USER MOD reduce.3.24.130724 H: found=0, std=0, add=820, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 816 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 Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 TYR OH : rot 180:sc=-0.00555 USER MOD Single : A 23 HIS : no HD1:sc= -0.242 X(o=-0.24,f=-0.39) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 HIS : no HD1:sc= -0.0145 X(o=-0.014,f=0) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 100:sc= -0.195! USER MOD Single : A 44 HIS : no HD1:sc= -3.9! C(o=-3.9!,f=-4.8!) USER MOD Single : A 47 CYS SG : rot 140:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= -0.297 X(o=-0.3,f=-0.097) USER MOD Single : A 58 MET CE :methyl 160:sc= -0.665 (180deg=-1.46) USER MOD Single : A 59 THR OG1 : rot 180:sc= -0.158 USER MOD Single : A 67 THR OG1 : rot -65:sc= 0.958 USER MOD Single : A 68 TYR OH : rot -6:sc= -0.426 USER MOD Single : A 71 ASN : amide:sc= -3.79! C(o=-3.8!,f=-11!) USER MOD Single : A 72 LYS NZ :NH3+ -165:sc= -5! (180deg=-6.67!) USER MOD Single : A 73 GLN : amide:sc= -0.099 X(o=-0.099,f=-0.48) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 LYS NZ :NH3+ -149:sc= 1.45 (180deg=-0.0142!) USER MOD Single : A 78 GLN : amide:sc= 0.111 X(o=0.11,f=0) USER MOD Single : A 83 SER OG : rot 180:sc= -0.54 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 ASN :FLIP amide:sc= -0.375 F(o=-1.7,f=-0.37) USER MOD Single : A 100 SER OG : rot 89:sc= 0.0103 USER MOD Single : A 103 ASN : amide:sc= -0.725 X(o=-0.73,f=-0.26) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ -160:sc= 0.961 (180deg=0.586) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 80:sc= -1.75 USER MOD Single : A 123 GLN : amide:sc=-1.13e-05 X(o=-1.1e-05,f=0) USER MOD ----------------------------------------------------------------- ATOM 251 N PRO A 18 10.746 -24.605 -9.332 1.00 0.00 N ATOM 252 CA PRO A 18 11.486 -23.485 -8.744 1.00 0.00 C ATOM 253 C PRO A 18 10.591 -22.570 -7.916 1.00 0.00 C ATOM 254 O PRO A 18 10.149 -21.522 -8.390 1.00 0.00 O ATOM 255 CB PRO A 18 12.030 -22.739 -9.965 1.00 0.00 C ATOM 256 CG PRO A 18 11.089 -23.080 -11.068 1.00 0.00 C ATOM 257 CD PRO A 18 10.622 -24.483 -10.795 1.00 0.00 C ATOM 0 HA PRO A 18 12.260 -23.825 -8.055 1.00 0.00 H new ATOM 0 HB2 PRO A 18 12.062 -21.664 -9.790 1.00 0.00 H new ATOM 0 HB3 PRO A 18 13.047 -23.054 -10.201 1.00 0.00 H new ATOM 0 HG2 PRO A 18 10.248 -22.387 -11.092 1.00 0.00 H new ATOM 0 HG3 PRO A 18 11.584 -23.015 -12.037 1.00 0.00 H new ATOM 0 HD2 PRO A 18 9.595 -24.636 -11.125 1.00 0.00 H new ATOM 0 HD3 PRO A 18 11.237 -25.219 -11.313 1.00 0.00 H new ATOM 265 N LEU A 19 10.327 -22.971 -6.678 1.00 0.00 N ATOM 266 CA LEU A 19 9.483 -22.186 -5.783 1.00 0.00 C ATOM 267 C LEU A 19 9.783 -20.696 -5.919 1.00 0.00 C ATOM 268 O LEU A 19 8.871 -19.879 -6.033 1.00 0.00 O ATOM 269 CB LEU A 19 9.693 -22.629 -4.334 1.00 0.00 C ATOM 270 CG LEU A 19 9.155 -24.014 -3.971 1.00 0.00 C ATOM 271 CD1 LEU A 19 10.190 -24.797 -3.178 1.00 0.00 C ATOM 272 CD2 LEU A 19 7.858 -23.894 -3.185 1.00 0.00 C ATOM 0 H LEU A 19 10.685 -23.835 -6.270 1.00 0.00 H new ATOM 0 HA LEU A 19 8.443 -22.356 -6.062 1.00 0.00 H new ATOM 0 HB2 LEU A 19 10.762 -22.609 -4.120 1.00 0.00 H new ATOM 0 HB3 LEU A 19 9.223 -21.895 -3.679 1.00 0.00 H new ATOM 0 HG LEU A 19 8.948 -24.555 -4.894 1.00 0.00 H new ATOM 0 HD11 LEU A 19 9.790 -25.780 -2.928 1.00 0.00 H new ATOM 0 HD12 LEU A 19 11.094 -24.914 -3.776 1.00 0.00 H new ATOM 0 HD13 LEU A 19 10.429 -24.259 -2.261 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.490 -24.889 -2.936 1.00 0.00 H new ATOM 0 HD22 LEU A 19 8.039 -23.334 -2.268 1.00 0.00 H new ATOM 0 HD23 LEU A 19 7.114 -23.373 -3.788 1.00 0.00 H new ATOM 284 N GLU A 20 11.067 -20.353 -5.908 1.00 0.00 N ATOM 285 CA GLU A 20 11.486 -18.962 -6.032 1.00 0.00 C ATOM 286 C GLU A 20 10.943 -18.343 -7.317 1.00 0.00 C ATOM 287 O GLU A 20 10.370 -17.253 -7.301 1.00 0.00 O ATOM 288 CB GLU A 20 13.013 -18.861 -6.010 1.00 0.00 C ATOM 289 CG GLU A 20 13.608 -18.954 -4.615 1.00 0.00 C ATOM 290 CD GLU A 20 13.886 -20.383 -4.193 1.00 0.00 C ATOM 291 OE1 GLU A 20 12.976 -21.228 -4.329 1.00 0.00 O ATOM 292 OE2 GLU A 20 15.011 -20.657 -3.726 1.00 0.00 O ATOM 0 H GLU A 20 11.834 -21.018 -5.815 1.00 0.00 H new ATOM 0 HA GLU A 20 11.081 -18.411 -5.183 1.00 0.00 H new ATOM 0 HB2 GLU A 20 13.430 -19.656 -6.628 1.00 0.00 H new ATOM 0 HB3 GLU A 20 13.313 -17.915 -6.462 1.00 0.00 H new ATOM 0 HG2 GLU A 20 14.535 -18.382 -4.581 1.00 0.00 H new ATOM 0 HG3 GLU A 20 12.924 -18.495 -3.901 1.00 0.00 H new ATOM 299 N LYS A 21 11.129 -19.045 -8.430 1.00 0.00 N ATOM 300 CA LYS A 21 10.658 -18.567 -9.724 1.00 0.00 C ATOM 301 C LYS A 21 9.142 -18.402 -9.725 1.00 0.00 C ATOM 302 O LYS A 21 8.607 -17.495 -10.363 1.00 0.00 O ATOM 303 CB LYS A 21 11.077 -19.537 -10.832 1.00 0.00 C ATOM 304 CG LYS A 21 10.899 -18.975 -12.232 1.00 0.00 C ATOM 305 CD LYS A 21 12.113 -19.251 -13.102 1.00 0.00 C ATOM 306 CE LYS A 21 12.192 -18.284 -14.273 1.00 0.00 C ATOM 307 NZ LYS A 21 11.365 -18.740 -15.425 1.00 0.00 N ATOM 0 H LYS A 21 11.603 -19.948 -8.461 1.00 0.00 H new ATOM 0 HA LYS A 21 11.111 -17.593 -9.910 1.00 0.00 H new ATOM 0 HB2 LYS A 21 12.123 -19.809 -10.689 1.00 0.00 H new ATOM 0 HB3 LYS A 21 10.494 -20.453 -10.741 1.00 0.00 H new ATOM 0 HG2 LYS A 21 10.014 -19.414 -12.691 1.00 0.00 H new ATOM 0 HG3 LYS A 21 10.728 -17.900 -12.175 1.00 0.00 H new ATOM 0 HD2 LYS A 21 13.019 -19.170 -12.501 1.00 0.00 H new ATOM 0 HD3 LYS A 21 12.069 -20.274 -13.476 1.00 0.00 H new ATOM 0 HE2 LYS A 21 11.856 -17.298 -13.953 1.00 0.00 H new ATOM 0 HE3 LYS A 21 13.230 -18.181 -14.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 11.445 -18.054 -16.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 11.701 -19.670 -15.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 10.370 -18.814 -15.130 1.00 0.00 H new ATOM 321 N TYR A 22 8.455 -19.283 -9.007 1.00 0.00 N ATOM 322 CA TYR A 22 7.000 -19.236 -8.926 1.00 0.00 C ATOM 323 C TYR A 22 6.536 -17.976 -8.201 1.00 0.00 C ATOM 324 O TYR A 22 5.619 -17.288 -8.652 1.00 0.00 O ATOM 325 CB TYR A 22 6.468 -20.477 -8.207 1.00 0.00 C ATOM 326 CG TYR A 22 5.176 -20.236 -7.459 1.00 0.00 C ATOM 327 CD1 TYR A 22 5.171 -19.571 -6.239 1.00 0.00 C ATOM 328 CD2 TYR A 22 3.961 -20.673 -7.972 1.00 0.00 C ATOM 329 CE1 TYR A 22 3.994 -19.349 -5.551 1.00 0.00 C ATOM 330 CE2 TYR A 22 2.779 -20.454 -7.292 1.00 0.00 C ATOM 331 CZ TYR A 22 2.800 -19.792 -6.082 1.00 0.00 C ATOM 332 OH TYR A 22 1.625 -19.573 -5.401 1.00 0.00 O ATOM 0 H TYR A 22 8.883 -20.039 -8.472 1.00 0.00 H new ATOM 0 HA TYR A 22 6.605 -19.216 -9.942 1.00 0.00 H new ATOM 0 HB2 TYR A 22 6.313 -21.271 -8.937 1.00 0.00 H new ATOM 0 HB3 TYR A 22 7.223 -20.832 -7.506 1.00 0.00 H new ATOM 0 HD1 TYR A 22 6.104 -19.222 -5.821 1.00 0.00 H new ATOM 0 HD2 TYR A 22 3.940 -21.193 -8.919 1.00 0.00 H new ATOM 0 HE1 TYR A 22 4.008 -18.832 -4.603 1.00 0.00 H new ATOM 0 HE2 TYR A 22 1.843 -20.799 -7.706 1.00 0.00 H new ATOM 0 HH TYR A 22 0.876 -19.946 -5.912 1.00 0.00 H new ATOM 342 N HIS A 23 7.176 -17.680 -7.074 1.00 0.00 N ATOM 343 CA HIS A 23 6.830 -16.502 -6.286 1.00 0.00 C ATOM 344 C HIS A 23 7.149 -15.222 -7.053 1.00 0.00 C ATOM 345 O HIS A 23 6.472 -14.207 -6.892 1.00 0.00 O ATOM 346 CB HIS A 23 7.584 -16.514 -4.955 1.00 0.00 C ATOM 347 CG HIS A 23 6.750 -16.075 -3.791 1.00 0.00 C ATOM 348 ND1 HIS A 23 5.533 -15.441 -3.933 1.00 0.00 N ATOM 349 CD2 HIS A 23 6.963 -16.183 -2.459 1.00 0.00 C ATOM 350 CE1 HIS A 23 5.035 -15.177 -2.739 1.00 0.00 C ATOM 351 NE2 HIS A 23 5.883 -15.617 -1.827 1.00 0.00 N ATOM 0 H HIS A 23 7.936 -18.239 -6.686 1.00 0.00 H new ATOM 0 HA HIS A 23 5.758 -16.529 -6.089 1.00 0.00 H new ATOM 0 HB2 HIS A 23 7.955 -17.521 -4.766 1.00 0.00 H new ATOM 0 HB3 HIS A 23 8.455 -15.863 -5.034 1.00 0.00 H new ATOM 0 HD2 HIS A 23 7.822 -16.631 -1.982 1.00 0.00 H new ATOM 0 HE1 HIS A 23 4.094 -14.685 -2.542 1.00 0.00 H new ATOM 0 HE2 HIS A 23 5.756 -15.548 -0.817 1.00 0.00 H new ATOM 359 N GLU A 24 8.184 -15.279 -7.885 1.00 0.00 N ATOM 360 CA GLU A 24 8.592 -14.123 -8.675 1.00 0.00 C ATOM 361 C GLU A 24 7.568 -13.820 -9.765 1.00 0.00 C ATOM 362 O GLU A 24 7.122 -12.683 -9.911 1.00 0.00 O ATOM 363 CB GLU A 24 9.965 -14.367 -9.304 1.00 0.00 C ATOM 364 CG GLU A 24 11.123 -13.886 -8.445 1.00 0.00 C ATOM 365 CD GLU A 24 12.263 -13.319 -9.268 1.00 0.00 C ATOM 366 OE1 GLU A 24 12.469 -13.793 -10.405 1.00 0.00 O ATOM 367 OE2 GLU A 24 12.951 -12.401 -8.774 1.00 0.00 O ATOM 0 H GLU A 24 8.755 -16.112 -8.029 1.00 0.00 H new ATOM 0 HA GLU A 24 8.653 -13.263 -8.009 1.00 0.00 H new ATOM 0 HB2 GLU A 24 10.084 -15.434 -9.494 1.00 0.00 H new ATOM 0 HB3 GLU A 24 10.007 -13.864 -10.270 1.00 0.00 H new ATOM 0 HG2 GLU A 24 10.765 -13.124 -7.753 1.00 0.00 H new ATOM 0 HG3 GLU A 24 11.492 -14.716 -7.842 1.00 0.00 H new ATOM 374 N GLU A 25 7.201 -14.846 -10.527 1.00 0.00 N ATOM 375 CA GLU A 25 6.231 -14.688 -11.604 1.00 0.00 C ATOM 376 C GLU A 25 4.845 -14.379 -11.046 1.00 0.00 C ATOM 377 O GLU A 25 4.232 -13.372 -11.400 1.00 0.00 O ATOM 378 CB GLU A 25 6.177 -15.955 -12.461 1.00 0.00 C ATOM 379 CG GLU A 25 7.137 -15.933 -13.639 1.00 0.00 C ATOM 380 CD GLU A 25 6.780 -16.956 -14.701 1.00 0.00 C ATOM 381 OE1 GLU A 25 5.807 -17.710 -14.495 1.00 0.00 O ATOM 382 OE2 GLU A 25 7.475 -17.001 -15.737 1.00 0.00 O ATOM 0 H GLU A 25 7.561 -15.794 -10.418 1.00 0.00 H new ATOM 0 HA GLU A 25 6.549 -13.851 -12.225 1.00 0.00 H new ATOM 0 HB2 GLU A 25 6.403 -16.818 -11.834 1.00 0.00 H new ATOM 0 HB3 GLU A 25 5.161 -16.089 -12.833 1.00 0.00 H new ATOM 0 HG2 GLU A 25 7.138 -14.938 -14.084 1.00 0.00 H new ATOM 0 HG3 GLU A 25 8.149 -16.123 -13.282 1.00 0.00 H new ATOM 389 N ALA A 26 4.356 -15.253 -10.173 1.00 0.00 N ATOM 390 CA ALA A 26 3.043 -15.074 -9.565 1.00 0.00 C ATOM 391 C ALA A 26 2.934 -13.712 -8.887 1.00 0.00 C ATOM 392 O ALA A 26 1.886 -13.068 -8.934 1.00 0.00 O ATOM 393 CB ALA A 26 2.768 -16.187 -8.565 1.00 0.00 C ATOM 0 H ALA A 26 4.850 -16.093 -9.871 1.00 0.00 H new ATOM 0 HA ALA A 26 2.294 -15.119 -10.356 1.00 0.00 H new ATOM 0 HB1 ALA A 26 1.784 -16.040 -8.119 1.00 0.00 H new ATOM 0 HB2 ALA A 26 2.795 -17.150 -9.075 1.00 0.00 H new ATOM 0 HB3 ALA A 26 3.527 -16.169 -7.783 1.00 0.00 H new ATOM 399 N ASP A 27 4.021 -13.281 -8.258 1.00 0.00 N ATOM 400 CA ASP A 27 4.047 -11.995 -7.570 1.00 0.00 C ATOM 401 C ASP A 27 3.933 -10.844 -8.566 1.00 0.00 C ATOM 402 O ASP A 27 3.168 -9.903 -8.357 1.00 0.00 O ATOM 403 CB ASP A 27 5.333 -11.855 -6.754 1.00 0.00 C ATOM 404 CG ASP A 27 5.484 -10.475 -6.144 1.00 0.00 C ATOM 405 OD1 ASP A 27 4.732 -10.160 -5.198 1.00 0.00 O ATOM 406 OD2 ASP A 27 6.353 -9.710 -6.613 1.00 0.00 O ATOM 0 H ASP A 27 4.896 -13.803 -8.210 1.00 0.00 H new ATOM 0 HA ASP A 27 3.192 -11.954 -6.895 1.00 0.00 H new ATOM 0 HB2 ASP A 27 5.340 -12.602 -5.961 1.00 0.00 H new ATOM 0 HB3 ASP A 27 6.191 -12.062 -7.394 1.00 0.00 H new ATOM 411 N ASP A 28 4.700 -10.927 -9.647 1.00 0.00 N ATOM 412 CA ASP A 28 4.686 -9.892 -10.675 1.00 0.00 C ATOM 413 C ASP A 28 3.374 -9.917 -11.453 1.00 0.00 C ATOM 414 O ASP A 28 2.911 -8.886 -11.941 1.00 0.00 O ATOM 415 CB ASP A 28 5.865 -10.078 -11.632 1.00 0.00 C ATOM 416 CG ASP A 28 5.703 -9.282 -12.912 1.00 0.00 C ATOM 417 OD1 ASP A 28 5.832 -8.040 -12.858 1.00 0.00 O ATOM 418 OD2 ASP A 28 5.448 -9.899 -13.966 1.00 0.00 O ATOM 0 H ASP A 28 5.339 -11.700 -9.835 1.00 0.00 H new ATOM 0 HA ASP A 28 4.777 -8.924 -10.183 1.00 0.00 H new ATOM 0 HB2 ASP A 28 6.785 -9.775 -11.133 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.968 -11.135 -11.876 1.00 0.00 H new ATOM 423 N TYR A 29 2.781 -11.100 -11.565 1.00 0.00 N ATOM 424 CA TYR A 29 1.525 -11.260 -12.287 1.00 0.00 C ATOM 425 C TYR A 29 0.378 -10.585 -11.540 1.00 0.00 C ATOM 426 O TYR A 29 -0.372 -9.795 -12.115 1.00 0.00 O ATOM 427 CB TYR A 29 1.213 -12.744 -12.488 1.00 0.00 C ATOM 428 CG TYR A 29 1.342 -13.201 -13.924 1.00 0.00 C ATOM 429 CD1 TYR A 29 0.398 -12.836 -14.876 1.00 0.00 C ATOM 430 CD2 TYR A 29 2.406 -13.997 -14.327 1.00 0.00 C ATOM 431 CE1 TYR A 29 0.511 -13.252 -16.189 1.00 0.00 C ATOM 432 CE2 TYR A 29 2.528 -14.416 -15.638 1.00 0.00 C ATOM 433 CZ TYR A 29 1.578 -14.041 -16.565 1.00 0.00 C ATOM 434 OH TYR A 29 1.695 -14.457 -17.872 1.00 0.00 O ATOM 0 H TYR A 29 3.150 -11.963 -11.165 1.00 0.00 H new ATOM 0 HA TYR A 29 1.632 -10.783 -13.261 1.00 0.00 H new ATOM 0 HB2 TYR A 29 1.885 -13.335 -11.866 1.00 0.00 H new ATOM 0 HB3 TYR A 29 0.199 -12.944 -12.142 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -0.438 -12.217 -14.585 1.00 0.00 H new ATOM 0 HD2 TYR A 29 3.151 -14.294 -13.603 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -0.232 -12.961 -16.917 1.00 0.00 H new ATOM 0 HE2 TYR A 29 3.363 -15.034 -15.935 1.00 0.00 H new ATOM 0 HH TYR A 29 2.502 -15.004 -17.970 1.00 0.00 H new ATOM 444 N LEU A 30 0.249 -10.901 -10.257 1.00 0.00 N ATOM 445 CA LEU A 30 -0.805 -10.326 -9.429 1.00 0.00 C ATOM 446 C LEU A 30 -0.569 -8.836 -9.205 1.00 0.00 C ATOM 447 O LEU A 30 -1.510 -8.042 -9.198 1.00 0.00 O ATOM 448 CB LEU A 30 -0.878 -11.050 -8.084 1.00 0.00 C ATOM 449 CG LEU A 30 -1.146 -12.554 -8.145 1.00 0.00 C ATOM 450 CD1 LEU A 30 -0.328 -13.286 -7.092 1.00 0.00 C ATOM 451 CD2 LEU A 30 -2.630 -12.839 -7.964 1.00 0.00 C ATOM 0 H LEU A 30 0.862 -11.553 -9.767 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.753 -10.451 -9.953 1.00 0.00 H new ATOM 0 HB2 LEU A 30 0.062 -10.890 -7.556 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -1.662 -10.585 -7.486 1.00 0.00 H new ATOM 0 HG LEU A 30 -0.844 -12.918 -9.127 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.532 -14.355 -7.151 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.733 -13.109 -7.268 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.598 -12.919 -6.102 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -2.802 -13.914 -8.010 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -2.958 -12.460 -6.996 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.194 -12.347 -8.756 1.00 0.00 H new ATOM 463 N ASP A 31 0.693 -8.463 -9.024 1.00 0.00 N ATOM 464 CA ASP A 31 1.054 -7.067 -8.803 1.00 0.00 C ATOM 465 C ASP A 31 0.662 -6.208 -10.001 1.00 0.00 C ATOM 466 O ASP A 31 0.067 -5.142 -9.846 1.00 0.00 O ATOM 467 CB ASP A 31 2.555 -6.942 -8.539 1.00 0.00 C ATOM 468 CG ASP A 31 2.880 -6.887 -7.059 1.00 0.00 C ATOM 469 OD1 ASP A 31 2.389 -7.758 -6.310 1.00 0.00 O ATOM 470 OD2 ASP A 31 3.627 -5.974 -6.650 1.00 0.00 O ATOM 0 H ASP A 31 1.483 -9.108 -9.026 1.00 0.00 H new ATOM 0 HA ASP A 31 0.509 -6.710 -7.929 1.00 0.00 H new ATOM 0 HB2 ASP A 31 3.072 -7.789 -8.990 1.00 0.00 H new ATOM 0 HB3 ASP A 31 2.933 -6.042 -9.025 1.00 0.00 H new ATOM 475 N HIS A 32 1.002 -6.680 -11.197 1.00 0.00 N ATOM 476 CA HIS A 32 0.686 -5.954 -12.422 1.00 0.00 C ATOM 477 C HIS A 32 -0.814 -5.982 -12.699 1.00 0.00 C ATOM 478 O HIS A 32 -1.355 -5.079 -13.339 1.00 0.00 O ATOM 479 CB HIS A 32 1.446 -6.555 -13.605 1.00 0.00 C ATOM 480 CG HIS A 32 2.539 -5.672 -14.125 1.00 0.00 C ATOM 481 ND1 HIS A 32 2.707 -5.393 -15.465 1.00 0.00 N ATOM 482 CD2 HIS A 32 3.521 -5.004 -13.477 1.00 0.00 C ATOM 483 CE1 HIS A 32 3.747 -4.592 -15.618 1.00 0.00 C ATOM 484 NE2 HIS A 32 4.258 -4.341 -14.427 1.00 0.00 N ATOM 0 H HIS A 32 1.496 -7.561 -11.343 1.00 0.00 H new ATOM 0 HA HIS A 32 0.994 -4.917 -12.290 1.00 0.00 H new ATOM 0 HB2 HIS A 32 1.875 -7.511 -13.303 1.00 0.00 H new ATOM 0 HB3 HIS A 32 0.742 -6.762 -14.411 1.00 0.00 H new ATOM 0 HD2 HIS A 32 3.693 -4.994 -12.411 1.00 0.00 H new ATOM 0 HE1 HIS A 32 4.116 -4.208 -16.558 1.00 0.00 H new ATOM 0 HE2 HIS A 32 5.069 -3.750 -14.242 1.00 0.00 H new ATOM 492 N LEU A 33 -1.481 -7.024 -12.214 1.00 0.00 N ATOM 493 CA LEU A 33 -2.919 -7.170 -12.409 1.00 0.00 C ATOM 494 C LEU A 33 -3.685 -6.101 -11.637 1.00 0.00 C ATOM 495 O LEU A 33 -4.497 -5.370 -12.206 1.00 0.00 O ATOM 496 CB LEU A 33 -3.375 -8.561 -11.966 1.00 0.00 C ATOM 497 CG LEU A 33 -4.187 -9.359 -12.987 1.00 0.00 C ATOM 498 CD1 LEU A 33 -5.637 -8.900 -12.992 1.00 0.00 C ATOM 499 CD2 LEU A 33 -3.578 -9.224 -14.375 1.00 0.00 C ATOM 0 H LEU A 33 -1.049 -7.780 -11.683 1.00 0.00 H new ATOM 0 HA LEU A 33 -3.131 -7.046 -13.471 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -2.493 -9.143 -11.699 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -3.972 -8.454 -11.060 1.00 0.00 H new ATOM 0 HG LEU A 33 -4.161 -10.411 -12.701 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -6.199 -9.479 -13.725 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.069 -9.049 -12.002 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.683 -7.843 -13.253 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.169 -9.798 -15.089 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -3.573 -8.175 -14.669 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.556 -9.602 -14.362 1.00 0.00 H new ATOM 511 N LEU A 34 -3.420 -6.014 -10.338 1.00 0.00 N ATOM 512 CA LEU A 34 -4.083 -5.032 -9.487 1.00 0.00 C ATOM 513 C LEU A 34 -3.614 -3.619 -9.818 1.00 0.00 C ATOM 514 O LEU A 34 -4.338 -2.647 -9.602 1.00 0.00 O ATOM 515 CB LEU A 34 -3.812 -5.339 -8.013 1.00 0.00 C ATOM 516 CG LEU A 34 -2.348 -5.569 -7.634 1.00 0.00 C ATOM 517 CD1 LEU A 34 -1.726 -4.285 -7.107 1.00 0.00 C ATOM 518 CD2 LEU A 34 -2.233 -6.682 -6.602 1.00 0.00 C ATOM 0 H LEU A 34 -2.751 -6.611 -9.851 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.155 -5.092 -9.673 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.196 -4.514 -7.414 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.382 -6.226 -7.736 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.804 -5.872 -8.528 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -0.684 -4.467 -6.842 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.775 -3.514 -7.876 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -2.272 -3.952 -6.224 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -1.185 -6.832 -6.344 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -2.791 -6.407 -5.707 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.641 -7.605 -7.015 1.00 0.00 H new ATOM 530 N ASP A 35 -2.399 -3.513 -10.345 1.00 0.00 N ATOM 531 CA ASP A 35 -1.834 -2.219 -10.709 1.00 0.00 C ATOM 532 C ASP A 35 -2.558 -1.630 -11.916 1.00 0.00 C ATOM 533 O ASP A 35 -2.878 -0.441 -11.941 1.00 0.00 O ATOM 534 CB ASP A 35 -0.341 -2.358 -11.013 1.00 0.00 C ATOM 535 CG ASP A 35 0.374 -1.021 -11.026 1.00 0.00 C ATOM 536 OD1 ASP A 35 0.183 -0.237 -10.073 1.00 0.00 O ATOM 537 OD2 ASP A 35 1.125 -0.759 -11.988 1.00 0.00 O ATOM 0 H ASP A 35 -1.787 -4.308 -10.530 1.00 0.00 H new ATOM 0 HA ASP A 35 -1.964 -1.543 -9.864 1.00 0.00 H new ATOM 0 HB2 ASP A 35 0.120 -3.006 -10.267 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -0.214 -2.844 -11.980 1.00 0.00 H new ATOM 542 N SER A 36 -2.813 -2.469 -12.915 1.00 0.00 N ATOM 543 CA SER A 36 -3.496 -2.030 -14.126 1.00 0.00 C ATOM 544 C SER A 36 -4.975 -1.777 -13.855 1.00 0.00 C ATOM 545 O SER A 36 -5.530 -0.761 -14.275 1.00 0.00 O ATOM 546 CB SER A 36 -3.340 -3.076 -15.232 1.00 0.00 C ATOM 547 OG SER A 36 -3.277 -2.464 -16.508 1.00 0.00 O ATOM 0 H SER A 36 -2.557 -3.456 -12.910 1.00 0.00 H new ATOM 0 HA SER A 36 -3.040 -1.095 -14.452 1.00 0.00 H new ATOM 0 HB2 SER A 36 -2.435 -3.659 -15.060 1.00 0.00 H new ATOM 0 HB3 SER A 36 -4.179 -3.771 -15.200 1.00 0.00 H new ATOM 0 HG SER A 36 -3.176 -3.154 -17.197 1.00 0.00 H new ATOM 553 N LEU A 37 -5.609 -2.708 -13.151 1.00 0.00 N ATOM 554 CA LEU A 37 -7.025 -2.587 -12.822 1.00 0.00 C ATOM 555 C LEU A 37 -7.271 -1.397 -11.900 1.00 0.00 C ATOM 556 O LEU A 37 -8.222 -0.640 -12.089 1.00 0.00 O ATOM 557 CB LEU A 37 -7.527 -3.872 -12.160 1.00 0.00 C ATOM 558 CG LEU A 37 -8.312 -4.828 -13.059 1.00 0.00 C ATOM 559 CD1 LEU A 37 -9.343 -4.065 -13.877 1.00 0.00 C ATOM 560 CD2 LEU A 37 -7.369 -5.599 -13.970 1.00 0.00 C ATOM 0 H LEU A 37 -5.165 -3.555 -12.797 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.575 -2.424 -13.749 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.668 -4.408 -11.756 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -8.159 -3.599 -11.315 1.00 0.00 H new ATOM 0 HG LEU A 37 -8.838 -5.543 -12.426 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.892 -4.761 -14.511 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.038 -3.559 -13.206 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.839 -3.327 -14.501 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.945 -6.274 -14.602 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.815 -4.900 -14.596 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.670 -6.176 -13.365 1.00 0.00 H new ATOM 572 N GLU A 38 -6.405 -1.239 -10.903 1.00 0.00 N ATOM 573 CA GLU A 38 -6.528 -0.140 -9.953 1.00 0.00 C ATOM 574 C GLU A 38 -6.375 1.207 -10.656 1.00 0.00 C ATOM 575 O GLU A 38 -7.100 2.157 -10.361 1.00 0.00 O ATOM 576 CB GLU A 38 -5.478 -0.272 -8.848 1.00 0.00 C ATOM 577 CG GLU A 38 -5.781 -1.378 -7.851 1.00 0.00 C ATOM 578 CD GLU A 38 -4.535 -1.897 -7.160 1.00 0.00 C ATOM 579 OE1 GLU A 38 -3.422 -1.509 -7.572 1.00 0.00 O ATOM 580 OE2 GLU A 38 -4.673 -2.693 -6.207 1.00 0.00 O ATOM 0 H GLU A 38 -5.612 -1.858 -10.733 1.00 0.00 H new ATOM 0 HA GLU A 38 -7.522 -0.188 -9.508 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -4.506 -0.460 -9.303 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -5.402 0.676 -8.315 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -6.479 -1.005 -7.102 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -6.276 -2.201 -8.366 1.00 0.00 H new ATOM 587 N GLU A 39 -5.428 1.278 -11.585 1.00 0.00 N ATOM 588 CA GLU A 39 -5.180 2.508 -12.329 1.00 0.00 C ATOM 589 C GLU A 39 -6.353 2.834 -13.249 1.00 0.00 C ATOM 590 O GLU A 39 -6.641 4.001 -13.517 1.00 0.00 O ATOM 591 CB GLU A 39 -3.894 2.384 -13.149 1.00 0.00 C ATOM 592 CG GLU A 39 -3.011 3.619 -13.088 1.00 0.00 C ATOM 593 CD GLU A 39 -2.125 3.764 -14.310 1.00 0.00 C ATOM 594 OE1 GLU A 39 -2.428 3.127 -15.341 1.00 0.00 O ATOM 595 OE2 GLU A 39 -1.128 4.512 -14.235 1.00 0.00 O ATOM 0 H GLU A 39 -4.820 0.500 -11.841 1.00 0.00 H new ATOM 0 HA GLU A 39 -5.068 3.320 -11.611 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -3.327 1.524 -12.792 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -4.154 2.185 -14.189 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -3.638 4.505 -12.992 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -2.387 3.571 -12.195 1.00 0.00 H new ATOM 602 N LEU A 40 -7.026 1.795 -13.730 1.00 0.00 N ATOM 603 CA LEU A 40 -8.168 1.969 -14.621 1.00 0.00 C ATOM 604 C LEU A 40 -9.427 2.313 -13.831 1.00 0.00 C ATOM 605 O LEU A 40 -10.211 3.172 -14.237 1.00 0.00 O ATOM 606 CB LEU A 40 -8.398 0.698 -15.441 1.00 0.00 C ATOM 607 CG LEU A 40 -7.531 0.540 -16.690 1.00 0.00 C ATOM 608 CD1 LEU A 40 -7.979 -0.667 -17.501 1.00 0.00 C ATOM 609 CD2 LEU A 40 -7.581 1.803 -17.538 1.00 0.00 C ATOM 0 H LEU A 40 -6.801 0.823 -13.518 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.948 2.795 -15.297 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.229 -0.163 -14.794 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -9.445 0.669 -15.744 1.00 0.00 H new ATOM 0 HG LEU A 40 -6.500 0.379 -16.375 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -7.351 -0.764 -18.386 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -7.890 -1.567 -16.893 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -9.017 -0.536 -17.806 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.958 1.672 -18.423 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -8.609 1.996 -17.844 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.211 2.647 -16.956 1.00 0.00 H new ATOM 621 N SER A 41 -9.613 1.639 -12.701 1.00 0.00 N ATOM 622 CA SER A 41 -10.778 1.873 -11.855 1.00 0.00 C ATOM 623 C SER A 41 -10.706 3.249 -11.200 1.00 0.00 C ATOM 624 O SER A 41 -11.727 3.820 -10.818 1.00 0.00 O ATOM 625 CB SER A 41 -10.880 0.789 -10.780 1.00 0.00 C ATOM 626 OG SER A 41 -11.162 1.353 -9.511 1.00 0.00 O ATOM 0 H SER A 41 -8.973 0.927 -12.350 1.00 0.00 H new ATOM 0 HA SER A 41 -11.667 1.835 -12.485 1.00 0.00 H new ATOM 0 HB2 SER A 41 -11.663 0.079 -11.048 1.00 0.00 H new ATOM 0 HB3 SER A 41 -9.945 0.230 -10.733 1.00 0.00 H new ATOM 0 HG SER A 41 -12.118 1.259 -9.316 1.00 0.00 H new ATOM 632 N GLU A 42 -9.492 3.775 -11.073 1.00 0.00 N ATOM 633 CA GLU A 42 -9.287 5.083 -10.463 1.00 0.00 C ATOM 634 C GLU A 42 -9.644 6.200 -11.439 1.00 0.00 C ATOM 635 O GLU A 42 -10.333 7.155 -11.081 1.00 0.00 O ATOM 636 CB GLU A 42 -7.834 5.235 -10.006 1.00 0.00 C ATOM 637 CG GLU A 42 -7.609 4.849 -8.554 1.00 0.00 C ATOM 638 CD GLU A 42 -7.590 6.049 -7.628 1.00 0.00 C ATOM 639 OE1 GLU A 42 -8.676 6.592 -7.336 1.00 0.00 O ATOM 640 OE2 GLU A 42 -6.488 6.446 -7.194 1.00 0.00 O ATOM 0 H GLU A 42 -8.636 3.316 -11.384 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.943 5.158 -9.596 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -7.196 4.619 -10.640 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -7.523 6.270 -10.150 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -8.395 4.163 -8.238 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -6.664 4.312 -8.467 1.00 0.00 H new ATOM 647 N ALA A 43 -9.170 6.073 -12.674 1.00 0.00 N ATOM 648 CA ALA A 43 -9.440 7.070 -13.703 1.00 0.00 C ATOM 649 C ALA A 43 -10.910 7.059 -14.106 1.00 0.00 C ATOM 650 O ALA A 43 -11.370 7.934 -14.840 1.00 0.00 O ATOM 651 CB ALA A 43 -8.556 6.828 -14.918 1.00 0.00 C ATOM 0 H ALA A 43 -8.597 5.289 -12.986 1.00 0.00 H new ATOM 0 HA ALA A 43 -9.211 8.053 -13.290 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.768 7.580 -15.678 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -7.508 6.895 -14.625 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -8.757 5.836 -15.323 1.00 0.00 H new ATOM 657 N HIS A 44 -11.644 6.062 -13.621 1.00 0.00 N ATOM 658 CA HIS A 44 -13.064 5.937 -13.931 1.00 0.00 C ATOM 659 C HIS A 44 -13.273 5.648 -15.415 1.00 0.00 C ATOM 660 O HIS A 44 -13.303 6.552 -16.250 1.00 0.00 O ATOM 661 CB HIS A 44 -13.808 7.214 -13.539 1.00 0.00 C ATOM 662 CG HIS A 44 -14.903 7.586 -14.491 1.00 0.00 C ATOM 663 ND1 HIS A 44 -15.706 6.655 -15.115 1.00 0.00 N ATOM 664 CD2 HIS A 44 -15.326 8.797 -14.923 1.00 0.00 C ATOM 665 CE1 HIS A 44 -16.575 7.277 -15.891 1.00 0.00 C ATOM 666 NE2 HIS A 44 -16.367 8.577 -15.792 1.00 0.00 N ATOM 0 H HIS A 44 -11.279 5.329 -13.012 1.00 0.00 H new ATOM 0 HA HIS A 44 -13.464 5.102 -13.356 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -14.232 7.086 -12.543 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -13.095 8.036 -13.479 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -14.921 9.757 -14.638 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -17.328 6.803 -16.503 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -16.894 9.301 -16.281 1.00 0.00 H new ATOM 674 N PRO A 45 -13.419 4.358 -15.752 1.00 0.00 N ATOM 675 CA PRO A 45 -13.627 3.921 -17.136 1.00 0.00 C ATOM 676 C PRO A 45 -14.999 4.318 -17.669 1.00 0.00 C ATOM 677 O PRO A 45 -15.112 4.897 -18.750 1.00 0.00 O ATOM 678 CB PRO A 45 -13.508 2.397 -17.048 1.00 0.00 C ATOM 679 CG PRO A 45 -13.871 2.069 -15.640 1.00 0.00 C ATOM 680 CD PRO A 45 -13.394 3.228 -14.809 1.00 0.00 C ATOM 0 HA PRO A 45 -12.913 4.379 -17.820 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -14.178 1.906 -17.754 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -12.497 2.065 -17.284 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -14.947 1.931 -15.536 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -13.399 1.140 -15.321 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -14.046 3.404 -13.954 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -12.392 3.055 -14.416 1.00 0.00 H new ATOM 688 N ASP A 46 -16.040 4.003 -16.905 1.00 0.00 N ATOM 689 CA ASP A 46 -17.405 4.328 -17.301 1.00 0.00 C ATOM 690 C ASP A 46 -18.314 4.431 -16.080 1.00 0.00 C ATOM 691 O ASP A 46 -18.946 5.462 -15.849 1.00 0.00 O ATOM 692 CB ASP A 46 -17.944 3.272 -18.267 1.00 0.00 C ATOM 693 CG ASP A 46 -18.780 3.877 -19.378 1.00 0.00 C ATOM 694 OD1 ASP A 46 -18.544 5.053 -19.724 1.00 0.00 O ATOM 695 OD2 ASP A 46 -19.670 3.175 -19.901 1.00 0.00 O ATOM 0 H ASP A 46 -15.964 3.523 -16.008 1.00 0.00 H new ATOM 0 HA ASP A 46 -17.391 5.295 -17.804 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -17.110 2.722 -18.702 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -18.547 2.551 -17.714 1.00 0.00 H new ATOM 700 N CYS A 47 -18.377 3.355 -15.303 1.00 0.00 N ATOM 701 CA CYS A 47 -19.211 3.323 -14.107 1.00 0.00 C ATOM 702 C CYS A 47 -18.391 3.652 -12.864 1.00 0.00 C ATOM 703 O CYS A 47 -18.206 4.820 -12.522 1.00 0.00 O ATOM 704 CB CYS A 47 -19.865 1.949 -13.953 1.00 0.00 C ATOM 705 SG CYS A 47 -21.103 1.574 -15.216 1.00 0.00 S ATOM 0 H CYS A 47 -17.860 2.493 -15.480 1.00 0.00 H new ATOM 0 HA CYS A 47 -19.990 4.078 -14.216 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -19.089 1.184 -13.982 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -20.334 1.890 -12.971 1.00 0.00 H new ATOM 0 HG CYS A 47 -20.991 0.330 -15.578 1.00 0.00 H new ATOM 711 N ILE A 48 -17.903 2.615 -12.191 1.00 0.00 N ATOM 712 CA ILE A 48 -17.104 2.794 -10.986 1.00 0.00 C ATOM 713 C ILE A 48 -16.676 1.450 -10.405 1.00 0.00 C ATOM 714 O ILE A 48 -17.118 1.041 -9.332 1.00 0.00 O ATOM 715 CB ILE A 48 -17.875 3.582 -9.911 1.00 0.00 C ATOM 716 CG1 ILE A 48 -16.976 3.856 -8.704 1.00 0.00 C ATOM 717 CG2 ILE A 48 -19.122 2.820 -9.487 1.00 0.00 C ATOM 718 CD1 ILE A 48 -15.508 3.961 -9.056 1.00 0.00 C ATOM 0 H ILE A 48 -18.047 1.642 -12.460 1.00 0.00 H new ATOM 0 HA ILE A 48 -16.219 3.361 -11.276 1.00 0.00 H new ATOM 0 HB ILE A 48 -18.183 4.538 -10.335 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -17.294 4.783 -8.227 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -17.110 3.059 -7.973 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -19.656 3.390 -8.727 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -19.770 2.672 -10.351 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -18.835 1.851 -9.079 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -14.930 4.156 -8.153 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -15.174 3.026 -9.506 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -15.361 4.777 -9.764 1.00 0.00 H new ATOM 730 N PRO A 49 -15.793 0.747 -11.130 1.00 0.00 N ATOM 731 CA PRO A 49 -15.283 -0.560 -10.705 1.00 0.00 C ATOM 732 C PRO A 49 -14.358 -0.457 -9.497 1.00 0.00 C ATOM 733 O PRO A 49 -13.339 0.232 -9.541 1.00 0.00 O ATOM 734 CB PRO A 49 -14.509 -1.054 -11.930 1.00 0.00 C ATOM 735 CG PRO A 49 -14.115 0.187 -12.655 1.00 0.00 C ATOM 736 CD PRO A 49 -15.224 1.174 -12.419 1.00 0.00 C ATOM 0 HA PRO A 49 -16.085 -1.228 -10.392 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -13.635 -1.636 -11.638 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -15.127 -1.699 -12.555 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -13.165 0.571 -12.283 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -13.986 -0.007 -13.720 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -14.849 2.196 -12.374 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -15.967 1.142 -13.216 1.00 0.00 H new ATOM 744 N ASP A 50 -14.720 -1.146 -8.421 1.00 0.00 N ATOM 745 CA ASP A 50 -13.921 -1.133 -7.201 1.00 0.00 C ATOM 746 C ASP A 50 -12.741 -2.094 -7.313 1.00 0.00 C ATOM 747 O ASP A 50 -12.868 -3.187 -7.863 1.00 0.00 O ATOM 748 CB ASP A 50 -14.786 -1.507 -5.996 1.00 0.00 C ATOM 749 CG ASP A 50 -14.925 -0.366 -5.007 1.00 0.00 C ATOM 750 OD1 ASP A 50 -13.891 0.232 -4.641 1.00 0.00 O ATOM 751 OD2 ASP A 50 -16.068 -0.070 -4.600 1.00 0.00 O ATOM 0 H ASP A 50 -15.561 -1.720 -8.368 1.00 0.00 H new ATOM 0 HA ASP A 50 -13.533 -0.124 -7.061 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -15.775 -1.807 -6.342 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -14.349 -2.369 -5.492 1.00 0.00 H new ATOM 756 N VAL A 51 -11.593 -1.677 -6.789 1.00 0.00 N ATOM 757 CA VAL A 51 -10.390 -2.500 -6.831 1.00 0.00 C ATOM 758 C VAL A 51 -10.001 -2.975 -5.435 1.00 0.00 C ATOM 759 O VAL A 51 -10.145 -2.242 -4.457 1.00 0.00 O ATOM 760 CB VAL A 51 -9.206 -1.732 -7.448 1.00 0.00 C ATOM 761 CG1 VAL A 51 -9.582 -1.179 -8.815 1.00 0.00 C ATOM 762 CG2 VAL A 51 -8.752 -0.616 -6.519 1.00 0.00 C ATOM 0 H VAL A 51 -11.471 -0.774 -6.330 1.00 0.00 H new ATOM 0 HA VAL A 51 -10.618 -3.364 -7.456 1.00 0.00 H new ATOM 0 HB VAL A 51 -8.375 -2.425 -7.579 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -8.733 -0.640 -9.235 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -9.854 -2.001 -9.478 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -10.429 -0.500 -8.713 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.915 -0.084 -6.971 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -9.576 0.078 -6.354 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -8.439 -1.041 -5.565 1.00 0.00 H new ATOM 772 N GLU A 52 -9.507 -4.206 -5.352 1.00 0.00 N ATOM 773 CA GLU A 52 -9.097 -4.779 -4.075 1.00 0.00 C ATOM 774 C GLU A 52 -7.969 -5.789 -4.269 1.00 0.00 C ATOM 775 O GLU A 52 -8.068 -6.696 -5.097 1.00 0.00 O ATOM 776 CB GLU A 52 -10.286 -5.452 -3.387 1.00 0.00 C ATOM 777 CG GLU A 52 -11.633 -5.028 -3.949 1.00 0.00 C ATOM 778 CD GLU A 52 -12.793 -5.474 -3.080 1.00 0.00 C ATOM 779 OE1 GLU A 52 -12.883 -5.004 -1.926 1.00 0.00 O ATOM 780 OE2 GLU A 52 -13.611 -6.290 -3.553 1.00 0.00 O ATOM 0 H GLU A 52 -9.381 -4.825 -6.153 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.732 -3.969 -3.443 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.186 -6.533 -3.482 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -10.257 -5.222 -2.322 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -11.655 -3.943 -4.050 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -11.752 -5.444 -4.950 1.00 0.00 H new ATOM 787 N LEU A 53 -6.898 -5.626 -3.501 1.00 0.00 N ATOM 788 CA LEU A 53 -5.751 -6.522 -3.587 1.00 0.00 C ATOM 789 C LEU A 53 -5.489 -7.203 -2.247 1.00 0.00 C ATOM 790 O LEU A 53 -5.232 -6.539 -1.243 1.00 0.00 O ATOM 791 CB LEU A 53 -4.507 -5.750 -4.031 1.00 0.00 C ATOM 792 CG LEU A 53 -3.161 -6.366 -3.647 1.00 0.00 C ATOM 793 CD1 LEU A 53 -2.848 -6.094 -2.184 1.00 0.00 C ATOM 794 CD2 LEU A 53 -3.161 -7.862 -3.926 1.00 0.00 C ATOM 0 H LEU A 53 -6.800 -4.881 -2.811 1.00 0.00 H new ATOM 0 HA LEU A 53 -5.977 -7.291 -4.326 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.538 -5.643 -5.115 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.558 -4.746 -3.610 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.384 -5.903 -4.255 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.887 -6.540 -1.929 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -2.805 -5.018 -2.015 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.627 -6.529 -1.558 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.196 -8.284 -3.647 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.948 -8.341 -3.344 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.339 -8.034 -4.987 1.00 0.00 H new ATOM 806 N SER A 54 -5.554 -8.530 -2.241 1.00 0.00 N ATOM 807 CA SER A 54 -5.326 -9.301 -1.024 1.00 0.00 C ATOM 808 C SER A 54 -4.101 -10.199 -1.171 1.00 0.00 C ATOM 809 O SER A 54 -3.615 -10.428 -2.279 1.00 0.00 O ATOM 810 CB SER A 54 -6.556 -10.147 -0.693 1.00 0.00 C ATOM 811 OG SER A 54 -7.172 -9.706 0.505 1.00 0.00 O ATOM 0 H SER A 54 -5.763 -9.094 -3.065 1.00 0.00 H new ATOM 0 HA SER A 54 -5.146 -8.601 -0.208 1.00 0.00 H new ATOM 0 HB2 SER A 54 -7.270 -10.092 -1.514 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.265 -11.193 -0.592 1.00 0.00 H new ATOM 0 HG SER A 54 -7.957 -10.262 0.693 1.00 0.00 H new ATOM 817 N HIS A 55 -3.608 -10.705 -0.046 1.00 0.00 N ATOM 818 CA HIS A 55 -2.440 -11.579 -0.048 1.00 0.00 C ATOM 819 C HIS A 55 -2.667 -12.786 -0.954 1.00 0.00 C ATOM 820 O HIS A 55 -3.225 -13.797 -0.530 1.00 0.00 O ATOM 821 CB HIS A 55 -2.123 -12.046 1.373 1.00 0.00 C ATOM 822 CG HIS A 55 -1.136 -11.172 2.084 1.00 0.00 C ATOM 823 ND1 HIS A 55 -0.939 -11.215 3.448 1.00 0.00 N ATOM 824 CD2 HIS A 55 -0.287 -10.230 1.612 1.00 0.00 C ATOM 825 CE1 HIS A 55 -0.013 -10.335 3.785 1.00 0.00 C ATOM 826 NE2 HIS A 55 0.400 -9.725 2.689 1.00 0.00 N ATOM 0 H HIS A 55 -3.999 -10.525 0.879 1.00 0.00 H new ATOM 0 HA HIS A 55 -1.593 -11.011 -0.433 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -3.047 -12.081 1.950 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -1.733 -13.063 1.334 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -0.171 -9.931 0.581 1.00 0.00 H new ATOM 0 HE1 HIS A 55 0.345 -10.147 4.786 1.00 0.00 H new ATOM 0 HE2 HIS A 55 1.113 -8.997 2.649 1.00 0.00 H new ATOM 834 N GLY A 56 -2.230 -12.672 -2.205 1.00 0.00 N ATOM 835 CA GLY A 56 -2.396 -13.760 -3.151 1.00 0.00 C ATOM 836 C GLY A 56 -3.762 -13.754 -3.808 1.00 0.00 C ATOM 837 O GLY A 56 -4.208 -14.771 -4.339 1.00 0.00 O ATOM 0 H GLY A 56 -1.764 -11.846 -2.580 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -1.626 -13.690 -3.920 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -2.248 -14.710 -2.637 1.00 0.00 H new ATOM 841 N VAL A 57 -4.429 -12.605 -3.773 1.00 0.00 N ATOM 842 CA VAL A 57 -5.752 -12.470 -4.369 1.00 0.00 C ATOM 843 C VAL A 57 -5.954 -11.076 -4.951 1.00 0.00 C ATOM 844 O VAL A 57 -5.396 -10.098 -4.454 1.00 0.00 O ATOM 845 CB VAL A 57 -6.863 -12.750 -3.339 1.00 0.00 C ATOM 846 CG1 VAL A 57 -8.147 -13.170 -4.039 1.00 0.00 C ATOM 847 CG2 VAL A 57 -6.414 -13.814 -2.349 1.00 0.00 C ATOM 0 H VAL A 57 -4.074 -11.754 -3.338 1.00 0.00 H new ATOM 0 HA VAL A 57 -5.814 -13.207 -5.170 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.062 -11.832 -2.786 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -8.920 -13.364 -3.295 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -8.476 -12.372 -4.705 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -7.966 -14.075 -4.618 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.210 -14.000 -1.628 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -6.186 -14.736 -2.884 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -5.523 -13.470 -1.824 1.00 0.00 H new ATOM 857 N MET A 58 -6.756 -10.992 -6.008 1.00 0.00 N ATOM 858 CA MET A 58 -7.033 -9.716 -6.657 1.00 0.00 C ATOM 859 C MET A 58 -8.533 -9.521 -6.856 1.00 0.00 C ATOM 860 O MET A 58 -9.094 -9.934 -7.871 1.00 0.00 O ATOM 861 CB MET A 58 -6.314 -9.638 -8.005 1.00 0.00 C ATOM 862 CG MET A 58 -5.818 -8.243 -8.350 1.00 0.00 C ATOM 863 SD MET A 58 -6.652 -7.545 -9.787 1.00 0.00 S ATOM 864 CE MET A 58 -7.930 -6.570 -8.997 1.00 0.00 C ATOM 0 H MET A 58 -7.225 -11.792 -6.433 1.00 0.00 H new ATOM 0 HA MET A 58 -6.664 -8.920 -6.010 1.00 0.00 H new ATOM 0 HB2 MET A 58 -5.467 -10.324 -7.996 1.00 0.00 H new ATOM 0 HB3 MET A 58 -6.991 -9.978 -8.789 1.00 0.00 H new ATOM 0 HG2 MET A 58 -5.968 -7.586 -7.493 1.00 0.00 H new ATOM 0 HG3 MET A 58 -4.745 -8.280 -8.540 1.00 0.00 H new ATOM 0 HE1 MET A 58 -8.295 -5.816 -9.694 1.00 0.00 H new ATOM 0 HE2 MET A 58 -8.753 -7.220 -8.702 1.00 0.00 H new ATOM 0 HE3 MET A 58 -7.520 -6.080 -8.114 1.00 0.00 H new ATOM 874 N THR A 59 -9.178 -8.890 -5.879 1.00 0.00 N ATOM 875 CA THR A 59 -10.613 -8.642 -5.947 1.00 0.00 C ATOM 876 C THR A 59 -10.910 -7.324 -6.653 1.00 0.00 C ATOM 877 O THR A 59 -10.299 -6.297 -6.356 1.00 0.00 O ATOM 878 CB THR A 59 -11.244 -8.613 -4.542 1.00 0.00 C ATOM 879 OG1 THR A 59 -10.256 -8.926 -3.554 1.00 0.00 O ATOM 880 CG2 THR A 59 -12.395 -9.603 -4.446 1.00 0.00 C ATOM 0 H THR A 59 -8.729 -8.542 -5.032 1.00 0.00 H new ATOM 0 HA THR A 59 -11.050 -9.462 -6.517 1.00 0.00 H new ATOM 0 HB THR A 59 -11.631 -7.610 -4.363 1.00 0.00 H new ATOM 0 HG1 THR A 59 -10.665 -8.904 -2.664 1.00 0.00 H new ATOM 0 HG21 THR A 59 -12.825 -9.565 -3.445 1.00 0.00 H new ATOM 0 HG22 THR A 59 -13.159 -9.345 -5.179 1.00 0.00 H new ATOM 0 HG23 THR A 59 -12.027 -10.609 -4.645 1.00 0.00 H new ATOM 888 N LEU A 60 -11.853 -7.360 -7.588 1.00 0.00 N ATOM 889 CA LEU A 60 -12.233 -6.167 -8.337 1.00 0.00 C ATOM 890 C LEU A 60 -13.745 -6.099 -8.522 1.00 0.00 C ATOM 891 O LEU A 60 -14.324 -6.884 -9.272 1.00 0.00 O ATOM 892 CB LEU A 60 -11.540 -6.154 -9.701 1.00 0.00 C ATOM 893 CG LEU A 60 -11.988 -5.061 -10.671 1.00 0.00 C ATOM 894 CD1 LEU A 60 -11.215 -3.775 -10.420 1.00 0.00 C ATOM 895 CD2 LEU A 60 -11.810 -5.520 -12.111 1.00 0.00 C ATOM 0 H LEU A 60 -12.368 -8.202 -7.846 1.00 0.00 H new ATOM 0 HA LEU A 60 -11.915 -5.294 -7.767 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -10.467 -6.051 -9.540 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -11.700 -7.122 -10.177 1.00 0.00 H new ATOM 0 HG LEU A 60 -13.047 -4.863 -10.502 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -11.547 -3.008 -11.120 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -11.393 -3.437 -9.399 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -10.150 -3.957 -10.561 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -12.134 -4.729 -12.788 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -10.759 -5.746 -12.294 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -12.409 -6.414 -12.285 1.00 0.00 H new ATOM 907 N GLU A 61 -14.379 -5.153 -7.835 1.00 0.00 N ATOM 908 CA GLU A 61 -15.824 -4.982 -7.925 1.00 0.00 C ATOM 909 C GLU A 61 -16.199 -4.154 -9.151 1.00 0.00 C ATOM 910 O GLU A 61 -15.510 -3.195 -9.499 1.00 0.00 O ATOM 911 CB GLU A 61 -16.360 -4.311 -6.659 1.00 0.00 C ATOM 912 CG GLU A 61 -17.499 -3.340 -6.921 1.00 0.00 C ATOM 913 CD GLU A 61 -18.718 -4.017 -7.517 1.00 0.00 C ATOM 914 OE1 GLU A 61 -18.786 -5.263 -7.469 1.00 0.00 O ATOM 915 OE2 GLU A 61 -19.604 -3.302 -8.030 1.00 0.00 O ATOM 0 H GLU A 61 -13.914 -4.494 -7.210 1.00 0.00 H new ATOM 0 HA GLU A 61 -16.276 -5.969 -8.023 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -16.702 -5.081 -5.967 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -15.546 -3.779 -6.167 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -17.779 -2.854 -5.987 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -17.156 -2.557 -7.597 1.00 0.00 H new ATOM 922 N ILE A 62 -17.294 -4.533 -9.801 1.00 0.00 N ATOM 923 CA ILE A 62 -17.760 -3.826 -10.987 1.00 0.00 C ATOM 924 C ILE A 62 -19.277 -3.669 -10.972 1.00 0.00 C ATOM 925 O ILE A 62 -20.022 -4.555 -11.392 1.00 0.00 O ATOM 926 CB ILE A 62 -17.344 -4.556 -12.278 1.00 0.00 C ATOM 927 CG1 ILE A 62 -15.821 -4.685 -12.348 1.00 0.00 C ATOM 928 CG2 ILE A 62 -17.875 -3.819 -13.498 1.00 0.00 C ATOM 929 CD1 ILE A 62 -15.325 -5.292 -13.641 1.00 0.00 C ATOM 0 H ILE A 62 -17.875 -5.325 -9.526 1.00 0.00 H new ATOM 0 HA ILE A 62 -17.294 -2.841 -10.970 1.00 0.00 H new ATOM 0 HB ILE A 62 -17.775 -5.557 -12.267 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -15.375 -3.698 -12.225 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -15.478 -5.297 -11.514 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -17.573 -4.347 -14.402 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -18.963 -3.774 -13.451 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -17.470 -2.807 -13.516 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -14.237 -5.353 -13.621 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -15.742 -6.292 -13.757 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -15.638 -4.669 -14.479 1.00 0.00 H new ATOM 941 N PRO A 63 -19.747 -2.513 -10.479 1.00 0.00 N ATOM 942 CA PRO A 63 -21.179 -2.211 -10.400 1.00 0.00 C ATOM 943 C PRO A 63 -21.802 -1.991 -11.775 1.00 0.00 C ATOM 944 O PRO A 63 -21.911 -0.859 -12.244 1.00 0.00 O ATOM 945 CB PRO A 63 -21.224 -0.919 -9.580 1.00 0.00 C ATOM 946 CG PRO A 63 -19.896 -0.282 -9.803 1.00 0.00 C ATOM 947 CD PRO A 63 -18.917 -1.413 -9.962 1.00 0.00 C ATOM 0 HA PRO A 63 -21.745 -3.032 -9.960 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -22.035 -0.269 -9.909 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -21.391 -1.127 -8.523 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -19.910 0.350 -10.691 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -19.623 0.356 -8.962 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -18.115 -1.156 -10.654 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -18.448 -1.675 -9.013 1.00 0.00 H new ATOM 955 N ALA A 64 -22.210 -3.082 -12.415 1.00 0.00 N ATOM 956 CA ALA A 64 -22.825 -3.008 -13.735 1.00 0.00 C ATOM 957 C ALA A 64 -22.798 -4.365 -14.430 1.00 0.00 C ATOM 958 O ALA A 64 -23.700 -4.698 -15.199 1.00 0.00 O ATOM 959 CB ALA A 64 -22.121 -1.962 -14.587 1.00 0.00 C ATOM 0 H ALA A 64 -22.126 -4.027 -12.041 1.00 0.00 H new ATOM 0 HA ALA A 64 -23.867 -2.715 -13.607 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -22.590 -1.917 -15.570 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -22.197 -0.988 -14.104 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -21.070 -2.231 -14.698 1.00 0.00 H new ATOM 965 N PHE A 65 -21.758 -5.145 -14.155 1.00 0.00 N ATOM 966 CA PHE A 65 -21.613 -6.466 -14.756 1.00 0.00 C ATOM 967 C PHE A 65 -21.381 -7.528 -13.685 1.00 0.00 C ATOM 968 O PHE A 65 -21.724 -8.695 -13.868 1.00 0.00 O ATOM 969 CB PHE A 65 -20.454 -6.471 -15.754 1.00 0.00 C ATOM 970 CG PHE A 65 -19.996 -5.096 -16.149 1.00 0.00 C ATOM 971 CD1 PHE A 65 -20.897 -4.168 -16.648 1.00 0.00 C ATOM 972 CD2 PHE A 65 -18.666 -4.730 -16.020 1.00 0.00 C ATOM 973 CE1 PHE A 65 -20.478 -2.903 -17.012 1.00 0.00 C ATOM 974 CE2 PHE A 65 -18.242 -3.465 -16.382 1.00 0.00 C ATOM 975 CZ PHE A 65 -19.149 -2.550 -16.878 1.00 0.00 C ATOM 0 H PHE A 65 -21.003 -4.885 -13.520 1.00 0.00 H new ATOM 0 HA PHE A 65 -22.538 -6.702 -15.283 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -19.614 -7.014 -15.320 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -20.758 -7.015 -16.648 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -21.938 -4.437 -16.753 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -17.952 -5.441 -15.632 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -21.189 -2.190 -17.401 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -17.202 -3.193 -16.277 1.00 0.00 H new ATOM 0 HZ PHE A 65 -18.820 -1.561 -17.161 1.00 0.00 H new ATOM 985 N GLY A 66 -20.796 -7.113 -12.565 1.00 0.00 N ATOM 986 CA GLY A 66 -20.527 -8.040 -11.481 1.00 0.00 C ATOM 987 C GLY A 66 -19.231 -7.728 -10.759 1.00 0.00 C ATOM 988 O GLY A 66 -18.844 -6.565 -10.637 1.00 0.00 O ATOM 0 H GLY A 66 -20.504 -6.152 -12.389 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -21.352 -8.011 -10.769 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -20.483 -9.055 -11.877 1.00 0.00 H new ATOM 992 N THR A 67 -18.558 -8.768 -10.278 1.00 0.00 N ATOM 993 CA THR A 67 -17.300 -8.599 -9.561 1.00 0.00 C ATOM 994 C THR A 67 -16.243 -9.572 -10.071 1.00 0.00 C ATOM 995 O THR A 67 -16.438 -10.787 -10.042 1.00 0.00 O ATOM 996 CB THR A 67 -17.484 -8.806 -8.046 1.00 0.00 C ATOM 997 OG1 THR A 67 -18.579 -8.014 -7.573 1.00 0.00 O ATOM 998 CG2 THR A 67 -16.217 -8.433 -7.291 1.00 0.00 C ATOM 0 H THR A 67 -18.863 -9.737 -10.372 1.00 0.00 H new ATOM 0 HA THR A 67 -16.967 -7.577 -9.742 1.00 0.00 H new ATOM 0 HB THR A 67 -17.696 -9.860 -7.868 1.00 0.00 H new ATOM 0 HG1 THR A 67 -18.364 -7.063 -7.676 1.00 0.00 H new ATOM 0 HG21 THR A 67 -16.371 -8.587 -6.223 1.00 0.00 H new ATOM 0 HG22 THR A 67 -15.392 -9.058 -7.633 1.00 0.00 H new ATOM 0 HG23 THR A 67 -15.979 -7.386 -7.475 1.00 0.00 H new ATOM 1006 N TYR A 68 -15.123 -9.030 -10.536 1.00 0.00 N ATOM 1007 CA TYR A 68 -14.034 -9.851 -11.054 1.00 0.00 C ATOM 1008 C TYR A 68 -13.024 -10.172 -9.956 1.00 0.00 C ATOM 1009 O TYR A 68 -12.662 -9.308 -9.157 1.00 0.00 O ATOM 1010 CB TYR A 68 -13.336 -9.137 -12.212 1.00 0.00 C ATOM 1011 CG TYR A 68 -13.869 -9.526 -13.573 1.00 0.00 C ATOM 1012 CD1 TYR A 68 -13.703 -10.815 -14.063 1.00 0.00 C ATOM 1013 CD2 TYR A 68 -14.539 -8.604 -14.367 1.00 0.00 C ATOM 1014 CE1 TYR A 68 -14.188 -11.175 -15.306 1.00 0.00 C ATOM 1015 CE2 TYR A 68 -15.028 -8.955 -15.611 1.00 0.00 C ATOM 1016 CZ TYR A 68 -14.850 -10.241 -16.076 1.00 0.00 C ATOM 1017 OH TYR A 68 -15.335 -10.595 -17.314 1.00 0.00 O ATOM 0 H TYR A 68 -14.945 -8.026 -10.565 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.459 -10.787 -11.416 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -13.445 -8.060 -12.083 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -12.269 -9.356 -12.173 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -13.186 -11.549 -13.462 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -14.680 -7.596 -14.006 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -14.050 -12.181 -15.672 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -15.547 -8.226 -16.216 1.00 0.00 H new ATOM 0 HH TYR A 68 -15.046 -11.506 -17.530 1.00 0.00 H new ATOM 1027 N VAL A 69 -12.572 -11.422 -9.924 1.00 0.00 N ATOM 1028 CA VAL A 69 -11.602 -11.858 -8.927 1.00 0.00 C ATOM 1029 C VAL A 69 -10.517 -12.724 -9.557 1.00 0.00 C ATOM 1030 O VAL A 69 -10.796 -13.550 -10.427 1.00 0.00 O ATOM 1031 CB VAL A 69 -12.281 -12.650 -7.793 1.00 0.00 C ATOM 1032 CG1 VAL A 69 -11.482 -12.528 -6.504 1.00 0.00 C ATOM 1033 CG2 VAL A 69 -13.711 -12.172 -7.592 1.00 0.00 C ATOM 0 H VAL A 69 -12.862 -12.150 -10.577 1.00 0.00 H new ATOM 0 HA VAL A 69 -11.149 -10.958 -8.512 1.00 0.00 H new ATOM 0 HB VAL A 69 -12.311 -13.702 -8.075 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -11.977 -13.094 -5.714 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -10.478 -12.923 -6.659 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -11.418 -11.479 -6.213 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -14.176 -12.742 -6.787 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -13.708 -11.114 -7.332 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -14.276 -12.317 -8.513 1.00 0.00 H new ATOM 1043 N ILE A 70 -9.280 -12.529 -9.113 1.00 0.00 N ATOM 1044 CA ILE A 70 -8.153 -13.293 -9.633 1.00 0.00 C ATOM 1045 C ILE A 70 -7.135 -13.587 -8.537 1.00 0.00 C ATOM 1046 O ILE A 70 -6.485 -12.680 -8.020 1.00 0.00 O ATOM 1047 CB ILE A 70 -7.451 -12.548 -10.784 1.00 0.00 C ATOM 1048 CG1 ILE A 70 -8.455 -11.685 -11.551 1.00 0.00 C ATOM 1049 CG2 ILE A 70 -6.771 -13.537 -11.719 1.00 0.00 C ATOM 1050 CD1 ILE A 70 -8.654 -10.311 -10.951 1.00 0.00 C ATOM 0 H ILE A 70 -9.033 -11.849 -8.394 1.00 0.00 H new ATOM 0 HA ILE A 70 -8.557 -14.232 -10.012 1.00 0.00 H new ATOM 0 HB ILE A 70 -6.688 -11.894 -10.361 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -8.116 -11.577 -12.581 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -9.415 -12.201 -11.584 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.280 -12.995 -12.527 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -6.030 -14.112 -11.164 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -7.516 -14.214 -12.137 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -9.378 -9.755 -11.546 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -9.023 -10.410 -9.930 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.704 -9.776 -10.943 1.00 0.00 H new ATOM 1062 N ASN A 71 -7.002 -14.863 -8.187 1.00 0.00 N ATOM 1063 CA ASN A 71 -6.062 -15.277 -7.152 1.00 0.00 C ATOM 1064 C ASN A 71 -4.980 -16.184 -7.731 1.00 0.00 C ATOM 1065 O ASN A 71 -5.200 -16.873 -8.728 1.00 0.00 O ATOM 1066 CB ASN A 71 -6.800 -16.002 -6.024 1.00 0.00 C ATOM 1067 CG ASN A 71 -8.234 -16.332 -6.390 1.00 0.00 C ATOM 1068 OD1 ASN A 71 -8.524 -16.717 -7.523 1.00 0.00 O ATOM 1069 ND2 ASN A 71 -9.139 -16.183 -5.430 1.00 0.00 N ATOM 0 H ASN A 71 -7.533 -15.627 -8.605 1.00 0.00 H new ATOM 0 HA ASN A 71 -5.586 -14.383 -6.750 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -6.269 -16.922 -5.779 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -6.790 -15.380 -5.129 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -10.120 -16.390 -5.617 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -8.853 -15.861 -4.505 1.00 0.00 H new ATOM 1076 N LYS A 72 -3.811 -16.178 -7.100 1.00 0.00 N ATOM 1077 CA LYS A 72 -2.694 -17.000 -7.550 1.00 0.00 C ATOM 1078 C LYS A 72 -1.818 -17.419 -6.373 1.00 0.00 C ATOM 1079 O LYS A 72 -0.635 -17.086 -6.320 1.00 0.00 O ATOM 1080 CB LYS A 72 -1.855 -16.239 -8.578 1.00 0.00 C ATOM 1081 CG LYS A 72 -0.648 -17.016 -9.074 1.00 0.00 C ATOM 1082 CD LYS A 72 -0.155 -16.487 -10.410 1.00 0.00 C ATOM 1083 CE LYS A 72 -0.143 -14.966 -10.437 1.00 0.00 C ATOM 1084 NZ LYS A 72 -1.487 -14.407 -10.754 1.00 0.00 N ATOM 0 H LYS A 72 -3.612 -15.612 -6.275 1.00 0.00 H new ATOM 0 HA LYS A 72 -3.101 -17.898 -8.016 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -2.485 -15.981 -9.429 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -1.517 -15.302 -8.136 1.00 0.00 H new ATOM 0 HG2 LYS A 72 0.154 -16.953 -8.338 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.908 -18.070 -9.172 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.850 -16.863 -10.603 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -0.795 -16.861 -11.209 1.00 0.00 H new ATOM 0 HE2 LYS A 72 0.189 -14.588 -9.470 1.00 0.00 H new ATOM 0 HE3 LYS A 72 0.578 -14.621 -11.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -1.394 -13.404 -11.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -1.903 -14.932 -11.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -2.104 -14.494 -9.921 1.00 0.00 H new ATOM 1098 N GLN A 73 -2.408 -18.152 -5.434 1.00 0.00 N ATOM 1099 CA GLN A 73 -1.679 -18.617 -4.259 1.00 0.00 C ATOM 1100 C GLN A 73 -2.270 -19.921 -3.733 1.00 0.00 C ATOM 1101 O GLN A 73 -2.441 -20.111 -2.529 1.00 0.00 O ATOM 1102 CB GLN A 73 -1.707 -17.551 -3.162 1.00 0.00 C ATOM 1103 CG GLN A 73 -0.572 -17.681 -2.159 1.00 0.00 C ATOM 1104 CD GLN A 73 -0.996 -17.324 -0.748 1.00 0.00 C ATOM 1105 OE1 GLN A 73 -2.069 -17.719 -0.291 1.00 0.00 O ATOM 1106 NE2 GLN A 73 -0.154 -16.571 -0.050 1.00 0.00 N ATOM 0 H GLN A 73 -3.387 -18.436 -5.464 1.00 0.00 H new ATOM 0 HA GLN A 73 -0.645 -18.800 -4.552 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -1.662 -16.565 -3.624 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -2.658 -17.611 -2.632 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -0.195 -18.704 -2.173 1.00 0.00 H new ATOM 0 HG3 GLN A 73 0.251 -17.034 -2.462 1.00 0.00 H new ATOM 0 HE21 GLN A 73 0.725 -16.266 -0.469 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -0.386 -16.297 0.905 1.00 0.00 H new ATOM 1115 N PRO A 74 -2.590 -20.841 -4.655 1.00 0.00 N ATOM 1116 CA PRO A 74 -3.166 -22.143 -4.307 1.00 0.00 C ATOM 1117 C PRO A 74 -2.163 -23.052 -3.606 1.00 0.00 C ATOM 1118 O PRO A 74 -0.969 -22.761 -3.535 1.00 0.00 O ATOM 1119 CB PRO A 74 -3.562 -22.730 -5.665 1.00 0.00 C ATOM 1120 CG PRO A 74 -2.656 -22.065 -6.643 1.00 0.00 C ATOM 1121 CD PRO A 74 -2.413 -20.681 -6.108 1.00 0.00 C ATOM 0 HA PRO A 74 -3.998 -22.047 -3.609 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -3.435 -23.813 -5.681 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -4.608 -22.528 -5.894 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -1.720 -22.614 -6.744 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -3.111 -22.026 -7.633 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -1.413 -20.325 -6.354 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.119 -19.961 -6.522 1.00 0.00 H new ATOM 1129 N PRO A 75 -2.656 -24.181 -3.076 1.00 0.00 N ATOM 1130 CA PRO A 75 -1.818 -25.156 -2.371 1.00 0.00 C ATOM 1131 C PRO A 75 -0.873 -25.896 -3.312 1.00 0.00 C ATOM 1132 O PRO A 75 -0.141 -26.792 -2.894 1.00 0.00 O ATOM 1133 CB PRO A 75 -2.836 -26.126 -1.765 1.00 0.00 C ATOM 1134 CG PRO A 75 -4.033 -26.018 -2.646 1.00 0.00 C ATOM 1135 CD PRO A 75 -4.069 -24.592 -3.123 1.00 0.00 C ATOM 0 HA PRO A 75 -1.171 -24.680 -1.634 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -2.449 -27.145 -1.746 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -3.076 -25.857 -0.736 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -3.963 -26.709 -3.486 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -4.943 -26.270 -2.101 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -4.476 -24.516 -4.131 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -4.690 -23.969 -2.480 1.00 0.00 H new ATOM 1143 N ASN A 76 -0.894 -25.514 -4.585 1.00 0.00 N ATOM 1144 CA ASN A 76 -0.038 -26.141 -5.585 1.00 0.00 C ATOM 1145 C ASN A 76 0.498 -25.105 -6.569 1.00 0.00 C ATOM 1146 O ASN A 76 1.546 -24.501 -6.342 1.00 0.00 O ATOM 1147 CB ASN A 76 -0.811 -27.225 -6.340 1.00 0.00 C ATOM 1148 CG ASN A 76 -0.555 -28.612 -5.780 1.00 0.00 C ATOM 1149 OD1 ASN A 76 0.452 -29.245 -6.097 1.00 0.00 O ATOM 1150 ND2 ASN A 76 -1.469 -29.090 -4.944 1.00 0.00 N ATOM 0 H ASN A 76 -1.494 -24.774 -4.948 1.00 0.00 H new ATOM 0 HA ASN A 76 0.807 -26.598 -5.069 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -1.878 -27.007 -6.292 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -0.529 -27.203 -7.393 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -1.352 -30.018 -4.536 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -2.288 -28.530 -4.710 1.00 0.00 H new ATOM 1157 N LYS A 77 -0.229 -24.905 -7.663 1.00 0.00 N ATOM 1158 CA LYS A 77 0.170 -23.941 -8.682 1.00 0.00 C ATOM 1159 C LYS A 77 -0.917 -23.786 -9.740 1.00 0.00 C ATOM 1160 O LYS A 77 -0.982 -24.560 -10.694 1.00 0.00 O ATOM 1161 CB LYS A 77 1.480 -24.379 -9.342 1.00 0.00 C ATOM 1162 CG LYS A 77 2.562 -23.314 -9.312 1.00 0.00 C ATOM 1163 CD LYS A 77 3.866 -23.859 -8.756 1.00 0.00 C ATOM 1164 CE LYS A 77 3.938 -23.698 -7.245 1.00 0.00 C ATOM 1165 NZ LYS A 77 5.237 -23.113 -6.810 1.00 0.00 N ATOM 0 H LYS A 77 -1.098 -25.398 -7.867 1.00 0.00 H new ATOM 0 HA LYS A 77 0.319 -22.977 -8.196 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.849 -25.274 -8.840 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.281 -24.654 -10.378 1.00 0.00 H new ATOM 0 HG2 LYS A 77 2.726 -22.933 -10.320 1.00 0.00 H new ATOM 0 HG3 LYS A 77 2.229 -22.473 -8.703 1.00 0.00 H new ATOM 0 HD2 LYS A 77 3.961 -24.913 -9.016 1.00 0.00 H new ATOM 0 HD3 LYS A 77 4.705 -23.340 -9.219 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.121 -23.059 -6.909 1.00 0.00 H new ATOM 0 HE3 LYS A 77 3.800 -24.669 -6.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 5.484 -23.477 -5.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 5.980 -23.376 -7.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 5.155 -22.077 -6.770 1.00 0.00 H new ATOM 1179 N GLN A 78 -1.768 -22.779 -9.564 1.00 0.00 N ATOM 1180 CA GLN A 78 -2.852 -22.523 -10.505 1.00 0.00 C ATOM 1181 C GLN A 78 -3.429 -21.126 -10.303 1.00 0.00 C ATOM 1182 O GLN A 78 -3.324 -20.551 -9.219 1.00 0.00 O ATOM 1183 CB GLN A 78 -3.954 -23.571 -10.344 1.00 0.00 C ATOM 1184 CG GLN A 78 -3.969 -24.613 -11.451 1.00 0.00 C ATOM 1185 CD GLN A 78 -4.162 -26.022 -10.924 1.00 0.00 C ATOM 1186 OE1 GLN A 78 -5.133 -26.306 -10.222 1.00 0.00 O ATOM 1187 NE2 GLN A 78 -3.237 -26.912 -11.260 1.00 0.00 N ATOM 0 H GLN A 78 -1.727 -22.128 -8.779 1.00 0.00 H new ATOM 0 HA GLN A 78 -2.446 -22.586 -11.514 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -3.829 -24.074 -9.385 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -4.921 -23.068 -10.316 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -4.769 -24.379 -12.154 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -3.032 -24.562 -12.006 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -2.449 -26.633 -11.844 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -3.314 -27.876 -10.934 1.00 0.00 H new ATOM 1196 N ILE A 79 -4.038 -20.585 -11.353 1.00 0.00 N ATOM 1197 CA ILE A 79 -4.632 -19.256 -11.290 1.00 0.00 C ATOM 1198 C ILE A 79 -6.155 -19.334 -11.294 1.00 0.00 C ATOM 1199 O ILE A 79 -6.758 -19.850 -12.234 1.00 0.00 O ATOM 1200 CB ILE A 79 -4.171 -18.377 -12.468 1.00 0.00 C ATOM 1201 CG1 ILE A 79 -2.741 -17.884 -12.237 1.00 0.00 C ATOM 1202 CG2 ILE A 79 -5.119 -17.201 -12.653 1.00 0.00 C ATOM 1203 CD1 ILE A 79 -1.816 -18.950 -11.693 1.00 0.00 C ATOM 0 H ILE A 79 -4.133 -21.047 -12.257 1.00 0.00 H new ATOM 0 HA ILE A 79 -4.296 -18.804 -10.357 1.00 0.00 H new ATOM 0 HB ILE A 79 -4.185 -18.978 -13.378 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -2.338 -17.510 -13.178 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.762 -17.044 -11.543 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -4.781 -16.589 -13.489 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -6.123 -17.572 -12.858 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.133 -16.599 -11.745 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -0.820 -18.531 -11.554 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -2.196 -19.308 -10.736 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -1.765 -19.781 -12.397 1.00 0.00 H new ATOM 1215 N TRP A 80 -6.770 -18.816 -10.237 1.00 0.00 N ATOM 1216 CA TRP A 80 -8.224 -18.825 -10.119 1.00 0.00 C ATOM 1217 C TRP A 80 -8.814 -17.489 -10.556 1.00 0.00 C ATOM 1218 O TRP A 80 -8.452 -16.436 -10.027 1.00 0.00 O ATOM 1219 CB TRP A 80 -8.638 -19.132 -8.679 1.00 0.00 C ATOM 1220 CG TRP A 80 -8.837 -20.595 -8.417 1.00 0.00 C ATOM 1221 CD1 TRP A 80 -8.038 -21.619 -8.838 1.00 0.00 C ATOM 1222 CD2 TRP A 80 -9.906 -21.195 -7.678 1.00 0.00 C ATOM 1223 NE1 TRP A 80 -8.546 -22.820 -8.404 1.00 0.00 N ATOM 1224 CE2 TRP A 80 -9.691 -22.587 -7.690 1.00 0.00 C ATOM 1225 CE3 TRP A 80 -11.023 -20.692 -7.005 1.00 0.00 C ATOM 1226 CZ2 TRP A 80 -10.553 -23.478 -7.056 1.00 0.00 C ATOM 1227 CZ3 TRP A 80 -11.877 -21.578 -6.377 1.00 0.00 C ATOM 1228 CH2 TRP A 80 -11.638 -22.958 -6.405 1.00 0.00 C ATOM 0 H TRP A 80 -6.285 -18.385 -9.450 1.00 0.00 H new ATOM 0 HA TRP A 80 -8.612 -19.604 -10.775 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -7.876 -18.749 -8.000 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -9.563 -18.601 -8.453 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -7.139 -21.502 -9.425 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -8.136 -23.737 -8.585 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -11.215 -19.630 -6.976 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -10.371 -24.542 -7.077 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -12.744 -21.200 -5.855 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -12.324 -23.624 -5.903 1.00 0.00 H new ATOM 1239 N LEU A 81 -9.723 -17.536 -11.523 1.00 0.00 N ATOM 1240 CA LEU A 81 -10.364 -16.328 -12.031 1.00 0.00 C ATOM 1241 C LEU A 81 -11.870 -16.367 -11.789 1.00 0.00 C ATOM 1242 O LEU A 81 -12.605 -17.052 -12.499 1.00 0.00 O ATOM 1243 CB LEU A 81 -10.081 -16.167 -13.525 1.00 0.00 C ATOM 1244 CG LEU A 81 -10.551 -14.858 -14.160 1.00 0.00 C ATOM 1245 CD1 LEU A 81 -12.055 -14.882 -14.382 1.00 0.00 C ATOM 1246 CD2 LEU A 81 -10.157 -13.672 -13.291 1.00 0.00 C ATOM 0 H LEU A 81 -10.033 -18.398 -11.971 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.950 -15.474 -11.494 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -9.006 -16.259 -13.683 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -10.553 -16.994 -14.055 1.00 0.00 H new ATOM 0 HG LEU A 81 -10.063 -14.751 -15.129 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -12.371 -13.942 -14.835 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -12.312 -15.708 -15.045 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -12.562 -15.013 -13.426 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -10.500 -12.749 -13.758 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -10.616 -13.773 -12.308 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.073 -13.644 -13.184 1.00 0.00 H new ATOM 1258 N ALA A 82 -12.321 -15.627 -10.782 1.00 0.00 N ATOM 1259 CA ALA A 82 -13.739 -15.573 -10.449 1.00 0.00 C ATOM 1260 C ALA A 82 -14.471 -14.563 -11.325 1.00 0.00 C ATOM 1261 O ALA A 82 -14.275 -13.355 -11.193 1.00 0.00 O ATOM 1262 CB ALA A 82 -13.923 -15.230 -8.978 1.00 0.00 C ATOM 0 H ALA A 82 -11.725 -15.056 -10.182 1.00 0.00 H new ATOM 0 HA ALA A 82 -14.169 -16.557 -10.638 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -14.987 -15.193 -8.743 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -13.442 -15.991 -8.364 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -13.472 -14.259 -8.772 1.00 0.00 H new ATOM 1268 N SER A 83 -15.315 -15.065 -12.221 1.00 0.00 N ATOM 1269 CA SER A 83 -16.074 -14.206 -13.123 1.00 0.00 C ATOM 1270 C SER A 83 -16.970 -13.252 -12.339 1.00 0.00 C ATOM 1271 O SER A 83 -17.145 -13.379 -11.127 1.00 0.00 O ATOM 1272 CB SER A 83 -16.920 -15.052 -14.076 1.00 0.00 C ATOM 1273 OG SER A 83 -16.460 -14.930 -15.411 1.00 0.00 O ATOM 0 H SER A 83 -15.491 -16.063 -12.342 1.00 0.00 H new ATOM 0 HA SER A 83 -15.366 -13.616 -13.705 1.00 0.00 H new ATOM 0 HB2 SER A 83 -16.883 -16.097 -13.769 1.00 0.00 H new ATOM 0 HB3 SER A 83 -17.962 -14.739 -14.017 1.00 0.00 H new ATOM 0 HG SER A 83 -17.016 -15.481 -16.000 1.00 0.00 H new ATOM 1279 N PRO A 84 -17.552 -12.273 -13.047 1.00 0.00 N ATOM 1280 CA PRO A 84 -18.441 -11.278 -12.439 1.00 0.00 C ATOM 1281 C PRO A 84 -19.770 -11.882 -11.996 1.00 0.00 C ATOM 1282 O PRO A 84 -20.625 -11.188 -11.443 1.00 0.00 O ATOM 1283 CB PRO A 84 -18.663 -10.265 -13.565 1.00 0.00 C ATOM 1284 CG PRO A 84 -18.442 -11.039 -14.819 1.00 0.00 C ATOM 1285 CD PRO A 84 -17.388 -12.061 -14.495 1.00 0.00 C ATOM 0 HA PRO A 84 -18.011 -10.845 -11.536 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -19.669 -9.848 -13.529 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -17.968 -9.429 -13.488 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -19.363 -11.520 -15.148 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -18.116 -10.386 -15.628 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -17.537 -12.984 -15.056 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -16.389 -11.699 -14.737 1.00 0.00 H new ATOM 1293 N LEU A 85 -19.937 -13.176 -12.242 1.00 0.00 N ATOM 1294 CA LEU A 85 -21.163 -13.874 -11.868 1.00 0.00 C ATOM 1295 C LEU A 85 -20.847 -15.166 -11.122 1.00 0.00 C ATOM 1296 O LEU A 85 -21.439 -16.211 -11.393 1.00 0.00 O ATOM 1297 CB LEU A 85 -21.998 -14.181 -13.112 1.00 0.00 C ATOM 1298 CG LEU A 85 -21.253 -14.830 -14.278 1.00 0.00 C ATOM 1299 CD1 LEU A 85 -21.561 -16.318 -14.346 1.00 0.00 C ATOM 1300 CD2 LEU A 85 -21.615 -14.148 -15.589 1.00 0.00 C ATOM 0 H LEU A 85 -19.240 -13.764 -12.699 1.00 0.00 H new ATOM 0 HA LEU A 85 -21.735 -13.224 -11.206 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -22.818 -14.837 -12.821 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -22.443 -13.251 -13.465 1.00 0.00 H new ATOM 0 HG LEU A 85 -20.183 -14.708 -14.113 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -21.022 -16.763 -15.182 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -21.250 -16.797 -13.417 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -22.632 -16.462 -14.487 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -21.075 -14.624 -16.408 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -22.688 -14.237 -15.761 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -21.342 -13.094 -15.538 1.00 0.00 H new ATOM 1312 N SER A 86 -19.914 -15.086 -10.179 1.00 0.00 N ATOM 1313 CA SER A 86 -19.519 -16.250 -9.394 1.00 0.00 C ATOM 1314 C SER A 86 -19.108 -17.405 -10.303 1.00 0.00 C ATOM 1315 O SER A 86 -19.830 -18.392 -10.435 1.00 0.00 O ATOM 1316 CB SER A 86 -20.665 -16.688 -8.480 1.00 0.00 C ATOM 1317 OG SER A 86 -20.232 -17.668 -7.553 1.00 0.00 O ATOM 0 H SER A 86 -19.417 -14.228 -9.940 1.00 0.00 H new ATOM 0 HA SER A 86 -18.662 -15.970 -8.781 1.00 0.00 H new ATOM 0 HB2 SER A 86 -21.057 -15.824 -7.944 1.00 0.00 H new ATOM 0 HB3 SER A 86 -21.482 -17.087 -9.081 1.00 0.00 H new ATOM 0 HG SER A 86 -20.982 -17.930 -6.980 1.00 0.00 H new ATOM 1323 N GLY A 87 -17.943 -17.272 -10.928 1.00 0.00 N ATOM 1324 CA GLY A 87 -17.455 -18.311 -11.817 1.00 0.00 C ATOM 1325 C GLY A 87 -15.942 -18.402 -11.829 1.00 0.00 C ATOM 1326 O GLY A 87 -15.269 -17.800 -12.666 1.00 0.00 O ATOM 0 H GLY A 87 -17.328 -16.464 -10.835 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -17.871 -19.271 -11.511 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -17.812 -18.116 -12.828 1.00 0.00 H new ATOM 1330 N PRO A 88 -15.384 -19.168 -10.879 1.00 0.00 N ATOM 1331 CA PRO A 88 -13.935 -19.352 -10.761 1.00 0.00 C ATOM 1332 C PRO A 88 -13.361 -20.180 -11.905 1.00 0.00 C ATOM 1333 O PRO A 88 -13.911 -21.219 -12.268 1.00 0.00 O ATOM 1334 CB PRO A 88 -13.779 -20.095 -9.432 1.00 0.00 C ATOM 1335 CG PRO A 88 -15.076 -20.800 -9.238 1.00 0.00 C ATOM 1336 CD PRO A 88 -16.126 -19.913 -9.848 1.00 0.00 C ATOM 0 HA PRO A 88 -13.399 -18.404 -10.800 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -12.947 -20.799 -9.467 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -13.578 -19.404 -8.613 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -15.064 -21.778 -9.719 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -15.274 -20.968 -8.179 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -16.941 -20.493 -10.280 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.567 -19.245 -9.108 1.00 0.00 H new ATOM 1344 N ASN A 89 -12.251 -19.714 -12.469 1.00 0.00 N ATOM 1345 CA ASN A 89 -11.603 -20.413 -13.573 1.00 0.00 C ATOM 1346 C ASN A 89 -10.219 -20.908 -13.165 1.00 0.00 C ATOM 1347 O ASN A 89 -9.360 -20.122 -12.764 1.00 0.00 O ATOM 1348 CB ASN A 89 -11.489 -19.493 -14.790 1.00 0.00 C ATOM 1349 CG ASN A 89 -12.074 -20.116 -16.043 1.00 0.00 C ATOM 1350 OD1 ASN A 89 -13.091 -19.657 -16.562 1.00 0.00 O ATOM 1351 ND2 ASN A 89 -11.432 -21.169 -16.534 1.00 0.00 N ATOM 0 H ASN A 89 -11.782 -18.856 -12.180 1.00 0.00 H new ATOM 0 HA ASN A 89 -12.216 -21.276 -13.834 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -12.001 -18.554 -14.581 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -10.440 -19.252 -14.963 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -11.779 -21.631 -17.375 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -10.592 -21.516 -16.071 1.00 0.00 H new ATOM 1358 N ARG A 90 -10.009 -22.216 -13.271 1.00 0.00 N ATOM 1359 CA ARG A 90 -8.730 -22.816 -12.912 1.00 0.00 C ATOM 1360 C ARG A 90 -7.780 -22.827 -14.107 1.00 0.00 C ATOM 1361 O ARG A 90 -7.883 -23.682 -14.987 1.00 0.00 O ATOM 1362 CB ARG A 90 -8.937 -24.242 -12.399 1.00 0.00 C ATOM 1363 CG ARG A 90 -10.348 -24.512 -11.904 1.00 0.00 C ATOM 1364 CD ARG A 90 -10.387 -25.697 -10.951 1.00 0.00 C ATOM 1365 NE ARG A 90 -11.709 -26.317 -10.903 1.00 0.00 N ATOM 1366 CZ ARG A 90 -12.012 -27.341 -10.113 1.00 0.00 C ATOM 1367 NH1 ARG A 90 -11.092 -27.856 -9.308 1.00 0.00 N ATOM 1368 NH2 ARG A 90 -13.237 -27.851 -10.125 1.00 0.00 N ATOM 0 H ARG A 90 -10.708 -22.880 -13.603 1.00 0.00 H new ATOM 0 HA ARG A 90 -8.284 -22.214 -12.120 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -8.701 -24.945 -13.198 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.234 -24.433 -11.588 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -10.734 -23.626 -11.400 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -11.002 -24.706 -12.754 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -9.650 -26.437 -11.263 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -10.104 -25.368 -9.951 1.00 0.00 H new ATOM 0 HE ARG A 90 -12.439 -25.943 -11.509 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -10.150 -27.466 -9.295 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -11.327 -28.642 -8.702 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -13.948 -27.457 -10.741 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -13.468 -28.637 -9.518 1.00 0.00 H new ATOM 1382 N PHE A 91 -6.857 -21.871 -14.131 1.00 0.00 N ATOM 1383 CA PHE A 91 -5.891 -21.770 -15.218 1.00 0.00 C ATOM 1384 C PHE A 91 -4.587 -22.475 -14.855 1.00 0.00 C ATOM 1385 O PHE A 91 -4.124 -22.398 -13.717 1.00 0.00 O ATOM 1386 CB PHE A 91 -5.615 -20.301 -15.548 1.00 0.00 C ATOM 1387 CG PHE A 91 -6.690 -19.661 -16.378 1.00 0.00 C ATOM 1388 CD1 PHE A 91 -6.708 -19.819 -17.754 1.00 0.00 C ATOM 1389 CD2 PHE A 91 -7.684 -18.901 -15.781 1.00 0.00 C ATOM 1390 CE1 PHE A 91 -7.697 -19.230 -18.520 1.00 0.00 C ATOM 1391 CE2 PHE A 91 -8.675 -18.310 -16.542 1.00 0.00 C ATOM 1392 CZ PHE A 91 -8.682 -18.475 -17.913 1.00 0.00 C ATOM 0 H PHE A 91 -6.758 -21.156 -13.410 1.00 0.00 H new ATOM 0 HA PHE A 91 -6.316 -22.259 -16.095 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.504 -19.743 -14.618 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -4.666 -20.228 -16.079 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -5.941 -20.409 -18.234 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -7.684 -18.769 -14.709 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -7.699 -19.360 -19.592 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -9.443 -17.720 -16.065 1.00 0.00 H new ATOM 0 HZ PHE A 91 -9.456 -18.015 -18.509 1.00 0.00 H new ATOM 1402 N ASP A 92 -4.001 -23.161 -15.830 1.00 0.00 N ATOM 1403 CA ASP A 92 -2.751 -23.880 -15.614 1.00 0.00 C ATOM 1404 C ASP A 92 -1.589 -23.165 -16.296 1.00 0.00 C ATOM 1405 O ASP A 92 -1.767 -22.505 -17.321 1.00 0.00 O ATOM 1406 CB ASP A 92 -2.864 -25.312 -16.139 1.00 0.00 C ATOM 1407 CG ASP A 92 -2.128 -26.309 -15.266 1.00 0.00 C ATOM 1408 OD1 ASP A 92 -2.381 -26.327 -14.043 1.00 0.00 O ATOM 1409 OD2 ASP A 92 -1.300 -27.072 -15.805 1.00 0.00 O ATOM 0 H ASP A 92 -4.371 -23.234 -16.778 1.00 0.00 H new ATOM 0 HA ASP A 92 -2.558 -23.909 -14.542 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -3.916 -25.592 -16.198 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -2.465 -25.357 -17.152 1.00 0.00 H new ATOM 1414 N LEU A 93 -0.399 -23.300 -15.720 1.00 0.00 N ATOM 1415 CA LEU A 93 0.794 -22.666 -16.272 1.00 0.00 C ATOM 1416 C LEU A 93 1.340 -23.465 -17.450 1.00 0.00 C ATOM 1417 O LEU A 93 2.088 -24.427 -17.268 1.00 0.00 O ATOM 1418 CB LEU A 93 1.868 -22.529 -15.192 1.00 0.00 C ATOM 1419 CG LEU A 93 2.252 -23.815 -14.460 1.00 0.00 C ATOM 1420 CD1 LEU A 93 3.714 -24.154 -14.707 1.00 0.00 C ATOM 1421 CD2 LEU A 93 1.979 -23.682 -12.969 1.00 0.00 C ATOM 0 H LEU A 93 -0.235 -23.842 -14.872 1.00 0.00 H new ATOM 0 HA LEU A 93 0.517 -21.674 -16.628 1.00 0.00 H new ATOM 0 HB2 LEU A 93 2.765 -22.114 -15.651 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.523 -21.804 -14.455 1.00 0.00 H new ATOM 0 HG LEU A 93 1.640 -24.628 -14.850 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.969 -25.072 -14.178 1.00 0.00 H new ATOM 0 HD12 LEU A 93 3.880 -24.293 -15.775 1.00 0.00 H new ATOM 0 HD13 LEU A 93 4.342 -23.340 -14.345 1.00 0.00 H new ATOM 0 HD21 LEU A 93 2.258 -24.607 -12.464 1.00 0.00 H new ATOM 0 HD22 LEU A 93 2.564 -22.856 -12.564 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.918 -23.487 -12.809 1.00 0.00 H new ATOM 1433 N LEU A 94 0.965 -23.060 -18.658 1.00 0.00 N ATOM 1434 CA LEU A 94 1.419 -23.738 -19.868 1.00 0.00 C ATOM 1435 C LEU A 94 2.093 -22.756 -20.821 1.00 0.00 C ATOM 1436 O LEU A 94 1.561 -21.682 -21.099 1.00 0.00 O ATOM 1437 CB LEU A 94 0.242 -24.419 -20.567 1.00 0.00 C ATOM 1438 CG LEU A 94 0.415 -25.906 -20.878 1.00 0.00 C ATOM 1439 CD1 LEU A 94 -0.495 -26.745 -19.994 1.00 0.00 C ATOM 1440 CD2 LEU A 94 0.133 -26.180 -22.348 1.00 0.00 C ATOM 0 H LEU A 94 0.348 -22.266 -18.826 1.00 0.00 H new ATOM 0 HA LEU A 94 2.148 -24.495 -19.579 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.644 -24.300 -19.943 1.00 0.00 H new ATOM 0 HB3 LEU A 94 0.047 -23.893 -21.502 1.00 0.00 H new ATOM 0 HG LEU A 94 1.448 -26.183 -20.669 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -0.358 -27.801 -20.229 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.246 -26.571 -18.947 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -1.533 -26.465 -20.171 1.00 0.00 H new ATOM 0 HD21 LEU A 94 0.261 -27.243 -22.551 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -0.890 -25.886 -22.583 1.00 0.00 H new ATOM 0 HD23 LEU A 94 0.826 -25.607 -22.964 1.00 0.00 H new ATOM 1452 N ASN A 95 3.266 -23.134 -21.320 1.00 0.00 N ATOM 1453 CA ASN A 95 4.012 -22.287 -22.244 1.00 0.00 C ATOM 1454 C ASN A 95 4.242 -20.902 -21.647 1.00 0.00 C ATOM 1455 O ASN A 95 4.102 -19.889 -22.331 1.00 0.00 O ATOM 1456 CB ASN A 95 3.263 -22.164 -23.573 1.00 0.00 C ATOM 1457 CG ASN A 95 2.666 -23.483 -24.024 1.00 0.00 C ATOM 1458 OD1 ASN A 95 3.260 -24.584 -23.579 1.00 0.00 O flip ATOM 1459 ND2 ASN A 95 1.683 -23.511 -24.765 1.00 0.00 N flip ATOM 0 H ASN A 95 3.720 -24.021 -21.100 1.00 0.00 H new ATOM 0 HA ASN A 95 4.982 -22.752 -22.422 1.00 0.00 H new ATOM 0 HB2 ASN A 95 2.469 -21.424 -23.472 1.00 0.00 H new ATOM 0 HB3 ASN A 95 3.946 -21.796 -24.339 1.00 0.00 H new ATOM 0 HD21 ASN A 95 1.259 -22.639 -25.083 1.00 0.00 H new ATOM 0 HD22 ASN A 95 1.293 -24.406 -25.061 1.00 0.00 H new ATOM 1466 N GLY A 96 4.598 -20.867 -20.366 1.00 0.00 N ATOM 1467 CA GLY A 96 4.843 -19.602 -19.699 1.00 0.00 C ATOM 1468 C GLY A 96 3.610 -18.721 -19.656 1.00 0.00 C ATOM 1469 O GLY A 96 3.714 -17.506 -19.489 1.00 0.00 O ATOM 0 H GLY A 96 4.721 -21.692 -19.779 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.186 -19.792 -18.682 1.00 0.00 H new ATOM 0 HA3 GLY A 96 5.646 -19.073 -20.213 1.00 0.00 H new ATOM 1473 N GLU A 97 2.440 -19.334 -19.808 1.00 0.00 N ATOM 1474 CA GLU A 97 1.183 -18.596 -19.788 1.00 0.00 C ATOM 1475 C GLU A 97 0.090 -19.402 -19.093 1.00 0.00 C ATOM 1476 O GLU A 97 -0.015 -20.614 -19.279 1.00 0.00 O ATOM 1477 CB GLU A 97 0.747 -18.248 -21.213 1.00 0.00 C ATOM 1478 CG GLU A 97 1.199 -16.870 -21.668 1.00 0.00 C ATOM 1479 CD GLU A 97 2.364 -16.929 -22.637 1.00 0.00 C ATOM 1480 OE1 GLU A 97 2.307 -17.742 -23.584 1.00 0.00 O ATOM 1481 OE2 GLU A 97 3.331 -16.162 -22.449 1.00 0.00 O ATOM 0 H GLU A 97 2.337 -20.339 -19.946 1.00 0.00 H new ATOM 0 HA GLU A 97 1.342 -17.674 -19.229 1.00 0.00 H new ATOM 0 HB2 GLU A 97 1.144 -18.996 -21.899 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -0.340 -18.304 -21.275 1.00 0.00 H new ATOM 0 HG2 GLU A 97 0.363 -16.355 -22.142 1.00 0.00 H new ATOM 0 HG3 GLU A 97 1.485 -16.280 -20.797 1.00 0.00 H new ATOM 1488 N TRP A 98 -0.720 -18.720 -18.292 1.00 0.00 N ATOM 1489 CA TRP A 98 -1.806 -19.372 -17.567 1.00 0.00 C ATOM 1490 C TRP A 98 -3.010 -19.594 -18.476 1.00 0.00 C ATOM 1491 O TRP A 98 -3.792 -18.676 -18.723 1.00 0.00 O ATOM 1492 CB TRP A 98 -2.214 -18.533 -16.355 1.00 0.00 C ATOM 1493 CG TRP A 98 -1.053 -18.111 -15.507 1.00 0.00 C ATOM 1494 CD1 TRP A 98 -0.389 -16.918 -15.560 1.00 0.00 C ATOM 1495 CD2 TRP A 98 -0.417 -18.880 -14.480 1.00 0.00 C ATOM 1496 NE1 TRP A 98 0.620 -16.900 -14.628 1.00 0.00 N ATOM 1497 CE2 TRP A 98 0.624 -18.091 -13.952 1.00 0.00 C ATOM 1498 CE3 TRP A 98 -0.626 -20.158 -13.954 1.00 0.00 C ATOM 1499 CZ2 TRP A 98 1.451 -18.540 -12.926 1.00 0.00 C ATOM 1500 CZ3 TRP A 98 0.196 -20.602 -12.936 1.00 0.00 C ATOM 1501 CH2 TRP A 98 1.223 -19.795 -12.430 1.00 0.00 C ATOM 0 H TRP A 98 -0.646 -17.716 -18.128 1.00 0.00 H new ATOM 0 HA TRP A 98 -1.449 -20.343 -17.224 1.00 0.00 H new ATOM 0 HB2 TRP A 98 -2.745 -17.645 -16.699 1.00 0.00 H new ATOM 0 HB3 TRP A 98 -2.912 -19.106 -15.744 1.00 0.00 H new ATOM 0 HD1 TRP A 98 -0.623 -16.108 -16.235 1.00 0.00 H new ATOM 0 HE1 TRP A 98 1.263 -16.125 -14.466 1.00 0.00 H new ATOM 0 HE3 TRP A 98 -1.416 -20.787 -14.336 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 2.244 -17.920 -12.535 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 0.044 -21.588 -12.523 1.00 0.00 H new ATOM 0 HH2 TRP A 98 1.847 -20.171 -11.633 1.00 0.00 H new ATOM 1512 N VAL A 99 -3.154 -20.819 -18.971 1.00 0.00 N ATOM 1513 CA VAL A 99 -4.265 -21.162 -19.851 1.00 0.00 C ATOM 1514 C VAL A 99 -5.075 -22.324 -19.286 1.00 0.00 C ATOM 1515 O VAL A 99 -4.519 -23.265 -18.721 1.00 0.00 O ATOM 1516 CB VAL A 99 -3.769 -21.535 -21.261 1.00 0.00 C ATOM 1517 CG1 VAL A 99 -2.828 -20.466 -21.796 1.00 0.00 C ATOM 1518 CG2 VAL A 99 -3.089 -22.895 -21.245 1.00 0.00 C ATOM 0 H VAL A 99 -2.515 -21.590 -18.778 1.00 0.00 H new ATOM 0 HA VAL A 99 -4.900 -20.279 -19.918 1.00 0.00 H new ATOM 0 HB VAL A 99 -4.631 -21.593 -21.926 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -2.488 -20.747 -22.793 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -3.353 -19.512 -21.847 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -1.968 -20.373 -21.132 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -2.745 -23.142 -22.250 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -2.237 -22.868 -20.566 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -3.797 -23.652 -20.908 1.00 0.00 H new ATOM 1528 N SER A 100 -6.393 -22.251 -19.445 1.00 0.00 N ATOM 1529 CA SER A 100 -7.281 -23.295 -18.948 1.00 0.00 C ATOM 1530 C SER A 100 -7.668 -24.257 -20.067 1.00 0.00 C ATOM 1531 O SER A 100 -8.208 -23.846 -21.096 1.00 0.00 O ATOM 1532 CB SER A 100 -8.539 -22.675 -18.335 1.00 0.00 C ATOM 1533 OG SER A 100 -9.418 -23.676 -17.854 1.00 0.00 O ATOM 0 H SER A 100 -6.869 -21.480 -19.914 1.00 0.00 H new ATOM 0 HA SER A 100 -6.749 -23.855 -18.179 1.00 0.00 H new ATOM 0 HB2 SER A 100 -8.259 -22.009 -17.518 1.00 0.00 H new ATOM 0 HB3 SER A 100 -9.049 -22.067 -19.082 1.00 0.00 H new ATOM 0 HG SER A 100 -9.189 -23.894 -16.926 1.00 0.00 H new ATOM 1539 N LEU A 101 -7.389 -25.539 -19.859 1.00 0.00 N ATOM 1540 CA LEU A 101 -7.708 -26.561 -20.850 1.00 0.00 C ATOM 1541 C LEU A 101 -9.211 -26.810 -20.911 1.00 0.00 C ATOM 1542 O LEU A 101 -9.731 -27.281 -21.923 1.00 0.00 O ATOM 1543 CB LEU A 101 -6.976 -27.864 -20.520 1.00 0.00 C ATOM 1544 CG LEU A 101 -6.579 -28.731 -21.715 1.00 0.00 C ATOM 1545 CD1 LEU A 101 -7.718 -28.813 -22.718 1.00 0.00 C ATOM 1546 CD2 LEU A 101 -5.322 -28.185 -22.375 1.00 0.00 C ATOM 0 H LEU A 101 -6.943 -25.895 -19.014 1.00 0.00 H new ATOM 0 HA LEU A 101 -7.378 -26.203 -21.825 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -6.074 -27.619 -19.959 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -7.610 -28.457 -19.861 1.00 0.00 H new ATOM 0 HG LEU A 101 -6.368 -29.738 -21.355 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -7.416 -29.434 -23.561 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -8.594 -29.251 -22.239 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -7.962 -27.812 -23.074 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -5.054 -28.814 -23.224 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -5.505 -27.168 -22.721 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -4.505 -28.181 -21.654 1.00 0.00 H new ATOM 1558 N ARG A 102 -9.904 -26.490 -19.824 1.00 0.00 N ATOM 1559 CA ARG A 102 -11.348 -26.677 -19.755 1.00 0.00 C ATOM 1560 C ARG A 102 -12.006 -26.328 -21.086 1.00 0.00 C ATOM 1561 O ARG A 102 -13.076 -26.838 -21.414 1.00 0.00 O ATOM 1562 CB ARG A 102 -11.943 -25.817 -18.638 1.00 0.00 C ATOM 1563 CG ARG A 102 -13.404 -26.120 -18.349 1.00 0.00 C ATOM 1564 CD ARG A 102 -13.810 -25.637 -16.965 1.00 0.00 C ATOM 1565 NE ARG A 102 -14.198 -24.229 -16.969 1.00 0.00 N ATOM 1566 CZ ARG A 102 -15.404 -23.799 -17.324 1.00 0.00 C ATOM 1567 NH1 ARG A 102 -16.334 -24.665 -17.702 1.00 0.00 N ATOM 1568 NH2 ARG A 102 -15.681 -22.502 -17.302 1.00 0.00 N ATOM 0 H ARG A 102 -9.489 -26.100 -18.978 1.00 0.00 H new ATOM 0 HA ARG A 102 -11.543 -27.727 -19.538 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.363 -25.967 -17.728 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.845 -24.766 -18.909 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -14.032 -25.642 -19.101 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -13.576 -27.194 -18.426 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -14.641 -26.241 -16.599 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -12.981 -25.783 -16.272 1.00 0.00 H new ATOM 0 HE ARG A 102 -13.505 -23.537 -16.683 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -16.124 -25.663 -17.721 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -17.259 -24.333 -17.974 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -14.968 -21.833 -17.012 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -16.607 -22.174 -17.575 1.00 0.00 H new ATOM 1582 N ASN A 103 -11.358 -25.453 -21.849 1.00 0.00 N ATOM 1583 CA ASN A 103 -11.881 -25.034 -23.144 1.00 0.00 C ATOM 1584 C ASN A 103 -10.802 -24.333 -23.965 1.00 0.00 C ATOM 1585 O ASN A 103 -11.103 -23.555 -24.870 1.00 0.00 O ATOM 1586 CB ASN A 103 -13.080 -24.103 -22.957 1.00 0.00 C ATOM 1587 CG ASN A 103 -13.954 -24.029 -24.194 1.00 0.00 C ATOM 1588 OD1 ASN A 103 -14.826 -24.873 -24.403 1.00 0.00 O ATOM 1589 ND2 ASN A 103 -13.723 -23.017 -25.021 1.00 0.00 N ATOM 0 H ASN A 103 -10.470 -25.021 -21.593 1.00 0.00 H new ATOM 0 HA ASN A 103 -12.203 -25.925 -23.683 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -13.677 -24.450 -22.114 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -12.725 -23.103 -22.706 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -14.279 -22.915 -25.870 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -12.990 -22.341 -24.807 1.00 0.00 H new ATOM 1596 N GLY A 104 -9.544 -24.615 -23.643 1.00 0.00 N ATOM 1597 CA GLY A 104 -8.439 -24.004 -24.359 1.00 0.00 C ATOM 1598 C GLY A 104 -8.539 -22.492 -24.398 1.00 0.00 C ATOM 1599 O GLY A 104 -8.455 -21.883 -25.465 1.00 0.00 O ATOM 0 H GLY A 104 -9.270 -25.256 -22.899 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -7.500 -24.291 -23.885 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -8.413 -24.390 -25.378 1.00 0.00 H new ATOM 1603 N THR A 105 -8.721 -21.883 -23.230 1.00 0.00 N ATOM 1604 CA THR A 105 -8.835 -20.433 -23.135 1.00 0.00 C ATOM 1605 C THR A 105 -7.754 -19.855 -22.228 1.00 0.00 C ATOM 1606 O THR A 105 -7.207 -20.552 -21.374 1.00 0.00 O ATOM 1607 CB THR A 105 -10.217 -20.012 -22.599 1.00 0.00 C ATOM 1608 OG1 THR A 105 -10.781 -21.070 -21.816 1.00 0.00 O ATOM 1609 CG2 THR A 105 -11.157 -19.664 -23.743 1.00 0.00 C ATOM 0 H THR A 105 -8.793 -22.371 -22.337 1.00 0.00 H new ATOM 0 HA THR A 105 -8.709 -20.039 -24.144 1.00 0.00 H new ATOM 0 HB THR A 105 -10.087 -19.128 -21.975 1.00 0.00 H new ATOM 0 HG1 THR A 105 -11.658 -20.794 -21.477 1.00 0.00 H new ATOM 0 HG21 THR A 105 -12.126 -19.370 -23.341 1.00 0.00 H new ATOM 0 HG22 THR A 105 -10.738 -18.840 -24.320 1.00 0.00 H new ATOM 0 HG23 THR A 105 -11.281 -20.533 -24.389 1.00 0.00 H new ATOM 1617 N LYS A 106 -7.451 -18.575 -22.419 1.00 0.00 N ATOM 1618 CA LYS A 106 -6.436 -17.901 -21.618 1.00 0.00 C ATOM 1619 C LYS A 106 -7.075 -17.133 -20.465 1.00 0.00 C ATOM 1620 O LYS A 106 -8.291 -16.936 -20.435 1.00 0.00 O ATOM 1621 CB LYS A 106 -5.620 -16.945 -22.490 1.00 0.00 C ATOM 1622 CG LYS A 106 -4.522 -17.633 -23.283 1.00 0.00 C ATOM 1623 CD LYS A 106 -4.263 -16.929 -24.604 1.00 0.00 C ATOM 1624 CE LYS A 106 -3.178 -15.871 -24.469 1.00 0.00 C ATOM 1625 NZ LYS A 106 -2.830 -15.262 -25.782 1.00 0.00 N ATOM 0 H LYS A 106 -7.894 -17.984 -23.122 1.00 0.00 H new ATOM 0 HA LYS A 106 -5.773 -18.660 -21.203 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -6.291 -16.435 -23.181 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -5.173 -16.179 -21.856 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -3.605 -17.653 -22.694 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -4.803 -18.669 -23.471 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -3.967 -17.661 -25.356 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -5.184 -16.464 -24.956 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -3.514 -15.092 -23.785 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -2.287 -16.319 -24.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -1.893 -14.816 -25.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -2.814 -16.001 -26.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -3.540 -14.543 -26.030 1.00 0.00 H new ATOM 1639 N LEU A 107 -6.249 -16.701 -19.518 1.00 0.00 N ATOM 1640 CA LEU A 107 -6.734 -15.953 -18.363 1.00 0.00 C ATOM 1641 C LEU A 107 -6.843 -14.466 -18.685 1.00 0.00 C ATOM 1642 O LEU A 107 -7.913 -13.974 -19.045 1.00 0.00 O ATOM 1643 CB LEU A 107 -5.802 -16.161 -17.169 1.00 0.00 C ATOM 1644 CG LEU A 107 -6.101 -15.317 -15.929 1.00 0.00 C ATOM 1645 CD1 LEU A 107 -5.228 -14.072 -15.907 1.00 0.00 C ATOM 1646 CD2 LEU A 107 -7.574 -14.940 -15.884 1.00 0.00 C ATOM 0 H LEU A 107 -5.241 -16.856 -19.527 1.00 0.00 H new ATOM 0 HA LEU A 107 -7.727 -16.325 -18.110 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -5.837 -17.213 -16.885 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -4.781 -15.951 -17.489 1.00 0.00 H new ATOM 0 HG LEU A 107 -5.872 -15.911 -15.044 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -5.455 -13.484 -15.018 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -4.178 -14.364 -15.891 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -5.424 -13.474 -16.797 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -7.769 -14.340 -14.995 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -7.830 -14.365 -16.774 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -8.180 -15.845 -15.851 1.00 0.00 H new ATOM 1658 N THR A 108 -5.728 -13.754 -18.554 1.00 0.00 N ATOM 1659 CA THR A 108 -5.698 -12.324 -18.832 1.00 0.00 C ATOM 1660 C THR A 108 -6.351 -12.010 -20.173 1.00 0.00 C ATOM 1661 O THR A 108 -6.819 -10.894 -20.400 1.00 0.00 O ATOM 1662 CB THR A 108 -4.256 -11.783 -18.837 1.00 0.00 C ATOM 1663 OG1 THR A 108 -4.266 -10.360 -19.002 1.00 0.00 O ATOM 1664 CG2 THR A 108 -3.442 -12.421 -19.952 1.00 0.00 C ATOM 0 H THR A 108 -4.834 -14.145 -18.257 1.00 0.00 H new ATOM 0 HA THR A 108 -6.259 -11.836 -18.035 1.00 0.00 H new ATOM 0 HB THR A 108 -3.795 -12.035 -17.882 1.00 0.00 H new ATOM 0 HG1 THR A 108 -3.345 -10.024 -19.003 1.00 0.00 H new ATOM 0 HG21 THR A 108 -2.427 -12.023 -19.935 1.00 0.00 H new ATOM 0 HG22 THR A 108 -3.411 -13.501 -19.807 1.00 0.00 H new ATOM 0 HG23 THR A 108 -3.904 -12.197 -20.914 1.00 0.00 H new ATOM 1672 N ASP A 109 -6.380 -13.000 -21.058 1.00 0.00 N ATOM 1673 CA ASP A 109 -6.978 -12.830 -22.377 1.00 0.00 C ATOM 1674 C ASP A 109 -8.500 -12.814 -22.285 1.00 0.00 C ATOM 1675 O ASP A 109 -9.160 -11.975 -22.899 1.00 0.00 O ATOM 1676 CB ASP A 109 -6.522 -13.949 -23.315 1.00 0.00 C ATOM 1677 CG ASP A 109 -5.907 -13.417 -24.594 1.00 0.00 C ATOM 1678 OD1 ASP A 109 -6.247 -12.282 -24.990 1.00 0.00 O ATOM 1679 OD2 ASP A 109 -5.085 -14.136 -25.200 1.00 0.00 O ATOM 0 H ASP A 109 -5.996 -13.929 -20.886 1.00 0.00 H new ATOM 0 HA ASP A 109 -6.647 -11.873 -22.779 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -5.796 -14.577 -22.800 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -7.374 -14.583 -23.561 1.00 0.00 H new ATOM 1684 N ILE A 110 -9.051 -13.747 -21.517 1.00 0.00 N ATOM 1685 CA ILE A 110 -10.496 -13.840 -21.345 1.00 0.00 C ATOM 1686 C ILE A 110 -11.014 -12.732 -20.434 1.00 0.00 C ATOM 1687 O ILE A 110 -12.131 -12.243 -20.606 1.00 0.00 O ATOM 1688 CB ILE A 110 -10.907 -15.204 -20.761 1.00 0.00 C ATOM 1689 CG1 ILE A 110 -11.356 -16.148 -21.878 1.00 0.00 C ATOM 1690 CG2 ILE A 110 -12.015 -15.027 -19.732 1.00 0.00 C ATOM 1691 CD1 ILE A 110 -10.321 -16.332 -22.965 1.00 0.00 C ATOM 0 H ILE A 110 -8.519 -14.450 -21.004 1.00 0.00 H new ATOM 0 HA ILE A 110 -10.939 -13.730 -22.335 1.00 0.00 H new ATOM 0 HB ILE A 110 -10.043 -15.645 -20.264 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -11.595 -17.120 -21.447 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -12.273 -15.762 -22.322 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -12.295 -16.000 -19.328 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -11.662 -14.386 -18.924 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -12.882 -14.568 -20.207 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -10.707 -17.013 -23.723 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -10.099 -15.368 -23.423 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.410 -16.747 -22.534 1.00 0.00 H new ATOM 1703 N LEU A 111 -10.194 -12.338 -19.466 1.00 0.00 N ATOM 1704 CA LEU A 111 -10.567 -11.286 -18.528 1.00 0.00 C ATOM 1705 C LEU A 111 -10.555 -9.921 -19.208 1.00 0.00 C ATOM 1706 O LEU A 111 -11.429 -9.086 -18.967 1.00 0.00 O ATOM 1707 CB LEU A 111 -9.614 -11.280 -17.331 1.00 0.00 C ATOM 1708 CG LEU A 111 -10.262 -11.096 -15.958 1.00 0.00 C ATOM 1709 CD1 LEU A 111 -10.875 -9.709 -15.839 1.00 0.00 C ATOM 1710 CD2 LEU A 111 -11.314 -12.169 -15.717 1.00 0.00 C ATOM 0 H LEU A 111 -9.266 -12.732 -19.310 1.00 0.00 H new ATOM 0 HA LEU A 111 -11.579 -11.489 -18.178 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -9.062 -12.220 -17.327 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -8.885 -10.483 -17.476 1.00 0.00 H new ATOM 0 HG LEU A 111 -9.489 -11.196 -15.196 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -11.331 -9.596 -14.856 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -10.098 -8.956 -15.967 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -11.636 -9.580 -16.609 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -11.765 -12.023 -14.735 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -12.085 -12.101 -16.484 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -10.846 -13.153 -15.759 1.00 0.00 H new ATOM 1722 N THR A 112 -9.561 -9.699 -20.062 1.00 0.00 N ATOM 1723 CA THR A 112 -9.435 -8.436 -20.779 1.00 0.00 C ATOM 1724 C THR A 112 -10.487 -8.320 -21.875 1.00 0.00 C ATOM 1725 O THR A 112 -11.057 -7.250 -22.090 1.00 0.00 O ATOM 1726 CB THR A 112 -8.037 -8.283 -21.406 1.00 0.00 C ATOM 1727 OG1 THR A 112 -7.788 -6.907 -21.716 1.00 0.00 O ATOM 1728 CG2 THR A 112 -7.915 -9.123 -22.668 1.00 0.00 C ATOM 0 H THR A 112 -8.830 -10.378 -20.274 1.00 0.00 H new ATOM 0 HA THR A 112 -9.586 -7.641 -20.049 1.00 0.00 H new ATOM 0 HB THR A 112 -7.298 -8.632 -20.684 1.00 0.00 H new ATOM 0 HG1 THR A 112 -6.897 -6.817 -22.113 1.00 0.00 H new ATOM 0 HG21 THR A 112 -6.919 -8.999 -23.093 1.00 0.00 H new ATOM 0 HG22 THR A 112 -8.077 -10.173 -22.423 1.00 0.00 H new ATOM 0 HG23 THR A 112 -8.662 -8.800 -23.393 1.00 0.00 H new ATOM 1736 N GLU A 113 -10.741 -9.427 -22.566 1.00 0.00 N ATOM 1737 CA GLU A 113 -11.726 -9.447 -23.641 1.00 0.00 C ATOM 1738 C GLU A 113 -13.144 -9.395 -23.081 1.00 0.00 C ATOM 1739 O GLU A 113 -14.023 -8.749 -23.650 1.00 0.00 O ATOM 1740 CB GLU A 113 -11.550 -10.702 -24.500 1.00 0.00 C ATOM 1741 CG GLU A 113 -10.595 -10.513 -25.666 1.00 0.00 C ATOM 1742 CD GLU A 113 -11.165 -11.022 -26.976 1.00 0.00 C ATOM 1743 OE1 GLU A 113 -12.406 -11.034 -27.117 1.00 0.00 O ATOM 1744 OE2 GLU A 113 -10.371 -11.409 -27.858 1.00 0.00 O ATOM 0 H GLU A 113 -10.279 -10.321 -22.401 1.00 0.00 H new ATOM 0 HA GLU A 113 -11.567 -8.565 -24.262 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -11.186 -11.514 -23.871 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -12.523 -11.008 -24.884 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -10.354 -9.455 -25.766 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -9.661 -11.034 -25.454 1.00 0.00 H new ATOM 1751 N GLU A 114 -13.358 -10.081 -21.962 1.00 0.00 N ATOM 1752 CA GLU A 114 -14.670 -10.113 -21.326 1.00 0.00 C ATOM 1753 C GLU A 114 -15.036 -8.742 -20.765 1.00 0.00 C ATOM 1754 O GLU A 114 -16.119 -8.220 -21.031 1.00 0.00 O ATOM 1755 CB GLU A 114 -14.693 -11.157 -20.208 1.00 0.00 C ATOM 1756 CG GLU A 114 -14.897 -12.578 -20.706 1.00 0.00 C ATOM 1757 CD GLU A 114 -14.907 -13.595 -19.581 1.00 0.00 C ATOM 1758 OE1 GLU A 114 -14.659 -13.199 -18.422 1.00 0.00 O ATOM 1759 OE2 GLU A 114 -15.162 -14.785 -19.859 1.00 0.00 O ATOM 0 H GLU A 114 -12.641 -10.621 -21.478 1.00 0.00 H new ATOM 0 HA GLU A 114 -15.406 -10.385 -22.082 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -13.755 -11.106 -19.655 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -15.490 -10.909 -19.507 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -15.839 -12.636 -21.252 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -14.104 -12.829 -21.411 1.00 0.00 H new ATOM 1766 N VAL A 115 -14.126 -8.166 -19.986 1.00 0.00 N ATOM 1767 CA VAL A 115 -14.353 -6.856 -19.387 1.00 0.00 C ATOM 1768 C VAL A 115 -14.436 -5.770 -20.454 1.00 0.00 C ATOM 1769 O VAL A 115 -15.140 -4.775 -20.287 1.00 0.00 O ATOM 1770 CB VAL A 115 -13.236 -6.495 -18.389 1.00 0.00 C ATOM 1771 CG1 VAL A 115 -13.135 -7.549 -17.297 1.00 0.00 C ATOM 1772 CG2 VAL A 115 -11.907 -6.334 -19.112 1.00 0.00 C ATOM 0 H VAL A 115 -13.225 -8.585 -19.755 1.00 0.00 H new ATOM 0 HA VAL A 115 -15.303 -6.911 -18.855 1.00 0.00 H new ATOM 0 HB VAL A 115 -13.485 -5.543 -17.920 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -12.341 -7.277 -16.601 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -14.082 -7.609 -16.761 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -12.909 -8.517 -17.745 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -11.130 -6.079 -18.392 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -11.648 -7.268 -19.610 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -11.990 -5.539 -19.853 1.00 0.00 H new ATOM 1782 N GLU A 116 -13.712 -5.970 -21.552 1.00 0.00 N ATOM 1783 CA GLU A 116 -13.704 -5.007 -22.647 1.00 0.00 C ATOM 1784 C GLU A 116 -15.054 -4.982 -23.359 1.00 0.00 C ATOM 1785 O GLU A 116 -15.614 -3.916 -23.614 1.00 0.00 O ATOM 1786 CB GLU A 116 -12.595 -5.345 -23.645 1.00 0.00 C ATOM 1787 CG GLU A 116 -12.449 -4.325 -24.761 1.00 0.00 C ATOM 1788 CD GLU A 116 -13.283 -4.672 -25.980 1.00 0.00 C ATOM 1789 OE1 GLU A 116 -12.914 -5.625 -26.698 1.00 0.00 O ATOM 1790 OE2 GLU A 116 -14.302 -3.991 -26.216 1.00 0.00 O ATOM 0 H GLU A 116 -13.124 -6.789 -21.706 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.516 -4.019 -22.227 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.648 -5.424 -23.110 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -12.797 -6.323 -24.082 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -12.743 -3.343 -24.391 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.400 -4.256 -25.050 1.00 0.00 H new ATOM 1797 N LYS A 117 -15.570 -6.164 -23.677 1.00 0.00 N ATOM 1798 CA LYS A 117 -16.853 -6.280 -24.359 1.00 0.00 C ATOM 1799 C LYS A 117 -18.009 -6.106 -23.378 1.00 0.00 C ATOM 1800 O LYS A 117 -19.159 -5.942 -23.783 1.00 0.00 O ATOM 1801 CB LYS A 117 -16.963 -7.638 -25.056 1.00 0.00 C ATOM 1802 CG LYS A 117 -15.907 -7.860 -26.126 1.00 0.00 C ATOM 1803 CD LYS A 117 -15.803 -9.326 -26.512 1.00 0.00 C ATOM 1804 CE LYS A 117 -16.874 -9.715 -27.518 1.00 0.00 C ATOM 1805 NZ LYS A 117 -16.287 -10.121 -28.825 1.00 0.00 N ATOM 0 H LYS A 117 -15.119 -7.056 -23.473 1.00 0.00 H new ATOM 0 HA LYS A 117 -16.911 -5.489 -25.106 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -16.883 -8.428 -24.309 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -17.951 -7.726 -25.508 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -16.151 -7.267 -27.008 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -14.941 -7.509 -25.763 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -14.817 -9.523 -26.934 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -15.898 -9.946 -25.620 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -17.468 -10.536 -27.116 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -17.552 -8.875 -27.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -17.050 -10.379 -29.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -15.741 -9.330 -29.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -15.660 -10.939 -28.685 1.00 0.00 H new ATOM 1819 N ALA A 118 -17.693 -6.142 -22.088 1.00 0.00 N ATOM 1820 CA ALA A 118 -18.705 -5.984 -21.050 1.00 0.00 C ATOM 1821 C ALA A 118 -18.920 -4.513 -20.712 1.00 0.00 C ATOM 1822 O ALA A 118 -20.014 -4.112 -20.312 1.00 0.00 O ATOM 1823 CB ALA A 118 -18.307 -6.761 -19.804 1.00 0.00 C ATOM 0 H ALA A 118 -16.745 -6.279 -21.737 1.00 0.00 H new ATOM 0 HA ALA A 118 -19.645 -6.383 -21.430 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -19.071 -6.635 -19.037 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -18.211 -7.819 -20.050 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -17.353 -6.387 -19.431 1.00 0.00 H new ATOM 1829 N ILE A 119 -17.872 -3.714 -20.875 1.00 0.00 N ATOM 1830 CA ILE A 119 -17.947 -2.287 -20.587 1.00 0.00 C ATOM 1831 C ILE A 119 -18.106 -1.475 -21.868 1.00 0.00 C ATOM 1832 O ILE A 119 -18.713 -0.404 -21.866 1.00 0.00 O ATOM 1833 CB ILE A 119 -16.696 -1.797 -19.834 1.00 0.00 C ATOM 1834 CG1 ILE A 119 -16.579 -2.503 -18.482 1.00 0.00 C ATOM 1835 CG2 ILE A 119 -16.748 -0.288 -19.647 1.00 0.00 C ATOM 1836 CD1 ILE A 119 -15.170 -2.943 -18.151 1.00 0.00 C ATOM 0 H ILE A 119 -16.960 -4.030 -21.205 1.00 0.00 H new ATOM 0 HA ILE A 119 -18.822 -2.139 -19.955 1.00 0.00 H new ATOM 0 HB ILE A 119 -15.814 -2.040 -20.427 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -16.935 -1.833 -17.699 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -17.234 -3.375 -18.478 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -15.857 0.043 -19.113 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -16.789 0.198 -20.622 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -17.635 -0.023 -19.072 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -15.162 -3.436 -17.179 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -14.817 -3.638 -18.913 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -14.514 -2.073 -18.122 1.00 0.00 H new ATOM 1848 N SER A 120 -17.559 -1.995 -22.963 1.00 0.00 N ATOM 1849 CA SER A 120 -17.638 -1.318 -24.252 1.00 0.00 C ATOM 1850 C SER A 120 -18.840 -1.812 -25.052 1.00 0.00 C ATOM 1851 O SER A 120 -19.719 -1.033 -25.421 1.00 0.00 O ATOM 1852 CB SER A 120 -16.352 -1.543 -25.050 1.00 0.00 C ATOM 1853 OG SER A 120 -16.047 -0.416 -25.854 1.00 0.00 O ATOM 0 H SER A 120 -17.057 -2.883 -22.983 1.00 0.00 H new ATOM 0 HA SER A 120 -17.760 -0.251 -24.067 1.00 0.00 H new ATOM 0 HB2 SER A 120 -15.526 -1.740 -24.367 1.00 0.00 H new ATOM 0 HB3 SER A 120 -16.461 -2.425 -25.681 1.00 0.00 H new ATOM 0 HG SER A 120 -15.220 -0.584 -26.353 1.00 0.00 H new ATOM 1859 N LYS A 121 -18.871 -3.113 -25.318 1.00 0.00 N ATOM 1860 CA LYS A 121 -19.963 -3.715 -26.073 1.00 0.00 C ATOM 1861 C LYS A 121 -21.305 -3.442 -25.400 1.00 0.00 C ATOM 1862 O LYS A 121 -22.361 -3.623 -26.005 1.00 0.00 O ATOM 1863 CB LYS A 121 -19.746 -5.224 -26.210 1.00 0.00 C ATOM 1864 CG LYS A 121 -19.945 -5.741 -27.624 1.00 0.00 C ATOM 1865 CD LYS A 121 -21.282 -6.448 -27.776 1.00 0.00 C ATOM 1866 CE LYS A 121 -21.203 -7.576 -28.793 1.00 0.00 C ATOM 1867 NZ LYS A 121 -21.816 -8.831 -28.279 1.00 0.00 N ATOM 0 H LYS A 121 -18.151 -3.772 -25.021 1.00 0.00 H new ATOM 0 HA LYS A 121 -19.976 -3.265 -27.066 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -18.736 -5.469 -25.881 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -20.433 -5.744 -25.542 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -19.890 -4.910 -28.327 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -19.138 -6.428 -27.878 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -21.595 -6.847 -26.811 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -22.041 -5.730 -28.086 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -21.709 -7.274 -29.710 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -20.160 -7.760 -29.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -21.742 -9.575 -29.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -21.317 -9.134 -27.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -22.818 -8.662 -28.057 1.00 0.00 H new ATOM 1881 N SER A 122 -21.254 -3.006 -24.145 1.00 0.00 N ATOM 1882 CA SER A 122 -22.466 -2.711 -23.390 1.00 0.00 C ATOM 1883 C SER A 122 -23.256 -1.584 -24.048 1.00 0.00 C ATOM 1884 O SER A 122 -24.449 -1.724 -24.317 1.00 0.00 O ATOM 1885 CB SER A 122 -22.114 -2.329 -21.950 1.00 0.00 C ATOM 1886 OG SER A 122 -20.801 -1.802 -21.869 1.00 0.00 O ATOM 0 H SER A 122 -20.387 -2.849 -23.630 1.00 0.00 H new ATOM 0 HA SER A 122 -23.086 -3.608 -23.380 1.00 0.00 H new ATOM 0 HB2 SER A 122 -22.828 -1.593 -21.581 1.00 0.00 H new ATOM 0 HB3 SER A 122 -22.198 -3.205 -21.307 1.00 0.00 H new ATOM 0 HG SER A 122 -20.808 -0.863 -22.149 1.00 0.00 H new ATOM 1892 N GLN A 123 -22.581 -0.468 -24.305 1.00 0.00 N ATOM 1893 CA GLN A 123 -23.220 0.683 -24.931 1.00 0.00 C ATOM 1894 C GLN A 123 -22.631 0.947 -26.313 1.00 0.00 C ATOM 1895 O GLN A 123 -23.284 0.716 -27.332 1.00 0.00 O ATOM 1896 CB GLN A 123 -23.059 1.924 -24.051 1.00 0.00 C ATOM 1897 CG GLN A 123 -23.287 3.231 -24.793 1.00 0.00 C ATOM 1898 CD GLN A 123 -24.107 4.222 -23.992 1.00 0.00 C ATOM 1899 OE1 GLN A 123 -23.598 5.252 -23.549 1.00 0.00 O ATOM 1900 NE2 GLN A 123 -25.385 3.916 -23.801 1.00 0.00 N ATOM 0 H GLN A 123 -21.593 -0.337 -24.089 1.00 0.00 H new ATOM 0 HA GLN A 123 -24.281 0.461 -25.044 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -23.760 1.862 -23.218 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -22.056 1.929 -23.624 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -22.324 3.677 -25.039 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -23.793 3.025 -25.736 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -25.766 3.052 -24.186 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -25.986 4.545 -23.269 1.00 0.00 H new