USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 964 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 115 GLN : amide:sc= 0.444 K(o=0.28,f=-0.91) USER MOD Set 1.2: A 117 GLN : amide:sc= -0.168 K(o=0.28,f=-1.8) USER MOD Set 2.1: A 16 ASN : amide:sc= -12.6! C(o=-13!,f=-16!) USER MOD Set 2.2: A 44 GLN : amide:sc= 0 X(o=-13,f=-13) USER MOD Single : A 6 MET CE :methyl -177:sc= 0 (180deg=-0.00391) USER MOD Single : A 20 CYS SG : rot 73:sc= 0.311 USER MOD Single : A 22 MET CE :methyl -133:sc= -5! (180deg=-7.33!) USER MOD Single : A 23 ASN :FLIP amide:sc= -6.2! C(o=-12!,f=-6.2!) USER MOD Single : A 24 ASN : amide:sc= -0.646 K(o=-0.65,f=-3.5!) USER MOD Single : A 26 LYS NZ :NH3+ -137:sc= 0.215 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot -58:sc= 0.0457 USER MOD Single : A 41 GLN : amide:sc= -1.26 K(o=-1.3,f=-3.2!) USER MOD Single : A 42 MET CE :methyl -123:sc= -6.07! (180deg=-8.28!) USER MOD Single : A 55 ASN : amide:sc= -4.39! C(o=-4.4!,f=-12!) USER MOD Single : A 65 THR OG1 : rot 12:sc= -0.945! USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 87:sc= -0.606! USER MOD Single : A 105 GLN : amide:sc= -0.821 K(o=-0.82,f=-2.3!) USER MOD Single : A 106 LYS NZ :NH3+ 144:sc= 0.00825 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 63:sc= 0.818 USER MOD Single : A 120 ASN : amide:sc= -0.0922 K(o=-0.092,f=-0.9) USER MOD Single : A 135 SER OG : rot 180:sc= -0.406 USER MOD Single : A 138 THR OG1 : rot 180:sc= -0.83 USER MOD Single : A 141 GLN : amide:sc=-0.00092 K(o=-0.00092,f=-2.2) USER MOD Single : A 146 THR OG1 : rot 36:sc= 0.562 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 TYR OH : rot -15:sc= -0.065 USER MOD Single : A 155 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0266) USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 164 HIS : no HD1:sc= -4.48! C(o=-4.5!,f=-4.5!) USER MOD ----------------------------------------------------------------- ATOM 61 N MET A 6 3.949 8.663 -2.450 1.00 0.00 N ATOM 62 CA MET A 6 4.428 9.132 -3.746 1.00 0.00 C ATOM 63 C MET A 6 3.276 9.288 -4.731 1.00 0.00 C ATOM 64 O MET A 6 2.442 8.395 -4.867 1.00 0.00 O ATOM 65 CB MET A 6 5.454 8.151 -4.306 1.00 0.00 C ATOM 66 CG MET A 6 6.508 7.734 -3.292 1.00 0.00 C ATOM 67 SD MET A 6 7.064 6.034 -3.522 1.00 0.00 S ATOM 68 CE MET A 6 5.698 5.123 -2.804 1.00 0.00 C ATOM 0 HA MET A 6 4.894 10.107 -3.604 1.00 0.00 H new ATOM 0 HB2 MET A 6 4.936 7.262 -4.667 1.00 0.00 H new ATOM 0 HB3 MET A 6 5.947 8.604 -5.166 1.00 0.00 H new ATOM 0 HG2 MET A 6 7.364 8.405 -3.367 1.00 0.00 H new ATOM 0 HG3 MET A 6 6.103 7.846 -2.286 1.00 0.00 H new ATOM 0 HE1 MET A 6 5.921 4.056 -2.824 1.00 0.00 H new ATOM 0 HE2 MET A 6 5.549 5.443 -1.773 1.00 0.00 H new ATOM 0 HE3 MET A 6 4.791 5.315 -3.378 1.00 0.00 H new ATOM 78 N ASP A 7 3.233 10.426 -5.418 1.00 0.00 N ATOM 79 CA ASP A 7 2.178 10.684 -6.389 1.00 0.00 C ATOM 80 C ASP A 7 2.345 9.831 -7.640 1.00 0.00 C ATOM 81 O ASP A 7 1.384 9.588 -8.368 1.00 0.00 O ATOM 82 CB ASP A 7 2.130 12.167 -6.763 1.00 0.00 C ATOM 83 CG ASP A 7 3.491 12.720 -7.136 1.00 0.00 C ATOM 84 OD1 ASP A 7 4.274 13.044 -6.217 1.00 0.00 O ATOM 85 OD2 ASP A 7 3.773 12.835 -8.347 1.00 0.00 O ATOM 0 H ASP A 7 3.913 11.180 -5.320 1.00 0.00 H new ATOM 0 HA ASP A 7 1.233 10.411 -5.919 1.00 0.00 H new ATOM 0 HB2 ASP A 7 1.445 12.305 -7.599 1.00 0.00 H new ATOM 0 HB3 ASP A 7 1.728 12.736 -5.925 1.00 0.00 H new ATOM 196 N ARG A 15 -1.544 -1.262 -7.948 1.00 0.00 N ATOM 197 CA ARG A 15 -2.345 -0.052 -8.081 1.00 0.00 C ATOM 198 C ARG A 15 -3.790 -0.284 -7.628 1.00 0.00 C ATOM 199 O ARG A 15 -4.540 -1.031 -8.257 1.00 0.00 O ATOM 200 CB ARG A 15 -2.314 0.409 -9.539 1.00 0.00 C ATOM 201 CG ARG A 15 -2.793 1.833 -9.731 1.00 0.00 C ATOM 202 CD ARG A 15 -2.025 2.549 -10.832 1.00 0.00 C ATOM 203 NE ARG A 15 -2.566 2.244 -12.152 1.00 0.00 N ATOM 204 CZ ARG A 15 -2.723 3.142 -13.121 1.00 0.00 C ATOM 205 NH1 ARG A 15 -2.358 4.407 -12.937 1.00 0.00 N ATOM 206 NH2 ARG A 15 -3.245 2.776 -14.281 1.00 0.00 N ATOM 0 HA ARG A 15 -1.922 0.720 -7.438 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -1.296 0.322 -9.918 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -2.935 -0.259 -10.137 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -3.856 1.828 -9.974 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -2.682 2.382 -8.796 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -2.064 3.625 -10.662 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -0.975 2.258 -10.792 1.00 0.00 H new ATOM 0 HE ARG A 15 -2.841 1.281 -12.344 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -1.953 4.697 -12.047 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -2.483 5.088 -13.686 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -3.526 1.807 -14.431 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -3.366 3.463 -15.025 1.00 0.00 H new ATOM 220 N ASN A 16 -4.171 0.381 -6.536 1.00 0.00 N ATOM 221 CA ASN A 16 -5.523 0.281 -5.984 1.00 0.00 C ATOM 222 C ASN A 16 -6.047 1.676 -5.625 1.00 0.00 C ATOM 223 O ASN A 16 -5.305 2.653 -5.692 1.00 0.00 O ATOM 224 CB ASN A 16 -5.542 -0.628 -4.752 1.00 0.00 C ATOM 225 CG ASN A 16 -4.540 -0.218 -3.704 1.00 0.00 C ATOM 226 OD1 ASN A 16 -4.919 0.106 -2.582 1.00 0.00 O ATOM 227 ND2 ASN A 16 -3.259 -0.261 -4.051 1.00 0.00 N ATOM 0 H ASN A 16 -3.554 1.001 -6.011 1.00 0.00 H new ATOM 0 HA ASN A 16 -6.174 -0.159 -6.740 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -6.541 -0.619 -4.316 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -5.338 -1.653 -5.060 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -2.538 -0.018 -3.371 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -2.996 -0.537 -4.997 1.00 0.00 H new ATOM 234 N VAL A 17 -7.312 1.777 -5.236 1.00 0.00 N ATOM 235 CA VAL A 17 -7.879 3.073 -4.869 1.00 0.00 C ATOM 236 C VAL A 17 -8.632 3.009 -3.561 1.00 0.00 C ATOM 237 O VAL A 17 -9.062 1.943 -3.131 1.00 0.00 O ATOM 238 CB VAL A 17 -8.851 3.630 -5.924 1.00 0.00 C ATOM 239 CG1 VAL A 17 -8.162 3.829 -7.241 1.00 0.00 C ATOM 240 CG2 VAL A 17 -10.065 2.741 -6.092 1.00 0.00 C ATOM 0 H VAL A 17 -7.958 0.991 -5.166 1.00 0.00 H new ATOM 0 HA VAL A 17 -7.015 3.733 -4.787 1.00 0.00 H new ATOM 0 HB VAL A 17 -9.195 4.600 -5.563 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -8.873 4.223 -7.967 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -7.340 4.534 -7.119 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -7.772 2.875 -7.596 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -10.727 3.168 -6.845 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -9.747 1.748 -6.409 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -10.596 2.666 -5.143 1.00 0.00 H new ATOM 250 N GLY A 18 -8.819 4.176 -2.963 1.00 0.00 N ATOM 251 CA GLY A 18 -9.553 4.278 -1.725 1.00 0.00 C ATOM 252 C GLY A 18 -10.663 5.301 -1.828 1.00 0.00 C ATOM 253 O GLY A 18 -10.540 6.280 -2.563 1.00 0.00 O ATOM 0 H GLY A 18 -8.469 5.064 -3.322 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -9.974 3.306 -1.468 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.874 4.555 -0.919 1.00 0.00 H new ATOM 257 N ILE A 19 -11.754 5.072 -1.111 1.00 0.00 N ATOM 258 CA ILE A 19 -12.888 5.985 -1.162 1.00 0.00 C ATOM 259 C ILE A 19 -13.256 6.538 0.209 1.00 0.00 C ATOM 260 O ILE A 19 -13.672 5.802 1.103 1.00 0.00 O ATOM 261 CB ILE A 19 -14.127 5.303 -1.773 1.00 0.00 C ATOM 262 CG1 ILE A 19 -13.741 4.537 -3.033 1.00 0.00 C ATOM 263 CG2 ILE A 19 -15.197 6.331 -2.087 1.00 0.00 C ATOM 264 CD1 ILE A 19 -13.583 3.049 -2.816 1.00 0.00 C ATOM 0 H ILE A 19 -11.878 4.270 -0.493 1.00 0.00 H new ATOM 0 HA ILE A 19 -12.574 6.815 -1.795 1.00 0.00 H new ATOM 0 HB ILE A 19 -14.529 4.598 -1.046 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -14.500 4.705 -3.797 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -12.805 4.940 -3.420 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -16.065 5.832 -2.518 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -15.490 6.843 -1.170 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -14.806 7.058 -2.799 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -13.308 2.571 -3.756 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -12.803 2.870 -2.076 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -14.524 2.631 -2.459 1.00 0.00 H new ATOM 276 N CYS A 20 -13.134 7.854 0.349 1.00 0.00 N ATOM 277 CA CYS A 20 -13.489 8.530 1.585 1.00 0.00 C ATOM 278 C CYS A 20 -14.853 9.169 1.413 1.00 0.00 C ATOM 279 O CYS A 20 -14.993 10.222 0.797 1.00 0.00 O ATOM 280 CB CYS A 20 -12.449 9.581 1.945 1.00 0.00 C ATOM 281 SG CYS A 20 -12.818 10.512 3.450 1.00 0.00 S ATOM 0 H CYS A 20 -12.790 8.474 -0.384 1.00 0.00 H new ATOM 0 HA CYS A 20 -13.520 7.806 2.399 1.00 0.00 H new ATOM 0 HB2 CYS A 20 -11.482 9.092 2.063 1.00 0.00 H new ATOM 0 HB3 CYS A 20 -12.354 10.280 1.114 1.00 0.00 H new ATOM 0 HG CYS A 20 -12.631 9.751 4.488 1.00 0.00 H new ATOM 287 N LEU A 21 -15.860 8.492 1.929 1.00 0.00 N ATOM 288 CA LEU A 21 -17.233 8.942 1.807 1.00 0.00 C ATOM 289 C LEU A 21 -17.729 9.607 3.079 1.00 0.00 C ATOM 290 O LEU A 21 -17.823 8.978 4.130 1.00 0.00 O ATOM 291 CB LEU A 21 -18.099 7.741 1.457 1.00 0.00 C ATOM 292 CG LEU A 21 -19.605 7.958 1.501 1.00 0.00 C ATOM 293 CD1 LEU A 21 -20.067 8.777 0.307 1.00 0.00 C ATOM 294 CD2 LEU A 21 -20.293 6.608 1.530 1.00 0.00 C ATOM 0 H LEU A 21 -15.751 7.618 2.443 1.00 0.00 H new ATOM 0 HA LEU A 21 -17.291 9.694 1.021 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -17.831 7.407 0.455 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -17.850 6.929 2.141 1.00 0.00 H new ATOM 0 HG LEU A 21 -19.866 8.517 2.400 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -21.146 8.920 0.359 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -19.572 9.748 0.318 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -19.815 8.252 -0.614 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -21.373 6.751 1.562 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -20.027 6.045 0.635 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -19.974 6.056 2.414 1.00 0.00 H new ATOM 306 N MET A 22 -18.058 10.887 2.963 1.00 0.00 N ATOM 307 CA MET A 22 -18.561 11.644 4.096 1.00 0.00 C ATOM 308 C MET A 22 -19.956 12.180 3.811 1.00 0.00 C ATOM 309 O MET A 22 -20.366 12.285 2.655 1.00 0.00 O ATOM 310 CB MET A 22 -17.630 12.806 4.452 1.00 0.00 C ATOM 311 CG MET A 22 -16.914 13.417 3.260 1.00 0.00 C ATOM 312 SD MET A 22 -15.927 14.852 3.715 1.00 0.00 S ATOM 313 CE MET A 22 -16.769 16.141 2.804 1.00 0.00 C ATOM 0 H MET A 22 -17.985 11.420 2.096 1.00 0.00 H new ATOM 0 HA MET A 22 -18.604 10.962 4.945 1.00 0.00 H new ATOM 0 HB2 MET A 22 -18.210 13.583 4.950 1.00 0.00 H new ATOM 0 HB3 MET A 22 -16.886 12.455 5.168 1.00 0.00 H new ATOM 0 HG2 MET A 22 -16.270 12.666 2.803 1.00 0.00 H new ATOM 0 HG3 MET A 22 -17.648 13.708 2.508 1.00 0.00 H new ATOM 0 HE1 MET A 22 -16.036 16.753 2.278 1.00 0.00 H new ATOM 0 HE2 MET A 22 -17.451 15.691 2.083 1.00 0.00 H new ATOM 0 HE3 MET A 22 -17.334 16.766 3.496 1.00 0.00 H new ATOM 323 N ASN A 23 -20.678 12.522 4.870 1.00 0.00 N ATOM 324 CA ASN A 23 -22.027 13.050 4.727 1.00 0.00 C ATOM 325 C ASN A 23 -22.011 14.566 4.786 1.00 0.00 C ATOM 326 O ASN A 23 -20.986 15.182 5.080 1.00 0.00 O ATOM 327 CB ASN A 23 -22.950 12.545 5.840 1.00 0.00 C ATOM 328 CG ASN A 23 -22.529 11.216 6.414 1.00 0.00 C ATOM 329 OD1 ASN A 23 -21.482 11.242 7.224 1.00 0.00 O flip ATOM 330 ND2 ASN A 23 -23.146 10.187 6.144 1.00 0.00 N flip ATOM 0 H ASN A 23 -20.353 12.443 5.834 1.00 0.00 H new ATOM 0 HA ASN A 23 -22.401 12.707 3.762 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -22.979 13.284 6.640 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -23.964 12.458 5.449 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -23.947 10.223 5.513 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -22.857 9.297 6.551 1.00 0.00 H new ATOM 337 N ASN A 24 -23.172 15.157 4.547 1.00 0.00 N ATOM 338 CA ASN A 24 -23.328 16.602 4.616 1.00 0.00 C ATOM 339 C ASN A 24 -22.932 17.139 5.999 1.00 0.00 C ATOM 340 O ASN A 24 -22.921 18.348 6.219 1.00 0.00 O ATOM 341 CB ASN A 24 -24.774 16.995 4.307 1.00 0.00 C ATOM 342 CG ASN A 24 -25.136 16.777 2.852 1.00 0.00 C ATOM 343 OD1 ASN A 24 -24.643 15.848 2.211 1.00 0.00 O ATOM 344 ND2 ASN A 24 -25.998 17.636 2.321 1.00 0.00 N ATOM 0 H ASN A 24 -24.025 14.654 4.302 1.00 0.00 H new ATOM 0 HA ASN A 24 -22.665 17.044 3.872 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -25.448 16.414 4.937 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -24.925 18.044 4.562 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -26.277 17.541 1.344 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -26.381 18.391 2.890 1.00 0.00 H new ATOM 351 N ASP A 25 -22.631 16.234 6.935 1.00 0.00 N ATOM 352 CA ASP A 25 -22.267 16.620 8.295 1.00 0.00 C ATOM 353 C ASP A 25 -20.762 16.607 8.508 1.00 0.00 C ATOM 354 O ASP A 25 -20.284 16.817 9.621 1.00 0.00 O ATOM 355 CB ASP A 25 -22.905 15.658 9.282 1.00 0.00 C ATOM 356 CG ASP A 25 -24.276 16.116 9.744 1.00 0.00 C ATOM 357 OD1 ASP A 25 -25.162 16.302 8.883 1.00 0.00 O ATOM 358 OD2 ASP A 25 -24.462 16.287 10.967 1.00 0.00 O ATOM 0 H ASP A 25 -22.633 15.227 6.772 1.00 0.00 H new ATOM 0 HA ASP A 25 -22.627 17.637 8.454 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -22.992 14.675 8.820 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -22.253 15.547 10.148 1.00 0.00 H new ATOM 363 N LYS A 26 -20.028 16.330 7.448 1.00 0.00 N ATOM 364 CA LYS A 26 -18.575 16.256 7.511 1.00 0.00 C ATOM 365 C LYS A 26 -18.140 14.979 8.217 1.00 0.00 C ATOM 366 O LYS A 26 -17.001 14.866 8.665 1.00 0.00 O ATOM 367 CB LYS A 26 -17.981 17.479 8.222 1.00 0.00 C ATOM 368 CG LYS A 26 -17.753 18.673 7.310 1.00 0.00 C ATOM 369 CD LYS A 26 -16.674 18.385 6.278 1.00 0.00 C ATOM 370 CE LYS A 26 -17.087 18.857 4.894 1.00 0.00 C ATOM 371 NZ LYS A 26 -16.904 20.326 4.730 1.00 0.00 N ATOM 0 H LYS A 26 -20.416 16.150 6.522 1.00 0.00 H new ATOM 0 HA LYS A 26 -18.199 16.245 6.488 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -18.648 17.775 9.032 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -17.032 17.196 8.678 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -18.684 18.929 6.804 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -17.466 19.539 7.907 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -15.748 18.879 6.571 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -16.470 17.315 6.253 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -16.499 18.332 4.141 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -18.132 18.600 4.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -17.730 20.726 4.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -16.807 20.770 5.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -16.047 20.509 4.170 1.00 0.00 H new ATOM 385 N LYS A 27 -19.047 14.009 8.297 1.00 0.00 N ATOM 386 CA LYS A 27 -18.734 12.741 8.930 1.00 0.00 C ATOM 387 C LYS A 27 -18.331 11.746 7.854 1.00 0.00 C ATOM 388 O LYS A 27 -18.880 11.755 6.756 1.00 0.00 O ATOM 389 CB LYS A 27 -19.930 12.217 9.738 1.00 0.00 C ATOM 390 CG LYS A 27 -20.535 13.246 10.674 1.00 0.00 C ATOM 391 CD LYS A 27 -20.774 12.670 12.058 1.00 0.00 C ATOM 392 CE LYS A 27 -20.411 13.672 13.138 1.00 0.00 C ATOM 393 NZ LYS A 27 -21.161 13.429 14.401 1.00 0.00 N ATOM 0 H LYS A 27 -19.997 14.080 7.933 1.00 0.00 H new ATOM 0 HA LYS A 27 -17.909 12.879 9.629 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -20.699 11.871 9.048 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -19.612 11.352 10.320 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -19.871 14.107 10.747 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -21.478 13.605 10.261 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -21.821 12.384 12.160 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -20.182 11.764 12.185 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -19.341 13.619 13.336 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -20.619 14.681 12.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -20.883 14.136 15.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -22.182 13.505 14.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -20.943 12.476 14.756 1.00 0.00 H new ATOM 407 N ILE A 28 -17.350 10.915 8.167 1.00 0.00 N ATOM 408 CA ILE A 28 -16.846 9.936 7.214 1.00 0.00 C ATOM 409 C ILE A 28 -17.400 8.548 7.476 1.00 0.00 C ATOM 410 O ILE A 28 -17.601 8.139 8.621 1.00 0.00 O ATOM 411 CB ILE A 28 -15.306 9.854 7.227 1.00 0.00 C ATOM 412 CG1 ILE A 28 -14.690 11.249 7.103 1.00 0.00 C ATOM 413 CG2 ILE A 28 -14.805 8.951 6.106 1.00 0.00 C ATOM 414 CD1 ILE A 28 -14.799 12.075 8.361 1.00 0.00 C ATOM 0 H ILE A 28 -16.885 10.898 9.075 1.00 0.00 H new ATOM 0 HA ILE A 28 -17.182 10.282 6.237 1.00 0.00 H new ATOM 0 HB ILE A 28 -14.997 9.424 8.180 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -13.638 11.149 6.835 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -15.178 11.781 6.286 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -13.716 8.907 6.133 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -15.212 7.948 6.237 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -15.128 9.351 5.145 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -14.341 13.050 8.197 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -15.850 12.207 8.620 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -14.286 11.566 9.176 1.00 0.00 H new ATOM 426 N PHE A 29 -17.632 7.827 6.395 1.00 0.00 N ATOM 427 CA PHE A 29 -18.147 6.472 6.464 1.00 0.00 C ATOM 428 C PHE A 29 -17.059 5.495 6.897 1.00 0.00 C ATOM 429 O PHE A 29 -15.911 5.600 6.468 1.00 0.00 O ATOM 430 CB PHE A 29 -18.694 6.050 5.104 1.00 0.00 C ATOM 431 CG PHE A 29 -19.213 4.648 5.087 1.00 0.00 C ATOM 432 CD1 PHE A 29 -20.458 4.360 5.609 1.00 0.00 C ATOM 433 CD2 PHE A 29 -18.456 3.619 4.555 1.00 0.00 C ATOM 434 CE1 PHE A 29 -20.942 3.074 5.602 1.00 0.00 C ATOM 435 CE2 PHE A 29 -18.936 2.327 4.541 1.00 0.00 C ATOM 436 CZ PHE A 29 -20.183 2.053 5.065 1.00 0.00 C ATOM 0 H PHE A 29 -17.469 8.163 5.446 1.00 0.00 H new ATOM 0 HA PHE A 29 -18.948 6.453 7.203 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -19.495 6.731 4.815 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -17.907 6.148 4.357 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -21.058 5.154 6.028 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -17.479 3.830 4.146 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -21.916 2.862 6.017 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -18.338 1.532 4.121 1.00 0.00 H new ATOM 0 HZ PHE A 29 -20.564 1.043 5.055 1.00 0.00 H new ATOM 446 N ALA A 30 -17.433 4.540 7.740 1.00 0.00 N ATOM 447 CA ALA A 30 -16.497 3.535 8.223 1.00 0.00 C ATOM 448 C ALA A 30 -17.145 2.161 8.232 1.00 0.00 C ATOM 449 O ALA A 30 -18.362 2.035 8.368 1.00 0.00 O ATOM 450 CB ALA A 30 -16.011 3.868 9.625 1.00 0.00 C ATOM 0 H ALA A 30 -18.381 4.441 8.103 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.644 3.529 7.545 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -15.313 3.100 9.960 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -15.509 4.836 9.616 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -16.862 3.907 10.305 1.00 0.00 H new ATOM 456 N ALA A 31 -16.329 1.136 8.075 1.00 0.00 N ATOM 457 CA ALA A 31 -16.823 -0.227 8.058 1.00 0.00 C ATOM 458 C ALA A 31 -15.891 -1.163 8.815 1.00 0.00 C ATOM 459 O ALA A 31 -14.672 -1.096 8.667 1.00 0.00 O ATOM 460 CB ALA A 31 -16.994 -0.690 6.627 1.00 0.00 C ATOM 0 H ALA A 31 -15.319 1.222 7.957 1.00 0.00 H new ATOM 0 HA ALA A 31 -17.790 -0.249 8.560 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -17.365 -1.715 6.618 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -17.707 -0.041 6.117 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -16.033 -0.648 6.114 1.00 0.00 H new ATOM 466 N SER A 32 -16.471 -2.036 9.627 1.00 0.00 N ATOM 467 CA SER A 32 -15.683 -2.981 10.406 1.00 0.00 C ATOM 468 C SER A 32 -15.631 -4.342 9.720 1.00 0.00 C ATOM 469 O SER A 32 -16.627 -4.804 9.168 1.00 0.00 O ATOM 470 CB SER A 32 -16.262 -3.124 11.817 1.00 0.00 C ATOM 471 OG SER A 32 -17.563 -3.696 11.793 1.00 0.00 O ATOM 0 H SER A 32 -17.479 -2.110 9.763 1.00 0.00 H new ATOM 0 HA SER A 32 -14.667 -2.594 10.479 1.00 0.00 H new ATOM 0 HB2 SER A 32 -15.601 -3.746 12.421 1.00 0.00 H new ATOM 0 HB3 SER A 32 -16.303 -2.145 12.295 1.00 0.00 H new ATOM 0 HG SER A 32 -18.153 -3.143 11.239 1.00 0.00 H new ATOM 477 N ARG A 33 -14.467 -4.989 9.765 1.00 0.00 N ATOM 478 CA ARG A 33 -14.303 -6.299 9.150 1.00 0.00 C ATOM 479 C ARG A 33 -15.120 -7.346 9.887 1.00 0.00 C ATOM 480 O ARG A 33 -15.026 -7.476 11.110 1.00 0.00 O ATOM 481 CB ARG A 33 -12.828 -6.711 9.143 1.00 0.00 C ATOM 482 CG ARG A 33 -11.918 -5.720 8.430 1.00 0.00 C ATOM 483 CD ARG A 33 -10.676 -5.389 9.255 1.00 0.00 C ATOM 484 NE ARG A 33 -10.028 -4.158 8.808 1.00 0.00 N ATOM 485 CZ ARG A 33 -9.407 -4.024 7.638 1.00 0.00 C ATOM 486 NH1 ARG A 33 -9.374 -5.032 6.771 1.00 0.00 N ATOM 487 NH2 ARG A 33 -8.805 -2.882 7.339 1.00 0.00 N ATOM 0 H ARG A 33 -13.629 -4.627 10.220 1.00 0.00 H new ATOM 0 HA ARG A 33 -14.659 -6.232 8.122 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -12.488 -6.827 10.172 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -12.735 -7.686 8.664 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -11.615 -6.133 7.468 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -12.471 -4.804 8.223 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -10.955 -5.291 10.304 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -9.968 -6.215 9.189 1.00 0.00 H new ATOM 0 HE ARG A 33 -10.053 -3.351 9.431 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -9.827 -5.917 7.000 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -8.896 -4.920 5.877 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -8.818 -2.109 8.004 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -8.328 -2.776 6.444 1.00 0.00 H new ATOM 501 N LEU A 34 -15.929 -8.087 9.142 1.00 0.00 N ATOM 502 CA LEU A 34 -16.770 -9.128 9.727 1.00 0.00 C ATOM 503 C LEU A 34 -15.965 -9.976 10.706 1.00 0.00 C ATOM 504 O LEU A 34 -16.474 -10.421 11.736 1.00 0.00 O ATOM 505 CB LEU A 34 -17.372 -10.010 8.636 1.00 0.00 C ATOM 506 CG LEU A 34 -18.557 -9.380 7.910 1.00 0.00 C ATOM 507 CD1 LEU A 34 -18.227 -9.122 6.449 1.00 0.00 C ATOM 508 CD2 LEU A 34 -19.803 -10.239 8.056 1.00 0.00 C ATOM 0 H LEU A 34 -16.022 -7.988 8.131 1.00 0.00 H new ATOM 0 HA LEU A 34 -17.583 -8.645 10.269 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -16.597 -10.248 7.907 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -17.691 -10.953 9.081 1.00 0.00 H new ATOM 0 HG LEU A 34 -18.765 -8.416 8.375 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -19.089 -8.673 5.955 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -17.376 -8.444 6.382 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -17.979 -10.064 5.960 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -20.633 -9.768 7.530 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -19.617 -11.225 7.631 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -20.053 -10.340 9.112 1.00 0.00 H new ATOM 520 N ASP A 35 -14.696 -10.172 10.375 1.00 0.00 N ATOM 521 CA ASP A 35 -13.783 -10.945 11.210 1.00 0.00 C ATOM 522 C ASP A 35 -13.441 -10.165 12.476 1.00 0.00 C ATOM 523 O ASP A 35 -13.328 -10.736 13.558 1.00 0.00 O ATOM 524 CB ASP A 35 -12.505 -11.272 10.431 1.00 0.00 C ATOM 525 CG ASP A 35 -12.048 -12.702 10.633 1.00 0.00 C ATOM 526 OD1 ASP A 35 -12.112 -13.190 11.779 1.00 0.00 O ATOM 527 OD2 ASP A 35 -11.625 -13.332 9.641 1.00 0.00 O ATOM 0 H ASP A 35 -14.271 -9.802 9.525 1.00 0.00 H new ATOM 0 HA ASP A 35 -14.271 -11.878 11.493 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -12.676 -11.096 9.369 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -11.711 -10.593 10.742 1.00 0.00 H new ATOM 532 N ILE A 36 -13.281 -8.852 12.325 1.00 0.00 N ATOM 533 CA ILE A 36 -12.956 -7.986 13.450 1.00 0.00 C ATOM 534 C ILE A 36 -13.965 -6.844 13.571 1.00 0.00 C ATOM 535 O ILE A 36 -13.981 -5.928 12.747 1.00 0.00 O ATOM 536 CB ILE A 36 -11.546 -7.391 13.310 1.00 0.00 C ATOM 537 CG1 ILE A 36 -10.525 -8.490 13.002 1.00 0.00 C ATOM 538 CG2 ILE A 36 -11.160 -6.640 14.577 1.00 0.00 C ATOM 539 CD1 ILE A 36 -10.412 -9.533 14.090 1.00 0.00 C ATOM 0 H ILE A 36 -13.372 -8.367 11.433 1.00 0.00 H new ATOM 0 HA ILE A 36 -12.995 -8.603 14.347 1.00 0.00 H new ATOM 0 HB ILE A 36 -11.549 -6.687 12.478 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -10.801 -8.980 12.068 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -9.548 -8.033 12.845 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -10.159 -6.224 14.463 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -11.871 -5.832 14.752 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -11.174 -7.325 15.425 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -9.671 -10.279 13.803 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -10.105 -9.056 15.021 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -11.378 -10.017 14.232 1.00 0.00 H new ATOM 551 N PRO A 37 -14.826 -6.880 14.604 1.00 0.00 N ATOM 552 CA PRO A 37 -15.841 -5.845 14.822 1.00 0.00 C ATOM 553 C PRO A 37 -15.252 -4.537 15.331 1.00 0.00 C ATOM 554 O PRO A 37 -15.895 -3.489 15.257 1.00 0.00 O ATOM 555 CB PRO A 37 -16.739 -6.453 15.894 1.00 0.00 C ATOM 556 CG PRO A 37 -15.854 -7.384 16.642 1.00 0.00 C ATOM 557 CD PRO A 37 -14.879 -7.931 15.635 1.00 0.00 C ATOM 0 HA PRO A 37 -16.353 -5.589 13.894 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -17.150 -5.685 16.549 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -17.584 -6.980 15.451 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -15.333 -6.865 17.447 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -16.431 -8.186 17.101 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -13.899 -8.108 16.079 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -15.218 -8.881 15.223 1.00 0.00 H new ATOM 565 N ASP A 38 -14.035 -4.598 15.863 1.00 0.00 N ATOM 566 CA ASP A 38 -13.375 -3.407 16.393 1.00 0.00 C ATOM 567 C ASP A 38 -12.506 -2.725 15.335 1.00 0.00 C ATOM 568 O ASP A 38 -12.056 -1.595 15.527 1.00 0.00 O ATOM 569 CB ASP A 38 -12.522 -3.770 17.608 1.00 0.00 C ATOM 570 CG ASP A 38 -11.624 -4.964 17.354 1.00 0.00 C ATOM 571 OD1 ASP A 38 -12.108 -6.107 17.490 1.00 0.00 O ATOM 572 OD2 ASP A 38 -10.436 -4.757 17.026 1.00 0.00 O ATOM 0 H ASP A 38 -13.487 -5.455 15.939 1.00 0.00 H new ATOM 0 HA ASP A 38 -14.154 -2.706 16.693 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -11.910 -2.912 17.887 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -13.174 -3.984 18.454 1.00 0.00 H new ATOM 577 N ALA A 39 -12.275 -3.417 14.221 1.00 0.00 N ATOM 578 CA ALA A 39 -11.462 -2.868 13.143 1.00 0.00 C ATOM 579 C ALA A 39 -12.331 -2.132 12.133 1.00 0.00 C ATOM 580 O ALA A 39 -13.025 -2.751 11.332 1.00 0.00 O ATOM 581 CB ALA A 39 -10.678 -3.976 12.456 1.00 0.00 C ATOM 0 H ALA A 39 -12.638 -4.354 14.044 1.00 0.00 H new ATOM 0 HA ALA A 39 -10.759 -2.155 13.574 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -10.075 -3.551 11.653 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -10.026 -4.463 13.181 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -11.371 -4.708 12.041 1.00 0.00 H new ATOM 587 N TRP A 40 -12.279 -0.804 12.179 1.00 0.00 N ATOM 588 CA TRP A 40 -13.055 0.035 11.269 1.00 0.00 C ATOM 589 C TRP A 40 -12.205 0.471 10.086 1.00 0.00 C ATOM 590 O TRP A 40 -10.983 0.546 10.184 1.00 0.00 O ATOM 591 CB TRP A 40 -13.613 1.244 12.016 1.00 0.00 C ATOM 592 CG TRP A 40 -14.781 0.883 12.881 1.00 0.00 C ATOM 593 CD1 TRP A 40 -14.764 0.429 14.171 1.00 0.00 C ATOM 594 CD2 TRP A 40 -16.151 0.934 12.499 1.00 0.00 C ATOM 595 NE1 TRP A 40 -16.049 0.200 14.608 1.00 0.00 N ATOM 596 CE2 TRP A 40 -16.919 0.508 13.597 1.00 0.00 C ATOM 597 CE3 TRP A 40 -16.789 1.306 11.331 1.00 0.00 C ATOM 598 CZ2 TRP A 40 -18.311 0.446 13.550 1.00 0.00 C ATOM 599 CZ3 TRP A 40 -18.161 1.244 11.279 1.00 0.00 C ATOM 600 CH2 TRP A 40 -18.915 0.819 12.383 1.00 0.00 C ATOM 0 H TRP A 40 -11.704 -0.282 12.841 1.00 0.00 H new ATOM 0 HA TRP A 40 -13.892 -0.547 10.883 1.00 0.00 H new ATOM 0 HB2 TRP A 40 -12.828 1.683 12.632 1.00 0.00 H new ATOM 0 HB3 TRP A 40 -13.917 2.005 11.297 1.00 0.00 H new ATOM 0 HD1 TRP A 40 -13.873 0.273 14.761 1.00 0.00 H new ATOM 0 HE1 TRP A 40 -16.310 -0.143 15.533 1.00 0.00 H new ATOM 0 HE3 TRP A 40 -16.220 1.639 10.475 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 -18.888 0.117 14.401 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 -18.669 1.528 10.369 1.00 0.00 H new ATOM 0 HH2 TRP A 40 -19.992 0.786 12.309 1.00 0.00 H new ATOM 611 N GLN A 41 -12.853 0.727 8.955 1.00 0.00 N ATOM 612 CA GLN A 41 -12.130 1.135 7.759 1.00 0.00 C ATOM 613 C GLN A 41 -13.026 1.871 6.778 1.00 0.00 C ATOM 614 O GLN A 41 -14.248 1.762 6.820 1.00 0.00 O ATOM 615 CB GLN A 41 -11.481 -0.066 7.052 1.00 0.00 C ATOM 616 CG GLN A 41 -11.692 -1.411 7.741 1.00 0.00 C ATOM 617 CD GLN A 41 -12.427 -2.409 6.867 1.00 0.00 C ATOM 618 OE1 GLN A 41 -13.457 -2.956 7.260 1.00 0.00 O ATOM 619 NE2 GLN A 41 -11.896 -2.650 5.675 1.00 0.00 N ATOM 0 H GLN A 41 -13.865 0.660 8.842 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.347 1.815 8.094 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -11.876 -0.128 6.038 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.410 0.117 6.966 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -10.724 -1.825 8.023 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -12.254 -1.258 8.662 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.040 -2.173 5.392 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -12.344 -3.313 5.042 1.00 0.00 H new ATOM 628 N MET A 42 -12.388 2.602 5.879 1.00 0.00 N ATOM 629 CA MET A 42 -13.086 3.356 4.852 1.00 0.00 C ATOM 630 C MET A 42 -13.067 2.559 3.546 1.00 0.00 C ATOM 631 O MET A 42 -12.182 1.729 3.337 1.00 0.00 O ATOM 632 CB MET A 42 -12.405 4.708 4.649 1.00 0.00 C ATOM 633 CG MET A 42 -12.995 5.842 5.470 1.00 0.00 C ATOM 634 SD MET A 42 -12.188 7.423 5.142 1.00 0.00 S ATOM 635 CE MET A 42 -10.460 6.957 5.245 1.00 0.00 C ATOM 0 H MET A 42 -11.372 2.689 5.841 1.00 0.00 H new ATOM 0 HA MET A 42 -14.118 3.526 5.159 1.00 0.00 H new ATOM 0 HB2 MET A 42 -11.348 4.609 4.897 1.00 0.00 H new ATOM 0 HB3 MET A 42 -12.461 4.974 3.593 1.00 0.00 H new ATOM 0 HG2 MET A 42 -14.059 5.929 5.252 1.00 0.00 H new ATOM 0 HG3 MET A 42 -12.905 5.604 6.530 1.00 0.00 H new ATOM 0 HE1 MET A 42 -9.963 7.567 5.999 1.00 0.00 H new ATOM 0 HE2 MET A 42 -10.383 5.905 5.520 1.00 0.00 H new ATOM 0 HE3 MET A 42 -9.982 7.115 4.278 1.00 0.00 H new ATOM 645 N PRO A 43 -14.038 2.792 2.651 1.00 0.00 N ATOM 646 CA PRO A 43 -14.110 2.079 1.372 1.00 0.00 C ATOM 647 C PRO A 43 -12.781 2.117 0.617 1.00 0.00 C ATOM 648 O PRO A 43 -12.051 3.106 0.673 1.00 0.00 O ATOM 649 CB PRO A 43 -15.195 2.834 0.602 1.00 0.00 C ATOM 650 CG PRO A 43 -16.045 3.464 1.654 1.00 0.00 C ATOM 651 CD PRO A 43 -15.136 3.758 2.815 1.00 0.00 C ATOM 0 HA PRO A 43 -14.330 1.020 1.504 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -14.761 3.585 -0.058 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -15.778 2.158 -0.024 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -16.509 4.378 1.283 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -16.852 2.795 1.953 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -14.773 4.785 2.789 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -15.648 3.625 3.768 1.00 0.00 H new ATOM 659 N GLN A 44 -12.469 1.033 -0.086 1.00 0.00 N ATOM 660 CA GLN A 44 -11.221 0.949 -0.839 1.00 0.00 C ATOM 661 C GLN A 44 -11.204 -0.284 -1.737 1.00 0.00 C ATOM 662 O GLN A 44 -11.679 -1.353 -1.351 1.00 0.00 O ATOM 663 CB GLN A 44 -10.023 0.900 0.125 1.00 0.00 C ATOM 664 CG GLN A 44 -8.784 1.615 -0.390 1.00 0.00 C ATOM 665 CD GLN A 44 -7.519 0.792 -0.249 1.00 0.00 C ATOM 666 OE1 GLN A 44 -7.311 -0.181 -0.973 1.00 0.00 O ATOM 667 NE2 GLN A 44 -6.659 1.186 0.683 1.00 0.00 N ATOM 0 H GLN A 44 -13.059 0.204 -0.151 1.00 0.00 H new ATOM 0 HA GLN A 44 -11.147 1.837 -1.467 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -10.317 1.344 1.076 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -9.772 -0.142 0.324 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -8.929 1.870 -1.440 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -8.662 2.553 0.152 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -6.871 1.999 1.262 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -5.786 0.676 0.820 1.00 0.00 H new ATOM 676 N GLY A 45 -10.647 -0.122 -2.934 1.00 0.00 N ATOM 677 CA GLY A 45 -10.558 -1.220 -3.880 1.00 0.00 C ATOM 678 C GLY A 45 -9.325 -1.099 -4.756 1.00 0.00 C ATOM 679 O GLY A 45 -8.493 -0.233 -4.517 1.00 0.00 O ATOM 0 H GLY A 45 -10.253 0.758 -3.267 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -10.531 -2.166 -3.340 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -11.450 -1.236 -4.506 1.00 0.00 H new ATOM 683 N GLY A 46 -9.193 -1.967 -5.756 1.00 0.00 N ATOM 684 CA GLY A 46 -8.025 -1.918 -6.624 1.00 0.00 C ATOM 685 C GLY A 46 -8.254 -1.135 -7.903 1.00 0.00 C ATOM 686 O GLY A 46 -9.109 -0.251 -7.960 1.00 0.00 O ATOM 0 H GLY A 46 -9.867 -2.699 -5.981 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -7.195 -1.471 -6.077 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -7.728 -2.936 -6.878 1.00 0.00 H new ATOM 690 N ILE A 47 -7.482 -1.475 -8.934 1.00 0.00 N ATOM 691 CA ILE A 47 -7.578 -0.819 -10.240 1.00 0.00 C ATOM 692 C ILE A 47 -6.901 -1.658 -11.316 1.00 0.00 C ATOM 693 O ILE A 47 -5.727 -2.006 -11.195 1.00 0.00 O ATOM 694 CB ILE A 47 -6.903 0.574 -10.278 1.00 0.00 C ATOM 695 CG1 ILE A 47 -6.962 1.296 -8.939 1.00 0.00 C ATOM 696 CG2 ILE A 47 -7.542 1.433 -11.349 1.00 0.00 C ATOM 697 CD1 ILE A 47 -5.980 2.446 -8.860 1.00 0.00 C ATOM 0 H ILE A 47 -6.775 -2.209 -8.890 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.647 -0.707 -10.422 1.00 0.00 H new ATOM 0 HB ILE A 47 -5.851 0.408 -10.509 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -7.972 1.672 -8.776 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -6.753 0.587 -8.138 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -7.060 2.410 -11.367 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -7.424 0.952 -12.320 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -8.603 1.556 -11.132 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -6.062 2.928 -7.886 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -4.966 2.069 -8.994 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -6.204 3.170 -9.643 1.00 0.00 H new ATOM 709 N ASP A 48 -7.641 -1.965 -12.375 1.00 0.00 N ATOM 710 CA ASP A 48 -7.104 -2.748 -13.483 1.00 0.00 C ATOM 711 C ASP A 48 -6.173 -1.901 -14.352 1.00 0.00 C ATOM 712 O ASP A 48 -6.056 -0.688 -14.159 1.00 0.00 O ATOM 713 CB ASP A 48 -8.233 -3.342 -14.329 1.00 0.00 C ATOM 714 CG ASP A 48 -9.457 -3.701 -13.506 1.00 0.00 C ATOM 715 OD1 ASP A 48 -9.396 -4.699 -12.753 1.00 0.00 O ATOM 716 OD2 ASP A 48 -10.474 -2.985 -13.608 1.00 0.00 O ATOM 0 H ASP A 48 -8.615 -1.684 -12.490 1.00 0.00 H new ATOM 0 HA ASP A 48 -6.524 -3.568 -13.061 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -8.517 -2.627 -15.102 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -7.869 -4.234 -14.838 1.00 0.00 H new ATOM 721 N GLU A 49 -5.503 -2.552 -15.301 1.00 0.00 N ATOM 722 CA GLU A 49 -4.564 -1.872 -16.200 1.00 0.00 C ATOM 723 C GLU A 49 -5.163 -0.585 -16.772 1.00 0.00 C ATOM 724 O GLU A 49 -4.820 0.514 -16.334 1.00 0.00 O ATOM 725 CB GLU A 49 -4.118 -2.803 -17.341 1.00 0.00 C ATOM 726 CG GLU A 49 -5.177 -3.797 -17.798 1.00 0.00 C ATOM 727 CD GLU A 49 -4.838 -4.435 -19.134 1.00 0.00 C ATOM 728 OE1 GLU A 49 -3.721 -4.980 -19.265 1.00 0.00 O ATOM 729 OE2 GLU A 49 -5.687 -4.387 -20.049 1.00 0.00 O ATOM 0 H GLU A 49 -5.592 -3.554 -15.470 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.689 -1.604 -15.607 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -3.818 -2.194 -18.194 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -3.235 -3.355 -17.018 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -5.288 -4.577 -17.044 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -6.138 -3.289 -17.875 1.00 0.00 H new ATOM 736 N GLY A 50 -6.054 -0.728 -17.751 1.00 0.00 N ATOM 737 CA GLY A 50 -6.682 0.428 -18.367 1.00 0.00 C ATOM 738 C GLY A 50 -7.902 0.915 -17.606 1.00 0.00 C ATOM 739 O GLY A 50 -8.864 1.400 -18.205 1.00 0.00 O ATOM 0 H GLY A 50 -6.352 -1.627 -18.129 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -5.955 1.237 -18.434 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -6.973 0.176 -19.387 1.00 0.00 H new ATOM 743 N GLU A 51 -7.858 0.798 -16.285 1.00 0.00 N ATOM 744 CA GLU A 51 -8.956 1.242 -15.440 1.00 0.00 C ATOM 745 C GLU A 51 -8.512 2.427 -14.595 1.00 0.00 C ATOM 746 O GLU A 51 -7.526 2.334 -13.867 1.00 0.00 O ATOM 747 CB GLU A 51 -9.425 0.102 -14.529 1.00 0.00 C ATOM 748 CG GLU A 51 -10.832 0.286 -13.985 1.00 0.00 C ATOM 749 CD GLU A 51 -10.839 0.774 -12.560 1.00 0.00 C ATOM 750 OE1 GLU A 51 -10.040 0.255 -11.755 1.00 0.00 O ATOM 751 OE2 GLU A 51 -11.646 1.675 -12.249 1.00 0.00 O ATOM 0 H GLU A 51 -7.070 0.398 -15.775 1.00 0.00 H new ATOM 0 HA GLU A 51 -9.786 1.545 -16.078 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -9.381 -0.835 -15.084 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -8.732 0.010 -13.693 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -11.371 0.997 -14.612 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -11.368 -0.661 -14.044 1.00 0.00 H new ATOM 758 N ASP A 52 -9.228 3.539 -14.689 1.00 0.00 N ATOM 759 CA ASP A 52 -8.873 4.717 -13.912 1.00 0.00 C ATOM 760 C ASP A 52 -9.173 4.474 -12.436 1.00 0.00 C ATOM 761 O ASP A 52 -9.959 3.589 -12.093 1.00 0.00 O ATOM 762 CB ASP A 52 -9.605 5.960 -14.430 1.00 0.00 C ATOM 763 CG ASP A 52 -8.840 6.659 -15.542 1.00 0.00 C ATOM 764 OD1 ASP A 52 -8.228 5.953 -16.372 1.00 0.00 O ATOM 765 OD2 ASP A 52 -8.851 7.908 -15.586 1.00 0.00 O ATOM 0 H ASP A 52 -10.047 3.650 -15.287 1.00 0.00 H new ATOM 0 HA ASP A 52 -7.804 4.901 -14.023 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -10.591 5.672 -14.796 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -9.761 6.656 -13.606 1.00 0.00 H new ATOM 770 N PRO A 53 -8.529 5.237 -11.536 1.00 0.00 N ATOM 771 CA PRO A 53 -8.705 5.080 -10.086 1.00 0.00 C ATOM 772 C PRO A 53 -10.038 5.618 -9.574 1.00 0.00 C ATOM 773 O PRO A 53 -10.758 4.935 -8.847 1.00 0.00 O ATOM 774 CB PRO A 53 -7.539 5.891 -9.492 1.00 0.00 C ATOM 775 CG PRO A 53 -6.671 6.282 -10.642 1.00 0.00 C ATOM 776 CD PRO A 53 -7.556 6.289 -11.849 1.00 0.00 C ATOM 0 HA PRO A 53 -8.709 4.028 -9.802 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -7.907 6.772 -8.965 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -6.981 5.297 -8.768 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -6.227 7.264 -10.479 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -5.849 5.578 -10.766 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -8.037 7.256 -11.994 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -7.000 6.070 -12.761 1.00 0.00 H new ATOM 784 N ARG A 54 -10.350 6.845 -9.955 1.00 0.00 N ATOM 785 CA ARG A 54 -11.594 7.493 -9.536 1.00 0.00 C ATOM 786 C ARG A 54 -12.795 6.587 -9.771 1.00 0.00 C ATOM 787 O ARG A 54 -13.657 6.449 -8.905 1.00 0.00 O ATOM 788 CB ARG A 54 -11.783 8.798 -10.311 1.00 0.00 C ATOM 789 CG ARG A 54 -12.341 9.941 -9.477 1.00 0.00 C ATOM 790 CD ARG A 54 -13.752 9.661 -8.989 1.00 0.00 C ATOM 791 NE ARG A 54 -14.764 10.233 -9.873 1.00 0.00 N ATOM 792 CZ ARG A 54 -14.938 11.540 -10.060 1.00 0.00 C ATOM 793 NH1 ARG A 54 -14.143 12.420 -9.459 1.00 0.00 N ATOM 794 NH2 ARG A 54 -15.905 11.970 -10.859 1.00 0.00 N ATOM 0 H ARG A 54 -9.760 7.420 -10.557 1.00 0.00 H new ATOM 0 HA ARG A 54 -11.524 7.701 -8.468 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -10.823 9.102 -10.729 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -12.453 8.615 -11.151 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -11.690 10.115 -8.620 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -12.338 10.856 -10.070 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -13.903 8.584 -8.916 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -13.876 10.069 -7.986 1.00 0.00 H new ATOM 0 HE ARG A 54 -15.375 9.592 -10.378 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -13.393 12.096 -8.849 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -14.284 13.419 -9.608 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -16.514 11.300 -11.329 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -16.040 12.971 -11.004 1.00 0.00 H new ATOM 808 N ASN A 55 -12.845 5.970 -10.939 1.00 0.00 N ATOM 809 CA ASN A 55 -13.957 5.073 -11.267 1.00 0.00 C ATOM 810 C ASN A 55 -13.909 3.836 -10.396 1.00 0.00 C ATOM 811 O ASN A 55 -14.927 3.396 -9.861 1.00 0.00 O ATOM 812 CB ASN A 55 -13.956 4.648 -12.740 1.00 0.00 C ATOM 813 CG ASN A 55 -12.768 5.164 -13.525 1.00 0.00 C ATOM 814 OD1 ASN A 55 -11.866 4.405 -13.876 1.00 0.00 O ATOM 815 ND2 ASN A 55 -12.768 6.463 -13.802 1.00 0.00 N ATOM 0 H ASN A 55 -12.142 6.067 -11.672 1.00 0.00 H new ATOM 0 HA ASN A 55 -14.874 5.632 -11.080 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -13.970 3.559 -12.794 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -14.873 5.003 -13.211 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -11.996 6.872 -14.328 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -13.540 7.051 -13.489 1.00 0.00 H new ATOM 822 N ALA A 56 -12.717 3.278 -10.256 1.00 0.00 N ATOM 823 CA ALA A 56 -12.535 2.087 -9.448 1.00 0.00 C ATOM 824 C ALA A 56 -12.984 2.361 -8.026 1.00 0.00 C ATOM 825 O ALA A 56 -13.659 1.539 -7.407 1.00 0.00 O ATOM 826 CB ALA A 56 -11.083 1.634 -9.494 1.00 0.00 C ATOM 0 H ALA A 56 -11.864 3.631 -10.691 1.00 0.00 H new ATOM 0 HA ALA A 56 -13.146 1.279 -9.850 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -10.961 0.739 -8.883 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -10.804 1.411 -10.524 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -10.442 2.427 -9.108 1.00 0.00 H new ATOM 832 N ALA A 57 -12.636 3.538 -7.520 1.00 0.00 N ATOM 833 CA ALA A 57 -13.045 3.927 -6.179 1.00 0.00 C ATOM 834 C ALA A 57 -14.564 3.886 -6.075 1.00 0.00 C ATOM 835 O ALA A 57 -15.127 3.186 -5.233 1.00 0.00 O ATOM 836 CB ALA A 57 -12.522 5.315 -5.842 1.00 0.00 C ATOM 0 H ALA A 57 -12.076 4.233 -8.014 1.00 0.00 H new ATOM 0 HA ALA A 57 -12.622 3.224 -5.461 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -12.838 5.588 -4.835 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -11.433 5.316 -5.893 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -12.919 6.037 -6.556 1.00 0.00 H new ATOM 842 N ILE A 58 -15.216 4.637 -6.956 1.00 0.00 N ATOM 843 CA ILE A 58 -16.670 4.695 -6.990 1.00 0.00 C ATOM 844 C ILE A 58 -17.275 3.304 -7.110 1.00 0.00 C ATOM 845 O ILE A 58 -18.130 2.916 -6.315 1.00 0.00 O ATOM 846 CB ILE A 58 -17.184 5.542 -8.173 1.00 0.00 C ATOM 847 CG1 ILE A 58 -16.532 6.919 -8.185 1.00 0.00 C ATOM 848 CG2 ILE A 58 -18.693 5.690 -8.098 1.00 0.00 C ATOM 849 CD1 ILE A 58 -16.603 7.603 -9.531 1.00 0.00 C ATOM 0 H ILE A 58 -14.756 5.216 -7.659 1.00 0.00 H new ATOM 0 HA ILE A 58 -16.976 5.157 -6.052 1.00 0.00 H new ATOM 0 HB ILE A 58 -16.918 5.026 -9.095 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -17.016 7.549 -7.439 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -15.487 6.821 -7.890 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -19.042 6.290 -8.939 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -19.158 4.705 -8.137 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -18.964 6.182 -7.164 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -16.120 8.578 -9.469 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -16.094 6.993 -10.277 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -17.646 7.732 -9.819 1.00 0.00 H new ATOM 861 N ARG A 59 -16.833 2.563 -8.121 1.00 0.00 N ATOM 862 CA ARG A 59 -17.342 1.223 -8.356 1.00 0.00 C ATOM 863 C ARG A 59 -17.033 0.314 -7.179 1.00 0.00 C ATOM 864 O ARG A 59 -17.947 -0.209 -6.540 1.00 0.00 O ATOM 865 CB ARG A 59 -16.766 0.664 -9.657 1.00 0.00 C ATOM 866 CG ARG A 59 -17.589 1.036 -10.884 1.00 0.00 C ATOM 867 CD ARG A 59 -18.529 -0.089 -11.295 1.00 0.00 C ATOM 868 NE ARG A 59 -19.797 0.414 -11.831 1.00 0.00 N ATOM 869 CZ ARG A 59 -20.724 1.027 -11.096 1.00 0.00 C ATOM 870 NH1 ARG A 59 -20.544 1.192 -9.793 1.00 0.00 N ATOM 871 NH2 ARG A 59 -21.842 1.463 -11.662 1.00 0.00 N ATOM 0 H ARG A 59 -16.125 2.870 -8.788 1.00 0.00 H new ATOM 0 HA ARG A 59 -18.426 1.271 -8.456 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -15.748 1.032 -9.784 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -16.705 -0.422 -9.583 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -18.168 1.935 -10.675 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -16.921 1.273 -11.712 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -18.041 -0.711 -12.045 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -18.728 -0.726 -10.433 1.00 0.00 H new ATOM 0 HE ARG A 59 -19.981 0.287 -12.826 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -19.693 0.849 -9.348 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -21.257 1.662 -9.235 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -21.993 1.329 -12.662 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -22.550 1.932 -11.097 1.00 0.00 H new ATOM 885 N GLU A 60 -15.748 0.142 -6.874 1.00 0.00 N ATOM 886 CA GLU A 60 -15.346 -0.686 -5.743 1.00 0.00 C ATOM 887 C GLU A 60 -16.196 -0.336 -4.530 1.00 0.00 C ATOM 888 O GLU A 60 -16.776 -1.208 -3.885 1.00 0.00 O ATOM 889 CB GLU A 60 -13.865 -0.474 -5.425 1.00 0.00 C ATOM 890 CG GLU A 60 -12.932 -1.131 -6.430 1.00 0.00 C ATOM 891 CD GLU A 60 -12.873 -2.639 -6.274 1.00 0.00 C ATOM 892 OE1 GLU A 60 -12.088 -3.119 -5.431 1.00 0.00 O ATOM 893 OE2 GLU A 60 -13.611 -3.339 -6.999 1.00 0.00 O ATOM 0 H GLU A 60 -14.975 0.562 -7.390 1.00 0.00 H new ATOM 0 HA GLU A 60 -15.496 -1.735 -6.000 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -13.657 0.596 -5.393 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -13.654 -0.870 -4.432 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -13.262 -0.887 -7.440 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -11.930 -0.718 -6.313 1.00 0.00 H new ATOM 900 N LEU A 61 -16.281 0.962 -4.245 1.00 0.00 N ATOM 901 CA LEU A 61 -17.078 1.454 -3.127 1.00 0.00 C ATOM 902 C LEU A 61 -18.480 0.853 -3.170 1.00 0.00 C ATOM 903 O LEU A 61 -19.013 0.414 -2.153 1.00 0.00 O ATOM 904 CB LEU A 61 -17.159 2.987 -3.165 1.00 0.00 C ATOM 905 CG LEU A 61 -18.325 3.602 -2.383 1.00 0.00 C ATOM 906 CD1 LEU A 61 -18.270 3.186 -0.922 1.00 0.00 C ATOM 907 CD2 LEU A 61 -18.313 5.119 -2.507 1.00 0.00 C ATOM 0 H LEU A 61 -15.806 1.692 -4.775 1.00 0.00 H new ATOM 0 HA LEU A 61 -16.596 1.151 -2.198 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -16.226 3.393 -2.773 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -17.233 3.305 -4.205 1.00 0.00 H new ATOM 0 HG LEU A 61 -19.256 3.230 -2.810 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -19.106 3.633 -0.385 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -18.332 2.100 -0.850 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -17.333 3.526 -0.482 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -19.148 5.537 -1.945 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -17.376 5.509 -2.109 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -18.406 5.399 -3.556 1.00 0.00 H new ATOM 919 N ARG A 62 -19.066 0.839 -4.364 1.00 0.00 N ATOM 920 CA ARG A 62 -20.401 0.296 -4.559 1.00 0.00 C ATOM 921 C ARG A 62 -20.446 -1.199 -4.257 1.00 0.00 C ATOM 922 O ARG A 62 -21.117 -1.641 -3.328 1.00 0.00 O ATOM 923 CB ARG A 62 -20.865 0.556 -5.998 1.00 0.00 C ATOM 924 CG ARG A 62 -22.279 0.076 -6.293 1.00 0.00 C ATOM 925 CD ARG A 62 -23.209 0.324 -5.114 1.00 0.00 C ATOM 926 NE ARG A 62 -24.567 -0.150 -5.364 1.00 0.00 N ATOM 927 CZ ARG A 62 -24.914 -1.434 -5.376 1.00 0.00 C ATOM 928 NH1 ARG A 62 -24.011 -2.376 -5.135 1.00 0.00 N ATOM 929 NH2 ARG A 62 -26.172 -1.776 -5.618 1.00 0.00 N ATOM 0 H ARG A 62 -18.632 1.200 -5.213 1.00 0.00 H new ATOM 0 HA ARG A 62 -21.074 0.798 -3.863 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -20.807 1.626 -6.199 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -20.176 0.065 -6.685 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -22.662 0.590 -7.175 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -22.262 -0.989 -6.527 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -22.811 -0.174 -4.230 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -23.235 1.391 -4.894 1.00 0.00 H new ATOM 0 HE ARG A 62 -25.293 0.545 -5.540 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -23.044 -2.117 -4.939 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -24.284 -3.359 -5.146 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -26.872 -1.055 -5.795 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -26.440 -2.760 -5.628 1.00 0.00 H new ATOM 943 N GLU A 63 -19.742 -1.975 -5.066 1.00 0.00 N ATOM 944 CA GLU A 63 -19.710 -3.427 -4.904 1.00 0.00 C ATOM 945 C GLU A 63 -19.417 -3.855 -3.468 1.00 0.00 C ATOM 946 O GLU A 63 -19.719 -4.985 -3.081 1.00 0.00 O ATOM 947 CB GLU A 63 -18.670 -4.042 -5.841 1.00 0.00 C ATOM 948 CG GLU A 63 -18.861 -3.662 -7.298 1.00 0.00 C ATOM 949 CD GLU A 63 -17.689 -2.881 -7.856 1.00 0.00 C ATOM 950 OE1 GLU A 63 -16.534 -3.220 -7.521 1.00 0.00 O ATOM 951 OE2 GLU A 63 -17.926 -1.930 -8.630 1.00 0.00 O ATOM 0 H GLU A 63 -19.183 -1.626 -5.844 1.00 0.00 H new ATOM 0 HA GLU A 63 -20.705 -3.791 -5.158 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -17.676 -3.730 -5.521 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -18.708 -5.127 -5.750 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -19.005 -4.566 -7.889 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -19.769 -3.068 -7.398 1.00 0.00 H new ATOM 958 N GLU A 64 -18.794 -2.979 -2.690 1.00 0.00 N ATOM 959 CA GLU A 64 -18.429 -3.314 -1.315 1.00 0.00 C ATOM 960 C GLU A 64 -19.432 -2.816 -0.271 1.00 0.00 C ATOM 961 O GLU A 64 -19.597 -3.451 0.770 1.00 0.00 O ATOM 962 CB GLU A 64 -17.047 -2.748 -0.988 1.00 0.00 C ATOM 963 CG GLU A 64 -15.929 -3.339 -1.825 1.00 0.00 C ATOM 964 CD GLU A 64 -14.654 -3.541 -1.029 1.00 0.00 C ATOM 965 OE1 GLU A 64 -14.363 -2.701 -0.152 1.00 0.00 O ATOM 966 OE2 GLU A 64 -13.949 -4.540 -1.283 1.00 0.00 O ATOM 0 H GLU A 64 -18.532 -2.038 -2.982 1.00 0.00 H new ATOM 0 HA GLU A 64 -18.428 -4.403 -1.262 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -17.064 -1.668 -1.132 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -16.832 -2.926 0.066 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -16.253 -4.295 -2.235 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -15.726 -2.682 -2.670 1.00 0.00 H new ATOM 973 N THR A 65 -20.079 -1.677 -0.512 1.00 0.00 N ATOM 974 CA THR A 65 -21.022 -1.142 0.472 1.00 0.00 C ATOM 975 C THR A 65 -22.389 -0.828 -0.121 1.00 0.00 C ATOM 976 O THR A 65 -23.307 -0.456 0.605 1.00 0.00 O ATOM 977 CB THR A 65 -20.452 0.125 1.110 1.00 0.00 C ATOM 978 OG1 THR A 65 -19.835 0.948 0.130 1.00 0.00 O ATOM 979 CG2 THR A 65 -19.426 -0.154 2.180 1.00 0.00 C ATOM 0 H THR A 65 -19.973 -1.117 -1.358 1.00 0.00 H new ATOM 0 HA THR A 65 -21.161 -1.921 1.222 1.00 0.00 H new ATOM 0 HB THR A 65 -21.306 0.625 1.568 1.00 0.00 H new ATOM 0 HG1 THR A 65 -20.070 0.624 -0.764 1.00 0.00 H new ATOM 0 HG21 THR A 65 -19.063 0.788 2.590 1.00 0.00 H new ATOM 0 HG22 THR A 65 -19.881 -0.745 2.975 1.00 0.00 H new ATOM 0 HG23 THR A 65 -18.592 -0.707 1.749 1.00 0.00 H new ATOM 987 N GLY A 66 -22.523 -0.945 -1.432 1.00 0.00 N ATOM 988 CA GLY A 66 -23.788 -0.628 -2.064 1.00 0.00 C ATOM 989 C GLY A 66 -23.967 0.871 -2.234 1.00 0.00 C ATOM 990 O GLY A 66 -24.842 1.318 -2.972 1.00 0.00 O ATOM 0 H GLY A 66 -21.786 -1.251 -2.067 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -23.841 -1.114 -3.038 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -24.606 -1.027 -1.464 1.00 0.00 H new ATOM 994 N VAL A 67 -23.133 1.645 -1.542 1.00 0.00 N ATOM 995 CA VAL A 67 -23.188 3.094 -1.606 1.00 0.00 C ATOM 996 C VAL A 67 -22.997 3.601 -3.026 1.00 0.00 C ATOM 997 O VAL A 67 -21.934 3.431 -3.625 1.00 0.00 O ATOM 998 CB VAL A 67 -22.119 3.731 -0.702 1.00 0.00 C ATOM 999 CG1 VAL A 67 -22.058 5.239 -0.915 1.00 0.00 C ATOM 1000 CG2 VAL A 67 -22.383 3.390 0.760 1.00 0.00 C ATOM 0 H VAL A 67 -22.406 1.282 -0.926 1.00 0.00 H new ATOM 0 HA VAL A 67 -24.179 3.383 -1.257 1.00 0.00 H new ATOM 0 HB VAL A 67 -21.147 3.319 -0.974 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -21.295 5.668 -0.265 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -21.809 5.450 -1.955 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -23.026 5.679 -0.677 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -21.617 3.849 1.385 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -23.363 3.768 1.051 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -22.358 2.308 0.892 1.00 0.00 H new ATOM 1010 N THR A 68 -24.020 4.256 -3.535 1.00 0.00 N ATOM 1011 CA THR A 68 -23.964 4.834 -4.864 1.00 0.00 C ATOM 1012 C THR A 68 -24.377 6.300 -4.798 1.00 0.00 C ATOM 1013 O THR A 68 -23.794 7.152 -5.469 1.00 0.00 O ATOM 1014 CB THR A 68 -24.848 4.054 -5.831 1.00 0.00 C ATOM 1015 OG1 THR A 68 -25.867 3.361 -5.131 1.00 0.00 O ATOM 1016 CG2 THR A 68 -24.076 3.038 -6.649 1.00 0.00 C ATOM 0 H THR A 68 -24.904 4.402 -3.047 1.00 0.00 H new ATOM 0 HA THR A 68 -22.942 4.775 -5.238 1.00 0.00 H new ATOM 0 HB THR A 68 -25.273 4.797 -6.506 1.00 0.00 H new ATOM 0 HG1 THR A 68 -26.425 2.868 -5.768 1.00 0.00 H new ATOM 0 HG21 THR A 68 -24.759 2.515 -7.318 1.00 0.00 H new ATOM 0 HG22 THR A 68 -23.312 3.548 -7.236 1.00 0.00 H new ATOM 0 HG23 THR A 68 -23.600 2.319 -5.982 1.00 0.00 H new ATOM 1024 N SER A 69 -25.381 6.585 -3.968 1.00 0.00 N ATOM 1025 CA SER A 69 -25.868 7.949 -3.780 1.00 0.00 C ATOM 1026 C SER A 69 -24.777 8.842 -3.200 1.00 0.00 C ATOM 1027 O SER A 69 -24.817 9.196 -2.022 1.00 0.00 O ATOM 1028 CB SER A 69 -27.075 7.972 -2.853 1.00 0.00 C ATOM 1029 OG SER A 69 -28.012 6.958 -3.186 1.00 0.00 O ATOM 0 H SER A 69 -25.874 5.885 -3.414 1.00 0.00 H new ATOM 0 HA SER A 69 -26.159 8.328 -4.760 1.00 0.00 H new ATOM 0 HB2 SER A 69 -26.745 7.839 -1.823 1.00 0.00 H new ATOM 0 HB3 SER A 69 -27.559 8.947 -2.909 1.00 0.00 H new ATOM 0 HG SER A 69 -28.773 7.001 -2.570 1.00 0.00 H new ATOM 1035 N ALA A 70 -23.804 9.192 -4.018 1.00 0.00 N ATOM 1036 CA ALA A 70 -22.701 10.029 -3.566 1.00 0.00 C ATOM 1037 C ALA A 70 -21.962 10.680 -4.734 1.00 0.00 C ATOM 1038 O ALA A 70 -21.973 10.167 -5.853 1.00 0.00 O ATOM 1039 CB ALA A 70 -21.737 9.206 -2.724 1.00 0.00 C ATOM 0 H ALA A 70 -23.751 8.913 -4.998 1.00 0.00 H new ATOM 0 HA ALA A 70 -23.120 10.832 -2.959 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -20.915 9.839 -2.390 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -22.262 8.805 -1.857 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -21.343 8.384 -3.321 1.00 0.00 H new ATOM 1045 N GLU A 71 -21.311 11.811 -4.455 1.00 0.00 N ATOM 1046 CA GLU A 71 -20.551 12.539 -5.471 1.00 0.00 C ATOM 1047 C GLU A 71 -19.136 12.831 -4.976 1.00 0.00 C ATOM 1048 O GLU A 71 -18.906 12.977 -3.778 1.00 0.00 O ATOM 1049 CB GLU A 71 -21.239 13.860 -5.833 1.00 0.00 C ATOM 1050 CG GLU A 71 -22.757 13.823 -5.751 1.00 0.00 C ATOM 1051 CD GLU A 71 -23.411 14.737 -6.773 1.00 0.00 C ATOM 1052 OE1 GLU A 71 -23.475 14.352 -7.960 1.00 0.00 O ATOM 1053 OE2 GLU A 71 -23.856 15.839 -6.388 1.00 0.00 O ATOM 0 H GLU A 71 -21.295 12.243 -3.531 1.00 0.00 H new ATOM 0 HA GLU A 71 -20.503 11.909 -6.359 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -20.871 14.641 -5.168 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -20.949 14.141 -6.846 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -23.102 12.801 -5.907 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -23.072 14.117 -4.750 1.00 0.00 H new ATOM 1060 N VAL A 72 -18.199 12.928 -5.908 1.00 0.00 N ATOM 1061 CA VAL A 72 -16.810 13.216 -5.569 1.00 0.00 C ATOM 1062 C VAL A 72 -16.621 14.678 -5.199 1.00 0.00 C ATOM 1063 O VAL A 72 -16.984 15.576 -5.959 1.00 0.00 O ATOM 1064 CB VAL A 72 -15.858 12.872 -6.734 1.00 0.00 C ATOM 1065 CG1 VAL A 72 -14.406 12.906 -6.281 1.00 0.00 C ATOM 1066 CG2 VAL A 72 -16.203 11.515 -7.323 1.00 0.00 C ATOM 0 H VAL A 72 -18.374 12.812 -6.906 1.00 0.00 H new ATOM 0 HA VAL A 72 -16.566 12.591 -4.710 1.00 0.00 H new ATOM 0 HB VAL A 72 -15.987 13.628 -7.509 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -13.757 12.660 -7.121 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -14.163 13.903 -5.914 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -14.257 12.179 -5.482 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -15.521 11.290 -8.143 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -16.109 10.750 -6.553 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -17.227 11.530 -7.697 1.00 0.00 H new ATOM 1076 N ILE A 73 -16.036 14.905 -4.035 1.00 0.00 N ATOM 1077 CA ILE A 73 -15.778 16.254 -3.565 1.00 0.00 C ATOM 1078 C ILE A 73 -14.294 16.572 -3.662 1.00 0.00 C ATOM 1079 O ILE A 73 -13.891 17.736 -3.659 1.00 0.00 O ATOM 1080 CB ILE A 73 -16.214 16.449 -2.102 1.00 0.00 C ATOM 1081 CG1 ILE A 73 -17.516 15.707 -1.808 1.00 0.00 C ATOM 1082 CG2 ILE A 73 -16.367 17.925 -1.791 1.00 0.00 C ATOM 1083 CD1 ILE A 73 -17.508 15.041 -0.458 1.00 0.00 C ATOM 0 H ILE A 73 -15.730 14.170 -3.397 1.00 0.00 H new ATOM 0 HA ILE A 73 -16.359 16.923 -4.200 1.00 0.00 H new ATOM 0 HB ILE A 73 -15.438 16.031 -1.461 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -18.349 16.408 -1.859 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -17.684 14.955 -2.579 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -16.676 18.048 -0.753 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -15.414 18.431 -1.949 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -17.121 18.359 -2.448 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -18.457 14.528 -0.300 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -16.693 14.319 -0.414 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -17.368 15.794 0.318 1.00 0.00 H new ATOM 1095 N ALA A 74 -13.485 15.523 -3.748 1.00 0.00 N ATOM 1096 CA ALA A 74 -12.043 15.688 -3.844 1.00 0.00 C ATOM 1097 C ALA A 74 -11.348 14.371 -4.150 1.00 0.00 C ATOM 1098 O ALA A 74 -11.978 13.315 -4.198 1.00 0.00 O ATOM 1099 CB ALA A 74 -11.495 16.284 -2.555 1.00 0.00 C ATOM 0 H ALA A 74 -13.803 14.554 -3.753 1.00 0.00 H new ATOM 0 HA ALA A 74 -11.841 16.370 -4.670 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -10.415 16.403 -2.639 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -11.954 17.257 -2.380 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -11.723 15.620 -1.721 1.00 0.00 H new ATOM 1105 N GLU A 75 -10.040 14.444 -4.342 1.00 0.00 N ATOM 1106 CA GLU A 75 -9.241 13.266 -4.630 1.00 0.00 C ATOM 1107 C GLU A 75 -7.807 13.475 -4.164 1.00 0.00 C ATOM 1108 O GLU A 75 -7.276 14.584 -4.245 1.00 0.00 O ATOM 1109 CB GLU A 75 -9.278 12.949 -6.123 1.00 0.00 C ATOM 1110 CG GLU A 75 -8.664 14.028 -6.992 1.00 0.00 C ATOM 1111 CD GLU A 75 -9.596 14.483 -8.097 1.00 0.00 C ATOM 1112 OE1 GLU A 75 -10.623 15.121 -7.783 1.00 0.00 O ATOM 1113 OE2 GLU A 75 -9.301 14.193 -9.274 1.00 0.00 O ATOM 0 H GLU A 75 -9.508 15.313 -4.303 1.00 0.00 H new ATOM 0 HA GLU A 75 -9.661 12.419 -4.088 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -8.752 12.011 -6.299 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -10.313 12.796 -6.427 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -8.398 14.883 -6.370 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -7.740 13.654 -7.432 1.00 0.00 H new ATOM 1120 N VAL A 76 -7.184 12.415 -3.664 1.00 0.00 N ATOM 1121 CA VAL A 76 -5.817 12.512 -3.178 1.00 0.00 C ATOM 1122 C VAL A 76 -4.836 12.701 -4.332 1.00 0.00 C ATOM 1123 O VAL A 76 -4.898 11.995 -5.336 1.00 0.00 O ATOM 1124 CB VAL A 76 -5.425 11.282 -2.332 1.00 0.00 C ATOM 1125 CG1 VAL A 76 -3.922 11.220 -2.119 1.00 0.00 C ATOM 1126 CG2 VAL A 76 -6.145 11.319 -0.997 1.00 0.00 C ATOM 0 H VAL A 76 -7.600 11.487 -3.585 1.00 0.00 H new ATOM 0 HA VAL A 76 -5.765 13.390 -2.534 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.725 10.385 -2.874 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -3.675 10.343 -1.520 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -3.420 11.153 -3.084 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -3.591 12.119 -1.600 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -5.862 10.447 -0.407 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -5.869 12.226 -0.460 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -7.222 11.310 -1.164 1.00 0.00 H new ATOM 1136 N PRO A 77 -3.923 13.680 -4.201 1.00 0.00 N ATOM 1137 CA PRO A 77 -2.928 13.990 -5.234 1.00 0.00 C ATOM 1138 C PRO A 77 -1.933 12.859 -5.460 1.00 0.00 C ATOM 1139 O PRO A 77 -1.692 12.451 -6.595 1.00 0.00 O ATOM 1140 CB PRO A 77 -2.214 15.231 -4.687 1.00 0.00 C ATOM 1141 CG PRO A 77 -2.453 15.197 -3.216 1.00 0.00 C ATOM 1142 CD PRO A 77 -3.806 14.574 -3.036 1.00 0.00 C ATOM 0 HA PRO A 77 -3.398 14.143 -6.206 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -1.148 15.205 -4.914 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -2.613 16.143 -5.131 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -1.684 14.615 -2.708 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -2.425 16.201 -2.792 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -3.874 14.024 -2.098 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -4.596 15.324 -3.023 1.00 0.00 H new ATOM 1150 N TYR A 78 -1.338 12.369 -4.379 1.00 0.00 N ATOM 1151 CA TYR A 78 -0.352 11.301 -4.476 1.00 0.00 C ATOM 1152 C TYR A 78 -0.953 9.937 -4.139 1.00 0.00 C ATOM 1153 O TYR A 78 -2.120 9.833 -3.782 1.00 0.00 O ATOM 1154 CB TYR A 78 0.825 11.589 -3.543 1.00 0.00 C ATOM 1155 CG TYR A 78 0.383 12.051 -2.176 1.00 0.00 C ATOM 1156 CD1 TYR A 78 -0.290 11.190 -1.323 1.00 0.00 C ATOM 1157 CD2 TYR A 78 0.613 13.351 -1.750 1.00 0.00 C ATOM 1158 CE1 TYR A 78 -0.720 11.607 -0.082 1.00 0.00 C ATOM 1159 CE2 TYR A 78 0.192 13.778 -0.508 1.00 0.00 C ATOM 1160 CZ TYR A 78 -0.473 12.905 0.321 1.00 0.00 C ATOM 1161 OH TYR A 78 -0.896 13.333 1.556 1.00 0.00 O ATOM 0 H TYR A 78 -1.520 12.693 -3.429 1.00 0.00 H new ATOM 0 HA TYR A 78 -0.006 11.268 -5.509 1.00 0.00 H new ATOM 0 HB2 TYR A 78 1.431 10.689 -3.440 1.00 0.00 H new ATOM 0 HB3 TYR A 78 1.461 12.352 -3.992 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -0.481 10.174 -1.637 1.00 0.00 H new ATOM 0 HD2 TYR A 78 1.130 14.040 -2.401 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -1.246 10.925 0.570 1.00 0.00 H new ATOM 0 HE2 TYR A 78 0.383 14.792 -0.188 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.212 13.125 2.226 1.00 0.00 H new ATOM 1171 N TRP A 79 -0.141 8.887 -4.251 1.00 0.00 N ATOM 1172 CA TRP A 79 -0.602 7.536 -3.949 1.00 0.00 C ATOM 1173 C TRP A 79 -0.276 7.164 -2.504 1.00 0.00 C ATOM 1174 O TRP A 79 0.008 8.036 -1.688 1.00 0.00 O ATOM 1175 CB TRP A 79 0.008 6.535 -4.935 1.00 0.00 C ATOM 1176 CG TRP A 79 -0.612 6.625 -6.295 1.00 0.00 C ATOM 1177 CD1 TRP A 79 -0.357 7.567 -7.246 1.00 0.00 C ATOM 1178 CD2 TRP A 79 -1.603 5.754 -6.848 1.00 0.00 C ATOM 1179 NE1 TRP A 79 -1.129 7.338 -8.359 1.00 0.00 N ATOM 1180 CE2 TRP A 79 -1.902 6.229 -8.139 1.00 0.00 C ATOM 1181 CE3 TRP A 79 -2.267 4.619 -6.379 1.00 0.00 C ATOM 1182 CZ2 TRP A 79 -2.836 5.610 -8.964 1.00 0.00 C ATOM 1183 CZ3 TRP A 79 -3.194 4.006 -7.198 1.00 0.00 C ATOM 1184 CH2 TRP A 79 -3.470 4.503 -8.479 1.00 0.00 C ATOM 0 H TRP A 79 0.833 8.946 -4.547 1.00 0.00 H new ATOM 0 HA TRP A 79 -1.686 7.502 -4.060 1.00 0.00 H new ATOM 0 HB2 TRP A 79 1.080 6.715 -5.015 1.00 0.00 H new ATOM 0 HB3 TRP A 79 -0.118 5.524 -4.547 1.00 0.00 H new ATOM 0 HD1 TRP A 79 0.350 8.377 -7.140 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -1.127 7.901 -9.209 1.00 0.00 H new ATOM 0 HE3 TRP A 79 -2.059 4.228 -5.394 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -3.051 5.991 -9.951 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 -3.715 3.128 -6.846 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -4.200 3.999 -9.095 1.00 0.00 H new ATOM 1195 N LEU A 80 -0.325 5.871 -2.189 1.00 0.00 N ATOM 1196 CA LEU A 80 -0.048 5.397 -0.833 1.00 0.00 C ATOM 1197 C LEU A 80 0.312 3.917 -0.845 1.00 0.00 C ATOM 1198 O LEU A 80 -0.553 3.054 -0.999 1.00 0.00 O ATOM 1199 CB LEU A 80 -1.260 5.618 0.077 1.00 0.00 C ATOM 1200 CG LEU A 80 -1.877 7.024 0.049 1.00 0.00 C ATOM 1201 CD1 LEU A 80 -3.267 7.006 0.669 1.00 0.00 C ATOM 1202 CD2 LEU A 80 -0.979 8.022 0.771 1.00 0.00 C ATOM 0 H LEU A 80 -0.554 5.132 -2.854 1.00 0.00 H new ATOM 0 HA LEU A 80 0.796 5.968 -0.447 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -2.032 4.899 -0.198 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -0.965 5.393 1.102 1.00 0.00 H new ATOM 0 HG LEU A 80 -1.967 7.339 -0.991 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -3.691 8.010 0.642 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -3.907 6.326 0.107 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -3.200 6.669 1.703 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -1.435 9.011 0.739 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -0.853 7.714 1.809 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -0.005 8.055 0.282 1.00 0.00 H new ATOM 1601 N ALA A 104 0.531 0.447 -4.311 1.00 0.00 N ATOM 1602 CA ALA A 104 0.216 1.875 -4.323 1.00 0.00 C ATOM 1603 C ALA A 104 -1.283 2.091 -4.338 1.00 0.00 C ATOM 1604 O ALA A 104 -1.996 1.560 -5.189 1.00 0.00 O ATOM 1605 CB ALA A 104 0.876 2.570 -5.509 1.00 0.00 C ATOM 0 HA ALA A 104 0.616 2.318 -3.411 1.00 0.00 H new ATOM 0 HB1 ALA A 104 0.626 3.631 -5.494 1.00 0.00 H new ATOM 0 HB2 ALA A 104 1.958 2.451 -5.444 1.00 0.00 H new ATOM 0 HB3 ALA A 104 0.517 2.125 -6.437 1.00 0.00 H new ATOM 1611 N GLN A 105 -1.755 2.841 -3.352 1.00 0.00 N ATOM 1612 CA GLN A 105 -3.178 3.090 -3.203 1.00 0.00 C ATOM 1613 C GLN A 105 -3.507 4.585 -3.146 1.00 0.00 C ATOM 1614 O GLN A 105 -3.075 5.288 -2.233 1.00 0.00 O ATOM 1615 CB GLN A 105 -3.674 2.422 -1.909 1.00 0.00 C ATOM 1616 CG GLN A 105 -2.793 1.282 -1.396 1.00 0.00 C ATOM 1617 CD GLN A 105 -2.626 1.290 0.110 1.00 0.00 C ATOM 1618 OE1 GLN A 105 -2.307 2.317 0.708 1.00 0.00 O ATOM 1619 NE2 GLN A 105 -2.840 0.134 0.730 1.00 0.00 N ATOM 0 H GLN A 105 -1.171 3.287 -2.644 1.00 0.00 H new ATOM 0 HA GLN A 105 -3.677 2.673 -4.078 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -3.750 3.182 -1.131 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -4.680 2.037 -2.078 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -3.227 0.330 -1.702 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -1.811 1.351 -1.865 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -3.103 -0.692 0.192 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -2.741 0.073 1.743 1.00 0.00 H new ATOM 1628 N LYS A 106 -4.309 5.053 -4.102 1.00 0.00 N ATOM 1629 CA LYS A 106 -4.731 6.454 -4.122 1.00 0.00 C ATOM 1630 C LYS A 106 -6.174 6.552 -3.647 1.00 0.00 C ATOM 1631 O LYS A 106 -7.025 5.761 -4.051 1.00 0.00 O ATOM 1632 CB LYS A 106 -4.586 7.072 -5.516 1.00 0.00 C ATOM 1633 CG LYS A 106 -4.308 8.569 -5.479 1.00 0.00 C ATOM 1634 CD LYS A 106 -4.759 9.265 -6.758 1.00 0.00 C ATOM 1635 CE LYS A 106 -3.911 8.848 -7.951 1.00 0.00 C ATOM 1636 NZ LYS A 106 -3.057 9.963 -8.452 1.00 0.00 N ATOM 0 H LYS A 106 -4.677 4.488 -4.867 1.00 0.00 H new ATOM 0 HA LYS A 106 -4.082 7.016 -3.451 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -3.776 6.571 -6.047 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -5.499 6.892 -6.084 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -4.821 9.012 -4.625 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -3.241 8.736 -5.332 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -5.805 9.027 -6.953 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -4.697 10.345 -6.626 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -3.278 8.007 -7.669 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -4.562 8.502 -8.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -2.144 9.583 -8.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -3.535 10.437 -9.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -2.896 10.648 -7.686 1.00 0.00 H new ATOM 1650 N TRP A 107 -6.443 7.507 -2.766 1.00 0.00 N ATOM 1651 CA TRP A 107 -7.784 7.672 -2.219 1.00 0.00 C ATOM 1652 C TRP A 107 -8.539 8.820 -2.876 1.00 0.00 C ATOM 1653 O TRP A 107 -7.954 9.665 -3.553 1.00 0.00 O ATOM 1654 CB TRP A 107 -7.708 7.887 -0.707 1.00 0.00 C ATOM 1655 CG TRP A 107 -7.616 6.602 0.048 1.00 0.00 C ATOM 1656 CD1 TRP A 107 -6.545 5.758 0.097 1.00 0.00 C ATOM 1657 CD2 TRP A 107 -8.638 6.004 0.850 1.00 0.00 C ATOM 1658 NE1 TRP A 107 -6.839 4.665 0.872 1.00 0.00 N ATOM 1659 CE2 TRP A 107 -8.118 4.794 1.350 1.00 0.00 C ATOM 1660 CE3 TRP A 107 -9.941 6.372 1.189 1.00 0.00 C ATOM 1661 CZ2 TRP A 107 -8.861 3.951 2.172 1.00 0.00 C ATOM 1662 CZ3 TRP A 107 -10.676 5.538 2.003 1.00 0.00 C ATOM 1663 CH2 TRP A 107 -10.136 4.338 2.488 1.00 0.00 C ATOM 0 H TRP A 107 -5.756 8.175 -2.417 1.00 0.00 H new ATOM 0 HA TRP A 107 -8.338 6.758 -2.432 1.00 0.00 H new ATOM 0 HB2 TRP A 107 -6.841 8.505 -0.474 1.00 0.00 H new ATOM 0 HB3 TRP A 107 -8.589 8.437 -0.376 1.00 0.00 H new ATOM 0 HD1 TRP A 107 -5.602 5.926 -0.402 1.00 0.00 H new ATOM 0 HE1 TRP A 107 -6.210 3.885 1.062 1.00 0.00 H new ATOM 0 HE3 TRP A 107 -10.365 7.294 0.820 1.00 0.00 H new ATOM 0 HZ2 TRP A 107 -8.447 3.026 2.546 1.00 0.00 H new ATOM 0 HZ3 TRP A 107 -11.685 5.813 2.272 1.00 0.00 H new ATOM 0 HH2 TRP A 107 -10.738 3.706 3.124 1.00 0.00 H new ATOM 1674 N PHE A 108 -9.851 8.829 -2.663 1.00 0.00 N ATOM 1675 CA PHE A 108 -10.726 9.853 -3.219 1.00 0.00 C ATOM 1676 C PHE A 108 -11.783 10.256 -2.190 1.00 0.00 C ATOM 1677 O PHE A 108 -12.147 9.465 -1.324 1.00 0.00 O ATOM 1678 CB PHE A 108 -11.429 9.328 -4.474 1.00 0.00 C ATOM 1679 CG PHE A 108 -10.531 9.075 -5.649 1.00 0.00 C ATOM 1680 CD1 PHE A 108 -9.936 7.836 -5.834 1.00 0.00 C ATOM 1681 CD2 PHE A 108 -10.301 10.073 -6.578 1.00 0.00 C ATOM 1682 CE1 PHE A 108 -9.120 7.601 -6.926 1.00 0.00 C ATOM 1683 CE2 PHE A 108 -9.489 9.846 -7.672 1.00 0.00 C ATOM 1684 CZ PHE A 108 -8.899 8.610 -7.846 1.00 0.00 C ATOM 0 H PHE A 108 -10.336 8.129 -2.102 1.00 0.00 H new ATOM 0 HA PHE A 108 -10.117 10.719 -3.479 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -11.942 8.400 -4.222 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -12.194 10.045 -4.770 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -10.112 7.047 -5.118 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -10.762 11.041 -6.447 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -8.658 6.634 -7.060 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -9.316 10.634 -8.390 1.00 0.00 H new ATOM 0 HZ PHE A 108 -8.264 8.431 -8.701 1.00 0.00 H new ATOM 1694 N LEU A 109 -12.278 11.485 -2.293 1.00 0.00 N ATOM 1695 CA LEU A 109 -13.301 11.980 -1.368 1.00 0.00 C ATOM 1696 C LEU A 109 -14.686 11.934 -2.009 1.00 0.00 C ATOM 1697 O LEU A 109 -14.840 12.209 -3.197 1.00 0.00 O ATOM 1698 CB LEU A 109 -12.969 13.403 -0.917 1.00 0.00 C ATOM 1699 CG LEU A 109 -13.917 13.999 0.130 1.00 0.00 C ATOM 1700 CD1 LEU A 109 -14.160 13.021 1.272 1.00 0.00 C ATOM 1701 CD2 LEU A 109 -13.361 15.313 0.666 1.00 0.00 C ATOM 0 H LEU A 109 -11.991 12.158 -3.004 1.00 0.00 H new ATOM 0 HA LEU A 109 -13.310 11.329 -0.494 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -11.957 13.411 -0.512 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -12.967 14.052 -1.792 1.00 0.00 H new ATOM 0 HG LEU A 109 -14.873 14.195 -0.356 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -14.836 13.471 1.999 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -14.606 12.107 0.880 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -13.212 12.784 1.756 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -14.046 15.722 1.408 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -12.390 15.136 1.128 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -13.249 16.022 -0.154 1.00 0.00 H new ATOM 1713 N PHE A 110 -15.692 11.568 -1.221 1.00 0.00 N ATOM 1714 CA PHE A 110 -17.053 11.469 -1.739 1.00 0.00 C ATOM 1715 C PHE A 110 -18.094 11.934 -0.743 1.00 0.00 C ATOM 1716 O PHE A 110 -17.964 11.737 0.465 1.00 0.00 O ATOM 1717 CB PHE A 110 -17.373 10.031 -2.119 1.00 0.00 C ATOM 1718 CG PHE A 110 -16.603 9.531 -3.293 1.00 0.00 C ATOM 1719 CD1 PHE A 110 -15.270 9.206 -3.166 1.00 0.00 C ATOM 1720 CD2 PHE A 110 -17.217 9.377 -4.520 1.00 0.00 C ATOM 1721 CE1 PHE A 110 -14.556 8.733 -4.242 1.00 0.00 C ATOM 1722 CE2 PHE A 110 -16.509 8.909 -5.603 1.00 0.00 C ATOM 1723 CZ PHE A 110 -15.176 8.584 -5.466 1.00 0.00 C ATOM 0 H PHE A 110 -15.594 11.337 -0.232 1.00 0.00 H new ATOM 0 HA PHE A 110 -17.092 12.121 -2.612 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -17.172 9.386 -1.264 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -18.438 9.951 -2.335 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -14.780 9.324 -2.211 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -18.262 9.626 -4.631 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -13.512 8.479 -4.129 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -16.997 8.796 -6.560 1.00 0.00 H new ATOM 0 HZ PHE A 110 -14.619 8.214 -6.314 1.00 0.00 H new ATOM 1733 N LYS A 111 -19.146 12.532 -1.282 1.00 0.00 N ATOM 1734 CA LYS A 111 -20.258 13.014 -0.472 1.00 0.00 C ATOM 1735 C LYS A 111 -21.452 12.083 -0.618 1.00 0.00 C ATOM 1736 O LYS A 111 -21.940 11.872 -1.722 1.00 0.00 O ATOM 1737 CB LYS A 111 -20.665 14.423 -0.901 1.00 0.00 C ATOM 1738 CG LYS A 111 -21.353 15.212 0.196 1.00 0.00 C ATOM 1739 CD LYS A 111 -21.040 16.694 0.098 1.00 0.00 C ATOM 1740 CE LYS A 111 -21.908 17.505 1.043 1.00 0.00 C ATOM 1741 NZ LYS A 111 -22.487 18.701 0.375 1.00 0.00 N ATOM 0 H LYS A 111 -19.254 12.696 -2.283 1.00 0.00 H new ATOM 0 HA LYS A 111 -19.936 13.037 0.569 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -19.778 14.966 -1.227 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -21.331 14.355 -1.761 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -22.431 15.062 0.132 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -21.036 14.836 1.169 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -19.989 16.862 0.332 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -21.197 17.034 -0.926 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -22.713 16.877 1.425 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -21.314 17.820 1.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -23.073 19.228 1.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -21.719 19.313 0.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -23.074 18.400 -0.429 1.00 0.00 H new ATOM 1755 N PHE A 112 -21.938 11.542 0.496 1.00 0.00 N ATOM 1756 CA PHE A 112 -23.092 10.650 0.460 1.00 0.00 C ATOM 1757 C PHE A 112 -24.385 11.446 0.293 1.00 0.00 C ATOM 1758 O PHE A 112 -24.953 11.945 1.266 1.00 0.00 O ATOM 1759 CB PHE A 112 -23.152 9.816 1.738 1.00 0.00 C ATOM 1760 CG PHE A 112 -24.116 8.664 1.669 1.00 0.00 C ATOM 1761 CD1 PHE A 112 -25.452 8.829 1.995 1.00 0.00 C ATOM 1762 CD2 PHE A 112 -23.677 7.409 1.289 1.00 0.00 C ATOM 1763 CE1 PHE A 112 -26.325 7.762 1.940 1.00 0.00 C ATOM 1764 CE2 PHE A 112 -24.546 6.337 1.234 1.00 0.00 C ATOM 1765 CZ PHE A 112 -25.871 6.514 1.560 1.00 0.00 C ATOM 0 H PHE A 112 -21.554 11.704 1.427 1.00 0.00 H new ATOM 0 HA PHE A 112 -22.984 9.983 -0.395 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -22.156 9.431 1.956 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -23.433 10.463 2.569 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -25.814 9.801 2.295 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -22.638 7.265 1.031 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -27.365 7.903 2.194 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -24.187 5.363 0.936 1.00 0.00 H new ATOM 0 HZ PHE A 112 -26.555 5.679 1.519 1.00 0.00 H new ATOM 1775 N THR A 113 -24.838 11.562 -0.949 1.00 0.00 N ATOM 1776 CA THR A 113 -26.057 12.299 -1.257 1.00 0.00 C ATOM 1777 C THR A 113 -27.255 11.358 -1.345 1.00 0.00 C ATOM 1778 O THR A 113 -27.960 11.325 -2.354 1.00 0.00 O ATOM 1779 CB THR A 113 -25.887 13.056 -2.576 1.00 0.00 C ATOM 1780 OG1 THR A 113 -25.869 12.159 -3.670 1.00 0.00 O ATOM 1781 CG2 THR A 113 -24.615 13.874 -2.633 1.00 0.00 C ATOM 0 H THR A 113 -24.377 11.153 -1.762 1.00 0.00 H new ATOM 0 HA THR A 113 -26.241 13.012 -0.453 1.00 0.00 H new ATOM 0 HB THR A 113 -26.740 13.732 -2.635 1.00 0.00 H new ATOM 0 HG1 THR A 113 -26.730 11.695 -3.727 1.00 0.00 H new ATOM 0 HG21 THR A 113 -24.554 14.386 -3.593 1.00 0.00 H new ATOM 0 HG22 THR A 113 -24.619 14.610 -1.829 1.00 0.00 H new ATOM 0 HG23 THR A 113 -23.754 13.216 -2.518 1.00 0.00 H new ATOM 1789 N GLY A 114 -27.475 10.594 -0.281 1.00 0.00 N ATOM 1790 CA GLY A 114 -28.585 9.659 -0.255 1.00 0.00 C ATOM 1791 C GLY A 114 -28.974 9.253 1.152 1.00 0.00 C ATOM 1792 O GLY A 114 -28.966 10.073 2.070 1.00 0.00 O ATOM 0 H GLY A 114 -26.904 10.605 0.564 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -29.446 10.109 -0.750 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -28.319 8.769 -0.825 1.00 0.00 H new ATOM 1796 N GLN A 115 -29.309 7.978 1.315 1.00 0.00 N ATOM 1797 CA GLN A 115 -29.699 7.441 2.619 1.00 0.00 C ATOM 1798 C GLN A 115 -28.848 6.224 2.986 1.00 0.00 C ATOM 1799 O GLN A 115 -28.420 5.470 2.115 1.00 0.00 O ATOM 1800 CB GLN A 115 -31.181 7.064 2.626 1.00 0.00 C ATOM 1801 CG GLN A 115 -31.659 6.432 1.325 1.00 0.00 C ATOM 1802 CD GLN A 115 -32.768 7.219 0.656 1.00 0.00 C ATOM 1803 OE1 GLN A 115 -32.756 8.449 0.643 1.00 0.00 O ATOM 1804 NE2 GLN A 115 -33.734 6.505 0.090 1.00 0.00 N ATOM 0 H GLN A 115 -29.319 7.293 0.559 1.00 0.00 H new ATOM 0 HA GLN A 115 -29.531 8.219 3.364 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -31.366 6.370 3.446 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -31.773 7.957 2.824 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -30.817 6.346 0.638 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -32.010 5.420 1.527 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -33.703 5.486 0.125 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -34.507 6.975 -0.380 1.00 0.00 H new ATOM 1813 N ASP A 116 -28.599 6.052 4.283 1.00 0.00 N ATOM 1814 CA ASP A 116 -27.781 4.943 4.781 1.00 0.00 C ATOM 1815 C ASP A 116 -28.389 3.582 4.464 1.00 0.00 C ATOM 1816 O ASP A 116 -27.673 2.589 4.339 1.00 0.00 O ATOM 1817 CB ASP A 116 -27.605 5.060 6.288 1.00 0.00 C ATOM 1818 CG ASP A 116 -26.650 6.170 6.682 1.00 0.00 C ATOM 1819 OD1 ASP A 116 -26.045 6.783 5.778 1.00 0.00 O ATOM 1820 OD2 ASP A 116 -26.506 6.427 7.896 1.00 0.00 O ATOM 0 H ASP A 116 -28.954 6.669 5.013 1.00 0.00 H new ATOM 0 HA ASP A 116 -26.818 5.011 4.275 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -28.576 5.241 6.750 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -27.236 4.113 6.681 1.00 0.00 H new ATOM 1825 N GLN A 117 -29.706 3.541 4.353 1.00 0.00 N ATOM 1826 CA GLN A 117 -30.418 2.295 4.068 1.00 0.00 C ATOM 1827 C GLN A 117 -29.949 1.643 2.765 1.00 0.00 C ATOM 1828 O GLN A 117 -30.377 0.539 2.431 1.00 0.00 O ATOM 1829 CB GLN A 117 -31.918 2.562 3.993 1.00 0.00 C ATOM 1830 CG GLN A 117 -32.271 3.731 3.095 1.00 0.00 C ATOM 1831 CD GLN A 117 -33.549 3.501 2.315 1.00 0.00 C ATOM 1832 OE1 GLN A 117 -33.603 3.722 1.103 1.00 0.00 O ATOM 1833 NE2 GLN A 117 -34.590 3.055 3.006 1.00 0.00 N ATOM 0 H GLN A 117 -30.310 4.356 4.455 1.00 0.00 H new ATOM 0 HA GLN A 117 -30.199 1.603 4.881 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -32.422 1.667 3.629 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -32.297 2.755 4.997 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -32.376 4.631 3.701 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -31.452 3.910 2.399 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -34.502 2.885 4.008 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -35.478 2.882 2.535 1.00 0.00 H new ATOM 1842 N GLU A 118 -29.068 2.318 2.033 1.00 0.00 N ATOM 1843 CA GLU A 118 -28.550 1.787 0.779 1.00 0.00 C ATOM 1844 C GLU A 118 -27.319 0.923 1.030 1.00 0.00 C ATOM 1845 O GLU A 118 -26.918 0.128 0.180 1.00 0.00 O ATOM 1846 CB GLU A 118 -28.185 2.937 -0.162 1.00 0.00 C ATOM 1847 CG GLU A 118 -27.924 2.500 -1.591 1.00 0.00 C ATOM 1848 CD GLU A 118 -29.200 2.265 -2.373 1.00 0.00 C ATOM 1849 OE1 GLU A 118 -30.215 2.922 -2.060 1.00 0.00 O ATOM 1850 OE2 GLU A 118 -29.185 1.426 -3.298 1.00 0.00 O ATOM 0 H GLU A 118 -28.698 3.234 2.288 1.00 0.00 H new ATOM 0 HA GLU A 118 -29.323 1.172 0.319 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -28.993 3.668 -0.158 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -27.298 3.440 0.222 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -27.328 3.260 -2.096 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -27.333 1.584 -1.584 1.00 0.00 H new ATOM 1857 N ILE A 119 -26.726 1.085 2.203 1.00 0.00 N ATOM 1858 CA ILE A 119 -25.544 0.326 2.569 1.00 0.00 C ATOM 1859 C ILE A 119 -25.909 -1.065 3.063 1.00 0.00 C ATOM 1860 O ILE A 119 -26.387 -1.233 4.186 1.00 0.00 O ATOM 1861 CB ILE A 119 -24.730 1.041 3.654 1.00 0.00 C ATOM 1862 CG1 ILE A 119 -24.643 2.537 3.367 1.00 0.00 C ATOM 1863 CG2 ILE A 119 -23.332 0.442 3.745 1.00 0.00 C ATOM 1864 CD1 ILE A 119 -23.869 3.282 4.421 1.00 0.00 C ATOM 0 H ILE A 119 -27.046 1.738 2.918 1.00 0.00 H new ATOM 0 HA ILE A 119 -24.939 0.240 1.667 1.00 0.00 H new ATOM 0 HB ILE A 119 -25.237 0.903 4.609 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -24.170 2.691 2.397 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -25.650 2.950 3.300 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -22.764 0.959 4.519 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -23.405 -0.617 3.994 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -22.825 0.555 2.787 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -23.837 4.342 4.168 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -24.355 3.154 5.388 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -22.853 2.891 4.471 1.00 0.00 H new ATOM 1876 N ASN A 120 -25.671 -2.063 2.225 1.00 0.00 N ATOM 1877 CA ASN A 120 -25.970 -3.442 2.585 1.00 0.00 C ATOM 1878 C ASN A 120 -24.690 -4.199 2.931 1.00 0.00 C ATOM 1879 O ASN A 120 -24.721 -5.170 3.687 1.00 0.00 O ATOM 1880 CB ASN A 120 -26.691 -4.143 1.429 1.00 0.00 C ATOM 1881 CG ASN A 120 -27.655 -5.212 1.908 1.00 0.00 C ATOM 1882 OD1 ASN A 120 -28.328 -5.050 2.926 1.00 0.00 O ATOM 1883 ND2 ASN A 120 -27.724 -6.313 1.169 1.00 0.00 N ATOM 0 H ASN A 120 -25.273 -1.945 1.293 1.00 0.00 H new ATOM 0 HA ASN A 120 -26.618 -3.435 3.461 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -27.236 -3.403 0.843 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -25.953 -4.594 0.766 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -28.354 -7.069 1.437 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -27.147 -6.403 0.333 1.00 0.00 H new ATOM 1890 N LEU A 121 -23.570 -3.753 2.369 1.00 0.00 N ATOM 1891 CA LEU A 121 -22.271 -4.384 2.609 1.00 0.00 C ATOM 1892 C LEU A 121 -22.168 -5.725 1.884 1.00 0.00 C ATOM 1893 O LEU A 121 -21.096 -6.109 1.421 1.00 0.00 O ATOM 1894 CB LEU A 121 -22.018 -4.573 4.108 1.00 0.00 C ATOM 1895 CG LEU A 121 -22.099 -3.295 4.953 1.00 0.00 C ATOM 1896 CD1 LEU A 121 -21.745 -3.591 6.400 1.00 0.00 C ATOM 1897 CD2 LEU A 121 -21.176 -2.215 4.402 1.00 0.00 C ATOM 0 H LEU A 121 -23.534 -2.951 1.739 1.00 0.00 H new ATOM 0 HA LEU A 121 -21.506 -3.718 2.211 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -22.742 -5.291 4.494 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -21.030 -5.014 4.240 1.00 0.00 H new ATOM 0 HG LEU A 121 -23.124 -2.928 4.907 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -21.808 -2.673 6.985 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -22.442 -4.326 6.802 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -20.731 -3.986 6.453 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -21.253 -1.320 5.020 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -20.147 -2.575 4.412 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -21.466 -1.976 3.379 1.00 0.00 H new ATOM 2016 N GLU A 130 -17.971 -8.316 2.819 1.00 0.00 N ATOM 2017 CA GLU A 130 -16.807 -7.470 3.057 1.00 0.00 C ATOM 2018 C GLU A 130 -16.796 -6.953 4.491 1.00 0.00 C ATOM 2019 O GLU A 130 -15.991 -7.387 5.314 1.00 0.00 O ATOM 2020 CB GLU A 130 -16.803 -6.293 2.078 1.00 0.00 C ATOM 2021 CG GLU A 130 -16.137 -6.612 0.750 1.00 0.00 C ATOM 2022 CD GLU A 130 -17.022 -7.447 -0.154 1.00 0.00 C ATOM 2023 OE1 GLU A 130 -18.094 -6.950 -0.559 1.00 0.00 O ATOM 2024 OE2 GLU A 130 -16.646 -8.600 -0.455 1.00 0.00 O ATOM 0 HA GLU A 130 -15.911 -8.070 2.900 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -17.831 -5.980 1.894 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -16.290 -5.449 2.539 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -15.879 -5.682 0.243 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -15.204 -7.145 0.933 1.00 0.00 H new ATOM 2031 N PHE A 131 -17.691 -6.014 4.781 1.00 0.00 N ATOM 2032 CA PHE A 131 -17.778 -5.433 6.115 1.00 0.00 C ATOM 2033 C PHE A 131 -18.985 -5.973 6.872 1.00 0.00 C ATOM 2034 O PHE A 131 -20.049 -6.196 6.296 1.00 0.00 O ATOM 2035 CB PHE A 131 -17.857 -3.914 6.024 1.00 0.00 C ATOM 2036 CG PHE A 131 -17.055 -3.332 4.890 1.00 0.00 C ATOM 2037 CD1 PHE A 131 -15.680 -3.179 5.003 1.00 0.00 C ATOM 2038 CD2 PHE A 131 -17.676 -2.930 3.719 1.00 0.00 C ATOM 2039 CE1 PHE A 131 -14.943 -2.635 3.969 1.00 0.00 C ATOM 2040 CE2 PHE A 131 -16.941 -2.387 2.680 1.00 0.00 C ATOM 2041 CZ PHE A 131 -15.572 -2.239 2.806 1.00 0.00 C ATOM 0 H PHE A 131 -18.364 -5.640 4.112 1.00 0.00 H new ATOM 0 HA PHE A 131 -16.878 -5.713 6.663 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -18.900 -3.620 5.908 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -17.507 -3.484 6.963 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -15.181 -3.489 5.909 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -18.745 -3.042 3.616 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -13.874 -2.519 4.071 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -17.436 -2.079 1.771 1.00 0.00 H new ATOM 0 HZ PHE A 131 -14.996 -1.815 1.997 1.00 0.00 H new ATOM 2051 N GLY A 132 -18.803 -6.179 8.171 1.00 0.00 N ATOM 2052 CA GLY A 132 -19.874 -6.691 8.998 1.00 0.00 C ATOM 2053 C GLY A 132 -20.798 -5.590 9.460 1.00 0.00 C ATOM 2054 O GLY A 132 -22.012 -5.777 9.553 1.00 0.00 O ATOM 0 H GLY A 132 -17.929 -5.999 8.666 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -20.443 -7.433 8.438 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -19.453 -7.200 9.865 1.00 0.00 H new ATOM 2058 N GLU A 133 -20.208 -4.435 9.733 1.00 0.00 N ATOM 2059 CA GLU A 133 -20.962 -3.269 10.176 1.00 0.00 C ATOM 2060 C GLU A 133 -20.261 -1.987 9.755 1.00 0.00 C ATOM 2061 O GLU A 133 -19.048 -1.967 9.564 1.00 0.00 O ATOM 2062 CB GLU A 133 -21.142 -3.286 11.698 1.00 0.00 C ATOM 2063 CG GLU A 133 -22.570 -3.008 12.137 1.00 0.00 C ATOM 2064 CD GLU A 133 -22.996 -3.847 13.326 1.00 0.00 C ATOM 2065 OE1 GLU A 133 -22.260 -3.869 14.335 1.00 0.00 O ATOM 2066 OE2 GLU A 133 -24.068 -4.481 13.248 1.00 0.00 O ATOM 0 H GLU A 133 -19.203 -4.279 9.655 1.00 0.00 H new ATOM 0 HA GLU A 133 -21.945 -3.306 9.706 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -20.834 -4.258 12.083 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -20.481 -2.543 12.144 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -22.668 -1.952 12.390 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -23.245 -3.200 11.303 1.00 0.00 H new ATOM 2073 N TRP A 134 -21.028 -0.916 9.605 1.00 0.00 N ATOM 2074 CA TRP A 134 -20.462 0.360 9.205 1.00 0.00 C ATOM 2075 C TRP A 134 -21.023 1.499 10.050 1.00 0.00 C ATOM 2076 O TRP A 134 -22.012 1.328 10.762 1.00 0.00 O ATOM 2077 CB TRP A 134 -20.725 0.615 7.723 1.00 0.00 C ATOM 2078 CG TRP A 134 -22.178 0.667 7.363 1.00 0.00 C ATOM 2079 CD1 TRP A 134 -22.890 -0.275 6.674 1.00 0.00 C ATOM 2080 CD2 TRP A 134 -23.100 1.717 7.675 1.00 0.00 C ATOM 2081 NE1 TRP A 134 -24.190 0.146 6.515 1.00 0.00 N ATOM 2082 CE2 TRP A 134 -24.339 1.361 7.124 1.00 0.00 C ATOM 2083 CE3 TRP A 134 -22.995 2.927 8.357 1.00 0.00 C ATOM 2084 CZ2 TRP A 134 -25.465 2.174 7.234 1.00 0.00 C ATOM 2085 CZ3 TRP A 134 -24.110 3.729 8.472 1.00 0.00 C ATOM 2086 CH2 TRP A 134 -25.329 3.352 7.912 1.00 0.00 C ATOM 0 H TRP A 134 -22.037 -0.907 9.754 1.00 0.00 H new ATOM 0 HA TRP A 134 -19.385 0.319 9.369 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -20.257 1.557 7.438 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -20.244 -0.170 7.139 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -22.491 -1.210 6.309 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -24.923 -0.365 6.023 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -22.054 3.232 8.789 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -26.410 1.884 6.799 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -24.038 4.665 9.005 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -26.183 4.004 8.016 1.00 0.00 H new ATOM 2097 N SER A 135 -20.383 2.664 9.961 1.00 0.00 N ATOM 2098 CA SER A 135 -20.813 3.840 10.715 1.00 0.00 C ATOM 2099 C SER A 135 -20.246 5.124 10.125 1.00 0.00 C ATOM 2100 O SER A 135 -19.277 5.107 9.370 1.00 0.00 O ATOM 2101 CB SER A 135 -20.383 3.750 12.180 1.00 0.00 C ATOM 2102 OG SER A 135 -20.658 4.963 12.864 1.00 0.00 O ATOM 0 H SER A 135 -19.564 2.819 9.373 1.00 0.00 H new ATOM 0 HA SER A 135 -21.901 3.863 10.652 1.00 0.00 H new ATOM 0 HB2 SER A 135 -20.906 2.927 12.667 1.00 0.00 H new ATOM 0 HB3 SER A 135 -19.317 3.529 12.237 1.00 0.00 H new ATOM 0 HG SER A 135 -20.377 4.882 13.799 1.00 0.00 H new ATOM 2108 N TRP A 136 -20.847 6.239 10.516 1.00 0.00 N ATOM 2109 CA TRP A 136 -20.401 7.557 10.072 1.00 0.00 C ATOM 2110 C TRP A 136 -19.787 8.293 11.246 1.00 0.00 C ATOM 2111 O TRP A 136 -20.482 8.708 12.173 1.00 0.00 O ATOM 2112 CB TRP A 136 -21.561 8.363 9.481 1.00 0.00 C ATOM 2113 CG TRP A 136 -22.236 7.689 8.325 1.00 0.00 C ATOM 2114 CD1 TRP A 136 -23.263 6.799 8.400 1.00 0.00 C ATOM 2115 CD2 TRP A 136 -21.946 7.851 6.927 1.00 0.00 C ATOM 2116 NE1 TRP A 136 -23.635 6.397 7.141 1.00 0.00 N ATOM 2117 CE2 TRP A 136 -22.842 7.025 6.220 1.00 0.00 C ATOM 2118 CE3 TRP A 136 -21.019 8.610 6.200 1.00 0.00 C ATOM 2119 CZ2 TRP A 136 -22.838 6.940 4.828 1.00 0.00 C ATOM 2120 CZ3 TRP A 136 -21.018 8.521 4.822 1.00 0.00 C ATOM 2121 CH2 TRP A 136 -21.920 7.692 4.147 1.00 0.00 C ATOM 0 H TRP A 136 -21.650 6.259 11.144 1.00 0.00 H new ATOM 0 HA TRP A 136 -19.655 7.433 9.287 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -22.298 8.549 10.262 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -21.188 9.335 9.157 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -23.719 6.458 9.318 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -24.382 5.737 6.927 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -20.317 9.254 6.709 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -23.536 6.302 4.305 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -20.307 9.103 4.254 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -21.891 7.645 3.068 1.00 0.00 H new ATOM 2132 N VAL A 137 -18.479 8.433 11.206 1.00 0.00 N ATOM 2133 CA VAL A 137 -17.749 9.094 12.264 1.00 0.00 C ATOM 2134 C VAL A 137 -16.946 10.249 11.693 1.00 0.00 C ATOM 2135 O VAL A 137 -16.877 10.409 10.480 1.00 0.00 O ATOM 2136 CB VAL A 137 -16.820 8.096 12.984 1.00 0.00 C ATOM 2137 CG1 VAL A 137 -17.632 6.967 13.614 1.00 0.00 C ATOM 2138 CG2 VAL A 137 -15.783 7.534 12.020 1.00 0.00 C ATOM 0 H VAL A 137 -17.895 8.093 10.442 1.00 0.00 H new ATOM 0 HA VAL A 137 -18.460 9.484 12.992 1.00 0.00 H new ATOM 0 HB VAL A 137 -16.296 8.629 13.778 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -16.960 6.272 14.118 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -18.333 7.383 14.338 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -18.184 6.438 12.837 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -15.138 6.832 12.548 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -16.288 7.019 11.203 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -15.181 8.349 11.618 1.00 0.00 H new ATOM 2148 N THR A 138 -16.319 11.039 12.549 1.00 0.00 N ATOM 2149 CA THR A 138 -15.509 12.148 12.071 1.00 0.00 C ATOM 2150 C THR A 138 -14.224 11.623 11.462 1.00 0.00 C ATOM 2151 O THR A 138 -13.927 10.431 11.564 1.00 0.00 O ATOM 2152 CB THR A 138 -15.196 13.126 13.201 1.00 0.00 C ATOM 2153 OG1 THR A 138 -14.196 12.602 14.060 1.00 0.00 O ATOM 2154 CG2 THR A 138 -16.405 13.462 14.030 1.00 0.00 C ATOM 0 H THR A 138 -16.353 10.936 13.563 1.00 0.00 H new ATOM 0 HA THR A 138 -16.075 12.683 11.309 1.00 0.00 H new ATOM 0 HB THR A 138 -14.844 14.037 12.718 1.00 0.00 H new ATOM 0 HG1 THR A 138 -14.010 13.245 14.776 1.00 0.00 H new ATOM 0 HG21 THR A 138 -16.123 14.161 14.818 1.00 0.00 H new ATOM 0 HG22 THR A 138 -17.166 13.918 13.396 1.00 0.00 H new ATOM 0 HG23 THR A 138 -16.804 12.552 14.478 1.00 0.00 H new ATOM 2162 N PRO A 139 -13.431 12.498 10.834 1.00 0.00 N ATOM 2163 CA PRO A 139 -12.173 12.086 10.235 1.00 0.00 C ATOM 2164 C PRO A 139 -11.234 11.540 11.301 1.00 0.00 C ATOM 2165 O PRO A 139 -10.770 10.407 11.210 1.00 0.00 O ATOM 2166 CB PRO A 139 -11.612 13.365 9.595 1.00 0.00 C ATOM 2167 CG PRO A 139 -12.723 14.367 9.613 1.00 0.00 C ATOM 2168 CD PRO A 139 -13.690 13.939 10.687 1.00 0.00 C ATOM 0 HA PRO A 139 -12.296 11.289 9.502 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -10.749 13.732 10.151 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -11.277 13.175 8.575 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -12.337 15.366 9.818 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -13.219 14.410 8.643 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -13.515 14.475 11.620 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -14.723 14.133 10.397 1.00 0.00 H new ATOM 2176 N GLU A 140 -10.986 12.347 12.325 1.00 0.00 N ATOM 2177 CA GLU A 140 -10.125 11.943 13.430 1.00 0.00 C ATOM 2178 C GLU A 140 -10.717 10.746 14.180 1.00 0.00 C ATOM 2179 O GLU A 140 -9.983 9.912 14.707 1.00 0.00 O ATOM 2180 CB GLU A 140 -9.903 13.115 14.385 1.00 0.00 C ATOM 2181 CG GLU A 140 -8.505 13.706 14.294 1.00 0.00 C ATOM 2182 CD GLU A 140 -8.489 15.198 14.560 1.00 0.00 C ATOM 2183 OE1 GLU A 140 -9.469 15.880 14.186 1.00 0.00 O ATOM 2184 OE2 GLU A 140 -7.498 15.687 15.139 1.00 0.00 O ATOM 0 H GLU A 140 -11.370 13.288 12.413 1.00 0.00 H new ATOM 0 HA GLU A 140 -9.163 11.639 13.017 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -10.634 13.894 14.170 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -10.084 12.782 15.407 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -7.855 13.205 15.011 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -8.096 13.512 13.303 1.00 0.00 H new ATOM 2191 N GLN A 141 -12.048 10.656 14.206 1.00 0.00 N ATOM 2192 CA GLN A 141 -12.725 9.543 14.875 1.00 0.00 C ATOM 2193 C GLN A 141 -12.507 8.258 14.101 1.00 0.00 C ATOM 2194 O GLN A 141 -12.132 7.233 14.671 1.00 0.00 O ATOM 2195 CB GLN A 141 -14.226 9.806 15.032 1.00 0.00 C ATOM 2196 CG GLN A 141 -14.605 10.448 16.359 1.00 0.00 C ATOM 2197 CD GLN A 141 -16.108 10.502 16.573 1.00 0.00 C ATOM 2198 OE1 GLN A 141 -16.846 9.645 16.089 1.00 0.00 O ATOM 2199 NE2 GLN A 141 -16.567 11.509 17.306 1.00 0.00 N ATOM 0 H GLN A 141 -12.675 11.335 13.775 1.00 0.00 H new ATOM 0 HA GLN A 141 -12.294 9.446 15.872 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -14.559 10.452 14.219 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -14.763 8.863 14.930 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -14.146 9.888 17.174 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -14.199 11.459 16.398 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -15.919 12.198 17.688 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -17.567 11.594 17.487 1.00 0.00 H new ATOM 2208 N LEU A 142 -12.731 8.320 12.794 1.00 0.00 N ATOM 2209 CA LEU A 142 -12.543 7.154 11.948 1.00 0.00 C ATOM 2210 C LEU A 142 -11.139 6.607 12.142 1.00 0.00 C ATOM 2211 O LEU A 142 -10.935 5.399 12.223 1.00 0.00 O ATOM 2212 CB LEU A 142 -12.758 7.526 10.478 1.00 0.00 C ATOM 2213 CG LEU A 142 -12.452 6.410 9.475 1.00 0.00 C ATOM 2214 CD1 LEU A 142 -13.724 5.966 8.781 1.00 0.00 C ATOM 2215 CD2 LEU A 142 -11.418 6.863 8.453 1.00 0.00 C ATOM 0 H LEU A 142 -13.040 9.159 12.303 1.00 0.00 H new ATOM 0 HA LEU A 142 -13.271 6.392 12.226 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -13.794 7.838 10.346 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -12.133 8.387 10.242 1.00 0.00 H new ATOM 0 HG LEU A 142 -12.036 5.564 10.022 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -13.493 5.172 8.071 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -14.432 5.595 9.522 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -14.163 6.811 8.251 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -11.219 6.052 7.753 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -11.799 7.727 7.909 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -10.495 7.135 8.965 1.00 0.00 H new ATOM 2227 N ILE A 143 -10.175 7.510 12.232 1.00 0.00 N ATOM 2228 CA ILE A 143 -8.788 7.114 12.433 1.00 0.00 C ATOM 2229 C ILE A 143 -8.626 6.332 13.740 1.00 0.00 C ATOM 2230 O ILE A 143 -7.842 5.387 13.819 1.00 0.00 O ATOM 2231 CB ILE A 143 -7.855 8.336 12.445 1.00 0.00 C ATOM 2232 CG1 ILE A 143 -8.032 9.143 11.156 1.00 0.00 C ATOM 2233 CG2 ILE A 143 -6.407 7.897 12.623 1.00 0.00 C ATOM 2234 CD1 ILE A 143 -7.536 8.431 9.916 1.00 0.00 C ATOM 0 H ILE A 143 -10.325 8.517 12.170 1.00 0.00 H new ATOM 0 HA ILE A 143 -8.511 6.471 11.597 1.00 0.00 H new ATOM 0 HB ILE A 143 -8.117 8.975 13.288 1.00 0.00 H new ATOM 0 HG12 ILE A 143 -9.088 9.380 11.029 1.00 0.00 H new ATOM 0 HG13 ILE A 143 -7.502 10.090 11.256 1.00 0.00 H new ATOM 0 HG21 ILE A 143 -5.759 8.774 12.629 1.00 0.00 H new ATOM 0 HG22 ILE A 143 -6.302 7.362 13.567 1.00 0.00 H new ATOM 0 HG23 ILE A 143 -6.122 7.241 11.800 1.00 0.00 H new ATOM 0 HD11 ILE A 143 -7.695 9.065 9.044 1.00 0.00 H new ATOM 0 HD12 ILE A 143 -6.472 8.218 10.020 1.00 0.00 H new ATOM 0 HD13 ILE A 143 -8.083 7.497 9.790 1.00 0.00 H new ATOM 2246 N ASP A 144 -9.373 6.732 14.765 1.00 0.00 N ATOM 2247 CA ASP A 144 -9.314 6.064 16.062 1.00 0.00 C ATOM 2248 C ASP A 144 -9.942 4.683 15.993 1.00 0.00 C ATOM 2249 O ASP A 144 -9.345 3.686 16.398 1.00 0.00 O ATOM 2250 CB ASP A 144 -10.024 6.904 17.123 1.00 0.00 C ATOM 2251 CG ASP A 144 -9.106 7.282 18.265 1.00 0.00 C ATOM 2252 OD1 ASP A 144 -8.180 6.499 18.564 1.00 0.00 O ATOM 2253 OD2 ASP A 144 -9.309 8.362 18.860 1.00 0.00 O ATOM 0 H ASP A 144 -10.026 7.515 14.723 1.00 0.00 H new ATOM 0 HA ASP A 144 -8.265 5.952 16.336 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -10.419 7.809 16.662 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -10.876 6.348 17.514 1.00 0.00 H new ATOM 2258 N LEU A 145 -11.160 4.640 15.489 1.00 0.00 N ATOM 2259 CA LEU A 145 -11.899 3.393 15.368 1.00 0.00 C ATOM 2260 C LEU A 145 -11.317 2.491 14.284 1.00 0.00 C ATOM 2261 O LEU A 145 -11.505 1.273 14.325 1.00 0.00 O ATOM 2262 CB LEU A 145 -13.367 3.674 15.049 1.00 0.00 C ATOM 2263 CG LEU A 145 -14.221 4.093 16.242 1.00 0.00 C ATOM 2264 CD1 LEU A 145 -14.480 5.590 16.202 1.00 0.00 C ATOM 2265 CD2 LEU A 145 -15.534 3.317 16.263 1.00 0.00 C ATOM 0 H LEU A 145 -11.664 5.461 15.153 1.00 0.00 H new ATOM 0 HA LEU A 145 -11.818 2.878 16.325 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -13.415 4.459 14.294 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -13.804 2.779 14.606 1.00 0.00 H new ATOM 0 HG LEU A 145 -13.677 3.861 17.158 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -15.090 5.877 17.058 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -13.531 6.125 16.238 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -15.005 5.844 15.281 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -16.128 3.631 17.121 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -16.089 3.515 15.346 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -15.325 2.250 16.337 1.00 0.00 H new ATOM 2277 N THR A 146 -10.632 3.077 13.303 1.00 0.00 N ATOM 2278 CA THR A 146 -10.069 2.284 12.213 1.00 0.00 C ATOM 2279 C THR A 146 -8.882 1.456 12.672 1.00 0.00 C ATOM 2280 O THR A 146 -8.368 1.625 13.778 1.00 0.00 O ATOM 2281 CB THR A 146 -9.671 3.154 11.011 1.00 0.00 C ATOM 2282 OG1 THR A 146 -9.512 2.357 9.845 1.00 0.00 O ATOM 2283 CG2 THR A 146 -8.387 3.933 11.207 1.00 0.00 C ATOM 0 H THR A 146 -10.456 4.080 13.240 1.00 0.00 H new ATOM 0 HA THR A 146 -10.859 1.605 11.892 1.00 0.00 H new ATOM 0 HB THR A 146 -10.488 3.868 10.904 1.00 0.00 H new ATOM 0 HG1 THR A 146 -10.172 1.633 9.851 1.00 0.00 H new ATOM 0 HG21 THR A 146 -8.178 4.521 10.313 1.00 0.00 H new ATOM 0 HG22 THR A 146 -8.493 4.600 12.063 1.00 0.00 H new ATOM 0 HG23 THR A 146 -7.565 3.240 11.386 1.00 0.00 H new ATOM 2291 N VAL A 147 -8.461 0.555 11.799 1.00 0.00 N ATOM 2292 CA VAL A 147 -7.341 -0.329 12.074 1.00 0.00 C ATOM 2293 C VAL A 147 -6.018 0.427 11.986 1.00 0.00 C ATOM 2294 O VAL A 147 -5.918 1.447 11.301 1.00 0.00 O ATOM 2295 CB VAL A 147 -7.346 -1.509 11.078 1.00 0.00 C ATOM 2296 CG1 VAL A 147 -8.631 -2.299 11.221 1.00 0.00 C ATOM 2297 CG2 VAL A 147 -7.188 -1.005 9.651 1.00 0.00 C ATOM 0 H VAL A 147 -8.885 0.416 10.882 1.00 0.00 H new ATOM 0 HA VAL A 147 -7.446 -0.715 13.088 1.00 0.00 H new ATOM 0 HB VAL A 147 -6.503 -2.162 11.304 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -8.628 -3.130 10.515 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -8.709 -2.686 12.237 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -9.482 -1.650 11.014 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -7.194 -1.851 8.964 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -8.013 -0.335 9.408 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -6.244 -0.468 9.557 1.00 0.00 H new ATOM 2307 N GLU A 148 -5.007 -0.073 12.690 1.00 0.00 N ATOM 2308 CA GLU A 148 -3.691 0.560 12.694 1.00 0.00 C ATOM 2309 C GLU A 148 -3.093 0.594 11.287 1.00 0.00 C ATOM 2310 O GLU A 148 -2.705 1.649 10.794 1.00 0.00 O ATOM 2311 CB GLU A 148 -2.740 -0.187 13.640 1.00 0.00 C ATOM 2312 CG GLU A 148 -2.506 0.519 14.968 1.00 0.00 C ATOM 2313 CD GLU A 148 -2.562 -0.428 16.151 1.00 0.00 C ATOM 2314 OE1 GLU A 148 -1.581 -1.170 16.368 1.00 0.00 O ATOM 2315 OE2 GLU A 148 -3.585 -0.421 16.869 1.00 0.00 O ATOM 0 H GLU A 148 -5.073 -0.913 13.264 1.00 0.00 H new ATOM 0 HA GLU A 148 -3.816 1.585 13.044 1.00 0.00 H new ATOM 0 HB2 GLU A 148 -3.144 -1.180 13.835 1.00 0.00 H new ATOM 0 HB3 GLU A 148 -1.781 -0.325 13.140 1.00 0.00 H new ATOM 0 HG2 GLU A 148 -1.534 1.011 14.947 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -3.255 1.300 15.097 1.00 0.00 H new ATOM 2322 N PHE A 149 -3.010 -0.575 10.652 1.00 0.00 N ATOM 2323 CA PHE A 149 -2.440 -0.683 9.308 1.00 0.00 C ATOM 2324 C PHE A 149 -3.140 0.203 8.267 1.00 0.00 C ATOM 2325 O PHE A 149 -2.757 0.193 7.096 1.00 0.00 O ATOM 2326 CB PHE A 149 -2.414 -2.143 8.846 1.00 0.00 C ATOM 2327 CG PHE A 149 -3.759 -2.786 8.671 1.00 0.00 C ATOM 2328 CD1 PHE A 149 -4.453 -3.289 9.759 1.00 0.00 C ATOM 2329 CD2 PHE A 149 -4.314 -2.917 7.409 1.00 0.00 C ATOM 2330 CE1 PHE A 149 -5.674 -3.910 9.591 1.00 0.00 C ATOM 2331 CE2 PHE A 149 -5.536 -3.531 7.235 1.00 0.00 C ATOM 2332 CZ PHE A 149 -6.217 -4.033 8.327 1.00 0.00 C ATOM 0 H PHE A 149 -3.330 -1.460 11.046 1.00 0.00 H new ATOM 0 HA PHE A 149 -1.419 -0.310 9.384 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -1.878 -2.197 7.898 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -1.843 -2.725 9.569 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -4.034 -3.194 10.750 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -3.783 -2.533 6.550 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -6.205 -4.300 10.447 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -5.960 -3.619 6.246 1.00 0.00 H new ATOM 0 HZ PHE A 149 -7.171 -4.520 8.193 1.00 0.00 H new ATOM 2342 N LYS A 150 -4.154 0.968 8.673 1.00 0.00 N ATOM 2343 CA LYS A 150 -4.864 1.840 7.736 1.00 0.00 C ATOM 2344 C LYS A 150 -5.069 3.245 8.308 1.00 0.00 C ATOM 2345 O LYS A 150 -5.520 4.145 7.602 1.00 0.00 O ATOM 2346 CB LYS A 150 -6.222 1.239 7.379 1.00 0.00 C ATOM 2347 CG LYS A 150 -6.136 -0.144 6.755 1.00 0.00 C ATOM 2348 CD LYS A 150 -6.344 -0.092 5.250 1.00 0.00 C ATOM 2349 CE LYS A 150 -6.658 -1.465 4.683 1.00 0.00 C ATOM 2350 NZ LYS A 150 -7.617 -1.395 3.547 1.00 0.00 N ATOM 0 H LYS A 150 -4.499 1.002 9.632 1.00 0.00 H new ATOM 0 HA LYS A 150 -4.247 1.922 6.841 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -6.832 1.183 8.280 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -6.735 1.908 6.688 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -5.162 -0.583 6.974 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -6.887 -0.794 7.205 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -7.159 0.594 5.018 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -5.448 0.304 4.771 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -5.735 -1.939 4.349 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -7.073 -2.095 5.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -7.803 -2.354 3.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -8.508 -0.967 3.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -7.211 -0.815 2.785 1.00 0.00 H new ATOM 2364 N LYS A 151 -4.737 3.427 9.580 1.00 0.00 N ATOM 2365 CA LYS A 151 -4.888 4.726 10.232 1.00 0.00 C ATOM 2366 C LYS A 151 -4.015 5.789 9.561 1.00 0.00 C ATOM 2367 O LYS A 151 -4.530 6.789 9.063 1.00 0.00 O ATOM 2368 CB LYS A 151 -4.546 4.600 11.724 1.00 0.00 C ATOM 2369 CG LYS A 151 -3.872 5.825 12.325 1.00 0.00 C ATOM 2370 CD LYS A 151 -3.872 5.766 13.844 1.00 0.00 C ATOM 2371 CE LYS A 151 -2.961 4.661 14.359 1.00 0.00 C ATOM 2372 NZ LYS A 151 -1.836 5.205 15.168 1.00 0.00 N ATOM 0 H LYS A 151 -4.362 2.694 10.182 1.00 0.00 H new ATOM 0 HA LYS A 151 -5.925 5.046 10.132 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -5.463 4.398 12.278 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -3.893 3.738 11.862 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -2.847 5.894 11.962 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -4.388 6.726 11.994 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -3.546 6.725 14.246 1.00 0.00 H new ATOM 0 HD3 LYS A 151 -4.888 5.599 14.203 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -3.541 3.964 14.965 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -2.563 4.096 13.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 -1.238 4.422 15.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 -1.268 5.850 14.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 -2.215 5.723 15.986 1.00 0.00 H new ATOM 2386 N PRO A 152 -2.683 5.582 9.524 1.00 0.00 N ATOM 2387 CA PRO A 152 -1.760 6.530 8.897 1.00 0.00 C ATOM 2388 C PRO A 152 -2.086 6.728 7.422 1.00 0.00 C ATOM 2389 O PRO A 152 -1.848 7.798 6.859 1.00 0.00 O ATOM 2390 CB PRO A 152 -0.381 5.879 9.066 1.00 0.00 C ATOM 2391 CG PRO A 152 -0.662 4.443 9.338 1.00 0.00 C ATOM 2392 CD PRO A 152 -1.975 4.408 10.066 1.00 0.00 C ATOM 0 HA PRO A 152 -1.817 7.520 9.349 1.00 0.00 H new ATOM 0 HB2 PRO A 152 0.225 5.999 8.168 1.00 0.00 H new ATOM 0 HB3 PRO A 152 0.172 6.335 9.887 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -0.715 3.873 8.410 1.00 0.00 H new ATOM 0 HG3 PRO A 152 0.130 3.998 9.940 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -2.519 3.483 9.873 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -1.841 4.480 11.145 1.00 0.00 H new ATOM 2400 N VAL A 153 -2.659 5.697 6.808 1.00 0.00 N ATOM 2401 CA VAL A 153 -3.049 5.775 5.410 1.00 0.00 C ATOM 2402 C VAL A 153 -4.211 6.744 5.274 1.00 0.00 C ATOM 2403 O VAL A 153 -4.177 7.668 4.462 1.00 0.00 O ATOM 2404 CB VAL A 153 -3.460 4.397 4.852 1.00 0.00 C ATOM 2405 CG1 VAL A 153 -3.697 4.479 3.350 1.00 0.00 C ATOM 2406 CG2 VAL A 153 -2.401 3.354 5.175 1.00 0.00 C ATOM 0 H VAL A 153 -2.861 4.803 7.256 1.00 0.00 H new ATOM 0 HA VAL A 153 -2.190 6.123 4.836 1.00 0.00 H new ATOM 0 HB VAL A 153 -4.393 4.095 5.328 1.00 0.00 H new ATOM 0 HG11 VAL A 153 -3.986 3.498 2.973 1.00 0.00 H new ATOM 0 HG12 VAL A 153 -4.493 5.195 3.146 1.00 0.00 H new ATOM 0 HG13 VAL A 153 -2.782 4.803 2.854 1.00 0.00 H new ATOM 0 HG21 VAL A 153 -2.707 2.388 4.774 1.00 0.00 H new ATOM 0 HG22 VAL A 153 -1.452 3.648 4.727 1.00 0.00 H new ATOM 0 HG23 VAL A 153 -2.284 3.277 6.256 1.00 0.00 H new ATOM 2416 N TYR A 154 -5.233 6.536 6.100 1.00 0.00 N ATOM 2417 CA TYR A 154 -6.406 7.397 6.106 1.00 0.00 C ATOM 2418 C TYR A 154 -6.021 8.794 6.579 1.00 0.00 C ATOM 2419 O TYR A 154 -6.516 9.801 6.071 1.00 0.00 O ATOM 2420 CB TYR A 154 -7.466 6.808 7.039 1.00 0.00 C ATOM 2421 CG TYR A 154 -7.998 5.457 6.608 1.00 0.00 C ATOM 2422 CD1 TYR A 154 -7.507 4.809 5.477 1.00 0.00 C ATOM 2423 CD2 TYR A 154 -8.997 4.827 7.337 1.00 0.00 C ATOM 2424 CE1 TYR A 154 -7.997 3.577 5.093 1.00 0.00 C ATOM 2425 CE2 TYR A 154 -9.491 3.599 6.957 1.00 0.00 C ATOM 2426 CZ TYR A 154 -8.989 2.976 5.836 1.00 0.00 C ATOM 2427 OH TYR A 154 -9.483 1.752 5.451 1.00 0.00 O ATOM 0 H TYR A 154 -5.269 5.773 6.776 1.00 0.00 H new ATOM 0 HA TYR A 154 -6.810 7.463 5.096 1.00 0.00 H new ATOM 0 HB2 TYR A 154 -7.042 6.716 8.039 1.00 0.00 H new ATOM 0 HB3 TYR A 154 -8.299 7.507 7.110 1.00 0.00 H new ATOM 0 HD1 TYR A 154 -6.730 5.278 4.891 1.00 0.00 H new ATOM 0 HD2 TYR A 154 -9.394 5.309 8.218 1.00 0.00 H new ATOM 0 HE1 TYR A 154 -7.605 3.087 4.214 1.00 0.00 H new ATOM 0 HE2 TYR A 154 -10.270 3.126 7.536 1.00 0.00 H new ATOM 0 HH TYR A 154 -9.210 1.565 4.529 1.00 0.00 H new ATOM 2437 N LYS A 155 -5.122 8.831 7.555 1.00 0.00 N ATOM 2438 CA LYS A 155 -4.632 10.086 8.116 1.00 0.00 C ATOM 2439 C LYS A 155 -4.050 10.961 7.024 1.00 0.00 C ATOM 2440 O LYS A 155 -4.302 12.163 6.972 1.00 0.00 O ATOM 2441 CB LYS A 155 -3.565 9.793 9.169 1.00 0.00 C ATOM 2442 CG LYS A 155 -3.740 10.551 10.476 1.00 0.00 C ATOM 2443 CD LYS A 155 -5.161 10.454 10.995 1.00 0.00 C ATOM 2444 CE LYS A 155 -5.297 11.082 12.367 1.00 0.00 C ATOM 2445 NZ LYS A 155 -5.110 12.555 12.311 1.00 0.00 N ATOM 0 H LYS A 155 -4.714 7.998 7.978 1.00 0.00 H new ATOM 0 HA LYS A 155 -5.465 10.615 8.579 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -3.567 8.724 9.381 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -2.587 10.034 8.753 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -3.052 10.153 11.222 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -3.478 11.598 10.327 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -5.838 10.949 10.299 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -5.461 9.407 11.042 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -6.281 10.854 12.777 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -4.561 10.646 13.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -5.309 12.966 13.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -4.129 12.770 12.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -5.761 12.961 11.609 1.00 0.00 H new ATOM 2459 N GLU A 156 -3.283 10.340 6.145 1.00 0.00 N ATOM 2460 CA GLU A 156 -2.679 11.050 5.040 1.00 0.00 C ATOM 2461 C GLU A 156 -3.774 11.479 4.092 1.00 0.00 C ATOM 2462 O GLU A 156 -3.717 12.551 3.493 1.00 0.00 O ATOM 2463 CB GLU A 156 -1.663 10.161 4.320 1.00 0.00 C ATOM 2464 CG GLU A 156 -0.957 10.858 3.175 1.00 0.00 C ATOM 2465 CD GLU A 156 0.518 11.084 3.448 1.00 0.00 C ATOM 2466 OE1 GLU A 156 1.154 10.192 4.048 1.00 0.00 O ATOM 2467 OE2 GLU A 156 1.039 12.150 3.058 1.00 0.00 O ATOM 0 H GLU A 156 -3.066 9.344 6.178 1.00 0.00 H new ATOM 0 HA GLU A 156 -2.147 11.926 5.411 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -0.920 9.816 5.039 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -2.172 9.276 3.938 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -1.068 10.262 2.269 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -1.439 11.817 2.987 1.00 0.00 H new ATOM 2474 N VAL A 157 -4.791 10.638 3.990 1.00 0.00 N ATOM 2475 CA VAL A 157 -5.924 10.934 3.149 1.00 0.00 C ATOM 2476 C VAL A 157 -6.673 12.141 3.705 1.00 0.00 C ATOM 2477 O VAL A 157 -7.116 13.011 2.959 1.00 0.00 O ATOM 2478 CB VAL A 157 -6.882 9.732 3.052 1.00 0.00 C ATOM 2479 CG1 VAL A 157 -8.041 10.050 2.130 1.00 0.00 C ATOM 2480 CG2 VAL A 157 -6.146 8.483 2.585 1.00 0.00 C ATOM 0 H VAL A 157 -4.849 9.746 4.482 1.00 0.00 H new ATOM 0 HA VAL A 157 -5.554 11.154 2.148 1.00 0.00 H new ATOM 0 HB VAL A 157 -7.279 9.533 4.047 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -8.708 9.189 2.073 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -8.589 10.909 2.517 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -7.661 10.281 1.135 1.00 0.00 H new ATOM 0 HG21 VAL A 157 -6.846 7.649 2.525 1.00 0.00 H new ATOM 0 HG22 VAL A 157 -5.711 8.663 1.602 1.00 0.00 H new ATOM 0 HG23 VAL A 157 -5.354 8.241 3.293 1.00 0.00 H new ATOM 2490 N LEU A 158 -6.809 12.179 5.030 1.00 0.00 N ATOM 2491 CA LEU A 158 -7.506 13.276 5.698 1.00 0.00 C ATOM 2492 C LEU A 158 -6.769 14.592 5.480 1.00 0.00 C ATOM 2493 O LEU A 158 -7.382 15.611 5.158 1.00 0.00 O ATOM 2494 CB LEU A 158 -7.636 12.990 7.198 1.00 0.00 C ATOM 2495 CG LEU A 158 -8.606 11.863 7.570 1.00 0.00 C ATOM 2496 CD1 LEU A 158 -8.756 11.763 9.083 1.00 0.00 C ATOM 2497 CD2 LEU A 158 -9.958 12.087 6.914 1.00 0.00 C ATOM 0 H LEU A 158 -6.446 11.464 5.661 1.00 0.00 H new ATOM 0 HA LEU A 158 -8.504 13.360 5.267 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -6.650 12.742 7.590 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -7.958 13.903 7.698 1.00 0.00 H new ATOM 0 HG LEU A 158 -8.197 10.922 7.203 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -9.448 10.957 9.328 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -7.785 11.555 9.532 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -9.142 12.705 9.473 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -10.634 11.278 7.189 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -10.373 13.037 7.251 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -9.838 12.107 5.831 1.00 0.00 H new ATOM 2509 N SER A 159 -5.446 14.565 5.643 1.00 0.00 N ATOM 2510 CA SER A 159 -4.632 15.760 5.445 1.00 0.00 C ATOM 2511 C SER A 159 -4.909 16.343 4.067 1.00 0.00 C ATOM 2512 O SER A 159 -5.020 17.556 3.901 1.00 0.00 O ATOM 2513 CB SER A 159 -3.142 15.442 5.604 1.00 0.00 C ATOM 2514 OG SER A 159 -2.342 16.551 5.231 1.00 0.00 O ATOM 0 H SER A 159 -4.920 13.733 5.910 1.00 0.00 H new ATOM 0 HA SER A 159 -4.898 16.494 6.205 1.00 0.00 H new ATOM 0 HB2 SER A 159 -2.933 15.170 6.639 1.00 0.00 H new ATOM 0 HB3 SER A 159 -2.883 14.580 4.990 1.00 0.00 H new ATOM 0 HG SER A 159 -1.395 16.324 5.343 1.00 0.00 H new ATOM 2520 N VAL A 160 -5.053 15.463 3.086 1.00 0.00 N ATOM 2521 CA VAL A 160 -5.361 15.892 1.736 1.00 0.00 C ATOM 2522 C VAL A 160 -6.768 16.473 1.701 1.00 0.00 C ATOM 2523 O VAL A 160 -7.031 17.479 1.046 1.00 0.00 O ATOM 2524 CB VAL A 160 -5.276 14.725 0.736 1.00 0.00 C ATOM 2525 CG1 VAL A 160 -5.601 15.199 -0.670 1.00 0.00 C ATOM 2526 CG2 VAL A 160 -3.902 14.083 0.776 1.00 0.00 C ATOM 0 H VAL A 160 -4.961 14.454 3.202 1.00 0.00 H new ATOM 0 HA VAL A 160 -4.627 16.644 1.447 1.00 0.00 H new ATOM 0 HB VAL A 160 -6.013 13.976 1.025 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -5.535 14.359 -1.361 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -6.611 15.609 -0.692 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -4.890 15.970 -0.967 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -3.864 13.261 0.062 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -3.146 14.824 0.517 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -3.707 13.702 1.779 1.00 0.00 H new ATOM 2536 N PHE A 161 -7.672 15.803 2.409 1.00 0.00 N ATOM 2537 CA PHE A 161 -9.066 16.212 2.479 1.00 0.00 C ATOM 2538 C PHE A 161 -9.290 17.337 3.481 1.00 0.00 C ATOM 2539 O PHE A 161 -10.427 17.741 3.721 1.00 0.00 O ATOM 2540 CB PHE A 161 -9.920 14.999 2.844 1.00 0.00 C ATOM 2541 CG PHE A 161 -9.919 13.929 1.787 1.00 0.00 C ATOM 2542 CD1 PHE A 161 -9.516 14.206 0.488 1.00 0.00 C ATOM 2543 CD2 PHE A 161 -10.306 12.640 2.097 1.00 0.00 C ATOM 2544 CE1 PHE A 161 -9.496 13.216 -0.476 1.00 0.00 C ATOM 2545 CE2 PHE A 161 -10.292 11.649 1.137 1.00 0.00 C ATOM 2546 CZ PHE A 161 -9.885 11.935 -0.150 1.00 0.00 C ATOM 0 H PHE A 161 -7.457 14.964 2.948 1.00 0.00 H new ATOM 0 HA PHE A 161 -9.356 16.599 1.502 1.00 0.00 H new ATOM 0 HB2 PHE A 161 -9.555 14.575 3.780 1.00 0.00 H new ATOM 0 HB3 PHE A 161 -10.945 15.325 3.020 1.00 0.00 H new ATOM 0 HD1 PHE A 161 -9.214 15.209 0.227 1.00 0.00 H new ATOM 0 HD2 PHE A 161 -10.623 12.405 3.102 1.00 0.00 H new ATOM 0 HE1 PHE A 161 -9.176 13.446 -1.482 1.00 0.00 H new ATOM 0 HE2 PHE A 161 -10.601 10.646 1.394 1.00 0.00 H new ATOM 0 HZ PHE A 161 -9.871 11.157 -0.899 1.00 0.00 H new ATOM 2556 N ALA A 162 -8.214 17.852 4.069 1.00 0.00 N ATOM 2557 CA ALA A 162 -8.338 18.933 5.035 1.00 0.00 C ATOM 2558 C ALA A 162 -9.025 20.141 4.404 1.00 0.00 C ATOM 2559 O ALA A 162 -10.019 20.642 4.934 1.00 0.00 O ATOM 2560 CB ALA A 162 -6.972 19.308 5.579 1.00 0.00 C ATOM 0 H ALA A 162 -7.258 17.541 3.895 1.00 0.00 H new ATOM 0 HA ALA A 162 -8.956 18.592 5.865 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -7.078 20.118 6.301 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -6.525 18.442 6.068 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -6.331 19.633 4.760 1.00 0.00 H new ATOM 2566 N PRO A 163 -8.524 20.614 3.248 1.00 0.00 N ATOM 2567 CA PRO A 163 -9.123 21.748 2.546 1.00 0.00 C ATOM 2568 C PRO A 163 -10.584 21.479 2.186 1.00 0.00 C ATOM 2569 O PRO A 163 -11.320 22.391 1.811 1.00 0.00 O ATOM 2570 CB PRO A 163 -8.274 21.887 1.274 1.00 0.00 C ATOM 2571 CG PRO A 163 -7.554 20.591 1.136 1.00 0.00 C ATOM 2572 CD PRO A 163 -7.357 20.075 2.532 1.00 0.00 C ATOM 0 HA PRO A 163 -9.130 22.650 3.158 1.00 0.00 H new ATOM 0 HB2 PRO A 163 -8.900 22.083 0.403 1.00 0.00 H new ATOM 0 HB3 PRO A 163 -7.574 22.718 1.358 1.00 0.00 H new ATOM 0 HG2 PRO A 163 -8.131 19.886 0.538 1.00 0.00 H new ATOM 0 HG3 PRO A 163 -6.597 20.728 0.632 1.00 0.00 H new ATOM 0 HD2 PRO A 163 -7.333 18.986 2.561 1.00 0.00 H new ATOM 0 HD3 PRO A 163 -6.420 20.426 2.964 1.00 0.00 H new ATOM 2580 N HIS A 164 -11.000 20.218 2.303 1.00 0.00 N ATOM 2581 CA HIS A 164 -12.369 19.829 1.989 1.00 0.00 C ATOM 2582 C HIS A 164 -13.155 19.507 3.259 1.00 0.00 C ATOM 2583 O HIS A 164 -14.385 19.508 3.253 1.00 0.00 O ATOM 2584 CB HIS A 164 -12.378 18.623 1.049 1.00 0.00 C ATOM 2585 CG HIS A 164 -11.625 18.859 -0.223 1.00 0.00 C ATOM 2586 ND1 HIS A 164 -12.034 19.761 -1.183 1.00 0.00 N ATOM 2587 CD2 HIS A 164 -10.477 18.312 -0.688 1.00 0.00 C ATOM 2588 CE1 HIS A 164 -11.171 19.755 -2.183 1.00 0.00 C ATOM 2589 NE2 HIS A 164 -10.217 18.885 -1.908 1.00 0.00 N ATOM 0 H HIS A 164 -10.405 19.450 2.614 1.00 0.00 H new ATOM 0 HA HIS A 164 -12.851 20.671 1.492 1.00 0.00 H new ATOM 0 HB2 HIS A 164 -11.946 17.765 1.565 1.00 0.00 H new ATOM 0 HB3 HIS A 164 -13.410 18.365 0.810 1.00 0.00 H new ATOM 0 HD2 HIS A 164 -9.877 17.564 -0.191 1.00 0.00 H new ATOM 0 HE1 HIS A 164 -11.235 20.360 -3.075 1.00 0.00 H new ATOM 0 HE2 HIS A 164 -9.417 18.673 -2.505 1.00 0.00 H new ATOM 2598 N LEU A 165 -12.444 19.235 4.348 1.00 0.00 N ATOM 2599 CA LEU A 165 -13.093 18.920 5.617 1.00 0.00 C ATOM 2600 C LEU A 165 -13.215 20.170 6.483 1.00 0.00 C ATOM 2601 O LEU A 165 -12.170 20.677 6.940 1.00 0.00 O ATOM 2602 CB LEU A 165 -12.307 17.844 6.370 1.00 0.00 C ATOM 2603 CG LEU A 165 -12.217 16.487 5.672 1.00 0.00 C ATOM 2604 CD1 LEU A 165 -11.351 15.531 6.475 1.00 0.00 C ATOM 2605 CD2 LEU A 165 -13.599 15.899 5.460 1.00 0.00 C ATOM 2606 OXT LEU A 165 -14.356 20.631 6.696 1.00 0.00 O ATOM 0 H LEU A 165 -11.425 19.226 4.379 1.00 0.00 H new ATOM 0 HA LEU A 165 -14.092 18.542 5.400 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -11.296 18.212 6.544 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -12.766 17.700 7.348 1.00 0.00 H new ATOM 0 HG LEU A 165 -11.755 16.636 4.696 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -11.298 14.570 5.963 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -10.347 15.945 6.574 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -11.785 15.391 7.465 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -13.511 14.933 4.962 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -14.090 15.767 6.424 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -14.191 16.574 4.841 1.00 0.00 H new