3.074 11.940 7.563 1.00 0.00 C ATOM 0 H TRP A 95 -0.181 5.704 9.964 1.00 0.00 H new ATOM 0 HA TRP A 95 -0.058 8.368 8.699 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -1.186 7.225 11.214 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -0.454 8.811 11.358 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -3.737 7.529 10.964 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -5.334 9.088 9.656 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -0.226 10.545 8.799 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -5.080 11.307 7.944 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -0.984 12.378 7.336 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -3.378 12.750 6.917 1.00 0.00 H new ATOM 1468 N PHE A 96 1.982 7.139 10.994 1.00 0.00 N ATOM 1469 CA PHE A 96 3.317 7.272 11.565 1.00 0.00 C ATOM 1470 C PHE A 96 3.867 5.913 11.988 1.00 0.00 C ATOM 1471 O PHE A 96 3.968 5.614 13.178 1.00 0.00 O ATOM 1472 CB PHE A 96 3.288 8.220 12.766 1.00 0.00 C ATOM 1473 CG PHE A 96 2.904 9.629 12.412 1.00 0.00 C ATOM 1474 CD1 PHE A 96 3.719 10.399 11.598 1.00 0.00 C ATOM 1475 CD2 PHE A 96 1.728 10.181 12.892 1.00 0.00 C ATOM 1476 CE1 PHE A 96 3.368 11.695 11.272 1.00 0.00 C ATOM 1477 CE2 PHE A 96 1.371 11.476 12.569 1.00 0.00 C ATOM 1478 CZ PHE A 96 2.193 12.234 11.756 1.00 0.00 C ATOM 0 H PHE A 96 1.451 6.341 11.343 1.00 0.00 H new ATOM 0 HA PHE A 96 3.973 7.686 10.799 1.00 0.00 H new ATOM 0 HB2 PHE A 96 2.585 7.835 13.505 1.00 0.00 H new ATOM 0 HB3 PHE A 96 4.271 8.228 13.236 1.00 0.00 H new ATOM 0 HD1 PHE A 96 4.638 9.982 11.214 1.00 0.00 H new ATOM 0 HD2 PHE A 96 1.082 9.592 13.526 1.00 0.00 H new ATOM 0 HE1 PHE A 96 4.013 12.286 10.639 1.00 0.00 H new ATOM 0 HE2 PHE A 96 0.452 11.895 12.951 1.00 0.00 H new ATOM 0 HZ PHE A 96 1.916 13.246 11.500 1.00 0.00 H new ATOM 1488 N SER A 97 4.221 5.092 11.005 1.00 0.00 N ATOM 1489 CA SER A 97 4.761 3.765 11.275 1.00 0.00 C ATOM 1490 C SER A 97 5.276 3.116 9.995 1.00 0.00 C ATOM 1491 O SER A 97 5.013 3.598 8.893 1.00 0.00 O ATOM 1492 CB SER A 97 3.693 2.878 11.917 1.00 0.00 C ATOM 1493 OG SER A 97 4.097 1.519 11.926 1.00 0.00 O ATOM 0 H SER A 97 4.144 5.322 10.014 1.00 0.00 H new ATOM 0 HA SER A 97 5.596 3.874 11.967 1.00 0.00 H new ATOM 0 HB2 SER A 97 3.504 3.211 12.937 1.00 0.00 H new ATOM 0 HB3 SER A 97 2.755 2.978 11.370 1.00 0.00 H new ATOM 0 HG SER A 97 3.398 0.973 12.343 1.00 0.00 H new ATOM 1499 N SER A 98 6.010 2.019 10.147 1.00 0.00 N ATOM 1500 CA SER A 98 6.562 1.303 9.003 1.00 0.00 C ATOM 1501 C SER A 98 6.605 -0.198 9.268 1.00 0.00 C ATOM 1502 O SER A 98 6.206 -0.661 10.336 1.00 0.00 O ATOM 1503 CB SER A 98 7.968 1.817 8.684 1.00 0.00 C ATOM 1504 OG SER A 98 7.946 3.196 8.358 1.00 0.00 O ATOM 0 H SER A 98 6.237 1.606 11.052 1.00 0.00 H new ATOM 0 HA SER A 98 5.913 1.483 8.146 1.00 0.00 H new ATOM 0 HB2 SER A 98 8.621 1.653 9.541 1.00 0.00 H new ATOM 0 HB3 SER A 98 8.386 1.250 7.852 1.00 0.00 H new ATOM 0 HG SER A 98 8.856 3.500 8.160 1.00 0.00 H new ATOM 1510 N ALA A 99 7.092 -0.953 8.288 1.00 0.00 N ATOM 1511 CA ALA A 99 7.187 -2.402 8.414 1.00 0.00 C ATOM 1512 C ALA A 99 8.049 -2.797 9.610 1.00 0.00 C ATOM 1513 O ALA A 99 7.880 -3.874 10.181 1.00 0.00 O ATOM 1514 CB ALA A 99 7.747 -3.006 7.136 1.00 0.00 C ATOM 0 H ALA A 99 7.427 -0.584 7.398 1.00 0.00 H new ATOM 0 HA ALA A 99 6.183 -2.793 8.580 1.00 0.00 H new ATOM 0 HB1 ALA A 99 7.813 -4.089 7.244 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.090 -2.764 6.301 1.00 0.00 H new ATOM 0 HB3 ALA A 99 8.740 -2.599 6.946 1.00 0.00 H new ATOM 1520 N LYS A 100 8.973 -1.917 9.985 1.00 0.00 N ATOM 1521 CA LYS A 100 9.862 -2.174 11.112 1.00 0.00 C ATOM 1522 C LYS A 100 9.206 -1.767 12.429 1.00 0.00 C ATOM 1523 O LYS A 100 9.567 -2.270 13.493 1.00 0.00 O ATOM 1524 CB LYS A 100 11.180 -1.419 10.932 1.00 0.00 C ATOM 1525 CG LYS A 100 11.976 -1.868 9.717 1.00 0.00 C ATOM 1526 CD LYS A 100 13.043 -0.850 9.345 1.00 0.00 C ATOM 1527 CE LYS A 100 13.166 -0.697 7.837 1.00 0.00 C ATOM 1528 NZ LYS A 100 14.398 -1.348 7.310 1.00 0.00 N ATOM 0 H LYS A 100 9.125 -1.020 9.524 1.00 0.00 H new ATOM 0 HA LYS A 100 10.065 -3.244 11.144 1.00 0.00 H new ATOM 0 HB2 LYS A 100 10.970 -0.353 10.845 1.00 0.00 H new ATOM 0 HB3 LYS A 100 11.790 -1.552 11.825 1.00 0.00 H new ATOM 0 HG2 LYS A 100 12.445 -2.830 9.923 1.00 0.00 H new ATOM 0 HG3 LYS A 100 11.302 -2.016 8.873 1.00 0.00 H new ATOM 0 HD2 LYS A 100 12.799 0.114 9.791 1.00 0.00 H new ATOM 0 HD3 LYS A 100 14.002 -1.159 9.760 1.00 0.00 H new ATOM 0 HE2 LYS A 100 12.291 -1.133 7.356 1.00 0.00 H new ATOM 0 HE3 LYS A 100 13.177 0.362 7.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 14.444 -1.221 6.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 15.235 -0.915 7.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 14.376 -2.364 7.533 1.00 0.00 H new ATOM 1542 N ASP A 101 8.243 -0.853 12.352 1.00 0.00 N ATOM 1543 CA ASP A 101 7.540 -0.382 13.540 1.00 0.00 C ATOM 1544 C ASP A 101 6.264 -1.185 13.785 1.00 0.00 C ATOM 1545 O ASP A 101 5.373 -0.741 14.509 1.00 0.00 O ATOM 1546 CB ASP A 101 7.201 1.104 13.398 1.00 0.00 C ATOM 1547 CG ASP A 101 7.356 1.859 14.704 1.00 0.00 C ATOM 1548 OD1 ASP A 101 8.396 1.682 15.373 1.00 0.00 O ATOM 1549 OD2 ASP A 101 6.437 2.628 15.057 1.00 0.00 O ATOM 0 H ASP A 101 7.932 -0.424 11.480 1.00 0.00 H new ATOM 0 HA ASP A 101 8.199 -0.522 14.397 1.00 0.00 H new ATOM 0 HB2 ASP A 101 7.848 1.551 12.644 1.00 0.00 H new ATOM 0 HB3 ASP A 101 6.176 1.208 13.041 1.00 0.00 H new ATOM 1554 N LEU A 102 6.180 -2.368 13.182 1.00 0.00 N ATOM 1555 CA LEU A 102 5.010 -3.223 13.342 1.00 0.00 C ATOM 1556 C LEU A 102 5.108 -4.042 14.626 1.00 0.00 C ATOM 1557 O LEU A 102 5.761 -5.086 14.659 1.00 0.00 O ATOM 1558 CB LEU A 102 4.866 -4.157 12.139 1.00 0.00 C ATOM 1559 CG LEU A 102 4.777 -3.456 10.782 1.00 0.00 C ATOM 1560 CD1 LEU A 102 4.718 -4.480 9.658 1.00 0.00 C ATOM 1561 CD2 LEU A 102 3.567 -2.537 10.736 1.00 0.00 C ATOM 0 H LEU A 102 6.907 -2.755 12.580 1.00 0.00 H new ATOM 0 HA LEU A 102 4.129 -2.584 13.404 1.00 0.00 H new ATOM 0 HB2 LEU A 102 5.716 -4.839 12.124 1.00 0.00 H new ATOM 0 HB3 LEU A 102 3.972 -4.766 12.276 1.00 0.00 H new ATOM 0 HG LEU A 102 5.672 -2.849 10.646 1.00 0.00 H new ATOM 0 HD11 LEU A 102 4.655 -3.965 8.699 1.00 0.00 H new ATOM 0 HD12 LEU A 102 5.616 -5.097 9.680 1.00 0.00 H new ATOM 0 HD13 LEU A 102 3.840 -5.113 9.788 1.00 0.00 H new ATOM 0 HD21 LEU A 102 3.519 -2.047 9.764 1.00 0.00 H new ATOM 0 HD22 LEU A 102 2.660 -3.121 10.893 1.00 0.00 H new ATOM 0 HD23 LEU A 102 3.653 -1.783 11.519 1.00 0.00 H new ATOM 1573 N GLN A 103 4.458 -3.561 15.681 1.00 0.00 N ATOM 1574 CA GLN A 103 4.474 -4.248 16.967 1.00 0.00 C ATOM 1575 C GLN A 103 3.409 -5.341 17.014 1.00 0.00 C ATOM 1576 O GLN A 103 2.593 -5.466 16.101 1.00 0.00 O ATOM 1577 CB GLN A 103 4.246 -3.251 18.104 1.00 0.00 C ATOM 1578 CG GLN A 103 5.333 -2.194 18.213 1.00 0.00 C ATOM 1579 CD GLN A 103 4.817 -0.883 18.774 1.00 0.00 C ATOM 1580 OE1 GLN A 103 4.339 -0.825 19.907 1.00 0.00 O ATOM 1581 NE2 GLN A 103 4.910 0.178 17.982 1.00 0.00 N ATOM 0 H GLN A 103 3.914 -2.698 15.670 1.00 0.00 H new ATOM 0 HA GLN A 103 5.452 -4.713 17.090 1.00 0.00 H new ATOM 0 HB2 GLN A 103 3.285 -2.758 17.957 1.00 0.00 H new ATOM 0 HB3 GLN A 103 4.184 -3.795 19.046 1.00 0.00 H new ATOM 0 HG2 GLN A 103 6.135 -2.567 18.850 1.00 0.00 H new ATOM 0 HG3 GLN A 103 5.764 -2.019 17.227 1.00 0.00 H new ATOM 0 HE21 GLN A 103 5.313 0.085 17.050 1.00 0.00 H new ATOM 0 HE22 GLN A 103 4.578 1.087 18.306 1.00 0.00 H new ATOM 1590 N ILE A 104 3.426 -6.130 18.084 1.00 0.00 N ATOM 1591 CA ILE A 104 2.463 -7.212 18.251 1.00 0.00 C ATOM 1592 C ILE A 104 1.092 -6.670 18.641 1.00 0.00 C ATOM 1593 O ILE A 104 0.744 -6.628 19.822 1.00 0.00 O ATOM 1594 CB ILE A 104 2.929 -8.219 19.319 1.00 0.00 C ATOM 1595 CG1 ILE A 104 4.373 -8.647 19.055 1.00 0.00 C ATOM 1596 CG2 ILE A 104 2.008 -9.429 19.344 1.00 0.00 C ATOM 1597 CD1 ILE A 104 5.057 -9.244 20.265 1.00 0.00 C ATOM 0 H ILE A 104 4.096 -6.040 18.848 1.00 0.00 H new ATOM 0 HA ILE A 104 2.389 -7.722 17.291 1.00 0.00 H new ATOM 0 HB ILE A 104 2.887 -7.735 20.295 1.00 0.00 H new ATOM 0 HG12 ILE A 104 4.385 -9.376 18.244 1.00 0.00 H new ATOM 0 HG13 ILE A 104 4.943 -7.783 18.715 1.00 0.00 H new ATOM 0 HG21 ILE A 104 2.351 -10.131 20.104 1.00 0.00 H new ATOM 0 HG22 ILE A 104 0.993 -9.109 19.577 1.00 0.00 H new ATOM 0 HG23 ILE A 104 2.020 -9.915 18.369 1.00 0.00 H new ATOM 0 HD11 ILE A 104 6.078 -9.525 20.005 1.00 0.00 H new ATOM 0 HD12 ILE A 104 5.077 -8.510 21.071 1.00 0.00 H new ATOM 0 HD13 ILE A 104 4.510 -10.128 20.593 1.00 0.00 H new ATOM 1609 N GLY A 105 0.317 -6.257 17.643 1.00 0.00 N ATOM 1610 CA GLY A 105 -1.007 -5.725 17.904 1.00 0.00 C ATOM 1611 C GLY A 105 -1.286 -4.458 17.119 1.00 0.00 C ATOM 1612 O GLY A 105 -1.824 -3.491 17.659 1.00 0.00 O ATOM 0 H GLY A 105 0.583 -6.281 16.659 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -1.754 -6.477 17.652 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -1.109 -5.519 18.969 1.00 0.00 H new ATOM 1616 N THR A 106 -0.920 -4.462 15.842 1.00 0.00 N ATOM 1617 CA THR A 106 -1.135 -3.305 14.981 1.00 0.00 C ATOM 1618 C THR A 106 -2.083 -3.647 13.836 1.00 0.00 C ATOM 1619 O THR A 106 -2.353 -4.818 13.570 1.00 0.00 O ATOM 1620 CB THR A 106 0.199 -2.806 14.423 1.00 0.00 C ATOM 1621 OG1 THR A 106 0.983 -3.888 13.952 1.00 0.00 O ATOM 1622 CG2 THR A 106 1.027 -2.047 15.437 1.00 0.00 C ATOM 0 H THR A 106 -0.473 -5.254 15.380 1.00 0.00 H new ATOM 0 HA THR A 106 -1.589 -2.516 15.580 1.00 0.00 H new ATOM 0 HB THR A 106 -0.065 -2.127 13.612 1.00 0.00 H new ATOM 0 HG1 THR A 106 1.432 -4.320 14.708 1.00 0.00 H new ATOM 0 HG21 THR A 106 1.959 -1.722 14.975 1.00 0.00 H new ATOM 0 HG22 THR A 106 0.470 -1.176 15.783 1.00 0.00 H new ATOM 0 HG23 THR A 106 1.249 -2.696 16.284 1.00 0.00 H new ATOM 1630 N THR A 107 -2.583 -2.617 13.162 1.00 0.00 N ATOM 1631 CA THR A 107 -3.501 -2.808 12.044 1.00 0.00 C ATOM 1632 C THR A 107 -2.758 -3.307 10.810 1.00 0.00 C ATOM 1633 O THR A 107 -3.312 -4.047 9.996 1.00 0.00 O ATOM 1634 CB THR A 107 -4.226 -1.500 11.724 1.00 0.00 C ATOM 1635 OG1 THR A 107 -4.802 -0.947 12.893 1.00 0.00 O ATOM 1636 CG2 THR A 107 -5.330 -1.665 10.702 1.00 0.00 C ATOM 0 H THR A 107 -2.368 -1.642 13.370 1.00 0.00 H new ATOM 0 HA THR A 107 -4.235 -3.561 12.332 1.00 0.00 H new ATOM 0 HB THR A 107 -3.464 -0.840 11.310 1.00 0.00 H new ATOM 0 HG1 THR A 107 -4.423 -0.058 13.056 1.00 0.00 H new ATOM 0 HG21 THR A 107 -5.804 -0.701 10.520 1.00 0.00 H new ATOM 0 HG22 THR A 107 -4.910 -2.045 9.771 1.00 0.00 H new ATOM 0 HG23 THR A 107 -6.072 -2.369 11.079 1.00 0.00 H new ATOM 1644 N LEU A 108 -1.501 -2.898 10.675 1.00 0.00 N ATOM 1645 CA LEU A 108 -0.682 -3.303 9.538 1.00 0.00 C ATOM 1646 C LEU A 108 -0.338 -4.787 9.617 1.00 0.00 C ATOM 1647 O LEU A 108 -0.398 -5.502 8.618 1.00 0.00 O ATOM 1648 CB LEU A 108 0.601 -2.471 9.485 1.00 0.00 C ATOM 1649 CG LEU A 108 0.468 -1.122 8.775 1.00 0.00 C ATOM 1650 CD1 LEU A 108 1.621 -0.204 9.151 1.00 0.00 C ATOM 1651 CD2 LEU A 108 0.409 -1.317 7.268 1.00 0.00 C ATOM 0 H LEU A 108 -1.027 -2.286 11.339 1.00 0.00 H new ATOM 0 HA LEU A 108 -1.256 -3.130 8.628 1.00 0.00 H new ATOM 0 HB2 LEU A 108 0.945 -2.296 10.504 1.00 0.00 H new ATOM 0 HB3 LEU A 108 1.374 -3.054 8.984 1.00 0.00 H new ATOM 0 HG LEU A 108 -0.462 -0.653 9.098 1.00 0.00 H new ATOM 0 HD11 LEU A 108 1.509 0.750 8.636 1.00 0.00 H new ATOM 0 HD12 LEU A 108 1.617 -0.038 10.228 1.00 0.00 H new ATOM 0 HD13 LEU A 108 2.564 -0.666 8.858 1.00 0.00 H new ATOM 0 HD21 LEU A 108 0.314 -0.347 6.779 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.322 -1.807 6.929 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -0.451 -1.936 7.015 1.00 0.00 H new ATOM 1663 N ARG A 109 0.024 -5.242 10.813 1.00 0.00 N ATOM 1664 CA ARG A 109 0.379 -6.640 11.022 1.00 0.00 C ATOM 1665 C ARG A 109 -0.832 -7.544 10.816 1.00 0.00 C ATOM 1666 O ARG A 109 -0.775 -8.512 10.057 1.00 0.00 O ATOM 1667 CB ARG A 109 0.950 -6.838 12.428 1.00 0.00 C ATOM 1668 CG ARG A 109 2.403 -7.287 12.436 1.00 0.00 C ATOM 1669 CD ARG A 109 2.634 -8.414 13.430 1.00 0.00 C ATOM 1670 NE ARG A 109 2.273 -9.716 12.873 1.00 0.00 N ATOM 1671 CZ ARG A 109 2.697 -10.877 13.368 1.00 0.00 C ATOM 1672 NH1 ARG A 109 3.495 -10.903 14.429 1.00 0.00 N ATOM 1673 NH2 ARG A 109 2.322 -12.015 12.802 1.00 0.00 N ATOM 0 H ARG A 109 0.079 -4.663 11.651 1.00 0.00 H new ATOM 0 HA ARG A 109 1.139 -6.911 10.289 1.00 0.00 H new ATOM 0 HB2 ARG A 109 0.864 -5.903 12.981 1.00 0.00 H new ATOM 0 HB3 ARG A 109 0.347 -7.577 12.956 1.00 0.00 H new ATOM 0 HG2 ARG A 109 2.688 -7.618 11.437 1.00 0.00 H new ATOM 0 HG3 ARG A 109 3.044 -6.442 12.687 1.00 0.00 H new ATOM 0 HD2 ARG A 109 3.682 -8.425 13.729 1.00 0.00 H new ATOM 0 HD3 ARG A 109 2.048 -8.229 14.330 1.00 0.00 H new ATOM 0 HE ARG A 109 1.661 -9.736 12.058 1.00 0.00 H new ATOM 0 HH11 ARG A 109 3.786 -10.030 14.869 1.00 0.00 H new ATOM 0 HH12 ARG A 109 3.816 -11.796 14.804 1.00 0.00 H new ATOM 0 HH21 ARG A 109 1.709 -12.001 11.987 1.00 0.00 H new ATOM 0 HH22 ARG A 109 2.647 -12.904 13.181 1.00 0.00 H new ATOM 1687 N SER A 110 -1.928 -7.221 11.495 1.00 0.00 N ATOM 1688 CA SER A 110 -3.154 -8.003 11.387 1.00 0.00 C ATOM 1689 C SER A 110 -3.644 -8.053 9.943 1.00 0.00 C ATOM 1690 O SER A 110 -4.274 -9.023 9.523 1.00 0.00 O ATOM 1691 CB SER A 110 -4.242 -7.413 12.286 1.00 0.00 C ATOM 1692 OG SER A 110 -4.414 -6.030 12.037 1.00 0.00 O ATOM 0 H SER A 110 -1.992 -6.422 12.126 1.00 0.00 H new ATOM 0 HA SER A 110 -2.935 -9.020 11.713 1.00 0.00 H new ATOM 0 HB2 SER A 110 -5.183 -7.936 12.115 1.00 0.00 H new ATOM 0 HB3 SER A 110 -3.977 -7.567 13.332 1.00 0.00 H new ATOM 0 HG SER A 110 -3.719 -5.524 12.507 1.00 0.00 H new ATOM 1698 N LEU A 111 -3.351 -6.999 9.187 1.00 0.00 N ATOM 1699 CA LEU A 111 -3.761 -6.922 7.791 1.00 0.00 C ATOM 1700 C LEU A 111 -2.731 -7.585 6.882 1.00 0.00 C ATOM 1701 O LEU A 111 -3.070 -8.107 5.820 1.00 0.00 O ATOM 1702 CB LEU A 111 -3.960 -5.462 7.376 1.00 0.00 C ATOM 1703 CG LEU A 111 -4.353 -5.253 5.913 1.00 0.00 C ATOM 1704 CD1 LEU A 111 -5.665 -5.960 5.607 1.00 0.00 C ATOM 1705 CD2 LEU A 111 -4.460 -3.769 5.598 1.00 0.00 C ATOM 0 H LEU A 111 -2.831 -6.187 9.519 1.00 0.00 H new ATOM 0 HA LEU A 111 -4.706 -7.455 7.687 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -4.730 -5.022 8.010 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -3.037 -4.916 7.570 1.00 0.00 H new ATOM 0 HG LEU A 111 -3.576 -5.684 5.282 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -5.929 -5.800 4.562 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -5.555 -7.028 5.795 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -6.452 -5.559 6.245 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -4.740 -3.638 4.553 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -5.218 -3.315 6.237 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.498 -3.288 5.778 1.00 0.00 H new ATOM 1717 N LYS A 112 -1.471 -7.559 7.304 1.00 0.00 N ATOM 1718 CA LYS A 112 -0.392 -8.159 6.527 1.00 0.00 C ATOM 1719 C LYS A 112 -0.384 -9.676 6.682 1.00 0.00 C ATOM 1720 O LYS A 112 -0.041 -10.403 5.749 1.00 0.00 O ATOM 1721 CB LYS A 112 0.958 -7.584 6.960 1.00 0.00 C ATOM 1722 CG LYS A 112 2.119 -8.033 6.087 1.00 0.00 C ATOM 1723 CD LYS A 112 3.354 -8.346 6.917 1.00 0.00 C ATOM 1724 CE LYS A 112 4.626 -7.919 6.204 1.00 0.00 C ATOM 1725 NZ LYS A 112 5.263 -9.052 5.478 1.00 0.00 N ATOM 0 H LYS A 112 -1.172 -7.129 8.179 1.00 0.00 H new ATOM 0 HA LYS A 112 -0.561 -7.921 5.477 1.00 0.00 H new ATOM 0 HB2 LYS A 112 0.902 -6.496 6.944 1.00 0.00 H new ATOM 0 HB3 LYS A 112 1.155 -7.878 7.991 1.00 0.00 H new ATOM 0 HG2 LYS A 112 1.828 -8.917 5.519 1.00 0.00 H new ATOM 0 HG3 LYS A 112 2.354 -7.252 5.363 1.00 0.00 H new ATOM 0 HD2 LYS A 112 3.286 -7.837 7.879 1.00 0.00 H new ATOM 0 HD3 LYS A 112 3.393 -9.415 7.124 1.00 0.00 H new ATOM 0 HE2 LYS A 112 4.396 -7.120 5.499 1.00 0.00 H new ATOM 0 HE3 LYS A 112 5.330 -7.512 6.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 6.138 -9.329 5.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 4.609 -9.860 5.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 5.487 -8.759 4.506 1.00 0.00 H new ATOM 1739 N ASP A 113 -0.761 -10.148 7.866 1.00 0.00 N ATOM 1740 CA ASP A 113 -0.794 -11.580 8.141 1.00 0.00 C ATOM 1741 C ASP A 113 -2.083 -12.210 7.621 1.00 0.00 C ATOM 1742 O ASP A 113 -2.131 -13.410 7.345 1.00 0.00 O ATOM 1743 CB ASP A 113 -0.656 -11.837 9.643 1.00 0.00 C ATOM 1744 CG ASP A 113 -1.678 -11.068 10.457 1.00 0.00 C ATOM 1745 OD1 ASP A 113 -2.850 -11.003 10.032 1.00 0.00 O ATOM 1746 OD2 ASP A 113 -1.306 -10.531 11.522 1.00 0.00 O ATOM 0 H ASP A 113 -1.048 -9.561 8.649 1.00 0.00 H new ATOM 0 HA ASP A 113 0.046 -12.040 7.622 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -0.768 -12.904 9.838 1.00 0.00 H new ATOM 0 HB3 ASP A 113 0.347 -11.557 9.966 1.00 0.00 H new ATOM 1751 N ALA A 114 -3.128 -11.399 7.487 1.00 0.00 N ATOM 1752 CA ALA A 114 -4.412 -11.885 6.999 1.00 0.00 C ATOM 1753 C ALA A 114 -4.538 -11.709 5.487 1.00 0.00 C ATOM 1754 O ALA A 114 -5.640 -11.743 4.940 1.00 0.00 O ATOM 1755 CB ALA A 114 -5.551 -11.169 7.710 1.00 0.00 C ATOM 0 H ALA A 114 -3.110 -10.404 7.709 1.00 0.00 H new ATOM 0 HA ALA A 114 -4.470 -12.951 7.217 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -6.505 -11.541 7.336 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -5.484 -11.354 8.782 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.481 -10.098 7.522 1.00 0.00 H new ATOM 1761 N LEU A 115 -3.405 -11.519 4.815 1.00 0.00 N ATOM 1762 CA LEU A 115 -3.396 -11.336 3.368 1.00 0.00 C ATOM 1763 C LEU A 115 -2.575 -12.423 2.678 1.00 0.00 C ATOM 1764 O LEU A 115 -2.818 -12.750 1.516 1.00 0.00 O ATOM 1765 CB LEU A 115 -2.838 -9.957 3.012 1.00 0.00 C ATOM 1766 CG LEU A 115 -3.845 -8.809 3.096 1.00 0.00 C ATOM 1767 CD1 LEU A 115 -3.151 -7.473 2.884 1.00 0.00 C ATOM 1768 CD2 LEU A 115 -4.957 -9.003 2.075 1.00 0.00 C ATOM 0 H LEU A 115 -2.483 -11.488 5.250 1.00 0.00 H new ATOM 0 HA LEU A 115 -4.425 -11.410 3.015 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -2.003 -9.737 3.677 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -2.437 -9.995 1.999 1.00 0.00 H new ATOM 0 HG LEU A 115 -4.287 -8.810 4.092 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -3.884 -6.668 2.947 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -2.390 -7.332 3.652 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -2.681 -7.459 1.901 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -5.665 -8.178 2.147 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -4.530 -9.028 1.072 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -5.473 -9.943 2.273 1.00 0.00 H new ATOM 1780 N PHE A 116 -1.600 -12.977 3.393 1.00 0.00 N ATOM 1781 CA PHE A 116 -0.746 -14.023 2.841 1.00 0.00 C ATOM 1782 C PHE A 116 -0.593 -15.181 3.820 1.00 0.00 C ATOM 1783 O PHE A 116 -0.835 -16.338 3.473 1.00 0.00 O ATOM 1784 CB PHE A 116 0.630 -13.452 2.492 1.00 0.00 C ATOM 1785 CG PHE A 116 1.485 -14.393 1.692 1.00 0.00 C ATOM 1786 CD1 PHE A 116 2.071 -15.497 2.291 1.00 0.00 C ATOM 1787 CD2 PHE A 116 1.703 -14.173 0.341 1.00 0.00 C ATOM 1788 CE1 PHE A 116 2.859 -16.364 1.557 1.00 0.00 C ATOM 1789 CE2 PHE A 116 2.490 -15.036 -0.397 1.00 0.00 C ATOM 1790 CZ PHE A 116 3.069 -16.133 0.211 1.00 0.00 C ATOM 0 H PHE A 116 -1.382 -12.719 4.355 1.00 0.00 H new ATOM 0 HA PHE A 116 -1.220 -14.401 1.935 1.00 0.00 H new ATOM 0 HB2 PHE A 116 0.499 -12.527 1.931 1.00 0.00 H new ATOM 0 HB3 PHE A 116 1.152 -13.194 3.414 1.00 0.00 H new ATOM 0 HD1 PHE A 116 1.910 -15.682 3.343 1.00 0.00 H new ATOM 0 HD2 PHE A 116 1.253 -13.317 -0.140 1.00 0.00 H new ATOM 0 HE1 PHE A 116 3.310 -17.221 2.035 1.00 0.00 H new ATOM 0 HE2 PHE A 116 2.652 -14.853 -1.449 1.00 0.00 H new ATOM 0 HZ PHE A 116 3.684 -16.809 -0.364 1.00 0.00 H new ATOM 1800 N LYS A 117 -0.186 -14.865 5.045 1.00 0.00 N ATOM 1801 CA LYS A 117 0.005 -15.880 6.077 1.00 0.00 C ATOM 1802 C LYS A 117 -1.268 -16.692 6.292 1.00 0.00 C ATOM 1803 O LYS A 117 -1.223 -17.918 6.395 1.00 0.00 O ATOM 1804 CB LYS A 117 0.435 -15.226 7.392 1.00 0.00 C ATOM 1805 CG LYS A 117 1.015 -16.208 8.398 1.00 0.00 C ATOM 1806 CD LYS A 117 0.084 -16.409 9.584 1.00 0.00 C ATOM 1807 CE LYS A 117 0.752 -17.211 10.689 1.00 0.00 C ATOM 1808 NZ LYS A 117 1.096 -16.362 11.863 1.00 0.00 N ATOM 0 H LYS A 117 0.018 -13.913 5.348 1.00 0.00 H new ATOM 0 HA LYS A 117 0.790 -16.557 5.740 1.00 0.00 H new ATOM 0 HB2 LYS A 117 1.176 -14.456 7.180 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -0.425 -14.727 7.838 1.00 0.00 H new ATOM 0 HG2 LYS A 117 1.196 -17.166 7.910 1.00 0.00 H new ATOM 0 HG3 LYS A 117 1.980 -15.842 8.750 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -0.225 -15.439 9.973 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -0.819 -16.923 9.255 1.00 0.00 H new ATOM 0 HE2 LYS A 117 0.088 -18.016 11.005 1.00 0.00 H new ATOM 0 HE3 LYS A 117 1.657 -17.678 10.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 1.724 -16.891 12.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 1.579 -15.500 11.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 0.226 -16.102 12.370 1.00 0.00 H new ATOM 1822 N TRP A 118 -2.402 -16.003 6.360 1.00 0.00 N ATOM 1823 CA TRP A 118 -3.686 -16.665 6.566 1.00 0.00 C ATOM 1824 C TRP A 118 -4.437 -16.822 5.247 1.00 0.00 C ATOM 1825 O TRP A 118 -4.700 -17.938 4.801 1.00 0.00 O ATOM 1826 CB TRP A 118 -4.538 -15.874 7.560 1.00 0.00 C ATOM 1827 CG TRP A 118 -3.860 -15.655 8.879 1.00 0.00 C ATOM 1828 CD1 TRP A 118 -3.564 -14.456 9.460 1.00 0.00 C ATOM 1829 CD2 TRP A 118 -3.392 -16.665 9.779 1.00 0.00 C ATOM 1830 NE1 TRP A 118 -2.941 -14.658 10.667 1.00 0.00 N ATOM 1831 CE2 TRP A 118 -2.824 -16.005 10.887 1.00 0.00 C ATOM 1832 CE3 TRP A 118 -3.399 -18.063 9.759 1.00 0.00 C ATOM 1833 CZ2 TRP A 118 -2.269 -16.696 11.960 1.00 0.00 C ATOM 1834 CZ3 TRP A 118 -2.848 -18.747 10.826 1.00 0.00 C ATOM 1835 CH2 TRP A 118 -2.289 -18.063 11.913 1.00 0.00 C ATOM 0 H TRP A 118 -2.459 -14.988 6.276 1.00 0.00 H new ATOM 0 HA TRP A 118 -3.492 -17.658 6.973 1.00 0.00 H new ATOM 0 HB2 TRP A 118 -4.790 -14.907 7.124 1.00 0.00 H new ATOM 0 HB3 TRP A 118 -5.477 -16.403 7.725 1.00 0.00 H new ATOM 0 HD1 TRP A 118 -3.787 -13.489 9.033 1.00 0.00 H new ATOM 0 HE1 TRP A 118 -2.618 -13.924 11.297 1.00 0.00 H new ATOM 0 HE3 TRP A 118 -3.827 -18.599 8.925 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 -1.838 -16.172 12.800 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 -2.848 -19.827 10.822 1.00 0.00 H new ATOM 0 HH2 TRP A 118 -1.865 -18.627 12.731 1.00 0.00 H new ATOM 1924 N LEU A 124 -1.158 -15.094 -2.979 1.00 0.00 N ATOM 1925 CA LEU A 124 -0.409 -14.022 -3.625 1.00 0.00 C ATOM 1926 C LEU A 124 0.988 -14.492 -4.015 1.00 0.00 C ATOM 1927 O LEU A 124 1.372 -15.628 -3.736 1.00 0.00 O ATOM 1928 CB LEU A 124 -0.312 -12.808 -2.697 1.00 0.00 C ATOM 1929 CG LEU A 124 -1.635 -12.086 -2.435 1.00 0.00 C ATOM 1930 CD1 LEU A 124 -1.516 -11.183 -1.217 1.00 0.00 C ATOM 1931 CD2 LEU A 124 -2.054 -11.284 -3.656 1.00 0.00 C ATOM 0 HA LEU A 124 -0.942 -13.736 -4.532 1.00 0.00 H new ATOM 0 HB2 LEU A 124 0.103 -13.132 -1.742 1.00 0.00 H new ATOM 0 HB3 LEU A 124 0.394 -12.097 -3.127 1.00 0.00 H new ATOM 0 HG LEU A 124 -2.403 -12.833 -2.235 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -2.466 -10.677 -1.045 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -1.261 -11.782 -0.343 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -0.736 -10.441 -1.389 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -2.997 -10.777 -3.452 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -1.287 -10.545 -3.887 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -2.179 -11.954 -4.506 1.00 0.00 H new ATOM 1943 N ARG A 125 1.745 -13.611 -4.660 1.00 0.00 N ATOM 1944 CA ARG A 125 3.101 -13.937 -5.088 1.00 0.00 C ATOM 1945 C ARG A 125 4.110 -13.603 -3.995 1.00 0.00 C ATOM 1946 O ARG A 125 5.137 -14.269 -3.856 1.00 0.00 O ATOM 1947 CB ARG A 125 3.445 -13.186 -6.377 1.00 0.00 C ATOM 1948 CG ARG A 125 3.584 -11.679 -6.204 1.00 0.00 C ATOM 1949 CD ARG A 125 4.819 -11.148 -6.914 1.00 0.00 C ATOM 1950 NE ARG A 125 6.046 -11.763 -6.412 1.00 0.00 N ATOM 1951 CZ ARG A 125 7.202 -11.758 -7.072 1.00 0.00 C ATOM 1952 NH1 ARG A 125 7.294 -11.172 -8.259 1.00 0.00 N ATOM 1953 NH2 ARG A 125 8.269 -12.341 -6.544 1.00 0.00 N ATOM 0 H ARG A 125 1.443 -12.666 -4.898 1.00 0.00 H new ATOM 0 HA ARG A 125 3.150 -15.009 -5.281 1.00 0.00 H new ATOM 0 HB2 ARG A 125 4.378 -13.582 -6.777 1.00 0.00 H new ATOM 0 HB3 ARG A 125 2.671 -13.385 -7.118 1.00 0.00 H new ATOM 0 HG2 ARG A 125 2.696 -11.183 -6.596 1.00 0.00 H new ATOM 0 HG3 ARG A 125 3.641 -11.437 -5.143 1.00 0.00 H new ATOM 0 HD2 ARG A 125 4.731 -11.336 -7.984 1.00 0.00 H new ATOM 0 HD3 ARG A 125 4.876 -10.067 -6.784 1.00 0.00 H new ATOM 0 HE ARG A 125 6.015 -12.223 -5.502 1.00 0.00 H new ATOM 0 HH11 ARG A 125 6.476 -10.722 -8.670 1.00 0.00 H new ATOM 0 HH12 ARG A 125 8.183 -11.171 -8.760 1.00 0.00 H new ATOM 0 HH21 ARG A 125 8.204 -12.793 -5.632 1.00 0.00 H new ATOM 0 HH22 ARG A 125 9.155 -12.337 -7.050 1.00 0.00 H new ATOM 1967 N ASN A 126 3.808 -12.567 -3.222 1.00 0.00 N ATOM 1968 CA ASN A 126 4.683 -12.138 -2.137 1.00 0.00 C ATOM 1969 C ASN A 126 3.869 -11.643 -0.946 1.00 0.00 C ATOM 1970 O ASN A 126 2.639 -11.695 -0.958 1.00 0.00 O ATOM 1971 CB ASN A 126 5.625 -11.033 -2.620 1.00 0.00 C ATOM 1972 CG ASN A 126 4.878 -9.839 -3.178 1.00 0.00 C ATOM 1973 OD1 ASN A 126 4.027 -9.255 -2.507 1.00 0.00 O ATOM 1974 ND2 ASN A 126 5.193 -9.469 -4.414 1.00 0.00 N ATOM 0 H ASN A 126 2.962 -12.007 -3.326 1.00 0.00 H new ATOM 0 HA ASN A 126 5.274 -12.997 -1.819 1.00 0.00 H new ATOM 0 HB2 ASN A 126 6.255 -10.709 -1.792 1.00 0.00 H new ATOM 0 HB3 ASN A 126 6.288 -11.434 -3.387 1.00 0.00 H new ATOM 0 HD21 ASN A 126 4.723 -8.672 -4.843 1.00 0.00 H new ATOM 0 HD22 ASN A 126 5.905 -9.982 -4.934 1.00 0.00 H new ATOM 1981 N GLU A 127 4.562 -11.162 0.081 1.00 0.00 N ATOM 1982 CA GLU A 127 3.902 -10.657 1.278 1.00 0.00 C ATOM 1983 C GLU A 127 3.662 -9.151 1.174 1.00 0.00 C ATOM 1984 O GLU A 127 4.545 -8.405 0.750 1.00 0.00 O ATOM 1985 CB GLU A 127 4.744 -10.965 2.518 1.00 0.00 C ATOM 1986 CG GLU A 127 4.571 -12.384 3.034 1.00 0.00 C ATOM 1987 CD GLU A 127 5.876 -12.998 3.502 1.00 0.00 C ATOM 1988 OE1 GLU A 127 6.865 -12.941 2.742 1.00 0.00 O ATOM 1989 OE2 GLU A 127 5.909 -13.534 4.630 1.00 0.00 O ATOM 0 H GLU A 127 5.580 -11.112 0.108 1.00 0.00 H new ATOM 0 HA GLU A 127 2.937 -11.156 1.368 1.00 0.00 H new ATOM 0 HB2 GLU A 127 5.795 -10.798 2.284 1.00 0.00 H new ATOM 0 HB3 GLU A 127 4.479 -10.265 3.310 1.00 0.00 H new ATOM 0 HG2 GLU A 127 3.858 -12.382 3.859 1.00 0.00 H new ATOM 0 HG3 GLU A 127 4.144 -13.004 2.245 1.00 0.00 H new ATOM 1996 N PRO A 128 2.461 -8.681 1.560 1.00 0.00 N ATOM 1997 CA PRO A 128 2.117 -7.257 1.504 1.00 0.00 C ATOM 1998 C PRO A 128 3.173 -6.378 2.169 1.00 0.00 C ATOM 1999 O PRO A 128 3.740 -6.744 3.198 1.00 0.00 O ATOM 2000 CB PRO A 128 0.798 -7.179 2.274 1.00 0.00 C ATOM 2001 CG PRO A 128 0.195 -8.533 2.127 1.00 0.00 C ATOM 2002 CD PRO A 128 1.347 -9.499 2.078 1.00 0.00 C ATOM 0 HA PRO A 128 2.050 -6.895 0.478 1.00 0.00 H new ATOM 0 HB2 PRO A 128 0.965 -6.931 3.322 1.00 0.00 H new ATOM 0 HB3 PRO A 128 0.145 -6.408 1.865 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -0.467 -8.758 2.963 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -0.405 -8.596 1.219 1.00 0.00 H new ATOM 0 HD2 PRO A 128 1.572 -9.905 3.064 1.00 0.00 H new ATOM 0 HD3 PRO A 128 1.133 -10.346 1.425 1.00 0.00 H new ATOM 2010 N LEU A 129 3.432 -5.219 1.572 1.00 0.00 N ATOM 2011 CA LEU A 129 4.420 -4.288 2.106 1.00 0.00 C ATOM 2012 C LEU A 129 3.750 -3.014 2.610 1.00 0.00 C ATOM 2013 O LEU A 129 2.537 -2.848 2.485 1.00 0.00 O ATOM 2014 CB LEU A 129 5.458 -3.943 1.036 1.00 0.00 C ATOM 2015 CG LEU A 129 5.978 -5.134 0.230 1.00 0.00 C ATOM 2016 CD1 LEU A 129 6.281 -4.719 -1.201 1.00 0.00 C ATOM 2017 CD2 LEU A 129 7.217 -5.721 0.889 1.00 0.00 C ATOM 0 H LEU A 129 2.972 -4.902 0.719 1.00 0.00 H new ATOM 0 HA LEU A 129 4.921 -4.771 2.945 1.00 0.00 H new ATOM 0 HB2 LEU A 129 5.021 -3.221 0.347 1.00 0.00 H new ATOM 0 HB3 LEU A 129 6.304 -3.452 1.517 1.00 0.00 H new ATOM 0 HG LEU A 129 5.203 -5.900 0.208 1.00 0.00 H new ATOM 0 HD11 LEU A 129 6.650 -5.580 -1.759 1.00 0.00 H new ATOM 0 HD12 LEU A 129 5.372 -4.344 -1.671 1.00 0.00 H new ATOM 0 HD13 LEU A 129 7.039 -3.935 -1.200 1.00 0.00 H new ATOM 0 HD21 LEU A 129 7.574 -6.568 0.303 1.00 0.00 H new ATOM 0 HD22 LEU A 129 7.996 -4.961 0.941 1.00 0.00 H new ATOM 0 HD23 LEU A 129 6.969 -6.056 1.896 1.00 0.00 H new ATOM 2029 N VAL A 130 4.549 -2.116 3.178 1.00 0.00 N ATOM 2030 CA VAL A 130 4.032 -0.856 3.699 1.00 0.00 C ATOM 2031 C VAL A 130 4.900 0.318 3.256 1.00 0.00 C ATOM 2032 O VAL A 130 6.127 0.269 3.357 1.00 0.00 O ATOM 2033 CB VAL A 130 3.953 -0.878 5.239 1.00 0.00 C ATOM 2034 CG1 VAL A 130 5.335 -1.069 5.846 1.00 0.00 C ATOM 2035 CG2 VAL A 130 3.304 0.397 5.760 1.00 0.00 C ATOM 0 H VAL A 130 5.556 -2.238 3.289 1.00 0.00 H new ATOM 0 HA VAL A 130 3.028 -0.731 3.295 1.00 0.00 H new ATOM 0 HB VAL A 130 3.333 -1.723 5.538 1.00 0.00 H new ATOM 0 HG11 VAL A 130 5.256 -1.082 6.933 1.00 0.00 H new ATOM 0 HG12 VAL A 130 5.756 -2.014 5.502 1.00 0.00 H new ATOM 0 HG13 VAL A 130 5.984 -0.249 5.539 1.00 0.00 H new ATOM 0 HG21 VAL A 130 3.257 0.363 6.848 1.00 0.00 H new ATOM 0 HG22 VAL A 130 3.894 1.259 5.449 1.00 0.00 H new ATOM 0 HG23 VAL A 130 2.295 0.483 5.356 1.00 0.00 H new ATOM 2045 N LEU A 131 4.255 1.371 2.766 1.00 0.00 N ATOM 2046 CA LEU A 131 4.967 2.558 2.308 1.00 0.00 C ATOM 2047 C LEU A 131 5.778 3.179 3.441 1.00 0.00 C ATOM 2048 O LEU A 131 5.391 3.104 4.608 1.00 0.00 O ATOM 2049 CB LEU A 131 3.981 3.586 1.749 1.00 0.00 C ATOM 2050 CG LEU A 131 4.625 4.812 1.100 1.00 0.00 C ATOM 2051 CD1 LEU A 131 4.828 4.582 -0.389 1.00 0.00 C ATOM 2052 CD2 LEU A 131 3.774 6.051 1.339 1.00 0.00 C ATOM 0 H LEU A 131 3.241 1.427 2.676 1.00 0.00 H new ATOM 0 HA LEU A 131 5.654 2.255 1.518 1.00 0.00 H new ATOM 0 HB2 LEU A 131 3.346 3.095 1.012 1.00 0.00 H new ATOM 0 HB3 LEU A 131 3.331 3.921 2.557 1.00 0.00 H new ATOM 0 HG LEU A 131 5.601 4.972 1.559 1.00 0.00 H new ATOM 0 HD11 LEU A 131 5.287 5.465 -0.834 1.00 0.00 H new ATOM 0 HD12 LEU A 131 5.478 3.720 -0.539 1.00 0.00 H new ATOM 0 HD13 LEU A 131 3.864 4.396 -0.863 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.248 6.914 0.870 1.00 0.00 H new ATOM 0 HD22 LEU A 131 2.784 5.901 0.908 1.00 0.00 H new ATOM 0 HD23 LEU A 131 3.680 6.227 2.411 1.00 0.00 H new ATOM 2064 N GLU A 132 6.904 3.791 3.090 1.00 0.00 N ATOM 2065 CA GLU A 132 7.769 4.424 4.078 1.00 0.00 C ATOM 2066 C GLU A 132 7.150 5.720 4.592 1.00 0.00 C ATOM 2067 O GLU A 132 7.099 6.722 3.878 1.00 0.00 O ATOM 2068 CB GLU A 132 9.148 4.705 3.475 1.00 0.00 C ATOM 2069 CG GLU A 132 10.298 4.175 4.315 1.00 0.00 C ATOM 2070 CD GLU A 132 10.391 2.661 4.289 1.00 0.00 C ATOM 2071 OE1 GLU A 132 11.041 2.122 3.369 1.00 0.00 O ATOM 2072 OE2 GLU A 132 9.812 2.015 5.188 1.00 0.00 O ATOM 0 H GLU A 132 7.239 3.862 2.129 1.00 0.00 H new ATOM 0 HA GLU A 132 7.882 3.739 4.918 1.00 0.00 H new ATOM 0 HB2 GLU A 132 9.199 4.259 2.482 1.00 0.00 H new ATOM 0 HB3 GLU A 132 9.267 5.781 3.348 1.00 0.00 H new ATOM 0 HG2 GLU A 132 11.234 4.599 3.951 1.00 0.00 H new ATOM 0 HG3 GLU A 132 10.175 4.510 5.345 1.00 0.00 H new ATOM 2079 N GLY A 133 6.679 5.693 5.835 1.00 0.00 N ATOM 2080 CA GLY A 133 6.069 6.870 6.423 1.00 0.00 C ATOM 2081 C GLY A 133 4.555 6.837 6.349 1.00 0.00 C ATOM 2082 O GLY A 133 3.872 7.404 7.202 1.00 0.00 O ATOM 0 H GLY A 133 6.709 4.876 6.445 1.00 0.00 H new ATOM 0 HA2 GLY A 133 6.377 6.953 7.465 1.00 0.00 H new ATOM 0 HA3 GLY A 133 6.435 7.760 5.911 1.00 0.00 H new ATOM 2086 N GLY A 134 4.030 6.171 5.325 1.00 0.00 N ATOM 2087 CA GLY A 134 2.592 6.077 5.162 1.00 0.00 C ATOM 2088 C GLY A 134 2.019 7.242 4.376 1.00 0.00 C ATOM 2089 O GLY A 134 2.723 7.873 3.588 1.00 0.00 O ATOM 0 H GLY A 134 4.575 5.695 4.606 1.00 0.00 H new ATOM 0 HA2 GLY A 134 2.347 5.144 4.653 1.00 0.00 H new ATOM 0 HA3 GLY A 134 2.120 6.038 6.144 1.00 0.00 H new ATOM 2093 N TYR A 135 0.740 7.525 4.593 1.00 0.00 N ATOM 2094 CA TYR A 135 0.071 8.621 3.900 1.00 0.00 C ATOM 2095 C TYR A 135 0.755 9.951 4.199 1.00 0.00 C ATOM 2096 O TYR A 135 0.857 10.817 3.330 1.00 0.00 O ATOM 2097 CB TYR A 135 -1.401 8.688 4.308 1.00 0.00 C ATOM 2098 CG TYR A 135 -2.234 9.591 3.427 1.00 0.00 C ATOM 2099 CD1 TYR A 135 -2.454 9.278 2.091 1.00 0.00 C ATOM 2100 CD2 TYR A 135 -2.800 10.756 3.930 1.00 0.00 C ATOM 2101 CE1 TYR A 135 -3.213 10.101 1.282 1.00 0.00 C ATOM 2102 CE2 TYR A 135 -3.562 11.584 3.127 1.00 0.00 C ATOM 2103 CZ TYR A 135 -3.765 11.252 1.805 1.00 0.00 C ATOM 2104 OH TYR A 135 -4.523 12.073 1.001 1.00 0.00 O ATOM 0 H TYR A 135 0.145 7.011 5.243 1.00 0.00 H new ATOM 0 HA TYR A 135 0.135 8.433 2.828 1.00 0.00 H new ATOM 0 HB2 TYR A 135 -1.822 7.683 4.284 1.00 0.00 H new ATOM 0 HB3 TYR A 135 -1.468 9.037 5.338 1.00 0.00 H new ATOM 0 HD1 TYR A 135 -2.025 8.377 1.679 1.00 0.00 H new ATOM 0 HD2 TYR A 135 -2.642 11.019 4.965 1.00 0.00 H new ATOM 0 HE1 TYR A 135 -3.373 9.845 0.245 1.00 0.00 H new ATOM 0 HE2 TYR A 135 -3.996 12.486 3.533 1.00 0.00 H new ATOM 0 HH TYR A 135 -4.914 11.547 0.272 1.00 0.00 H new ATOM 2114 N GLU A 136 1.222 10.107 5.434 1.00 0.00 N ATOM 2115 CA GLU A 136 1.897 11.333 5.846 1.00 0.00 C ATOM 2116 C GLU A 136 3.122 11.600 4.978 1.00 0.00 C ATOM 2117 O GLU A 136 3.487 12.752 4.741 1.00 0.00 O ATOM 2118 CB GLU A 136 2.310 11.243 7.316 1.00 0.00 C ATOM 2119 CG GLU A 136 2.519 12.596 7.972 1.00 0.00 C ATOM 2120 CD GLU A 136 1.216 13.330 8.224 1.00 0.00 C ATOM 2121 OE1 GLU A 136 0.695 13.954 7.276 1.00 0.00 O ATOM 2122 OE2 GLU A 136 0.718 13.279 9.368 1.00 0.00 O ATOM 0 H GLU A 136 1.146 9.401 6.166 1.00 0.00 H new ATOM 0 HA GLU A 136 1.199 12.161 5.721 1.00 0.00 H new ATOM 0 HB2 GLU A 136 1.545 10.696 7.867 1.00 0.00 H new ATOM 0 HB3 GLU A 136 3.232 10.666 7.391 1.00 0.00 H new ATOM 0 HG2 GLU A 136 3.044 12.460 8.918 1.00 0.00 H new ATOM 0 HG3 GLU A 136 3.160 13.208 7.337 1.00 0.00 H new ATOM 2129 N ASN A 137 3.751 10.531 4.504 1.00 0.00 N ATOM 2130 CA ASN A 137 4.935 10.651 3.661 1.00 0.00 C ATOM 2131 C ASN A 137 4.545 10.752 2.190 1.00 0.00 C ATOM 2132 O ASN A 137 5.240 11.388 1.396 1.00 0.00 O ATOM 2133 CB ASN A 137 5.864 9.454 3.877 1.00 0.00 C ATOM 2134 CG ASN A 137 7.098 9.819 4.679 1.00 0.00 C ATOM 2135 OD1 ASN A 137 7.010 10.496 5.704 1.00 0.00 O ATOM 2136 ND2 ASN A 137 8.260 9.372 4.214 1.00 0.00 N ATOM 0 H ASN A 137 3.461 9.571 4.689 1.00 0.00 H new ATOM 0 HA ASN A 137 5.461 11.563 3.941 1.00 0.00 H new ATOM 0 HB2 ASN A 137 5.319 8.663 4.393 1.00 0.00 H new ATOM 0 HB3 ASN A 137 6.168 9.054 2.910 1.00 0.00 H new ATOM 0 HD21 ASN A 137 9.125 9.587 4.711 1.00 0.00 H new ATOM 0 HD22 ASN A 137 8.287 8.814 3.361 1.00 0.00 H new ATOM 2143 N TRP A 138 3.431 10.122 1.832 1.00 0.00 N ATOM 2144 CA TRP A 138 2.950 10.142 0.455 1.00 0.00 C ATOM 2145 C TRP A 138 2.661 11.569 0.001 1.00 0.00 C ATOM 2146 O TRP A 138 2.906 11.925 -1.152 1.00 0.00 O ATOM 2147 CB TRP A 138 1.689 9.286 0.322 1.00 0.00 C ATOM 2148 CG TRP A 138 1.247 9.097 -1.097 1.00 0.00 C ATOM 2149 CD1 TRP A 138 0.073 9.517 -1.653 1.00 0.00 C ATOM 2150 CD2 TRP A 138 1.973 8.438 -2.141 1.00 0.00 C ATOM 2151 NE1 TRP A 138 0.024 9.160 -2.979 1.00 0.00 N ATOM 2152 CE2 TRP A 138 1.179 8.497 -3.303 1.00 0.00 C ATOM 2153 CE3 TRP A 138 3.218 7.806 -2.208 1.00 0.00 C ATOM 2154 CZ2 TRP A 138 1.590 7.947 -4.514 1.00 0.00 C ATOM 2155 CZ3 TRP A 138 3.624 7.260 -3.411 1.00 0.00 C ATOM 2156 CH2 TRP A 138 2.813 7.334 -4.550 1.00 0.00 C ATOM 0 H TRP A 138 2.844 9.591 2.476 1.00 0.00 H new ATOM 0 HA TRP A 138 3.731 9.728 -0.183 1.00 0.00 H new ATOM 0 HB2 TRP A 138 1.872 8.310 0.771 1.00 0.00 H new ATOM 0 HB3 TRP A 138 0.882 9.751 0.888 1.00 0.00 H new ATOM 0 HD1 TRP A 138 -0.704 10.052 -1.127 1.00 0.00 H new ATOM 0 HE1 TRP A 138 -0.746 9.356 -3.618 1.00 0.00 H new ATOM 0 HE3 TRP A 138 3.851 7.745 -1.335 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 0.966 8.002 -5.394 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 4.583 6.768 -3.474 1.00 0.00 H new ATOM 0 HH2 TRP A 138 3.160 6.899 -5.476 1.00 0.00 H new ATOM 2167 N LEU A 139 2.138 12.380 0.913 1.00 0.00 N ATOM 2168 CA LEU A 139 1.815 13.769 0.606 1.00 0.00 C ATOM 2169 C LEU A 139 3.081 14.615 0.521 1.00 0.00 C ATOM 2170 O LEU A 139 3.246 15.414 -0.401 1.00 0.00 O ATOM 2171 CB LEU A 139 0.873 14.343 1.667 1.00 0.00 C ATOM 2172 CG LEU A 139 -0.366 13.496 1.959 1.00 0.00 C ATOM 2173 CD1 LEU A 139 -0.931 13.832 3.330 1.00 0.00 C ATOM 2174 CD2 LEU A 139 -1.419 13.705 0.881 1.00 0.00 C ATOM 0 H LEU A 139 1.928 12.100 1.871 1.00 0.00 H new ATOM 0 HA LEU A 139 1.317 13.795 -0.363 1.00 0.00 H new ATOM 0 HB2 LEU A 139 1.431 14.474 2.594 1.00 0.00 H new ATOM 0 HB3 LEU A 139 0.550 15.333 1.347 1.00 0.00 H new ATOM 0 HG LEU A 139 -0.074 12.446 1.957 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -1.812 13.219 3.520 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -0.178 13.632 4.093 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -1.208 14.886 3.361 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -2.294 13.095 1.104 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -1.707 14.756 0.853 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -1.011 13.414 -0.087 1.00 0.00 H new ATOM 2186 N LEU A 140 3.972 14.436 1.491 1.00 0.00 N ATOM 2187 CA LEU A 140 5.224 15.183 1.528 1.00 0.00 C ATOM 2188 C LEU A 140 6.070 14.890 0.292 1.00 0.00 C ATOM 2189 O LEU A 140 6.825 15.745 -0.172 1.00 0.00 O ATOM 2190 CB LEU A 140 6.010 14.837 2.793 1.00 0.00 C ATOM 2191 CG LEU A 140 5.678 15.692 4.017 1.00 0.00 C ATOM 2192 CD1 LEU A 140 6.036 14.955 5.297 1.00 0.00 C ATOM 2193 CD2 LEU A 140 6.404 17.027 3.945 1.00 0.00 C ATOM 0 H LEU A 140 3.850 13.780 2.262 1.00 0.00 H new ATOM 0 HA LEU A 140 4.984 16.246 1.537 1.00 0.00 H new ATOM 0 HB2 LEU A 140 5.829 13.791 3.040 1.00 0.00 H new ATOM 0 HB3 LEU A 140 7.074 14.934 2.579 1.00 0.00 H new ATOM 0 HG LEU A 140 4.605 15.884 4.023 1.00 0.00 H new ATOM 0 HD11 LEU A 140 5.793 15.579 6.157 1.00 0.00 H new ATOM 0 HD12 LEU A 140 5.470 14.025 5.352 1.00 0.00 H new ATOM 0 HD13 LEU A 140 7.103 14.731 5.302 1.00 0.00 H new ATOM 0 HD21 LEU A 140 6.157 17.623 4.823 1.00 0.00 H new ATOM 0 HD22 LEU A 140 7.480 16.855 3.914 1.00 0.00 H new ATOM 0 HD23 LEU A 140 6.096 17.561 3.046 1.00 0.00 H new ATOM 2205 N CYS A 141 5.940 13.677 -0.236 1.00 0.00 N ATOM 2206 CA CYS A 141 6.694 13.273 -1.417 1.00 0.00 C ATOM 2207 C CYS A 141 5.878 13.494 -2.686 1.00 0.00 C ATOM 2208 O CYS A 141 6.289 14.238 -3.577 1.00 0.00 O ATOM 2209 CB CYS A 141 7.101 11.802 -1.307 1.00 0.00 C ATOM 2210 SG CYS A 141 8.770 11.544 -0.660 1.00 0.00 S ATOM 0 H CYS A 141 5.320 12.957 0.135 1.00 0.00 H new ATOM 0 HA CYS A 141 7.592 13.889 -1.474 1.00 0.00 H new ATOM 0 HB2 CYS A 141 6.389 11.286 -0.662 1.00 0.00 H new ATOM 0 HB3 CYS A 141 7.030 11.342 -2.292 1.00 0.00 H new ATOM 0 HG CYS A 141 9.021 10.270 -0.602 1.00 0.00 H new ATOM 2216 N TYR A 142 4.721 12.845 -2.762 1.00 0.00 N ATOM 2217 CA TYR A 142 3.848 12.971 -3.923 1.00 0.00 C ATOM 2218 C TYR A 142 2.483 13.530 -3.523 1.00 0.00 C ATOM 2219 O TYR A 142 1.495 12.797 -3.468 1.00 0.00 O ATOM 2220 CB TYR A 142 3.677 11.614 -4.608 1.00 0.00 C ATOM 2221 CG TYR A 142 4.975 11.017 -5.103 1.00 0.00 C ATOM 2222 CD1 TYR A 142 5.570 11.472 -6.274 1.00 0.00 C ATOM 2223 CD2 TYR A 142 5.605 9.998 -4.400 1.00 0.00 C ATOM 2224 CE1 TYR A 142 6.756 10.929 -6.730 1.00 0.00 C ATOM 2225 CE2 TYR A 142 6.792 9.450 -4.850 1.00 0.00 C ATOM 2226 CZ TYR A 142 7.363 9.919 -6.014 1.00 0.00 C ATOM 2227 OH TYR A 142 8.544 9.375 -6.464 1.00 0.00 O ATOM 0 H TYR A 142 4.366 12.226 -2.033 1.00 0.00 H new ATOM 0 HA TYR A 142 4.313 13.667 -4.621 1.00 0.00 H new ATOM 0 HB2 TYR A 142 3.211 10.920 -3.909 1.00 0.00 H new ATOM 0 HB3 TYR A 142 2.994 11.725 -5.450 1.00 0.00 H new ATOM 0 HD1 TYR A 142 5.097 12.263 -6.837 1.00 0.00 H new ATOM 0 HD2 TYR A 142 5.161 9.628 -3.488 1.00 0.00 H new ATOM 0 HE1 TYR A 142 7.205 11.294 -7.642 1.00 0.00 H new ATOM 0 HE2 TYR A 142 7.270 8.658 -4.292 1.00 0.00 H new ATOM 0 HH TYR A 142 8.839 8.676 -5.844 1.00 0.00 H new ATOM 2237 N PRO A 143 2.412 14.842 -3.237 1.00 0.00 N ATOM 2238 CA PRO A 143 1.161 15.496 -2.842 1.00 0.00 C ATOM 2239 C PRO A 143 0.180 15.633 -4.003 1.00 0.00 C ATOM 2240 O PRO A 143 -1.008 15.877 -3.796 1.00 0.00 O ATOM 2241 CB PRO A 143 1.618 16.875 -2.365 1.00 0.00 C ATOM 2242 CG PRO A 143 2.885 17.130 -3.105 1.00 0.00 C ATOM 2243 CD PRO A 143 3.543 15.788 -3.278 1.00 0.00 C ATOM 0 HA PRO A 143 0.625 14.922 -2.086 1.00 0.00 H new ATOM 0 HB2 PRO A 143 0.871 17.638 -2.584 1.00 0.00 H new ATOM 0 HB3 PRO A 143 1.779 16.888 -1.287 1.00 0.00 H new ATOM 0 HG2 PRO A 143 2.686 17.594 -4.071 1.00 0.00 H new ATOM 0 HG3 PRO A 143 3.530 17.812 -2.551 1.00 0.00 H new ATOM 0 HD2 PRO A 143 4.085 15.725 -4.222 1.00 0.00 H new ATOM 0 HD3 PRO A 143 4.262 15.588 -2.484 1.00 0.00 H new ATOM 2251 N GLN A 144 0.682 15.473 -5.224 1.00 0.00 N ATOM 2252 CA GLN A 144 -0.154 15.579 -6.414 1.00 0.00 C ATOM 2253 C GLN A 144 -0.620 14.202 -6.878 1.00 0.00 C ATOM 2254 O GLN A 144 -0.690 13.930 -8.077 1.00 0.00 O ATOM 2255 CB GLN A 144 0.611 16.278 -7.540 1.00 0.00 C ATOM 2256 CG GLN A 144 1.928 15.604 -7.890 1.00 0.00 C ATOM 2257 CD GLN A 144 1.953 15.072 -9.310 1.00 0.00 C ATOM 2258 OE1 GLN A 144 2.357 15.771 -10.241 1.00 0.00 O ATOM 2259 NE2 GLN A 144 1.520 13.829 -9.484 1.00 0.00 N ATOM 0 H GLN A 144 1.663 15.270 -5.415 1.00 0.00 H new ATOM 0 HA GLN A 144 -1.032 16.172 -6.158 1.00 0.00 H new ATOM 0 HB2 GLN A 144 -0.018 16.311 -8.429 1.00 0.00 H new ATOM 0 HB3 GLN A 144 0.807 17.310 -7.249 1.00 0.00 H new ATOM 0 HG2 GLN A 144 2.742 16.316 -7.759 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.107 14.783 -7.195 1.00 0.00 H new ATOM 0 HE21 GLN A 144 1.194 13.286 -8.684 1.00 0.00 H new ATOM 0 HE22 GLN A 144 1.513 13.417 -10.417 1.00 0.00 H new ATOM 2268 N TYR A 145 -0.940 13.337 -5.921 1.00 0.00 N ATOM 2269 CA TYR A 145 -1.402 11.989 -6.230 1.00 0.00 C ATOM 2270 C TYR A 145 -2.483 11.550 -5.249 1.00 0.00 C ATOM 2271 O TYR A 145 -2.616 10.364 -4.945 1.00 0.00 O ATOM 2272 CB TYR A 145 -0.230 11.006 -6.191 1.00 0.00 C ATOM 2273 CG TYR A 145 -0.272 9.968 -7.291 1.00 0.00 C ATOM 2274 CD1 TYR A 145 -1.177 8.914 -7.244 1.00 0.00 C ATOM 2275 CD2 TYR A 145 0.593 10.043 -8.375 1.00 0.00 C ATOM 2276 CE1 TYR A 145 -1.217 7.964 -8.247 1.00 0.00 C ATOM 2277 CE2 TYR A 145 0.558 9.098 -9.382 1.00 0.00 C ATOM 2278 CZ TYR A 145 -0.348 8.061 -9.313 1.00 0.00 C ATOM 2279 OH TYR A 145 -0.385 7.117 -10.313 1.00 0.00 O ATOM 0 H TYR A 145 -0.888 13.546 -4.924 1.00 0.00 H new ATOM 0 HA TYR A 145 -1.828 11.996 -7.233 1.00 0.00 H new ATOM 0 HB2 TYR A 145 0.704 11.564 -6.265 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -0.223 10.500 -5.226 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -1.860 8.836 -6.411 1.00 0.00 H new ATOM 0 HD2 TYR A 145 1.305 10.853 -8.432 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -1.925 7.150 -8.196 1.00 0.00 H new ATOM 0 HE2 TYR A 145 1.237 9.171 -10.219 1.00 0.00 H new ATOM 0 HH TYR A 145 0.291 7.331 -10.990 1.00 0.00 H new ATOM 2289 N THR A 146 -3.254 12.513 -4.755 1.00 0.00 N ATOM 2290 CA THR A 146 -4.324 12.228 -3.807 1.00 0.00 C ATOM 2291 C THR A 146 -5.548 13.091 -4.092 1.00 0.00 C ATOM 2292 O THR A 146 -5.425 14.246 -4.496 1.00 0.00 O ATOM 2293 CB THR A 146 -3.840 12.466 -2.375 1.00 0.00 C ATOM 2294 OG1 THR A 146 -3.570 13.839 -2.160 1.00 0.00 O ATOM 2295 CG2 THR A 146 -2.585 11.692 -2.032 1.00 0.00 C ATOM 0 H THR A 146 -3.157 13.499 -4.996 1.00 0.00 H new ATOM 0 HA THR A 146 -4.606 11.181 -3.919 1.00 0.00 H new ATOM 0 HB THR A 146 -4.649 12.117 -1.734 1.00 0.00 H new ATOM 0 HG1 THR A 146 -2.611 14.006 -2.274 1.00 0.00 H new ATOM 0 HG21 THR A 146 -2.296 11.906 -1.003 1.00 0.00 H new ATOM 0 HG22 THR A 146 -2.775 10.624 -2.141 1.00 0.00 H new ATOM 0 HG23 THR A 146 -1.780 11.988 -2.704 1.00 0.00 H new ATOM 2303 N THR A 147 -6.729 12.520 -3.880 1.00 0.00 N ATOM 2304 CA THR A 147 -7.976 13.236 -4.115 1.00 0.00 C ATOM 2305 C THR A 147 -8.074 14.468 -3.221 1.00 0.00 C ATOM 2306 O THR A 147 -8.666 15.479 -3.601 1.00 0.00 O ATOM 2307 CB THR A 147 -9.172 12.316 -3.867 1.00 0.00 C ATOM 2308 OG1 THR A 147 -9.129 11.778 -2.557 1.00 0.00 O ATOM 2309 CG2 THR A 147 -9.248 11.157 -4.837 1.00 0.00 C ATOM 0 H THR A 147 -6.848 11.564 -3.546 1.00 0.00 H new ATOM 0 HA THR A 147 -7.987 13.562 -5.155 1.00 0.00 H new ATOM 0 HB THR A 147 -10.052 12.944 -4.007 1.00 0.00 H new ATOM 0 HG1 THR A 147 -9.151 10.799 -2.604 1.00 0.00 H new ATOM 0 HG21 THR A 147 -10.119 10.545 -4.605 1.00 0.00 H new ATOM 0 HG22 THR A 147 -9.334 11.539 -5.854 1.00 0.00 H new ATOM 0 HG23 THR A 147 -8.346 10.551 -4.752 1.00 0.00 H new ATOM 2317 N ASN A 148 -7.491 14.376 -2.030 1.00 0.00 N ATOM 2318 CA ASN A 148 -7.513 15.483 -1.081 1.00 0.00 C ATOM 2319 C ASN A 148 -6.127 15.718 -0.487 1.00 0.00 C ATOM 2320 O ASN A 148 -5.733 15.057 0.474 1.00 0.00 O ATOM 2321 CB ASN A 148 -8.519 15.204 0.037 1.00 0.00 C ATOM 2322 CG ASN A 148 -8.796 16.430 0.884 1.00 0.00 C ATOM 2323 OD1 ASN A 148 -9.760 17.158 0.646 1.00 0.00 O ATOM 2324 ND2 ASN A 148 -7.949 16.665 1.879 1.00 0.00 N ATOM 0 H ASN A 148 -6.998 13.547 -1.699 1.00 0.00 H new ATOM 0 HA ASN A 148 -7.816 16.382 -1.617 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -9.453 14.848 -0.399 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -8.139 14.405 0.673 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -8.084 17.476 2.483 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -7.163 16.035 2.040 1.00 0.00 H new ATOM 2331 N ALA A 149 -5.393 16.662 -1.066 1.00 0.00 N ATOM 2332 CA ALA A 149 -4.052 16.983 -0.594 1.00 0.00 C ATOM 2333 C ALA A 149 -4.039 18.308 0.162 1.00 0.00 C ATOM 2334 O ALA A 149 -3.629 19.337 -0.377 1.00 0.00 O ATOM 2335 CB ALA A 149 -3.079 17.030 -1.762 1.00 0.00 C ATOM 0 H ALA A 149 -5.704 17.218 -1.863 1.00 0.00 H new ATOM 0 HA ALA A 149 -3.738 16.199 0.095 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -2.081 17.271 -1.395 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -3.059 16.060 -2.258 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -3.399 17.793 -2.471 1.00 0.00 H new