USER MOD reduce.3.24.130724 H: found=0, std=0, add=972, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 972 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 164 ASN : amide:sc= -0.569 K(o=-0.61,f=-4!) USER MOD Set 1.2: A 167 ASN : amide:sc= -0.0441 X(o=-0.61,f=-0.61) USER MOD Set 2.1: A 68 TYR OH : rot 41:sc= -0.319 USER MOD Set 2.2: A 157 HIS : no HD1:sc= -0.128 X(o=-0.45,f=-0.91) USER MOD Set 3.1: A 84 ASN : amide:sc= 0 X(o=0.26,f=0.014) USER MOD Set 3.2: A 138 LYS NZ :NH3+ -163:sc= 0.264 (180deg=0.0268) USER MOD Set 4.1: A 28 ASN : amide:sc= 0.196 K(o=-3.7,f=-10!) USER MOD Set 4.2: A 30 THR OG1 : rot 84:sc= 0.82 USER MOD Set 4.3: A 134 MET CE :methyl -144:sc= -4.8! (180deg=-7.28!) USER MOD Set 4.4: A 176 CYS SG : rot 52:sc= 0.125 USER MOD Set 5.1: A 126 CYS SG : rot 126:sc= 0.767 USER MOD Set 5.2: A 147 MET CE :methyl 176:sc= -0.0132 (180deg=0) USER MOD Set 6.1: A 85 SER OG : rot 180:sc= 0 USER MOD Set 6.2: A 89 ASN : amide:sc= -2.27! K(o=-2.3!,f=-1.5) USER MOD Set 7.1: A 19 SER OG : rot 180:sc= 0 USER MOD Set 7.2: A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl -176:sc= 0 (180deg=-0.0442) USER MOD Single : A 22 GLN : amide:sc= -0.603 K(o=-0.6,f=-2.2!) USER MOD Single : A 24 ASN : amide:sc= -0.676 K(o=-0.68,f=-0.17) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= 0.455 X(o=0.46,f=0) USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl 158:sc= -1.26 (180deg=-2.11!) USER MOD Single : A 82 THR OG1 : rot 170:sc= 0 USER MOD Single : A 91 MET CE :methyl 147:sc= -0.102 (180deg=-2.04) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 78:sc= 0.783 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -0.0383 X(o=-0.038,f=0) USER MOD Single : A 104 MET CE :methyl -128:sc= -0.119 (180deg=-3.02!) USER MOD Single : A 105 ASN : amide:sc= -0.919 K(o=-0.92,f=-3.7!) USER MOD Single : A 110 THR OG1 : rot 55:sc= 0.908 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 141 HIS : no HD1:sc= -1.02 X(o=-1,f=-0.62) USER MOD Single : A 142 THR OG1 : rot 48:sc= 0.0294 USER MOD Single : A 149 THR OG1 : rot -114:sc= 1.28 USER MOD Single : A 151 ASN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 152 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 156 CYS SG : rot 170:sc= -0.797 USER MOD Single : A 161 CYS SG : rot 180:sc= -1.05 USER MOD Single : A 169 SER OG : rot -65:sc= 1.18 USER MOD Single : A 173 GLN : amide:sc= 0.626 K(o=0.63,f=-0.075) USER MOD ----------------------------------------------------------------- ATOM 213 N LEU A 18 -4.111 8.403 -11.528 1.00 0.00 N ATOM 214 CA LEU A 18 -4.477 7.080 -11.033 1.00 0.00 C ATOM 215 C LEU A 18 -4.585 6.080 -12.179 1.00 0.00 C ATOM 216 O LEU A 18 -4.374 4.882 -11.993 1.00 0.00 O ATOM 217 CB LEU A 18 -5.802 7.147 -10.272 1.00 0.00 C ATOM 218 CG LEU A 18 -5.711 7.542 -8.798 1.00 0.00 C ATOM 219 CD1 LEU A 18 -7.080 7.935 -8.265 1.00 0.00 C ATOM 220 CD2 LEU A 18 -5.123 6.404 -7.976 1.00 0.00 C ATOM 0 HA LEU A 18 -3.693 6.743 -10.355 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.453 7.859 -10.779 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -6.285 6.172 -10.337 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.050 8.404 -8.713 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.995 8.213 -7.214 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -7.463 8.782 -8.835 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.764 7.092 -8.363 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.066 6.703 -6.929 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.758 5.523 -8.067 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.123 6.170 -8.342 1.00 0.00 H new ATOM 232 N SER A 19 -4.914 6.581 -13.366 1.00 0.00 N ATOM 233 CA SER A 19 -5.051 5.732 -14.543 1.00 0.00 C ATOM 234 C SER A 19 -3.757 4.972 -14.819 1.00 0.00 C ATOM 235 O SER A 19 -3.697 3.751 -14.674 1.00 0.00 O ATOM 236 CB SER A 19 -5.433 6.573 -15.763 1.00 0.00 C ATOM 237 OG SER A 19 -5.813 5.749 -16.851 1.00 0.00 O ATOM 0 H SER A 19 -5.091 7.571 -13.537 1.00 0.00 H new ATOM 0 HA SER A 19 -5.842 5.008 -14.348 1.00 0.00 H new ATOM 0 HB2 SER A 19 -6.254 7.242 -15.505 1.00 0.00 H new ATOM 0 HB3 SER A 19 -4.591 7.200 -16.055 1.00 0.00 H new ATOM 0 HG SER A 19 -6.054 6.310 -17.618 1.00 0.00 H new ATOM 243 N LYS A 20 -2.723 5.704 -15.219 1.00 0.00 N ATOM 244 CA LYS A 20 -1.428 5.102 -15.515 1.00 0.00 C ATOM 245 C LYS A 20 -1.014 4.132 -14.412 1.00 0.00 C ATOM 246 O LYS A 20 -0.272 3.181 -14.656 1.00 0.00 O ATOM 247 CB LYS A 20 -0.363 6.189 -15.679 1.00 0.00 C ATOM 248 CG LYS A 20 0.004 6.882 -14.379 1.00 0.00 C ATOM 249 CD LYS A 20 1.358 7.565 -14.474 1.00 0.00 C ATOM 250 CE LYS A 20 1.229 8.991 -14.986 1.00 0.00 C ATOM 251 NZ LYS A 20 2.545 9.552 -15.401 1.00 0.00 N ATOM 0 H LYS A 20 -2.756 6.716 -15.346 1.00 0.00 H new ATOM 0 HA LYS A 20 -1.518 4.546 -16.448 1.00 0.00 H new ATOM 0 HB2 LYS A 20 0.534 5.745 -16.110 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -0.722 6.934 -16.389 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -0.760 7.619 -14.130 1.00 0.00 H new ATOM 0 HG3 LYS A 20 0.019 6.153 -13.569 1.00 0.00 H new ATOM 0 HD2 LYS A 20 1.833 7.571 -13.493 1.00 0.00 H new ATOM 0 HD3 LYS A 20 2.008 6.996 -15.139 1.00 0.00 H new ATOM 0 HE2 LYS A 20 0.542 9.012 -15.832 1.00 0.00 H new ATOM 0 HE3 LYS A 20 0.796 9.619 -14.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 2.415 10.525 -15.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 3.193 9.555 -14.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 2.947 8.968 -16.162 1.00 0.00 H new ATOM 265 N MET A 21 -1.500 4.379 -13.200 1.00 0.00 N ATOM 266 CA MET A 21 -1.182 3.526 -12.061 1.00 0.00 C ATOM 267 C MET A 21 -1.970 2.221 -12.122 1.00 0.00 C ATOM 268 O MET A 21 -1.442 1.152 -11.820 1.00 0.00 O ATOM 269 CB MET A 21 -1.481 4.255 -10.750 1.00 0.00 C ATOM 270 CG MET A 21 -0.683 5.537 -10.572 1.00 0.00 C ATOM 271 SD MET A 21 1.088 5.236 -10.417 1.00 0.00 S ATOM 272 CE MET A 21 1.236 4.989 -8.649 1.00 0.00 C ATOM 0 H MET A 21 -2.115 5.163 -12.981 1.00 0.00 H new ATOM 0 HA MET A 21 -0.119 3.290 -12.102 1.00 0.00 H new ATOM 0 HB2 MET A 21 -2.545 4.490 -10.709 1.00 0.00 H new ATOM 0 HB3 MET A 21 -1.270 3.586 -9.916 1.00 0.00 H new ATOM 0 HG2 MET A 21 -0.863 6.194 -11.423 1.00 0.00 H new ATOM 0 HG3 MET A 21 -1.038 6.061 -9.685 1.00 0.00 H new ATOM 0 HE1 MET A 21 2.286 4.862 -8.386 1.00 0.00 H new ATOM 0 HE2 MET A 21 0.833 5.856 -8.126 1.00 0.00 H new ATOM 0 HE3 MET A 21 0.679 4.098 -8.358 1.00 0.00 H new ATOM 282 N GLN A 22 -3.236 2.318 -12.515 1.00 0.00 N ATOM 283 CA GLN A 22 -4.097 1.145 -12.614 1.00 0.00 C ATOM 284 C GLN A 22 -3.724 0.298 -13.826 1.00 0.00 C ATOM 285 O GLN A 22 -4.075 -0.879 -13.902 1.00 0.00 O ATOM 286 CB GLN A 22 -5.564 1.569 -12.705 1.00 0.00 C ATOM 287 CG GLN A 22 -6.049 2.345 -11.491 1.00 0.00 C ATOM 288 CD GLN A 22 -7.297 3.157 -11.778 1.00 0.00 C ATOM 289 OE1 GLN A 22 -7.218 4.322 -12.169 1.00 0.00 O ATOM 290 NE2 GLN A 22 -8.459 2.544 -11.585 1.00 0.00 N ATOM 0 H GLN A 22 -3.688 3.196 -12.770 1.00 0.00 H new ATOM 0 HA GLN A 22 -3.955 0.544 -11.716 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -5.702 2.181 -13.596 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -6.183 0.681 -12.829 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -6.252 1.649 -10.677 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -5.257 3.012 -11.150 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -8.478 1.577 -11.260 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -9.333 3.040 -11.762 1.00 0.00 H new ATOM 299 N GLN A 23 -3.012 0.905 -14.770 1.00 0.00 N ATOM 300 CA GLN A 23 -2.594 0.205 -15.979 1.00 0.00 C ATOM 301 C GLN A 23 -1.238 -0.465 -15.778 1.00 0.00 C ATOM 302 O GLN A 23 -1.061 -1.638 -16.104 1.00 0.00 O ATOM 303 CB GLN A 23 -2.526 1.177 -17.158 1.00 0.00 C ATOM 304 CG GLN A 23 -3.881 1.725 -17.573 1.00 0.00 C ATOM 305 CD GLN A 23 -3.850 2.390 -18.935 1.00 0.00 C ATOM 306 OE1 GLN A 23 -3.877 1.718 -19.967 1.00 0.00 O ATOM 307 NE2 GLN A 23 -3.792 3.716 -18.946 1.00 0.00 N ATOM 0 H GLN A 23 -2.713 1.879 -14.721 1.00 0.00 H new ATOM 0 HA GLN A 23 -3.332 -0.567 -16.196 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -1.872 2.009 -16.895 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -2.072 0.671 -18.010 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -4.608 0.913 -17.586 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -4.221 2.445 -16.829 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -3.771 4.233 -18.067 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -3.768 4.218 -19.834 1.00 0.00 H new ATOM 316 N ASN A 24 -0.285 0.288 -15.239 1.00 0.00 N ATOM 317 CA ASN A 24 1.055 -0.233 -14.996 1.00 0.00 C ATOM 318 C ASN A 24 1.294 -0.444 -13.504 1.00 0.00 C ATOM 319 O ASN A 24 1.503 -1.568 -13.051 1.00 0.00 O ATOM 320 CB ASN A 24 2.107 0.723 -15.562 1.00 0.00 C ATOM 321 CG ASN A 24 1.615 1.462 -16.792 1.00 0.00 C ATOM 322 OD1 ASN A 24 1.850 2.660 -16.945 1.00 0.00 O ATOM 323 ND2 ASN A 24 0.927 0.748 -17.675 1.00 0.00 N ATOM 0 H ASN A 24 -0.416 1.261 -14.962 1.00 0.00 H new ATOM 0 HA ASN A 24 1.140 -1.196 -15.500 1.00 0.00 H new ATOM 0 HB2 ASN A 24 2.387 1.445 -14.795 1.00 0.00 H new ATOM 0 HB3 ASN A 24 3.006 0.161 -15.815 1.00 0.00 H new ATOM 0 HD21 ASN A 24 0.570 1.191 -18.521 1.00 0.00 H new ATOM 0 HD22 ASN A 24 0.756 -0.243 -17.507 1.00 0.00 H new ATOM 330 N GLY A 25 1.261 0.647 -12.745 1.00 0.00 N ATOM 331 CA GLY A 25 1.475 0.561 -11.312 1.00 0.00 C ATOM 332 C GLY A 25 2.764 1.231 -10.877 1.00 0.00 C ATOM 333 O GLY A 25 3.160 2.253 -11.437 1.00 0.00 O ATOM 0 H GLY A 25 1.090 1.589 -13.097 1.00 0.00 H new ATOM 0 HA2 GLY A 25 0.635 1.024 -10.794 1.00 0.00 H new ATOM 0 HA3 GLY A 25 1.495 -0.487 -11.013 1.00 0.00 H new ATOM 337 N TYR A 26 3.418 0.655 -9.875 1.00 0.00 N ATOM 338 CA TYR A 26 4.667 1.205 -9.362 1.00 0.00 C ATOM 339 C TYR A 26 5.484 0.131 -8.650 1.00 0.00 C ATOM 340 O TYR A 26 5.102 -0.349 -7.583 1.00 0.00 O ATOM 341 CB TYR A 26 4.383 2.364 -8.404 1.00 0.00 C ATOM 342 CG TYR A 26 5.579 3.258 -8.165 1.00 0.00 C ATOM 343 CD1 TYR A 26 6.116 4.023 -9.193 1.00 0.00 C ATOM 344 CD2 TYR A 26 6.172 3.338 -6.911 1.00 0.00 C ATOM 345 CE1 TYR A 26 7.209 4.841 -8.979 1.00 0.00 C ATOM 346 CE2 TYR A 26 7.263 4.155 -6.687 1.00 0.00 C ATOM 347 CZ TYR A 26 7.778 4.904 -7.725 1.00 0.00 C ATOM 348 OH TYR A 26 8.867 5.717 -7.507 1.00 0.00 O ATOM 0 H TYR A 26 3.104 -0.192 -9.402 1.00 0.00 H new ATOM 0 HA TYR A 26 5.246 1.575 -10.208 1.00 0.00 H new ATOM 0 HB2 TYR A 26 3.566 2.964 -8.805 1.00 0.00 H new ATOM 0 HB3 TYR A 26 4.044 1.961 -7.449 1.00 0.00 H new ATOM 0 HD1 TYR A 26 5.672 3.978 -10.176 1.00 0.00 H new ATOM 0 HD2 TYR A 26 5.773 2.751 -6.097 1.00 0.00 H new ATOM 0 HE1 TYR A 26 7.615 5.428 -9.790 1.00 0.00 H new ATOM 0 HE2 TYR A 26 7.710 4.207 -5.705 1.00 0.00 H new ATOM 0 HH TYR A 26 9.145 5.647 -6.570 1.00 0.00 H new ATOM 358 N GLU A 27 6.612 -0.240 -9.248 1.00 0.00 N ATOM 359 CA GLU A 27 7.483 -1.257 -8.672 1.00 0.00 C ATOM 360 C GLU A 27 8.642 -0.615 -7.916 1.00 0.00 C ATOM 361 O GLU A 27 9.580 -0.096 -8.520 1.00 0.00 O ATOM 362 CB GLU A 27 8.022 -2.179 -9.768 1.00 0.00 C ATOM 363 CG GLU A 27 7.052 -3.276 -10.172 1.00 0.00 C ATOM 364 CD GLU A 27 7.618 -4.192 -11.240 1.00 0.00 C ATOM 365 OE1 GLU A 27 8.436 -3.717 -12.056 1.00 0.00 O ATOM 366 OE2 GLU A 27 7.243 -5.383 -11.259 1.00 0.00 O ATOM 0 H GLU A 27 6.944 0.149 -10.131 1.00 0.00 H new ATOM 0 HA GLU A 27 6.895 -1.847 -7.968 1.00 0.00 H new ATOM 0 HB2 GLU A 27 8.267 -1.581 -10.646 1.00 0.00 H new ATOM 0 HB3 GLU A 27 8.950 -2.635 -9.423 1.00 0.00 H new ATOM 0 HG2 GLU A 27 6.791 -3.866 -9.294 1.00 0.00 H new ATOM 0 HG3 GLU A 27 6.130 -2.824 -10.538 1.00 0.00 H new ATOM 373 N ASN A 28 8.571 -0.655 -6.589 1.00 0.00 N ATOM 374 CA ASN A 28 9.613 -0.077 -5.750 1.00 0.00 C ATOM 375 C ASN A 28 10.951 -0.773 -5.986 1.00 0.00 C ATOM 376 O ASN A 28 11.144 -1.936 -5.633 1.00 0.00 O ATOM 377 CB ASN A 28 9.225 -0.182 -4.273 1.00 0.00 C ATOM 378 CG ASN A 28 10.066 0.719 -3.389 1.00 0.00 C ATOM 379 OD1 ASN A 28 11.135 1.178 -3.790 1.00 0.00 O ATOM 380 ND2 ASN A 28 9.583 0.976 -2.179 1.00 0.00 N ATOM 0 H ASN A 28 7.802 -1.082 -6.072 1.00 0.00 H new ATOM 0 HA ASN A 28 9.718 0.974 -6.018 1.00 0.00 H new ATOM 0 HB2 ASN A 28 8.173 0.079 -4.157 1.00 0.00 H new ATOM 0 HB3 ASN A 28 9.335 -1.215 -3.944 1.00 0.00 H new ATOM 0 HD21 ASN A 28 10.103 1.576 -1.539 1.00 0.00 H new ATOM 0 HD22 ASN A 28 8.692 0.573 -1.889 1.00 0.00 H new ATOM 387 N PRO A 29 11.896 -0.044 -6.598 1.00 0.00 N ATOM 388 CA PRO A 29 13.232 -0.570 -6.894 1.00 0.00 C ATOM 389 C PRO A 29 14.067 -0.776 -5.635 1.00 0.00 C ATOM 390 O PRO A 29 14.939 -1.645 -5.589 1.00 0.00 O ATOM 391 CB PRO A 29 13.853 0.516 -7.776 1.00 0.00 C ATOM 392 CG PRO A 29 13.136 1.766 -7.399 1.00 0.00 C ATOM 393 CD PRO A 29 11.735 1.349 -7.047 1.00 0.00 C ATOM 0 HA PRO A 29 13.188 -1.550 -7.368 1.00 0.00 H new ATOM 0 HB2 PRO A 29 14.925 0.605 -7.598 1.00 0.00 H new ATOM 0 HB3 PRO A 29 13.723 0.289 -8.834 1.00 0.00 H new ATOM 0 HG2 PRO A 29 13.622 2.255 -6.554 1.00 0.00 H new ATOM 0 HG3 PRO A 29 13.136 2.479 -8.223 1.00 0.00 H new ATOM 0 HD2 PRO A 29 11.314 1.978 -6.263 1.00 0.00 H new ATOM 0 HD3 PRO A 29 11.067 1.420 -7.905 1.00 0.00 H new ATOM 401 N THR A 30 13.794 0.028 -4.612 1.00 0.00 N ATOM 402 CA THR A 30 14.520 -0.065 -3.351 1.00 0.00 C ATOM 403 C THR A 30 14.367 -1.449 -2.730 1.00 0.00 C ATOM 404 O THR A 30 15.231 -1.902 -1.979 1.00 0.00 O ATOM 405 CB THR A 30 14.036 0.994 -2.344 1.00 0.00 C ATOM 406 OG1 THR A 30 13.658 2.190 -3.034 1.00 0.00 O ATOM 407 CG2 THR A 30 15.122 1.311 -1.327 1.00 0.00 C ATOM 0 H THR A 30 13.075 0.751 -4.632 1.00 0.00 H new ATOM 0 HA THR A 30 15.571 0.115 -3.577 1.00 0.00 H new ATOM 0 HB THR A 30 13.172 0.592 -1.815 1.00 0.00 H new ATOM 0 HG1 THR A 30 12.737 2.104 -3.357 1.00 0.00 H new ATOM 0 HG21 THR A 30 14.756 2.062 -0.626 1.00 0.00 H new ATOM 0 HG22 THR A 30 15.386 0.405 -0.782 1.00 0.00 H new ATOM 0 HG23 THR A 30 16.003 1.694 -1.843 1.00 0.00 H new ATOM 824 N VAL A 61 5.156 14.452 7.801 1.00 0.00 N ATOM 825 CA VAL A 61 4.168 13.446 8.173 1.00 0.00 C ATOM 826 C VAL A 61 2.800 13.777 7.587 1.00 0.00 C ATOM 827 O VAL A 61 2.346 14.919 7.652 1.00 0.00 O ATOM 828 CB VAL A 61 4.042 13.322 9.703 1.00 0.00 C ATOM 829 CG1 VAL A 61 3.554 14.630 10.307 1.00 0.00 C ATOM 830 CG2 VAL A 61 3.112 12.176 10.070 1.00 0.00 C ATOM 0 HA VAL A 61 4.515 12.496 7.766 1.00 0.00 H new ATOM 0 HB VAL A 61 5.028 13.105 10.114 1.00 0.00 H new ATOM 0 HG11 VAL A 61 3.471 14.523 11.389 1.00 0.00 H new ATOM 0 HG12 VAL A 61 4.263 15.425 10.074 1.00 0.00 H new ATOM 0 HG13 VAL A 61 2.578 14.881 9.892 1.00 0.00 H new ATOM 0 HG21 VAL A 61 3.035 12.103 11.155 1.00 0.00 H new ATOM 0 HG22 VAL A 61 2.124 12.360 9.647 1.00 0.00 H new ATOM 0 HG23 VAL A 61 3.510 11.243 9.671 1.00 0.00 H new ATOM 840 N GLN A 62 2.148 12.769 7.016 1.00 0.00 N ATOM 841 CA GLN A 62 0.830 12.954 6.418 1.00 0.00 C ATOM 842 C GLN A 62 -0.146 11.893 6.915 1.00 0.00 C ATOM 843 O GLN A 62 0.211 10.723 7.058 1.00 0.00 O ATOM 844 CB GLN A 62 0.928 12.900 4.893 1.00 0.00 C ATOM 845 CG GLN A 62 1.641 14.098 4.286 1.00 0.00 C ATOM 846 CD GLN A 62 1.840 13.962 2.789 1.00 0.00 C ATOM 847 OE1 GLN A 62 0.936 14.246 2.003 1.00 0.00 O ATOM 848 NE2 GLN A 62 3.028 13.527 2.387 1.00 0.00 N ATOM 0 H GLN A 62 2.510 11.817 6.955 1.00 0.00 H new ATOM 0 HA GLN A 62 0.456 13.933 6.717 1.00 0.00 H new ATOM 0 HB2 GLN A 62 1.453 11.990 4.603 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -0.076 12.835 4.475 1.00 0.00 H new ATOM 0 HG2 GLN A 62 1.066 15.001 4.492 1.00 0.00 H new ATOM 0 HG3 GLN A 62 2.611 14.221 4.768 1.00 0.00 H new ATOM 0 HE21 GLN A 62 3.748 13.303 3.074 1.00 0.00 H new ATOM 0 HE22 GLN A 62 3.221 13.416 1.391 1.00 0.00 H new ATOM 857 N LYS A 63 -1.381 12.308 7.176 1.00 0.00 N ATOM 858 CA LYS A 63 -2.411 11.395 7.656 1.00 0.00 C ATOM 859 C LYS A 63 -3.603 11.371 6.706 1.00 0.00 C ATOM 860 O LYS A 63 -4.238 12.398 6.465 1.00 0.00 O ATOM 861 CB LYS A 63 -2.870 11.802 9.058 1.00 0.00 C ATOM 862 CG LYS A 63 -1.872 11.455 10.150 1.00 0.00 C ATOM 863 CD LYS A 63 -0.831 12.548 10.320 1.00 0.00 C ATOM 864 CE LYS A 63 -1.394 13.742 11.077 1.00 0.00 C ATOM 865 NZ LYS A 63 -1.266 13.575 12.551 1.00 0.00 N ATOM 0 H LYS A 63 -1.693 13.272 7.063 1.00 0.00 H new ATOM 0 HA LYS A 63 -1.982 10.394 7.697 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -3.054 12.876 9.073 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -3.819 11.313 9.276 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -2.399 11.304 11.092 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -1.377 10.515 9.907 1.00 0.00 H new ATOM 0 HD2 LYS A 63 0.031 12.150 10.855 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -0.477 12.871 9.341 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -0.872 14.647 10.767 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -2.444 13.875 10.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -1.661 14.409 13.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -1.785 12.725 12.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -0.262 13.474 12.803 1.00 0.00 H new ATOM 879 N PHE A 64 -3.904 10.193 6.169 1.00 0.00 N ATOM 880 CA PHE A 64 -5.021 10.037 5.245 1.00 0.00 C ATOM 881 C PHE A 64 -6.122 9.179 5.863 1.00 0.00 C ATOM 882 O PHE A 64 -5.859 8.338 6.723 1.00 0.00 O ATOM 883 CB PHE A 64 -4.543 9.406 3.935 1.00 0.00 C ATOM 884 CG PHE A 64 -3.485 10.210 3.234 1.00 0.00 C ATOM 885 CD1 PHE A 64 -3.827 11.317 2.475 1.00 0.00 C ATOM 886 CD2 PHE A 64 -2.149 9.859 3.335 1.00 0.00 C ATOM 887 CE1 PHE A 64 -2.856 12.058 1.828 1.00 0.00 C ATOM 888 CE2 PHE A 64 -1.173 10.596 2.691 1.00 0.00 C ATOM 889 CZ PHE A 64 -1.527 11.698 1.937 1.00 0.00 C ATOM 0 H PHE A 64 -3.390 9.333 6.358 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.428 11.026 5.037 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.153 8.409 4.142 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -5.396 9.283 3.268 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -4.864 11.605 2.388 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -1.866 8.999 3.924 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -3.136 12.918 1.238 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.135 10.311 2.777 1.00 0.00 H new ATOM 0 HZ PHE A 64 -0.766 12.277 1.434 1.00 0.00 H new ATOM 899 N ARG A 65 -7.355 9.400 5.419 1.00 0.00 N ATOM 900 CA ARG A 65 -8.496 8.650 5.929 1.00 0.00 C ATOM 901 C ARG A 65 -8.889 7.535 4.964 1.00 0.00 C ATOM 902 O ARG A 65 -9.408 7.793 3.878 1.00 0.00 O ATOM 903 CB ARG A 65 -9.686 9.583 6.158 1.00 0.00 C ATOM 904 CG ARG A 65 -10.916 8.879 6.708 1.00 0.00 C ATOM 905 CD ARG A 65 -12.197 9.570 6.268 1.00 0.00 C ATOM 906 NE ARG A 65 -12.329 10.902 6.853 1.00 0.00 N ATOM 907 CZ ARG A 65 -13.388 11.683 6.671 1.00 0.00 C ATOM 908 NH1 ARG A 65 -14.402 11.267 5.924 1.00 0.00 N ATOM 909 NH2 ARG A 65 -13.435 12.882 7.237 1.00 0.00 N ATOM 0 H ARG A 65 -7.589 10.092 4.707 1.00 0.00 H new ATOM 0 HA ARG A 65 -8.207 8.200 6.879 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -9.390 10.372 6.849 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -9.945 10.065 5.216 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -10.925 7.843 6.369 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -10.868 8.858 7.797 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -12.212 9.648 5.181 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -13.054 8.961 6.555 1.00 0.00 H new ATOM 0 HE ARG A 65 -11.566 11.252 7.433 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -14.370 10.346 5.488 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -15.214 11.869 5.786 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -12.657 13.205 7.813 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -14.249 13.481 7.096 1.00 0.00 H new ATOM 923 N VAL A 66 -8.637 6.294 5.368 1.00 0.00 N ATOM 924 CA VAL A 66 -8.964 5.139 4.540 1.00 0.00 C ATOM 925 C VAL A 66 -9.568 4.017 5.377 1.00 0.00 C ATOM 926 O VAL A 66 -9.511 4.046 6.606 1.00 0.00 O ATOM 927 CB VAL A 66 -7.720 4.604 3.806 1.00 0.00 C ATOM 928 CG1 VAL A 66 -7.056 5.713 3.004 1.00 0.00 C ATOM 929 CG2 VAL A 66 -6.741 3.989 4.794 1.00 0.00 C ATOM 0 H VAL A 66 -8.207 6.063 6.264 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.695 5.474 3.804 1.00 0.00 H new ATOM 0 HB VAL A 66 -8.036 3.825 3.112 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -6.179 5.317 2.492 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -7.760 6.102 2.269 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -6.752 6.516 3.676 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.868 3.616 4.257 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -6.428 4.745 5.515 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -7.223 3.165 5.319 1.00 0.00 H new ATOM 939 N GLN A 67 -10.146 3.028 4.702 1.00 0.00 N ATOM 940 CA GLN A 67 -10.761 1.896 5.384 1.00 0.00 C ATOM 941 C GLN A 67 -9.904 0.643 5.240 1.00 0.00 C ATOM 942 O GLN A 67 -9.085 0.540 4.326 1.00 0.00 O ATOM 943 CB GLN A 67 -12.161 1.636 4.825 1.00 0.00 C ATOM 944 CG GLN A 67 -13.250 2.442 5.515 1.00 0.00 C ATOM 945 CD GLN A 67 -14.470 2.645 4.638 1.00 0.00 C ATOM 946 OE1 GLN A 67 -14.528 3.584 3.843 1.00 0.00 O ATOM 947 NE2 GLN A 67 -15.454 1.764 4.778 1.00 0.00 N ATOM 0 H GLN A 67 -10.201 2.988 3.684 1.00 0.00 H new ATOM 0 HA GLN A 67 -10.839 2.142 6.443 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -12.167 1.869 3.760 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -12.390 0.575 4.920 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -13.547 1.934 6.432 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -12.850 3.414 5.804 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -15.364 1.001 5.449 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -16.300 1.850 4.214 1.00 0.00 H new ATOM 956 N TYR A 68 -10.096 -0.307 6.149 1.00 0.00 N ATOM 957 CA TYR A 68 -9.338 -1.552 6.125 1.00 0.00 C ATOM 958 C TYR A 68 -10.170 -2.685 5.532 1.00 0.00 C ATOM 959 O TYR A 68 -11.305 -2.922 5.949 1.00 0.00 O ATOM 960 CB TYR A 68 -8.883 -1.924 7.537 1.00 0.00 C ATOM 961 CG TYR A 68 -7.586 -2.700 7.571 1.00 0.00 C ATOM 962 CD1 TYR A 68 -7.442 -3.883 6.857 1.00 0.00 C ATOM 963 CD2 TYR A 68 -6.504 -2.251 8.319 1.00 0.00 C ATOM 964 CE1 TYR A 68 -6.259 -4.595 6.885 1.00 0.00 C ATOM 965 CE2 TYR A 68 -5.317 -2.956 8.352 1.00 0.00 C ATOM 966 CZ TYR A 68 -5.199 -4.128 7.634 1.00 0.00 C ATOM 967 OH TYR A 68 -4.019 -4.834 7.665 1.00 0.00 O ATOM 0 H TYR A 68 -10.770 -0.238 6.911 1.00 0.00 H new ATOM 0 HA TYR A 68 -8.461 -1.401 5.496 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -8.767 -1.013 8.124 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -9.663 -2.515 8.017 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -8.270 -4.252 6.270 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -6.593 -1.335 8.884 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -6.164 -5.513 6.323 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -4.485 -2.592 8.937 1.00 0.00 H new ATOM 0 HH TYR A 68 -3.816 -5.172 6.768 1.00 0.00 H new ATOM 977 N LEU A 69 -9.598 -3.383 4.557 1.00 0.00 N ATOM 978 CA LEU A 69 -10.285 -4.493 3.906 1.00 0.00 C ATOM 979 C LEU A 69 -9.851 -5.828 4.503 1.00 0.00 C ATOM 980 O LEU A 69 -10.684 -6.659 4.861 1.00 0.00 O ATOM 981 CB LEU A 69 -10.006 -4.479 2.402 1.00 0.00 C ATOM 982 CG LEU A 69 -10.943 -3.619 1.553 1.00 0.00 C ATOM 983 CD1 LEU A 69 -10.400 -2.204 1.426 1.00 0.00 C ATOM 984 CD2 LEU A 69 -11.139 -4.242 0.179 1.00 0.00 C ATOM 0 H LEU A 69 -8.660 -3.200 4.200 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.356 -4.373 4.072 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.985 -4.131 2.246 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -10.054 -5.504 2.034 1.00 0.00 H new ATOM 0 HG LEU A 69 -11.912 -3.571 2.050 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.080 -1.607 0.819 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -10.311 -1.758 2.417 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -9.419 -2.232 0.952 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.809 -3.617 -0.412 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.176 -4.320 -0.326 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.573 -5.236 0.289 1.00 0.00 H new ATOM 996 N GLY A 70 -8.540 -6.025 4.609 1.00 0.00 N ATOM 997 CA GLY A 70 -8.018 -7.260 5.165 1.00 0.00 C ATOM 998 C GLY A 70 -6.811 -7.773 4.406 1.00 0.00 C ATOM 999 O GLY A 70 -6.543 -7.338 3.286 1.00 0.00 O ATOM 0 H GLY A 70 -7.831 -5.352 4.320 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -7.746 -7.099 6.208 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.800 -8.019 5.153 1.00 0.00 H new ATOM 1003 N MET A 71 -6.079 -8.699 5.017 1.00 0.00 N ATOM 1004 CA MET A 71 -4.893 -9.271 4.390 1.00 0.00 C ATOM 1005 C MET A 71 -5.271 -10.411 3.450 1.00 0.00 C ATOM 1006 O MET A 71 -6.254 -11.117 3.678 1.00 0.00 O ATOM 1007 CB MET A 71 -3.920 -9.776 5.458 1.00 0.00 C ATOM 1008 CG MET A 71 -2.608 -10.292 4.889 1.00 0.00 C ATOM 1009 SD MET A 71 -1.828 -11.523 5.950 1.00 0.00 S ATOM 1010 CE MET A 71 -2.648 -13.016 5.397 1.00 0.00 C ATOM 0 H MET A 71 -6.286 -9.069 5.945 1.00 0.00 H new ATOM 0 HA MET A 71 -4.408 -8.489 3.806 1.00 0.00 H new ATOM 0 HB2 MET A 71 -3.710 -8.967 6.158 1.00 0.00 H new ATOM 0 HB3 MET A 71 -4.399 -10.573 6.026 1.00 0.00 H new ATOM 0 HG2 MET A 71 -2.789 -10.727 3.906 1.00 0.00 H new ATOM 0 HG3 MET A 71 -1.924 -9.455 4.746 1.00 0.00 H new ATOM 0 HE1 MET A 71 -2.271 -13.869 5.962 1.00 0.00 H new ATOM 0 HE2 MET A 71 -3.722 -12.921 5.556 1.00 0.00 H new ATOM 0 HE3 MET A 71 -2.451 -13.168 4.336 1.00 0.00 H new ATOM 1020 N LEU A 72 -4.485 -10.585 2.393 1.00 0.00 N ATOM 1021 CA LEU A 72 -4.737 -11.640 1.418 1.00 0.00 C ATOM 1022 C LEU A 72 -3.434 -12.300 0.979 1.00 0.00 C ATOM 1023 O LEU A 72 -2.479 -11.636 0.574 1.00 0.00 O ATOM 1024 CB LEU A 72 -5.469 -11.071 0.200 1.00 0.00 C ATOM 1025 CG LEU A 72 -6.434 -12.023 -0.508 1.00 0.00 C ATOM 1026 CD1 LEU A 72 -5.668 -13.132 -1.212 1.00 0.00 C ATOM 1027 CD2 LEU A 72 -7.431 -12.607 0.483 1.00 0.00 C ATOM 0 H LEU A 72 -3.668 -10.009 2.189 1.00 0.00 H new ATOM 0 HA LEU A 72 -5.363 -12.396 1.892 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.026 -10.189 0.515 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -4.725 -10.736 -0.523 1.00 0.00 H new ATOM 0 HG LEU A 72 -6.987 -11.458 -1.258 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -6.371 -13.800 -1.710 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -4.995 -12.697 -1.951 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.089 -13.695 -0.480 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -8.110 -13.282 -0.039 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -6.895 -13.157 1.257 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -8.003 -11.800 0.942 1.00 0.00 H new ATOM 1039 N PRO A 73 -3.391 -13.638 1.060 1.00 0.00 N ATOM 1040 CA PRO A 73 -2.211 -14.417 0.673 1.00 0.00 C ATOM 1041 C PRO A 73 -1.975 -14.402 -0.833 1.00 0.00 C ATOM 1042 O PRO A 73 -2.890 -14.652 -1.618 1.00 0.00 O ATOM 1043 CB PRO A 73 -2.550 -15.832 1.148 1.00 0.00 C ATOM 1044 CG PRO A 73 -4.039 -15.879 1.167 1.00 0.00 C ATOM 1045 CD PRO A 73 -4.492 -14.493 1.534 1.00 0.00 C ATOM 0 HA PRO A 73 -1.296 -14.015 1.107 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -2.139 -16.585 0.475 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -2.135 -16.028 2.137 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -4.433 -16.173 0.194 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -4.397 -16.611 1.891 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -5.435 -14.238 1.052 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -4.646 -14.392 2.608 1.00 0.00 H new ATOM 1053 N VAL A 74 -0.741 -14.109 -1.231 1.00 0.00 N ATOM 1054 CA VAL A 74 -0.384 -14.063 -2.644 1.00 0.00 C ATOM 1055 C VAL A 74 0.706 -15.078 -2.968 1.00 0.00 C ATOM 1056 O VAL A 74 1.183 -15.795 -2.088 1.00 0.00 O ATOM 1057 CB VAL A 74 0.097 -12.660 -3.056 1.00 0.00 C ATOM 1058 CG1 VAL A 74 -1.077 -11.697 -3.145 1.00 0.00 C ATOM 1059 CG2 VAL A 74 1.144 -12.147 -2.079 1.00 0.00 C ATOM 0 H VAL A 74 0.028 -13.900 -0.595 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.285 -14.309 -3.206 1.00 0.00 H new ATOM 0 HB VAL A 74 0.556 -12.728 -4.042 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.717 -10.711 -3.437 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.789 -12.058 -3.887 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.568 -11.631 -2.174 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.473 -11.154 -2.386 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.713 -12.094 -1.079 1.00 0.00 H new ATOM 0 HG23 VAL A 74 1.997 -12.825 -2.071 1.00 0.00 H new ATOM 1069 N ASP A 75 1.097 -15.133 -4.237 1.00 0.00 N ATOM 1070 CA ASP A 75 2.133 -16.059 -4.678 1.00 0.00 C ATOM 1071 C ASP A 75 3.349 -15.304 -5.206 1.00 0.00 C ATOM 1072 O ASP A 75 4.457 -15.839 -5.244 1.00 0.00 O ATOM 1073 CB ASP A 75 1.587 -16.991 -5.761 1.00 0.00 C ATOM 1074 CG ASP A 75 0.443 -17.851 -5.261 1.00 0.00 C ATOM 1075 OD1 ASP A 75 0.472 -18.249 -4.077 1.00 0.00 O ATOM 1076 OD2 ASP A 75 -0.483 -18.125 -6.053 1.00 0.00 O ATOM 0 H ASP A 75 0.712 -14.547 -4.978 1.00 0.00 H new ATOM 0 HA ASP A 75 2.442 -16.654 -3.819 1.00 0.00 H new ATOM 0 HB2 ASP A 75 1.248 -16.397 -6.610 1.00 0.00 H new ATOM 0 HB3 ASP A 75 2.390 -17.634 -6.122 1.00 0.00 H new ATOM 1081 N ARG A 76 3.133 -14.057 -5.613 1.00 0.00 N ATOM 1082 CA ARG A 76 4.210 -13.229 -6.141 1.00 0.00 C ATOM 1083 C ARG A 76 4.229 -11.863 -5.461 1.00 0.00 C ATOM 1084 O ARG A 76 3.189 -11.288 -5.138 1.00 0.00 O ATOM 1085 CB ARG A 76 4.055 -13.055 -7.653 1.00 0.00 C ATOM 1086 CG ARG A 76 4.522 -14.259 -8.455 1.00 0.00 C ATOM 1087 CD ARG A 76 6.024 -14.461 -8.331 1.00 0.00 C ATOM 1088 NE ARG A 76 6.518 -15.474 -9.260 1.00 0.00 N ATOM 1089 CZ ARG A 76 6.487 -16.779 -9.010 1.00 0.00 C ATOM 1090 NH1 ARG A 76 5.987 -17.226 -7.866 1.00 0.00 N ATOM 1091 NH2 ARG A 76 6.955 -17.639 -9.905 1.00 0.00 N ATOM 0 H ARG A 76 2.222 -13.599 -5.587 1.00 0.00 H new ATOM 0 HA ARG A 76 5.155 -13.732 -5.935 1.00 0.00 H new ATOM 0 HB2 ARG A 76 3.007 -12.860 -7.882 1.00 0.00 H new ATOM 0 HB3 ARG A 76 4.619 -12.177 -7.969 1.00 0.00 H new ATOM 0 HG2 ARG A 76 4.004 -15.153 -8.107 1.00 0.00 H new ATOM 0 HG3 ARG A 76 4.257 -14.124 -9.504 1.00 0.00 H new ATOM 0 HD2 ARG A 76 6.534 -13.516 -8.520 1.00 0.00 H new ATOM 0 HD3 ARG A 76 6.267 -14.756 -7.310 1.00 0.00 H new ATOM 0 HE ARG A 76 6.908 -15.163 -10.150 1.00 0.00 H new ATOM 0 HH11 ARG A 76 5.625 -16.568 -7.176 1.00 0.00 H new ATOM 0 HH12 ARG A 76 5.964 -18.228 -7.676 1.00 0.00 H new ATOM 0 HH21 ARG A 76 7.339 -17.299 -10.787 1.00 0.00 H new ATOM 0 HH22 ARG A 76 6.931 -18.640 -9.712 1.00 0.00 H new ATOM 1105 N PRO A 77 5.439 -11.330 -5.236 1.00 0.00 N ATOM 1106 CA PRO A 77 5.623 -10.026 -4.593 1.00 0.00 C ATOM 1107 C PRO A 77 5.172 -8.872 -5.481 1.00 0.00 C ATOM 1108 O PRO A 77 4.855 -7.787 -4.994 1.00 0.00 O ATOM 1109 CB PRO A 77 7.134 -9.957 -4.354 1.00 0.00 C ATOM 1110 CG PRO A 77 7.721 -10.855 -5.388 1.00 0.00 C ATOM 1111 CD PRO A 77 6.722 -11.959 -5.594 1.00 0.00 C ATOM 0 HA PRO A 77 5.029 -9.934 -3.684 1.00 0.00 H new ATOM 0 HB2 PRO A 77 7.505 -8.937 -4.458 1.00 0.00 H new ATOM 0 HB3 PRO A 77 7.392 -10.289 -3.348 1.00 0.00 H new ATOM 0 HG2 PRO A 77 7.902 -10.314 -6.317 1.00 0.00 H new ATOM 0 HG3 PRO A 77 8.681 -11.254 -5.059 1.00 0.00 H new ATOM 0 HD2 PRO A 77 6.722 -12.314 -6.625 1.00 0.00 H new ATOM 0 HD3 PRO A 77 6.938 -12.820 -4.961 1.00 0.00 H new ATOM 1119 N VAL A 78 5.144 -9.113 -6.788 1.00 0.00 N ATOM 1120 CA VAL A 78 4.729 -8.094 -7.745 1.00 0.00 C ATOM 1121 C VAL A 78 3.863 -8.695 -8.847 1.00 0.00 C ATOM 1122 O VAL A 78 3.775 -9.914 -8.986 1.00 0.00 O ATOM 1123 CB VAL A 78 5.944 -7.397 -8.385 1.00 0.00 C ATOM 1124 CG1 VAL A 78 6.767 -6.679 -7.326 1.00 0.00 C ATOM 1125 CG2 VAL A 78 6.797 -8.404 -9.143 1.00 0.00 C ATOM 0 H VAL A 78 5.404 -10.005 -7.208 1.00 0.00 H new ATOM 0 HA VAL A 78 4.147 -7.357 -7.191 1.00 0.00 H new ATOM 0 HB VAL A 78 5.582 -6.654 -9.095 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.621 -6.192 -7.797 1.00 0.00 H new ATOM 0 HG12 VAL A 78 6.149 -5.929 -6.832 1.00 0.00 H new ATOM 0 HG13 VAL A 78 7.121 -7.400 -6.589 1.00 0.00 H new ATOM 0 HG21 VAL A 78 7.651 -7.895 -9.589 1.00 0.00 H new ATOM 0 HG22 VAL A 78 7.151 -9.172 -8.455 1.00 0.00 H new ATOM 0 HG23 VAL A 78 6.201 -8.868 -9.929 1.00 0.00 H new ATOM 1135 N GLY A 79 3.225 -7.829 -9.629 1.00 0.00 N ATOM 1136 CA GLY A 79 2.375 -8.293 -10.710 1.00 0.00 C ATOM 1137 C GLY A 79 0.936 -7.844 -10.549 1.00 0.00 C ATOM 1138 O GLY A 79 0.228 -8.313 -9.657 1.00 0.00 O ATOM 0 H GLY A 79 3.282 -6.815 -9.533 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.764 -7.923 -11.659 1.00 0.00 H new ATOM 0 HA3 GLY A 79 2.410 -9.382 -10.754 1.00 0.00 H new ATOM 1142 N MET A 80 0.503 -6.931 -11.412 1.00 0.00 N ATOM 1143 CA MET A 80 -0.862 -6.418 -11.361 1.00 0.00 C ATOM 1144 C MET A 80 -1.853 -7.539 -11.068 1.00 0.00 C ATOM 1145 O MET A 80 -2.597 -7.483 -10.088 1.00 0.00 O ATOM 1146 CB MET A 80 -1.222 -5.734 -12.681 1.00 0.00 C ATOM 1147 CG MET A 80 -0.846 -4.262 -12.725 1.00 0.00 C ATOM 1148 SD MET A 80 -2.151 -3.192 -12.090 1.00 0.00 S ATOM 1149 CE MET A 80 -1.725 -3.134 -10.352 1.00 0.00 C ATOM 0 H MET A 80 1.077 -6.531 -12.155 1.00 0.00 H new ATOM 0 HA MET A 80 -0.919 -5.687 -10.555 1.00 0.00 H new ATOM 0 HB2 MET A 80 -0.721 -6.253 -13.498 1.00 0.00 H new ATOM 0 HB3 MET A 80 -2.294 -5.832 -12.851 1.00 0.00 H new ATOM 0 HG2 MET A 80 0.062 -4.106 -12.143 1.00 0.00 H new ATOM 0 HG3 MET A 80 -0.618 -3.980 -13.753 1.00 0.00 H new ATOM 0 HE1 MET A 80 -2.163 -2.244 -9.900 1.00 0.00 H new ATOM 0 HE2 MET A 80 -2.111 -4.023 -9.853 1.00 0.00 H new ATOM 0 HE3 MET A 80 -0.641 -3.100 -10.244 1.00 0.00 H new ATOM 1159 N ASP A 81 -1.859 -8.556 -11.922 1.00 0.00 N ATOM 1160 CA ASP A 81 -2.759 -9.691 -11.755 1.00 0.00 C ATOM 1161 C ASP A 81 -2.896 -10.063 -10.282 1.00 0.00 C ATOM 1162 O ASP A 81 -3.997 -10.321 -9.794 1.00 0.00 O ATOM 1163 CB ASP A 81 -2.253 -10.894 -12.552 1.00 0.00 C ATOM 1164 CG ASP A 81 -3.376 -11.812 -12.991 1.00 0.00 C ATOM 1165 OD1 ASP A 81 -4.375 -11.306 -13.545 1.00 0.00 O ATOM 1166 OD2 ASP A 81 -3.256 -13.037 -12.782 1.00 0.00 O ATOM 0 H ASP A 81 -1.250 -8.618 -12.738 1.00 0.00 H new ATOM 0 HA ASP A 81 -3.740 -9.403 -12.132 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -1.711 -10.542 -13.430 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -1.544 -11.457 -11.944 1.00 0.00 H new ATOM 1171 N THR A 82 -1.769 -10.091 -9.576 1.00 0.00 N ATOM 1172 CA THR A 82 -1.762 -10.433 -8.160 1.00 0.00 C ATOM 1173 C THR A 82 -2.476 -9.370 -7.333 1.00 0.00 C ATOM 1174 O THR A 82 -3.344 -9.681 -6.517 1.00 0.00 O ATOM 1175 CB THR A 82 -0.326 -10.602 -7.629 1.00 0.00 C ATOM 1176 OG1 THR A 82 0.415 -11.475 -8.490 1.00 0.00 O ATOM 1177 CG2 THR A 82 -0.333 -11.161 -6.215 1.00 0.00 C ATOM 0 H THR A 82 -0.849 -9.881 -9.963 1.00 0.00 H new ATOM 0 HA THR A 82 -2.291 -11.381 -8.062 1.00 0.00 H new ATOM 0 HB THR A 82 0.149 -9.621 -7.611 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.363 -11.451 -8.242 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.692 -11.271 -5.862 1.00 0.00 H new ATOM 0 HG22 THR A 82 -0.872 -10.479 -5.557 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.825 -12.134 -6.211 1.00 0.00 H new ATOM 1185 N LEU A 83 -2.105 -8.112 -7.549 1.00 0.00 N ATOM 1186 CA LEU A 83 -2.711 -7.001 -6.824 1.00 0.00 C ATOM 1187 C LEU A 83 -4.224 -6.987 -7.014 1.00 0.00 C ATOM 1188 O LEU A 83 -4.981 -6.938 -6.046 1.00 0.00 O ATOM 1189 CB LEU A 83 -2.114 -5.673 -7.294 1.00 0.00 C ATOM 1190 CG LEU A 83 -2.205 -4.509 -6.308 1.00 0.00 C ATOM 1191 CD1 LEU A 83 -1.022 -4.525 -5.352 1.00 0.00 C ATOM 1192 CD2 LEU A 83 -2.275 -3.183 -7.052 1.00 0.00 C ATOM 0 H LEU A 83 -1.388 -7.837 -8.220 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.498 -7.133 -5.763 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -1.064 -5.836 -7.537 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -2.613 -5.380 -8.218 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.118 -4.623 -5.724 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -1.104 -3.689 -4.658 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -1.018 -5.461 -4.794 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -0.095 -4.436 -5.919 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -2.339 -2.366 -6.334 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -1.380 -3.060 -7.662 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -3.156 -3.172 -7.694 1.00 0.00 H new ATOM 1204 N ASN A 84 -4.658 -7.031 -8.270 1.00 0.00 N ATOM 1205 CA ASN A 84 -6.081 -7.025 -8.588 1.00 0.00 C ATOM 1206 C ASN A 84 -6.771 -8.260 -8.016 1.00 0.00 C ATOM 1207 O ASN A 84 -7.981 -8.258 -7.787 1.00 0.00 O ATOM 1208 CB ASN A 84 -6.287 -6.967 -10.103 1.00 0.00 C ATOM 1209 CG ASN A 84 -6.362 -5.544 -10.622 1.00 0.00 C ATOM 1210 OD1 ASN A 84 -7.421 -5.082 -11.047 1.00 0.00 O ATOM 1211 ND2 ASN A 84 -5.235 -4.843 -10.590 1.00 0.00 N ATOM 0 H ASN A 84 -4.044 -7.071 -9.084 1.00 0.00 H new ATOM 0 HA ASN A 84 -6.525 -6.139 -8.134 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -5.468 -7.489 -10.599 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -7.205 -7.494 -10.363 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -5.224 -3.880 -10.926 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -4.381 -5.267 -10.229 1.00 0.00 H new ATOM 1218 N SER A 85 -5.994 -9.314 -7.789 1.00 0.00 N ATOM 1219 CA SER A 85 -6.530 -10.557 -7.248 1.00 0.00 C ATOM 1220 C SER A 85 -6.916 -10.390 -5.781 1.00 0.00 C ATOM 1221 O SER A 85 -7.967 -10.859 -5.347 1.00 0.00 O ATOM 1222 CB SER A 85 -5.506 -11.685 -7.392 1.00 0.00 C ATOM 1223 OG SER A 85 -6.046 -12.922 -6.962 1.00 0.00 O ATOM 0 H SER A 85 -4.991 -9.332 -7.972 1.00 0.00 H new ATOM 0 HA SER A 85 -7.425 -10.814 -7.814 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.191 -11.764 -8.433 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.617 -11.450 -6.807 1.00 0.00 H new ATOM 0 HG SER A 85 -5.373 -13.626 -7.065 1.00 0.00 H new ATOM 1229 N ALA A 86 -6.056 -9.716 -5.023 1.00 0.00 N ATOM 1230 CA ALA A 86 -6.307 -9.484 -3.606 1.00 0.00 C ATOM 1231 C ALA A 86 -7.481 -8.533 -3.405 1.00 0.00 C ATOM 1232 O ALA A 86 -8.396 -8.817 -2.631 1.00 0.00 O ATOM 1233 CB ALA A 86 -5.058 -8.934 -2.933 1.00 0.00 C ATOM 0 H ALA A 86 -5.180 -9.322 -5.367 1.00 0.00 H new ATOM 0 HA ALA A 86 -6.564 -10.438 -3.146 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -5.259 -8.765 -1.875 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -4.243 -9.650 -3.038 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -4.776 -7.992 -3.404 1.00 0.00 H new ATOM 1239 N ILE A 87 -7.449 -7.404 -4.105 1.00 0.00 N ATOM 1240 CA ILE A 87 -8.512 -6.411 -4.003 1.00 0.00 C ATOM 1241 C ILE A 87 -9.882 -7.052 -4.195 1.00 0.00 C ATOM 1242 O ILE A 87 -10.758 -6.935 -3.338 1.00 0.00 O ATOM 1243 CB ILE A 87 -8.333 -5.287 -5.039 1.00 0.00 C ATOM 1244 CG1 ILE A 87 -7.027 -4.532 -4.786 1.00 0.00 C ATOM 1245 CG2 ILE A 87 -9.518 -4.334 -4.997 1.00 0.00 C ATOM 1246 CD1 ILE A 87 -6.559 -3.717 -5.972 1.00 0.00 C ATOM 0 H ILE A 87 -6.699 -7.154 -4.749 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.451 -5.984 -3.002 1.00 0.00 H new ATOM 0 HB ILE A 87 -8.285 -5.734 -6.032 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.160 -3.870 -3.930 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.250 -5.247 -4.518 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -9.377 -3.545 -5.735 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -10.433 -4.881 -5.222 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -9.594 -3.892 -4.004 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -5.628 -3.209 -5.720 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -6.394 -4.376 -6.824 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.318 -2.977 -6.227 1.00 0.00 H new ATOM 1258 N GLU A 88 -10.059 -7.730 -5.324 1.00 0.00 N ATOM 1259 CA GLU A 88 -11.324 -8.391 -5.627 1.00 0.00 C ATOM 1260 C GLU A 88 -11.654 -9.444 -4.574 1.00 0.00 C ATOM 1261 O GLU A 88 -12.816 -9.645 -4.225 1.00 0.00 O ATOM 1262 CB GLU A 88 -11.267 -9.039 -7.012 1.00 0.00 C ATOM 1263 CG GLU A 88 -11.016 -8.049 -8.137 1.00 0.00 C ATOM 1264 CD GLU A 88 -10.582 -8.726 -9.423 1.00 0.00 C ATOM 1265 OE1 GLU A 88 -10.056 -9.856 -9.351 1.00 0.00 O ATOM 1266 OE2 GLU A 88 -10.769 -8.125 -10.502 1.00 0.00 O ATOM 0 H GLU A 88 -9.344 -7.836 -6.044 1.00 0.00 H new ATOM 0 HA GLU A 88 -12.110 -7.636 -5.619 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -10.479 -9.792 -7.019 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -12.206 -9.559 -7.200 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -11.925 -7.476 -8.321 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -10.249 -7.339 -7.827 1.00 0.00 H new ATOM 1273 N ASN A 89 -10.622 -10.114 -4.071 1.00 0.00 N ATOM 1274 CA ASN A 89 -10.802 -11.148 -3.058 1.00 0.00 C ATOM 1275 C ASN A 89 -11.479 -10.579 -1.815 1.00 0.00 C ATOM 1276 O ASN A 89 -12.526 -11.067 -1.388 1.00 0.00 O ATOM 1277 CB ASN A 89 -9.452 -11.762 -2.681 1.00 0.00 C ATOM 1278 CG ASN A 89 -9.097 -12.955 -3.548 1.00 0.00 C ATOM 1279 OD1 ASN A 89 -9.906 -13.864 -3.732 1.00 0.00 O ATOM 1280 ND2 ASN A 89 -7.882 -12.956 -4.084 1.00 0.00 N ATOM 0 H ASN A 89 -9.653 -9.959 -4.348 1.00 0.00 H new ATOM 0 HA ASN A 89 -11.443 -11.924 -3.476 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -8.673 -11.005 -2.773 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -9.475 -12.070 -1.636 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -7.586 -13.732 -4.676 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -7.244 -12.180 -3.904 1.00 0.00 H new ATOM 1287 N LEU A 90 -10.876 -9.545 -1.240 1.00 0.00 N ATOM 1288 CA LEU A 90 -11.421 -8.909 -0.046 1.00 0.00 C ATOM 1289 C LEU A 90 -12.694 -8.136 -0.373 1.00 0.00 C ATOM 1290 O LEU A 90 -13.576 -7.986 0.472 1.00 0.00 O ATOM 1291 CB LEU A 90 -10.385 -7.968 0.573 1.00 0.00 C ATOM 1292 CG LEU A 90 -9.432 -8.595 1.592 1.00 0.00 C ATOM 1293 CD1 LEU A 90 -10.197 -9.486 2.559 1.00 0.00 C ATOM 1294 CD2 LEU A 90 -8.341 -9.386 0.885 1.00 0.00 C ATOM 0 H LEU A 90 -10.009 -9.129 -1.581 1.00 0.00 H new ATOM 0 HA LEU A 90 -11.667 -9.692 0.671 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.791 -7.535 -0.232 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -10.913 -7.147 1.057 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.961 -7.794 2.162 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -9.503 -9.924 3.277 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -10.941 -8.892 3.089 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -10.695 -10.281 2.005 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.672 -9.825 1.625 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -8.794 -10.179 0.290 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -7.774 -8.721 0.233 1.00 0.00 H new ATOM 1306 N MET A 91 -12.784 -7.650 -1.607 1.00 0.00 N ATOM 1307 CA MET A 91 -13.952 -6.895 -2.047 1.00 0.00 C ATOM 1308 C MET A 91 -15.200 -7.773 -2.042 1.00 0.00 C ATOM 1309 O MET A 91 -16.300 -7.304 -1.749 1.00 0.00 O ATOM 1310 CB MET A 91 -13.720 -6.327 -3.449 1.00 0.00 C ATOM 1311 CG MET A 91 -13.051 -4.962 -3.448 1.00 0.00 C ATOM 1312 SD MET A 91 -13.230 -4.101 -5.022 1.00 0.00 S ATOM 1313 CE MET A 91 -14.836 -3.337 -4.809 1.00 0.00 C ATOM 0 H MET A 91 -12.063 -7.765 -2.319 1.00 0.00 H new ATOM 0 HA MET A 91 -14.105 -6.071 -1.350 1.00 0.00 H new ATOM 0 HB2 MET A 91 -13.104 -7.024 -4.017 1.00 0.00 H new ATOM 0 HB3 MET A 91 -14.677 -6.253 -3.965 1.00 0.00 H new ATOM 0 HG2 MET A 91 -13.480 -4.352 -2.653 1.00 0.00 H new ATOM 0 HG3 MET A 91 -11.991 -5.081 -3.222 1.00 0.00 H new ATOM 0 HE1 MET A 91 -14.856 -2.381 -5.332 1.00 0.00 H new ATOM 0 HE2 MET A 91 -15.607 -3.990 -5.218 1.00 0.00 H new ATOM 0 HE3 MET A 91 -15.024 -3.174 -3.748 1.00 0.00 H new ATOM 1323 N THR A 92 -15.022 -9.049 -2.367 1.00 0.00 N ATOM 1324 CA THR A 92 -16.133 -9.992 -2.401 1.00 0.00 C ATOM 1325 C THR A 92 -16.299 -10.695 -1.058 1.00 0.00 C ATOM 1326 O THR A 92 -17.363 -11.234 -0.756 1.00 0.00 O ATOM 1327 CB THR A 92 -15.938 -11.051 -3.502 1.00 0.00 C ATOM 1328 OG1 THR A 92 -17.192 -11.666 -3.818 1.00 0.00 O ATOM 1329 CG2 THR A 92 -14.944 -12.114 -3.059 1.00 0.00 C ATOM 0 H THR A 92 -14.118 -9.454 -2.611 1.00 0.00 H new ATOM 0 HA THR A 92 -17.031 -9.414 -2.619 1.00 0.00 H new ATOM 0 HB THR A 92 -15.544 -10.554 -4.388 1.00 0.00 H new ATOM 0 HG1 THR A 92 -17.060 -12.337 -4.520 1.00 0.00 H new ATOM 0 HG21 THR A 92 -14.822 -12.851 -3.852 1.00 0.00 H new ATOM 0 HG22 THR A 92 -13.982 -11.647 -2.847 1.00 0.00 H new ATOM 0 HG23 THR A 92 -15.314 -12.606 -2.160 1.00 0.00 H new ATOM 1337 N SER A 93 -15.239 -10.685 -0.255 1.00 0.00 N ATOM 1338 CA SER A 93 -15.267 -11.325 1.055 1.00 0.00 C ATOM 1339 C SER A 93 -16.182 -10.565 2.011 1.00 0.00 C ATOM 1340 O SER A 93 -17.079 -11.146 2.622 1.00 0.00 O ATOM 1341 CB SER A 93 -13.855 -11.403 1.637 1.00 0.00 C ATOM 1342 OG SER A 93 -13.112 -12.449 1.035 1.00 0.00 O ATOM 0 H SER A 93 -14.351 -10.241 -0.489 1.00 0.00 H new ATOM 0 HA SER A 93 -15.658 -12.335 0.931 1.00 0.00 H new ATOM 0 HB2 SER A 93 -13.342 -10.454 1.484 1.00 0.00 H new ATOM 0 HB3 SER A 93 -13.910 -11.565 2.713 1.00 0.00 H new ATOM 0 HG SER A 93 -12.805 -12.164 0.149 1.00 0.00 H new ATOM 1348 N SER A 94 -15.948 -9.263 2.134 1.00 0.00 N ATOM 1349 CA SER A 94 -16.748 -8.423 3.019 1.00 0.00 C ATOM 1350 C SER A 94 -17.462 -7.329 2.230 1.00 0.00 C ATOM 1351 O SER A 94 -17.340 -7.250 1.008 1.00 0.00 O ATOM 1352 CB SER A 94 -15.864 -7.795 4.098 1.00 0.00 C ATOM 1353 OG SER A 94 -15.246 -8.792 4.894 1.00 0.00 O ATOM 0 H SER A 94 -15.212 -8.766 1.633 1.00 0.00 H new ATOM 0 HA SER A 94 -17.499 -9.052 3.496 1.00 0.00 H new ATOM 0 HB2 SER A 94 -15.100 -7.173 3.631 1.00 0.00 H new ATOM 0 HB3 SER A 94 -16.465 -7.141 4.730 1.00 0.00 H new ATOM 0 HG SER A 94 -14.685 -8.366 5.575 1.00 0.00 H new ATOM 1359 N SER A 95 -18.207 -6.488 2.940 1.00 0.00 N ATOM 1360 CA SER A 95 -18.944 -5.400 2.307 1.00 0.00 C ATOM 1361 C SER A 95 -18.153 -4.097 2.372 1.00 0.00 C ATOM 1362 O SER A 95 -17.132 -4.011 3.054 1.00 0.00 O ATOM 1363 CB SER A 95 -20.305 -5.218 2.982 1.00 0.00 C ATOM 1364 OG SER A 95 -21.092 -6.391 2.869 1.00 0.00 O ATOM 0 H SER A 95 -18.316 -6.539 3.953 1.00 0.00 H new ATOM 0 HA SER A 95 -19.097 -5.659 1.259 1.00 0.00 H new ATOM 0 HB2 SER A 95 -20.162 -4.972 4.034 1.00 0.00 H new ATOM 0 HB3 SER A 95 -20.831 -4.379 2.527 1.00 0.00 H new ATOM 0 HG SER A 95 -21.956 -6.249 3.310 1.00 0.00 H new ATOM 1370 N LYS A 96 -18.633 -3.085 1.658 1.00 0.00 N ATOM 1371 CA LYS A 96 -17.973 -1.785 1.634 1.00 0.00 C ATOM 1372 C LYS A 96 -18.001 -1.135 3.013 1.00 0.00 C ATOM 1373 O LYS A 96 -17.044 -0.476 3.417 1.00 0.00 O ATOM 1374 CB LYS A 96 -18.647 -0.867 0.612 1.00 0.00 C ATOM 1375 CG LYS A 96 -18.041 0.525 0.551 1.00 0.00 C ATOM 1376 CD LYS A 96 -18.536 1.296 -0.661 1.00 0.00 C ATOM 1377 CE LYS A 96 -17.673 2.518 -0.934 1.00 0.00 C ATOM 1378 NZ LYS A 96 -17.935 3.091 -2.284 1.00 0.00 N ATOM 0 H LYS A 96 -19.477 -3.140 1.088 1.00 0.00 H new ATOM 0 HA LYS A 96 -16.933 -1.939 1.345 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -18.582 -1.326 -0.375 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -19.706 -0.783 0.855 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -18.293 1.072 1.459 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -16.954 0.448 0.516 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -18.533 0.644 -1.535 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -19.568 1.607 -0.499 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -17.865 3.276 -0.174 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -16.621 2.245 -0.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -17.328 3.922 -2.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -17.727 2.376 -3.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -18.933 3.375 -2.353 1.00 0.00 H new ATOM 1392 N GLU A 97 -19.103 -1.327 3.731 1.00 0.00 N ATOM 1393 CA GLU A 97 -19.253 -0.759 5.066 1.00 0.00 C ATOM 1394 C GLU A 97 -18.539 -1.617 6.106 1.00 0.00 C ATOM 1395 O GLU A 97 -17.970 -1.101 7.067 1.00 0.00 O ATOM 1396 CB GLU A 97 -20.735 -0.630 5.425 1.00 0.00 C ATOM 1397 CG GLU A 97 -21.479 -1.955 5.424 1.00 0.00 C ATOM 1398 CD GLU A 97 -22.845 -1.857 6.075 1.00 0.00 C ATOM 1399 OE1 GLU A 97 -22.905 -1.549 7.284 1.00 0.00 O ATOM 1400 OE2 GLU A 97 -23.854 -2.089 5.377 1.00 0.00 O ATOM 0 H GLU A 97 -19.904 -1.871 3.411 1.00 0.00 H new ATOM 0 HA GLU A 97 -18.799 0.232 5.065 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -20.823 -0.174 6.411 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -21.214 0.047 4.717 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -21.594 -2.302 4.397 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -20.883 -2.702 5.948 1.00 0.00 H new ATOM 1407 N ASP A 98 -18.575 -2.930 5.906 1.00 0.00 N ATOM 1408 CA ASP A 98 -17.931 -3.861 6.825 1.00 0.00 C ATOM 1409 C ASP A 98 -16.495 -3.435 7.113 1.00 0.00 C ATOM 1410 O ASP A 98 -15.934 -3.772 8.156 1.00 0.00 O ATOM 1411 CB ASP A 98 -17.950 -5.277 6.247 1.00 0.00 C ATOM 1412 CG ASP A 98 -19.188 -6.052 6.652 1.00 0.00 C ATOM 1413 OD1 ASP A 98 -20.230 -5.413 6.912 1.00 0.00 O ATOM 1414 OD2 ASP A 98 -19.117 -7.297 6.709 1.00 0.00 O ATOM 0 H ASP A 98 -19.043 -3.373 5.116 1.00 0.00 H new ATOM 0 HA ASP A 98 -18.488 -3.852 7.762 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -17.899 -5.223 5.160 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -17.063 -5.815 6.582 1.00 0.00 H new ATOM 1419 N TRP A 99 -15.905 -2.694 6.182 1.00 0.00 N ATOM 1420 CA TRP A 99 -14.534 -2.223 6.336 1.00 0.00 C ATOM 1421 C TRP A 99 -14.457 -1.094 7.358 1.00 0.00 C ATOM 1422 O TRP A 99 -15.013 -0.013 7.166 1.00 0.00 O ATOM 1423 CB TRP A 99 -13.982 -1.748 4.990 1.00 0.00 C ATOM 1424 CG TRP A 99 -14.265 -2.695 3.864 1.00 0.00 C ATOM 1425 CD1 TRP A 99 -14.331 -4.057 3.936 1.00 0.00 C ATOM 1426 CD2 TRP A 99 -14.519 -2.351 2.498 1.00 0.00 C ATOM 1427 NE1 TRP A 99 -14.611 -4.581 2.697 1.00 0.00 N ATOM 1428 CE2 TRP A 99 -14.731 -3.554 1.797 1.00 0.00 C ATOM 1429 CE3 TRP A 99 -14.589 -1.143 1.798 1.00 0.00 C ATOM 1430 CZ2 TRP A 99 -15.007 -3.583 0.433 1.00 0.00 C ATOM 1431 CZ3 TRP A 99 -14.863 -1.173 0.444 1.00 0.00 C ATOM 1432 CH2 TRP A 99 -15.070 -2.385 -0.227 1.00 0.00 C ATOM 0 H TRP A 99 -16.355 -2.407 5.313 1.00 0.00 H new ATOM 0 HA TRP A 99 -13.929 -3.055 6.696 1.00 0.00 H new ATOM 0 HB2 TRP A 99 -14.411 -0.774 4.753 1.00 0.00 H new ATOM 0 HB3 TRP A 99 -12.904 -1.609 5.076 1.00 0.00 H new ATOM 0 HD1 TRP A 99 -14.185 -4.637 4.835 1.00 0.00 H new ATOM 0 HE1 TRP A 99 -14.713 -5.573 2.482 1.00 0.00 H new ATOM 0 HE3 TRP A 99 -14.432 -0.203 2.306 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 -15.166 -4.517 -0.086 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 -14.919 -0.246 -0.107 1.00 0.00 H new ATOM 0 HH2 TRP A 99 -15.283 -2.374 -1.286 1.00 0.00 H new ATOM 1443 N PRO A 100 -13.752 -1.348 8.470 1.00 0.00 N ATOM 1444 CA PRO A 100 -13.586 -0.365 9.544 1.00 0.00 C ATOM 1445 C PRO A 100 -12.696 0.802 9.129 1.00 0.00 C ATOM 1446 O PRO A 100 -11.744 0.629 8.368 1.00 0.00 O ATOM 1447 CB PRO A 100 -12.923 -1.171 10.664 1.00 0.00 C ATOM 1448 CG PRO A 100 -12.221 -2.283 9.966 1.00 0.00 C ATOM 1449 CD PRO A 100 -13.063 -2.616 8.765 1.00 0.00 C ATOM 0 HA PRO A 100 -14.535 0.089 9.831 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -12.225 -0.557 11.233 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -13.662 -1.550 11.370 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -11.216 -1.984 9.667 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -12.114 -3.149 10.620 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -12.452 -2.946 7.925 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -13.770 -3.417 8.980 1.00 0.00 H new ATOM 1457 N SER A 101 -13.011 1.990 9.635 1.00 0.00 N ATOM 1458 CA SER A 101 -12.241 3.186 9.314 1.00 0.00 C ATOM 1459 C SER A 101 -10.872 3.147 9.985 1.00 0.00 C ATOM 1460 O SER A 101 -10.736 2.687 11.118 1.00 0.00 O ATOM 1461 CB SER A 101 -13.001 4.440 9.751 1.00 0.00 C ATOM 1462 OG SER A 101 -14.070 4.724 8.865 1.00 0.00 O ATOM 0 H SER A 101 -13.794 2.150 10.269 1.00 0.00 H new ATOM 0 HA SER A 101 -12.096 3.216 8.234 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.388 4.301 10.760 1.00 0.00 H new ATOM 0 HB3 SER A 101 -12.318 5.289 9.786 1.00 0.00 H new ATOM 0 HG SER A 101 -14.541 5.529 9.167 1.00 0.00 H new ATOM 1468 N VAL A 102 -9.858 3.635 9.276 1.00 0.00 N ATOM 1469 CA VAL A 102 -8.499 3.657 9.802 1.00 0.00 C ATOM 1470 C VAL A 102 -7.691 4.796 9.189 1.00 0.00 C ATOM 1471 O VAL A 102 -7.847 5.118 8.012 1.00 0.00 O ATOM 1472 CB VAL A 102 -7.772 2.326 9.536 1.00 0.00 C ATOM 1473 CG1 VAL A 102 -8.435 1.192 10.303 1.00 0.00 C ATOM 1474 CG2 VAL A 102 -7.740 2.025 8.045 1.00 0.00 C ATOM 0 H VAL A 102 -9.953 4.020 8.336 1.00 0.00 H new ATOM 0 HA VAL A 102 -8.579 3.810 10.878 1.00 0.00 H new ATOM 0 HB VAL A 102 -6.744 2.417 9.887 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -7.907 0.260 10.102 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -8.400 1.406 11.371 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -9.473 1.097 9.986 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -7.222 1.081 7.875 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -8.760 1.953 7.666 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -7.215 2.825 7.523 1.00 0.00 H new ATOM 1484 N ASN A 103 -6.827 5.403 9.996 1.00 0.00 N ATOM 1485 CA ASN A 103 -5.994 6.507 9.533 1.00 0.00 C ATOM 1486 C ASN A 103 -4.640 5.999 9.047 1.00 0.00 C ATOM 1487 O ASN A 103 -3.936 5.292 9.766 1.00 0.00 O ATOM 1488 CB ASN A 103 -5.796 7.529 10.655 1.00 0.00 C ATOM 1489 CG ASN A 103 -7.093 8.201 11.060 1.00 0.00 C ATOM 1490 OD1 ASN A 103 -7.657 8.993 10.305 1.00 0.00 O ATOM 1491 ND2 ASN A 103 -7.572 7.887 12.258 1.00 0.00 N ATOM 0 H ASN A 103 -6.685 5.149 10.974 1.00 0.00 H new ATOM 0 HA ASN A 103 -6.503 6.989 8.698 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -5.361 7.033 11.522 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -5.083 8.287 10.331 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -8.441 8.308 12.586 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -7.071 7.225 12.850 1.00 0.00 H new ATOM 1498 N MET A 104 -4.282 6.368 7.821 1.00 0.00 N ATOM 1499 CA MET A 104 -3.011 5.951 7.239 1.00 0.00 C ATOM 1500 C MET A 104 -1.948 7.030 7.426 1.00 0.00 C ATOM 1501 O MET A 104 -2.214 8.216 7.237 1.00 0.00 O ATOM 1502 CB MET A 104 -3.184 5.642 5.751 1.00 0.00 C ATOM 1503 CG MET A 104 -1.984 4.944 5.132 1.00 0.00 C ATOM 1504 SD MET A 104 -2.086 3.148 5.256 1.00 0.00 S ATOM 1505 CE MET A 104 -3.251 2.783 3.946 1.00 0.00 C ATOM 0 H MET A 104 -4.853 6.954 7.212 1.00 0.00 H new ATOM 0 HA MET A 104 -2.682 5.048 7.754 1.00 0.00 H new ATOM 0 HB2 MET A 104 -4.066 5.016 5.618 1.00 0.00 H new ATOM 0 HB3 MET A 104 -3.370 6.572 5.214 1.00 0.00 H new ATOM 0 HG2 MET A 104 -1.905 5.228 4.083 1.00 0.00 H new ATOM 0 HG3 MET A 104 -1.074 5.287 5.625 1.00 0.00 H new ATOM 0 HE1 MET A 104 -4.057 2.163 4.338 1.00 0.00 H new ATOM 0 HE2 MET A 104 -3.665 3.714 3.557 1.00 0.00 H new ATOM 0 HE3 MET A 104 -2.741 2.250 3.144 1.00 0.00 H new ATOM 1515 N ASN A 105 -0.744 6.609 7.800 1.00 0.00 N ATOM 1516 CA ASN A 105 0.358 7.539 8.013 1.00 0.00 C ATOM 1517 C ASN A 105 1.423 7.378 6.933 1.00 0.00 C ATOM 1518 O ASN A 105 1.642 6.280 6.421 1.00 0.00 O ATOM 1519 CB ASN A 105 0.979 7.319 9.394 1.00 0.00 C ATOM 1520 CG ASN A 105 0.039 7.705 10.519 1.00 0.00 C ATOM 1521 OD1 ASN A 105 -1.107 8.088 10.282 1.00 0.00 O ATOM 1522 ND2 ASN A 105 0.521 7.607 11.753 1.00 0.00 N ATOM 0 H ASN A 105 -0.507 5.630 7.962 1.00 0.00 H new ATOM 0 HA ASN A 105 -0.040 8.552 7.958 1.00 0.00 H new ATOM 0 HB2 ASN A 105 1.258 6.271 9.501 1.00 0.00 H new ATOM 0 HB3 ASN A 105 1.896 7.903 9.474 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -0.065 7.854 12.551 1.00 0.00 H new ATOM 0 HD22 ASN A 105 1.477 7.285 11.903 1.00 0.00 H new ATOM 1529 N VAL A 106 2.084 8.480 6.592 1.00 0.00 N ATOM 1530 CA VAL A 106 3.127 8.461 5.574 1.00 0.00 C ATOM 1531 C VAL A 106 4.363 9.224 6.039 1.00 0.00 C ATOM 1532 O VAL A 106 5.119 9.755 5.227 1.00 0.00 O ATOM 1533 CB VAL A 106 2.631 9.071 4.249 1.00 0.00 C ATOM 1534 CG1 VAL A 106 3.644 8.835 3.140 1.00 0.00 C ATOM 1535 CG2 VAL A 106 1.273 8.495 3.874 1.00 0.00 C ATOM 0 H VAL A 106 1.915 9.397 7.006 1.00 0.00 H new ATOM 0 HA VAL A 106 3.388 7.416 5.409 1.00 0.00 H new ATOM 0 HB VAL A 106 2.520 10.147 4.383 1.00 0.00 H new ATOM 0 HG11 VAL A 106 3.276 9.273 2.212 1.00 0.00 H new ATOM 0 HG12 VAL A 106 4.593 9.299 3.409 1.00 0.00 H new ATOM 0 HG13 VAL A 106 3.790 7.764 3.003 1.00 0.00 H new ATOM 0 HG21 VAL A 106 0.937 8.936 2.936 1.00 0.00 H new ATOM 0 HG22 VAL A 106 1.356 7.414 3.758 1.00 0.00 H new ATOM 0 HG23 VAL A 106 0.552 8.721 4.660 1.00 0.00 H new ATOM 1545 N ALA A 107 4.562 9.272 7.352 1.00 0.00 N ATOM 1546 CA ALA A 107 5.707 9.967 7.927 1.00 0.00 C ATOM 1547 C ALA A 107 7.004 9.216 7.643 1.00 0.00 C ATOM 1548 O ALA A 107 7.029 7.985 7.631 1.00 0.00 O ATOM 1549 CB ALA A 107 5.517 10.148 9.425 1.00 0.00 C ATOM 0 H ALA A 107 3.945 8.838 8.038 1.00 0.00 H new ATOM 0 HA ALA A 107 5.777 10.949 7.460 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.380 10.668 9.841 1.00 0.00 H new ATOM 0 HB2 ALA A 107 4.616 10.734 9.609 1.00 0.00 H new ATOM 0 HB3 ALA A 107 5.419 9.172 9.900 1.00 0.00 H new ATOM 1555 N ASP A 108 8.077 9.964 7.414 1.00 0.00 N ATOM 1556 CA ASP A 108 9.378 9.368 7.131 1.00 0.00 C ATOM 1557 C ASP A 108 9.250 8.248 6.103 1.00 0.00 C ATOM 1558 O ASP A 108 9.772 7.151 6.299 1.00 0.00 O ATOM 1559 CB ASP A 108 10.007 8.829 8.416 1.00 0.00 C ATOM 1560 CG ASP A 108 11.522 8.869 8.380 1.00 0.00 C ATOM 1561 OD1 ASP A 108 12.096 9.927 8.712 1.00 0.00 O ATOM 1562 OD2 ASP A 108 12.134 7.841 8.021 1.00 0.00 O ATOM 0 H ASP A 108 8.072 10.984 7.419 1.00 0.00 H new ATOM 0 HA ASP A 108 10.023 10.143 6.719 1.00 0.00 H new ATOM 0 HB2 ASP A 108 9.651 9.414 9.264 1.00 0.00 H new ATOM 0 HB3 ASP A 108 9.677 7.802 8.576 1.00 0.00 H new ATOM 1567 N ALA A 109 8.552 8.533 5.009 1.00 0.00 N ATOM 1568 CA ALA A 109 8.356 7.550 3.950 1.00 0.00 C ATOM 1569 C ALA A 109 7.991 6.186 4.528 1.00 0.00 C ATOM 1570 O ALA A 109 8.410 5.149 4.013 1.00 0.00 O ATOM 1571 CB ALA A 109 9.608 7.443 3.092 1.00 0.00 C ATOM 0 H ALA A 109 8.113 9.436 4.833 1.00 0.00 H new ATOM 0 HA ALA A 109 7.528 7.885 3.326 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.448 6.706 2.305 1.00 0.00 H new ATOM 0 HB2 ALA A 109 9.825 8.412 2.643 1.00 0.00 H new ATOM 0 HB3 ALA A 109 10.449 7.135 3.713 1.00 0.00 H new ATOM 1577 N THR A 110 7.206 6.195 5.601 1.00 0.00 N ATOM 1578 CA THR A 110 6.786 4.959 6.250 1.00 0.00 C ATOM 1579 C THR A 110 5.266 4.837 6.267 1.00 0.00 C ATOM 1580 O THR A 110 4.556 5.823 6.463 1.00 0.00 O ATOM 1581 CB THR A 110 7.312 4.876 7.695 1.00 0.00 C ATOM 1582 OG1 THR A 110 8.744 4.896 7.697 1.00 0.00 O ATOM 1583 CG2 THR A 110 6.817 3.611 8.379 1.00 0.00 C ATOM 0 H THR A 110 6.848 7.044 6.039 1.00 0.00 H new ATOM 0 HA THR A 110 7.208 4.138 5.670 1.00 0.00 H new ATOM 0 HB THR A 110 6.936 5.739 8.245 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.061 5.692 7.220 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.201 3.574 9.398 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.727 3.612 8.402 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.167 2.738 7.828 1.00 0.00 H new ATOM 1591 N VAL A 111 4.773 3.620 6.060 1.00 0.00 N ATOM 1592 CA VAL A 111 3.337 3.368 6.053 1.00 0.00 C ATOM 1593 C VAL A 111 2.889 2.706 7.351 1.00 0.00 C ATOM 1594 O VAL A 111 3.331 1.606 7.686 1.00 0.00 O ATOM 1595 CB VAL A 111 2.929 2.475 4.867 1.00 0.00 C ATOM 1596 CG1 VAL A 111 1.416 2.329 4.803 1.00 0.00 C ATOM 1597 CG2 VAL A 111 3.474 3.039 3.563 1.00 0.00 C ATOM 0 H VAL A 111 5.347 2.793 5.895 1.00 0.00 H new ATOM 0 HA VAL A 111 2.847 4.336 5.954 1.00 0.00 H new ATOM 0 HB VAL A 111 3.359 1.485 5.016 1.00 0.00 H new ATOM 0 HG11 VAL A 111 1.147 1.695 3.958 1.00 0.00 H new ATOM 0 HG12 VAL A 111 1.055 1.876 5.726 1.00 0.00 H new ATOM 0 HG13 VAL A 111 0.961 3.311 4.678 1.00 0.00 H new ATOM 0 HG21 VAL A 111 3.176 2.395 2.735 1.00 0.00 H new ATOM 0 HG22 VAL A 111 3.075 4.041 3.405 1.00 0.00 H new ATOM 0 HG23 VAL A 111 4.562 3.085 3.613 1.00 0.00 H new ATOM 1607 N THR A 112 2.007 3.382 8.081 1.00 0.00 N ATOM 1608 CA THR A 112 1.499 2.861 9.343 1.00 0.00 C ATOM 1609 C THR A 112 -0.017 3.004 9.427 1.00 0.00 C ATOM 1610 O THR A 112 -0.534 4.093 9.674 1.00 0.00 O ATOM 1611 CB THR A 112 2.139 3.579 10.546 1.00 0.00 C ATOM 1612 OG1 THR A 112 3.548 3.723 10.338 1.00 0.00 O ATOM 1613 CG2 THR A 112 1.888 2.807 11.833 1.00 0.00 C ATOM 0 H THR A 112 1.630 4.293 7.819 1.00 0.00 H new ATOM 0 HA THR A 112 1.764 1.804 9.378 1.00 0.00 H new ATOM 0 HB THR A 112 1.683 4.565 10.637 1.00 0.00 H new ATOM 0 HG1 THR A 112 3.947 4.182 11.107 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.349 3.333 12.669 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.815 2.724 12.004 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.320 1.810 11.749 1.00 0.00 H new ATOM 1621 N VAL A 113 -0.724 1.898 9.221 1.00 0.00 N ATOM 1622 CA VAL A 113 -2.181 1.900 9.275 1.00 0.00 C ATOM 1623 C VAL A 113 -2.677 2.069 10.707 1.00 0.00 C ATOM 1624 O VAL A 113 -2.819 1.093 11.444 1.00 0.00 O ATOM 1625 CB VAL A 113 -2.766 0.601 8.690 1.00 0.00 C ATOM 1626 CG1 VAL A 113 -4.277 0.570 8.865 1.00 0.00 C ATOM 1627 CG2 VAL A 113 -2.388 0.459 7.224 1.00 0.00 C ATOM 0 H VAL A 113 -0.311 0.988 9.015 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.519 2.744 8.674 1.00 0.00 H new ATOM 0 HB VAL A 113 -2.344 -0.244 9.233 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -4.673 -0.355 8.446 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -4.522 0.621 9.926 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -4.721 1.421 8.349 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -2.810 -0.464 6.827 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -2.780 1.307 6.663 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.302 0.432 7.129 1.00 0.00 H new ATOM 1637 N ILE A 114 -2.939 3.313 11.093 1.00 0.00 N ATOM 1638 CA ILE A 114 -3.421 3.609 12.436 1.00 0.00 C ATOM 1639 C ILE A 114 -4.931 3.416 12.534 1.00 0.00 C ATOM 1640 O ILE A 114 -5.647 3.524 11.538 1.00 0.00 O ATOM 1641 CB ILE A 114 -3.072 5.050 12.855 1.00 0.00 C ATOM 1642 CG1 ILE A 114 -1.601 5.347 12.558 1.00 0.00 C ATOM 1643 CG2 ILE A 114 -3.373 5.260 14.331 1.00 0.00 C ATOM 1644 CD1 ILE A 114 -0.646 4.728 13.554 1.00 0.00 C ATOM 0 H ILE A 114 -2.826 4.132 10.495 1.00 0.00 H new ATOM 0 HA ILE A 114 -2.923 2.912 13.110 1.00 0.00 H new ATOM 0 HB ILE A 114 -3.687 5.740 12.278 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -1.359 4.981 11.560 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -1.452 6.427 12.547 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -3.121 6.283 14.612 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -4.433 5.084 14.515 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -2.781 4.564 14.926 1.00 0.00 H new ATOM 0 HD11 ILE A 114 0.379 4.980 13.281 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -0.861 5.112 14.551 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -0.767 3.645 13.549 1.00 0.00 H new ATOM 1656 N SER A 115 -5.409 3.131 13.741 1.00 0.00 N ATOM 1657 CA SER A 115 -6.834 2.920 13.969 1.00 0.00 C ATOM 1658 C SER A 115 -7.579 4.251 14.013 1.00 0.00 C ATOM 1659 O SER A 115 -6.968 5.312 14.131 1.00 0.00 O ATOM 1660 CB SER A 115 -7.055 2.155 15.275 1.00 0.00 C ATOM 1661 OG SER A 115 -8.388 1.682 15.369 1.00 0.00 O ATOM 0 H SER A 115 -4.830 3.041 14.576 1.00 0.00 H new ATOM 0 HA SER A 115 -7.227 2.331 13.141 1.00 0.00 H new ATOM 0 HB2 SER A 115 -6.363 1.315 15.330 1.00 0.00 H new ATOM 0 HB3 SER A 115 -6.836 2.805 16.122 1.00 0.00 H new ATOM 0 HG SER A 115 -8.504 1.195 16.212 1.00 0.00 H new ATOM 1667 N GLU A 116 -8.903 4.183 13.917 1.00 0.00 N ATOM 1668 CA GLU A 116 -9.733 5.382 13.945 1.00 0.00 C ATOM 1669 C GLU A 116 -10.149 5.723 15.373 1.00 0.00 C ATOM 1670 O GLU A 116 -10.275 6.893 15.734 1.00 0.00 O ATOM 1671 CB GLU A 116 -10.974 5.191 13.072 1.00 0.00 C ATOM 1672 CG GLU A 116 -11.605 6.496 12.616 1.00 0.00 C ATOM 1673 CD GLU A 116 -11.926 7.424 13.771 1.00 0.00 C ATOM 1674 OE1 GLU A 116 -12.888 7.135 14.514 1.00 0.00 O ATOM 1675 OE2 GLU A 116 -11.217 8.439 13.933 1.00 0.00 O ATOM 0 H GLU A 116 -9.424 3.311 13.819 1.00 0.00 H new ATOM 0 HA GLU A 116 -9.144 6.209 13.550 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -10.704 4.602 12.195 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.713 4.614 13.628 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -10.928 7.001 11.927 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -12.520 6.280 12.064 1.00 0.00 H new ATOM 1682 N LYS A 117 -10.362 4.691 16.183 1.00 0.00 N ATOM 1683 CA LYS A 117 -10.764 4.878 17.572 1.00 0.00 C ATOM 1684 C LYS A 117 -9.640 5.517 18.382 1.00 0.00 C ATOM 1685 O LYS A 117 -9.891 6.291 19.305 1.00 0.00 O ATOM 1686 CB LYS A 117 -11.157 3.537 18.196 1.00 0.00 C ATOM 1687 CG LYS A 117 -12.405 2.924 17.584 1.00 0.00 C ATOM 1688 CD LYS A 117 -12.057 1.891 16.525 1.00 0.00 C ATOM 1689 CE LYS A 117 -11.956 0.495 17.120 1.00 0.00 C ATOM 1690 NZ LYS A 117 -11.431 -0.491 16.136 1.00 0.00 N ATOM 0 H LYS A 117 -10.263 3.716 15.901 1.00 0.00 H new ATOM 0 HA LYS A 117 -11.625 5.546 17.588 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -10.328 2.838 18.087 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -11.318 3.676 19.265 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -13.003 2.457 18.366 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -13.017 3.709 17.140 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -12.816 1.900 15.743 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -11.111 2.156 16.054 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -11.304 0.519 17.993 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -12.939 0.175 17.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -11.377 -1.430 16.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -12.066 -0.533 15.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -10.482 -0.200 15.826 1.00 0.00 H new ATOM 1704 N ASN A 118 -8.402 5.190 18.029 1.00 0.00 N ATOM 1705 CA ASN A 118 -7.240 5.733 18.722 1.00 0.00 C ATOM 1706 C ASN A 118 -6.121 6.058 17.738 1.00 0.00 C ATOM 1707 O ASN A 118 -6.119 5.576 16.605 1.00 0.00 O ATOM 1708 CB ASN A 118 -6.738 4.742 19.774 1.00 0.00 C ATOM 1709 CG ASN A 118 -7.603 4.731 21.019 1.00 0.00 C ATOM 1710 OD1 ASN A 118 -7.515 5.628 21.858 1.00 0.00 O ATOM 1711 ND2 ASN A 118 -8.447 3.713 21.144 1.00 0.00 N ATOM 0 H ASN A 118 -8.177 4.551 17.266 1.00 0.00 H new ATOM 0 HA ASN A 118 -7.543 6.656 19.217 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -6.714 3.741 19.343 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -5.714 4.996 20.049 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -9.056 3.653 21.960 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -8.486 2.992 20.424 1.00 0.00 H new ATOM 1718 N GLU A 119 -5.171 6.877 18.179 1.00 0.00 N ATOM 1719 CA GLU A 119 -4.046 7.265 17.335 1.00 0.00 C ATOM 1720 C GLU A 119 -2.795 6.470 17.696 1.00 0.00 C ATOM 1721 O GLU A 119 -1.809 6.478 16.961 1.00 0.00 O ATOM 1722 CB GLU A 119 -3.769 8.764 17.475 1.00 0.00 C ATOM 1723 CG GLU A 119 -2.827 9.310 16.415 1.00 0.00 C ATOM 1724 CD GLU A 119 -2.629 10.809 16.528 1.00 0.00 C ATOM 1725 OE1 GLU A 119 -2.084 11.260 17.556 1.00 0.00 O ATOM 1726 OE2 GLU A 119 -3.019 11.531 15.586 1.00 0.00 O ATOM 0 H GLU A 119 -5.158 7.284 19.114 1.00 0.00 H new ATOM 0 HA GLU A 119 -4.308 7.046 16.300 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -4.713 9.306 17.424 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -3.344 8.956 18.460 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -1.861 8.812 16.501 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -3.221 9.073 15.427 1.00 0.00 H new ATOM 1733 N GLU A 120 -2.845 5.783 18.834 1.00 0.00 N ATOM 1734 CA GLU A 120 -1.715 4.984 19.293 1.00 0.00 C ATOM 1735 C GLU A 120 -1.965 3.498 19.047 1.00 0.00 C ATOM 1736 O GLU A 120 -1.323 2.643 19.656 1.00 0.00 O ATOM 1737 CB GLU A 120 -1.459 5.230 20.781 1.00 0.00 C ATOM 1738 CG GLU A 120 -2.601 4.782 21.678 1.00 0.00 C ATOM 1739 CD GLU A 120 -2.479 5.319 23.091 1.00 0.00 C ATOM 1740 OE1 GLU A 120 -2.719 6.528 23.290 1.00 0.00 O ATOM 1741 OE2 GLU A 120 -2.143 4.529 23.998 1.00 0.00 O ATOM 0 H GLU A 120 -3.655 5.764 19.454 1.00 0.00 H new ATOM 0 HA GLU A 120 -0.834 5.286 18.726 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -0.550 4.706 21.076 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -1.280 6.293 20.939 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -3.547 5.113 21.248 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -2.628 3.693 21.708 1.00 0.00 H new ATOM 1748 N GLU A 121 -2.901 3.202 18.151 1.00 0.00 N ATOM 1749 CA GLU A 121 -3.236 1.820 17.827 1.00 0.00 C ATOM 1750 C GLU A 121 -2.698 1.439 16.450 1.00 0.00 C ATOM 1751 O GLU A 121 -3.442 1.402 15.470 1.00 0.00 O ATOM 1752 CB GLU A 121 -4.752 1.616 17.869 1.00 0.00 C ATOM 1753 CG GLU A 121 -5.177 0.169 17.685 1.00 0.00 C ATOM 1754 CD GLU A 121 -6.479 -0.151 18.392 1.00 0.00 C ATOM 1755 OE1 GLU A 121 -6.576 0.120 19.607 1.00 0.00 O ATOM 1756 OE2 GLU A 121 -7.401 -0.673 17.731 1.00 0.00 O ATOM 0 H GLU A 121 -3.440 3.899 17.637 1.00 0.00 H new ATOM 0 HA GLU A 121 -2.769 1.175 18.572 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -5.133 1.979 18.824 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -5.214 2.223 17.090 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -5.284 -0.042 16.621 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -4.392 -0.487 18.062 1.00 0.00 H new ATOM 1763 N VAL A 122 -1.401 1.158 16.385 1.00 0.00 N ATOM 1764 CA VAL A 122 -0.763 0.779 15.130 1.00 0.00 C ATOM 1765 C VAL A 122 -1.167 -0.630 14.711 1.00 0.00 C ATOM 1766 O VAL A 122 -0.681 -1.617 15.264 1.00 0.00 O ATOM 1767 CB VAL A 122 0.772 0.851 15.237 1.00 0.00 C ATOM 1768 CG1 VAL A 122 1.238 0.342 16.593 1.00 0.00 C ATOM 1769 CG2 VAL A 122 1.422 0.061 14.110 1.00 0.00 C ATOM 0 H VAL A 122 -0.771 1.186 17.187 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.101 1.490 14.376 1.00 0.00 H new ATOM 0 HB VAL A 122 1.077 1.893 15.143 1.00 0.00 H new ATOM 0 HG11 VAL A 122 2.325 0.401 16.650 1.00 0.00 H new ATOM 0 HG12 VAL A 122 0.800 0.954 17.381 1.00 0.00 H new ATOM 0 HG13 VAL A 122 0.923 -0.694 16.721 1.00 0.00 H new ATOM 0 HG21 VAL A 122 2.506 0.123 14.201 1.00 0.00 H new ATOM 0 HG22 VAL A 122 1.111 -0.982 14.171 1.00 0.00 H new ATOM 0 HG23 VAL A 122 1.114 0.476 13.150 1.00 0.00 H new ATOM 1779 N LEU A 123 -2.059 -0.717 13.730 1.00 0.00 N ATOM 1780 CA LEU A 123 -2.529 -2.006 13.236 1.00 0.00 C ATOM 1781 C LEU A 123 -1.488 -2.653 12.327 1.00 0.00 C ATOM 1782 O LEU A 123 -1.217 -3.849 12.429 1.00 0.00 O ATOM 1783 CB LEU A 123 -3.847 -1.834 12.479 1.00 0.00 C ATOM 1784 CG LEU A 123 -4.977 -1.149 13.247 1.00 0.00 C ATOM 1785 CD1 LEU A 123 -6.022 -0.604 12.285 1.00 0.00 C ATOM 1786 CD2 LEU A 123 -5.613 -2.116 14.235 1.00 0.00 C ATOM 0 H LEU A 123 -2.471 0.090 13.261 1.00 0.00 H new ATOM 0 HA LEU A 123 -2.692 -2.659 14.094 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -3.650 -1.260 11.573 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -4.193 -2.818 12.164 1.00 0.00 H new ATOM 0 HG LEU A 123 -4.556 -0.313 13.806 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -6.819 -0.120 12.850 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -5.558 0.122 11.617 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -6.439 -1.423 11.698 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.415 -1.611 14.773 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -6.020 -2.972 13.696 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -4.860 -2.459 14.945 1.00 0.00 H new ATOM 1798 N VAL A 124 -0.906 -1.853 11.439 1.00 0.00 N ATOM 1799 CA VAL A 124 0.108 -2.346 10.515 1.00 0.00 C ATOM 1800 C VAL A 124 1.268 -1.365 10.397 1.00 0.00 C ATOM 1801 O VAL A 124 1.068 -0.184 10.114 1.00 0.00 O ATOM 1802 CB VAL A 124 -0.483 -2.597 9.115 1.00 0.00 C ATOM 1803 CG1 VAL A 124 0.613 -2.981 8.133 1.00 0.00 C ATOM 1804 CG2 VAL A 124 -1.557 -3.672 9.175 1.00 0.00 C ATOM 0 H VAL A 124 -1.120 -0.861 11.340 1.00 0.00 H new ATOM 0 HA VAL A 124 0.474 -3.289 10.921 1.00 0.00 H new ATOM 0 HB VAL A 124 -0.944 -1.674 8.764 1.00 0.00 H new ATOM 0 HG11 VAL A 124 0.176 -3.154 7.150 1.00 0.00 H new ATOM 0 HG12 VAL A 124 1.343 -2.174 8.069 1.00 0.00 H new ATOM 0 HG13 VAL A 124 1.107 -3.890 8.476 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -1.964 -3.836 8.177 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -1.123 -4.600 9.547 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -2.356 -3.351 9.844 1.00 0.00 H new ATOM 1814 N GLU A 125 2.482 -1.862 10.615 1.00 0.00 N ATOM 1815 CA GLU A 125 3.675 -1.027 10.533 1.00 0.00 C ATOM 1816 C GLU A 125 4.565 -1.463 9.372 1.00 0.00 C ATOM 1817 O GLU A 125 5.391 -2.365 9.515 1.00 0.00 O ATOM 1818 CB GLU A 125 4.460 -1.091 11.844 1.00 0.00 C ATOM 1819 CG GLU A 125 5.528 -0.017 11.967 1.00 0.00 C ATOM 1820 CD GLU A 125 6.145 0.037 13.351 1.00 0.00 C ATOM 1821 OE1 GLU A 125 5.399 0.270 14.325 1.00 0.00 O ATOM 1822 OE2 GLU A 125 7.374 -0.154 13.460 1.00 0.00 O ATOM 0 H GLU A 125 2.665 -2.838 10.849 1.00 0.00 H new ATOM 0 HA GLU A 125 3.357 0.001 10.358 1.00 0.00 H new ATOM 0 HB2 GLU A 125 3.765 -0.998 12.679 1.00 0.00 H new ATOM 0 HB3 GLU A 125 4.930 -2.071 11.929 1.00 0.00 H new ATOM 0 HG2 GLU A 125 6.311 -0.202 11.231 1.00 0.00 H new ATOM 0 HG3 GLU A 125 5.091 0.953 11.730 1.00 0.00 H new ATOM 1829 N CYS A 126 4.389 -0.817 8.225 1.00 0.00 N ATOM 1830 CA CYS A 126 5.175 -1.138 7.039 1.00 0.00 C ATOM 1831 C CYS A 126 5.942 0.085 6.547 1.00 0.00 C ATOM 1832 O CYS A 126 5.546 1.222 6.804 1.00 0.00 O ATOM 1833 CB CYS A 126 4.267 -1.667 5.928 1.00 0.00 C ATOM 1834 SG CYS A 126 5.105 -2.739 4.737 1.00 0.00 S ATOM 0 H CYS A 126 3.709 -0.068 8.091 1.00 0.00 H new ATOM 0 HA CYS A 126 5.895 -1.911 7.309 1.00 0.00 H new ATOM 0 HB2 CYS A 126 3.442 -2.218 6.379 1.00 0.00 H new ATOM 0 HB3 CYS A 126 3.832 -0.821 5.396 1.00 0.00 H new ATOM 0 HG CYS A 126 4.468 -3.869 4.647 1.00 0.00 H new ATOM 1840 N ARG A 127 7.041 -0.157 5.840 1.00 0.00 N ATOM 1841 CA ARG A 127 7.864 0.925 5.314 1.00 0.00 C ATOM 1842 C ARG A 127 8.107 0.747 3.818 1.00 0.00 C ATOM 1843 O ARG A 127 7.742 -0.275 3.237 1.00 0.00 O ATOM 1844 CB ARG A 127 9.202 0.983 6.055 1.00 0.00 C ATOM 1845 CG ARG A 127 9.058 1.182 7.555 1.00 0.00 C ATOM 1846 CD ARG A 127 10.326 0.782 8.294 1.00 0.00 C ATOM 1847 NE ARG A 127 10.507 1.547 9.525 1.00 0.00 N ATOM 1848 CZ ARG A 127 11.275 1.148 10.532 1.00 0.00 C ATOM 1849 NH1 ARG A 127 11.932 -0.001 10.454 1.00 0.00 N ATOM 1850 NH2 ARG A 127 11.389 1.899 11.620 1.00 0.00 N ATOM 0 H ARG A 127 7.382 -1.092 5.618 1.00 0.00 H new ATOM 0 HA ARG A 127 7.329 1.862 5.468 1.00 0.00 H new ATOM 0 HB2 ARG A 127 9.751 0.059 5.870 1.00 0.00 H new ATOM 0 HB3 ARG A 127 9.800 1.797 5.645 1.00 0.00 H new ATOM 0 HG2 ARG A 127 8.828 2.227 7.764 1.00 0.00 H new ATOM 0 HG3 ARG A 127 8.219 0.591 7.923 1.00 0.00 H new ATOM 0 HD2 ARG A 127 10.288 -0.281 8.530 1.00 0.00 H new ATOM 0 HD3 ARG A 127 11.188 0.933 7.644 1.00 0.00 H new ATOM 0 HE ARG A 127 10.016 2.437 9.616 1.00 0.00 H new ATOM 0 HH11 ARG A 127 11.848 -0.581 9.619 1.00 0.00 H new ATOM 0 HH12 ARG A 127 12.521 -0.305 11.229 1.00 0.00 H new ATOM 0 HH21 ARG A 127 10.886 2.784 11.684 1.00 0.00 H new ATOM 0 HH22 ARG A 127 11.979 1.591 12.393 1.00 0.00 H new ATOM 1864 N VAL A 128 8.725 1.748 3.201 1.00 0.00 N ATOM 1865 CA VAL A 128 9.017 1.702 1.773 1.00 0.00 C ATOM 1866 C VAL A 128 10.158 0.735 1.476 1.00 0.00 C ATOM 1867 O VAL A 128 10.313 0.269 0.347 1.00 0.00 O ATOM 1868 CB VAL A 128 9.386 3.096 1.230 1.00 0.00 C ATOM 1869 CG1 VAL A 128 8.174 4.015 1.253 1.00 0.00 C ATOM 1870 CG2 VAL A 128 10.534 3.693 2.031 1.00 0.00 C ATOM 0 H VAL A 128 9.033 2.601 3.667 1.00 0.00 H new ATOM 0 HA VAL A 128 8.111 1.355 1.276 1.00 0.00 H new ATOM 0 HB VAL A 128 9.712 2.990 0.195 1.00 0.00 H new ATOM 0 HG11 VAL A 128 8.453 4.995 0.866 1.00 0.00 H new ATOM 0 HG12 VAL A 128 7.384 3.591 0.632 1.00 0.00 H new ATOM 0 HG13 VAL A 128 7.815 4.118 2.277 1.00 0.00 H new ATOM 0 HG21 VAL A 128 10.781 4.677 1.634 1.00 0.00 H new ATOM 0 HG22 VAL A 128 10.238 3.787 3.076 1.00 0.00 H new ATOM 0 HG23 VAL A 128 11.406 3.043 1.958 1.00 0.00 H new ATOM 1880 N ARG A 129 10.954 0.437 2.498 1.00 0.00 N ATOM 1881 CA ARG A 129 12.082 -0.474 2.347 1.00 0.00 C ATOM 1882 C ARG A 129 11.603 -1.919 2.243 1.00 0.00 C ATOM 1883 O ARG A 129 12.312 -2.784 1.726 1.00 0.00 O ATOM 1884 CB ARG A 129 13.045 -0.328 3.526 1.00 0.00 C ATOM 1885 CG ARG A 129 13.311 1.116 3.921 1.00 0.00 C ATOM 1886 CD ARG A 129 14.701 1.285 4.514 1.00 0.00 C ATOM 1887 NE ARG A 129 14.706 1.087 5.961 1.00 0.00 N ATOM 1888 CZ ARG A 129 15.815 1.028 6.690 1.00 0.00 C ATOM 1889 NH1 ARG A 129 17.001 1.153 6.111 1.00 0.00 N ATOM 1890 NH2 ARG A 129 15.738 0.846 8.002 1.00 0.00 N ATOM 0 H ARG A 129 10.838 0.813 3.439 1.00 0.00 H new ATOM 0 HA ARG A 129 12.605 -0.215 1.426 1.00 0.00 H new ATOM 0 HB2 ARG A 129 12.638 -0.861 4.385 1.00 0.00 H new ATOM 0 HB3 ARG A 129 13.991 -0.807 3.273 1.00 0.00 H new ATOM 0 HG2 ARG A 129 13.207 1.758 3.047 1.00 0.00 H new ATOM 0 HG3 ARG A 129 12.564 1.440 4.645 1.00 0.00 H new ATOM 0 HD2 ARG A 129 15.383 0.573 4.048 1.00 0.00 H new ATOM 0 HD3 ARG A 129 15.075 2.283 4.283 1.00 0.00 H new ATOM 0 HE ARG A 129 13.810 0.989 6.438 1.00 0.00 H new ATOM 0 HH11 ARG A 129 17.064 1.295 5.103 1.00 0.00 H new ATOM 0 HH12 ARG A 129 17.851 1.107 6.674 1.00 0.00 H new ATOM 0 HH21 ARG A 129 14.827 0.751 8.451 1.00 0.00 H new ATOM 0 HH22 ARG A 129 16.590 0.801 8.561 1.00 0.00 H new ATOM 1904 N PHE A 130 10.397 -2.174 2.739 1.00 0.00 N ATOM 1905 CA PHE A 130 9.824 -3.515 2.703 1.00 0.00 C ATOM 1906 C PHE A 130 8.765 -3.625 1.610 1.00 0.00 C ATOM 1907 O PHE A 130 8.424 -4.723 1.168 1.00 0.00 O ATOM 1908 CB PHE A 130 9.210 -3.866 4.060 1.00 0.00 C ATOM 1909 CG PHE A 130 10.230 -4.082 5.141 1.00 0.00 C ATOM 1910 CD1 PHE A 130 10.946 -3.015 5.661 1.00 0.00 C ATOM 1911 CD2 PHE A 130 10.474 -5.352 5.639 1.00 0.00 C ATOM 1912 CE1 PHE A 130 11.886 -3.211 6.655 1.00 0.00 C ATOM 1913 CE2 PHE A 130 11.412 -5.555 6.633 1.00 0.00 C ATOM 1914 CZ PHE A 130 12.118 -4.483 7.142 1.00 0.00 C ATOM 0 H PHE A 130 9.798 -1.470 3.170 1.00 0.00 H new ATOM 0 HA PHE A 130 10.625 -4.220 2.480 1.00 0.00 H new ATOM 0 HB2 PHE A 130 8.535 -3.065 4.363 1.00 0.00 H new ATOM 0 HB3 PHE A 130 8.607 -4.768 3.955 1.00 0.00 H new ATOM 0 HD1 PHE A 130 10.767 -2.019 5.285 1.00 0.00 H new ATOM 0 HD2 PHE A 130 9.924 -6.194 5.245 1.00 0.00 H new ATOM 0 HE1 PHE A 130 12.438 -2.371 7.050 1.00 0.00 H new ATOM 0 HE2 PHE A 130 11.593 -6.550 7.011 1.00 0.00 H new ATOM 0 HZ PHE A 130 12.851 -4.639 7.920 1.00 0.00 H new ATOM 1924 N LEU A 131 8.248 -2.480 1.179 1.00 0.00 N ATOM 1925 CA LEU A 131 7.227 -2.446 0.137 1.00 0.00 C ATOM 1926 C LEU A 131 7.791 -2.928 -1.195 1.00 0.00 C ATOM 1927 O LEU A 131 8.800 -2.412 -1.676 1.00 0.00 O ATOM 1928 CB LEU A 131 6.671 -1.029 -0.014 1.00 0.00 C ATOM 1929 CG LEU A 131 5.217 -0.923 -0.474 1.00 0.00 C ATOM 1930 CD1 LEU A 131 4.720 0.509 -0.349 1.00 0.00 C ATOM 1931 CD2 LEU A 131 5.073 -1.416 -1.906 1.00 0.00 C ATOM 0 H LEU A 131 8.519 -1.563 1.534 1.00 0.00 H new ATOM 0 HA LEU A 131 6.420 -3.117 0.432 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.766 -0.519 0.945 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.296 -0.489 -0.725 1.00 0.00 H new ATOM 0 HG LEU A 131 4.606 -1.555 0.170 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.683 0.565 -0.681 1.00 0.00 H new ATOM 0 HD12 LEU A 131 4.785 0.827 0.691 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.335 1.163 -0.968 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.031 -1.333 -2.216 1.00 0.00 H new ATOM 0 HD22 LEU A 131 5.697 -0.811 -2.564 1.00 0.00 H new ATOM 0 HD23 LEU A 131 5.387 -2.458 -1.965 1.00 0.00 H new ATOM 1943 N SER A 132 7.133 -3.919 -1.788 1.00 0.00 N ATOM 1944 CA SER A 132 7.570 -4.471 -3.064 1.00 0.00 C ATOM 1945 C SER A 132 6.786 -3.857 -4.220 1.00 0.00 C ATOM 1946 O SER A 132 7.351 -3.179 -5.078 1.00 0.00 O ATOM 1947 CB SER A 132 7.402 -5.992 -3.070 1.00 0.00 C ATOM 1948 OG SER A 132 7.932 -6.568 -1.889 1.00 0.00 O ATOM 0 H SER A 132 6.295 -4.356 -1.405 1.00 0.00 H new ATOM 0 HA SER A 132 8.625 -4.228 -3.194 1.00 0.00 H new ATOM 0 HB2 SER A 132 6.345 -6.244 -3.159 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.904 -6.413 -3.941 1.00 0.00 H new ATOM 0 HG SER A 132 7.811 -7.540 -1.916 1.00 0.00 H new ATOM 1954 N PHE A 133 5.479 -4.099 -4.234 1.00 0.00 N ATOM 1955 CA PHE A 133 4.615 -3.571 -5.284 1.00 0.00 C ATOM 1956 C PHE A 133 3.450 -2.788 -4.687 1.00 0.00 C ATOM 1957 O PHE A 133 3.025 -3.048 -3.562 1.00 0.00 O ATOM 1958 CB PHE A 133 4.084 -4.710 -6.158 1.00 0.00 C ATOM 1959 CG PHE A 133 3.384 -4.236 -7.399 1.00 0.00 C ATOM 1960 CD1 PHE A 133 3.958 -3.268 -8.208 1.00 0.00 C ATOM 1961 CD2 PHE A 133 2.152 -4.759 -7.758 1.00 0.00 C ATOM 1962 CE1 PHE A 133 3.317 -2.831 -9.351 1.00 0.00 C ATOM 1963 CE2 PHE A 133 1.506 -4.326 -8.900 1.00 0.00 C ATOM 1964 CZ PHE A 133 2.089 -3.360 -9.697 1.00 0.00 C ATOM 0 H PHE A 133 4.995 -4.657 -3.531 1.00 0.00 H new ATOM 0 HA PHE A 133 5.207 -2.894 -5.901 1.00 0.00 H new ATOM 0 HB2 PHE A 133 4.914 -5.356 -6.443 1.00 0.00 H new ATOM 0 HB3 PHE A 133 3.395 -5.317 -5.571 1.00 0.00 H new ATOM 0 HD1 PHE A 133 4.918 -2.850 -7.942 1.00 0.00 H new ATOM 0 HD2 PHE A 133 1.691 -5.514 -7.138 1.00 0.00 H new ATOM 0 HE1 PHE A 133 3.776 -2.077 -9.973 1.00 0.00 H new ATOM 0 HE2 PHE A 133 0.546 -4.742 -9.169 1.00 0.00 H new ATOM 0 HZ PHE A 133 1.585 -3.019 -10.589 1.00 0.00 H new ATOM 1974 N MET A 134 2.939 -1.826 -5.449 1.00 0.00 N ATOM 1975 CA MET A 134 1.823 -1.004 -4.996 1.00 0.00 C ATOM 1976 C MET A 134 1.102 -0.367 -6.179 1.00 0.00 C ATOM 1977 O MET A 134 1.621 0.550 -6.815 1.00 0.00 O ATOM 1978 CB MET A 134 2.317 0.082 -4.039 1.00 0.00 C ATOM 1979 CG MET A 134 3.430 0.941 -4.618 1.00 0.00 C ATOM 1980 SD MET A 134 4.238 1.963 -3.371 1.00 0.00 S ATOM 1981 CE MET A 134 5.927 1.382 -3.500 1.00 0.00 C ATOM 0 H MET A 134 3.280 -1.597 -6.383 1.00 0.00 H new ATOM 0 HA MET A 134 1.119 -1.649 -4.469 1.00 0.00 H new ATOM 0 HB2 MET A 134 1.479 0.723 -3.766 1.00 0.00 H new ATOM 0 HB3 MET A 134 2.671 -0.387 -3.121 1.00 0.00 H new ATOM 0 HG2 MET A 134 4.172 0.297 -5.091 1.00 0.00 H new ATOM 0 HG3 MET A 134 3.020 1.582 -5.398 1.00 0.00 H new ATOM 0 HE1 MET A 134 6.386 1.375 -2.511 1.00 0.00 H new ATOM 0 HE2 MET A 134 5.934 0.372 -3.911 1.00 0.00 H new ATOM 0 HE3 MET A 134 6.491 2.045 -4.156 1.00 0.00 H new ATOM 1991 N GLY A 135 -0.099 -0.858 -6.470 1.00 0.00 N ATOM 1992 CA GLY A 135 -0.871 -0.325 -7.577 1.00 0.00 C ATOM 1993 C GLY A 135 -2.327 -0.107 -7.216 1.00 0.00 C ATOM 1994 O GLY A 135 -2.719 -0.269 -6.060 1.00 0.00 O ATOM 0 H GLY A 135 -0.551 -1.616 -5.958 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -0.434 0.620 -7.899 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -0.808 -1.010 -8.423 1.00 0.00 H new ATOM 1998 N VAL A 136 -3.132 0.264 -8.207 1.00 0.00 N ATOM 1999 CA VAL A 136 -4.553 0.506 -7.988 1.00 0.00 C ATOM 2000 C VAL A 136 -5.406 -0.396 -8.873 1.00 0.00 C ATOM 2001 O VAL A 136 -5.146 -0.537 -10.067 1.00 0.00 O ATOM 2002 CB VAL A 136 -4.921 1.976 -8.264 1.00 0.00 C ATOM 2003 CG1 VAL A 136 -6.419 2.190 -8.104 1.00 0.00 C ATOM 2004 CG2 VAL A 136 -4.140 2.902 -7.345 1.00 0.00 C ATOM 0 H VAL A 136 -2.824 0.403 -9.169 1.00 0.00 H new ATOM 0 HA VAL A 136 -4.756 0.280 -6.941 1.00 0.00 H new ATOM 0 HB VAL A 136 -4.652 2.213 -9.293 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.661 3.234 -8.303 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -6.955 1.553 -8.808 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -6.716 1.936 -7.086 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -4.412 3.937 -7.554 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -4.375 2.667 -6.307 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -3.072 2.767 -7.515 1.00 0.00 H new ATOM 2014 N GLY A 137 -6.428 -1.004 -8.279 1.00 0.00 N ATOM 2015 CA GLY A 137 -7.305 -1.884 -9.028 1.00 0.00 C ATOM 2016 C GLY A 137 -8.151 -1.136 -10.040 1.00 0.00 C ATOM 2017 O GLY A 137 -7.923 0.046 -10.298 1.00 0.00 O ATOM 0 H GLY A 137 -6.664 -0.903 -7.292 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -6.707 -2.635 -9.544 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -7.958 -2.416 -8.336 1.00 0.00 H new ATOM 2021 N LYS A 138 -9.129 -1.826 -10.617 1.00 0.00 N ATOM 2022 CA LYS A 138 -10.012 -1.221 -11.607 1.00 0.00 C ATOM 2023 C LYS A 138 -10.561 0.110 -11.105 1.00 0.00 C ATOM 2024 O LYS A 138 -10.586 1.098 -11.839 1.00 0.00 O ATOM 2025 CB LYS A 138 -11.167 -2.169 -11.937 1.00 0.00 C ATOM 2026 CG LYS A 138 -10.840 -3.167 -13.035 1.00 0.00 C ATOM 2027 CD LYS A 138 -11.808 -4.338 -13.030 1.00 0.00 C ATOM 2028 CE LYS A 138 -11.336 -5.448 -12.104 1.00 0.00 C ATOM 2029 NZ LYS A 138 -10.146 -6.157 -12.649 1.00 0.00 N ATOM 0 H LYS A 138 -9.330 -2.806 -10.416 1.00 0.00 H new ATOM 0 HA LYS A 138 -9.431 -1.037 -12.511 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -11.449 -2.713 -11.035 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -12.034 -1.581 -12.238 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -10.876 -2.668 -14.004 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -9.822 -3.534 -12.903 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -12.794 -3.995 -12.716 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -11.914 -4.728 -14.042 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -11.093 -5.028 -11.128 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -12.145 -6.162 -11.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -10.028 -7.066 -12.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -10.279 -6.328 -13.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -9.298 -5.573 -12.505 1.00 0.00 H new ATOM 2043 N ASP A 139 -10.998 0.130 -9.851 1.00 0.00 N ATOM 2044 CA ASP A 139 -11.544 1.341 -9.250 1.00 0.00 C ATOM 2045 C ASP A 139 -10.435 2.190 -8.636 1.00 0.00 C ATOM 2046 O ASP A 139 -9.385 1.676 -8.252 1.00 0.00 O ATOM 2047 CB ASP A 139 -12.580 0.984 -8.183 1.00 0.00 C ATOM 2048 CG ASP A 139 -13.884 0.495 -8.783 1.00 0.00 C ATOM 2049 OD1 ASP A 139 -14.697 1.343 -9.205 1.00 0.00 O ATOM 2050 OD2 ASP A 139 -14.091 -0.736 -8.830 1.00 0.00 O ATOM 0 H ASP A 139 -10.985 -0.679 -9.230 1.00 0.00 H new ATOM 0 HA ASP A 139 -12.028 1.921 -10.036 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -12.173 0.213 -7.529 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -12.774 1.859 -7.562 1.00 0.00 H new ATOM 2055 N VAL A 140 -10.676 3.495 -8.548 1.00 0.00 N ATOM 2056 CA VAL A 140 -9.699 4.416 -7.981 1.00 0.00 C ATOM 2057 C VAL A 140 -9.834 4.496 -6.464 1.00 0.00 C ATOM 2058 O VAL A 140 -9.202 5.331 -5.817 1.00 0.00 O ATOM 2059 CB VAL A 140 -9.849 5.829 -8.574 1.00 0.00 C ATOM 2060 CG1 VAL A 140 -9.376 5.855 -10.019 1.00 0.00 C ATOM 2061 CG2 VAL A 140 -11.292 6.300 -8.468 1.00 0.00 C ATOM 0 H VAL A 140 -11.540 3.937 -8.862 1.00 0.00 H new ATOM 0 HA VAL A 140 -8.713 4.027 -8.235 1.00 0.00 H new ATOM 0 HB VAL A 140 -9.224 6.513 -8.000 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -9.490 6.862 -10.421 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -8.327 5.563 -10.064 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -9.972 5.159 -10.609 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -11.380 7.300 -8.892 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -11.939 5.615 -9.016 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -11.591 6.322 -7.420 1.00 0.00 H new ATOM 2071 N HIS A 141 -10.663 3.622 -5.903 1.00 0.00 N ATOM 2072 CA HIS A 141 -10.881 3.593 -4.461 1.00 0.00 C ATOM 2073 C HIS A 141 -10.331 2.305 -3.854 1.00 0.00 C ATOM 2074 O HIS A 141 -10.636 1.965 -2.710 1.00 0.00 O ATOM 2075 CB HIS A 141 -12.372 3.722 -4.146 1.00 0.00 C ATOM 2076 CG HIS A 141 -13.091 4.684 -5.041 1.00 0.00 C ATOM 2077 ND1 HIS A 141 -14.053 4.293 -5.948 1.00 0.00 N ATOM 2078 CD2 HIS A 141 -12.986 6.028 -5.163 1.00 0.00 C ATOM 2079 CE1 HIS A 141 -14.507 5.354 -6.591 1.00 0.00 C ATOM 2080 NE2 HIS A 141 -13.876 6.420 -6.132 1.00 0.00 N ATOM 0 H HIS A 141 -11.195 2.925 -6.424 1.00 0.00 H new ATOM 0 HA HIS A 141 -10.350 4.437 -4.022 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -12.839 2.741 -4.231 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -12.490 4.043 -3.111 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -12.325 6.672 -4.602 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -15.265 5.350 -7.361 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -14.026 7.379 -6.446 1.00 0.00 H new ATOM 2088 N THR A 142 -9.519 1.591 -4.628 1.00 0.00 N ATOM 2089 CA THR A 142 -8.929 0.341 -4.168 1.00 0.00 C ATOM 2090 C THR A 142 -7.407 0.394 -4.235 1.00 0.00 C ATOM 2091 O THR A 142 -6.822 0.388 -5.318 1.00 0.00 O ATOM 2092 CB THR A 142 -9.426 -0.855 -5.002 1.00 0.00 C ATOM 2093 OG1 THR A 142 -9.490 -0.495 -6.386 1.00 0.00 O ATOM 2094 CG2 THR A 142 -10.797 -1.312 -4.528 1.00 0.00 C ATOM 0 H THR A 142 -9.255 1.858 -5.577 1.00 0.00 H new ATOM 0 HA THR A 142 -9.240 0.207 -3.132 1.00 0.00 H new ATOM 0 HB THR A 142 -8.722 -1.677 -4.873 1.00 0.00 H new ATOM 0 HG1 THR A 142 -8.657 -0.051 -6.647 1.00 0.00 H new ATOM 0 HG21 THR A 142 -11.127 -2.157 -5.132 1.00 0.00 H new ATOM 0 HG22 THR A 142 -10.739 -1.614 -3.482 1.00 0.00 H new ATOM 0 HG23 THR A 142 -11.509 -0.493 -4.630 1.00 0.00 H new ATOM 2102 N PHE A 143 -6.769 0.447 -3.070 1.00 0.00 N ATOM 2103 CA PHE A 143 -5.314 0.502 -2.996 1.00 0.00 C ATOM 2104 C PHE A 143 -4.765 -0.676 -2.197 1.00 0.00 C ATOM 2105 O PHE A 143 -5.214 -0.948 -1.084 1.00 0.00 O ATOM 2106 CB PHE A 143 -4.864 1.819 -2.360 1.00 0.00 C ATOM 2107 CG PHE A 143 -3.389 1.877 -2.083 1.00 0.00 C ATOM 2108 CD1 PHE A 143 -2.477 1.940 -3.125 1.00 0.00 C ATOM 2109 CD2 PHE A 143 -2.914 1.869 -0.782 1.00 0.00 C ATOM 2110 CE1 PHE A 143 -1.119 1.993 -2.873 1.00 0.00 C ATOM 2111 CE2 PHE A 143 -1.557 1.923 -0.523 1.00 0.00 C ATOM 2112 CZ PHE A 143 -0.659 1.986 -1.570 1.00 0.00 C ATOM 0 H PHE A 143 -7.237 0.453 -2.164 1.00 0.00 H new ATOM 0 HA PHE A 143 -4.921 0.444 -4.011 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -5.134 2.643 -3.020 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -5.407 1.967 -1.427 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -2.831 1.948 -4.145 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -3.612 1.820 0.040 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -0.418 2.040 -3.693 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -1.200 1.916 0.496 1.00 0.00 H new ATOM 0 HZ PHE A 143 0.402 2.030 -1.371 1.00 0.00 H new ATOM 2122 N ALA A 144 -3.791 -1.372 -2.774 1.00 0.00 N ATOM 2123 CA ALA A 144 -3.179 -2.520 -2.116 1.00 0.00 C ATOM 2124 C ALA A 144 -1.668 -2.531 -2.323 1.00 0.00 C ATOM 2125 O ALA A 144 -1.170 -2.080 -3.355 1.00 0.00 O ATOM 2126 CB ALA A 144 -3.794 -3.813 -2.630 1.00 0.00 C ATOM 0 H ALA A 144 -3.409 -1.161 -3.696 1.00 0.00 H new ATOM 0 HA ALA A 144 -3.372 -2.439 -1.046 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -3.327 -4.662 -2.130 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -4.864 -3.814 -2.424 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -3.631 -3.891 -3.705 1.00 0.00 H new ATOM 2132 N PHE A 145 -0.944 -3.047 -1.336 1.00 0.00 N ATOM 2133 CA PHE A 145 0.511 -3.115 -1.410 1.00 0.00 C ATOM 2134 C PHE A 145 1.025 -4.425 -0.820 1.00 0.00 C ATOM 2135 O PHE A 145 0.558 -4.871 0.229 1.00 0.00 O ATOM 2136 CB PHE A 145 1.136 -1.930 -0.672 1.00 0.00 C ATOM 2137 CG PHE A 145 0.891 -1.950 0.810 1.00 0.00 C ATOM 2138 CD1 PHE A 145 1.550 -2.858 1.623 1.00 0.00 C ATOM 2139 CD2 PHE A 145 0.001 -1.061 1.390 1.00 0.00 C ATOM 2140 CE1 PHE A 145 1.327 -2.879 2.987 1.00 0.00 C ATOM 2141 CE2 PHE A 145 -0.226 -1.076 2.753 1.00 0.00 C ATOM 2142 CZ PHE A 145 0.437 -1.987 3.552 1.00 0.00 C ATOM 0 H PHE A 145 -1.341 -3.424 -0.475 1.00 0.00 H new ATOM 0 HA PHE A 145 0.799 -3.073 -2.460 1.00 0.00 H new ATOM 0 HB2 PHE A 145 2.211 -1.924 -0.855 1.00 0.00 H new ATOM 0 HB3 PHE A 145 0.738 -1.004 -1.086 1.00 0.00 H new ATOM 0 HD1 PHE A 145 2.246 -3.558 1.186 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -0.522 -0.348 0.770 1.00 0.00 H new ATOM 0 HE1 PHE A 145 1.848 -3.592 3.610 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -0.921 -0.376 3.193 1.00 0.00 H new ATOM 0 HZ PHE A 145 0.260 -2.002 4.617 1.00 0.00 H new ATOM 2152 N ILE A 146 1.988 -5.036 -1.501 1.00 0.00 N ATOM 2153 CA ILE A 146 2.566 -6.294 -1.045 1.00 0.00 C ATOM 2154 C ILE A 146 3.910 -6.066 -0.362 1.00 0.00 C ATOM 2155 O ILE A 146 4.826 -5.490 -0.949 1.00 0.00 O ATOM 2156 CB ILE A 146 2.756 -7.282 -2.211 1.00 0.00 C ATOM 2157 CG1 ILE A 146 1.416 -7.562 -2.895 1.00 0.00 C ATOM 2158 CG2 ILE A 146 3.382 -8.576 -1.712 1.00 0.00 C ATOM 2159 CD1 ILE A 146 1.555 -8.030 -4.326 1.00 0.00 C ATOM 0 H ILE A 146 2.385 -4.680 -2.371 1.00 0.00 H new ATOM 0 HA ILE A 146 1.865 -6.722 -0.328 1.00 0.00 H new ATOM 0 HB ILE A 146 3.429 -6.833 -2.942 1.00 0.00 H new ATOM 0 HG12 ILE A 146 0.877 -8.318 -2.325 1.00 0.00 H new ATOM 0 HG13 ILE A 146 0.810 -6.656 -2.875 1.00 0.00 H new ATOM 0 HG21 ILE A 146 3.510 -9.264 -2.548 1.00 0.00 H new ATOM 0 HG22 ILE A 146 4.353 -8.362 -1.266 1.00 0.00 H new ATOM 0 HG23 ILE A 146 2.732 -9.030 -0.964 1.00 0.00 H new ATOM 0 HD11 ILE A 146 0.566 -8.209 -4.748 1.00 0.00 H new ATOM 0 HD12 ILE A 146 2.066 -7.265 -4.911 1.00 0.00 H new ATOM 0 HD13 ILE A 146 2.133 -8.953 -4.352 1.00 0.00 H new ATOM 2171 N MET A 147 4.022 -6.523 0.881 1.00 0.00 N ATOM 2172 CA MET A 147 5.256 -6.371 1.642 1.00 0.00 C ATOM 2173 C MET A 147 5.876 -7.731 1.949 1.00 0.00 C ATOM 2174 O MET A 147 5.248 -8.770 1.746 1.00 0.00 O ATOM 2175 CB MET A 147 4.987 -5.615 2.945 1.00 0.00 C ATOM 2176 CG MET A 147 4.347 -6.472 4.024 1.00 0.00 C ATOM 2177 SD MET A 147 3.415 -5.499 5.222 1.00 0.00 S ATOM 2178 CE MET A 147 4.506 -5.574 6.641 1.00 0.00 C ATOM 0 H MET A 147 3.273 -7.001 1.382 1.00 0.00 H new ATOM 0 HA MET A 147 5.959 -5.799 1.037 1.00 0.00 H new ATOM 0 HB2 MET A 147 5.927 -5.212 3.322 1.00 0.00 H new ATOM 0 HB3 MET A 147 4.338 -4.765 2.735 1.00 0.00 H new ATOM 0 HG2 MET A 147 3.683 -7.200 3.558 1.00 0.00 H new ATOM 0 HG3 MET A 147 5.123 -7.035 4.543 1.00 0.00 H new ATOM 0 HE1 MET A 147 4.101 -4.958 7.444 1.00 0.00 H new ATOM 0 HE2 MET A 147 4.589 -6.606 6.982 1.00 0.00 H new ATOM 0 HE3 MET A 147 5.492 -5.203 6.362 1.00 0.00 H new ATOM 2188 N ASP A 148 7.111 -7.716 2.438 1.00 0.00 N ATOM 2189 CA ASP A 148 7.816 -8.948 2.774 1.00 0.00 C ATOM 2190 C ASP A 148 7.967 -9.093 4.285 1.00 0.00 C ATOM 2191 O ASP A 148 8.491 -8.204 4.956 1.00 0.00 O ATOM 2192 CB ASP A 148 9.192 -8.972 2.107 1.00 0.00 C ATOM 2193 CG ASP A 148 10.056 -10.114 2.602 1.00 0.00 C ATOM 2194 OD1 ASP A 148 9.496 -11.175 2.949 1.00 0.00 O ATOM 2195 OD2 ASP A 148 11.293 -9.948 2.642 1.00 0.00 O ATOM 0 H ASP A 148 7.645 -6.864 2.611 1.00 0.00 H new ATOM 0 HA ASP A 148 7.227 -9.787 2.404 1.00 0.00 H new ATOM 0 HB2 ASP A 148 9.068 -9.056 1.027 1.00 0.00 H new ATOM 0 HB3 ASP A 148 9.701 -8.027 2.297 1.00 0.00 H new ATOM 2200 N THR A 149 7.503 -10.221 4.815 1.00 0.00 N ATOM 2201 CA THR A 149 7.585 -10.482 6.247 1.00 0.00 C ATOM 2202 C THR A 149 8.696 -11.476 6.562 1.00 0.00 C ATOM 2203 O THR A 149 9.414 -11.327 7.550 1.00 0.00 O ATOM 2204 CB THR A 149 6.253 -11.028 6.795 1.00 0.00 C ATOM 2205 OG1 THR A 149 5.876 -12.209 6.079 1.00 0.00 O ATOM 2206 CG2 THR A 149 5.151 -9.985 6.678 1.00 0.00 C ATOM 0 H THR A 149 7.067 -10.968 4.274 1.00 0.00 H new ATOM 0 HA THR A 149 7.806 -9.530 6.730 1.00 0.00 H new ATOM 0 HB THR A 149 6.392 -11.271 7.849 1.00 0.00 H new ATOM 0 HG1 THR A 149 5.053 -12.037 5.575 1.00 0.00 H new ATOM 0 HG21 THR A 149 4.220 -10.394 7.071 1.00 0.00 H new ATOM 0 HG22 THR A 149 5.427 -9.098 7.248 1.00 0.00 H new ATOM 0 HG23 THR A 149 5.015 -9.715 5.631 1.00 0.00 H new ATOM 2214 N GLY A 150 8.834 -12.491 5.715 1.00 0.00 N ATOM 2215 CA GLY A 150 9.862 -13.495 5.921 1.00 0.00 C ATOM 2216 C GLY A 150 10.750 -13.673 4.706 1.00 0.00 C ATOM 2217 O GLY A 150 11.141 -12.697 4.066 1.00 0.00 O ATOM 0 H GLY A 150 8.252 -12.636 4.890 1.00 0.00 H new ATOM 0 HA2 GLY A 150 10.475 -13.213 6.777 1.00 0.00 H new ATOM 0 HA3 GLY A 150 9.392 -14.447 6.166 1.00 0.00 H new ATOM 2221 N ASN A 151 11.072 -14.923 4.387 1.00 0.00 N ATOM 2222 CA ASN A 151 11.922 -15.225 3.242 1.00 0.00 C ATOM 2223 C ASN A 151 11.147 -15.082 1.936 1.00 0.00 C ATOM 2224 O ASN A 151 11.433 -14.200 1.126 1.00 0.00 O ATOM 2225 CB ASN A 151 12.488 -16.641 3.360 1.00 0.00 C ATOM 2226 CG ASN A 151 13.371 -16.811 4.580 1.00 0.00 C ATOM 2227 OD1 ASN A 151 14.154 -15.925 4.922 1.00 0.00 O ATOM 2228 ND2 ASN A 151 13.250 -17.955 5.244 1.00 0.00 N ATOM 0 H ASN A 151 10.757 -15.743 4.906 1.00 0.00 H new ATOM 0 HA ASN A 151 12.746 -14.511 3.235 1.00 0.00 H new ATOM 0 HB2 ASN A 151 11.666 -17.355 3.408 1.00 0.00 H new ATOM 0 HB3 ASN A 151 13.062 -16.876 2.464 1.00 0.00 H new ATOM 0 HD21 ASN A 151 13.819 -18.126 6.073 1.00 0.00 H new ATOM 0 HD22 ASN A 151 12.588 -18.662 4.925 1.00 0.00 H new ATOM 2235 N GLN A 152 10.164 -15.955 1.739 1.00 0.00 N ATOM 2236 CA GLN A 152 9.348 -15.926 0.531 1.00 0.00 C ATOM 2237 C GLN A 152 7.885 -15.659 0.869 1.00 0.00 C ATOM 2238 O GLN A 152 6.997 -15.881 0.046 1.00 0.00 O ATOM 2239 CB GLN A 152 9.475 -17.248 -0.228 1.00 0.00 C ATOM 2240 CG GLN A 152 10.876 -17.515 -0.754 1.00 0.00 C ATOM 2241 CD GLN A 152 11.126 -18.984 -1.031 1.00 0.00 C ATOM 2242 OE1 GLN A 152 11.186 -19.409 -2.185 1.00 0.00 O ATOM 2243 NE2 GLN A 152 11.272 -19.770 0.030 1.00 0.00 N ATOM 0 H GLN A 152 9.914 -16.690 2.400 1.00 0.00 H new ATOM 0 HA GLN A 152 9.710 -15.116 -0.102 1.00 0.00 H new ATOM 0 HB2 GLN A 152 9.181 -18.065 0.431 1.00 0.00 H new ATOM 0 HB3 GLN A 152 8.776 -17.246 -1.064 1.00 0.00 H new ATOM 0 HG2 GLN A 152 11.031 -16.945 -1.670 1.00 0.00 H new ATOM 0 HG3 GLN A 152 11.607 -17.157 -0.029 1.00 0.00 H new ATOM 0 HE21 GLN A 152 11.215 -19.375 0.969 1.00 0.00 H new ATOM 0 HE22 GLN A 152 11.441 -20.768 -0.094 1.00 0.00 H new ATOM 2252 N ARG A 153 7.641 -15.182 2.086 1.00 0.00 N ATOM 2253 CA ARG A 153 6.286 -14.886 2.533 1.00 0.00 C ATOM 2254 C ARG A 153 5.891 -13.459 2.166 1.00 0.00 C ATOM 2255 O ARG A 153 6.622 -12.509 2.449 1.00 0.00 O ATOM 2256 CB ARG A 153 6.170 -15.086 4.045 1.00 0.00 C ATOM 2257 CG ARG A 153 5.804 -16.505 4.447 1.00 0.00 C ATOM 2258 CD ARG A 153 4.412 -16.879 3.962 1.00 0.00 C ATOM 2259 NE ARG A 153 3.894 -18.062 4.645 1.00 0.00 N ATOM 2260 CZ ARG A 153 2.695 -18.582 4.407 1.00 0.00 C ATOM 2261 NH1 ARG A 153 1.895 -18.027 3.507 1.00 0.00 N ATOM 2262 NH2 ARG A 153 2.295 -19.659 5.070 1.00 0.00 N ATOM 0 H ARG A 153 8.365 -14.993 2.779 1.00 0.00 H new ATOM 0 HA ARG A 153 5.606 -15.573 2.029 1.00 0.00 H new ATOM 0 HB2 ARG A 153 7.118 -14.819 4.512 1.00 0.00 H new ATOM 0 HB3 ARG A 153 5.418 -14.401 4.437 1.00 0.00 H new ATOM 0 HG2 ARG A 153 6.534 -17.201 4.034 1.00 0.00 H new ATOM 0 HG3 ARG A 153 5.851 -16.601 5.532 1.00 0.00 H new ATOM 0 HD2 ARG A 153 3.734 -16.041 4.124 1.00 0.00 H new ATOM 0 HD3 ARG A 153 4.440 -17.063 2.888 1.00 0.00 H new ATOM 0 HE ARG A 153 4.485 -18.513 5.343 1.00 0.00 H new ATOM 0 HH11 ARG A 153 2.200 -17.199 2.995 1.00 0.00 H new ATOM 0 HH12 ARG A 153 0.975 -18.428 3.326 1.00 0.00 H new ATOM 0 HH21 ARG A 153 2.908 -20.088 5.763 1.00 0.00 H new ATOM 0 HH22 ARG A 153 1.374 -20.058 4.887 1.00 0.00 H new ATOM 2276 N PHE A 154 4.731 -13.316 1.533 1.00 0.00 N ATOM 2277 CA PHE A 154 4.239 -12.005 1.125 1.00 0.00 C ATOM 2278 C PHE A 154 2.810 -11.784 1.612 1.00 0.00 C ATOM 2279 O PHE A 154 1.954 -12.656 1.469 1.00 0.00 O ATOM 2280 CB PHE A 154 4.299 -11.865 -0.397 1.00 0.00 C ATOM 2281 CG PHE A 154 5.554 -12.426 -1.002 1.00 0.00 C ATOM 2282 CD1 PHE A 154 6.797 -12.080 -0.497 1.00 0.00 C ATOM 2283 CD2 PHE A 154 5.491 -13.301 -2.075 1.00 0.00 C ATOM 2284 CE1 PHE A 154 7.953 -12.594 -1.052 1.00 0.00 C ATOM 2285 CE2 PHE A 154 6.644 -13.818 -2.634 1.00 0.00 C ATOM 2286 CZ PHE A 154 7.877 -13.466 -2.121 1.00 0.00 C ATOM 0 H PHE A 154 4.114 -14.092 1.292 1.00 0.00 H new ATOM 0 HA PHE A 154 4.879 -11.248 1.578 1.00 0.00 H new ATOM 0 HB2 PHE A 154 3.437 -12.369 -0.834 1.00 0.00 H new ATOM 0 HB3 PHE A 154 4.218 -10.810 -0.660 1.00 0.00 H new ATOM 0 HD1 PHE A 154 6.863 -11.401 0.340 1.00 0.00 H new ATOM 0 HD2 PHE A 154 4.530 -13.582 -2.479 1.00 0.00 H new ATOM 0 HE1 PHE A 154 8.916 -12.314 -0.650 1.00 0.00 H new ATOM 0 HE2 PHE A 154 6.581 -14.497 -3.472 1.00 0.00 H new ATOM 0 HZ PHE A 154 8.779 -13.871 -2.554 1.00 0.00 H new ATOM 2296 N GLU A 155 2.562 -10.612 2.188 1.00 0.00 N ATOM 2297 CA GLU A 155 1.237 -10.278 2.698 1.00 0.00 C ATOM 2298 C GLU A 155 0.617 -9.138 1.895 1.00 0.00 C ATOM 2299 O GLU A 155 1.140 -8.023 1.874 1.00 0.00 O ATOM 2300 CB GLU A 155 1.317 -9.890 4.176 1.00 0.00 C ATOM 2301 CG GLU A 155 1.636 -11.057 5.095 1.00 0.00 C ATOM 2302 CD GLU A 155 2.570 -12.065 4.455 1.00 0.00 C ATOM 2303 OE1 GLU A 155 3.788 -11.794 4.397 1.00 0.00 O ATOM 2304 OE2 GLU A 155 2.083 -13.127 4.012 1.00 0.00 O ATOM 0 H GLU A 155 3.260 -9.879 2.313 1.00 0.00 H new ATOM 0 HA GLU A 155 0.604 -11.159 2.595 1.00 0.00 H new ATOM 0 HB2 GLU A 155 2.080 -9.121 4.300 1.00 0.00 H new ATOM 0 HB3 GLU A 155 0.367 -9.449 4.479 1.00 0.00 H new ATOM 0 HG2 GLU A 155 2.088 -10.679 6.012 1.00 0.00 H new ATOM 0 HG3 GLU A 155 0.709 -11.555 5.379 1.00 0.00 H new ATOM 2311 N CYS A 156 -0.499 -9.426 1.235 1.00 0.00 N ATOM 2312 CA CYS A 156 -1.190 -8.426 0.428 1.00 0.00 C ATOM 2313 C CYS A 156 -2.305 -7.759 1.227 1.00 0.00 C ATOM 2314 O CYS A 156 -3.315 -8.388 1.548 1.00 0.00 O ATOM 2315 CB CYS A 156 -1.765 -9.068 -0.835 1.00 0.00 C ATOM 2316 SG CYS A 156 -2.069 -7.902 -2.183 1.00 0.00 S ATOM 0 H CYS A 156 -0.945 -10.343 1.243 1.00 0.00 H new ATOM 0 HA CYS A 156 -0.466 -7.663 0.141 1.00 0.00 H new ATOM 0 HB2 CYS A 156 -1.077 -9.838 -1.184 1.00 0.00 H new ATOM 0 HB3 CYS A 156 -2.701 -9.567 -0.582 1.00 0.00 H new ATOM 0 HG CYS A 156 -2.349 -8.558 -3.270 1.00 0.00 H new ATOM 2322 N HIS A 157 -2.116 -6.483 1.547 1.00 0.00 N ATOM 2323 CA HIS A 157 -3.105 -5.731 2.310 1.00 0.00 C ATOM 2324 C HIS A 157 -3.851 -4.748 1.413 1.00 0.00 C ATOM 2325 O HIS A 157 -3.240 -4.022 0.628 1.00 0.00 O ATOM 2326 CB HIS A 157 -2.431 -4.980 3.459 1.00 0.00 C ATOM 2327 CG HIS A 157 -1.717 -5.877 4.423 1.00 0.00 C ATOM 2328 ND1 HIS A 157 -2.336 -6.461 5.508 1.00 0.00 N ATOM 2329 CD2 HIS A 157 -0.429 -6.290 4.459 1.00 0.00 C ATOM 2330 CE1 HIS A 157 -1.459 -7.193 6.171 1.00 0.00 C ATOM 2331 NE2 HIS A 157 -0.293 -7.107 5.555 1.00 0.00 N ATOM 0 H HIS A 157 -1.287 -5.948 1.290 1.00 0.00 H new ATOM 0 HA HIS A 157 -3.825 -6.439 2.721 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -1.720 -4.264 3.047 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -3.184 -4.406 3.999 1.00 0.00 H new ATOM 0 HD2 HIS A 157 0.348 -6.026 3.757 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -1.661 -7.765 7.065 1.00 0.00 H new ATOM 0 HE2 HIS A 157 0.567 -7.571 5.846 1.00 0.00 H new ATOM 2339 N VAL A 158 -5.174 -4.730 1.534 1.00 0.00 N ATOM 2340 CA VAL A 158 -6.003 -3.836 0.734 1.00 0.00 C ATOM 2341 C VAL A 158 -6.669 -2.777 1.606 1.00 0.00 C ATOM 2342 O VAL A 158 -7.055 -3.047 2.743 1.00 0.00 O ATOM 2343 CB VAL A 158 -7.091 -4.614 -0.031 1.00 0.00 C ATOM 2344 CG1 VAL A 158 -7.916 -3.670 -0.892 1.00 0.00 C ATOM 2345 CG2 VAL A 158 -6.465 -5.711 -0.878 1.00 0.00 C ATOM 0 H VAL A 158 -5.695 -5.324 2.178 1.00 0.00 H new ATOM 0 HA VAL A 158 -5.343 -3.349 0.017 1.00 0.00 H new ATOM 0 HB VAL A 158 -7.757 -5.082 0.694 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -8.679 -4.237 -1.425 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -8.395 -2.924 -0.258 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -7.266 -3.172 -1.611 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -7.248 -6.250 -1.411 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -5.776 -5.267 -1.597 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -5.922 -6.403 -0.234 1.00 0.00 H new ATOM 2355 N PHE A 159 -6.801 -1.571 1.064 1.00 0.00 N ATOM 2356 CA PHE A 159 -7.420 -0.469 1.793 1.00 0.00 C ATOM 2357 C PHE A 159 -8.220 0.424 0.850 1.00 0.00 C ATOM 2358 O PHE A 159 -7.792 0.705 -0.269 1.00 0.00 O ATOM 2359 CB PHE A 159 -6.352 0.357 2.513 1.00 0.00 C ATOM 2360 CG PHE A 159 -5.451 -0.462 3.391 1.00 0.00 C ATOM 2361 CD1 PHE A 159 -4.388 -1.167 2.850 1.00 0.00 C ATOM 2362 CD2 PHE A 159 -5.667 -0.529 4.758 1.00 0.00 C ATOM 2363 CE1 PHE A 159 -3.556 -1.922 3.655 1.00 0.00 C ATOM 2364 CE2 PHE A 159 -4.839 -1.282 5.569 1.00 0.00 C ATOM 2365 CZ PHE A 159 -3.783 -1.980 5.017 1.00 0.00 C ATOM 0 H PHE A 159 -6.488 -1.332 0.123 1.00 0.00 H new ATOM 0 HA PHE A 159 -8.102 -0.891 2.531 1.00 0.00 H new ATOM 0 HB2 PHE A 159 -5.747 0.879 1.772 1.00 0.00 H new ATOM 0 HB3 PHE A 159 -6.841 1.119 3.119 1.00 0.00 H new ATOM 0 HD1 PHE A 159 -4.207 -1.126 1.786 1.00 0.00 H new ATOM 0 HD2 PHE A 159 -6.492 0.014 5.195 1.00 0.00 H new ATOM 0 HE1 PHE A 159 -2.730 -2.466 3.221 1.00 0.00 H new ATOM 0 HE2 PHE A 159 -5.018 -1.324 6.633 1.00 0.00 H new ATOM 0 HZ PHE A 159 -3.136 -2.570 5.649 1.00 0.00 H new ATOM 2375 N TRP A 160 -9.385 0.866 1.311 1.00 0.00 N ATOM 2376 CA TRP A 160 -10.247 1.728 0.509 1.00 0.00 C ATOM 2377 C TRP A 160 -9.965 3.198 0.796 1.00 0.00 C ATOM 2378 O TRP A 160 -10.103 3.656 1.931 1.00 0.00 O ATOM 2379 CB TRP A 160 -11.717 1.414 0.788 1.00 0.00 C ATOM 2380 CG TRP A 160 -12.640 1.876 -0.299 1.00 0.00 C ATOM 2381 CD1 TRP A 160 -13.164 3.128 -0.451 1.00 0.00 C ATOM 2382 CD2 TRP A 160 -13.149 1.091 -1.383 1.00 0.00 C ATOM 2383 NE1 TRP A 160 -13.968 3.169 -1.565 1.00 0.00 N ATOM 2384 CE2 TRP A 160 -13.974 1.932 -2.155 1.00 0.00 C ATOM 2385 CE3 TRP A 160 -12.985 -0.239 -1.778 1.00 0.00 C ATOM 2386 CZ2 TRP A 160 -14.634 1.484 -3.296 1.00 0.00 C ATOM 2387 CZ3 TRP A 160 -13.641 -0.683 -2.911 1.00 0.00 C ATOM 2388 CH2 TRP A 160 -14.456 0.177 -3.660 1.00 0.00 C ATOM 0 H TRP A 160 -9.754 0.642 2.235 1.00 0.00 H new ATOM 0 HA TRP A 160 -10.035 1.536 -0.543 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -11.833 0.338 0.920 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -12.010 1.884 1.727 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -12.975 3.963 0.207 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -14.478 3.987 -1.898 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -12.357 -0.908 -1.209 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -15.264 2.144 -3.873 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -13.524 -1.710 -3.224 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -14.953 -0.199 -4.542 1.00 0.00 H new ATOM 2399 N CYS A 161 -9.570 3.933 -0.238 1.00 0.00 N ATOM 2400 CA CYS A 161 -9.269 5.353 -0.096 1.00 0.00 C ATOM 2401 C CYS A 161 -10.382 6.208 -0.693 1.00 0.00 C ATOM 2402 O CYS A 161 -11.143 5.747 -1.543 1.00 0.00 O ATOM 2403 CB CYS A 161 -7.938 5.683 -0.774 1.00 0.00 C ATOM 2404 SG CYS A 161 -6.572 4.606 -0.280 1.00 0.00 S ATOM 0 H CYS A 161 -9.451 3.569 -1.183 1.00 0.00 H new ATOM 0 HA CYS A 161 -9.194 5.578 0.968 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -8.066 5.617 -1.854 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -7.673 6.716 -0.547 1.00 0.00 H new ATOM 0 HG CYS A 161 -5.490 4.961 -0.907 1.00 0.00 H new ATOM 2410 N GLU A 162 -10.472 7.454 -0.240 1.00 0.00 N ATOM 2411 CA GLU A 162 -11.495 8.372 -0.727 1.00 0.00 C ATOM 2412 C GLU A 162 -11.015 9.818 -0.639 1.00 0.00 C ATOM 2413 O GLU A 162 -10.212 10.181 0.222 1.00 0.00 O ATOM 2414 CB GLU A 162 -12.788 8.202 0.073 1.00 0.00 C ATOM 2415 CG GLU A 162 -13.575 6.957 -0.299 1.00 0.00 C ATOM 2416 CD GLU A 162 -14.941 6.913 0.356 1.00 0.00 C ATOM 2417 OE1 GLU A 162 -15.845 7.642 -0.105 1.00 0.00 O ATOM 2418 OE2 GLU A 162 -15.108 6.149 1.330 1.00 0.00 O ATOM 0 H GLU A 162 -9.849 7.851 0.463 1.00 0.00 H new ATOM 0 HA GLU A 162 -11.690 8.135 -1.773 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -12.546 8.165 1.135 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -13.418 9.079 -0.080 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -13.694 6.917 -1.382 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -13.008 6.073 -0.008 1.00 0.00 H new ATOM 2425 N PRO A 163 -11.518 10.664 -1.549 1.00 0.00 N ATOM 2426 CA PRO A 163 -12.474 10.244 -2.578 1.00 0.00 C ATOM 2427 C PRO A 163 -11.836 9.339 -3.627 1.00 0.00 C ATOM 2428 O PRO A 163 -12.496 8.904 -4.569 1.00 0.00 O ATOM 2429 CB PRO A 163 -12.918 11.565 -3.211 1.00 0.00 C ATOM 2430 CG PRO A 163 -11.786 12.502 -2.966 1.00 0.00 C ATOM 2431 CD PRO A 163 -11.191 12.097 -1.645 1.00 0.00 C ATOM 0 HA PRO A 163 -13.293 9.660 -2.159 1.00 0.00 H new ATOM 0 HB2 PRO A 163 -13.111 11.448 -4.277 1.00 0.00 H new ATOM 0 HB3 PRO A 163 -13.840 11.931 -2.758 1.00 0.00 H new ATOM 0 HG2 PRO A 163 -11.046 12.437 -3.764 1.00 0.00 H new ATOM 0 HG3 PRO A 163 -12.134 13.535 -2.937 1.00 0.00 H new ATOM 0 HD2 PRO A 163 -10.114 12.266 -1.620 1.00 0.00 H new ATOM 0 HD3 PRO A 163 -11.622 12.664 -0.820 1.00 0.00 H new ATOM 2439 N ASN A 164 -10.547 9.061 -3.457 1.00 0.00 N ATOM 2440 CA ASN A 164 -9.820 8.208 -4.390 1.00 0.00 C ATOM 2441 C ASN A 164 -8.498 7.745 -3.786 1.00 0.00 C ATOM 2442 O ASN A 164 -8.157 8.106 -2.660 1.00 0.00 O ATOM 2443 CB ASN A 164 -9.561 8.954 -5.700 1.00 0.00 C ATOM 2444 CG ASN A 164 -8.846 10.273 -5.483 1.00 0.00 C ATOM 2445 OD1 ASN A 164 -8.129 10.448 -4.498 1.00 0.00 O ATOM 2446 ND2 ASN A 164 -9.039 11.209 -6.405 1.00 0.00 N ATOM 0 H ASN A 164 -9.985 9.414 -2.682 1.00 0.00 H new ATOM 0 HA ASN A 164 -10.433 7.330 -4.595 1.00 0.00 H new ATOM 0 HB2 ASN A 164 -8.965 8.325 -6.361 1.00 0.00 H new ATOM 0 HB3 ASN A 164 -10.510 9.137 -6.204 1.00 0.00 H new ATOM 0 HD21 ASN A 164 -8.584 12.117 -6.313 1.00 0.00 H new ATOM 0 HD22 ASN A 164 -9.642 11.020 -7.205 1.00 0.00 H new ATOM 2453 N ALA A 165 -7.756 6.942 -4.543 1.00 0.00 N ATOM 2454 CA ALA A 165 -6.471 6.432 -4.084 1.00 0.00 C ATOM 2455 C ALA A 165 -5.316 7.176 -4.747 1.00 0.00 C ATOM 2456 O ALA A 165 -4.235 6.621 -4.938 1.00 0.00 O ATOM 2457 CB ALA A 165 -6.366 4.939 -4.361 1.00 0.00 C ATOM 0 H ALA A 165 -8.024 6.631 -5.477 1.00 0.00 H new ATOM 0 HA ALA A 165 -6.406 6.597 -3.009 1.00 0.00 H new ATOM 0 HB1 ALA A 165 -5.401 4.571 -4.013 1.00 0.00 H new ATOM 0 HB2 ALA A 165 -7.165 4.415 -3.836 1.00 0.00 H new ATOM 0 HB3 ALA A 165 -6.457 4.760 -5.432 1.00 0.00 H new ATOM 2463 N ALA A 166 -5.554 8.437 -5.095 1.00 0.00 N ATOM 2464 CA ALA A 166 -4.533 9.257 -5.735 1.00 0.00 C ATOM 2465 C ALA A 166 -3.594 9.871 -4.702 1.00 0.00 C ATOM 2466 O ALA A 166 -2.388 9.630 -4.725 1.00 0.00 O ATOM 2467 CB ALA A 166 -5.183 10.348 -6.574 1.00 0.00 C ATOM 0 H ALA A 166 -6.444 8.912 -4.944 1.00 0.00 H new ATOM 0 HA ALA A 166 -3.942 8.614 -6.388 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -4.409 10.953 -7.046 1.00 0.00 H new ATOM 0 HB2 ALA A 166 -5.807 9.893 -7.343 1.00 0.00 H new ATOM 0 HB3 ALA A 166 -5.799 10.981 -5.935 1.00 0.00 H new ATOM 2473 N ASN A 167 -4.156 10.665 -3.797 1.00 0.00 N ATOM 2474 CA ASN A 167 -3.368 11.314 -2.755 1.00 0.00 C ATOM 2475 C ASN A 167 -2.552 10.290 -1.973 1.00 0.00 C ATOM 2476 O ASN A 167 -1.525 10.621 -1.380 1.00 0.00 O ATOM 2477 CB ASN A 167 -4.282 12.089 -1.804 1.00 0.00 C ATOM 2478 CG ASN A 167 -5.141 13.107 -2.528 1.00 0.00 C ATOM 2479 OD1 ASN A 167 -4.660 14.163 -2.937 1.00 0.00 O ATOM 2480 ND2 ASN A 167 -6.421 12.792 -2.690 1.00 0.00 N ATOM 0 H ASN A 167 -5.154 10.875 -3.764 1.00 0.00 H new ATOM 0 HA ASN A 167 -2.680 12.010 -3.235 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -4.925 11.388 -1.271 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -3.675 12.597 -1.055 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -7.048 13.437 -3.170 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -6.777 11.905 -2.334 1.00 0.00 H new ATOM 2487 N VAL A 168 -3.015 9.044 -1.977 1.00 0.00 N ATOM 2488 CA VAL A 168 -2.328 7.970 -1.269 1.00 0.00 C ATOM 2489 C VAL A 168 -1.241 7.348 -2.138 1.00 0.00 C ATOM 2490 O VAL A 168 -0.057 7.405 -1.805 1.00 0.00 O ATOM 2491 CB VAL A 168 -3.311 6.869 -0.828 1.00 0.00 C ATOM 2492 CG1 VAL A 168 -2.561 5.706 -0.197 1.00 0.00 C ATOM 2493 CG2 VAL A 168 -4.345 7.433 0.134 1.00 0.00 C ATOM 0 H VAL A 168 -3.863 8.753 -2.463 1.00 0.00 H new ATOM 0 HA VAL A 168 -1.872 8.414 -0.384 1.00 0.00 H new ATOM 0 HB VAL A 168 -3.834 6.497 -1.709 1.00 0.00 H new ATOM 0 HG11 VAL A 168 -3.271 4.938 0.108 1.00 0.00 H new ATOM 0 HG12 VAL A 168 -1.863 5.287 -0.922 1.00 0.00 H new ATOM 0 HG13 VAL A 168 -2.010 6.058 0.675 1.00 0.00 H new ATOM 0 HG21 VAL A 168 -5.031 6.642 0.435 1.00 0.00 H new ATOM 0 HG22 VAL A 168 -3.843 7.833 1.015 1.00 0.00 H new ATOM 0 HG23 VAL A 168 -4.903 8.230 -0.358 1.00 0.00 H new ATOM 2503 N SER A 169 -1.651 6.753 -3.254 1.00 0.00 N ATOM 2504 CA SER A 169 -0.712 6.117 -4.170 1.00 0.00 C ATOM 2505 C SER A 169 0.398 7.084 -4.571 1.00 0.00 C ATOM 2506 O SER A 169 1.534 6.677 -4.811 1.00 0.00 O ATOM 2507 CB SER A 169 -1.443 5.617 -5.418 1.00 0.00 C ATOM 2508 OG SER A 169 -2.075 6.686 -6.100 1.00 0.00 O ATOM 0 H SER A 169 -2.627 6.698 -3.545 1.00 0.00 H new ATOM 0 HA SER A 169 -0.262 5.268 -3.656 1.00 0.00 H new ATOM 0 HB2 SER A 169 -0.736 5.124 -6.085 1.00 0.00 H new ATOM 0 HB3 SER A 169 -2.186 4.872 -5.134 1.00 0.00 H new ATOM 0 HG SER A 169 -2.786 7.058 -5.538 1.00 0.00 H new ATOM 2514 N GLU A 170 0.058 8.368 -4.640 1.00 0.00 N ATOM 2515 CA GLU A 170 1.025 9.394 -5.012 1.00 0.00 C ATOM 2516 C GLU A 170 1.964 9.704 -3.850 1.00 0.00 C ATOM 2517 O GLU A 170 3.185 9.702 -4.007 1.00 0.00 O ATOM 2518 CB GLU A 170 0.304 10.669 -5.454 1.00 0.00 C ATOM 2519 CG GLU A 170 1.202 11.895 -5.489 1.00 0.00 C ATOM 2520 CD GLU A 170 0.600 13.036 -6.285 1.00 0.00 C ATOM 2521 OE1 GLU A 170 -0.382 13.641 -5.805 1.00 0.00 O ATOM 2522 OE2 GLU A 170 1.109 13.325 -7.388 1.00 0.00 O ATOM 0 H GLU A 170 -0.878 8.722 -4.443 1.00 0.00 H new ATOM 0 HA GLU A 170 1.618 9.014 -5.844 1.00 0.00 H new ATOM 0 HB2 GLU A 170 -0.120 10.511 -6.446 1.00 0.00 H new ATOM 0 HB3 GLU A 170 -0.529 10.858 -4.777 1.00 0.00 H new ATOM 0 HG2 GLU A 170 1.394 12.230 -4.469 1.00 0.00 H new ATOM 0 HG3 GLU A 170 2.165 11.623 -5.922 1.00 0.00 H new ATOM 2529 N ALA A 171 1.385 9.971 -2.684 1.00 0.00 N ATOM 2530 CA ALA A 171 2.168 10.282 -1.495 1.00 0.00 C ATOM 2531 C ALA A 171 3.121 9.142 -1.153 1.00 0.00 C ATOM 2532 O ALA A 171 4.284 9.370 -0.818 1.00 0.00 O ATOM 2533 CB ALA A 171 1.249 10.576 -0.319 1.00 0.00 C ATOM 0 H ALA A 171 0.376 9.978 -2.538 1.00 0.00 H new ATOM 0 HA ALA A 171 2.765 11.170 -1.705 1.00 0.00 H new ATOM 0 HB1 ALA A 171 1.848 10.807 0.562 1.00 0.00 H new ATOM 0 HB2 ALA A 171 0.613 11.428 -0.559 1.00 0.00 H new ATOM 0 HB3 ALA A 171 0.627 9.704 -0.117 1.00 0.00 H new ATOM 2539 N VAL A 172 2.621 7.913 -1.237 1.00 0.00 N ATOM 2540 CA VAL A 172 3.429 6.737 -0.936 1.00 0.00 C ATOM 2541 C VAL A 172 4.538 6.554 -1.966 1.00 0.00 C ATOM 2542 O VAL A 172 5.657 6.173 -1.624 1.00 0.00 O ATOM 2543 CB VAL A 172 2.567 5.461 -0.893 1.00 0.00 C ATOM 2544 CG1 VAL A 172 3.435 4.239 -0.633 1.00 0.00 C ATOM 2545 CG2 VAL A 172 1.480 5.588 0.164 1.00 0.00 C ATOM 0 H VAL A 172 1.661 7.706 -1.511 1.00 0.00 H new ATOM 0 HA VAL A 172 3.873 6.900 0.046 1.00 0.00 H new ATOM 0 HB VAL A 172 2.086 5.335 -1.863 1.00 0.00 H new ATOM 0 HG11 VAL A 172 2.809 3.347 -0.606 1.00 0.00 H new ATOM 0 HG12 VAL A 172 4.173 4.141 -1.429 1.00 0.00 H new ATOM 0 HG13 VAL A 172 3.946 4.353 0.323 1.00 0.00 H new ATOM 0 HG21 VAL A 172 0.881 4.678 0.181 1.00 0.00 H new ATOM 0 HG22 VAL A 172 1.939 5.738 1.141 1.00 0.00 H new ATOM 0 HG23 VAL A 172 0.841 6.439 -0.072 1.00 0.00 H new ATOM 2555 N GLN A 173 4.218 6.827 -3.226 1.00 0.00 N ATOM 2556 CA GLN A 173 5.189 6.692 -4.306 1.00 0.00 C ATOM 2557 C GLN A 173 6.396 7.593 -4.070 1.00 0.00 C ATOM 2558 O GLN A 173 7.514 7.114 -3.887 1.00 0.00 O ATOM 2559 CB GLN A 173 4.540 7.031 -5.649 1.00 0.00 C ATOM 2560 CG GLN A 173 5.462 6.825 -6.840 1.00 0.00 C ATOM 2561 CD GLN A 173 5.081 7.686 -8.028 1.00 0.00 C ATOM 2562 OE1 GLN A 173 5.007 8.911 -7.924 1.00 0.00 O ATOM 2563 NE2 GLN A 173 4.838 7.049 -9.168 1.00 0.00 N ATOM 0 H GLN A 173 3.295 7.143 -3.525 1.00 0.00 H new ATOM 0 HA GLN A 173 5.530 5.657 -4.326 1.00 0.00 H new ATOM 0 HB2 GLN A 173 3.650 6.415 -5.779 1.00 0.00 H new ATOM 0 HB3 GLN A 173 4.209 8.070 -5.631 1.00 0.00 H new ATOM 0 HG2 GLN A 173 6.487 7.052 -6.545 1.00 0.00 H new ATOM 0 HG3 GLN A 173 5.440 5.776 -7.135 1.00 0.00 H new ATOM 0 HE21 GLN A 173 4.911 6.032 -9.210 1.00 0.00 H new ATOM 0 HE22 GLN A 173 4.578 7.576 -10.002 1.00 0.00 H new ATOM 2572 N ALA A 174 6.161 8.901 -4.074 1.00 0.00 N ATOM 2573 CA ALA A 174 7.229 9.870 -3.859 1.00 0.00 C ATOM 2574 C ALA A 174 8.062 9.505 -2.635 1.00 0.00 C ATOM 2575 O ALA A 174 9.290 9.580 -2.664 1.00 0.00 O ATOM 2576 CB ALA A 174 6.650 11.269 -3.707 1.00 0.00 C ATOM 0 H ALA A 174 5.241 9.314 -4.224 1.00 0.00 H new ATOM 0 HA ALA A 174 7.883 9.852 -4.731 1.00 0.00 H new ATOM 0 HB1 ALA A 174 7.459 11.982 -3.547 1.00 0.00 H new ATOM 0 HB2 ALA A 174 6.104 11.537 -4.611 1.00 0.00 H new ATOM 0 HB3 ALA A 174 5.972 11.292 -2.854 1.00 0.00 H new ATOM 2582 N ALA A 175 7.387 9.109 -1.561 1.00 0.00 N ATOM 2583 CA ALA A 175 8.065 8.731 -0.328 1.00 0.00 C ATOM 2584 C ALA A 175 9.269 7.840 -0.615 1.00 0.00 C ATOM 2585 O ALA A 175 10.374 8.099 -0.136 1.00 0.00 O ATOM 2586 CB ALA A 175 7.098 8.029 0.613 1.00 0.00 C ATOM 0 H ALA A 175 6.370 9.042 -1.520 1.00 0.00 H new ATOM 0 HA ALA A 175 8.425 9.640 0.153 1.00 0.00 H new ATOM 0 HB1 ALA A 175 7.619 7.752 1.530 1.00 0.00 H new ATOM 0 HB2 ALA A 175 6.272 8.699 0.853 1.00 0.00 H new ATOM 0 HB3 ALA A 175 6.709 7.132 0.132 1.00 0.00 H new ATOM 2592 N CYS A 176 9.047 6.789 -1.396 1.00 0.00 N ATOM 2593 CA CYS A 176 10.114 5.857 -1.745 1.00 0.00 C ATOM 2594 C CYS A 176 11.426 6.597 -1.985 1.00 0.00 C ATOM 2595 O CYS A 176 11.694 7.063 -3.092 1.00 0.00 O ATOM 2596 CB CYS A 176 9.732 5.056 -2.991 1.00 0.00 C ATOM 2597 SG CYS A 176 8.233 4.063 -2.799 1.00 0.00 S ATOM 0 H CYS A 176 8.139 6.561 -1.800 1.00 0.00 H new ATOM 0 HA CYS A 176 10.252 5.172 -0.909 1.00 0.00 H new ATOM 0 HB2 CYS A 176 9.594 5.745 -3.825 1.00 0.00 H new ATOM 0 HB3 CYS A 176 10.560 4.398 -3.255 1.00 0.00 H new ATOM 0 HG CYS A 176 7.266 4.816 -2.365 1.00 0.00 H new