USER MOD reduce.3.24.130724 H: found=0, std=0, add=820, rem=0, adj=24 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 Set 1.1: A 108 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 112 THR OG1 : rot 107:sc= 1.24 USER MOD Set 2.1: A 89 ASN : amide:sc= -0.578 X(o=-0.61,f=-0.4) USER MOD Set 2.2: A 100 SER OG : rot 150:sc= -0.0321 USER MOD Set 3.1: A 76 ASN :FLIP amide:sc= -1.88! C(o=-2.1!,f=-1.5!) USER MOD Set 3.2: A 78 GLN :FLIP amide:sc= 0.412 F(o=-2.1,f=-1.5) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 TYR OH : rot 37:sc= -0.975 USER MOD Single : A 23 HIS : no HD1:sc= -0.0353 X(o=-0.035,f=-0.032) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 HIS : no HD1:sc= -3.75! X(o=-3.7!,f=-3.4) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= -0.795 USER MOD Single : A 44 HIS : no HE2:sc= -3.68! C(o=-3.7!,f=-8.4!) USER MOD Single : A 47 CYS SG : rot 169:sc= 0.412 USER MOD Single : A 54 SER OG : rot 180:sc=-0.00105 USER MOD Single : A 55 HIS : no HD1:sc= -0.373 X(o=-0.37,f=-0.17) USER MOD Single : A 58 MET CE :methyl -128:sc= -6.99! (180deg=-11.3!) USER MOD Single : A 59 THR OG1 : rot -163:sc= -0.809 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 100:sc= -2.96! USER MOD Single : A 71 ASN : amide:sc= -3.63! C(o=-3.6!,f=-5.4!) USER MOD Single : A 72 LYS NZ :NH3+ 158:sc= -1.3! (180deg=-2.51!) USER MOD Single : A 73 GLN : amide:sc= -0.0635 K(o=-0.063,f=-2.9) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot -76:sc= -1.9! USER MOD Single : A 86 SER OG : rot 66:sc= 1.2 USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 103 ASN :FLIP amide:sc= -4.34! C(o=-6.7!,f=-4.3!) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ -170:sc= 0.00306 (180deg=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 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 251 N PRO A 18 11.057 -24.733 -9.570 1.00 0.00 N ATOM 252 CA PRO A 18 11.431 -23.319 -9.469 1.00 0.00 C ATOM 253 C PRO A 18 10.452 -22.519 -8.617 1.00 0.00 C ATOM 254 O PRO A 18 9.673 -21.717 -9.134 1.00 0.00 O ATOM 255 CB PRO A 18 11.392 -22.838 -10.922 1.00 0.00 C ATOM 256 CG PRO A 18 10.439 -23.759 -11.601 1.00 0.00 C ATOM 257 CD PRO A 18 10.595 -25.091 -10.922 1.00 0.00 C ATOM 0 HA PRO A 18 12.400 -23.187 -8.987 1.00 0.00 H new ATOM 0 HB2 PRO A 18 11.057 -21.803 -10.987 1.00 0.00 H new ATOM 0 HB3 PRO A 18 12.380 -22.883 -11.380 1.00 0.00 H new ATOM 0 HG2 PRO A 18 9.415 -23.394 -11.514 1.00 0.00 H new ATOM 0 HG3 PRO A 18 10.661 -23.835 -12.665 1.00 0.00 H new ATOM 0 HD2 PRO A 18 9.654 -25.640 -10.893 1.00 0.00 H new ATOM 0 HD3 PRO A 18 11.317 -25.723 -11.439 1.00 0.00 H new ATOM 265 N LEU A 19 10.496 -22.742 -7.308 1.00 0.00 N ATOM 266 CA LEU A 19 9.612 -22.041 -6.383 1.00 0.00 C ATOM 267 C LEU A 19 9.816 -20.532 -6.472 1.00 0.00 C ATOM 268 O LEU A 19 8.854 -19.770 -6.550 1.00 0.00 O ATOM 269 CB LEU A 19 9.860 -22.517 -4.950 1.00 0.00 C ATOM 270 CG LEU A 19 9.127 -23.792 -4.530 1.00 0.00 C ATOM 271 CD1 LEU A 19 9.465 -24.153 -3.092 1.00 0.00 C ATOM 272 CD2 LEU A 19 7.624 -23.624 -4.701 1.00 0.00 C ATOM 0 H LEU A 19 11.134 -23.402 -6.863 1.00 0.00 H new ATOM 0 HA LEU A 19 8.583 -22.267 -6.662 1.00 0.00 H new ATOM 0 HB2 LEU A 19 10.930 -22.678 -4.822 1.00 0.00 H new ATOM 0 HB3 LEU A 19 9.575 -21.716 -4.268 1.00 0.00 H new ATOM 0 HG LEU A 19 9.457 -24.607 -5.174 1.00 0.00 H new ATOM 0 HD11 LEU A 19 8.934 -25.063 -2.811 1.00 0.00 H new ATOM 0 HD12 LEU A 19 10.539 -24.316 -3.001 1.00 0.00 H new ATOM 0 HD13 LEU A 19 9.164 -23.339 -2.432 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.119 -24.541 -4.397 1.00 0.00 H new ATOM 0 HD22 LEU A 19 7.278 -22.797 -4.082 1.00 0.00 H new ATOM 0 HD23 LEU A 19 7.398 -23.414 -5.746 1.00 0.00 H new ATOM 284 N GLU A 20 11.077 -20.109 -6.461 1.00 0.00 N ATOM 285 CA GLU A 20 11.406 -18.691 -6.542 1.00 0.00 C ATOM 286 C GLU A 20 10.773 -18.055 -7.776 1.00 0.00 C ATOM 287 O GLU A 20 10.231 -16.952 -7.711 1.00 0.00 O ATOM 288 CB GLU A 20 12.924 -18.499 -6.577 1.00 0.00 C ATOM 289 CG GLU A 20 13.351 -17.046 -6.706 1.00 0.00 C ATOM 290 CD GLU A 20 14.843 -16.858 -6.517 1.00 0.00 C ATOM 291 OE1 GLU A 20 15.283 -16.742 -5.354 1.00 0.00 O ATOM 292 OE2 GLU A 20 15.571 -16.826 -7.531 1.00 0.00 O ATOM 0 H GLU A 20 11.886 -20.727 -6.397 1.00 0.00 H new ATOM 0 HA GLU A 20 11.005 -18.200 -5.656 1.00 0.00 H new ATOM 0 HB2 GLU A 20 13.356 -18.916 -5.667 1.00 0.00 H new ATOM 0 HB3 GLU A 20 13.334 -19.065 -7.413 1.00 0.00 H new ATOM 0 HG2 GLU A 20 13.063 -16.672 -7.689 1.00 0.00 H new ATOM 0 HG3 GLU A 20 12.817 -16.447 -5.968 1.00 0.00 H new ATOM 299 N LYS A 21 10.846 -18.759 -8.901 1.00 0.00 N ATOM 300 CA LYS A 21 10.281 -18.265 -10.151 1.00 0.00 C ATOM 301 C LYS A 21 8.759 -18.201 -10.071 1.00 0.00 C ATOM 302 O LYS A 21 8.133 -17.328 -10.672 1.00 0.00 O ATOM 303 CB LYS A 21 10.703 -19.164 -11.315 1.00 0.00 C ATOM 304 CG LYS A 21 10.528 -18.516 -12.678 1.00 0.00 C ATOM 305 CD LYS A 21 11.699 -17.610 -13.020 1.00 0.00 C ATOM 306 CE LYS A 21 12.379 -18.042 -14.310 1.00 0.00 C ATOM 307 NZ LYS A 21 11.525 -17.780 -15.502 1.00 0.00 N ATOM 0 H LYS A 21 11.291 -19.674 -8.972 1.00 0.00 H new ATOM 0 HA LYS A 21 10.662 -17.258 -10.321 1.00 0.00 H new ATOM 0 HB2 LYS A 21 11.749 -19.444 -11.187 1.00 0.00 H new ATOM 0 HB3 LYS A 21 10.120 -20.085 -11.282 1.00 0.00 H new ATOM 0 HG2 LYS A 21 10.431 -19.290 -13.440 1.00 0.00 H new ATOM 0 HG3 LYS A 21 9.604 -17.938 -12.691 1.00 0.00 H new ATOM 0 HD2 LYS A 21 11.349 -16.582 -13.118 1.00 0.00 H new ATOM 0 HD3 LYS A 21 12.422 -17.624 -12.204 1.00 0.00 H new ATOM 0 HE2 LYS A 21 13.325 -17.511 -14.417 1.00 0.00 H new ATOM 0 HE3 LYS A 21 12.614 -19.105 -14.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 12.024 -18.088 -16.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 10.633 -18.306 -15.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 11.321 -16.762 -15.566 1.00 0.00 H new ATOM 321 N TYR A 22 8.170 -19.128 -9.324 1.00 0.00 N ATOM 322 CA TYR A 22 6.722 -19.177 -9.167 1.00 0.00 C ATOM 323 C TYR A 22 6.220 -17.978 -8.368 1.00 0.00 C ATOM 324 O TYR A 22 5.200 -17.376 -8.704 1.00 0.00 O ATOM 325 CB TYR A 22 6.306 -20.476 -8.474 1.00 0.00 C ATOM 326 CG TYR A 22 4.999 -20.369 -7.721 1.00 0.00 C ATOM 327 CD1 TYR A 22 4.919 -19.663 -6.526 1.00 0.00 C ATOM 328 CD2 TYR A 22 3.845 -20.975 -8.202 1.00 0.00 C ATOM 329 CE1 TYR A 22 3.728 -19.564 -5.834 1.00 0.00 C ATOM 330 CE2 TYR A 22 2.649 -20.879 -7.518 1.00 0.00 C ATOM 331 CZ TYR A 22 2.596 -20.173 -6.334 1.00 0.00 C ATOM 332 OH TYR A 22 1.407 -20.076 -5.648 1.00 0.00 O ATOM 0 H TYR A 22 8.674 -19.856 -8.817 1.00 0.00 H new ATOM 0 HA TYR A 22 6.273 -19.143 -10.160 1.00 0.00 H new ATOM 0 HB2 TYR A 22 6.222 -21.265 -9.221 1.00 0.00 H new ATOM 0 HB3 TYR A 22 7.092 -20.776 -7.781 1.00 0.00 H new ATOM 0 HD1 TYR A 22 5.803 -19.184 -6.132 1.00 0.00 H new ATOM 0 HD2 TYR A 22 3.884 -21.531 -9.127 1.00 0.00 H new ATOM 0 HE1 TYR A 22 3.683 -19.013 -4.906 1.00 0.00 H new ATOM 0 HE2 TYR A 22 1.761 -21.354 -7.908 1.00 0.00 H new ATOM 0 HH TYR A 22 1.333 -19.185 -5.247 1.00 0.00 H new ATOM 342 N HIS A 23 6.945 -17.637 -7.307 1.00 0.00 N ATOM 343 CA HIS A 23 6.576 -16.509 -6.459 1.00 0.00 C ATOM 344 C HIS A 23 6.890 -15.185 -7.149 1.00 0.00 C ATOM 345 O HIS A 23 6.243 -14.171 -6.889 1.00 0.00 O ATOM 346 CB HIS A 23 7.311 -16.587 -5.121 1.00 0.00 C ATOM 347 CG HIS A 23 6.789 -17.657 -4.212 1.00 0.00 C ATOM 348 ND1 HIS A 23 5.624 -17.524 -3.486 1.00 0.00 N ATOM 349 CD2 HIS A 23 7.278 -18.883 -3.914 1.00 0.00 C ATOM 350 CE1 HIS A 23 5.420 -18.622 -2.780 1.00 0.00 C ATOM 351 NE2 HIS A 23 6.410 -19.463 -3.022 1.00 0.00 N ATOM 0 H HIS A 23 7.791 -18.126 -7.014 1.00 0.00 H new ATOM 0 HA HIS A 23 5.502 -16.559 -6.278 1.00 0.00 H new ATOM 0 HB2 HIS A 23 8.370 -16.765 -5.308 1.00 0.00 H new ATOM 0 HB3 HIS A 23 7.234 -15.624 -4.617 1.00 0.00 H new ATOM 0 HD2 HIS A 23 8.183 -19.324 -4.305 1.00 0.00 H new ATOM 0 HE1 HIS A 23 4.586 -18.802 -2.118 1.00 0.00 H new ATOM 0 HE2 HIS A 23 6.513 -20.392 -2.613 1.00 0.00 H new ATOM 359 N GLU A 24 7.887 -15.203 -8.029 1.00 0.00 N ATOM 360 CA GLU A 24 8.286 -14.003 -8.754 1.00 0.00 C ATOM 361 C GLU A 24 7.259 -13.647 -9.825 1.00 0.00 C ATOM 362 O GLU A 24 6.803 -12.507 -9.906 1.00 0.00 O ATOM 363 CB GLU A 24 9.661 -14.202 -9.396 1.00 0.00 C ATOM 364 CG GLU A 24 10.811 -14.132 -8.406 1.00 0.00 C ATOM 365 CD GLU A 24 11.641 -12.873 -8.565 1.00 0.00 C ATOM 366 OE1 GLU A 24 12.564 -12.872 -9.405 1.00 0.00 O ATOM 367 OE2 GLU A 24 11.366 -11.888 -7.847 1.00 0.00 O ATOM 0 H GLU A 24 8.432 -16.035 -8.256 1.00 0.00 H new ATOM 0 HA GLU A 24 8.341 -13.180 -8.041 1.00 0.00 H new ATOM 0 HB2 GLU A 24 9.682 -15.170 -9.897 1.00 0.00 H new ATOM 0 HB3 GLU A 24 9.807 -13.443 -10.164 1.00 0.00 H new ATOM 0 HG2 GLU A 24 10.415 -14.176 -7.391 1.00 0.00 H new ATOM 0 HG3 GLU A 24 11.452 -15.004 -8.537 1.00 0.00 H new ATOM 374 N GLU A 25 6.901 -14.631 -10.643 1.00 0.00 N ATOM 375 CA GLU A 25 5.929 -14.421 -11.710 1.00 0.00 C ATOM 376 C GLU A 25 4.536 -14.176 -11.136 1.00 0.00 C ATOM 377 O GLU A 25 3.872 -13.201 -11.485 1.00 0.00 O ATOM 378 CB GLU A 25 5.900 -15.628 -12.649 1.00 0.00 C ATOM 379 CG GLU A 25 7.018 -15.624 -13.679 1.00 0.00 C ATOM 380 CD GLU A 25 6.948 -16.811 -14.620 1.00 0.00 C ATOM 381 OE1 GLU A 25 6.892 -17.957 -14.128 1.00 0.00 O ATOM 382 OE2 GLU A 25 6.949 -16.593 -15.850 1.00 0.00 O ATOM 0 H GLU A 25 7.269 -15.581 -10.588 1.00 0.00 H new ATOM 0 HA GLU A 25 6.232 -13.539 -12.274 1.00 0.00 H new ATOM 0 HB2 GLU A 25 5.966 -16.541 -12.057 1.00 0.00 H new ATOM 0 HB3 GLU A 25 4.941 -15.653 -13.166 1.00 0.00 H new ATOM 0 HG2 GLU A 25 6.970 -14.702 -14.259 1.00 0.00 H new ATOM 0 HG3 GLU A 25 7.980 -15.628 -13.166 1.00 0.00 H new ATOM 389 N ALA A 26 4.100 -15.070 -10.254 1.00 0.00 N ATOM 390 CA ALA A 26 2.788 -14.952 -9.631 1.00 0.00 C ATOM 391 C ALA A 26 2.658 -13.636 -8.872 1.00 0.00 C ATOM 392 O ALA A 26 1.602 -13.003 -8.884 1.00 0.00 O ATOM 393 CB ALA A 26 2.538 -16.128 -8.699 1.00 0.00 C ATOM 0 H ALA A 26 4.637 -15.884 -9.955 1.00 0.00 H new ATOM 0 HA ALA A 26 2.036 -14.962 -10.420 1.00 0.00 H new ATOM 0 HB1 ALA A 26 1.554 -16.026 -8.241 1.00 0.00 H new ATOM 0 HB2 ALA A 26 2.580 -17.057 -9.267 1.00 0.00 H new ATOM 0 HB3 ALA A 26 3.301 -16.144 -7.921 1.00 0.00 H new ATOM 399 N ASP A 27 3.736 -13.231 -8.211 1.00 0.00 N ATOM 400 CA ASP A 27 3.743 -11.989 -7.445 1.00 0.00 C ATOM 401 C ASP A 27 3.609 -10.782 -8.368 1.00 0.00 C ATOM 402 O ASP A 27 2.831 -9.866 -8.099 1.00 0.00 O ATOM 403 CB ASP A 27 5.028 -11.879 -6.623 1.00 0.00 C ATOM 404 CG ASP A 27 5.163 -10.533 -5.939 1.00 0.00 C ATOM 405 OD1 ASP A 27 4.131 -9.852 -5.759 1.00 0.00 O ATOM 406 OD2 ASP A 27 6.300 -10.160 -5.582 1.00 0.00 O ATOM 0 H ASP A 27 4.617 -13.744 -8.190 1.00 0.00 H new ATOM 0 HA ASP A 27 2.889 -12.003 -6.768 1.00 0.00 H new ATOM 0 HB2 ASP A 27 5.044 -12.669 -5.872 1.00 0.00 H new ATOM 0 HB3 ASP A 27 5.887 -12.041 -7.274 1.00 0.00 H new ATOM 411 N ASP A 28 4.372 -10.787 -9.455 1.00 0.00 N ATOM 412 CA ASP A 28 4.338 -9.692 -10.418 1.00 0.00 C ATOM 413 C ASP A 28 3.043 -9.716 -11.224 1.00 0.00 C ATOM 414 O ASP A 28 2.542 -8.672 -11.643 1.00 0.00 O ATOM 415 CB ASP A 28 5.541 -9.775 -11.359 1.00 0.00 C ATOM 416 CG ASP A 28 6.862 -9.682 -10.621 1.00 0.00 C ATOM 417 OD1 ASP A 28 6.873 -9.153 -9.489 1.00 0.00 O ATOM 418 OD2 ASP A 28 7.884 -10.138 -11.174 1.00 0.00 O ATOM 0 H ASP A 28 5.022 -11.537 -9.692 1.00 0.00 H new ATOM 0 HA ASP A 28 4.383 -8.754 -9.865 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.502 -10.714 -11.911 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.481 -8.971 -12.093 1.00 0.00 H new ATOM 423 N TYR A 29 2.508 -10.912 -11.437 1.00 0.00 N ATOM 424 CA TYR A 29 1.273 -11.073 -12.196 1.00 0.00 C ATOM 425 C TYR A 29 0.091 -10.466 -11.447 1.00 0.00 C ATOM 426 O TYR A 29 -0.649 -9.644 -11.991 1.00 0.00 O ATOM 427 CB TYR A 29 1.009 -12.554 -12.474 1.00 0.00 C ATOM 428 CG TYR A 29 1.146 -12.929 -13.932 1.00 0.00 C ATOM 429 CD1 TYR A 29 0.265 -12.430 -14.884 1.00 0.00 C ATOM 430 CD2 TYR A 29 2.155 -13.784 -14.358 1.00 0.00 C ATOM 431 CE1 TYR A 29 0.385 -12.771 -16.217 1.00 0.00 C ATOM 432 CE2 TYR A 29 2.284 -14.129 -15.690 1.00 0.00 C ATOM 433 CZ TYR A 29 1.396 -13.621 -16.615 1.00 0.00 C ATOM 434 OH TYR A 29 1.521 -13.963 -17.942 1.00 0.00 O ATOM 0 H TYR A 29 2.910 -11.785 -11.095 1.00 0.00 H new ATOM 0 HA TYR A 29 1.388 -10.548 -13.144 1.00 0.00 H new ATOM 0 HB2 TYR A 29 1.703 -13.155 -11.886 1.00 0.00 H new ATOM 0 HB3 TYR A 29 0.004 -12.805 -12.136 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -0.527 -11.764 -14.576 1.00 0.00 H new ATOM 0 HD2 TYR A 29 2.850 -14.186 -13.636 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -0.309 -12.374 -16.944 1.00 0.00 H new ATOM 0 HE2 TYR A 29 3.076 -14.793 -16.005 1.00 0.00 H new ATOM 0 HH TYR A 29 2.284 -14.568 -18.053 1.00 0.00 H new ATOM 444 N LEU A 30 -0.082 -10.876 -10.195 1.00 0.00 N ATOM 445 CA LEU A 30 -1.174 -10.374 -9.369 1.00 0.00 C ATOM 446 C LEU A 30 -0.993 -8.889 -9.072 1.00 0.00 C ATOM 447 O LEU A 30 -1.948 -8.114 -9.122 1.00 0.00 O ATOM 448 CB LEU A 30 -1.253 -11.161 -8.060 1.00 0.00 C ATOM 449 CG LEU A 30 -1.504 -12.664 -8.195 1.00 0.00 C ATOM 450 CD1 LEU A 30 -2.456 -13.145 -7.111 1.00 0.00 C ATOM 451 CD2 LEU A 30 -2.054 -12.991 -9.575 1.00 0.00 C ATOM 0 H LEU A 30 0.520 -11.555 -9.730 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.105 -10.505 -9.921 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.320 -11.016 -7.515 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -2.048 -10.733 -7.450 1.00 0.00 H new ATOM 0 HG LEU A 30 -0.554 -13.184 -8.073 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -2.623 -14.216 -7.223 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -2.022 -12.946 -6.131 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -3.406 -12.618 -7.201 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -2.226 -14.064 -9.653 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -2.994 -12.460 -9.727 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -1.336 -12.683 -10.335 1.00 0.00 H new ATOM 463 N ASP A 31 0.239 -8.498 -8.764 1.00 0.00 N ATOM 464 CA ASP A 31 0.547 -7.105 -8.462 1.00 0.00 C ATOM 465 C ASP A 31 0.236 -6.209 -9.656 1.00 0.00 C ATOM 466 O ASP A 31 -0.426 -5.179 -9.518 1.00 0.00 O ATOM 467 CB ASP A 31 2.017 -6.959 -8.068 1.00 0.00 C ATOM 468 CG ASP A 31 2.227 -7.053 -6.569 1.00 0.00 C ATOM 469 OD1 ASP A 31 2.247 -8.185 -6.042 1.00 0.00 O ATOM 470 OD2 ASP A 31 2.373 -5.994 -5.924 1.00 0.00 O ATOM 0 H ASP A 31 1.041 -9.127 -8.717 1.00 0.00 H new ATOM 0 HA ASP A 31 -0.078 -6.794 -7.625 1.00 0.00 H new ATOM 0 HB2 ASP A 31 2.602 -7.734 -8.563 1.00 0.00 H new ATOM 0 HB3 ASP A 31 2.392 -6.000 -8.425 1.00 0.00 H new ATOM 475 N HIS A 32 0.719 -6.606 -10.829 1.00 0.00 N ATOM 476 CA HIS A 32 0.493 -5.838 -12.049 1.00 0.00 C ATOM 477 C HIS A 32 -0.994 -5.780 -12.387 1.00 0.00 C ATOM 478 O HIS A 32 -1.469 -4.812 -12.982 1.00 0.00 O ATOM 479 CB HIS A 32 1.269 -6.451 -13.214 1.00 0.00 C ATOM 480 CG HIS A 32 2.756 -6.358 -13.059 1.00 0.00 C ATOM 481 ND1 HIS A 32 3.386 -5.272 -12.488 1.00 0.00 N ATOM 482 CD2 HIS A 32 3.738 -7.224 -13.401 1.00 0.00 C ATOM 483 CE1 HIS A 32 4.692 -5.474 -12.488 1.00 0.00 C ATOM 484 NE2 HIS A 32 4.932 -6.652 -13.036 1.00 0.00 N ATOM 0 H HIS A 32 1.269 -7.455 -10.961 1.00 0.00 H new ATOM 0 HA HIS A 32 0.849 -4.822 -11.880 1.00 0.00 H new ATOM 0 HB2 HIS A 32 0.988 -7.499 -13.316 1.00 0.00 H new ATOM 0 HB3 HIS A 32 0.976 -5.951 -14.137 1.00 0.00 H new ATOM 0 HD2 HIS A 32 3.607 -8.186 -13.873 1.00 0.00 H new ATOM 0 HE1 HIS A 32 5.437 -4.792 -12.105 1.00 0.00 H new ATOM 0 HE2 HIS A 32 5.854 -7.069 -13.167 1.00 0.00 H new ATOM 492 N LEU A 33 -1.723 -6.823 -12.005 1.00 0.00 N ATOM 493 CA LEU A 33 -3.156 -6.892 -12.268 1.00 0.00 C ATOM 494 C LEU A 33 -3.910 -5.841 -11.459 1.00 0.00 C ATOM 495 O LEU A 33 -4.663 -5.038 -12.012 1.00 0.00 O ATOM 496 CB LEU A 33 -3.690 -8.286 -11.936 1.00 0.00 C ATOM 497 CG LEU A 33 -4.651 -8.898 -12.956 1.00 0.00 C ATOM 498 CD1 LEU A 33 -5.168 -10.241 -12.464 1.00 0.00 C ATOM 499 CD2 LEU A 33 -5.807 -7.949 -13.235 1.00 0.00 C ATOM 0 H LEU A 33 -1.345 -7.632 -11.512 1.00 0.00 H new ATOM 0 HA LEU A 33 -3.315 -6.692 -13.328 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -2.841 -8.959 -11.817 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -4.197 -8.239 -10.972 1.00 0.00 H new ATOM 0 HG LEU A 33 -4.107 -9.060 -13.887 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.850 -10.661 -13.203 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -4.330 -10.922 -12.316 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.695 -10.104 -11.520 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.481 -8.401 -13.963 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.350 -7.755 -12.310 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.420 -7.011 -13.632 1.00 0.00 H new ATOM 511 N LEU A 34 -3.700 -5.849 -10.147 1.00 0.00 N ATOM 512 CA LEU A 34 -4.357 -4.895 -9.261 1.00 0.00 C ATOM 513 C LEU A 34 -3.811 -3.487 -9.475 1.00 0.00 C ATOM 514 O LEU A 34 -4.501 -2.499 -9.227 1.00 0.00 O ATOM 515 CB LEU A 34 -4.167 -5.311 -7.801 1.00 0.00 C ATOM 516 CG LEU A 34 -2.768 -5.794 -7.417 1.00 0.00 C ATOM 517 CD1 LEU A 34 -2.132 -4.844 -6.414 1.00 0.00 C ATOM 518 CD2 LEU A 34 -2.828 -7.206 -6.853 1.00 0.00 C ATOM 0 H LEU A 34 -3.080 -6.506 -9.673 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.421 -4.892 -9.497 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.424 -4.463 -7.166 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.878 -6.105 -7.575 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.150 -5.809 -8.315 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.137 -5.204 -6.152 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.054 -3.850 -6.853 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -2.748 -4.797 -5.516 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -1.824 -7.534 -6.585 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -3.462 -7.217 -5.966 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -3.242 -7.880 -7.603 1.00 0.00 H new ATOM 530 N ASP A 35 -2.570 -3.404 -9.940 1.00 0.00 N ATOM 531 CA ASP A 35 -1.932 -2.117 -10.191 1.00 0.00 C ATOM 532 C ASP A 35 -2.559 -1.427 -11.399 1.00 0.00 C ATOM 533 O ASP A 35 -2.828 -0.226 -11.369 1.00 0.00 O ATOM 534 CB ASP A 35 -0.430 -2.303 -10.417 1.00 0.00 C ATOM 535 CG ASP A 35 0.338 -1.001 -10.305 1.00 0.00 C ATOM 536 OD1 ASP A 35 0.209 -0.156 -11.216 1.00 0.00 O ATOM 537 OD2 ASP A 35 1.069 -0.827 -9.308 1.00 0.00 O ATOM 0 H ASP A 35 -1.985 -4.213 -10.151 1.00 0.00 H new ATOM 0 HA ASP A 35 -2.084 -1.487 -9.315 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -0.041 -3.014 -9.688 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -0.265 -2.735 -11.404 1.00 0.00 H new ATOM 542 N SER A 36 -2.787 -2.194 -12.460 1.00 0.00 N ATOM 543 CA SER A 36 -3.377 -1.655 -13.680 1.00 0.00 C ATOM 544 C SER A 36 -4.847 -1.308 -13.464 1.00 0.00 C ATOM 545 O SER A 36 -5.320 -0.257 -13.898 1.00 0.00 O ATOM 546 CB SER A 36 -3.241 -2.660 -14.825 1.00 0.00 C ATOM 547 OG SER A 36 -3.159 -2.000 -16.076 1.00 0.00 O ATOM 0 H SER A 36 -2.572 -3.190 -12.500 1.00 0.00 H new ATOM 0 HA SER A 36 -2.841 -0.743 -13.942 1.00 0.00 H new ATOM 0 HB2 SER A 36 -2.351 -3.270 -14.673 1.00 0.00 H new ATOM 0 HB3 SER A 36 -4.096 -3.337 -14.823 1.00 0.00 H new ATOM 0 HG SER A 36 -3.071 -2.664 -16.791 1.00 0.00 H new ATOM 553 N LEU A 37 -5.566 -2.200 -12.791 1.00 0.00 N ATOM 554 CA LEU A 37 -6.984 -1.990 -12.517 1.00 0.00 C ATOM 555 C LEU A 37 -7.186 -0.816 -11.564 1.00 0.00 C ATOM 556 O LEU A 37 -8.133 -0.044 -11.709 1.00 0.00 O ATOM 557 CB LEU A 37 -7.601 -3.256 -11.922 1.00 0.00 C ATOM 558 CG LEU A 37 -8.209 -4.240 -12.922 1.00 0.00 C ATOM 559 CD1 LEU A 37 -9.053 -3.503 -13.950 1.00 0.00 C ATOM 560 CD2 LEU A 37 -7.117 -5.049 -13.607 1.00 0.00 C ATOM 0 H LEU A 37 -5.191 -3.075 -12.425 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.481 -1.759 -13.459 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.832 -3.777 -11.351 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -8.377 -2.961 -11.216 1.00 0.00 H new ATOM 0 HG LEU A 37 -8.855 -4.928 -12.377 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.478 -4.219 -14.653 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.858 -2.970 -13.445 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.429 -2.791 -14.490 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.569 -5.744 -14.315 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.444 -4.376 -14.138 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.555 -5.608 -12.859 1.00 0.00 H new ATOM 572 N GLU A 38 -6.288 -0.688 -10.592 1.00 0.00 N ATOM 573 CA GLU A 38 -6.368 0.393 -9.617 1.00 0.00 C ATOM 574 C GLU A 38 -6.174 1.749 -10.290 1.00 0.00 C ATOM 575 O GLU A 38 -6.872 2.713 -9.979 1.00 0.00 O ATOM 576 CB GLU A 38 -5.318 0.201 -8.521 1.00 0.00 C ATOM 577 CG GLU A 38 -5.668 -0.895 -7.529 1.00 0.00 C ATOM 578 CD GLU A 38 -4.446 -1.473 -6.842 1.00 0.00 C ATOM 579 OE1 GLU A 38 -3.323 -1.246 -7.339 1.00 0.00 O ATOM 580 OE2 GLU A 38 -4.613 -2.152 -5.807 1.00 0.00 O ATOM 0 H GLU A 38 -5.498 -1.319 -10.459 1.00 0.00 H new ATOM 0 HA GLU A 38 -7.361 0.368 -9.167 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -4.360 -0.033 -8.985 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -5.191 1.140 -7.982 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -6.348 -0.495 -6.777 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -6.200 -1.693 -8.048 1.00 0.00 H new ATOM 587 N GLU A 39 -5.219 1.813 -11.213 1.00 0.00 N ATOM 588 CA GLU A 39 -4.932 3.050 -11.930 1.00 0.00 C ATOM 589 C GLU A 39 -6.036 3.366 -12.935 1.00 0.00 C ATOM 590 O GLU A 39 -6.331 4.531 -13.204 1.00 0.00 O ATOM 591 CB GLU A 39 -3.585 2.948 -12.650 1.00 0.00 C ATOM 592 CG GLU A 39 -2.398 3.308 -11.773 1.00 0.00 C ATOM 593 CD GLU A 39 -1.085 3.289 -12.532 1.00 0.00 C ATOM 594 OE1 GLU A 39 -1.119 3.124 -13.770 1.00 0.00 O ATOM 595 OE2 GLU A 39 -0.025 3.439 -11.890 1.00 0.00 O ATOM 0 H GLU A 39 -4.632 1.023 -11.481 1.00 0.00 H new ATOM 0 HA GLU A 39 -4.886 3.859 -11.201 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -3.457 1.931 -13.021 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.596 3.605 -13.519 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.553 4.299 -11.347 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -2.342 2.608 -10.939 1.00 0.00 H new ATOM 602 N LEU A 40 -6.641 2.321 -13.487 1.00 0.00 N ATOM 603 CA LEU A 40 -7.713 2.485 -14.464 1.00 0.00 C ATOM 604 C LEU A 40 -9.016 2.883 -13.780 1.00 0.00 C ATOM 605 O LEU A 40 -9.823 3.624 -14.342 1.00 0.00 O ATOM 606 CB LEU A 40 -7.912 1.190 -15.253 1.00 0.00 C ATOM 607 CG LEU A 40 -6.709 0.706 -16.064 1.00 0.00 C ATOM 608 CD1 LEU A 40 -6.668 -0.814 -16.100 1.00 0.00 C ATOM 609 CD2 LEU A 40 -6.753 1.275 -17.474 1.00 0.00 C ATOM 0 H LEU A 40 -6.408 1.351 -13.275 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.427 3.281 -15.151 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.194 0.402 -14.554 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -8.752 1.328 -15.934 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.800 1.062 -15.579 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.806 -1.141 -16.681 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -6.588 -1.200 -15.084 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -7.581 -1.192 -16.561 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -5.890 0.920 -18.037 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.668 0.949 -17.969 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -6.733 2.364 -17.428 1.00 0.00 H new ATOM 621 N SER A 41 -9.216 2.388 -12.562 1.00 0.00 N ATOM 622 CA SER A 41 -10.422 2.690 -11.802 1.00 0.00 C ATOM 623 C SER A 41 -10.293 4.033 -11.089 1.00 0.00 C ATOM 624 O SER A 41 -11.292 4.666 -10.749 1.00 0.00 O ATOM 625 CB SER A 41 -10.699 1.583 -10.783 1.00 0.00 C ATOM 626 OG SER A 41 -10.939 2.124 -9.495 1.00 0.00 O ATOM 0 H SER A 41 -8.557 1.776 -12.081 1.00 0.00 H new ATOM 0 HA SER A 41 -11.257 2.748 -12.500 1.00 0.00 H new ATOM 0 HB2 SER A 41 -11.562 0.998 -11.102 1.00 0.00 H new ATOM 0 HB3 SER A 41 -9.850 0.901 -10.742 1.00 0.00 H new ATOM 0 HG SER A 41 -11.115 1.397 -8.862 1.00 0.00 H new ATOM 632 N GLU A 42 -9.054 4.460 -10.866 1.00 0.00 N ATOM 633 CA GLU A 42 -8.793 5.727 -10.192 1.00 0.00 C ATOM 634 C GLU A 42 -8.600 6.852 -11.205 1.00 0.00 C ATOM 635 O GLU A 42 -8.973 7.997 -10.954 1.00 0.00 O ATOM 636 CB GLU A 42 -7.554 5.610 -9.301 1.00 0.00 C ATOM 637 CG GLU A 42 -7.183 6.908 -8.603 1.00 0.00 C ATOM 638 CD GLU A 42 -5.889 6.799 -7.820 1.00 0.00 C ATOM 639 OE1 GLU A 42 -4.838 6.539 -8.443 1.00 0.00 O ATOM 640 OE2 GLU A 42 -5.926 6.973 -6.584 1.00 0.00 O ATOM 0 H GLU A 42 -8.216 3.948 -11.142 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.657 5.964 -9.571 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -7.728 4.840 -8.550 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -6.711 5.279 -9.907 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -7.089 7.701 -9.345 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -7.989 7.197 -7.928 1.00 0.00 H new ATOM 647 N ALA A 43 -8.014 6.516 -12.349 1.00 0.00 N ATOM 648 CA ALA A 43 -7.773 7.496 -13.401 1.00 0.00 C ATOM 649 C ALA A 43 -9.018 7.701 -14.256 1.00 0.00 C ATOM 650 O ALA A 43 -9.289 8.809 -14.722 1.00 0.00 O ATOM 651 CB ALA A 43 -6.600 7.062 -14.268 1.00 0.00 C ATOM 0 H ALA A 43 -7.697 5.572 -12.571 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.529 8.447 -12.928 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.431 7.803 -15.049 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.705 6.974 -13.652 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -6.822 6.098 -14.725 1.00 0.00 H new ATOM 657 N HIS A 44 -9.774 6.627 -14.461 1.00 0.00 N ATOM 658 CA HIS A 44 -10.992 6.689 -15.261 1.00 0.00 C ATOM 659 C HIS A 44 -11.770 5.380 -15.170 1.00 0.00 C ATOM 660 O HIS A 44 -11.779 4.569 -16.095 1.00 0.00 O ATOM 661 CB HIS A 44 -10.653 6.993 -16.721 1.00 0.00 C ATOM 662 CG HIS A 44 -9.973 5.860 -17.427 1.00 0.00 C ATOM 663 ND1 HIS A 44 -9.409 4.791 -16.763 1.00 0.00 N ATOM 664 CD2 HIS A 44 -9.771 5.632 -18.745 1.00 0.00 C ATOM 665 CE1 HIS A 44 -8.887 3.956 -17.644 1.00 0.00 C ATOM 666 NE2 HIS A 44 -9.094 4.443 -18.854 1.00 0.00 N ATOM 0 H HIS A 44 -9.564 5.703 -14.084 1.00 0.00 H new ATOM 0 HA HIS A 44 -11.616 7.490 -14.865 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -11.570 7.244 -17.254 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -10.011 7.873 -16.761 1.00 0.00 H new ATOM 0 HD1 HIS A 44 -9.397 4.665 -15.751 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -10.084 6.268 -19.560 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -8.377 3.032 -17.414 1.00 0.00 H new ATOM 674 N PRO A 45 -12.440 5.168 -14.027 1.00 0.00 N ATOM 675 CA PRO A 45 -13.233 3.959 -13.787 1.00 0.00 C ATOM 676 C PRO A 45 -14.491 3.911 -14.647 1.00 0.00 C ATOM 677 O PRO A 45 -14.467 3.412 -15.772 1.00 0.00 O ATOM 678 CB PRO A 45 -13.602 4.066 -12.305 1.00 0.00 C ATOM 679 CG PRO A 45 -13.558 5.525 -12.007 1.00 0.00 C ATOM 680 CD PRO A 45 -12.474 6.093 -12.881 1.00 0.00 C ATOM 0 HA PRO A 45 -12.682 3.053 -14.039 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -14.592 3.653 -12.113 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -12.899 3.513 -11.681 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -14.518 5.996 -12.220 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -13.343 5.702 -10.953 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -12.702 7.112 -13.194 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -11.516 6.126 -12.363 1.00 0.00 H new ATOM 688 N ASP A 46 -15.589 4.434 -14.112 1.00 0.00 N ATOM 689 CA ASP A 46 -16.857 4.452 -14.832 1.00 0.00 C ATOM 690 C ASP A 46 -18.006 4.825 -13.900 1.00 0.00 C ATOM 691 O ASP A 46 -18.842 5.664 -14.234 1.00 0.00 O ATOM 692 CB ASP A 46 -17.124 3.088 -15.471 1.00 0.00 C ATOM 693 CG ASP A 46 -17.205 3.164 -16.983 1.00 0.00 C ATOM 694 OD1 ASP A 46 -16.475 3.986 -17.575 1.00 0.00 O ATOM 695 OD2 ASP A 46 -17.997 2.401 -17.574 1.00 0.00 O ATOM 0 H ASP A 46 -15.626 4.851 -13.182 1.00 0.00 H new ATOM 0 HA ASP A 46 -16.791 5.206 -15.617 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -16.332 2.395 -15.187 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -18.057 2.683 -15.080 1.00 0.00 H new ATOM 700 N CYS A 47 -18.040 4.195 -12.730 1.00 0.00 N ATOM 701 CA CYS A 47 -19.088 4.459 -11.750 1.00 0.00 C ATOM 702 C CYS A 47 -18.509 4.527 -10.341 1.00 0.00 C ATOM 703 O CYS A 47 -18.574 5.566 -9.682 1.00 0.00 O ATOM 704 CB CYS A 47 -20.165 3.376 -11.820 1.00 0.00 C ATOM 705 SG CYS A 47 -19.982 2.241 -13.216 1.00 0.00 S ATOM 0 H CYS A 47 -17.355 3.499 -12.437 1.00 0.00 H new ATOM 0 HA CYS A 47 -19.538 5.424 -11.986 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -20.148 2.801 -10.894 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -21.143 3.854 -11.880 1.00 0.00 H new ATOM 0 HG CYS A 47 -20.782 1.228 -13.060 1.00 0.00 H new ATOM 711 N ILE A 48 -17.944 3.415 -9.884 1.00 0.00 N ATOM 712 CA ILE A 48 -17.355 3.349 -8.553 1.00 0.00 C ATOM 713 C ILE A 48 -16.750 1.974 -8.287 1.00 0.00 C ATOM 714 O ILE A 48 -17.159 1.255 -7.375 1.00 0.00 O ATOM 715 CB ILE A 48 -18.395 3.660 -7.461 1.00 0.00 C ATOM 716 CG1 ILE A 48 -17.799 3.412 -6.073 1.00 0.00 C ATOM 717 CG2 ILE A 48 -19.645 2.817 -7.664 1.00 0.00 C ATOM 718 CD1 ILE A 48 -18.147 4.486 -5.066 1.00 0.00 C ATOM 0 H ILE A 48 -17.882 2.547 -10.416 1.00 0.00 H new ATOM 0 HA ILE A 48 -16.568 4.102 -8.518 1.00 0.00 H new ATOM 0 HB ILE A 48 -18.673 4.711 -7.534 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -18.151 2.449 -5.702 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -16.715 3.343 -6.159 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -20.371 3.048 -6.884 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -20.078 3.038 -8.640 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -19.383 1.760 -7.614 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -17.692 4.245 -4.105 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -17.771 5.448 -5.415 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -19.230 4.540 -4.951 1.00 0.00 H new ATOM 730 N PRO A 49 -15.751 1.600 -9.100 1.00 0.00 N ATOM 731 CA PRO A 49 -15.067 0.310 -8.971 1.00 0.00 C ATOM 732 C PRO A 49 -14.204 0.234 -7.716 1.00 0.00 C ATOM 733 O PRO A 49 -13.903 1.254 -7.096 1.00 0.00 O ATOM 734 CB PRO A 49 -14.193 0.245 -10.226 1.00 0.00 C ATOM 735 CG PRO A 49 -13.964 1.668 -10.602 1.00 0.00 C ATOM 736 CD PRO A 49 -15.213 2.407 -10.208 1.00 0.00 C ATOM 0 HA PRO A 49 -15.771 -0.517 -8.882 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -13.252 -0.268 -10.027 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -14.691 -0.301 -11.027 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -13.093 2.072 -10.087 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -13.775 1.763 -11.671 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -14.994 3.427 -9.893 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -15.919 2.474 -11.036 1.00 0.00 H new ATOM 744 N ASP A 50 -13.810 -0.980 -7.348 1.00 0.00 N ATOM 745 CA ASP A 50 -12.980 -1.188 -6.167 1.00 0.00 C ATOM 746 C ASP A 50 -11.969 -2.306 -6.403 1.00 0.00 C ATOM 747 O ASP A 50 -12.342 -3.456 -6.636 1.00 0.00 O ATOM 748 CB ASP A 50 -13.853 -1.521 -4.956 1.00 0.00 C ATOM 749 CG ASP A 50 -13.763 -0.467 -3.870 1.00 0.00 C ATOM 750 OD1 ASP A 50 -12.657 -0.270 -3.325 1.00 0.00 O ATOM 751 OD2 ASP A 50 -14.799 0.160 -3.564 1.00 0.00 O ATOM 0 H ASP A 50 -14.052 -1.834 -7.850 1.00 0.00 H new ATOM 0 HA ASP A 50 -12.435 -0.265 -5.970 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -14.890 -1.621 -5.276 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -13.551 -2.486 -4.548 1.00 0.00 H new ATOM 756 N VAL A 51 -10.687 -1.960 -6.343 1.00 0.00 N ATOM 757 CA VAL A 51 -9.622 -2.933 -6.551 1.00 0.00 C ATOM 758 C VAL A 51 -9.011 -3.371 -5.224 1.00 0.00 C ATOM 759 O VAL A 51 -8.338 -2.590 -4.553 1.00 0.00 O ATOM 760 CB VAL A 51 -8.510 -2.365 -7.453 1.00 0.00 C ATOM 761 CG1 VAL A 51 -7.927 -3.459 -8.335 1.00 0.00 C ATOM 762 CG2 VAL A 51 -9.044 -1.217 -8.296 1.00 0.00 C ATOM 0 H VAL A 51 -10.361 -1.013 -6.152 1.00 0.00 H new ATOM 0 HA VAL A 51 -10.073 -3.795 -7.043 1.00 0.00 H new ATOM 0 HB VAL A 51 -7.712 -1.980 -6.818 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.143 -3.039 -8.965 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -7.507 -4.246 -7.709 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -8.713 -3.877 -8.964 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -8.246 -0.827 -8.927 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -9.860 -1.575 -8.923 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -9.409 -0.425 -7.642 1.00 0.00 H new ATOM 772 N GLU A 52 -9.250 -4.625 -4.854 1.00 0.00 N ATOM 773 CA GLU A 52 -8.723 -5.166 -3.607 1.00 0.00 C ATOM 774 C GLU A 52 -7.645 -6.212 -3.880 1.00 0.00 C ATOM 775 O GLU A 52 -7.769 -7.021 -4.800 1.00 0.00 O ATOM 776 CB GLU A 52 -9.849 -5.784 -2.776 1.00 0.00 C ATOM 777 CG GLU A 52 -9.356 -6.639 -1.621 1.00 0.00 C ATOM 778 CD GLU A 52 -10.420 -6.863 -0.565 1.00 0.00 C ATOM 779 OE1 GLU A 52 -11.618 -6.729 -0.892 1.00 0.00 O ATOM 780 OE2 GLU A 52 -10.057 -7.172 0.589 1.00 0.00 O ATOM 0 H GLU A 52 -9.805 -5.285 -5.399 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.276 -4.345 -3.046 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.479 -4.986 -2.383 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -10.476 -6.394 -3.426 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -9.022 -7.603 -2.004 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -8.490 -6.160 -1.163 1.00 0.00 H new ATOM 787 N LEU A 53 -6.589 -6.188 -3.074 1.00 0.00 N ATOM 788 CA LEU A 53 -5.488 -7.133 -3.228 1.00 0.00 C ATOM 789 C LEU A 53 -5.284 -7.943 -1.952 1.00 0.00 C ATOM 790 O LEU A 53 -4.993 -7.388 -0.893 1.00 0.00 O ATOM 791 CB LEU A 53 -4.200 -6.392 -3.588 1.00 0.00 C ATOM 792 CG LEU A 53 -2.910 -7.210 -3.509 1.00 0.00 C ATOM 793 CD1 LEU A 53 -2.343 -7.178 -2.098 1.00 0.00 C ATOM 794 CD2 LEU A 53 -3.161 -8.644 -3.953 1.00 0.00 C ATOM 0 H LEU A 53 -6.472 -5.525 -2.308 1.00 0.00 H new ATOM 0 HA LEU A 53 -5.741 -7.820 -4.036 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.299 -6.004 -4.602 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.102 -5.532 -2.926 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.178 -6.765 -4.182 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.426 -7.765 -2.061 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -2.126 -6.148 -1.816 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.071 -7.598 -1.404 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.233 -9.212 -3.891 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.910 -9.100 -3.305 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.521 -8.649 -4.982 1.00 0.00 H new ATOM 806 N SER A 54 -5.436 -9.259 -2.061 1.00 0.00 N ATOM 807 CA SER A 54 -5.269 -10.146 -0.916 1.00 0.00 C ATOM 808 C SER A 54 -4.106 -11.107 -1.138 1.00 0.00 C ATOM 809 O SER A 54 -3.627 -11.272 -2.260 1.00 0.00 O ATOM 810 CB SER A 54 -6.556 -10.934 -0.662 1.00 0.00 C ATOM 811 OG SER A 54 -7.646 -10.373 -1.373 1.00 0.00 O ATOM 0 H SER A 54 -5.675 -9.735 -2.931 1.00 0.00 H new ATOM 0 HA SER A 54 -5.049 -9.533 -0.042 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.416 -11.972 -0.964 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.778 -10.940 0.405 1.00 0.00 H new ATOM 0 HG SER A 54 -8.456 -10.895 -1.195 1.00 0.00 H new ATOM 817 N HIS A 55 -3.655 -11.740 -0.059 1.00 0.00 N ATOM 818 CA HIS A 55 -2.548 -12.687 -0.135 1.00 0.00 C ATOM 819 C HIS A 55 -2.865 -13.817 -1.110 1.00 0.00 C ATOM 820 O HIS A 55 -3.470 -14.821 -0.736 1.00 0.00 O ATOM 821 CB HIS A 55 -2.246 -13.262 1.249 1.00 0.00 C ATOM 822 CG HIS A 55 -1.065 -12.626 1.917 1.00 0.00 C ATOM 823 ND1 HIS A 55 -0.927 -12.548 3.287 1.00 0.00 N ATOM 824 CD2 HIS A 55 0.037 -12.038 1.395 1.00 0.00 C ATOM 825 CE1 HIS A 55 0.208 -11.938 3.579 1.00 0.00 C ATOM 826 NE2 HIS A 55 0.812 -11.618 2.448 1.00 0.00 N ATOM 0 H HIS A 55 -4.039 -11.614 0.878 1.00 0.00 H new ATOM 0 HA HIS A 55 -1.670 -12.153 -0.498 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -3.123 -13.138 1.884 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -2.068 -14.333 1.157 1.00 0.00 H new ATOM 0 HD2 HIS A 55 0.264 -11.921 0.346 1.00 0.00 H new ATOM 0 HE1 HIS A 55 0.579 -11.735 4.573 1.00 0.00 H new ATOM 0 HE2 HIS A 55 1.708 -11.137 2.370 1.00 0.00 H new ATOM 834 N GLY A 56 -2.452 -13.645 -2.362 1.00 0.00 N ATOM 835 CA GLY A 56 -2.702 -14.657 -3.371 1.00 0.00 C ATOM 836 C GLY A 56 -4.061 -14.502 -4.024 1.00 0.00 C ATOM 837 O GLY A 56 -4.590 -15.449 -4.606 1.00 0.00 O ATOM 0 H GLY A 56 -1.949 -12.823 -2.695 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -1.927 -14.603 -4.135 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -2.632 -15.645 -2.916 1.00 0.00 H new ATOM 841 N VAL A 57 -4.629 -13.304 -3.928 1.00 0.00 N ATOM 842 CA VAL A 57 -5.935 -13.028 -4.514 1.00 0.00 C ATOM 843 C VAL A 57 -6.022 -11.588 -5.008 1.00 0.00 C ATOM 844 O VAL A 57 -5.490 -10.673 -4.382 1.00 0.00 O ATOM 845 CB VAL A 57 -7.069 -13.281 -3.502 1.00 0.00 C ATOM 846 CG1 VAL A 57 -8.374 -13.577 -4.226 1.00 0.00 C ATOM 847 CG2 VAL A 57 -6.700 -14.419 -2.563 1.00 0.00 C ATOM 0 H VAL A 57 -4.205 -12.509 -3.450 1.00 0.00 H new ATOM 0 HA VAL A 57 -6.053 -13.707 -5.358 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.209 -12.380 -2.905 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.164 -13.753 -3.495 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -8.643 -12.727 -4.853 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.252 -14.463 -4.849 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.512 -14.584 -1.855 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -6.532 -15.328 -3.141 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -5.791 -14.162 -2.019 1.00 0.00 H new ATOM 857 N MET A 58 -6.697 -11.396 -6.137 1.00 0.00 N ATOM 858 CA MET A 58 -6.856 -10.066 -6.715 1.00 0.00 C ATOM 859 C MET A 58 -8.327 -9.757 -6.971 1.00 0.00 C ATOM 860 O MET A 58 -8.872 -10.104 -8.020 1.00 0.00 O ATOM 861 CB MET A 58 -6.064 -9.957 -8.019 1.00 0.00 C ATOM 862 CG MET A 58 -5.986 -8.540 -8.565 1.00 0.00 C ATOM 863 SD MET A 58 -7.479 -8.052 -9.450 1.00 0.00 S ATOM 864 CE MET A 58 -7.604 -6.329 -8.979 1.00 0.00 C ATOM 0 H MET A 58 -7.142 -12.144 -6.669 1.00 0.00 H new ATOM 0 HA MET A 58 -6.470 -9.338 -6.002 1.00 0.00 H new ATOM 0 HB2 MET A 58 -5.053 -10.330 -7.853 1.00 0.00 H new ATOM 0 HB3 MET A 58 -6.523 -10.602 -8.768 1.00 0.00 H new ATOM 0 HG2 MET A 58 -5.814 -7.847 -7.742 1.00 0.00 H new ATOM 0 HG3 MET A 58 -5.129 -8.459 -9.234 1.00 0.00 H new ATOM 0 HE1 MET A 58 -8.603 -6.130 -8.590 1.00 0.00 H new ATOM 0 HE2 MET A 58 -6.864 -6.107 -8.210 1.00 0.00 H new ATOM 0 HE3 MET A 58 -7.422 -5.700 -9.850 1.00 0.00 H new ATOM 874 N THR A 59 -8.967 -9.102 -6.007 1.00 0.00 N ATOM 875 CA THR A 59 -10.375 -8.747 -6.129 1.00 0.00 C ATOM 876 C THR A 59 -10.551 -7.457 -6.922 1.00 0.00 C ATOM 877 O THR A 59 -9.838 -6.478 -6.699 1.00 0.00 O ATOM 878 CB THR A 59 -11.034 -8.580 -4.746 1.00 0.00 C ATOM 879 OG1 THR A 59 -10.053 -8.738 -3.714 1.00 0.00 O ATOM 880 CG2 THR A 59 -12.149 -9.596 -4.552 1.00 0.00 C ATOM 0 H THR A 59 -8.532 -8.807 -5.133 1.00 0.00 H new ATOM 0 HA THR A 59 -10.862 -9.565 -6.660 1.00 0.00 H new ATOM 0 HB THR A 59 -11.462 -7.579 -4.690 1.00 0.00 H new ATOM 0 HG1 THR A 59 -10.502 -8.900 -2.858 1.00 0.00 H new ATOM 0 HG21 THR A 59 -12.599 -9.459 -3.569 1.00 0.00 H new ATOM 0 HG22 THR A 59 -12.908 -9.455 -5.322 1.00 0.00 H new ATOM 0 HG23 THR A 59 -11.740 -10.604 -4.626 1.00 0.00 H new ATOM 888 N LEU A 60 -11.504 -7.462 -7.847 1.00 0.00 N ATOM 889 CA LEU A 60 -11.774 -6.291 -8.673 1.00 0.00 C ATOM 890 C LEU A 60 -13.275 -6.090 -8.859 1.00 0.00 C ATOM 891 O LEU A 60 -13.889 -6.703 -9.731 1.00 0.00 O ATOM 892 CB LEU A 60 -11.095 -6.436 -10.036 1.00 0.00 C ATOM 893 CG LEU A 60 -11.416 -5.351 -11.065 1.00 0.00 C ATOM 894 CD1 LEU A 60 -10.523 -4.138 -10.856 1.00 0.00 C ATOM 895 CD2 LEU A 60 -11.260 -5.894 -12.478 1.00 0.00 C ATOM 0 H LEU A 60 -12.103 -8.264 -8.044 1.00 0.00 H new ATOM 0 HA LEU A 60 -11.369 -5.417 -8.163 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -10.016 -6.455 -9.882 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -11.373 -7.402 -10.457 1.00 0.00 H new ATOM 0 HG LEU A 60 -12.452 -5.042 -10.929 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -10.765 -3.376 -11.597 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -10.684 -3.736 -9.856 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -9.479 -4.432 -10.965 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -11.492 -5.109 -13.197 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -10.234 -6.231 -12.627 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -11.942 -6.732 -12.623 1.00 0.00 H new ATOM 907 N GLU A 61 -13.858 -5.226 -8.034 1.00 0.00 N ATOM 908 CA GLU A 61 -15.286 -4.943 -8.109 1.00 0.00 C ATOM 909 C GLU A 61 -15.584 -3.932 -9.212 1.00 0.00 C ATOM 910 O GLU A 61 -14.926 -2.896 -9.313 1.00 0.00 O ATOM 911 CB GLU A 61 -15.796 -4.415 -6.766 1.00 0.00 C ATOM 912 CG GLU A 61 -17.235 -3.929 -6.810 1.00 0.00 C ATOM 913 CD GLU A 61 -17.819 -3.711 -5.428 1.00 0.00 C ATOM 914 OE1 GLU A 61 -17.287 -4.295 -4.461 1.00 0.00 O ATOM 915 OE2 GLU A 61 -18.808 -2.957 -5.313 1.00 0.00 O ATOM 0 H GLU A 61 -13.363 -4.710 -7.306 1.00 0.00 H new ATOM 0 HA GLU A 61 -15.802 -5.874 -8.345 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -15.711 -5.204 -6.019 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -15.155 -3.596 -6.440 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -17.283 -2.996 -7.372 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -17.844 -4.656 -7.347 1.00 0.00 H new ATOM 922 N ILE A 62 -16.579 -4.241 -10.037 1.00 0.00 N ATOM 923 CA ILE A 62 -16.964 -3.360 -11.132 1.00 0.00 C ATOM 924 C ILE A 62 -18.470 -3.123 -11.144 1.00 0.00 C ATOM 925 O ILE A 62 -19.250 -3.955 -11.610 1.00 0.00 O ATOM 926 CB ILE A 62 -16.535 -3.935 -12.495 1.00 0.00 C ATOM 927 CG1 ILE A 62 -15.127 -4.528 -12.403 1.00 0.00 C ATOM 928 CG2 ILE A 62 -16.591 -2.856 -13.567 1.00 0.00 C ATOM 929 CD1 ILE A 62 -14.572 -4.976 -13.736 1.00 0.00 C ATOM 0 H ILE A 62 -17.133 -5.095 -9.968 1.00 0.00 H new ATOM 0 HA ILE A 62 -16.451 -2.412 -10.969 1.00 0.00 H new ATOM 0 HB ILE A 62 -17.227 -4.731 -12.771 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -14.456 -3.786 -11.970 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -15.143 -5.378 -11.721 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -16.285 -3.278 -14.524 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -17.609 -2.475 -13.647 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -15.919 -2.041 -13.298 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -13.572 -5.385 -13.595 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -15.221 -5.742 -14.161 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -14.523 -4.124 -14.414 1.00 0.00 H new ATOM 941 N PRO A 63 -18.891 -1.962 -10.622 1.00 0.00 N ATOM 942 CA PRO A 63 -20.308 -1.588 -10.563 1.00 0.00 C ATOM 943 C PRO A 63 -20.887 -1.290 -11.942 1.00 0.00 C ATOM 944 O PRO A 63 -21.289 -0.163 -12.227 1.00 0.00 O ATOM 945 CB PRO A 63 -20.305 -0.323 -9.701 1.00 0.00 C ATOM 946 CG PRO A 63 -18.940 0.250 -9.873 1.00 0.00 C ATOM 947 CD PRO A 63 -18.017 -0.924 -10.050 1.00 0.00 C ATOM 0 HA PRO A 63 -20.925 -2.392 -10.163 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -21.073 0.379 -10.026 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -20.508 -0.556 -8.656 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -18.901 0.911 -10.739 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -18.654 0.844 -9.005 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -17.187 -0.686 -10.715 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -17.584 -1.241 -9.101 1.00 0.00 H new ATOM 955 N ALA A 64 -20.926 -2.309 -12.795 1.00 0.00 N ATOM 956 CA ALA A 64 -21.458 -2.157 -14.143 1.00 0.00 C ATOM 957 C ALA A 64 -21.638 -3.512 -14.818 1.00 0.00 C ATOM 958 O ALA A 64 -22.620 -3.740 -15.525 1.00 0.00 O ATOM 959 CB ALA A 64 -20.545 -1.268 -14.974 1.00 0.00 C ATOM 0 H ALA A 64 -20.595 -3.249 -12.576 1.00 0.00 H new ATOM 0 HA ALA A 64 -22.437 -1.684 -14.069 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -20.955 -1.163 -15.979 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -20.471 -0.285 -14.508 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -19.554 -1.717 -15.032 1.00 0.00 H new ATOM 965 N PHE A 65 -20.683 -4.410 -14.597 1.00 0.00 N ATOM 966 CA PHE A 65 -20.736 -5.743 -15.186 1.00 0.00 C ATOM 967 C PHE A 65 -20.628 -6.818 -14.109 1.00 0.00 C ATOM 968 O PHE A 65 -20.941 -7.984 -14.347 1.00 0.00 O ATOM 969 CB PHE A 65 -19.612 -5.916 -16.209 1.00 0.00 C ATOM 970 CG PHE A 65 -18.691 -4.732 -16.295 1.00 0.00 C ATOM 971 CD1 PHE A 65 -19.191 -3.467 -16.559 1.00 0.00 C ATOM 972 CD2 PHE A 65 -17.326 -4.884 -16.110 1.00 0.00 C ATOM 973 CE1 PHE A 65 -18.346 -2.376 -16.639 1.00 0.00 C ATOM 974 CE2 PHE A 65 -16.477 -3.797 -16.188 1.00 0.00 C ATOM 975 CZ PHE A 65 -16.987 -2.541 -16.452 1.00 0.00 C ATOM 0 H PHE A 65 -19.863 -4.239 -14.014 1.00 0.00 H new ATOM 0 HA PHE A 65 -21.697 -5.853 -15.689 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -19.030 -6.801 -15.951 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -20.050 -6.098 -17.191 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.253 -3.332 -16.704 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -16.921 -5.864 -15.902 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -18.748 -1.395 -16.848 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -15.415 -3.929 -16.043 1.00 0.00 H new ATOM 0 HZ PHE A 65 -16.325 -1.690 -16.512 1.00 0.00 H new ATOM 985 N GLY A 66 -20.183 -6.416 -12.922 1.00 0.00 N ATOM 986 CA GLY A 66 -20.041 -7.357 -11.826 1.00 0.00 C ATOM 987 C GLY A 66 -18.748 -7.162 -11.059 1.00 0.00 C ATOM 988 O GLY A 66 -18.276 -6.036 -10.897 1.00 0.00 O ATOM 0 H GLY A 66 -19.919 -5.456 -12.700 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -20.884 -7.246 -11.144 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -20.078 -8.374 -12.217 1.00 0.00 H new ATOM 992 N THR A 67 -18.173 -8.262 -10.583 1.00 0.00 N ATOM 993 CA THR A 67 -16.928 -8.207 -9.826 1.00 0.00 C ATOM 994 C THR A 67 -15.946 -9.269 -10.307 1.00 0.00 C ATOM 995 O THR A 67 -16.212 -10.467 -10.206 1.00 0.00 O ATOM 996 CB THR A 67 -17.179 -8.401 -8.319 1.00 0.00 C ATOM 997 OG1 THR A 67 -18.235 -7.539 -7.883 1.00 0.00 O ATOM 998 CG2 THR A 67 -15.917 -8.110 -7.519 1.00 0.00 C ATOM 0 H THR A 67 -18.549 -9.202 -10.708 1.00 0.00 H new ATOM 0 HA THR A 67 -16.500 -7.218 -9.991 1.00 0.00 H new ATOM 0 HB THR A 67 -17.466 -9.439 -8.151 1.00 0.00 H new ATOM 0 HG1 THR A 67 -18.389 -7.670 -6.924 1.00 0.00 H new ATOM 0 HG21 THR A 67 -16.118 -8.253 -6.457 1.00 0.00 H new ATOM 0 HG22 THR A 67 -15.123 -8.788 -7.833 1.00 0.00 H new ATOM 0 HG23 THR A 67 -15.605 -7.080 -7.693 1.00 0.00 H new ATOM 1006 N TYR A 68 -14.809 -8.823 -10.830 1.00 0.00 N ATOM 1007 CA TYR A 68 -13.787 -9.735 -11.328 1.00 0.00 C ATOM 1008 C TYR A 68 -12.757 -10.044 -10.245 1.00 0.00 C ATOM 1009 O TYR A 68 -12.314 -9.152 -9.521 1.00 0.00 O ATOM 1010 CB TYR A 68 -13.092 -9.136 -12.552 1.00 0.00 C ATOM 1011 CG TYR A 68 -13.704 -9.565 -13.866 1.00 0.00 C ATOM 1012 CD1 TYR A 68 -13.567 -10.869 -14.327 1.00 0.00 C ATOM 1013 CD2 TYR A 68 -14.421 -8.667 -14.647 1.00 0.00 C ATOM 1014 CE1 TYR A 68 -14.124 -11.265 -15.527 1.00 0.00 C ATOM 1015 CE2 TYR A 68 -14.983 -9.054 -15.848 1.00 0.00 C ATOM 1016 CZ TYR A 68 -14.831 -10.354 -16.284 1.00 0.00 C ATOM 1017 OH TYR A 68 -15.389 -10.745 -17.480 1.00 0.00 O ATOM 0 H TYR A 68 -14.572 -7.835 -10.920 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.276 -10.666 -11.615 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -13.126 -8.049 -12.483 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -12.041 -9.424 -12.539 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -13.015 -11.585 -13.736 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -14.541 -7.648 -14.309 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -14.007 -12.282 -15.871 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -15.538 -8.343 -16.442 1.00 0.00 H new ATOM 0 HH TYR A 68 -16.344 -10.924 -17.352 1.00 0.00 H new ATOM 1027 N VAL A 69 -12.381 -11.314 -10.140 1.00 0.00 N ATOM 1028 CA VAL A 69 -11.403 -11.743 -9.148 1.00 0.00 C ATOM 1029 C VAL A 69 -10.419 -12.744 -9.742 1.00 0.00 C ATOM 1030 O VAL A 69 -10.783 -13.558 -10.591 1.00 0.00 O ATOM 1031 CB VAL A 69 -12.087 -12.378 -7.923 1.00 0.00 C ATOM 1032 CG1 VAL A 69 -11.247 -12.169 -6.673 1.00 0.00 C ATOM 1033 CG2 VAL A 69 -13.485 -11.806 -7.738 1.00 0.00 C ATOM 0 H VAL A 69 -12.739 -12.065 -10.730 1.00 0.00 H new ATOM 0 HA VAL A 69 -10.862 -10.851 -8.832 1.00 0.00 H new ATOM 0 HB VAL A 69 -12.177 -13.451 -8.095 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -11.747 -12.625 -5.818 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -10.269 -12.631 -6.810 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -11.122 -11.101 -6.493 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -13.954 -12.266 -6.868 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -13.420 -10.728 -7.588 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -14.083 -12.014 -8.625 1.00 0.00 H new ATOM 1043 N ILE A 70 -9.171 -12.677 -9.291 1.00 0.00 N ATOM 1044 CA ILE A 70 -8.134 -13.579 -9.777 1.00 0.00 C ATOM 1045 C ILE A 70 -7.164 -13.954 -8.662 1.00 0.00 C ATOM 1046 O ILE A 70 -6.365 -13.130 -8.218 1.00 0.00 O ATOM 1047 CB ILE A 70 -7.344 -12.953 -10.942 1.00 0.00 C ATOM 1048 CG1 ILE A 70 -8.198 -11.908 -11.662 1.00 0.00 C ATOM 1049 CG2 ILE A 70 -6.886 -14.032 -11.912 1.00 0.00 C ATOM 1050 CD1 ILE A 70 -8.170 -10.546 -11.005 1.00 0.00 C ATOM 0 H ILE A 70 -8.853 -12.008 -8.590 1.00 0.00 H new ATOM 0 HA ILE A 70 -8.639 -14.477 -10.133 1.00 0.00 H new ATOM 0 HB ILE A 70 -6.461 -12.457 -10.538 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -7.850 -11.813 -12.691 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -9.229 -12.260 -11.705 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.329 -13.574 -12.729 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -6.245 -14.742 -11.390 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -7.755 -14.554 -12.313 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -8.798 -9.857 -11.570 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -8.546 -10.626 -9.985 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.146 -10.172 -10.986 1.00 0.00 H new ATOM 1062 N ASN A 71 -7.238 -15.203 -8.215 1.00 0.00 N ATOM 1063 CA ASN A 71 -6.364 -15.688 -7.152 1.00 0.00 C ATOM 1064 C ASN A 71 -5.562 -16.899 -7.617 1.00 0.00 C ATOM 1065 O ASN A 71 -5.898 -17.533 -8.618 1.00 0.00 O ATOM 1066 CB ASN A 71 -7.187 -16.051 -5.914 1.00 0.00 C ATOM 1067 CG ASN A 71 -7.181 -17.541 -5.633 1.00 0.00 C ATOM 1068 OD1 ASN A 71 -7.359 -18.355 -6.539 1.00 0.00 O ATOM 1069 ND2 ASN A 71 -6.976 -17.904 -4.372 1.00 0.00 N ATOM 0 H ASN A 71 -7.894 -15.898 -8.572 1.00 0.00 H new ATOM 0 HA ASN A 71 -5.667 -14.890 -6.896 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -6.791 -15.519 -5.049 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -8.214 -15.714 -6.052 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -6.962 -18.893 -4.122 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -6.833 -17.194 -3.654 1.00 0.00 H new ATOM 1076 N LYS A 72 -4.501 -17.216 -6.884 1.00 0.00 N ATOM 1077 CA LYS A 72 -3.651 -18.353 -7.218 1.00 0.00 C ATOM 1078 C LYS A 72 -3.143 -19.042 -5.956 1.00 0.00 C ATOM 1079 O LYS A 72 -1.952 -19.327 -5.831 1.00 0.00 O ATOM 1080 CB LYS A 72 -2.467 -17.896 -8.074 1.00 0.00 C ATOM 1081 CG LYS A 72 -1.362 -17.226 -7.276 1.00 0.00 C ATOM 1082 CD LYS A 72 -0.044 -17.970 -7.415 1.00 0.00 C ATOM 1083 CE LYS A 72 0.244 -18.326 -8.865 1.00 0.00 C ATOM 1084 NZ LYS A 72 -0.081 -19.749 -9.162 1.00 0.00 N ATOM 0 H LYS A 72 -4.208 -16.701 -6.054 1.00 0.00 H new ATOM 0 HA LYS A 72 -4.248 -19.067 -7.785 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -2.054 -18.758 -8.598 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -2.826 -17.203 -8.835 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -1.238 -16.198 -7.616 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -1.647 -17.182 -6.225 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.766 -17.355 -7.022 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -0.073 -18.879 -6.815 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.336 -17.677 -9.521 1.00 0.00 H new ATOM 0 HE3 LYS A 72 1.296 -18.141 -9.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -0.234 -19.864 -10.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 0.708 -20.356 -8.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.944 -20.022 -8.650 1.00 0.00 H new ATOM 1098 N GLN A 73 -4.053 -19.308 -5.025 1.00 0.00 N ATOM 1099 CA GLN A 73 -3.696 -19.965 -3.773 1.00 0.00 C ATOM 1100 C GLN A 73 -4.427 -21.296 -3.629 1.00 0.00 C ATOM 1101 O GLN A 73 -4.897 -21.660 -2.551 1.00 0.00 O ATOM 1102 CB GLN A 73 -4.024 -19.058 -2.585 1.00 0.00 C ATOM 1103 CG GLN A 73 -2.833 -18.788 -1.679 1.00 0.00 C ATOM 1104 CD GLN A 73 -2.449 -19.995 -0.846 1.00 0.00 C ATOM 1105 OE1 GLN A 73 -2.279 -21.097 -1.369 1.00 0.00 O ATOM 1106 NE2 GLN A 73 -2.310 -19.793 0.459 1.00 0.00 N ATOM 0 H GLN A 73 -5.043 -19.079 -5.114 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.624 -20.160 -3.787 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -4.409 -18.109 -2.958 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -4.820 -19.516 -1.998 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -1.980 -18.484 -2.287 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -3.066 -17.954 -1.017 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -2.461 -18.863 0.850 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -2.053 -20.568 1.070 1.00 0.00 H new ATOM 1115 N PRO A 74 -4.526 -22.040 -4.740 1.00 0.00 N ATOM 1116 CA PRO A 74 -5.198 -23.343 -4.763 1.00 0.00 C ATOM 1117 C PRO A 74 -4.420 -24.410 -3.999 1.00 0.00 C ATOM 1118 O PRO A 74 -3.277 -24.206 -3.591 1.00 0.00 O ATOM 1119 CB PRO A 74 -5.254 -23.687 -6.253 1.00 0.00 C ATOM 1120 CG PRO A 74 -4.120 -22.935 -6.859 1.00 0.00 C ATOM 1121 CD PRO A 74 -3.988 -21.668 -6.060 1.00 0.00 C ATOM 0 HA PRO A 74 -6.176 -23.306 -4.283 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -5.149 -24.760 -6.416 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -6.206 -23.389 -6.692 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -3.200 -23.518 -6.820 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -4.314 -22.716 -7.909 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.950 -21.341 -5.993 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -4.552 -20.850 -6.508 1.00 0.00 H new ATOM 1129 N PRO A 75 -5.053 -25.576 -3.801 1.00 0.00 N ATOM 1130 CA PRO A 75 -4.438 -26.698 -3.086 1.00 0.00 C ATOM 1131 C PRO A 75 -3.302 -27.337 -3.877 1.00 0.00 C ATOM 1132 O PRO A 75 -2.721 -28.334 -3.451 1.00 0.00 O ATOM 1133 CB PRO A 75 -5.594 -27.687 -2.917 1.00 0.00 C ATOM 1134 CG PRO A 75 -6.529 -27.371 -4.032 1.00 0.00 C ATOM 1135 CD PRO A 75 -6.417 -25.888 -4.259 1.00 0.00 C ATOM 0 HA PRO A 75 -3.987 -26.383 -2.145 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -5.244 -28.718 -2.974 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -6.079 -27.568 -1.948 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -6.264 -27.925 -4.933 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -7.551 -27.650 -3.775 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -6.557 -25.630 -5.309 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -7.167 -25.337 -3.692 1.00 0.00 H new ATOM 1143 N ASN A 76 -2.990 -26.756 -5.031 1.00 0.00 N ATOM 1144 CA ASN A 76 -1.923 -27.269 -5.882 1.00 0.00 C ATOM 1145 C ASN A 76 -1.127 -26.126 -6.505 1.00 0.00 C ATOM 1146 O ASN A 76 -0.156 -25.642 -5.923 1.00 0.00 O ATOM 1147 CB ASN A 76 -2.503 -28.160 -6.981 1.00 0.00 C ATOM 1148 CG ASN A 76 -1.512 -28.417 -8.100 1.00 0.00 C ATOM 1149 OD1 ASN A 76 -2.018 -28.536 -9.322 1.00 0.00 O flip ATOM 1150 ND2 ASN A 76 -0.307 -28.508 -7.868 1.00 0.00 N flip ATOM 0 H ASN A 76 -3.461 -25.929 -5.398 1.00 0.00 H new ATOM 0 HA ASN A 76 -1.250 -27.861 -5.262 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -2.813 -29.111 -6.548 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -3.397 -27.691 -7.392 1.00 0.00 H new ATOM 0 HD21 ASN A 76 0.037 -28.410 -6.913 1.00 0.00 H new ATOM 0 HD22 ASN A 76 0.348 -28.682 -8.631 1.00 0.00 H new ATOM 1157 N LYS A 77 -1.545 -25.699 -7.691 1.00 0.00 N ATOM 1158 CA LYS A 77 -0.874 -24.612 -8.394 1.00 0.00 C ATOM 1159 C LYS A 77 -1.681 -24.170 -9.610 1.00 0.00 C ATOM 1160 O LYS A 77 -1.553 -24.742 -10.692 1.00 0.00 O ATOM 1161 CB LYS A 77 0.527 -25.048 -8.830 1.00 0.00 C ATOM 1162 CG LYS A 77 0.997 -24.389 -10.115 1.00 0.00 C ATOM 1163 CD LYS A 77 2.500 -24.166 -10.111 1.00 0.00 C ATOM 1164 CE LYS A 77 3.257 -25.470 -10.314 1.00 0.00 C ATOM 1165 NZ LYS A 77 3.927 -25.922 -9.063 1.00 0.00 N ATOM 0 H LYS A 77 -2.346 -26.090 -8.186 1.00 0.00 H new ATOM 0 HA LYS A 77 -0.789 -23.768 -7.710 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.234 -24.817 -8.033 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.537 -26.130 -8.962 1.00 0.00 H new ATOM 0 HG2 LYS A 77 0.723 -25.013 -10.966 1.00 0.00 H new ATOM 0 HG3 LYS A 77 0.487 -23.434 -10.243 1.00 0.00 H new ATOM 0 HD2 LYS A 77 2.767 -23.463 -10.900 1.00 0.00 H new ATOM 0 HD3 LYS A 77 2.799 -23.713 -9.166 1.00 0.00 H new ATOM 0 HE2 LYS A 77 2.567 -26.241 -10.656 1.00 0.00 H new ATOM 0 HE3 LYS A 77 4.002 -25.339 -11.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 4.432 -26.813 -9.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 4.604 -25.197 -8.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 3.213 -26.072 -8.321 1.00 0.00 H new ATOM 1179 N GLN A 78 -2.511 -23.149 -9.424 1.00 0.00 N ATOM 1180 CA GLN A 78 -3.338 -22.630 -10.508 1.00 0.00 C ATOM 1181 C GLN A 78 -3.902 -21.258 -10.153 1.00 0.00 C ATOM 1182 O GLN A 78 -3.851 -20.835 -8.998 1.00 0.00 O ATOM 1183 CB GLN A 78 -4.480 -23.600 -10.814 1.00 0.00 C ATOM 1184 CG GLN A 78 -4.156 -24.591 -11.921 1.00 0.00 C ATOM 1185 CD GLN A 78 -4.161 -26.028 -11.437 1.00 0.00 C ATOM 1186 OE1 GLN A 78 -5.349 -26.557 -11.165 1.00 0.00 O flip ATOM 1187 NE2 GLN A 78 -3.110 -26.656 -11.310 1.00 0.00 N flip ATOM 0 H GLN A 78 -2.629 -22.665 -8.534 1.00 0.00 H new ATOM 0 HA GLN A 78 -2.711 -22.527 -11.393 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -4.731 -24.150 -9.907 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -5.365 -23.029 -11.096 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -4.882 -24.480 -12.727 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -3.177 -24.356 -12.339 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -2.220 -26.210 -11.530 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -3.130 -27.622 -10.984 1.00 0.00 H new ATOM 1196 N ILE A 79 -4.438 -20.568 -11.154 1.00 0.00 N ATOM 1197 CA ILE A 79 -5.012 -19.244 -10.947 1.00 0.00 C ATOM 1198 C ILE A 79 -6.519 -19.255 -11.180 1.00 0.00 C ATOM 1199 O ILE A 79 -6.981 -19.452 -12.304 1.00 0.00 O ATOM 1200 CB ILE A 79 -4.367 -18.199 -11.877 1.00 0.00 C ATOM 1201 CG1 ILE A 79 -3.178 -17.532 -11.183 1.00 0.00 C ATOM 1202 CG2 ILE A 79 -5.395 -17.159 -12.297 1.00 0.00 C ATOM 1203 CD1 ILE A 79 -2.118 -17.038 -12.143 1.00 0.00 C ATOM 0 H ILE A 79 -4.487 -20.904 -12.116 1.00 0.00 H new ATOM 0 HA ILE A 79 -4.809 -18.971 -9.911 1.00 0.00 H new ATOM 0 HB ILE A 79 -4.004 -18.704 -12.772 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -3.539 -16.692 -10.589 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.727 -18.242 -10.490 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -4.925 -16.427 -12.954 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -6.213 -17.649 -12.826 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.785 -16.655 -11.413 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.305 -16.577 -11.582 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.730 -17.877 -12.720 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -2.554 -16.303 -12.820 1.00 0.00 H new ATOM 1215 N TRP A 80 -7.279 -19.041 -10.112 1.00 0.00 N ATOM 1216 CA TRP A 80 -8.734 -19.025 -10.201 1.00 0.00 C ATOM 1217 C TRP A 80 -9.242 -17.636 -10.573 1.00 0.00 C ATOM 1218 O TRP A 80 -9.018 -16.668 -9.846 1.00 0.00 O ATOM 1219 CB TRP A 80 -9.352 -19.469 -8.874 1.00 0.00 C ATOM 1220 CG TRP A 80 -9.667 -20.934 -8.826 1.00 0.00 C ATOM 1221 CD1 TRP A 80 -8.923 -21.950 -9.354 1.00 0.00 C ATOM 1222 CD2 TRP A 80 -10.811 -21.544 -8.219 1.00 0.00 C ATOM 1223 NE1 TRP A 80 -9.535 -23.156 -9.111 1.00 0.00 N ATOM 1224 CE2 TRP A 80 -10.694 -22.934 -8.416 1.00 0.00 C ATOM 1225 CE3 TRP A 80 -11.920 -21.053 -7.526 1.00 0.00 C ATOM 1226 CZ2 TRP A 80 -11.647 -23.835 -7.945 1.00 0.00 C ATOM 1227 CZ3 TRP A 80 -12.865 -21.948 -7.060 1.00 0.00 C ATOM 1228 CH2 TRP A 80 -12.723 -23.326 -7.270 1.00 0.00 C ATOM 0 H TRP A 80 -6.912 -18.876 -9.175 1.00 0.00 H new ATOM 0 HA TRP A 80 -9.032 -19.722 -10.984 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -8.666 -19.225 -8.063 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.267 -18.902 -8.700 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -7.991 -21.824 -9.885 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -9.183 -24.068 -9.401 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -12.037 -19.993 -7.357 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -11.540 -24.897 -8.107 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -13.727 -21.579 -6.525 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -13.478 -24.000 -6.892 1.00 0.00 H new ATOM 1239 N LEU A 81 -9.925 -17.545 -11.709 1.00 0.00 N ATOM 1240 CA LEU A 81 -10.465 -16.273 -12.177 1.00 0.00 C ATOM 1241 C LEU A 81 -11.965 -16.189 -11.916 1.00 0.00 C ATOM 1242 O LEU A 81 -12.768 -16.738 -12.671 1.00 0.00 O ATOM 1243 CB LEU A 81 -10.184 -16.096 -13.670 1.00 0.00 C ATOM 1244 CG LEU A 81 -10.629 -14.768 -14.284 1.00 0.00 C ATOM 1245 CD1 LEU A 81 -12.135 -14.755 -14.494 1.00 0.00 C ATOM 1246 CD2 LEU A 81 -10.202 -13.603 -13.402 1.00 0.00 C ATOM 0 H LEU A 81 -10.118 -18.336 -12.323 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.974 -15.472 -11.624 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -9.112 -16.208 -13.833 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -10.675 -16.906 -14.210 1.00 0.00 H new ATOM 0 HG LEU A 81 -10.146 -14.659 -15.255 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -12.433 -13.802 -14.932 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -12.416 -15.566 -15.165 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -12.637 -14.887 -13.536 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -10.527 -12.666 -13.854 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -10.656 -13.707 -12.417 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.117 -13.601 -13.303 1.00 0.00 H new ATOM 1258 N ALA A 82 -12.337 -15.498 -10.844 1.00 0.00 N ATOM 1259 CA ALA A 82 -13.741 -15.338 -10.487 1.00 0.00 C ATOM 1260 C ALA A 82 -14.436 -14.350 -11.417 1.00 0.00 C ATOM 1261 O ALA A 82 -14.115 -13.162 -11.427 1.00 0.00 O ATOM 1262 CB ALA A 82 -13.869 -14.884 -9.040 1.00 0.00 C ATOM 0 H ALA A 82 -11.685 -15.040 -10.207 1.00 0.00 H new ATOM 0 HA ALA A 82 -14.231 -16.306 -10.598 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -14.923 -14.768 -8.787 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -13.418 -15.628 -8.384 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -13.358 -13.930 -8.912 1.00 0.00 H new ATOM 1268 N SER A 83 -15.388 -14.849 -12.198 1.00 0.00 N ATOM 1269 CA SER A 83 -16.125 -14.010 -13.136 1.00 0.00 C ATOM 1270 C SER A 83 -16.881 -12.907 -12.401 1.00 0.00 C ATOM 1271 O SER A 83 -16.973 -12.895 -11.173 1.00 0.00 O ATOM 1272 CB SER A 83 -17.104 -14.858 -13.951 1.00 0.00 C ATOM 1273 OG SER A 83 -17.160 -16.185 -13.460 1.00 0.00 O ATOM 0 H SER A 83 -15.667 -15.830 -12.200 1.00 0.00 H new ATOM 0 HA SER A 83 -15.406 -13.546 -13.812 1.00 0.00 H new ATOM 0 HB2 SER A 83 -18.097 -14.410 -13.912 1.00 0.00 H new ATOM 0 HB3 SER A 83 -16.799 -14.867 -14.997 1.00 0.00 H new ATOM 0 HG SER A 83 -16.362 -16.675 -13.750 1.00 0.00 H new ATOM 1279 N PRO A 84 -17.435 -11.957 -13.168 1.00 0.00 N ATOM 1280 CA PRO A 84 -18.193 -10.833 -12.613 1.00 0.00 C ATOM 1281 C PRO A 84 -19.528 -11.270 -12.019 1.00 0.00 C ATOM 1282 O PRO A 84 -20.318 -10.442 -11.563 1.00 0.00 O ATOM 1283 CB PRO A 84 -18.419 -9.924 -13.823 1.00 0.00 C ATOM 1284 CG PRO A 84 -18.356 -10.836 -14.999 1.00 0.00 C ATOM 1285 CD PRO A 84 -17.365 -11.909 -14.639 1.00 0.00 C ATOM 0 HA PRO A 84 -17.662 -10.350 -11.793 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -19.383 -9.420 -13.764 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -17.656 -9.148 -13.883 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -19.335 -11.265 -15.213 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -18.041 -10.298 -15.893 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -17.630 -12.867 -15.086 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -16.362 -11.662 -14.986 1.00 0.00 H new ATOM 1293 N LEU A 85 -19.775 -12.575 -12.027 1.00 0.00 N ATOM 1294 CA LEU A 85 -21.015 -13.123 -11.489 1.00 0.00 C ATOM 1295 C LEU A 85 -20.728 -14.150 -10.399 1.00 0.00 C ATOM 1296 O LEU A 85 -21.230 -14.040 -9.280 1.00 0.00 O ATOM 1297 CB LEU A 85 -21.839 -13.765 -12.607 1.00 0.00 C ATOM 1298 CG LEU A 85 -23.299 -14.075 -12.271 1.00 0.00 C ATOM 1299 CD1 LEU A 85 -24.231 -13.380 -13.251 1.00 0.00 C ATOM 1300 CD2 LEU A 85 -23.540 -15.577 -12.276 1.00 0.00 C ATOM 0 H LEU A 85 -19.133 -13.274 -12.400 1.00 0.00 H new ATOM 0 HA LEU A 85 -21.585 -12.304 -11.050 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -21.819 -13.103 -13.472 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -21.350 -14.693 -12.904 1.00 0.00 H new ATOM 0 HG LEU A 85 -23.510 -13.697 -11.271 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -25.265 -13.612 -12.997 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -24.077 -12.302 -13.198 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -24.020 -13.727 -14.262 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -24.584 -15.779 -12.035 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -23.311 -15.979 -13.263 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -22.898 -16.051 -11.534 1.00 0.00 H new ATOM 1312 N SER A 86 -19.917 -15.149 -10.732 1.00 0.00 N ATOM 1313 CA SER A 86 -19.564 -16.197 -9.782 1.00 0.00 C ATOM 1314 C SER A 86 -19.063 -17.442 -10.508 1.00 0.00 C ATOM 1315 O SER A 86 -19.622 -18.528 -10.359 1.00 0.00 O ATOM 1316 CB SER A 86 -20.770 -16.551 -8.910 1.00 0.00 C ATOM 1317 OG SER A 86 -20.730 -15.857 -7.676 1.00 0.00 O ATOM 0 H SER A 86 -19.492 -15.255 -11.653 1.00 0.00 H new ATOM 0 HA SER A 86 -18.762 -15.822 -9.146 1.00 0.00 H new ATOM 0 HB2 SER A 86 -21.690 -16.304 -9.440 1.00 0.00 H new ATOM 0 HB3 SER A 86 -20.786 -17.625 -8.726 1.00 0.00 H new ATOM 0 HG SER A 86 -20.825 -14.895 -7.838 1.00 0.00 H new ATOM 1323 N GLY A 87 -18.004 -17.276 -11.294 1.00 0.00 N ATOM 1324 CA GLY A 87 -17.445 -18.393 -12.032 1.00 0.00 C ATOM 1325 C GLY A 87 -15.930 -18.353 -12.084 1.00 0.00 C ATOM 1326 O GLY A 87 -15.335 -17.744 -12.972 1.00 0.00 O ATOM 0 H GLY A 87 -17.523 -16.387 -11.433 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -17.765 -19.327 -11.570 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -17.841 -18.388 -13.048 1.00 0.00 H new ATOM 1330 N PRO A 88 -15.283 -19.015 -11.113 1.00 0.00 N ATOM 1331 CA PRO A 88 -13.821 -19.066 -11.030 1.00 0.00 C ATOM 1332 C PRO A 88 -13.206 -19.904 -12.145 1.00 0.00 C ATOM 1333 O PRO A 88 -13.662 -21.011 -12.427 1.00 0.00 O ATOM 1334 CB PRO A 88 -13.566 -19.718 -9.668 1.00 0.00 C ATOM 1335 CG PRO A 88 -14.791 -20.522 -9.398 1.00 0.00 C ATOM 1336 CD PRO A 88 -15.930 -19.764 -10.022 1.00 0.00 C ATOM 0 HA PRO A 88 -13.372 -18.079 -11.136 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -12.676 -20.347 -9.691 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -13.406 -18.968 -8.894 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -14.705 -21.520 -9.827 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -14.947 -20.648 -8.327 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -16.702 -20.436 -10.398 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.409 -19.097 -9.306 1.00 0.00 H new ATOM 1344 N ASN A 89 -12.166 -19.369 -12.777 1.00 0.00 N ATOM 1345 CA ASN A 89 -11.488 -20.068 -13.863 1.00 0.00 C ATOM 1346 C ASN A 89 -10.134 -20.602 -13.404 1.00 0.00 C ATOM 1347 O ASN A 89 -9.205 -19.833 -13.154 1.00 0.00 O ATOM 1348 CB ASN A 89 -11.302 -19.135 -15.061 1.00 0.00 C ATOM 1349 CG ASN A 89 -11.419 -19.864 -16.385 1.00 0.00 C ATOM 1350 OD1 ASN A 89 -12.289 -19.557 -17.201 1.00 0.00 O ATOM 1351 ND2 ASN A 89 -10.541 -20.836 -16.605 1.00 0.00 N ATOM 0 H ASN A 89 -11.774 -18.454 -12.556 1.00 0.00 H new ATOM 0 HA ASN A 89 -12.109 -20.912 -14.162 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -12.048 -18.341 -15.019 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -10.324 -18.657 -14.998 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -10.571 -21.362 -17.478 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -9.837 -21.056 -15.901 1.00 0.00 H new ATOM 1358 N ARG A 90 -10.030 -21.922 -13.297 1.00 0.00 N ATOM 1359 CA ARG A 90 -8.791 -22.559 -12.869 1.00 0.00 C ATOM 1360 C ARG A 90 -7.775 -22.593 -14.007 1.00 0.00 C ATOM 1361 O ARG A 90 -7.777 -23.511 -14.828 1.00 0.00 O ATOM 1362 CB ARG A 90 -9.067 -23.980 -12.375 1.00 0.00 C ATOM 1363 CG ARG A 90 -10.184 -24.681 -13.130 1.00 0.00 C ATOM 1364 CD ARG A 90 -11.521 -24.518 -12.424 1.00 0.00 C ATOM 1365 NE ARG A 90 -12.037 -25.792 -11.929 1.00 0.00 N ATOM 1366 CZ ARG A 90 -13.161 -25.907 -11.230 1.00 0.00 C ATOM 1367 NH1 ARG A 90 -13.882 -24.832 -10.945 1.00 0.00 N ATOM 1368 NH2 ARG A 90 -13.565 -27.101 -10.814 1.00 0.00 N ATOM 0 H ARG A 90 -10.789 -22.572 -13.501 1.00 0.00 H new ATOM 0 HA ARG A 90 -8.374 -21.972 -12.051 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -8.155 -24.570 -12.463 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -9.322 -23.944 -11.316 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -10.253 -24.276 -14.140 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -9.949 -25.741 -13.227 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -11.409 -23.824 -11.591 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -12.243 -24.077 -13.112 1.00 0.00 H new ATOM 0 HE ARG A 90 -11.506 -26.639 -12.131 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -13.574 -23.913 -11.263 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -14.744 -24.924 -10.408 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -13.012 -27.930 -11.031 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -14.428 -27.189 -10.277 1.00 0.00 H new ATOM 1382 N PHE A 91 -6.909 -21.586 -14.050 1.00 0.00 N ATOM 1383 CA PHE A 91 -5.889 -21.499 -15.089 1.00 0.00 C ATOM 1384 C PHE A 91 -4.594 -22.167 -14.636 1.00 0.00 C ATOM 1385 O PHE A 91 -4.147 -21.976 -13.505 1.00 0.00 O ATOM 1386 CB PHE A 91 -5.622 -20.037 -15.451 1.00 0.00 C ATOM 1387 CG PHE A 91 -6.625 -19.465 -16.413 1.00 0.00 C ATOM 1388 CD1 PHE A 91 -6.489 -19.668 -17.777 1.00 0.00 C ATOM 1389 CD2 PHE A 91 -7.702 -18.726 -15.953 1.00 0.00 C ATOM 1390 CE1 PHE A 91 -7.410 -19.143 -18.664 1.00 0.00 C ATOM 1391 CE2 PHE A 91 -8.627 -18.198 -16.835 1.00 0.00 C ATOM 1392 CZ PHE A 91 -8.480 -18.408 -18.192 1.00 0.00 C ATOM 0 H PHE A 91 -6.893 -20.819 -13.378 1.00 0.00 H new ATOM 0 HA PHE A 91 -6.259 -22.022 -15.971 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.623 -19.439 -14.540 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -4.626 -19.955 -15.885 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -5.654 -20.243 -18.151 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -7.821 -18.560 -14.892 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -7.293 -19.307 -19.725 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -9.462 -17.623 -16.464 1.00 0.00 H new ATOM 0 HZ PHE A 91 -9.201 -17.998 -18.884 1.00 0.00 H new ATOM 1402 N ASP A 92 -3.996 -22.951 -15.527 1.00 0.00 N ATOM 1403 CA ASP A 92 -2.752 -23.647 -15.220 1.00 0.00 C ATOM 1404 C ASP A 92 -1.556 -22.906 -15.808 1.00 0.00 C ATOM 1405 O ASP A 92 -1.634 -22.351 -16.905 1.00 0.00 O ATOM 1406 CB ASP A 92 -2.797 -25.078 -15.759 1.00 0.00 C ATOM 1407 CG ASP A 92 -2.295 -26.092 -14.750 1.00 0.00 C ATOM 1408 OD1 ASP A 92 -1.262 -25.824 -14.102 1.00 0.00 O ATOM 1409 OD2 ASP A 92 -2.936 -27.155 -14.608 1.00 0.00 O ATOM 0 H ASP A 92 -4.353 -23.120 -16.467 1.00 0.00 H new ATOM 0 HA ASP A 92 -2.640 -23.679 -14.136 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -3.821 -25.325 -16.040 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -2.194 -25.141 -16.665 1.00 0.00 H new ATOM 1414 N LEU A 93 -0.450 -22.901 -15.073 1.00 0.00 N ATOM 1415 CA LEU A 93 0.764 -22.227 -15.521 1.00 0.00 C ATOM 1416 C LEU A 93 1.372 -22.942 -16.723 1.00 0.00 C ATOM 1417 O LEU A 93 1.529 -24.164 -16.718 1.00 0.00 O ATOM 1418 CB LEU A 93 1.784 -22.161 -14.383 1.00 0.00 C ATOM 1419 CG LEU A 93 2.456 -23.482 -14.007 1.00 0.00 C ATOM 1420 CD1 LEU A 93 1.417 -24.579 -13.833 1.00 0.00 C ATOM 1421 CD2 LEU A 93 3.481 -23.878 -15.060 1.00 0.00 C ATOM 0 H LEU A 93 -0.368 -23.356 -14.164 1.00 0.00 H new ATOM 0 HA LEU A 93 0.497 -21.214 -15.821 1.00 0.00 H new ATOM 0 HB2 LEU A 93 2.560 -21.447 -14.658 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.286 -21.765 -13.498 1.00 0.00 H new ATOM 0 HG LEU A 93 2.974 -23.346 -13.058 1.00 0.00 H new ATOM 0 HD11 LEU A 93 1.914 -25.512 -13.566 1.00 0.00 H new ATOM 0 HD12 LEU A 93 0.721 -24.299 -13.042 1.00 0.00 H new ATOM 0 HD13 LEU A 93 0.870 -24.714 -14.766 1.00 0.00 H new ATOM 0 HD21 LEU A 93 3.949 -24.820 -14.776 1.00 0.00 H new ATOM 0 HD22 LEU A 93 2.986 -23.995 -16.024 1.00 0.00 H new ATOM 0 HD23 LEU A 93 4.243 -23.103 -15.136 1.00 0.00 H new ATOM 1433 N LEU A 94 1.713 -22.174 -17.752 1.00 0.00 N ATOM 1434 CA LEU A 94 2.306 -22.733 -18.961 1.00 0.00 C ATOM 1435 C LEU A 94 3.599 -22.007 -19.320 1.00 0.00 C ATOM 1436 O LEU A 94 3.572 -20.917 -19.889 1.00 0.00 O ATOM 1437 CB LEU A 94 1.318 -22.645 -20.126 1.00 0.00 C ATOM 1438 CG LEU A 94 1.534 -23.638 -21.267 1.00 0.00 C ATOM 1439 CD1 LEU A 94 0.669 -24.873 -21.071 1.00 0.00 C ATOM 1440 CD2 LEU A 94 1.237 -22.984 -22.608 1.00 0.00 C ATOM 0 H LEU A 94 1.589 -21.162 -17.773 1.00 0.00 H new ATOM 0 HA LEU A 94 2.540 -23.780 -18.770 1.00 0.00 H new ATOM 0 HB2 LEU A 94 0.311 -22.787 -19.733 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.361 -21.636 -20.536 1.00 0.00 H new ATOM 0 HG LEU A 94 2.579 -23.947 -21.260 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.836 -25.569 -21.893 1.00 0.00 H new ATOM 0 HD12 LEU A 94 0.931 -25.355 -20.129 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.381 -24.582 -21.050 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.396 -23.707 -23.408 1.00 0.00 H new ATOM 0 HD22 LEU A 94 0.201 -22.645 -22.626 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.900 -22.131 -22.752 1.00 0.00 H new ATOM 1452 N ASN A 95 4.729 -22.621 -18.985 1.00 0.00 N ATOM 1453 CA ASN A 95 6.032 -22.034 -19.274 1.00 0.00 C ATOM 1454 C ASN A 95 5.992 -20.517 -19.117 1.00 0.00 C ATOM 1455 O ASN A 95 6.594 -19.785 -19.901 1.00 0.00 O ATOM 1456 CB ASN A 95 6.477 -22.400 -20.691 1.00 0.00 C ATOM 1457 CG ASN A 95 6.313 -23.878 -20.986 1.00 0.00 C ATOM 1458 OD1 ASN A 95 6.675 -24.728 -20.172 1.00 0.00 O ATOM 1459 ND2 ASN A 95 5.766 -24.192 -22.154 1.00 0.00 N ATOM 0 H ASN A 95 4.769 -23.525 -18.513 1.00 0.00 H new ATOM 0 HA ASN A 95 6.750 -22.437 -18.560 1.00 0.00 H new ATOM 0 HB2 ASN A 95 5.898 -21.822 -21.411 1.00 0.00 H new ATOM 0 HB3 ASN A 95 7.522 -22.120 -20.824 1.00 0.00 H new ATOM 0 HD21 ASN A 95 5.631 -25.171 -22.407 1.00 0.00 H new ATOM 0 HD22 ASN A 95 5.481 -23.454 -22.798 1.00 0.00 H new ATOM 1466 N GLY A 96 5.278 -20.052 -18.096 1.00 0.00 N ATOM 1467 CA GLY A 96 5.173 -18.625 -17.854 1.00 0.00 C ATOM 1468 C GLY A 96 3.897 -18.033 -18.420 1.00 0.00 C ATOM 1469 O GLY A 96 3.800 -16.822 -18.613 1.00 0.00 O ATOM 0 H GLY A 96 4.771 -20.638 -17.433 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.212 -18.438 -16.781 1.00 0.00 H new ATOM 0 HA3 GLY A 96 6.032 -18.120 -18.297 1.00 0.00 H new ATOM 1473 N GLU A 97 2.917 -18.890 -18.688 1.00 0.00 N ATOM 1474 CA GLU A 97 1.642 -18.444 -19.238 1.00 0.00 C ATOM 1475 C GLU A 97 0.486 -19.254 -18.658 1.00 0.00 C ATOM 1476 O GLU A 97 0.391 -20.462 -18.874 1.00 0.00 O ATOM 1477 CB GLU A 97 1.650 -18.565 -20.763 1.00 0.00 C ATOM 1478 CG GLU A 97 1.634 -17.226 -21.480 1.00 0.00 C ATOM 1479 CD GLU A 97 0.351 -16.993 -22.255 1.00 0.00 C ATOM 1480 OE1 GLU A 97 0.238 -17.515 -23.384 1.00 0.00 O ATOM 1481 OE2 GLU A 97 -0.539 -16.290 -21.733 1.00 0.00 O ATOM 0 H GLU A 97 2.981 -19.896 -18.533 1.00 0.00 H new ATOM 0 HA GLU A 97 1.503 -17.398 -18.964 1.00 0.00 H new ATOM 0 HB2 GLU A 97 2.535 -19.121 -21.070 1.00 0.00 H new ATOM 0 HB3 GLU A 97 0.783 -19.146 -21.077 1.00 0.00 H new ATOM 0 HG2 GLU A 97 1.764 -16.426 -20.751 1.00 0.00 H new ATOM 0 HG3 GLU A 97 2.481 -17.174 -22.164 1.00 0.00 H new ATOM 1488 N TRP A 98 -0.388 -18.580 -17.920 1.00 0.00 N ATOM 1489 CA TRP A 98 -1.538 -19.236 -17.308 1.00 0.00 C ATOM 1490 C TRP A 98 -2.648 -19.455 -18.330 1.00 0.00 C ATOM 1491 O TRP A 98 -3.276 -18.502 -18.793 1.00 0.00 O ATOM 1492 CB TRP A 98 -2.063 -18.404 -16.137 1.00 0.00 C ATOM 1493 CG TRP A 98 -0.984 -17.952 -15.199 1.00 0.00 C ATOM 1494 CD1 TRP A 98 -0.277 -16.786 -15.265 1.00 0.00 C ATOM 1495 CD2 TRP A 98 -0.490 -18.660 -14.057 1.00 0.00 C ATOM 1496 NE1 TRP A 98 0.628 -16.726 -14.232 1.00 0.00 N ATOM 1497 CE2 TRP A 98 0.516 -17.863 -13.476 1.00 0.00 C ATOM 1498 CE3 TRP A 98 -0.801 -19.888 -13.467 1.00 0.00 C ATOM 1499 CZ2 TRP A 98 1.212 -18.257 -12.337 1.00 0.00 C ATOM 1500 CZ3 TRP A 98 -0.109 -20.277 -12.336 1.00 0.00 C ATOM 1501 CH2 TRP A 98 0.887 -19.464 -11.780 1.00 0.00 C ATOM 0 H TRP A 98 -0.323 -17.580 -17.731 1.00 0.00 H new ATOM 0 HA TRP A 98 -1.214 -20.209 -16.937 1.00 0.00 H new ATOM 0 HB2 TRP A 98 -2.585 -17.530 -16.527 1.00 0.00 H new ATOM 0 HB3 TRP A 98 -2.794 -18.992 -15.582 1.00 0.00 H new ATOM 0 HD1 TRP A 98 -0.409 -16.023 -16.018 1.00 0.00 H new ATOM 0 HE1 TRP A 98 1.278 -15.959 -14.057 1.00 0.00 H new ATOM 0 HE3 TRP A 98 -1.568 -20.521 -13.887 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 1.981 -17.632 -11.908 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 -0.340 -21.225 -11.872 1.00 0.00 H new ATOM 0 HH2 TRP A 98 1.409 -19.796 -10.895 1.00 0.00 H new ATOM 1512 N VAL A 99 -2.886 -20.715 -18.679 1.00 0.00 N ATOM 1513 CA VAL A 99 -3.922 -21.059 -19.646 1.00 0.00 C ATOM 1514 C VAL A 99 -4.799 -22.195 -19.131 1.00 0.00 C ATOM 1515 O VAL A 99 -4.330 -23.079 -18.415 1.00 0.00 O ATOM 1516 CB VAL A 99 -3.313 -21.468 -21.000 1.00 0.00 C ATOM 1517 CG1 VAL A 99 -2.551 -20.304 -21.616 1.00 0.00 C ATOM 1518 CG2 VAL A 99 -2.408 -22.679 -20.832 1.00 0.00 C ATOM 0 H VAL A 99 -2.375 -21.515 -18.306 1.00 0.00 H new ATOM 0 HA VAL A 99 -4.533 -20.167 -19.786 1.00 0.00 H new ATOM 0 HB VAL A 99 -4.123 -21.739 -21.677 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -2.128 -20.612 -22.572 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -3.231 -19.466 -21.773 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -1.748 -19.999 -20.945 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.986 -22.955 -21.798 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -1.602 -22.437 -20.140 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.987 -23.514 -20.437 1.00 0.00 H new ATOM 1528 N SER A 100 -6.075 -22.164 -19.503 1.00 0.00 N ATOM 1529 CA SER A 100 -7.020 -23.190 -19.076 1.00 0.00 C ATOM 1530 C SER A 100 -7.391 -24.105 -20.240 1.00 0.00 C ATOM 1531 O SER A 100 -7.271 -23.725 -21.406 1.00 0.00 O ATOM 1532 CB SER A 100 -8.280 -22.544 -18.499 1.00 0.00 C ATOM 1533 OG SER A 100 -9.228 -23.527 -18.118 1.00 0.00 O ATOM 0 H SER A 100 -6.478 -21.440 -20.098 1.00 0.00 H new ATOM 0 HA SER A 100 -6.542 -23.791 -18.302 1.00 0.00 H new ATOM 0 HB2 SER A 100 -8.017 -21.934 -17.635 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.721 -21.876 -19.239 1.00 0.00 H new ATOM 0 HG SER A 100 -9.760 -23.194 -17.366 1.00 0.00 H new ATOM 1539 N LEU A 101 -7.841 -25.311 -19.916 1.00 0.00 N ATOM 1540 CA LEU A 101 -8.230 -26.282 -20.933 1.00 0.00 C ATOM 1541 C LEU A 101 -7.006 -26.987 -21.509 1.00 0.00 C ATOM 1542 O LEU A 101 -6.797 -26.996 -22.723 1.00 0.00 O ATOM 1543 CB LEU A 101 -9.010 -25.591 -22.053 1.00 0.00 C ATOM 1544 CG LEU A 101 -10.032 -26.456 -22.791 1.00 0.00 C ATOM 1545 CD1 LEU A 101 -10.908 -27.208 -21.802 1.00 0.00 C ATOM 1546 CD2 LEU A 101 -10.884 -25.601 -23.718 1.00 0.00 C ATOM 0 H LEU A 101 -7.946 -25.641 -18.957 1.00 0.00 H new ATOM 0 HA LEU A 101 -8.868 -27.030 -20.462 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -9.529 -24.731 -21.630 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -8.296 -25.206 -22.781 1.00 0.00 H new ATOM 0 HG LEU A 101 -9.493 -27.186 -23.395 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -11.629 -27.818 -22.346 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -10.285 -27.850 -21.180 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -11.439 -26.495 -21.171 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.606 -26.233 -24.235 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -11.414 -24.848 -23.134 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -10.244 -25.108 -24.450 1.00 0.00 H new ATOM 1558 N ARG A 102 -6.202 -27.578 -20.632 1.00 0.00 N ATOM 1559 CA ARG A 102 -5.000 -28.287 -21.054 1.00 0.00 C ATOM 1560 C ARG A 102 -4.339 -27.581 -22.234 1.00 0.00 C ATOM 1561 O ARG A 102 -4.021 -28.207 -23.245 1.00 0.00 O ATOM 1562 CB ARG A 102 -5.339 -29.729 -21.433 1.00 0.00 C ATOM 1563 CG ARG A 102 -6.470 -29.844 -22.442 1.00 0.00 C ATOM 1564 CD ARG A 102 -6.901 -31.290 -22.633 1.00 0.00 C ATOM 1565 NE ARG A 102 -5.971 -32.032 -23.479 1.00 0.00 N ATOM 1566 CZ ARG A 102 -6.310 -33.113 -24.172 1.00 0.00 C ATOM 1567 NH1 ARG A 102 -7.551 -33.575 -24.121 1.00 0.00 N ATOM 1568 NH2 ARG A 102 -5.406 -33.734 -24.920 1.00 0.00 N ATOM 0 H ARG A 102 -6.361 -27.580 -19.624 1.00 0.00 H new ATOM 0 HA ARG A 102 -4.300 -28.294 -20.218 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -4.449 -30.207 -21.842 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -5.610 -30.278 -20.532 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -7.321 -29.251 -22.106 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -6.150 -29.429 -23.398 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -6.974 -31.778 -21.661 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -7.895 -31.316 -23.078 1.00 0.00 H new ATOM 0 HE ARG A 102 -5.008 -31.702 -23.541 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -8.249 -33.100 -23.548 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -7.808 -34.405 -24.654 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -4.450 -33.381 -24.963 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -5.667 -34.564 -25.452 1.00 0.00 H new ATOM 1582 N ASN A 103 -4.136 -26.275 -22.098 1.00 0.00 N ATOM 1583 CA ASN A 103 -3.514 -25.484 -23.154 1.00 0.00 C ATOM 1584 C ASN A 103 -4.531 -25.120 -24.232 1.00 0.00 C ATOM 1585 O ASN A 103 -4.573 -25.737 -25.295 1.00 0.00 O ATOM 1586 CB ASN A 103 -2.348 -26.253 -23.777 1.00 0.00 C ATOM 1587 CG ASN A 103 -1.665 -27.172 -22.783 1.00 0.00 C ATOM 1588 OD1 ASN A 103 -1.743 -26.823 -21.504 1.00 0.00 O flip ATOM 1589 ND2 ASN A 103 -1.075 -28.185 -23.160 1.00 0.00 N flip ATOM 0 H ASN A 103 -4.393 -25.742 -21.267 1.00 0.00 H new ATOM 0 HA ASN A 103 -3.137 -24.563 -22.709 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -2.713 -26.840 -24.620 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -1.620 -25.545 -24.173 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -1.040 -28.415 -24.153 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -0.621 -28.794 -22.479 1.00 0.00 H new ATOM 1596 N GLY A 104 -5.351 -24.112 -23.948 1.00 0.00 N ATOM 1597 CA GLY A 104 -6.356 -23.682 -24.903 1.00 0.00 C ATOM 1598 C GLY A 104 -6.645 -22.197 -24.812 1.00 0.00 C ATOM 1599 O GLY A 104 -6.508 -21.468 -25.794 1.00 0.00 O ATOM 0 H GLY A 104 -5.337 -23.586 -23.074 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -6.020 -23.922 -25.912 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -7.277 -24.239 -24.732 1.00 0.00 H new ATOM 1603 N THR A 105 -7.049 -21.746 -23.628 1.00 0.00 N ATOM 1604 CA THR A 105 -7.362 -20.339 -23.412 1.00 0.00 C ATOM 1605 C THR A 105 -6.459 -19.732 -22.344 1.00 0.00 C ATOM 1606 O THR A 105 -5.911 -20.444 -21.502 1.00 0.00 O ATOM 1607 CB THR A 105 -8.832 -20.148 -22.994 1.00 0.00 C ATOM 1608 OG1 THR A 105 -9.358 -21.375 -22.478 1.00 0.00 O ATOM 1609 CG2 THR A 105 -9.674 -19.686 -24.174 1.00 0.00 C ATOM 0 H THR A 105 -7.167 -22.335 -22.804 1.00 0.00 H new ATOM 0 HA THR A 105 -7.192 -19.829 -24.360 1.00 0.00 H new ATOM 0 HB THR A 105 -8.870 -19.383 -22.219 1.00 0.00 H new ATOM 0 HG1 THR A 105 -10.292 -21.245 -22.213 1.00 0.00 H new ATOM 0 HG21 THR A 105 -10.708 -19.558 -23.855 1.00 0.00 H new ATOM 0 HG22 THR A 105 -9.289 -18.737 -24.546 1.00 0.00 H new ATOM 0 HG23 THR A 105 -9.629 -20.432 -24.967 1.00 0.00 H new ATOM 1617 N LYS A 106 -6.307 -18.413 -22.384 1.00 0.00 N ATOM 1618 CA LYS A 106 -5.472 -17.709 -21.419 1.00 0.00 C ATOM 1619 C LYS A 106 -6.316 -16.810 -20.521 1.00 0.00 C ATOM 1620 O LYS A 106 -7.408 -16.384 -20.902 1.00 0.00 O ATOM 1621 CB LYS A 106 -4.413 -16.874 -22.142 1.00 0.00 C ATOM 1622 CG LYS A 106 -4.513 -16.944 -23.656 1.00 0.00 C ATOM 1623 CD LYS A 106 -4.107 -18.311 -24.180 1.00 0.00 C ATOM 1624 CE LYS A 106 -3.490 -18.216 -25.567 1.00 0.00 C ATOM 1625 NZ LYS A 106 -2.061 -18.633 -25.568 1.00 0.00 N ATOM 0 H LYS A 106 -6.752 -17.809 -23.075 1.00 0.00 H new ATOM 0 HA LYS A 106 -4.976 -18.453 -20.796 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -4.505 -15.834 -21.828 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -3.423 -17.213 -21.835 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -5.535 -16.724 -23.964 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -3.875 -16.179 -24.099 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -3.394 -18.768 -23.494 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -4.980 -18.963 -24.213 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -4.052 -18.844 -26.258 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -3.570 -17.191 -25.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -1.631 -18.396 -26.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -1.554 -18.135 -24.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -1.999 -19.659 -25.411 1.00 0.00 H new ATOM 1639 N LEU A 107 -5.806 -16.524 -19.329 1.00 0.00 N ATOM 1640 CA LEU A 107 -6.513 -15.674 -18.377 1.00 0.00 C ATOM 1641 C LEU A 107 -6.745 -14.283 -18.958 1.00 0.00 C ATOM 1642 O LEU A 107 -7.850 -13.956 -19.393 1.00 0.00 O ATOM 1643 CB LEU A 107 -5.722 -15.568 -17.072 1.00 0.00 C ATOM 1644 CG LEU A 107 -6.337 -14.688 -15.984 1.00 0.00 C ATOM 1645 CD1 LEU A 107 -6.202 -13.217 -16.347 1.00 0.00 C ATOM 1646 CD2 LEU A 107 -7.798 -15.053 -15.766 1.00 0.00 C ATOM 0 H LEU A 107 -4.905 -16.868 -18.998 1.00 0.00 H new ATOM 0 HA LEU A 107 -7.482 -16.129 -18.171 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -5.590 -16.572 -16.668 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -4.728 -15.184 -17.303 1.00 0.00 H new ATOM 0 HG LEU A 107 -5.796 -14.863 -15.054 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -6.645 -12.606 -15.561 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -5.147 -12.963 -16.452 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -6.717 -13.026 -17.289 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -8.220 -14.417 -14.988 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -8.352 -14.908 -16.694 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -7.871 -16.097 -15.460 1.00 0.00 H new ATOM 1658 N THR A 108 -5.696 -13.467 -18.965 1.00 0.00 N ATOM 1659 CA THR A 108 -5.785 -12.112 -19.493 1.00 0.00 C ATOM 1660 C THR A 108 -6.528 -12.088 -20.824 1.00 0.00 C ATOM 1661 O THR A 108 -7.051 -11.052 -21.236 1.00 0.00 O ATOM 1662 CB THR A 108 -4.389 -11.491 -19.688 1.00 0.00 C ATOM 1663 OG1 THR A 108 -4.509 -10.091 -19.964 1.00 0.00 O ATOM 1664 CG2 THR A 108 -3.646 -12.176 -20.825 1.00 0.00 C ATOM 0 H THR A 108 -4.774 -13.722 -18.611 1.00 0.00 H new ATOM 0 HA THR A 108 -6.337 -11.524 -18.760 1.00 0.00 H new ATOM 0 HB THR A 108 -3.822 -11.631 -18.768 1.00 0.00 H new ATOM 0 HG1 THR A 108 -3.617 -9.704 -20.085 1.00 0.00 H new ATOM 0 HG21 THR A 108 -2.663 -11.720 -20.944 1.00 0.00 H new ATOM 0 HG22 THR A 108 -3.530 -13.236 -20.597 1.00 0.00 H new ATOM 0 HG23 THR A 108 -4.212 -12.063 -21.750 1.00 0.00 H new ATOM 1672 N ASP A 109 -6.573 -13.236 -21.492 1.00 0.00 N ATOM 1673 CA ASP A 109 -7.254 -13.347 -22.776 1.00 0.00 C ATOM 1674 C ASP A 109 -8.767 -13.410 -22.585 1.00 0.00 C ATOM 1675 O ASP A 109 -9.518 -12.716 -23.271 1.00 0.00 O ATOM 1676 CB ASP A 109 -6.771 -14.588 -23.528 1.00 0.00 C ATOM 1677 CG ASP A 109 -6.288 -14.265 -24.929 1.00 0.00 C ATOM 1678 OD1 ASP A 109 -7.118 -14.285 -25.861 1.00 0.00 O ATOM 1679 OD2 ASP A 109 -5.080 -13.993 -25.092 1.00 0.00 O ATOM 0 H ASP A 109 -6.146 -14.103 -21.165 1.00 0.00 H new ATOM 0 HA ASP A 109 -7.016 -12.460 -23.363 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -5.963 -15.057 -22.967 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -7.582 -15.314 -23.585 1.00 0.00 H new ATOM 1684 N ILE A 110 -9.205 -14.247 -21.651 1.00 0.00 N ATOM 1685 CA ILE A 110 -10.628 -14.400 -21.370 1.00 0.00 C ATOM 1686 C ILE A 110 -11.165 -13.208 -20.586 1.00 0.00 C ATOM 1687 O ILE A 110 -12.328 -12.828 -20.731 1.00 0.00 O ATOM 1688 CB ILE A 110 -10.909 -15.690 -20.578 1.00 0.00 C ATOM 1689 CG1 ILE A 110 -11.345 -16.811 -21.524 1.00 0.00 C ATOM 1690 CG2 ILE A 110 -11.973 -15.440 -19.519 1.00 0.00 C ATOM 1691 CD1 ILE A 110 -12.584 -16.477 -22.326 1.00 0.00 C ATOM 0 H ILE A 110 -8.596 -14.829 -21.076 1.00 0.00 H new ATOM 0 HA ILE A 110 -11.136 -14.456 -22.333 1.00 0.00 H new ATOM 0 HB ILE A 110 -9.991 -15.999 -20.078 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -10.528 -17.035 -22.210 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.531 -17.714 -20.943 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -12.161 -16.361 -18.967 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -11.627 -14.669 -18.831 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -12.894 -15.111 -19.999 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -12.835 -17.316 -22.975 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -13.415 -16.281 -21.648 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -12.396 -15.592 -22.934 1.00 0.00 H new ATOM 1703 N LEU A 111 -10.310 -12.619 -19.757 1.00 0.00 N ATOM 1704 CA LEU A 111 -10.698 -11.467 -18.950 1.00 0.00 C ATOM 1705 C LEU A 111 -10.778 -10.206 -19.805 1.00 0.00 C ATOM 1706 O LEU A 111 -11.670 -9.376 -19.625 1.00 0.00 O ATOM 1707 CB LEU A 111 -9.700 -11.260 -17.809 1.00 0.00 C ATOM 1708 CG LEU A 111 -10.304 -10.971 -16.434 1.00 0.00 C ATOM 1709 CD1 LEU A 111 -10.999 -9.619 -16.430 1.00 0.00 C ATOM 1710 CD2 LEU A 111 -11.275 -12.073 -16.036 1.00 0.00 C ATOM 0 H LEU A 111 -9.344 -12.920 -19.626 1.00 0.00 H new ATOM 0 HA LEU A 111 -11.685 -11.663 -18.531 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -9.078 -12.152 -17.730 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.041 -10.434 -18.075 1.00 0.00 H new ATOM 0 HG LEU A 111 -9.497 -10.944 -15.702 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -11.423 -9.431 -15.444 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -10.277 -8.838 -16.670 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -11.796 -9.617 -17.173 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -11.695 -11.851 -15.055 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -12.079 -12.132 -16.770 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -10.748 -13.026 -15.997 1.00 0.00 H new ATOM 1722 N THR A 112 -9.842 -10.069 -20.739 1.00 0.00 N ATOM 1723 CA THR A 112 -9.807 -8.911 -21.623 1.00 0.00 C ATOM 1724 C THR A 112 -10.921 -8.978 -22.661 1.00 0.00 C ATOM 1725 O THR A 112 -11.559 -7.971 -22.966 1.00 0.00 O ATOM 1726 CB THR A 112 -8.452 -8.798 -22.347 1.00 0.00 C ATOM 1727 OG1 THR A 112 -7.406 -8.570 -21.396 1.00 0.00 O ATOM 1728 CG2 THR A 112 -8.475 -7.666 -23.364 1.00 0.00 C ATOM 0 H THR A 112 -9.097 -10.747 -20.903 1.00 0.00 H new ATOM 0 HA THR A 112 -9.950 -8.031 -20.997 1.00 0.00 H new ATOM 0 HB THR A 112 -8.267 -9.735 -22.873 1.00 0.00 H new ATOM 0 HG1 THR A 112 -6.875 -9.387 -21.292 1.00 0.00 H new ATOM 0 HG21 THR A 112 -7.508 -7.605 -23.863 1.00 0.00 H new ATOM 0 HG22 THR A 112 -9.253 -7.857 -24.103 1.00 0.00 H new ATOM 0 HG23 THR A 112 -8.681 -6.724 -22.855 1.00 0.00 H new ATOM 1736 N GLU A 113 -11.151 -10.171 -23.200 1.00 0.00 N ATOM 1737 CA GLU A 113 -12.189 -10.368 -24.205 1.00 0.00 C ATOM 1738 C GLU A 113 -13.576 -10.335 -23.568 1.00 0.00 C ATOM 1739 O GLU A 113 -14.524 -9.809 -24.149 1.00 0.00 O ATOM 1740 CB GLU A 113 -11.981 -11.698 -24.932 1.00 0.00 C ATOM 1741 CG GLU A 113 -10.902 -11.646 -26.000 1.00 0.00 C ATOM 1742 CD GLU A 113 -9.956 -10.475 -25.817 1.00 0.00 C ATOM 1743 OE1 GLU A 113 -9.015 -10.593 -25.005 1.00 0.00 O ATOM 1744 OE2 GLU A 113 -10.158 -9.440 -26.486 1.00 0.00 O ATOM 0 H GLU A 113 -10.633 -11.015 -22.958 1.00 0.00 H new ATOM 0 HA GLU A 113 -12.120 -9.554 -24.926 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -11.721 -12.465 -24.202 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -12.921 -12.002 -25.392 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -10.332 -12.575 -25.981 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -11.371 -11.580 -26.982 1.00 0.00 H new ATOM 1751 N GLU A 114 -13.684 -10.903 -22.370 1.00 0.00 N ATOM 1752 CA GLU A 114 -14.954 -10.939 -21.655 1.00 0.00 C ATOM 1753 C GLU A 114 -15.380 -9.537 -21.230 1.00 0.00 C ATOM 1754 O GLU A 114 -16.509 -9.116 -21.480 1.00 0.00 O ATOM 1755 CB GLU A 114 -14.848 -11.846 -20.428 1.00 0.00 C ATOM 1756 CG GLU A 114 -16.156 -12.003 -19.671 1.00 0.00 C ATOM 1757 CD GLU A 114 -17.190 -12.793 -20.449 1.00 0.00 C ATOM 1758 OE1 GLU A 114 -16.953 -13.994 -20.699 1.00 0.00 O ATOM 1759 OE2 GLU A 114 -18.234 -12.211 -20.810 1.00 0.00 O ATOM 0 H GLU A 114 -12.908 -11.344 -21.876 1.00 0.00 H new ATOM 0 HA GLU A 114 -15.710 -11.340 -22.330 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -14.500 -12.830 -20.743 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -14.094 -11.442 -19.753 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -15.964 -12.501 -18.721 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -16.557 -11.017 -19.439 1.00 0.00 H new ATOM 1766 N VAL A 115 -14.467 -8.818 -20.584 1.00 0.00 N ATOM 1767 CA VAL A 115 -14.746 -7.463 -20.124 1.00 0.00 C ATOM 1768 C VAL A 115 -14.955 -6.516 -21.299 1.00 0.00 C ATOM 1769 O VAL A 115 -15.727 -5.562 -21.210 1.00 0.00 O ATOM 1770 CB VAL A 115 -13.606 -6.925 -19.240 1.00 0.00 C ATOM 1771 CG1 VAL A 115 -13.990 -5.585 -18.630 1.00 0.00 C ATOM 1772 CG2 VAL A 115 -13.251 -7.931 -18.156 1.00 0.00 C ATOM 0 H VAL A 115 -13.528 -9.152 -20.368 1.00 0.00 H new ATOM 0 HA VAL A 115 -15.661 -7.511 -19.534 1.00 0.00 H new ATOM 0 HB VAL A 115 -12.726 -6.774 -19.865 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -13.172 -5.220 -18.009 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -14.189 -4.867 -19.425 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -14.884 -5.706 -18.018 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -12.443 -7.534 -17.541 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -14.125 -8.117 -17.532 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -12.930 -8.865 -18.617 1.00 0.00 H new ATOM 1782 N GLU A 116 -14.260 -6.786 -22.400 1.00 0.00 N ATOM 1783 CA GLU A 116 -14.370 -5.956 -23.594 1.00 0.00 C ATOM 1784 C GLU A 116 -15.756 -6.081 -24.219 1.00 0.00 C ATOM 1785 O GLU A 116 -16.405 -5.080 -24.525 1.00 0.00 O ATOM 1786 CB GLU A 116 -13.301 -6.349 -24.616 1.00 0.00 C ATOM 1787 CG GLU A 116 -13.287 -5.467 -25.853 1.00 0.00 C ATOM 1788 CD GLU A 116 -12.232 -4.380 -25.783 1.00 0.00 C ATOM 1789 OE1 GLU A 116 -12.454 -3.382 -25.066 1.00 0.00 O ATOM 1790 OE2 GLU A 116 -11.184 -4.528 -26.446 1.00 0.00 O ATOM 0 H GLU A 116 -13.616 -7.572 -22.490 1.00 0.00 H new ATOM 0 HA GLU A 116 -14.216 -4.918 -23.298 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -12.322 -6.307 -24.139 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -13.463 -7.383 -24.919 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -13.109 -6.085 -26.733 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -14.268 -5.008 -25.979 1.00 0.00 H new ATOM 1797 N LYS A 117 -16.205 -7.318 -24.406 1.00 0.00 N ATOM 1798 CA LYS A 117 -17.514 -7.577 -24.994 1.00 0.00 C ATOM 1799 C LYS A 117 -18.621 -7.376 -23.964 1.00 0.00 C ATOM 1800 O LYS A 117 -19.799 -7.304 -24.313 1.00 0.00 O ATOM 1801 CB LYS A 117 -17.573 -9.001 -25.551 1.00 0.00 C ATOM 1802 CG LYS A 117 -16.955 -9.140 -26.931 1.00 0.00 C ATOM 1803 CD LYS A 117 -16.107 -10.396 -27.039 1.00 0.00 C ATOM 1804 CE LYS A 117 -16.969 -11.640 -27.190 1.00 0.00 C ATOM 1805 NZ LYS A 117 -16.407 -12.799 -26.443 1.00 0.00 N ATOM 0 H LYS A 117 -15.681 -8.157 -24.159 1.00 0.00 H new ATOM 0 HA LYS A 117 -17.666 -6.869 -25.809 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -17.060 -9.673 -24.863 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -18.614 -9.323 -25.594 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -17.744 -9.167 -27.683 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -16.340 -8.266 -27.145 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -15.436 -10.311 -27.894 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -15.481 -10.491 -26.151 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -17.976 -11.430 -26.830 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -17.055 -11.896 -28.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -17.023 -13.627 -26.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -15.456 -13.016 -26.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -16.348 -12.565 -25.431 1.00 0.00 H new ATOM 1819 N ALA A 118 -18.235 -7.284 -22.696 1.00 0.00 N ATOM 1820 CA ALA A 118 -19.195 -7.088 -21.617 1.00 0.00 C ATOM 1821 C ALA A 118 -19.471 -5.605 -21.391 1.00 0.00 C ATOM 1822 O ALA A 118 -20.582 -5.219 -21.028 1.00 0.00 O ATOM 1823 CB ALA A 118 -18.689 -7.734 -20.336 1.00 0.00 C ATOM 0 H ALA A 118 -17.264 -7.342 -22.391 1.00 0.00 H new ATOM 0 HA ALA A 118 -20.131 -7.565 -21.906 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -19.416 -7.580 -19.539 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -18.550 -8.803 -20.498 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -17.738 -7.283 -20.052 1.00 0.00 H new ATOM 1829 N ILE A 119 -18.453 -4.779 -21.607 1.00 0.00 N ATOM 1830 CA ILE A 119 -18.587 -3.339 -21.426 1.00 0.00 C ATOM 1831 C ILE A 119 -18.916 -2.648 -22.745 1.00 0.00 C ATOM 1832 O ILE A 119 -19.592 -1.619 -22.767 1.00 0.00 O ATOM 1833 CB ILE A 119 -17.301 -2.722 -20.844 1.00 0.00 C ATOM 1834 CG1 ILE A 119 -16.945 -3.393 -19.515 1.00 0.00 C ATOM 1835 CG2 ILE A 119 -17.471 -1.222 -20.657 1.00 0.00 C ATOM 1836 CD1 ILE A 119 -15.649 -2.893 -18.915 1.00 0.00 C ATOM 0 H ILE A 119 -17.527 -5.082 -21.907 1.00 0.00 H new ATOM 0 HA ILE A 119 -19.405 -3.184 -20.723 1.00 0.00 H new ATOM 0 HB ILE A 119 -16.484 -2.890 -21.546 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -17.754 -3.225 -18.804 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -16.874 -4.470 -19.668 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -16.554 -0.800 -20.245 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -17.684 -0.757 -21.620 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -18.297 -1.032 -19.972 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -15.459 -3.411 -17.975 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -14.829 -3.085 -19.607 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -15.723 -1.821 -18.730 1.00 0.00 H new ATOM 1848 N SER A 120 -18.435 -3.221 -23.844 1.00 0.00 N ATOM 1849 CA SER A 120 -18.676 -2.660 -25.168 1.00 0.00 C ATOM 1850 C SER A 120 -20.014 -3.139 -25.725 1.00 0.00 C ATOM 1851 O SER A 120 -20.620 -2.478 -26.569 1.00 0.00 O ATOM 1852 CB SER A 120 -17.545 -3.046 -26.122 1.00 0.00 C ATOM 1853 OG SER A 120 -17.591 -2.271 -27.308 1.00 0.00 O ATOM 0 H SER A 120 -17.876 -4.074 -23.843 1.00 0.00 H new ATOM 0 HA SER A 120 -18.708 -1.574 -25.076 1.00 0.00 H new ATOM 0 HB2 SER A 120 -16.584 -2.904 -25.628 1.00 0.00 H new ATOM 0 HB3 SER A 120 -17.621 -4.104 -26.372 1.00 0.00 H new ATOM 0 HG SER A 120 -16.857 -2.536 -27.901 1.00 0.00 H new ATOM 1859 N LYS A 121 -20.468 -4.292 -25.247 1.00 0.00 N ATOM 1860 CA LYS A 121 -21.733 -4.861 -25.695 1.00 0.00 C ATOM 1861 C LYS A 121 -22.815 -3.788 -25.772 1.00 0.00 C ATOM 1862 O LYS A 121 -23.798 -3.936 -26.499 1.00 0.00 O ATOM 1863 CB LYS A 121 -22.176 -5.980 -24.749 1.00 0.00 C ATOM 1864 CG LYS A 121 -22.164 -7.357 -25.389 1.00 0.00 C ATOM 1865 CD LYS A 121 -22.195 -8.458 -24.342 1.00 0.00 C ATOM 1866 CE LYS A 121 -23.621 -8.844 -23.980 1.00 0.00 C ATOM 1867 NZ LYS A 121 -23.731 -10.285 -23.619 1.00 0.00 N ATOM 0 H LYS A 121 -19.978 -4.851 -24.549 1.00 0.00 H new ATOM 0 HA LYS A 121 -21.584 -5.274 -26.692 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -21.522 -5.988 -23.877 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -23.182 -5.764 -24.390 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -23.024 -7.459 -26.051 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -21.272 -7.465 -26.006 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -21.664 -9.333 -24.717 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -21.669 -8.125 -23.447 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -23.961 -8.233 -23.144 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -24.280 -8.629 -24.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -24.718 -10.508 -23.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -23.430 -10.869 -24.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -23.122 -10.485 -22.800 1.00 0.00 H new ATOM 1881 N SER A 122 -22.627 -2.709 -25.020 1.00 0.00 N ATOM 1882 CA SER A 122 -23.588 -1.612 -25.002 1.00 0.00 C ATOM 1883 C SER A 122 -23.016 -0.377 -25.691 1.00 0.00 C ATOM 1884 O SER A 122 -23.627 0.174 -26.606 1.00 0.00 O ATOM 1885 CB SER A 122 -23.979 -1.272 -23.562 1.00 0.00 C ATOM 1886 OG SER A 122 -25.368 -1.014 -23.459 1.00 0.00 O ATOM 0 H SER A 122 -21.818 -2.570 -24.415 1.00 0.00 H new ATOM 0 HA SER A 122 -24.477 -1.931 -25.547 1.00 0.00 H new ATOM 0 HB2 SER A 122 -23.709 -2.098 -22.904 1.00 0.00 H new ATOM 0 HB3 SER A 122 -23.418 -0.400 -23.226 1.00 0.00 H new ATOM 0 HG SER A 122 -25.593 -0.801 -22.529 1.00 0.00 H new ATOM 1892 N GLN A 123 -21.839 0.050 -25.244 1.00 0.00 N ATOM 1893 CA GLN A 123 -21.185 1.220 -25.817 1.00 0.00 C ATOM 1894 C GLN A 123 -20.749 0.952 -27.254 1.00 0.00 C ATOM 1895 O GLN A 123 -20.800 1.839 -28.106 1.00 0.00 O ATOM 1896 CB GLN A 123 -19.975 1.620 -24.971 1.00 0.00 C ATOM 1897 CG GLN A 123 -19.160 2.755 -25.571 1.00 0.00 C ATOM 1898 CD GLN A 123 -19.300 4.048 -24.792 1.00 0.00 C ATOM 1899 OE1 GLN A 123 -18.360 4.494 -24.134 1.00 0.00 O ATOM 1900 NE2 GLN A 123 -20.478 4.658 -24.863 1.00 0.00 N ATOM 0 H GLN A 123 -21.320 -0.396 -24.488 1.00 0.00 H new ATOM 0 HA GLN A 123 -21.903 2.040 -25.822 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -20.317 1.915 -23.979 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -19.330 0.751 -24.840 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -18.109 2.466 -25.602 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -19.476 2.920 -26.601 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -21.230 4.252 -25.421 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -20.631 5.532 -24.360 1.00 0.00 H new