USER MOD reduce.3.24.130724 H: found=0, std=0, add=972, rem=0, adj=32 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 20 LYS NZ :NH3+ 169:sc= 0.634 (180deg=0) USER MOD Set 1.2: A 173 GLN : amide:sc= -0.837 K(o=-0.2,f=-7.7!) USER MOD Set 2.1: A 68 TYR OH : rot 25:sc= -0.0199 USER MOD Set 2.2: A 157 HIS : no HD1:sc= -0.893 K(o=-0.91,f=-3.4) USER MOD Set 3.1: A 134 MET CE :methyl -141:sc= -1.78 (180deg=-5.78!) USER MOD Set 3.2: A 176 CYS SG : rot 180:sc= -0.0571 USER MOD Set 4.1: A 126 CYS SG : rot 118:sc= -1.08 USER MOD Set 4.2: A 147 MET CE :methyl 169:sc= -0.0996 (180deg=0) USER MOD Set 5.1: A 67 GLN : amide:sc= 1.04 K(o=2.2,f=-12!) USER MOD Set 5.2: A 96 LYS NZ :NH3+ -173:sc= 1.13 (180deg=-0.0124) USER MOD Set 6.1: A 28 ASN : amide:sc= -2.67! C(o=-2.7!,f=-7.1!) USER MOD Set 6.2: A 30 THR OG1 : rot 180:sc= 0 USER MOD Set 7.1: A 19 SER OG : rot 180:sc= 0 USER MOD Set 7.2: A 23 GLN : amide:sc= -0.625 K(o=-0.63,f=0) USER MOD Single : A 21 MET CE :methyl -173:sc= 0 (180deg=-0.0131) USER MOD Single : A 22 GLN : amide:sc= 0.0294 K(o=0.029,f=-0.71) USER MOD Single : A 24 ASN : amide:sc=-0.00919 X(o=-0.0092,f=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.135 K(o=-0.13,f=-0.64) USER MOD Single : A 63 LYS NZ :NH3+ 126:sc= -0.0995 (180deg=-1.13) USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl 165:sc= -0.557 (180deg=-0.961) USER MOD Single : A 82 THR OG1 : rot -150:sc= 0 USER MOD Single : A 84 ASN : amide:sc= -0.287 X(o=-0.29,f=-0.44) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -2.53! K(o=-2.5!,f=-1.8) USER MOD Single : A 91 MET CE :methyl -156:sc= -0.111 (180deg=-0.596) USER MOD Single : A 92 THR OG1 : rot 37:sc= 0.94 USER MOD Single : A 93 SER OG : rot 70:sc= 0.0473 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 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -0.848 X(o=-0.85,f=-0.38) USER MOD Single : A 104 MET CE :methyl 134:sc= -1.18 (180deg=-4.02!) USER MOD Single : A 105 ASN : amide:sc= -0.735 K(o=-0.73,f=-3.7!) USER MOD Single : A 110 THR OG1 : rot 53:sc= 0.484 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 166:sc= -0.739 USER MOD Single : A 117 LYS NZ :NH3+ -120:sc=-0.00509 (180deg=-0.872) USER MOD Single : A 118 ASN : amide:sc= -0.226 X(o=-0.23,f=-0.33) USER MOD Single : A 132 SER OG : rot -73:sc= 1.02 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 HIS : no HD1:sc= -0.167 X(o=-0.17,f=-0.12) USER MOD Single : A 142 THR OG1 : rot 41:sc= 0.54 USER MOD Single : A 149 THR OG1 : rot -104:sc= 0.239 USER MOD Single : A 151 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 152 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 156 CYS SG : rot 180:sc= 0 USER MOD Single : A 161 CYS SG : rot 180:sc= -1.19 USER MOD Single : A 164 ASN : amide:sc= -1.34! C(o=-1.3!,f=-6.5!) USER MOD Single : A 167 ASN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 169 SER OG : rot -85:sc= 0.832 USER MOD ----------------------------------------------------------------- ATOM 213 N LEU A 18 -3.743 8.209 -11.653 1.00 0.00 N ATOM 214 CA LEU A 18 -3.960 6.882 -11.086 1.00 0.00 C ATOM 215 C LEU A 18 -3.975 5.819 -12.180 1.00 0.00 C ATOM 216 O LEU A 18 -3.617 4.665 -11.942 1.00 0.00 O ATOM 217 CB LEU A 18 -5.277 6.848 -10.309 1.00 0.00 C ATOM 218 CG LEU A 18 -5.256 7.497 -8.924 1.00 0.00 C ATOM 219 CD1 LEU A 18 -6.652 7.947 -8.524 1.00 0.00 C ATOM 220 CD2 LEU A 18 -4.689 6.532 -7.892 1.00 0.00 C ATOM 0 HA LEU A 18 -3.137 6.665 -10.405 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.042 7.342 -10.908 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -5.583 5.808 -10.196 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.611 8.375 -8.965 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.617 8.406 -7.536 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -7.022 8.672 -9.249 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.319 7.085 -8.500 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.681 7.010 -6.912 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.308 5.636 -7.853 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.671 6.259 -8.170 1.00 0.00 H new ATOM 232 N SER A 19 -4.389 6.216 -13.379 1.00 0.00 N ATOM 233 CA SER A 19 -4.451 5.296 -14.509 1.00 0.00 C ATOM 234 C SER A 19 -3.127 4.558 -14.683 1.00 0.00 C ATOM 235 O SER A 19 -3.095 3.333 -14.797 1.00 0.00 O ATOM 236 CB SER A 19 -4.797 6.054 -15.792 1.00 0.00 C ATOM 237 OG SER A 19 -5.454 5.210 -16.722 1.00 0.00 O ATOM 0 H SER A 19 -4.686 7.168 -13.593 1.00 0.00 H new ATOM 0 HA SER A 19 -5.232 4.563 -14.306 1.00 0.00 H new ATOM 0 HB2 SER A 19 -5.435 6.905 -15.554 1.00 0.00 H new ATOM 0 HB3 SER A 19 -3.887 6.453 -16.239 1.00 0.00 H new ATOM 0 HG SER A 19 -5.666 5.719 -17.533 1.00 0.00 H new ATOM 243 N LYS A 20 -2.034 5.314 -14.702 1.00 0.00 N ATOM 244 CA LYS A 20 -0.705 4.735 -14.860 1.00 0.00 C ATOM 245 C LYS A 20 -0.517 3.543 -13.927 1.00 0.00 C ATOM 246 O LYS A 20 0.156 2.572 -14.273 1.00 0.00 O ATOM 247 CB LYS A 20 0.369 5.788 -14.583 1.00 0.00 C ATOM 248 CG LYS A 20 0.719 5.928 -13.111 1.00 0.00 C ATOM 249 CD LYS A 20 1.749 7.021 -12.884 1.00 0.00 C ATOM 250 CE LYS A 20 2.602 6.738 -11.658 1.00 0.00 C ATOM 251 NZ LYS A 20 3.843 7.561 -11.642 1.00 0.00 N ATOM 0 H LYS A 20 -2.043 6.330 -14.610 1.00 0.00 H new ATOM 0 HA LYS A 20 -0.607 4.388 -15.889 1.00 0.00 H new ATOM 0 HB2 LYS A 20 1.270 5.530 -15.139 1.00 0.00 H new ATOM 0 HB3 LYS A 20 0.027 6.752 -14.960 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -0.183 6.153 -12.542 1.00 0.00 H new ATOM 0 HG3 LYS A 20 1.105 4.980 -12.736 1.00 0.00 H new ATOM 0 HD2 LYS A 20 2.389 7.107 -13.762 1.00 0.00 H new ATOM 0 HD3 LYS A 20 1.244 7.979 -12.763 1.00 0.00 H new ATOM 0 HE2 LYS A 20 2.021 6.939 -10.758 1.00 0.00 H new ATOM 0 HE3 LYS A 20 2.867 5.681 -11.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 4.301 7.480 -10.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 4.494 7.222 -12.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 3.602 8.556 -11.824 1.00 0.00 H new ATOM 265 N MET A 21 -1.116 3.623 -12.743 1.00 0.00 N ATOM 266 CA MET A 21 -1.015 2.550 -11.762 1.00 0.00 C ATOM 267 C MET A 21 -1.902 1.371 -12.152 1.00 0.00 C ATOM 268 O MET A 21 -1.503 0.214 -12.023 1.00 0.00 O ATOM 269 CB MET A 21 -1.408 3.060 -10.374 1.00 0.00 C ATOM 270 CG MET A 21 -0.903 4.463 -10.077 1.00 0.00 C ATOM 271 SD MET A 21 -0.656 4.754 -8.315 1.00 0.00 S ATOM 272 CE MET A 21 1.126 4.617 -8.196 1.00 0.00 C ATOM 0 H MET A 21 -1.676 4.420 -12.440 1.00 0.00 H new ATOM 0 HA MET A 21 0.021 2.211 -11.737 1.00 0.00 H new ATOM 0 HB2 MET A 21 -2.494 3.047 -10.285 1.00 0.00 H new ATOM 0 HB3 MET A 21 -1.019 2.375 -9.621 1.00 0.00 H new ATOM 0 HG2 MET A 21 0.038 4.625 -10.603 1.00 0.00 H new ATOM 0 HG3 MET A 21 -1.615 5.191 -10.465 1.00 0.00 H new ATOM 0 HE1 MET A 21 1.424 4.649 -7.148 1.00 0.00 H new ATOM 0 HE2 MET A 21 1.449 3.674 -8.637 1.00 0.00 H new ATOM 0 HE3 MET A 21 1.591 5.445 -8.731 1.00 0.00 H new ATOM 282 N GLN A 22 -3.105 1.674 -12.629 1.00 0.00 N ATOM 283 CA GLN A 22 -4.047 0.639 -13.037 1.00 0.00 C ATOM 284 C GLN A 22 -3.576 -0.055 -14.311 1.00 0.00 C ATOM 285 O GLN A 22 -3.981 -1.180 -14.601 1.00 0.00 O ATOM 286 CB GLN A 22 -5.437 1.241 -13.254 1.00 0.00 C ATOM 287 CG GLN A 22 -6.043 1.842 -11.996 1.00 0.00 C ATOM 288 CD GLN A 22 -7.380 2.508 -12.253 1.00 0.00 C ATOM 289 OE1 GLN A 22 -7.585 3.134 -13.293 1.00 0.00 O ATOM 290 NE2 GLN A 22 -8.299 2.377 -11.303 1.00 0.00 N ATOM 0 H GLN A 22 -3.450 2.627 -12.742 1.00 0.00 H new ATOM 0 HA GLN A 22 -4.100 -0.102 -12.240 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -5.374 2.013 -14.021 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -6.104 0.467 -13.634 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -6.169 1.059 -11.248 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -5.351 2.573 -11.578 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -8.086 1.849 -10.457 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -9.218 2.804 -11.420 1.00 0.00 H new ATOM 299 N GLN A 23 -2.720 0.625 -15.067 1.00 0.00 N ATOM 300 CA GLN A 23 -2.196 0.074 -16.311 1.00 0.00 C ATOM 301 C GLN A 23 -0.946 -0.761 -16.051 1.00 0.00 C ATOM 302 O GLN A 23 -0.871 -1.923 -16.449 1.00 0.00 O ATOM 303 CB GLN A 23 -1.876 1.198 -17.297 1.00 0.00 C ATOM 304 CG GLN A 23 -3.102 1.970 -17.757 1.00 0.00 C ATOM 305 CD GLN A 23 -2.751 3.148 -18.645 1.00 0.00 C ATOM 306 OE1 GLN A 23 -2.770 3.042 -19.872 1.00 0.00 O ATOM 307 NE2 GLN A 23 -2.429 4.279 -18.029 1.00 0.00 N ATOM 0 H GLN A 23 -2.375 1.558 -14.840 1.00 0.00 H new ATOM 0 HA GLN A 23 -2.960 -0.572 -16.744 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -1.175 1.890 -16.831 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -1.375 0.775 -18.168 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -3.768 1.298 -18.298 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -3.650 2.328 -16.885 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -2.426 4.322 -17.010 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -2.184 5.105 -18.575 1.00 0.00 H new ATOM 316 N ASN A 24 0.033 -0.161 -15.382 1.00 0.00 N ATOM 317 CA ASN A 24 1.280 -0.849 -15.071 1.00 0.00 C ATOM 318 C ASN A 24 1.437 -1.036 -13.565 1.00 0.00 C ATOM 319 O ASN A 24 1.509 -2.161 -13.072 1.00 0.00 O ATOM 320 CB ASN A 24 2.472 -0.066 -15.626 1.00 0.00 C ATOM 321 CG ASN A 24 2.489 -0.037 -17.142 1.00 0.00 C ATOM 322 OD1 ASN A 24 3.188 -0.824 -17.781 1.00 0.00 O ATOM 323 ND2 ASN A 24 1.718 0.873 -17.725 1.00 0.00 N ATOM 0 H ASN A 24 -0.013 0.801 -15.045 1.00 0.00 H new ATOM 0 HA ASN A 24 1.250 -1.832 -15.540 1.00 0.00 H new ATOM 0 HB2 ASN A 24 2.441 0.955 -15.246 1.00 0.00 H new ATOM 0 HB3 ASN A 24 3.398 -0.513 -15.263 1.00 0.00 H new ATOM 0 HD21 ASN A 24 1.688 0.940 -18.742 1.00 0.00 H new ATOM 0 HD22 ASN A 24 1.155 1.505 -17.156 1.00 0.00 H new ATOM 330 N GLY A 25 1.488 0.076 -12.838 1.00 0.00 N ATOM 331 CA GLY A 25 1.636 0.014 -11.396 1.00 0.00 C ATOM 332 C GLY A 25 2.894 0.707 -10.911 1.00 0.00 C ATOM 333 O GLY A 25 3.379 1.643 -11.546 1.00 0.00 O ATOM 0 H GLY A 25 1.429 1.019 -13.222 1.00 0.00 H new ATOM 0 HA2 GLY A 25 0.767 0.474 -10.925 1.00 0.00 H new ATOM 0 HA3 GLY A 25 1.655 -1.029 -11.081 1.00 0.00 H new ATOM 337 N TYR A 26 3.422 0.247 -9.782 1.00 0.00 N ATOM 338 CA TYR A 26 4.629 0.832 -9.210 1.00 0.00 C ATOM 339 C TYR A 26 5.535 -0.249 -8.628 1.00 0.00 C ATOM 340 O TYR A 26 5.180 -0.914 -7.656 1.00 0.00 O ATOM 341 CB TYR A 26 4.265 1.846 -8.124 1.00 0.00 C ATOM 342 CG TYR A 26 5.387 2.803 -7.788 1.00 0.00 C ATOM 343 CD1 TYR A 26 6.637 2.332 -7.407 1.00 0.00 C ATOM 344 CD2 TYR A 26 5.196 4.178 -7.853 1.00 0.00 C ATOM 345 CE1 TYR A 26 7.664 3.202 -7.098 1.00 0.00 C ATOM 346 CE2 TYR A 26 6.218 5.055 -7.547 1.00 0.00 C ATOM 347 CZ TYR A 26 7.450 4.563 -7.170 1.00 0.00 C ATOM 348 OH TYR A 26 8.471 5.433 -6.865 1.00 0.00 O ATOM 0 H TYR A 26 3.034 -0.529 -9.245 1.00 0.00 H new ATOM 0 HA TYR A 26 5.168 1.342 -10.008 1.00 0.00 H new ATOM 0 HB2 TYR A 26 3.396 2.418 -8.449 1.00 0.00 H new ATOM 0 HB3 TYR A 26 3.974 1.310 -7.221 1.00 0.00 H new ATOM 0 HD1 TYR A 26 6.809 1.267 -7.351 1.00 0.00 H new ATOM 0 HD2 TYR A 26 4.233 4.567 -8.148 1.00 0.00 H new ATOM 0 HE1 TYR A 26 8.629 2.819 -6.802 1.00 0.00 H new ATOM 0 HE2 TYR A 26 6.053 6.121 -7.603 1.00 0.00 H new ATOM 0 HH TYR A 26 8.156 6.355 -6.967 1.00 0.00 H new ATOM 358 N GLU A 27 6.708 -0.417 -9.231 1.00 0.00 N ATOM 359 CA GLU A 27 7.665 -1.417 -8.774 1.00 0.00 C ATOM 360 C GLU A 27 8.811 -0.762 -8.007 1.00 0.00 C ATOM 361 O GLU A 27 9.665 -0.099 -8.593 1.00 0.00 O ATOM 362 CB GLU A 27 8.218 -2.207 -9.962 1.00 0.00 C ATOM 363 CG GLU A 27 7.271 -3.280 -10.473 1.00 0.00 C ATOM 364 CD GLU A 27 7.917 -4.186 -11.502 1.00 0.00 C ATOM 365 OE1 GLU A 27 9.015 -4.713 -11.222 1.00 0.00 O ATOM 366 OE2 GLU A 27 7.326 -4.369 -12.587 1.00 0.00 O ATOM 0 H GLU A 27 7.018 0.126 -10.037 1.00 0.00 H new ATOM 0 HA GLU A 27 7.145 -2.101 -8.103 1.00 0.00 H new ATOM 0 HB2 GLU A 27 8.443 -1.516 -10.774 1.00 0.00 H new ATOM 0 HB3 GLU A 27 9.159 -2.673 -9.671 1.00 0.00 H new ATOM 0 HG2 GLU A 27 6.922 -3.881 -9.633 1.00 0.00 H new ATOM 0 HG3 GLU A 27 6.393 -2.806 -10.912 1.00 0.00 H new ATOM 373 N ASN A 28 8.821 -0.955 -6.692 1.00 0.00 N ATOM 374 CA ASN A 28 9.860 -0.383 -5.843 1.00 0.00 C ATOM 375 C ASN A 28 11.184 -1.116 -6.036 1.00 0.00 C ATOM 376 O ASN A 28 11.329 -2.288 -5.689 1.00 0.00 O ATOM 377 CB ASN A 28 9.439 -0.444 -4.374 1.00 0.00 C ATOM 378 CG ASN A 28 10.302 0.435 -3.488 1.00 0.00 C ATOM 379 OD1 ASN A 28 11.263 1.048 -3.951 1.00 0.00 O ATOM 380 ND2 ASN A 28 9.960 0.499 -2.206 1.00 0.00 N ATOM 0 H ASN A 28 8.121 -1.503 -6.191 1.00 0.00 H new ATOM 0 HA ASN A 28 9.997 0.659 -6.131 1.00 0.00 H new ATOM 0 HB2 ASN A 28 8.398 -0.135 -4.284 1.00 0.00 H new ATOM 0 HB3 ASN A 28 9.497 -1.475 -4.025 1.00 0.00 H new ATOM 0 HD21 ASN A 28 10.503 1.074 -1.562 1.00 0.00 H new ATOM 0 HD22 ASN A 28 9.155 -0.027 -1.866 1.00 0.00 H new ATOM 387 N PRO A 29 12.175 -0.410 -6.601 1.00 0.00 N ATOM 388 CA PRO A 29 13.505 -0.974 -6.851 1.00 0.00 C ATOM 389 C PRO A 29 14.282 -1.218 -5.563 1.00 0.00 C ATOM 390 O PRO A 29 14.903 -2.268 -5.389 1.00 0.00 O ATOM 391 CB PRO A 29 14.193 0.102 -7.695 1.00 0.00 C ATOM 392 CG PRO A 29 13.498 1.370 -7.332 1.00 0.00 C ATOM 393 CD PRO A 29 12.073 0.992 -7.040 1.00 0.00 C ATOM 0 HA PRO A 29 13.450 -1.947 -7.338 1.00 0.00 H new ATOM 0 HB2 PRO A 29 15.259 0.157 -7.474 1.00 0.00 H new ATOM 0 HB3 PRO A 29 14.099 -0.110 -8.760 1.00 0.00 H new ATOM 0 HG2 PRO A 29 13.964 1.836 -6.464 1.00 0.00 H new ATOM 0 HG3 PRO A 29 13.551 2.091 -8.147 1.00 0.00 H new ATOM 0 HD2 PRO A 29 11.640 1.625 -6.266 1.00 0.00 H new ATOM 0 HD3 PRO A 29 11.442 1.092 -7.923 1.00 0.00 H new ATOM 401 N THR A 30 14.245 -0.243 -4.660 1.00 0.00 N ATOM 402 CA THR A 30 14.947 -0.352 -3.387 1.00 0.00 C ATOM 403 C THR A 30 14.825 -1.758 -2.811 1.00 0.00 C ATOM 404 O THR A 30 15.798 -2.318 -2.306 1.00 0.00 O ATOM 405 CB THR A 30 14.407 0.660 -2.360 1.00 0.00 C ATOM 406 OG1 THR A 30 14.421 1.979 -2.917 1.00 0.00 O ATOM 407 CG2 THR A 30 15.238 0.634 -1.086 1.00 0.00 C ATOM 0 H THR A 30 13.736 0.632 -4.787 1.00 0.00 H new ATOM 0 HA THR A 30 15.996 -0.133 -3.584 1.00 0.00 H new ATOM 0 HB THR A 30 13.383 0.381 -2.113 1.00 0.00 H new ATOM 0 HG1 THR A 30 14.074 2.616 -2.258 1.00 0.00 H new ATOM 0 HG21 THR A 30 14.837 1.357 -0.376 1.00 0.00 H new ATOM 0 HG22 THR A 30 15.201 -0.363 -0.648 1.00 0.00 H new ATOM 0 HG23 THR A 30 16.271 0.890 -1.320 1.00 0.00 H new ATOM 824 N VAL A 61 4.480 14.991 8.597 1.00 0.00 N ATOM 825 CA VAL A 61 3.707 13.755 8.584 1.00 0.00 C ATOM 826 C VAL A 61 2.345 13.966 7.933 1.00 0.00 C ATOM 827 O VAL A 61 1.753 15.039 8.042 1.00 0.00 O ATOM 828 CB VAL A 61 3.504 13.206 10.009 1.00 0.00 C ATOM 829 CG1 VAL A 61 2.937 14.283 10.921 1.00 0.00 C ATOM 830 CG2 VAL A 61 2.596 11.985 9.984 1.00 0.00 C ATOM 0 HA VAL A 61 4.276 13.031 8.001 1.00 0.00 H new ATOM 0 HB VAL A 61 4.473 12.903 10.405 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.801 13.876 11.923 1.00 0.00 H new ATOM 0 HG12 VAL A 61 3.627 15.125 10.962 1.00 0.00 H new ATOM 0 HG13 VAL A 61 1.976 14.620 10.532 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.463 11.610 10.999 1.00 0.00 H new ATOM 0 HG22 VAL A 61 1.627 12.261 9.569 1.00 0.00 H new ATOM 0 HG23 VAL A 61 3.047 11.209 9.366 1.00 0.00 H new ATOM 840 N GLN A 62 1.852 12.933 7.257 1.00 0.00 N ATOM 841 CA GLN A 62 0.559 13.005 6.588 1.00 0.00 C ATOM 842 C GLN A 62 -0.399 11.955 7.140 1.00 0.00 C ATOM 843 O GLN A 62 -0.005 10.821 7.412 1.00 0.00 O ATOM 844 CB GLN A 62 0.729 12.813 5.080 1.00 0.00 C ATOM 845 CG GLN A 62 1.312 14.027 4.374 1.00 0.00 C ATOM 846 CD GLN A 62 1.583 13.774 2.904 1.00 0.00 C ATOM 847 OE1 GLN A 62 0.698 13.931 2.062 1.00 0.00 O ATOM 848 NE2 GLN A 62 2.810 13.380 2.587 1.00 0.00 N ATOM 0 H GLN A 62 2.329 12.037 7.158 1.00 0.00 H new ATOM 0 HA GLN A 62 0.136 13.992 6.776 1.00 0.00 H new ATOM 0 HB2 GLN A 62 1.376 11.954 4.902 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -0.240 12.578 4.640 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.623 14.866 4.473 1.00 0.00 H new ATOM 0 HG3 GLN A 62 2.240 14.317 4.866 1.00 0.00 H new ATOM 0 HE21 GLN A 62 3.513 13.263 3.317 1.00 0.00 H new ATOM 0 HE22 GLN A 62 3.050 13.195 1.613 1.00 0.00 H new ATOM 857 N LYS A 63 -1.660 12.341 7.305 1.00 0.00 N ATOM 858 CA LYS A 63 -2.676 11.433 7.825 1.00 0.00 C ATOM 859 C LYS A 63 -3.893 11.395 6.905 1.00 0.00 C ATOM 860 O LYS A 63 -4.584 12.398 6.731 1.00 0.00 O ATOM 861 CB LYS A 63 -3.101 11.862 9.232 1.00 0.00 C ATOM 862 CG LYS A 63 -2.244 11.264 10.334 1.00 0.00 C ATOM 863 CD LYS A 63 -2.501 11.942 11.669 1.00 0.00 C ATOM 864 CE LYS A 63 -1.627 13.174 11.847 1.00 0.00 C ATOM 865 NZ LYS A 63 -2.292 14.404 11.334 1.00 0.00 N ATOM 0 H LYS A 63 -2.003 13.276 7.086 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.245 10.433 7.871 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -3.059 12.949 9.300 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -4.139 11.573 9.393 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -2.452 10.198 10.420 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -1.191 11.363 10.071 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -3.551 12.227 11.737 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -2.308 11.238 12.479 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -1.391 13.302 12.903 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -0.682 13.027 11.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -2.308 15.127 12.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -1.766 14.766 10.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -3.267 14.179 11.049 1.00 0.00 H new ATOM 879 N PHE A 64 -4.149 10.229 6.320 1.00 0.00 N ATOM 880 CA PHE A 64 -5.283 10.060 5.418 1.00 0.00 C ATOM 881 C PHE A 64 -6.317 9.111 6.017 1.00 0.00 C ATOM 882 O PHE A 64 -5.968 8.087 6.605 1.00 0.00 O ATOM 883 CB PHE A 64 -4.810 9.528 4.064 1.00 0.00 C ATOM 884 CG PHE A 64 -3.783 10.402 3.402 1.00 0.00 C ATOM 885 CD1 PHE A 64 -4.171 11.476 2.617 1.00 0.00 C ATOM 886 CD2 PHE A 64 -2.430 10.151 3.566 1.00 0.00 C ATOM 887 CE1 PHE A 64 -3.228 12.281 2.006 1.00 0.00 C ATOM 888 CE2 PHE A 64 -1.483 10.953 2.959 1.00 0.00 C ATOM 889 CZ PHE A 64 -1.882 12.020 2.178 1.00 0.00 C ATOM 0 H PHE A 64 -3.587 9.388 6.454 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.750 11.035 5.275 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.393 8.530 4.200 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -5.670 9.426 3.402 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -5.222 11.686 2.481 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -2.112 9.318 4.176 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -3.543 13.114 1.394 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.432 10.746 3.095 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.144 12.649 1.703 1.00 0.00 H new ATOM 899 N ARG A 65 -7.590 9.459 5.863 1.00 0.00 N ATOM 900 CA ARG A 65 -8.675 8.640 6.390 1.00 0.00 C ATOM 901 C ARG A 65 -9.092 7.575 5.380 1.00 0.00 C ATOM 902 O ARG A 65 -9.749 7.874 4.382 1.00 0.00 O ATOM 903 CB ARG A 65 -9.877 9.517 6.748 1.00 0.00 C ATOM 904 CG ARG A 65 -10.977 8.770 7.485 1.00 0.00 C ATOM 905 CD ARG A 65 -12.180 9.664 7.742 1.00 0.00 C ATOM 906 NE ARG A 65 -13.426 8.904 7.789 1.00 0.00 N ATOM 907 CZ ARG A 65 -14.595 9.429 8.142 1.00 0.00 C ATOM 908 NH1 ARG A 65 -14.676 10.710 8.476 1.00 0.00 N ATOM 909 NH2 ARG A 65 -15.685 8.673 8.159 1.00 0.00 N ATOM 0 H ARG A 65 -7.896 10.302 5.378 1.00 0.00 H new ATOM 0 HA ARG A 65 -8.316 8.142 7.291 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -9.538 10.349 7.365 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -10.289 9.945 5.834 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -11.285 7.903 6.900 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -10.592 8.395 8.433 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -12.043 10.194 8.684 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -12.245 10.419 6.958 1.00 0.00 H new ATOM 0 HE ARG A 65 -13.398 7.916 7.537 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -13.840 11.294 8.462 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -15.574 11.111 8.747 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -15.626 7.688 7.901 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -16.582 9.077 8.430 1.00 0.00 H new ATOM 923 N VAL A 66 -8.705 6.331 5.645 1.00 0.00 N ATOM 924 CA VAL A 66 -9.039 5.222 4.760 1.00 0.00 C ATOM 925 C VAL A 66 -9.666 4.069 5.536 1.00 0.00 C ATOM 926 O VAL A 66 -9.716 4.091 6.766 1.00 0.00 O ATOM 927 CB VAL A 66 -7.795 4.706 4.013 1.00 0.00 C ATOM 928 CG1 VAL A 66 -7.123 5.838 3.249 1.00 0.00 C ATOM 929 CG2 VAL A 66 -6.821 4.057 4.984 1.00 0.00 C ATOM 0 H VAL A 66 -8.160 6.066 6.466 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.758 5.602 4.034 1.00 0.00 H new ATOM 0 HB VAL A 66 -8.112 3.951 3.293 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -6.246 5.455 2.727 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -7.823 6.254 2.524 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -6.818 6.617 3.947 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.948 3.698 4.439 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -6.508 4.789 5.729 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -7.308 3.218 5.482 1.00 0.00 H new ATOM 939 N GLN A 67 -10.142 3.063 4.810 1.00 0.00 N ATOM 940 CA GLN A 67 -10.766 1.901 5.431 1.00 0.00 C ATOM 941 C GLN A 67 -9.911 0.653 5.233 1.00 0.00 C ATOM 942 O GLN A 67 -9.202 0.527 4.235 1.00 0.00 O ATOM 943 CB GLN A 67 -12.163 1.674 4.850 1.00 0.00 C ATOM 944 CG GLN A 67 -13.260 2.416 5.597 1.00 0.00 C ATOM 945 CD GLN A 67 -14.512 2.600 4.762 1.00 0.00 C ATOM 946 OE1 GLN A 67 -14.606 3.528 3.959 1.00 0.00 O ATOM 947 NE2 GLN A 67 -15.483 1.714 4.948 1.00 0.00 N ATOM 0 H GLN A 67 -10.107 3.029 3.791 1.00 0.00 H new ATOM 0 HA GLN A 67 -10.852 2.094 6.500 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -12.169 1.988 3.806 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -12.384 0.607 4.863 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -13.511 1.868 6.505 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -12.887 3.392 5.907 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -15.363 0.960 5.624 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -16.349 1.787 4.414 1.00 0.00 H new ATOM 956 N TYR A 68 -9.984 -0.265 6.190 1.00 0.00 N ATOM 957 CA TYR A 68 -9.215 -1.502 6.122 1.00 0.00 C ATOM 958 C TYR A 68 -10.056 -2.635 5.543 1.00 0.00 C ATOM 959 O TYR A 68 -11.180 -2.879 5.985 1.00 0.00 O ATOM 960 CB TYR A 68 -8.706 -1.888 7.512 1.00 0.00 C ATOM 961 CG TYR A 68 -7.394 -2.637 7.491 1.00 0.00 C ATOM 962 CD1 TYR A 68 -7.229 -3.766 6.697 1.00 0.00 C ATOM 963 CD2 TYR A 68 -6.318 -2.218 8.264 1.00 0.00 C ATOM 964 CE1 TYR A 68 -6.031 -4.455 6.674 1.00 0.00 C ATOM 965 CE2 TYR A 68 -5.117 -2.900 8.247 1.00 0.00 C ATOM 966 CZ TYR A 68 -4.978 -4.017 7.450 1.00 0.00 C ATOM 967 OH TYR A 68 -3.784 -4.700 7.431 1.00 0.00 O ATOM 0 H TYR A 68 -10.568 -0.176 7.022 1.00 0.00 H new ATOM 0 HA TYR A 68 -8.362 -1.334 5.464 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -8.589 -0.984 8.110 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -9.458 -2.503 8.007 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -8.051 -4.111 6.087 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -6.423 -1.344 8.889 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -5.920 -5.331 6.052 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -4.291 -2.560 8.855 1.00 0.00 H new ATOM 0 HH TYR A 68 -3.698 -5.184 6.583 1.00 0.00 H new ATOM 977 N LEU A 69 -9.503 -3.326 4.552 1.00 0.00 N ATOM 978 CA LEU A 69 -10.200 -4.436 3.911 1.00 0.00 C ATOM 979 C LEU A 69 -9.737 -5.772 4.482 1.00 0.00 C ATOM 980 O LEU A 69 -10.549 -6.587 4.919 1.00 0.00 O ATOM 981 CB LEU A 69 -9.967 -4.405 2.400 1.00 0.00 C ATOM 982 CG LEU A 69 -10.977 -3.600 1.581 1.00 0.00 C ATOM 983 CD1 LEU A 69 -10.549 -2.143 1.489 1.00 0.00 C ATOM 984 CD2 LEU A 69 -11.136 -4.199 0.191 1.00 0.00 C ATOM 0 H LEU A 69 -8.574 -3.137 4.175 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.266 -4.327 4.110 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.973 -3.999 2.214 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.966 -5.431 2.032 1.00 0.00 H new ATOM 0 HG LEU A 69 -11.942 -3.644 2.086 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.279 -1.586 0.903 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -10.487 -1.718 2.491 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -9.573 -2.080 1.007 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.858 -3.613 -0.377 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.175 -4.187 -0.323 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.489 -5.227 0.276 1.00 0.00 H new ATOM 996 N GLY A 70 -8.426 -5.990 4.477 1.00 0.00 N ATOM 997 CA GLY A 70 -7.877 -7.228 4.998 1.00 0.00 C ATOM 998 C GLY A 70 -6.682 -7.714 4.202 1.00 0.00 C ATOM 999 O GLY A 70 -6.450 -7.261 3.081 1.00 0.00 O ATOM 0 H GLY A 70 -7.734 -5.331 4.121 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -7.582 -7.082 6.037 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.651 -7.996 4.991 1.00 0.00 H new ATOM 1003 N MET A 71 -5.922 -8.636 4.782 1.00 0.00 N ATOM 1004 CA MET A 71 -4.743 -9.182 4.119 1.00 0.00 C ATOM 1005 C MET A 71 -5.126 -10.330 3.190 1.00 0.00 C ATOM 1006 O MET A 71 -6.057 -11.086 3.472 1.00 0.00 O ATOM 1007 CB MET A 71 -3.727 -9.666 5.155 1.00 0.00 C ATOM 1008 CG MET A 71 -2.426 -10.162 4.544 1.00 0.00 C ATOM 1009 SD MET A 71 -1.613 -11.410 5.560 1.00 0.00 S ATOM 1010 CE MET A 71 -2.387 -12.904 4.946 1.00 0.00 C ATOM 0 H MET A 71 -6.101 -9.021 5.709 1.00 0.00 H new ATOM 0 HA MET A 71 -4.292 -8.389 3.522 1.00 0.00 H new ATOM 0 HB2 MET A 71 -3.508 -8.851 5.845 1.00 0.00 H new ATOM 0 HB3 MET A 71 -4.173 -10.469 5.742 1.00 0.00 H new ATOM 0 HG2 MET A 71 -2.628 -10.578 3.557 1.00 0.00 H new ATOM 0 HG3 MET A 71 -1.751 -9.318 4.402 1.00 0.00 H new ATOM 0 HE1 MET A 71 -1.987 -13.767 5.479 1.00 0.00 H new ATOM 0 HE2 MET A 71 -3.464 -12.847 5.104 1.00 0.00 H new ATOM 0 HE3 MET A 71 -2.182 -13.009 3.881 1.00 0.00 H new ATOM 1020 N LEU A 72 -4.403 -10.455 2.082 1.00 0.00 N ATOM 1021 CA LEU A 72 -4.667 -11.511 1.111 1.00 0.00 C ATOM 1022 C LEU A 72 -3.366 -12.132 0.615 1.00 0.00 C ATOM 1023 O LEU A 72 -2.447 -11.440 0.176 1.00 0.00 O ATOM 1024 CB LEU A 72 -5.464 -10.957 -0.071 1.00 0.00 C ATOM 1025 CG LEU A 72 -6.454 -11.922 -0.725 1.00 0.00 C ATOM 1026 CD1 LEU A 72 -5.714 -13.035 -1.449 1.00 0.00 C ATOM 1027 CD2 LEU A 72 -7.404 -12.498 0.315 1.00 0.00 C ATOM 0 H LEU A 72 -3.630 -9.838 1.834 1.00 0.00 H new ATOM 0 HA LEU A 72 -5.253 -12.286 1.605 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.013 -10.078 0.267 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -4.760 -10.620 -0.832 1.00 0.00 H new ATOM 0 HG LEU A 72 -7.042 -11.369 -1.457 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -6.434 -13.712 -1.908 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -5.076 -12.605 -2.221 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.100 -13.587 -0.737 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -8.101 -13.182 -0.168 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -6.833 -13.036 1.071 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -7.960 -11.688 0.788 1.00 0.00 H new ATOM 1039 N PRO A 73 -3.284 -13.469 0.683 1.00 0.00 N ATOM 1040 CA PRO A 73 -2.101 -14.214 0.242 1.00 0.00 C ATOM 1041 C PRO A 73 -1.927 -14.182 -1.272 1.00 0.00 C ATOM 1042 O PRO A 73 -2.820 -14.584 -2.018 1.00 0.00 O ATOM 1043 CB PRO A 73 -2.382 -15.641 0.719 1.00 0.00 C ATOM 1044 CG PRO A 73 -3.867 -15.728 0.798 1.00 0.00 C ATOM 1045 CD PRO A 73 -4.341 -14.358 1.195 1.00 0.00 C ATOM 0 HA PRO A 73 -1.180 -13.790 0.642 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -1.979 -16.377 0.024 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -1.922 -15.832 1.689 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -4.292 -16.025 -0.161 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -4.176 -16.475 1.529 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -5.310 -14.125 0.754 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -4.452 -14.269 2.276 1.00 0.00 H new ATOM 1053 N VAL A 74 -0.771 -13.702 -1.721 1.00 0.00 N ATOM 1054 CA VAL A 74 -0.480 -13.619 -3.147 1.00 0.00 C ATOM 1055 C VAL A 74 0.582 -14.636 -3.551 1.00 0.00 C ATOM 1056 O VAL A 74 1.232 -15.241 -2.698 1.00 0.00 O ATOM 1057 CB VAL A 74 -0.001 -12.209 -3.542 1.00 0.00 C ATOM 1058 CG1 VAL A 74 -1.134 -11.203 -3.405 1.00 0.00 C ATOM 1059 CG2 VAL A 74 1.194 -11.797 -2.696 1.00 0.00 C ATOM 0 H VAL A 74 -0.021 -13.365 -1.117 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.409 -13.839 -3.673 1.00 0.00 H new ATOM 0 HB VAL A 74 0.311 -12.229 -4.586 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.777 -10.213 -3.688 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.958 -11.492 -4.057 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.479 -11.182 -2.371 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.520 -10.799 -2.988 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.911 -11.793 -1.644 1.00 0.00 H new ATOM 0 HG23 VAL A 74 2.009 -12.504 -2.849 1.00 0.00 H new ATOM 1069 N ASP A 75 0.753 -14.818 -4.855 1.00 0.00 N ATOM 1070 CA ASP A 75 1.738 -15.761 -5.373 1.00 0.00 C ATOM 1071 C ASP A 75 3.003 -15.035 -5.820 1.00 0.00 C ATOM 1072 O ASP A 75 4.088 -15.617 -5.847 1.00 0.00 O ATOM 1073 CB ASP A 75 1.151 -16.554 -6.542 1.00 0.00 C ATOM 1074 CG ASP A 75 -0.043 -17.393 -6.130 1.00 0.00 C ATOM 1075 OD1 ASP A 75 0.041 -18.075 -5.088 1.00 0.00 O ATOM 1076 OD2 ASP A 75 -1.063 -17.366 -6.851 1.00 0.00 O ATOM 0 H ASP A 75 0.223 -14.325 -5.573 1.00 0.00 H new ATOM 0 HA ASP A 75 2.000 -16.451 -4.571 1.00 0.00 H new ATOM 0 HB2 ASP A 75 0.852 -15.864 -7.331 1.00 0.00 H new ATOM 0 HB3 ASP A 75 1.921 -17.203 -6.960 1.00 0.00 H new ATOM 1081 N ARG A 76 2.856 -13.761 -6.169 1.00 0.00 N ATOM 1082 CA ARG A 76 3.986 -12.956 -6.617 1.00 0.00 C ATOM 1083 C ARG A 76 3.983 -11.589 -5.938 1.00 0.00 C ATOM 1084 O ARG A 76 2.933 -11.002 -5.675 1.00 0.00 O ATOM 1085 CB ARG A 76 3.946 -12.783 -8.136 1.00 0.00 C ATOM 1086 CG ARG A 76 4.113 -14.085 -8.903 1.00 0.00 C ATOM 1087 CD ARG A 76 4.620 -13.839 -10.315 1.00 0.00 C ATOM 1088 NE ARG A 76 4.738 -15.079 -11.077 1.00 0.00 N ATOM 1089 CZ ARG A 76 4.913 -15.119 -12.394 1.00 0.00 C ATOM 1090 NH1 ARG A 76 4.990 -13.993 -13.090 1.00 0.00 N ATOM 1091 NH2 ARG A 76 5.012 -16.286 -13.016 1.00 0.00 N ATOM 0 H ARG A 76 1.965 -13.264 -6.150 1.00 0.00 H new ATOM 0 HA ARG A 76 4.903 -13.477 -6.342 1.00 0.00 H new ATOM 0 HB2 ARG A 76 2.997 -12.326 -8.416 1.00 0.00 H new ATOM 0 HB3 ARG A 76 4.734 -12.092 -8.435 1.00 0.00 H new ATOM 0 HG2 ARG A 76 4.810 -14.734 -8.373 1.00 0.00 H new ATOM 0 HG3 ARG A 76 3.158 -14.609 -8.944 1.00 0.00 H new ATOM 0 HD2 ARG A 76 3.941 -13.160 -10.831 1.00 0.00 H new ATOM 0 HD3 ARG A 76 5.591 -13.347 -10.271 1.00 0.00 H new ATOM 0 HE ARG A 76 4.683 -15.963 -10.571 1.00 0.00 H new ATOM 0 HH11 ARG A 76 4.915 -13.094 -12.615 1.00 0.00 H new ATOM 0 HH12 ARG A 76 5.124 -14.026 -14.101 1.00 0.00 H new ATOM 0 HH21 ARG A 76 4.954 -17.154 -12.484 1.00 0.00 H new ATOM 0 HH22 ARG A 76 5.146 -16.315 -14.027 1.00 0.00 H new ATOM 1105 N PRO A 77 5.185 -11.070 -5.647 1.00 0.00 N ATOM 1106 CA PRO A 77 5.347 -9.768 -4.995 1.00 0.00 C ATOM 1107 C PRO A 77 4.960 -8.610 -5.908 1.00 0.00 C ATOM 1108 O PRO A 77 4.629 -7.521 -5.440 1.00 0.00 O ATOM 1109 CB PRO A 77 6.843 -9.717 -4.672 1.00 0.00 C ATOM 1110 CG PRO A 77 7.477 -10.623 -5.670 1.00 0.00 C ATOM 1111 CD PRO A 77 6.478 -11.715 -5.932 1.00 0.00 C ATOM 0 HA PRO A 77 4.704 -9.667 -4.121 1.00 0.00 H new ATOM 0 HB2 PRO A 77 7.232 -8.702 -4.756 1.00 0.00 H new ATOM 0 HB3 PRO A 77 7.040 -10.051 -3.653 1.00 0.00 H new ATOM 0 HG2 PRO A 77 7.717 -10.086 -6.587 1.00 0.00 H new ATOM 0 HG3 PRO A 77 8.411 -11.033 -5.287 1.00 0.00 H new ATOM 0 HD2 PRO A 77 6.532 -12.070 -6.961 1.00 0.00 H new ATOM 0 HD3 PRO A 77 6.647 -12.578 -5.288 1.00 0.00 H new ATOM 1119 N VAL A 78 5.004 -8.853 -7.215 1.00 0.00 N ATOM 1120 CA VAL A 78 4.656 -7.830 -8.194 1.00 0.00 C ATOM 1121 C VAL A 78 3.697 -8.379 -9.244 1.00 0.00 C ATOM 1122 O VAL A 78 3.572 -9.592 -9.413 1.00 0.00 O ATOM 1123 CB VAL A 78 5.910 -7.278 -8.899 1.00 0.00 C ATOM 1124 CG1 VAL A 78 6.872 -6.680 -7.884 1.00 0.00 C ATOM 1125 CG2 VAL A 78 6.589 -8.371 -9.711 1.00 0.00 C ATOM 0 H VAL A 78 5.277 -9.749 -7.619 1.00 0.00 H new ATOM 0 HA VAL A 78 4.169 -7.022 -7.648 1.00 0.00 H new ATOM 0 HB VAL A 78 5.603 -6.487 -9.583 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.752 -6.295 -8.400 1.00 0.00 H new ATOM 0 HG12 VAL A 78 6.379 -5.867 -7.351 1.00 0.00 H new ATOM 0 HG13 VAL A 78 7.175 -7.449 -7.173 1.00 0.00 H new ATOM 0 HG21 VAL A 78 7.473 -7.964 -10.202 1.00 0.00 H new ATOM 0 HG22 VAL A 78 6.884 -9.185 -9.049 1.00 0.00 H new ATOM 0 HG23 VAL A 78 5.897 -8.748 -10.464 1.00 0.00 H new ATOM 1135 N GLY A 79 3.021 -7.477 -9.950 1.00 0.00 N ATOM 1136 CA GLY A 79 2.081 -7.891 -10.976 1.00 0.00 C ATOM 1137 C GLY A 79 0.682 -7.363 -10.727 1.00 0.00 C ATOM 1138 O GLY A 79 0.094 -7.617 -9.676 1.00 0.00 O ATOM 0 H GLY A 79 3.107 -6.468 -9.830 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.431 -7.541 -11.947 1.00 0.00 H new ATOM 0 HA3 GLY A 79 2.053 -8.980 -11.021 1.00 0.00 H new ATOM 1142 N MET A 80 0.148 -6.627 -11.695 1.00 0.00 N ATOM 1143 CA MET A 80 -1.191 -6.062 -11.575 1.00 0.00 C ATOM 1144 C MET A 80 -2.234 -7.164 -11.422 1.00 0.00 C ATOM 1145 O MET A 80 -3.124 -7.076 -10.576 1.00 0.00 O ATOM 1146 CB MET A 80 -1.517 -5.202 -12.798 1.00 0.00 C ATOM 1147 CG MET A 80 -1.110 -3.746 -12.642 1.00 0.00 C ATOM 1148 SD MET A 80 -2.390 -2.748 -11.856 1.00 0.00 S ATOM 1149 CE MET A 80 -1.742 -2.618 -10.191 1.00 0.00 C ATOM 0 H MET A 80 0.622 -6.408 -12.571 1.00 0.00 H new ATOM 0 HA MET A 80 -1.215 -5.436 -10.683 1.00 0.00 H new ATOM 0 HB2 MET A 80 -1.014 -5.620 -13.670 1.00 0.00 H new ATOM 0 HB3 MET A 80 -2.588 -5.253 -12.993 1.00 0.00 H new ATOM 0 HG2 MET A 80 -0.196 -3.689 -12.051 1.00 0.00 H new ATOM 0 HG3 MET A 80 -0.881 -3.330 -13.623 1.00 0.00 H new ATOM 0 HE1 MET A 80 -2.266 -1.825 -9.658 1.00 0.00 H new ATOM 0 HE2 MET A 80 -1.887 -3.564 -9.669 1.00 0.00 H new ATOM 0 HE3 MET A 80 -0.678 -2.386 -10.232 1.00 0.00 H new ATOM 1159 N ASP A 81 -2.119 -8.200 -12.245 1.00 0.00 N ATOM 1160 CA ASP A 81 -3.052 -9.320 -12.200 1.00 0.00 C ATOM 1161 C ASP A 81 -3.038 -9.984 -10.827 1.00 0.00 C ATOM 1162 O ASP A 81 -3.972 -10.698 -10.461 1.00 0.00 O ATOM 1163 CB ASP A 81 -2.703 -10.346 -13.280 1.00 0.00 C ATOM 1164 CG ASP A 81 -3.188 -9.927 -14.654 1.00 0.00 C ATOM 1165 OD1 ASP A 81 -3.238 -8.708 -14.920 1.00 0.00 O ATOM 1166 OD2 ASP A 81 -3.517 -10.818 -15.464 1.00 0.00 O ATOM 0 H ASP A 81 -1.389 -8.288 -12.952 1.00 0.00 H new ATOM 0 HA ASP A 81 -4.054 -8.934 -12.387 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -1.623 -10.488 -13.307 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -3.145 -11.308 -13.020 1.00 0.00 H new ATOM 1171 N THR A 82 -1.971 -9.746 -10.071 1.00 0.00 N ATOM 1172 CA THR A 82 -1.834 -10.323 -8.739 1.00 0.00 C ATOM 1173 C THR A 82 -2.463 -9.422 -7.683 1.00 0.00 C ATOM 1174 O THR A 82 -3.076 -9.902 -6.728 1.00 0.00 O ATOM 1175 CB THR A 82 -0.355 -10.560 -8.380 1.00 0.00 C ATOM 1176 OG1 THR A 82 0.168 -11.649 -9.149 1.00 0.00 O ATOM 1177 CG2 THR A 82 -0.200 -10.860 -6.897 1.00 0.00 C ATOM 0 H THR A 82 -1.189 -9.158 -10.358 1.00 0.00 H new ATOM 0 HA THR A 82 -2.355 -11.280 -8.753 1.00 0.00 H new ATOM 0 HB THR A 82 0.202 -9.652 -8.612 1.00 0.00 H new ATOM 0 HG1 THR A 82 0.872 -12.101 -8.639 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.853 -11.024 -6.667 1.00 0.00 H new ATOM 0 HG22 THR A 82 -0.572 -10.017 -6.314 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.770 -11.754 -6.645 1.00 0.00 H new ATOM 1185 N LEU A 83 -2.311 -8.114 -7.860 1.00 0.00 N ATOM 1186 CA LEU A 83 -2.866 -7.145 -6.921 1.00 0.00 C ATOM 1187 C LEU A 83 -4.389 -7.122 -7.000 1.00 0.00 C ATOM 1188 O LEU A 83 -5.075 -7.310 -5.996 1.00 0.00 O ATOM 1189 CB LEU A 83 -2.307 -5.751 -7.207 1.00 0.00 C ATOM 1190 CG LEU A 83 -2.420 -4.736 -6.069 1.00 0.00 C ATOM 1191 CD1 LEU A 83 -1.207 -4.821 -5.155 1.00 0.00 C ATOM 1192 CD2 LEU A 83 -2.574 -3.327 -6.624 1.00 0.00 C ATOM 0 H LEU A 83 -1.808 -7.700 -8.645 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.578 -7.445 -5.914 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -1.255 -5.851 -7.475 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -2.821 -5.347 -8.079 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.308 -4.973 -5.483 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -1.305 -4.091 -4.351 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -1.141 -5.823 -4.730 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -0.304 -4.610 -5.728 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -2.653 -2.618 -5.800 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -1.705 -3.079 -7.234 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -3.474 -3.273 -7.236 1.00 0.00 H new ATOM 1204 N ASN A 84 -4.911 -6.891 -8.200 1.00 0.00 N ATOM 1205 CA ASN A 84 -6.353 -6.845 -8.410 1.00 0.00 C ATOM 1206 C ASN A 84 -7.031 -8.069 -7.803 1.00 0.00 C ATOM 1207 O ASN A 84 -8.180 -8.003 -7.366 1.00 0.00 O ATOM 1208 CB ASN A 84 -6.669 -6.762 -9.905 1.00 0.00 C ATOM 1209 CG ASN A 84 -6.678 -5.334 -10.416 1.00 0.00 C ATOM 1210 OD1 ASN A 84 -7.734 -4.777 -10.718 1.00 0.00 O ATOM 1211 ND2 ASN A 84 -5.498 -4.733 -10.514 1.00 0.00 N ATOM 0 H ASN A 84 -4.357 -6.733 -9.042 1.00 0.00 H new ATOM 0 HA ASN A 84 -6.739 -5.955 -7.913 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -5.931 -7.340 -10.462 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -7.640 -7.219 -10.094 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -5.442 -3.772 -10.851 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -4.648 -5.233 -10.253 1.00 0.00 H new ATOM 1218 N SER A 85 -6.311 -9.186 -7.779 1.00 0.00 N ATOM 1219 CA SER A 85 -6.844 -10.427 -7.229 1.00 0.00 C ATOM 1220 C SER A 85 -7.198 -10.259 -5.754 1.00 0.00 C ATOM 1221 O SER A 85 -8.192 -10.807 -5.277 1.00 0.00 O ATOM 1222 CB SER A 85 -5.830 -11.560 -7.395 1.00 0.00 C ATOM 1223 OG SER A 85 -6.419 -12.818 -7.112 1.00 0.00 O ATOM 0 H SER A 85 -5.357 -9.257 -8.134 1.00 0.00 H new ATOM 0 HA SER A 85 -7.752 -10.678 -7.777 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.441 -11.558 -8.413 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.983 -11.394 -6.730 1.00 0.00 H new ATOM 0 HG SER A 85 -5.751 -13.525 -7.227 1.00 0.00 H new ATOM 1229 N ALA A 86 -6.378 -9.498 -5.038 1.00 0.00 N ATOM 1230 CA ALA A 86 -6.605 -9.255 -3.619 1.00 0.00 C ATOM 1231 C ALA A 86 -7.815 -8.352 -3.403 1.00 0.00 C ATOM 1232 O ALA A 86 -8.681 -8.646 -2.578 1.00 0.00 O ATOM 1233 CB ALA A 86 -5.366 -8.641 -2.983 1.00 0.00 C ATOM 0 H ALA A 86 -5.550 -9.039 -5.417 1.00 0.00 H new ATOM 0 HA ALA A 86 -6.809 -10.213 -3.140 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -5.550 -8.465 -1.923 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -4.523 -9.323 -3.096 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -5.136 -7.695 -3.473 1.00 0.00 H new ATOM 1239 N ILE A 87 -7.868 -7.253 -4.148 1.00 0.00 N ATOM 1240 CA ILE A 87 -8.972 -6.308 -4.037 1.00 0.00 C ATOM 1241 C ILE A 87 -10.316 -7.012 -4.194 1.00 0.00 C ATOM 1242 O ILE A 87 -11.175 -6.931 -3.317 1.00 0.00 O ATOM 1243 CB ILE A 87 -8.865 -5.191 -5.092 1.00 0.00 C ATOM 1244 CG1 ILE A 87 -7.582 -4.384 -4.884 1.00 0.00 C ATOM 1245 CG2 ILE A 87 -10.084 -4.284 -5.028 1.00 0.00 C ATOM 1246 CD1 ILE A 87 -7.208 -3.526 -6.072 1.00 0.00 C ATOM 0 H ILE A 87 -7.159 -6.995 -4.835 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.910 -5.865 -3.043 1.00 0.00 H new ATOM 0 HB ILE A 87 -8.828 -5.648 -6.081 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.702 -3.746 -4.009 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.762 -5.069 -4.669 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -9.994 -3.500 -5.779 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -10.983 -4.869 -5.220 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -10.150 -3.832 -4.038 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.289 -2.983 -5.853 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -7.056 -4.160 -6.945 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -8.010 -2.816 -6.275 1.00 0.00 H new ATOM 1258 N GLU A 88 -10.488 -7.704 -5.315 1.00 0.00 N ATOM 1259 CA GLU A 88 -11.728 -8.424 -5.585 1.00 0.00 C ATOM 1260 C GLU A 88 -11.994 -9.472 -4.509 1.00 0.00 C ATOM 1261 O GLU A 88 -13.143 -9.750 -4.169 1.00 0.00 O ATOM 1262 CB GLU A 88 -11.666 -9.092 -6.960 1.00 0.00 C ATOM 1263 CG GLU A 88 -11.544 -8.108 -8.111 1.00 0.00 C ATOM 1264 CD GLU A 88 -11.188 -8.783 -9.421 1.00 0.00 C ATOM 1265 OE1 GLU A 88 -9.987 -9.039 -9.651 1.00 0.00 O ATOM 1266 OE2 GLU A 88 -12.111 -9.056 -10.217 1.00 0.00 O ATOM 0 H GLU A 88 -9.786 -7.782 -6.051 1.00 0.00 H new ATOM 0 HA GLU A 88 -12.546 -7.704 -5.576 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -10.816 -9.774 -6.985 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -12.563 -9.695 -7.102 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -12.486 -7.572 -8.227 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -10.783 -7.366 -7.870 1.00 0.00 H new ATOM 1273 N ASN A 89 -10.922 -10.051 -3.978 1.00 0.00 N ATOM 1274 CA ASN A 89 -11.039 -11.070 -2.941 1.00 0.00 C ATOM 1275 C ASN A 89 -11.735 -10.511 -1.704 1.00 0.00 C ATOM 1276 O ASN A 89 -12.875 -10.867 -1.405 1.00 0.00 O ATOM 1277 CB ASN A 89 -9.655 -11.604 -2.564 1.00 0.00 C ATOM 1278 CG ASN A 89 -9.262 -12.819 -3.381 1.00 0.00 C ATOM 1279 OD1 ASN A 89 -10.052 -13.748 -3.553 1.00 0.00 O ATOM 1280 ND2 ASN A 89 -8.035 -12.819 -3.889 1.00 0.00 N ATOM 0 H ASN A 89 -9.963 -9.832 -4.248 1.00 0.00 H new ATOM 0 HA ASN A 89 -11.642 -11.888 -3.336 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -8.914 -10.818 -2.708 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -9.644 -11.863 -1.505 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -7.714 -13.610 -4.447 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -7.414 -12.028 -3.721 1.00 0.00 H new ATOM 1287 N LEU A 90 -11.041 -9.632 -0.988 1.00 0.00 N ATOM 1288 CA LEU A 90 -11.592 -9.022 0.217 1.00 0.00 C ATOM 1289 C LEU A 90 -12.903 -8.304 -0.087 1.00 0.00 C ATOM 1290 O LEU A 90 -13.799 -8.243 0.755 1.00 0.00 O ATOM 1291 CB LEU A 90 -10.587 -8.038 0.819 1.00 0.00 C ATOM 1292 CG LEU A 90 -9.408 -8.659 1.569 1.00 0.00 C ATOM 1293 CD1 LEU A 90 -9.900 -9.484 2.748 1.00 0.00 C ATOM 1294 CD2 LEU A 90 -8.570 -9.514 0.631 1.00 0.00 C ATOM 0 H LEU A 90 -10.096 -9.326 -1.221 1.00 0.00 H new ATOM 0 HA LEU A 90 -11.792 -9.815 0.937 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -10.194 -7.415 0.016 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -11.120 -7.378 1.503 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.781 -7.854 1.952 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -9.047 -9.918 3.270 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -10.457 -8.844 3.433 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -10.549 -10.282 2.388 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.736 -9.948 1.182 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -9.186 -10.312 0.218 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -8.187 -8.895 -0.180 1.00 0.00 H new ATOM 1306 N MET A 91 -13.010 -7.764 -1.297 1.00 0.00 N ATOM 1307 CA MET A 91 -14.213 -7.054 -1.713 1.00 0.00 C ATOM 1308 C MET A 91 -15.430 -7.973 -1.670 1.00 0.00 C ATOM 1309 O MET A 91 -16.546 -7.532 -1.394 1.00 0.00 O ATOM 1310 CB MET A 91 -14.036 -6.489 -3.124 1.00 0.00 C ATOM 1311 CG MET A 91 -13.182 -5.233 -3.173 1.00 0.00 C ATOM 1312 SD MET A 91 -14.135 -3.732 -2.873 1.00 0.00 S ATOM 1313 CE MET A 91 -15.118 -3.651 -4.369 1.00 0.00 C ATOM 0 H MET A 91 -12.278 -7.805 -2.006 1.00 0.00 H new ATOM 0 HA MET A 91 -14.377 -6.231 -1.018 1.00 0.00 H new ATOM 0 HB2 MET A 91 -13.583 -7.251 -3.758 1.00 0.00 H new ATOM 0 HB3 MET A 91 -15.017 -6.268 -3.544 1.00 0.00 H new ATOM 0 HG2 MET A 91 -12.388 -5.309 -2.430 1.00 0.00 H new ATOM 0 HG3 MET A 91 -12.700 -5.164 -4.148 1.00 0.00 H new ATOM 0 HE1 MET A 91 -15.425 -2.620 -4.547 1.00 0.00 H new ATOM 0 HE2 MET A 91 -14.526 -4.005 -5.213 1.00 0.00 H new ATOM 0 HE3 MET A 91 -16.002 -4.279 -4.258 1.00 0.00 H new ATOM 1323 N THR A 92 -15.207 -9.255 -1.945 1.00 0.00 N ATOM 1324 CA THR A 92 -16.285 -10.236 -1.939 1.00 0.00 C ATOM 1325 C THR A 92 -16.488 -10.821 -0.546 1.00 0.00 C ATOM 1326 O THR A 92 -17.620 -11.023 -0.106 1.00 0.00 O ATOM 1327 CB THR A 92 -16.007 -11.382 -2.929 1.00 0.00 C ATOM 1328 OG1 THR A 92 -14.624 -11.752 -2.875 1.00 0.00 O ATOM 1329 CG2 THR A 92 -16.371 -10.972 -4.348 1.00 0.00 C ATOM 0 H THR A 92 -14.290 -9.638 -2.175 1.00 0.00 H new ATOM 0 HA THR A 92 -17.190 -9.712 -2.246 1.00 0.00 H new ATOM 0 HB THR A 92 -16.623 -12.235 -2.644 1.00 0.00 H new ATOM 0 HG1 THR A 92 -14.305 -11.691 -1.950 1.00 0.00 H new ATOM 0 HG21 THR A 92 -16.166 -11.798 -5.029 1.00 0.00 H new ATOM 0 HG22 THR A 92 -17.430 -10.719 -4.393 1.00 0.00 H new ATOM 0 HG23 THR A 92 -15.778 -10.105 -4.640 1.00 0.00 H new ATOM 1337 N SER A 93 -15.384 -11.091 0.144 1.00 0.00 N ATOM 1338 CA SER A 93 -15.442 -11.656 1.487 1.00 0.00 C ATOM 1339 C SER A 93 -16.210 -10.737 2.431 1.00 0.00 C ATOM 1340 O SER A 93 -17.125 -11.171 3.131 1.00 0.00 O ATOM 1341 CB SER A 93 -14.029 -11.893 2.025 1.00 0.00 C ATOM 1342 OG SER A 93 -13.303 -12.772 1.183 1.00 0.00 O ATOM 0 H SER A 93 -14.439 -10.928 -0.205 1.00 0.00 H new ATOM 0 HA SER A 93 -15.967 -12.610 1.430 1.00 0.00 H new ATOM 0 HB2 SER A 93 -13.502 -10.942 2.104 1.00 0.00 H new ATOM 0 HB3 SER A 93 -14.085 -12.311 3.030 1.00 0.00 H new ATOM 0 HG SER A 93 -13.098 -12.321 0.338 1.00 0.00 H new ATOM 1348 N SER A 94 -15.831 -9.463 2.445 1.00 0.00 N ATOM 1349 CA SER A 94 -16.480 -8.481 3.306 1.00 0.00 C ATOM 1350 C SER A 94 -17.089 -7.353 2.479 1.00 0.00 C ATOM 1351 O SER A 94 -16.842 -7.244 1.278 1.00 0.00 O ATOM 1352 CB SER A 94 -15.478 -7.909 4.310 1.00 0.00 C ATOM 1353 OG SER A 94 -14.996 -8.918 5.180 1.00 0.00 O ATOM 0 H SER A 94 -15.078 -9.087 1.870 1.00 0.00 H new ATOM 0 HA SER A 94 -17.280 -8.983 3.849 1.00 0.00 H new ATOM 0 HB2 SER A 94 -14.643 -7.455 3.777 1.00 0.00 H new ATOM 0 HB3 SER A 94 -15.952 -7.119 4.892 1.00 0.00 H new ATOM 0 HG SER A 94 -14.356 -8.527 5.811 1.00 0.00 H new ATOM 1359 N SER A 95 -17.888 -6.514 3.132 1.00 0.00 N ATOM 1360 CA SER A 95 -18.537 -5.395 2.457 1.00 0.00 C ATOM 1361 C SER A 95 -17.863 -4.076 2.823 1.00 0.00 C ATOM 1362 O SER A 95 -16.914 -4.046 3.607 1.00 0.00 O ATOM 1363 CB SER A 95 -20.021 -5.342 2.824 1.00 0.00 C ATOM 1364 OG SER A 95 -20.745 -6.372 2.173 1.00 0.00 O ATOM 0 H SER A 95 -18.101 -6.588 4.127 1.00 0.00 H new ATOM 0 HA SER A 95 -18.442 -5.546 1.382 1.00 0.00 H new ATOM 0 HB2 SER A 95 -20.135 -5.439 3.904 1.00 0.00 H new ATOM 0 HB3 SER A 95 -20.433 -4.372 2.546 1.00 0.00 H new ATOM 0 HG SER A 95 -21.690 -6.317 2.426 1.00 0.00 H new ATOM 1370 N LYS A 96 -18.362 -2.986 2.251 1.00 0.00 N ATOM 1371 CA LYS A 96 -17.811 -1.662 2.516 1.00 0.00 C ATOM 1372 C LYS A 96 -18.049 -1.254 3.966 1.00 0.00 C ATOM 1373 O LYS A 96 -17.206 -0.604 4.583 1.00 0.00 O ATOM 1374 CB LYS A 96 -18.437 -0.629 1.575 1.00 0.00 C ATOM 1375 CG LYS A 96 -18.000 0.797 1.861 1.00 0.00 C ATOM 1376 CD LYS A 96 -16.764 1.172 1.061 1.00 0.00 C ATOM 1377 CE LYS A 96 -16.687 2.672 0.825 1.00 0.00 C ATOM 1378 NZ LYS A 96 -16.547 3.429 2.100 1.00 0.00 N ATOM 0 H LYS A 96 -19.148 -2.993 1.600 1.00 0.00 H new ATOM 0 HA LYS A 96 -16.736 -1.701 2.340 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -18.176 -0.881 0.547 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -19.523 -0.690 1.652 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -18.812 1.483 1.620 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -17.793 0.909 2.925 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -15.871 0.840 1.591 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -16.778 0.652 0.103 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -15.840 2.894 0.176 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -17.584 3.004 0.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -16.617 4.449 1.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -17.304 3.147 2.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -15.622 3.220 2.528 1.00 0.00 H new ATOM 1392 N GLU A 97 -19.201 -1.643 4.504 1.00 0.00 N ATOM 1393 CA GLU A 97 -19.547 -1.317 5.883 1.00 0.00 C ATOM 1394 C GLU A 97 -18.741 -2.166 6.861 1.00 0.00 C ATOM 1395 O GLU A 97 -18.600 -1.816 8.033 1.00 0.00 O ATOM 1396 CB GLU A 97 -21.044 -1.530 6.120 1.00 0.00 C ATOM 1397 CG GLU A 97 -21.515 -2.941 5.810 1.00 0.00 C ATOM 1398 CD GLU A 97 -22.943 -3.190 6.254 1.00 0.00 C ATOM 1399 OE1 GLU A 97 -23.871 -2.765 5.536 1.00 0.00 O ATOM 1400 OE2 GLU A 97 -23.132 -3.812 7.321 1.00 0.00 O ATOM 0 H GLU A 97 -19.909 -2.183 4.007 1.00 0.00 H new ATOM 0 HA GLU A 97 -19.305 -0.268 6.054 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -21.275 -1.299 7.160 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -21.604 -0.826 5.505 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -21.436 -3.119 4.738 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -20.856 -3.656 6.302 1.00 0.00 H new ATOM 1407 N ASP A 98 -18.214 -3.283 6.372 1.00 0.00 N ATOM 1408 CA ASP A 98 -17.421 -4.182 7.202 1.00 0.00 C ATOM 1409 C ASP A 98 -16.013 -3.632 7.408 1.00 0.00 C ATOM 1410 O ASP A 98 -15.379 -3.890 8.431 1.00 0.00 O ATOM 1411 CB ASP A 98 -17.351 -5.571 6.564 1.00 0.00 C ATOM 1412 CG ASP A 98 -16.360 -6.480 7.264 1.00 0.00 C ATOM 1413 OD1 ASP A 98 -15.178 -6.094 7.377 1.00 0.00 O ATOM 1414 OD2 ASP A 98 -16.767 -7.579 7.698 1.00 0.00 O ATOM 0 H ASP A 98 -18.322 -3.588 5.405 1.00 0.00 H new ATOM 0 HA ASP A 98 -17.906 -4.261 8.175 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -18.340 -6.029 6.588 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -17.071 -5.472 5.515 1.00 0.00 H new ATOM 1419 N TRP A 99 -15.531 -2.875 6.429 1.00 0.00 N ATOM 1420 CA TRP A 99 -14.197 -2.289 6.503 1.00 0.00 C ATOM 1421 C TRP A 99 -14.137 -1.205 7.573 1.00 0.00 C ATOM 1422 O TRP A 99 -14.743 -0.141 7.447 1.00 0.00 O ATOM 1423 CB TRP A 99 -13.798 -1.706 5.146 1.00 0.00 C ATOM 1424 CG TRP A 99 -14.072 -2.631 3.999 1.00 0.00 C ATOM 1425 CD1 TRP A 99 -14.076 -3.996 4.029 1.00 0.00 C ATOM 1426 CD2 TRP A 99 -14.380 -2.256 2.652 1.00 0.00 C ATOM 1427 NE1 TRP A 99 -14.368 -4.493 2.782 1.00 0.00 N ATOM 1428 CE2 TRP A 99 -14.560 -3.446 1.920 1.00 0.00 C ATOM 1429 CE3 TRP A 99 -14.524 -1.032 1.993 1.00 0.00 C ATOM 1430 CZ2 TRP A 99 -14.874 -3.445 0.563 1.00 0.00 C ATOM 1431 CZ3 TRP A 99 -14.835 -1.033 0.647 1.00 0.00 C ATOM 1432 CH2 TRP A 99 -15.008 -2.232 -0.056 1.00 0.00 C ATOM 0 H TRP A 99 -16.043 -2.653 5.575 1.00 0.00 H new ATOM 0 HA TRP A 99 -13.495 -3.078 6.772 1.00 0.00 H new ATOM 0 HB2 TRP A 99 -14.337 -0.772 4.987 1.00 0.00 H new ATOM 0 HB3 TRP A 99 -12.736 -1.462 5.161 1.00 0.00 H new ATOM 0 HD1 TRP A 99 -13.879 -4.597 4.904 1.00 0.00 H new ATOM 0 HE1 TRP A 99 -14.432 -5.481 2.538 1.00 0.00 H new ATOM 0 HE3 TRP A 99 -14.394 -0.102 2.526 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 -15.007 -4.368 0.019 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 -14.947 -0.093 0.128 1.00 0.00 H new ATOM 0 HH2 TRP A 99 -15.252 -2.199 -1.108 1.00 0.00 H new ATOM 1443 N PRO A 100 -13.389 -1.478 8.653 1.00 0.00 N ATOM 1444 CA PRO A 100 -13.232 -0.537 9.766 1.00 0.00 C ATOM 1445 C PRO A 100 -12.405 0.684 9.380 1.00 0.00 C ATOM 1446 O PRO A 100 -11.394 0.567 8.688 1.00 0.00 O ATOM 1447 CB PRO A 100 -12.504 -1.363 10.829 1.00 0.00 C ATOM 1448 CG PRO A 100 -11.776 -2.412 10.061 1.00 0.00 C ATOM 1449 CD PRO A 100 -12.639 -2.726 8.870 1.00 0.00 C ATOM 0 HA PRO A 100 -14.189 -0.137 10.100 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -11.816 -0.746 11.407 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -13.206 -1.805 11.536 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -10.794 -2.056 9.749 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -11.614 -3.301 10.671 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -12.040 -2.991 7.999 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -13.305 -3.566 9.067 1.00 0.00 H new ATOM 1457 N SER A 101 -12.840 1.856 9.833 1.00 0.00 N ATOM 1458 CA SER A 101 -12.140 3.099 9.532 1.00 0.00 C ATOM 1459 C SER A 101 -10.776 3.133 10.215 1.00 0.00 C ATOM 1460 O SER A 101 -10.668 2.929 11.424 1.00 0.00 O ATOM 1461 CB SER A 101 -12.976 4.300 9.978 1.00 0.00 C ATOM 1462 OG SER A 101 -13.967 4.617 9.016 1.00 0.00 O ATOM 0 H SER A 101 -13.674 1.970 10.410 1.00 0.00 H new ATOM 0 HA SER A 101 -11.989 3.151 8.454 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.450 4.082 10.935 1.00 0.00 H new ATOM 0 HB3 SER A 101 -12.327 5.162 10.133 1.00 0.00 H new ATOM 0 HG SER A 101 -14.489 5.387 9.325 1.00 0.00 H new ATOM 1468 N VAL A 102 -9.735 3.394 9.430 1.00 0.00 N ATOM 1469 CA VAL A 102 -8.377 3.456 9.956 1.00 0.00 C ATOM 1470 C VAL A 102 -7.627 4.662 9.401 1.00 0.00 C ATOM 1471 O VAL A 102 -7.874 5.095 8.277 1.00 0.00 O ATOM 1472 CB VAL A 102 -7.586 2.177 9.624 1.00 0.00 C ATOM 1473 CG1 VAL A 102 -8.189 0.976 10.338 1.00 0.00 C ATOM 1474 CG2 VAL A 102 -7.548 1.950 8.121 1.00 0.00 C ATOM 0 H VAL A 102 -9.807 3.566 8.427 1.00 0.00 H new ATOM 0 HA VAL A 102 -8.462 3.551 11.039 1.00 0.00 H new ATOM 0 HB VAL A 102 -6.562 2.302 9.976 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -7.617 0.081 10.092 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -8.159 1.140 11.415 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -9.223 0.845 10.019 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -6.985 1.042 7.904 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -8.565 1.845 7.743 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -7.067 2.800 7.637 1.00 0.00 H new ATOM 1484 N ASN A 103 -6.709 5.199 10.198 1.00 0.00 N ATOM 1485 CA ASN A 103 -5.922 6.356 9.786 1.00 0.00 C ATOM 1486 C ASN A 103 -4.570 5.923 9.227 1.00 0.00 C ATOM 1487 O ASN A 103 -3.777 5.286 9.919 1.00 0.00 O ATOM 1488 CB ASN A 103 -5.718 7.307 10.967 1.00 0.00 C ATOM 1489 CG ASN A 103 -6.929 8.185 11.218 1.00 0.00 C ATOM 1490 OD1 ASN A 103 -7.434 8.841 10.306 1.00 0.00 O ATOM 1491 ND2 ASN A 103 -7.400 8.202 12.459 1.00 0.00 N ATOM 0 H ASN A 103 -6.492 4.852 11.132 1.00 0.00 H new ATOM 0 HA ASN A 103 -6.470 6.876 9.000 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -5.501 6.727 11.864 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -4.849 7.937 10.777 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -8.212 8.775 12.688 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -6.950 7.642 13.183 1.00 0.00 H new ATOM 1498 N MET A 104 -4.314 6.275 7.972 1.00 0.00 N ATOM 1499 CA MET A 104 -3.057 5.925 7.321 1.00 0.00 C ATOM 1500 C MET A 104 -2.009 7.010 7.544 1.00 0.00 C ATOM 1501 O MET A 104 -2.288 8.198 7.386 1.00 0.00 O ATOM 1502 CB MET A 104 -3.276 5.711 5.822 1.00 0.00 C ATOM 1503 CG MET A 104 -2.063 5.140 5.106 1.00 0.00 C ATOM 1504 SD MET A 104 -2.454 4.536 3.452 1.00 0.00 S ATOM 1505 CE MET A 104 -3.443 3.095 3.843 1.00 0.00 C ATOM 0 H MET A 104 -4.960 6.803 7.385 1.00 0.00 H new ATOM 0 HA MET A 104 -2.694 4.997 7.763 1.00 0.00 H new ATOM 0 HB2 MET A 104 -4.122 5.039 5.679 1.00 0.00 H new ATOM 0 HB3 MET A 104 -3.544 6.663 5.363 1.00 0.00 H new ATOM 0 HG2 MET A 104 -1.293 5.908 5.036 1.00 0.00 H new ATOM 0 HG3 MET A 104 -1.647 4.324 5.698 1.00 0.00 H new ATOM 0 HE1 MET A 104 -4.336 3.086 3.218 1.00 0.00 H new ATOM 0 HE2 MET A 104 -2.861 2.193 3.657 1.00 0.00 H new ATOM 0 HE3 MET A 104 -3.735 3.128 4.893 1.00 0.00 H new ATOM 1515 N ASN A 105 -0.801 6.594 7.913 1.00 0.00 N ATOM 1516 CA ASN A 105 0.289 7.531 8.158 1.00 0.00 C ATOM 1517 C ASN A 105 1.384 7.379 7.107 1.00 0.00 C ATOM 1518 O ASN A 105 1.733 6.265 6.716 1.00 0.00 O ATOM 1519 CB ASN A 105 0.873 7.312 9.555 1.00 0.00 C ATOM 1520 CG ASN A 105 -0.065 7.776 10.653 1.00 0.00 C ATOM 1521 OD1 ASN A 105 -1.209 8.146 10.392 1.00 0.00 O ATOM 1522 ND2 ASN A 105 0.419 7.760 11.890 1.00 0.00 N ATOM 0 H ASN A 105 -0.553 5.614 8.049 1.00 0.00 H new ATOM 0 HA ASN A 105 -0.113 8.542 8.094 1.00 0.00 H new ATOM 0 HB2 ASN A 105 1.093 6.253 9.692 1.00 0.00 H new ATOM 0 HB3 ASN A 105 1.819 7.847 9.639 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -0.165 8.063 12.670 1.00 0.00 H new ATOM 0 HD22 ASN A 105 1.374 7.445 12.060 1.00 0.00 H new ATOM 1529 N VAL A 106 1.923 8.506 6.655 1.00 0.00 N ATOM 1530 CA VAL A 106 2.980 8.499 5.650 1.00 0.00 C ATOM 1531 C VAL A 106 4.164 9.351 6.093 1.00 0.00 C ATOM 1532 O VAL A 106 4.709 10.129 5.311 1.00 0.00 O ATOM 1533 CB VAL A 106 2.468 9.017 4.293 1.00 0.00 C ATOM 1534 CG1 VAL A 106 3.473 8.714 3.192 1.00 0.00 C ATOM 1535 CG2 VAL A 106 1.111 8.410 3.969 1.00 0.00 C ATOM 0 H VAL A 106 1.645 9.436 6.969 1.00 0.00 H new ATOM 0 HA VAL A 106 3.303 7.464 5.537 1.00 0.00 H new ATOM 0 HB VAL A 106 2.351 10.099 4.357 1.00 0.00 H new ATOM 0 HG11 VAL A 106 3.094 9.087 2.241 1.00 0.00 H new ATOM 0 HG12 VAL A 106 4.421 9.200 3.421 1.00 0.00 H new ATOM 0 HG13 VAL A 106 3.625 7.637 3.124 1.00 0.00 H new ATOM 0 HG21 VAL A 106 0.764 8.787 3.007 1.00 0.00 H new ATOM 0 HG22 VAL A 106 1.200 7.325 3.923 1.00 0.00 H new ATOM 0 HG23 VAL A 106 0.396 8.683 4.745 1.00 0.00 H new ATOM 1545 N ALA A 107 4.558 9.198 7.353 1.00 0.00 N ATOM 1546 CA ALA A 107 5.679 9.952 7.900 1.00 0.00 C ATOM 1547 C ALA A 107 6.993 9.204 7.699 1.00 0.00 C ATOM 1548 O ALA A 107 7.024 7.973 7.700 1.00 0.00 O ATOM 1549 CB ALA A 107 5.453 10.238 9.377 1.00 0.00 C ATOM 0 H ALA A 107 4.117 8.558 8.014 1.00 0.00 H new ATOM 0 HA ALA A 107 5.744 10.899 7.364 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.298 10.802 9.772 1.00 0.00 H new ATOM 0 HB2 ALA A 107 4.540 10.820 9.499 1.00 0.00 H new ATOM 0 HB3 ALA A 107 5.359 9.297 9.920 1.00 0.00 H new ATOM 1555 N ASP A 108 8.076 9.954 7.528 1.00 0.00 N ATOM 1556 CA ASP A 108 9.393 9.362 7.326 1.00 0.00 C ATOM 1557 C ASP A 108 9.346 8.287 6.245 1.00 0.00 C ATOM 1558 O ASP A 108 9.987 7.244 6.364 1.00 0.00 O ATOM 1559 CB ASP A 108 9.912 8.763 8.635 1.00 0.00 C ATOM 1560 CG ASP A 108 11.425 8.799 8.728 1.00 0.00 C ATOM 1561 OD1 ASP A 108 11.977 9.882 9.016 1.00 0.00 O ATOM 1562 OD2 ASP A 108 12.057 7.744 8.512 1.00 0.00 O ATOM 0 H ASP A 108 8.068 10.974 7.525 1.00 0.00 H new ATOM 0 HA ASP A 108 10.072 10.150 7.000 1.00 0.00 H new ATOM 0 HB2 ASP A 108 9.486 9.310 9.476 1.00 0.00 H new ATOM 0 HB3 ASP A 108 9.570 7.732 8.720 1.00 0.00 H new ATOM 1567 N ALA A 109 8.581 8.550 5.190 1.00 0.00 N ATOM 1568 CA ALA A 109 8.451 7.607 4.087 1.00 0.00 C ATOM 1569 C ALA A 109 8.057 6.223 4.591 1.00 0.00 C ATOM 1570 O ALA A 109 8.416 5.207 3.995 1.00 0.00 O ATOM 1571 CB ALA A 109 9.751 7.533 3.299 1.00 0.00 C ATOM 0 H ALA A 109 8.042 9.409 5.077 1.00 0.00 H new ATOM 0 HA ALA A 109 7.659 7.964 3.428 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.639 6.825 2.478 1.00 0.00 H new ATOM 0 HB2 ALA A 109 9.990 8.518 2.898 1.00 0.00 H new ATOM 0 HB3 ALA A 109 10.556 7.203 3.956 1.00 0.00 H new ATOM 1577 N THR A 110 7.316 6.189 5.695 1.00 0.00 N ATOM 1578 CA THR A 110 6.875 4.930 6.281 1.00 0.00 C ATOM 1579 C THR A 110 5.354 4.828 6.284 1.00 0.00 C ATOM 1580 O THR A 110 4.655 5.818 6.503 1.00 0.00 O ATOM 1581 CB THR A 110 7.391 4.770 7.724 1.00 0.00 C ATOM 1582 OG1 THR A 110 8.809 4.969 7.761 1.00 0.00 O ATOM 1583 CG2 THR A 110 7.053 3.392 8.270 1.00 0.00 C ATOM 0 H THR A 110 7.009 7.020 6.201 1.00 0.00 H new ATOM 0 HA THR A 110 7.289 4.133 5.664 1.00 0.00 H new ATOM 0 HB THR A 110 6.902 5.519 8.347 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.030 5.827 7.342 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.427 3.303 9.290 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.972 3.255 8.267 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.517 2.629 7.645 1.00 0.00 H new ATOM 1591 N VAL A 111 4.846 3.624 6.040 1.00 0.00 N ATOM 1592 CA VAL A 111 3.406 3.392 6.016 1.00 0.00 C ATOM 1593 C VAL A 111 2.950 2.639 7.260 1.00 0.00 C ATOM 1594 O VAL A 111 3.307 1.478 7.463 1.00 0.00 O ATOM 1595 CB VAL A 111 2.987 2.597 4.765 1.00 0.00 C ATOM 1596 CG1 VAL A 111 1.475 2.437 4.717 1.00 0.00 C ATOM 1597 CG2 VAL A 111 3.500 3.277 3.505 1.00 0.00 C ATOM 0 H VAL A 111 5.410 2.794 5.856 1.00 0.00 H new ATOM 0 HA VAL A 111 2.928 4.371 5.992 1.00 0.00 H new ATOM 0 HB VAL A 111 3.432 1.604 4.820 1.00 0.00 H new ATOM 0 HG11 VAL A 111 1.197 1.873 3.827 1.00 0.00 H new ATOM 0 HG12 VAL A 111 1.137 1.903 5.605 1.00 0.00 H new ATOM 0 HG13 VAL A 111 1.006 3.420 4.685 1.00 0.00 H new ATOM 0 HG21 VAL A 111 3.195 2.702 2.631 1.00 0.00 H new ATOM 0 HG22 VAL A 111 3.086 4.283 3.440 1.00 0.00 H new ATOM 0 HG23 VAL A 111 4.588 3.334 3.540 1.00 0.00 H new ATOM 1607 N THR A 112 2.158 3.307 8.093 1.00 0.00 N ATOM 1608 CA THR A 112 1.653 2.701 9.319 1.00 0.00 C ATOM 1609 C THR A 112 0.139 2.843 9.419 1.00 0.00 C ATOM 1610 O THR A 112 -0.390 3.955 9.449 1.00 0.00 O ATOM 1611 CB THR A 112 2.300 3.333 10.566 1.00 0.00 C ATOM 1612 OG1 THR A 112 3.715 3.118 10.546 1.00 0.00 O ATOM 1613 CG2 THR A 112 1.710 2.745 11.838 1.00 0.00 C ATOM 0 H THR A 112 1.852 4.268 7.941 1.00 0.00 H new ATOM 0 HA THR A 112 1.914 1.644 9.280 1.00 0.00 H new ATOM 0 HB THR A 112 2.096 4.404 10.551 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.119 3.524 11.341 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.182 3.206 12.705 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.637 2.937 11.864 1.00 0.00 H new ATOM 0 HG23 THR A 112 1.887 1.670 11.858 1.00 0.00 H new ATOM 1621 N VAL A 113 -0.555 1.711 9.470 1.00 0.00 N ATOM 1622 CA VAL A 113 -2.010 1.710 9.569 1.00 0.00 C ATOM 1623 C VAL A 113 -2.463 1.891 11.013 1.00 0.00 C ATOM 1624 O VAL A 113 -2.476 0.939 11.795 1.00 0.00 O ATOM 1625 CB VAL A 113 -2.609 0.403 9.015 1.00 0.00 C ATOM 1626 CG1 VAL A 113 -4.129 0.449 9.063 1.00 0.00 C ATOM 1627 CG2 VAL A 113 -2.120 0.153 7.597 1.00 0.00 C ATOM 0 H VAL A 113 -0.133 0.783 9.444 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.368 2.548 8.971 1.00 0.00 H new ATOM 0 HB VAL A 113 -2.275 -0.424 9.642 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -4.534 -0.483 8.668 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -4.457 0.578 10.095 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -4.487 1.284 8.461 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -2.553 -0.774 7.221 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -2.423 0.981 6.956 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.033 0.073 7.596 1.00 0.00 H new ATOM 1637 N ILE A 114 -2.835 3.118 11.361 1.00 0.00 N ATOM 1638 CA ILE A 114 -3.291 3.424 12.711 1.00 0.00 C ATOM 1639 C ILE A 114 -4.801 3.251 12.835 1.00 0.00 C ATOM 1640 O ILE A 114 -5.537 3.428 11.865 1.00 0.00 O ATOM 1641 CB ILE A 114 -2.915 4.861 13.120 1.00 0.00 C ATOM 1642 CG1 ILE A 114 -1.454 5.150 12.768 1.00 0.00 C ATOM 1643 CG2 ILE A 114 -3.158 5.068 14.608 1.00 0.00 C ATOM 1644 CD1 ILE A 114 -0.465 4.377 13.612 1.00 0.00 C ATOM 0 H ILE A 114 -2.830 3.917 10.726 1.00 0.00 H new ATOM 0 HA ILE A 114 -2.792 2.722 13.379 1.00 0.00 H new ATOM 0 HB ILE A 114 -3.546 5.557 12.568 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -1.288 4.911 11.718 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -1.264 6.217 12.886 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -2.888 6.088 14.882 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -4.211 4.899 14.832 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -2.549 4.366 15.177 1.00 0.00 H new ATOM 0 HD11 ILE A 114 0.550 4.631 13.307 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -0.604 4.634 14.662 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -0.628 3.308 13.475 1.00 0.00 H new ATOM 1656 N SER A 115 -5.255 2.905 14.035 1.00 0.00 N ATOM 1657 CA SER A 115 -6.678 2.705 14.285 1.00 0.00 C ATOM 1658 C SER A 115 -7.379 4.039 14.525 1.00 0.00 C ATOM 1659 O SER A 115 -6.995 4.804 15.408 1.00 0.00 O ATOM 1660 CB SER A 115 -6.881 1.786 15.491 1.00 0.00 C ATOM 1661 OG SER A 115 -8.087 1.051 15.375 1.00 0.00 O ATOM 0 H SER A 115 -4.659 2.757 14.849 1.00 0.00 H new ATOM 0 HA SER A 115 -7.115 2.237 13.403 1.00 0.00 H new ATOM 0 HB2 SER A 115 -6.039 1.099 15.574 1.00 0.00 H new ATOM 0 HB3 SER A 115 -6.900 2.379 16.405 1.00 0.00 H new ATOM 0 HG SER A 115 -8.087 0.318 16.025 1.00 0.00 H new ATOM 1667 N GLU A 116 -8.410 4.309 13.730 1.00 0.00 N ATOM 1668 CA GLU A 116 -9.165 5.550 13.855 1.00 0.00 C ATOM 1669 C GLU A 116 -9.670 5.739 15.283 1.00 0.00 C ATOM 1670 O GLU A 116 -9.996 6.851 15.696 1.00 0.00 O ATOM 1671 CB GLU A 116 -10.345 5.555 12.881 1.00 0.00 C ATOM 1672 CG GLU A 116 -10.759 6.947 12.434 1.00 0.00 C ATOM 1673 CD GLU A 116 -11.162 7.837 13.594 1.00 0.00 C ATOM 1674 OE1 GLU A 116 -12.157 7.509 14.274 1.00 0.00 O ATOM 1675 OE2 GLU A 116 -10.484 8.860 13.821 1.00 0.00 O ATOM 0 H GLU A 116 -8.741 3.686 12.994 1.00 0.00 H new ATOM 0 HA GLU A 116 -8.498 6.377 13.612 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -10.084 4.964 12.004 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.197 5.066 13.353 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -9.934 7.412 11.894 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.592 6.867 11.736 1.00 0.00 H new ATOM 1682 N LYS A 117 -9.732 4.643 16.032 1.00 0.00 N ATOM 1683 CA LYS A 117 -10.196 4.685 17.413 1.00 0.00 C ATOM 1684 C LYS A 117 -9.121 5.260 18.331 1.00 0.00 C ATOM 1685 O LYS A 117 -9.403 6.104 19.179 1.00 0.00 O ATOM 1686 CB LYS A 117 -10.587 3.283 17.885 1.00 0.00 C ATOM 1687 CG LYS A 117 -9.407 2.338 18.030 1.00 0.00 C ATOM 1688 CD LYS A 117 -9.856 0.939 18.415 1.00 0.00 C ATOM 1689 CE LYS A 117 -9.957 0.782 19.925 1.00 0.00 C ATOM 1690 NZ LYS A 117 -11.292 1.198 20.438 1.00 0.00 N ATOM 0 H LYS A 117 -9.466 3.714 15.705 1.00 0.00 H new ATOM 0 HA LYS A 117 -11.071 5.333 17.456 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -11.099 3.361 18.844 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -11.299 2.856 17.178 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -8.854 2.298 17.091 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -8.723 2.722 18.787 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -10.824 0.728 17.961 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -9.152 0.208 18.018 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -9.772 -0.258 20.195 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -9.181 1.379 20.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -11.176 1.978 21.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -11.886 1.514 19.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -11.748 0.393 20.913 1.00 0.00 H new ATOM 1704 N ASN A 118 -7.888 4.796 18.153 1.00 0.00 N ATOM 1705 CA ASN A 118 -6.771 5.265 18.965 1.00 0.00 C ATOM 1706 C ASN A 118 -5.506 5.400 18.123 1.00 0.00 C ATOM 1707 O ASN A 118 -5.192 4.529 17.313 1.00 0.00 O ATOM 1708 CB ASN A 118 -6.521 4.305 20.129 1.00 0.00 C ATOM 1709 CG ASN A 118 -5.938 5.005 21.342 1.00 0.00 C ATOM 1710 OD1 ASN A 118 -4.886 4.618 21.850 1.00 0.00 O ATOM 1711 ND2 ASN A 118 -6.621 6.044 21.810 1.00 0.00 N ATOM 0 H ASN A 118 -7.637 4.096 17.454 1.00 0.00 H new ATOM 0 HA ASN A 118 -7.030 6.247 19.361 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -7.459 3.823 20.407 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -5.841 3.517 19.806 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -6.277 6.556 22.622 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -7.489 6.330 21.357 1.00 0.00 H new ATOM 1718 N GLU A 119 -4.784 6.499 18.321 1.00 0.00 N ATOM 1719 CA GLU A 119 -3.553 6.748 17.579 1.00 0.00 C ATOM 1720 C GLU A 119 -2.471 5.746 17.970 1.00 0.00 C ATOM 1721 O GLU A 119 -1.764 5.217 17.114 1.00 0.00 O ATOM 1722 CB GLU A 119 -3.059 8.174 17.832 1.00 0.00 C ATOM 1723 CG GLU A 119 -1.990 8.630 16.854 1.00 0.00 C ATOM 1724 CD GLU A 119 -2.572 9.280 15.614 1.00 0.00 C ATOM 1725 OE1 GLU A 119 -3.658 9.886 15.715 1.00 0.00 O ATOM 1726 OE2 GLU A 119 -1.940 9.182 14.541 1.00 0.00 O ATOM 0 H GLU A 119 -5.030 7.230 18.988 1.00 0.00 H new ATOM 0 HA GLU A 119 -3.768 6.629 16.517 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -3.906 8.858 17.777 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -2.663 8.238 18.846 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -1.325 9.336 17.352 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -1.383 7.774 16.560 1.00 0.00 H new ATOM 1733 N GLU A 120 -2.348 5.493 19.269 1.00 0.00 N ATOM 1734 CA GLU A 120 -1.351 4.556 19.773 1.00 0.00 C ATOM 1735 C GLU A 120 -1.604 3.151 19.236 1.00 0.00 C ATOM 1736 O GLU A 120 -0.710 2.305 19.238 1.00 0.00 O ATOM 1737 CB GLU A 120 -1.362 4.539 21.303 1.00 0.00 C ATOM 1738 CG GLU A 120 -0.910 5.847 21.930 1.00 0.00 C ATOM 1739 CD GLU A 120 -1.666 7.045 21.390 1.00 0.00 C ATOM 1740 OE1 GLU A 120 -2.739 7.368 21.940 1.00 0.00 O ATOM 1741 OE2 GLU A 120 -1.183 7.661 20.416 1.00 0.00 O ATOM 0 H GLU A 120 -2.926 5.923 19.991 1.00 0.00 H new ATOM 0 HA GLU A 120 -0.372 4.887 19.428 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -2.370 4.310 21.648 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -0.715 3.735 21.654 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -1.045 5.794 23.010 1.00 0.00 H new ATOM 0 HG3 GLU A 120 0.156 5.983 21.749 1.00 0.00 H new ATOM 1748 N GLU A 121 -2.828 2.910 18.778 1.00 0.00 N ATOM 1749 CA GLU A 121 -3.199 1.607 18.239 1.00 0.00 C ATOM 1750 C GLU A 121 -2.622 1.412 16.840 1.00 0.00 C ATOM 1751 O GLU A 121 -3.285 1.685 15.839 1.00 0.00 O ATOM 1752 CB GLU A 121 -4.722 1.462 18.199 1.00 0.00 C ATOM 1753 CG GLU A 121 -5.191 0.041 17.934 1.00 0.00 C ATOM 1754 CD GLU A 121 -6.609 -0.204 18.413 1.00 0.00 C ATOM 1755 OE1 GLU A 121 -7.000 0.394 19.437 1.00 0.00 O ATOM 1756 OE2 GLU A 121 -7.326 -0.994 17.765 1.00 0.00 O ATOM 0 H GLU A 121 -3.579 3.600 18.769 1.00 0.00 H new ATOM 0 HA GLU A 121 -2.785 0.840 18.894 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -5.136 1.801 19.149 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -5.121 2.118 17.425 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -5.132 -0.164 16.865 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -4.518 -0.658 18.430 1.00 0.00 H new ATOM 1763 N VAL A 122 -1.381 0.939 16.779 1.00 0.00 N ATOM 1764 CA VAL A 122 -0.714 0.707 15.504 1.00 0.00 C ATOM 1765 C VAL A 122 -0.993 -0.699 14.985 1.00 0.00 C ATOM 1766 O VAL A 122 -0.269 -1.645 15.300 1.00 0.00 O ATOM 1767 CB VAL A 122 0.809 0.905 15.623 1.00 0.00 C ATOM 1768 CG1 VAL A 122 1.301 0.448 16.988 1.00 0.00 C ATOM 1769 CG2 VAL A 122 1.532 0.160 14.511 1.00 0.00 C ATOM 0 H VAL A 122 -0.818 0.709 17.598 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.114 1.437 14.800 1.00 0.00 H new ATOM 0 HB VAL A 122 1.029 1.968 15.520 1.00 0.00 H new ATOM 0 HG11 VAL A 122 2.379 0.595 17.054 1.00 0.00 H new ATOM 0 HG12 VAL A 122 0.807 1.030 17.766 1.00 0.00 H new ATOM 0 HG13 VAL A 122 1.070 -0.609 17.123 1.00 0.00 H new ATOM 0 HG21 VAL A 122 2.607 0.311 14.611 1.00 0.00 H new ATOM 0 HG22 VAL A 122 1.307 -0.904 14.580 1.00 0.00 H new ATOM 0 HG23 VAL A 122 1.201 0.539 13.544 1.00 0.00 H new ATOM 1779 N LEU A 123 -2.048 -0.831 14.187 1.00 0.00 N ATOM 1780 CA LEU A 123 -2.424 -2.122 13.623 1.00 0.00 C ATOM 1781 C LEU A 123 -1.284 -2.708 12.795 1.00 0.00 C ATOM 1782 O LEU A 123 -0.695 -3.725 13.162 1.00 0.00 O ATOM 1783 CB LEU A 123 -3.676 -1.977 12.757 1.00 0.00 C ATOM 1784 CG LEU A 123 -4.863 -1.266 13.407 1.00 0.00 C ATOM 1785 CD1 LEU A 123 -5.832 -0.766 12.347 1.00 0.00 C ATOM 1786 CD2 LEU A 123 -5.571 -2.193 14.385 1.00 0.00 C ATOM 0 H LEU A 123 -2.658 -0.059 13.916 1.00 0.00 H new ATOM 0 HA LEU A 123 -2.637 -2.803 14.447 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -3.406 -1.435 11.851 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -3.998 -2.972 12.450 1.00 0.00 H new ATOM 0 HG LEU A 123 -4.487 -0.406 13.961 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -6.670 -0.263 12.829 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -5.320 -0.066 11.687 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -6.202 -1.610 11.765 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.413 -1.670 14.838 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -5.934 -3.073 13.854 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -4.874 -2.501 15.164 1.00 0.00 H new ATOM 1798 N VAL A 124 -0.976 -2.057 11.678 1.00 0.00 N ATOM 1799 CA VAL A 124 0.095 -2.511 10.799 1.00 0.00 C ATOM 1800 C VAL A 124 1.211 -1.475 10.713 1.00 0.00 C ATOM 1801 O VAL A 124 0.957 -0.272 10.745 1.00 0.00 O ATOM 1802 CB VAL A 124 -0.428 -2.804 9.381 1.00 0.00 C ATOM 1803 CG1 VAL A 124 0.715 -3.206 8.462 1.00 0.00 C ATOM 1804 CG2 VAL A 124 -1.497 -3.886 9.420 1.00 0.00 C ATOM 0 H VAL A 124 -1.453 -1.213 11.360 1.00 0.00 H new ATOM 0 HA VAL A 124 0.489 -3.431 11.230 1.00 0.00 H new ATOM 0 HB VAL A 124 -0.878 -1.894 8.984 1.00 0.00 H new ATOM 0 HG11 VAL A 124 0.326 -3.409 7.464 1.00 0.00 H new ATOM 0 HG12 VAL A 124 1.442 -2.396 8.410 1.00 0.00 H new ATOM 0 HG13 VAL A 124 1.198 -4.102 8.852 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -1.855 -4.080 8.409 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -1.074 -4.800 9.837 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -2.328 -3.554 10.042 1.00 0.00 H new ATOM 1814 N GLU A 125 2.447 -1.953 10.604 1.00 0.00 N ATOM 1815 CA GLU A 125 3.602 -1.067 10.514 1.00 0.00 C ATOM 1816 C GLU A 125 4.535 -1.504 9.388 1.00 0.00 C ATOM 1817 O GLU A 125 5.387 -2.373 9.577 1.00 0.00 O ATOM 1818 CB GLU A 125 4.361 -1.046 11.842 1.00 0.00 C ATOM 1819 CG GLU A 125 5.443 0.018 11.907 1.00 0.00 C ATOM 1820 CD GLU A 125 6.069 0.131 13.284 1.00 0.00 C ATOM 1821 OE1 GLU A 125 5.462 0.781 14.160 1.00 0.00 O ATOM 1822 OE2 GLU A 125 7.165 -0.433 13.485 1.00 0.00 O ATOM 0 H GLU A 125 2.674 -2.947 10.576 1.00 0.00 H new ATOM 0 HA GLU A 125 3.242 -0.062 10.295 1.00 0.00 H new ATOM 0 HB2 GLU A 125 3.652 -0.882 12.654 1.00 0.00 H new ATOM 0 HB3 GLU A 125 4.814 -2.024 12.008 1.00 0.00 H new ATOM 0 HG2 GLU A 125 6.219 -0.213 11.177 1.00 0.00 H new ATOM 0 HG3 GLU A 125 5.017 0.981 11.625 1.00 0.00 H new ATOM 1829 N CYS A 126 4.368 -0.896 8.220 1.00 0.00 N ATOM 1830 CA CYS A 126 5.195 -1.222 7.063 1.00 0.00 C ATOM 1831 C CYS A 126 6.011 -0.012 6.619 1.00 0.00 C ATOM 1832 O CYS A 126 5.724 1.120 7.008 1.00 0.00 O ATOM 1833 CB CYS A 126 4.321 -1.713 5.908 1.00 0.00 C ATOM 1834 SG CYS A 126 5.157 -2.858 4.786 1.00 0.00 S ATOM 0 H CYS A 126 3.668 -0.175 8.048 1.00 0.00 H new ATOM 0 HA CYS A 126 5.884 -2.016 7.352 1.00 0.00 H new ATOM 0 HB2 CYS A 126 3.437 -2.202 6.318 1.00 0.00 H new ATOM 0 HB3 CYS A 126 3.973 -0.852 5.338 1.00 0.00 H new ATOM 0 HG CYS A 126 4.551 -4.008 4.809 1.00 0.00 H new ATOM 1840 N ARG A 127 7.032 -0.260 5.805 1.00 0.00 N ATOM 1841 CA ARG A 127 7.892 0.809 5.311 1.00 0.00 C ATOM 1842 C ARG A 127 8.028 0.739 3.793 1.00 0.00 C ATOM 1843 O ARG A 127 7.547 -0.200 3.158 1.00 0.00 O ATOM 1844 CB ARG A 127 9.274 0.721 5.962 1.00 0.00 C ATOM 1845 CG ARG A 127 9.289 1.152 7.419 1.00 0.00 C ATOM 1846 CD ARG A 127 10.452 0.525 8.173 1.00 0.00 C ATOM 1847 NE ARG A 127 10.832 1.311 9.344 1.00 0.00 N ATOM 1848 CZ ARG A 127 11.473 2.472 9.274 1.00 0.00 C ATOM 1849 NH1 ARG A 127 11.803 2.980 8.095 1.00 0.00 N ATOM 1850 NH2 ARG A 127 11.784 3.128 10.385 1.00 0.00 N ATOM 0 H ARG A 127 7.284 -1.191 5.474 1.00 0.00 H new ATOM 0 HA ARG A 127 7.433 1.762 5.574 1.00 0.00 H new ATOM 0 HB2 ARG A 127 9.635 -0.305 5.892 1.00 0.00 H new ATOM 0 HB3 ARG A 127 9.971 1.343 5.401 1.00 0.00 H new ATOM 0 HG2 ARG A 127 9.359 2.238 7.478 1.00 0.00 H new ATOM 0 HG3 ARG A 127 8.350 0.867 7.894 1.00 0.00 H new ATOM 0 HD2 ARG A 127 10.180 -0.483 8.486 1.00 0.00 H new ATOM 0 HD3 ARG A 127 11.309 0.431 7.506 1.00 0.00 H new ATOM 0 HE ARG A 127 10.592 0.948 10.267 1.00 0.00 H new ATOM 0 HH11 ARG A 127 11.565 2.479 7.239 1.00 0.00 H new ATOM 0 HH12 ARG A 127 12.295 3.872 8.044 1.00 0.00 H new ATOM 0 HH21 ARG A 127 11.531 2.741 11.294 1.00 0.00 H new ATOM 0 HH22 ARG A 127 12.276 4.020 10.330 1.00 0.00 H new ATOM 1864 N VAL A 128 8.685 1.741 3.216 1.00 0.00 N ATOM 1865 CA VAL A 128 8.885 1.794 1.773 1.00 0.00 C ATOM 1866 C VAL A 128 10.018 0.870 1.341 1.00 0.00 C ATOM 1867 O VAL A 128 9.985 0.298 0.251 1.00 0.00 O ATOM 1868 CB VAL A 128 9.197 3.226 1.302 1.00 0.00 C ATOM 1869 CG1 VAL A 128 7.998 4.136 1.526 1.00 0.00 C ATOM 1870 CG2 VAL A 128 10.426 3.766 2.017 1.00 0.00 C ATOM 0 H VAL A 128 9.088 2.527 3.726 1.00 0.00 H new ATOM 0 HA VAL A 128 7.954 1.463 1.312 1.00 0.00 H new ATOM 0 HB VAL A 128 9.408 3.200 0.233 1.00 0.00 H new ATOM 0 HG11 VAL A 128 8.238 5.144 1.187 1.00 0.00 H new ATOM 0 HG12 VAL A 128 7.144 3.758 0.964 1.00 0.00 H new ATOM 0 HG13 VAL A 128 7.752 4.159 2.588 1.00 0.00 H new ATOM 0 HG21 VAL A 128 10.632 4.779 1.672 1.00 0.00 H new ATOM 0 HG22 VAL A 128 10.245 3.779 3.092 1.00 0.00 H new ATOM 0 HG23 VAL A 128 11.283 3.128 1.800 1.00 0.00 H new ATOM 1880 N ARG A 129 11.020 0.729 2.202 1.00 0.00 N ATOM 1881 CA ARG A 129 12.165 -0.125 1.909 1.00 0.00 C ATOM 1882 C ARG A 129 11.730 -1.578 1.739 1.00 0.00 C ATOM 1883 O ARG A 129 12.306 -2.320 0.943 1.00 0.00 O ATOM 1884 CB ARG A 129 13.205 -0.021 3.025 1.00 0.00 C ATOM 1885 CG ARG A 129 13.508 1.409 3.444 1.00 0.00 C ATOM 1886 CD ARG A 129 14.909 1.536 4.020 1.00 0.00 C ATOM 1887 NE ARG A 129 15.118 2.826 4.673 1.00 0.00 N ATOM 1888 CZ ARG A 129 15.486 3.926 4.026 1.00 0.00 C ATOM 1889 NH1 ARG A 129 15.685 3.893 2.715 1.00 0.00 N ATOM 1890 NH2 ARG A 129 15.656 5.062 4.689 1.00 0.00 N ATOM 0 H ARG A 129 11.062 1.195 3.108 1.00 0.00 H new ATOM 0 HA ARG A 129 12.610 0.215 0.974 1.00 0.00 H new ATOM 0 HB2 ARG A 129 12.851 -0.578 3.893 1.00 0.00 H new ATOM 0 HB3 ARG A 129 14.128 -0.497 2.695 1.00 0.00 H new ATOM 0 HG2 ARG A 129 13.406 2.071 2.584 1.00 0.00 H new ATOM 0 HG3 ARG A 129 12.778 1.735 4.185 1.00 0.00 H new ATOM 0 HD2 ARG A 129 15.079 0.734 4.738 1.00 0.00 H new ATOM 0 HD3 ARG A 129 15.641 1.411 3.223 1.00 0.00 H new ATOM 0 HE ARG A 129 14.973 2.885 5.681 1.00 0.00 H new ATOM 0 HH11 ARG A 129 15.555 3.021 2.201 1.00 0.00 H new ATOM 0 HH12 ARG A 129 15.968 4.739 2.221 1.00 0.00 H new ATOM 0 HH21 ARG A 129 15.504 5.092 5.697 1.00 0.00 H new ATOM 0 HH22 ARG A 129 15.939 5.906 4.191 1.00 0.00 H new ATOM 1904 N PHE A 130 10.710 -1.977 2.492 1.00 0.00 N ATOM 1905 CA PHE A 130 10.199 -3.341 2.426 1.00 0.00 C ATOM 1906 C PHE A 130 9.139 -3.472 1.337 1.00 0.00 C ATOM 1907 O PHE A 130 8.936 -4.551 0.778 1.00 0.00 O ATOM 1908 CB PHE A 130 9.611 -3.754 3.777 1.00 0.00 C ATOM 1909 CG PHE A 130 10.653 -4.056 4.817 1.00 0.00 C ATOM 1910 CD1 PHE A 130 11.335 -3.030 5.451 1.00 0.00 C ATOM 1911 CD2 PHE A 130 10.949 -5.365 5.160 1.00 0.00 C ATOM 1912 CE1 PHE A 130 12.294 -3.305 6.408 1.00 0.00 C ATOM 1913 CE2 PHE A 130 11.907 -5.646 6.116 1.00 0.00 C ATOM 1914 CZ PHE A 130 12.580 -4.614 6.741 1.00 0.00 C ATOM 0 H PHE A 130 10.221 -1.375 3.155 1.00 0.00 H new ATOM 0 HA PHE A 130 11.030 -4.002 2.182 1.00 0.00 H new ATOM 0 HB2 PHE A 130 8.965 -2.956 4.142 1.00 0.00 H new ATOM 0 HB3 PHE A 130 8.983 -4.634 3.637 1.00 0.00 H new ATOM 0 HD1 PHE A 130 11.115 -2.004 5.195 1.00 0.00 H new ATOM 0 HD2 PHE A 130 10.425 -6.175 4.675 1.00 0.00 H new ATOM 0 HE1 PHE A 130 12.819 -2.496 6.895 1.00 0.00 H new ATOM 0 HE2 PHE A 130 12.129 -6.671 6.374 1.00 0.00 H new ATOM 0 HZ PHE A 130 13.329 -4.831 7.489 1.00 0.00 H new ATOM 1924 N LEU A 131 8.465 -2.367 1.039 1.00 0.00 N ATOM 1925 CA LEU A 131 7.424 -2.357 0.017 1.00 0.00 C ATOM 1926 C LEU A 131 7.950 -2.918 -1.301 1.00 0.00 C ATOM 1927 O LEU A 131 8.913 -2.401 -1.867 1.00 0.00 O ATOM 1928 CB LEU A 131 6.902 -0.935 -0.194 1.00 0.00 C ATOM 1929 CG LEU A 131 5.442 -0.814 -0.633 1.00 0.00 C ATOM 1930 CD1 LEU A 131 4.883 0.549 -0.256 1.00 0.00 C ATOM 1931 CD2 LEU A 131 5.315 -1.049 -2.131 1.00 0.00 C ATOM 0 H LEU A 131 8.621 -1.466 1.491 1.00 0.00 H new ATOM 0 HA LEU A 131 6.606 -2.990 0.361 1.00 0.00 H new ATOM 0 HB2 LEU A 131 7.028 -0.381 0.737 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.527 -0.447 -0.942 1.00 0.00 H new ATOM 0 HG LEU A 131 4.862 -1.578 -0.115 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.843 0.617 -0.576 1.00 0.00 H new ATOM 0 HD12 LEU A 131 4.939 0.679 0.825 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.465 1.329 -0.746 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.270 -0.959 -2.426 1.00 0.00 H new ATOM 0 HD22 LEU A 131 5.908 -0.308 -2.667 1.00 0.00 H new ATOM 0 HD23 LEU A 131 5.676 -2.048 -2.374 1.00 0.00 H new ATOM 1943 N SER A 132 7.310 -3.978 -1.784 1.00 0.00 N ATOM 1944 CA SER A 132 7.714 -4.610 -3.034 1.00 0.00 C ATOM 1945 C SER A 132 6.941 -4.027 -4.213 1.00 0.00 C ATOM 1946 O SER A 132 7.527 -3.456 -5.133 1.00 0.00 O ATOM 1947 CB SER A 132 7.491 -6.122 -2.961 1.00 0.00 C ATOM 1948 OG SER A 132 6.119 -6.427 -2.779 1.00 0.00 O ATOM 0 H SER A 132 6.510 -4.417 -1.329 1.00 0.00 H new ATOM 0 HA SER A 132 8.775 -4.413 -3.185 1.00 0.00 H new ATOM 0 HB2 SER A 132 7.853 -6.591 -3.876 1.00 0.00 H new ATOM 0 HB3 SER A 132 8.072 -6.539 -2.138 1.00 0.00 H new ATOM 0 HG SER A 132 5.856 -6.215 -1.859 1.00 0.00 H new ATOM 1954 N PHE A 133 5.621 -4.175 -4.178 1.00 0.00 N ATOM 1955 CA PHE A 133 4.765 -3.664 -5.243 1.00 0.00 C ATOM 1956 C PHE A 133 3.562 -2.924 -4.666 1.00 0.00 C ATOM 1957 O PHE A 133 3.045 -3.287 -3.610 1.00 0.00 O ATOM 1958 CB PHE A 133 4.292 -4.810 -6.139 1.00 0.00 C ATOM 1959 CG PHE A 133 3.548 -4.349 -7.360 1.00 0.00 C ATOM 1960 CD1 PHE A 133 2.179 -4.142 -7.316 1.00 0.00 C ATOM 1961 CD2 PHE A 133 4.218 -4.121 -8.551 1.00 0.00 C ATOM 1962 CE1 PHE A 133 1.492 -3.718 -8.438 1.00 0.00 C ATOM 1963 CE2 PHE A 133 3.537 -3.697 -9.676 1.00 0.00 C ATOM 1964 CZ PHE A 133 2.172 -3.494 -9.619 1.00 0.00 C ATOM 0 H PHE A 133 5.120 -4.645 -3.424 1.00 0.00 H new ATOM 0 HA PHE A 133 5.348 -2.963 -5.839 1.00 0.00 H new ATOM 0 HB2 PHE A 133 5.156 -5.398 -6.450 1.00 0.00 H new ATOM 0 HB3 PHE A 133 3.648 -5.472 -5.559 1.00 0.00 H new ATOM 0 HD1 PHE A 133 1.642 -4.314 -6.395 1.00 0.00 H new ATOM 0 HD2 PHE A 133 5.286 -4.277 -8.601 1.00 0.00 H new ATOM 0 HE1 PHE A 133 0.424 -3.562 -8.391 1.00 0.00 H new ATOM 0 HE2 PHE A 133 4.071 -3.525 -10.599 1.00 0.00 H new ATOM 0 HZ PHE A 133 1.637 -3.161 -10.496 1.00 0.00 H new ATOM 1974 N MET A 134 3.123 -1.884 -5.368 1.00 0.00 N ATOM 1975 CA MET A 134 1.980 -1.093 -4.926 1.00 0.00 C ATOM 1976 C MET A 134 1.243 -0.491 -6.118 1.00 0.00 C ATOM 1977 O MET A 134 1.794 0.327 -6.853 1.00 0.00 O ATOM 1978 CB MET A 134 2.438 0.019 -3.981 1.00 0.00 C ATOM 1979 CG MET A 134 3.253 1.103 -4.667 1.00 0.00 C ATOM 1980 SD MET A 134 4.113 2.171 -3.496 1.00 0.00 S ATOM 1981 CE MET A 134 5.820 1.829 -3.916 1.00 0.00 C ATOM 0 H MET A 134 3.541 -1.570 -6.244 1.00 0.00 H new ATOM 0 HA MET A 134 1.296 -1.754 -4.394 1.00 0.00 H new ATOM 0 HB2 MET A 134 1.563 0.473 -3.517 1.00 0.00 H new ATOM 0 HB3 MET A 134 3.033 -0.419 -3.179 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.981 0.639 -5.332 1.00 0.00 H new ATOM 0 HG3 MET A 134 2.594 1.709 -5.289 1.00 0.00 H new ATOM 0 HE1 MET A 134 6.418 1.789 -3.005 1.00 0.00 H new ATOM 0 HE2 MET A 134 5.883 0.872 -4.433 1.00 0.00 H new ATOM 0 HE3 MET A 134 6.200 2.618 -4.565 1.00 0.00 H new ATOM 1991 N GLY A 135 -0.008 -0.903 -6.304 1.00 0.00 N ATOM 1992 CA GLY A 135 -0.800 -0.394 -7.409 1.00 0.00 C ATOM 1993 C GLY A 135 -2.262 -0.229 -7.046 1.00 0.00 C ATOM 1994 O GLY A 135 -2.645 -0.400 -5.889 1.00 0.00 O ATOM 0 H GLY A 135 -0.487 -1.580 -5.710 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -0.397 0.567 -7.728 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -0.714 -1.073 -8.257 1.00 0.00 H new ATOM 1998 N VAL A 136 -3.082 0.106 -8.037 1.00 0.00 N ATOM 1999 CA VAL A 136 -4.511 0.296 -7.817 1.00 0.00 C ATOM 2000 C VAL A 136 -5.332 -0.631 -8.706 1.00 0.00 C ATOM 2001 O VAL A 136 -4.948 -0.924 -9.837 1.00 0.00 O ATOM 2002 CB VAL A 136 -4.932 1.753 -8.086 1.00 0.00 C ATOM 2003 CG1 VAL A 136 -6.427 1.927 -7.864 1.00 0.00 C ATOM 2004 CG2 VAL A 136 -4.139 2.707 -7.205 1.00 0.00 C ATOM 0 H VAL A 136 -2.781 0.252 -9.001 1.00 0.00 H new ATOM 0 HA VAL A 136 -4.704 0.057 -6.771 1.00 0.00 H new ATOM 0 HB VAL A 136 -4.714 1.990 -9.127 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.706 2.963 -8.059 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -6.974 1.271 -8.541 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -6.674 1.673 -6.833 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -4.449 3.732 -7.408 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -4.324 2.473 -6.157 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -3.075 2.600 -7.419 1.00 0.00 H new ATOM 2014 N GLY A 137 -6.466 -1.091 -8.185 1.00 0.00 N ATOM 2015 CA GLY A 137 -7.324 -1.980 -8.945 1.00 0.00 C ATOM 2016 C GLY A 137 -8.172 -1.240 -9.961 1.00 0.00 C ATOM 2017 O GLY A 137 -7.963 -0.052 -10.208 1.00 0.00 O ATOM 0 H GLY A 137 -6.805 -0.863 -7.250 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -6.711 -2.720 -9.459 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -7.975 -2.524 -8.261 1.00 0.00 H new ATOM 2021 N LYS A 138 -9.131 -1.943 -10.553 1.00 0.00 N ATOM 2022 CA LYS A 138 -10.014 -1.347 -11.549 1.00 0.00 C ATOM 2023 C LYS A 138 -10.567 -0.014 -11.056 1.00 0.00 C ATOM 2024 O LYS A 138 -10.598 0.968 -11.798 1.00 0.00 O ATOM 2025 CB LYS A 138 -11.166 -2.300 -11.875 1.00 0.00 C ATOM 2026 CG LYS A 138 -10.860 -3.256 -13.015 1.00 0.00 C ATOM 2027 CD LYS A 138 -12.132 -3.769 -13.669 1.00 0.00 C ATOM 2028 CE LYS A 138 -12.606 -2.836 -14.774 1.00 0.00 C ATOM 2029 NZ LYS A 138 -11.908 -3.102 -16.062 1.00 0.00 N ATOM 0 H LYS A 138 -9.317 -2.927 -10.360 1.00 0.00 H new ATOM 0 HA LYS A 138 -9.433 -1.168 -12.453 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -11.412 -2.877 -10.984 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -12.050 -1.715 -12.130 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -10.245 -2.751 -13.760 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -10.278 -4.098 -12.639 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -11.955 -4.763 -14.081 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -12.914 -3.870 -12.916 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -13.681 -2.954 -14.912 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -12.434 -1.802 -14.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -12.259 -2.446 -16.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -10.885 -2.965 -15.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -12.092 -4.081 -16.361 1.00 0.00 H new ATOM 2043 N ASP A 139 -11.001 0.014 -9.801 1.00 0.00 N ATOM 2044 CA ASP A 139 -11.551 1.228 -9.208 1.00 0.00 C ATOM 2045 C ASP A 139 -10.451 2.061 -8.558 1.00 0.00 C ATOM 2046 O ASP A 139 -9.482 1.522 -8.024 1.00 0.00 O ATOM 2047 CB ASP A 139 -12.621 0.876 -8.174 1.00 0.00 C ATOM 2048 CG ASP A 139 -13.864 0.281 -8.805 1.00 0.00 C ATOM 2049 OD1 ASP A 139 -14.350 0.848 -9.806 1.00 0.00 O ATOM 2050 OD2 ASP A 139 -14.352 -0.751 -8.298 1.00 0.00 O ATOM 0 H ASP A 139 -10.983 -0.790 -9.174 1.00 0.00 H new ATOM 0 HA ASP A 139 -12.006 1.818 -10.003 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -12.208 0.168 -7.455 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -12.893 1.773 -7.618 1.00 0.00 H new ATOM 2055 N VAL A 140 -10.608 3.380 -8.609 1.00 0.00 N ATOM 2056 CA VAL A 140 -9.628 4.289 -8.025 1.00 0.00 C ATOM 2057 C VAL A 140 -9.895 4.504 -6.539 1.00 0.00 C ATOM 2058 O VAL A 140 -9.420 5.473 -5.946 1.00 0.00 O ATOM 2059 CB VAL A 140 -9.634 5.654 -8.739 1.00 0.00 C ATOM 2060 CG1 VAL A 140 -9.175 5.504 -10.181 1.00 0.00 C ATOM 2061 CG2 VAL A 140 -11.017 6.284 -8.673 1.00 0.00 C ATOM 0 H VAL A 140 -11.404 3.843 -9.048 1.00 0.00 H new ATOM 0 HA VAL A 140 -8.650 3.825 -8.152 1.00 0.00 H new ATOM 0 HB VAL A 140 -8.935 6.315 -8.227 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -9.186 6.478 -10.669 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -8.163 5.099 -10.201 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -9.847 4.827 -10.708 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -11.003 7.248 -9.182 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -11.739 5.628 -9.158 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -11.302 6.429 -7.631 1.00 0.00 H new ATOM 2071 N HIS A 141 -10.658 3.593 -5.943 1.00 0.00 N ATOM 2072 CA HIS A 141 -10.987 3.682 -4.525 1.00 0.00 C ATOM 2073 C HIS A 141 -10.438 2.479 -3.763 1.00 0.00 C ATOM 2074 O HIS A 141 -10.818 2.230 -2.618 1.00 0.00 O ATOM 2075 CB HIS A 141 -12.502 3.772 -4.336 1.00 0.00 C ATOM 2076 CG HIS A 141 -13.176 4.672 -5.326 1.00 0.00 C ATOM 2077 ND1 HIS A 141 -13.883 4.200 -6.411 1.00 0.00 N ATOM 2078 CD2 HIS A 141 -13.250 6.022 -5.388 1.00 0.00 C ATOM 2079 CE1 HIS A 141 -14.361 5.221 -7.100 1.00 0.00 C ATOM 2080 NE2 HIS A 141 -13.991 6.338 -6.500 1.00 0.00 N ATOM 0 H HIS A 141 -11.060 2.786 -6.420 1.00 0.00 H new ATOM 0 HA HIS A 141 -10.524 4.585 -4.126 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -12.930 2.773 -4.415 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -12.714 4.130 -3.329 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -12.809 6.720 -4.693 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -14.953 5.154 -8.001 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -14.219 7.282 -6.812 1.00 0.00 H new ATOM 2088 N THR A 142 -9.544 1.735 -4.406 1.00 0.00 N ATOM 2089 CA THR A 142 -8.944 0.558 -3.791 1.00 0.00 C ATOM 2090 C THR A 142 -7.431 0.552 -3.973 1.00 0.00 C ATOM 2091 O THR A 142 -6.931 0.402 -5.088 1.00 0.00 O ATOM 2092 CB THR A 142 -9.526 -0.741 -4.379 1.00 0.00 C ATOM 2093 OG1 THR A 142 -9.295 -0.785 -5.792 1.00 0.00 O ATOM 2094 CG2 THR A 142 -11.018 -0.841 -4.102 1.00 0.00 C ATOM 0 H THR A 142 -9.219 1.927 -5.354 1.00 0.00 H new ATOM 0 HA THR A 142 -9.178 0.604 -2.727 1.00 0.00 H new ATOM 0 HB THR A 142 -9.027 -1.584 -3.902 1.00 0.00 H new ATOM 0 HG1 THR A 142 -8.394 -0.452 -5.987 1.00 0.00 H new ATOM 0 HG21 THR A 142 -11.406 -1.767 -4.527 1.00 0.00 H new ATOM 0 HG22 THR A 142 -11.189 -0.836 -3.026 1.00 0.00 H new ATOM 0 HG23 THR A 142 -11.530 0.008 -4.555 1.00 0.00 H new ATOM 2102 N PHE A 143 -6.706 0.717 -2.871 1.00 0.00 N ATOM 2103 CA PHE A 143 -5.249 0.731 -2.910 1.00 0.00 C ATOM 2104 C PHE A 143 -4.672 -0.425 -2.098 1.00 0.00 C ATOM 2105 O PHE A 143 -5.025 -0.618 -0.935 1.00 0.00 O ATOM 2106 CB PHE A 143 -4.716 2.061 -2.374 1.00 0.00 C ATOM 2107 CG PHE A 143 -3.284 1.996 -1.925 1.00 0.00 C ATOM 2108 CD1 PHE A 143 -2.253 2.013 -2.851 1.00 0.00 C ATOM 2109 CD2 PHE A 143 -2.969 1.919 -0.578 1.00 0.00 C ATOM 2110 CE1 PHE A 143 -0.934 1.953 -2.441 1.00 0.00 C ATOM 2111 CE2 PHE A 143 -1.652 1.859 -0.162 1.00 0.00 C ATOM 2112 CZ PHE A 143 -0.634 1.877 -1.095 1.00 0.00 C ATOM 0 H PHE A 143 -7.104 0.843 -1.940 1.00 0.00 H new ATOM 0 HA PHE A 143 -4.937 0.614 -3.948 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -4.811 2.820 -3.150 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -5.337 2.381 -1.537 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -2.482 2.074 -3.905 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -3.762 1.906 0.156 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -0.139 1.966 -3.172 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -1.420 1.798 0.891 1.00 0.00 H new ATOM 0 HZ PHE A 143 0.396 1.832 -0.772 1.00 0.00 H new ATOM 2122 N ALA A 144 -3.783 -1.192 -2.720 1.00 0.00 N ATOM 2123 CA ALA A 144 -3.156 -2.328 -2.056 1.00 0.00 C ATOM 2124 C ALA A 144 -1.642 -2.306 -2.243 1.00 0.00 C ATOM 2125 O ALA A 144 -1.139 -1.837 -3.264 1.00 0.00 O ATOM 2126 CB ALA A 144 -3.735 -3.633 -2.582 1.00 0.00 C ATOM 0 H ALA A 144 -3.481 -1.047 -3.683 1.00 0.00 H new ATOM 0 HA ALA A 144 -3.366 -2.254 -0.989 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -3.257 -4.473 -2.077 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -4.808 -3.658 -2.392 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -3.555 -3.705 -3.655 1.00 0.00 H new ATOM 2132 N PHE A 145 -0.921 -2.815 -1.249 1.00 0.00 N ATOM 2133 CA PHE A 145 0.536 -2.852 -1.304 1.00 0.00 C ATOM 2134 C PHE A 145 1.068 -4.165 -0.737 1.00 0.00 C ATOM 2135 O PHE A 145 0.632 -4.619 0.322 1.00 0.00 O ATOM 2136 CB PHE A 145 1.126 -1.673 -0.528 1.00 0.00 C ATOM 2137 CG PHE A 145 0.925 -1.770 0.957 1.00 0.00 C ATOM 2138 CD1 PHE A 145 1.618 -2.709 1.703 1.00 0.00 C ATOM 2139 CD2 PHE A 145 0.041 -0.923 1.606 1.00 0.00 C ATOM 2140 CE1 PHE A 145 1.435 -2.801 3.070 1.00 0.00 C ATOM 2141 CE2 PHE A 145 -0.146 -1.011 2.973 1.00 0.00 C ATOM 2142 CZ PHE A 145 0.551 -1.951 3.706 1.00 0.00 C ATOM 0 H PHE A 145 -1.321 -3.207 -0.397 1.00 0.00 H new ATOM 0 HA PHE A 145 0.838 -2.779 -2.349 1.00 0.00 H new ATOM 0 HB2 PHE A 145 2.194 -1.608 -0.738 1.00 0.00 H new ATOM 0 HB3 PHE A 145 0.674 -0.749 -0.888 1.00 0.00 H new ATOM 0 HD1 PHE A 145 2.309 -3.377 1.211 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -0.508 -0.186 1.038 1.00 0.00 H new ATOM 0 HE1 PHE A 145 1.983 -3.537 3.640 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -0.837 -0.345 3.468 1.00 0.00 H new ATOM 0 HZ PHE A 145 0.405 -2.022 4.774 1.00 0.00 H new ATOM 2152 N ILE A 146 2.012 -4.771 -1.449 1.00 0.00 N ATOM 2153 CA ILE A 146 2.604 -6.031 -1.018 1.00 0.00 C ATOM 2154 C ILE A 146 3.954 -5.803 -0.347 1.00 0.00 C ATOM 2155 O ILE A 146 4.857 -5.207 -0.934 1.00 0.00 O ATOM 2156 CB ILE A 146 2.787 -7.001 -2.200 1.00 0.00 C ATOM 2157 CG1 ILE A 146 1.449 -7.244 -2.901 1.00 0.00 C ATOM 2158 CG2 ILE A 146 3.387 -8.314 -1.719 1.00 0.00 C ATOM 2159 CD1 ILE A 146 1.593 -7.689 -4.339 1.00 0.00 C ATOM 0 H ILE A 146 2.383 -4.409 -2.327 1.00 0.00 H new ATOM 0 HA ILE A 146 1.914 -6.474 -0.299 1.00 0.00 H new ATOM 0 HB ILE A 146 3.474 -6.552 -2.917 1.00 0.00 H new ATOM 0 HG12 ILE A 146 0.891 -8.000 -2.349 1.00 0.00 H new ATOM 0 HG13 ILE A 146 0.860 -6.327 -2.870 1.00 0.00 H new ATOM 0 HG21 ILE A 146 3.510 -8.989 -2.566 1.00 0.00 H new ATOM 0 HG22 ILE A 146 4.358 -8.124 -1.262 1.00 0.00 H new ATOM 0 HG23 ILE A 146 2.723 -8.770 -0.985 1.00 0.00 H new ATOM 0 HD11 ILE A 146 0.605 -7.842 -4.773 1.00 0.00 H new ATOM 0 HD12 ILE A 146 2.123 -6.923 -4.905 1.00 0.00 H new ATOM 0 HD13 ILE A 146 2.155 -8.622 -4.377 1.00 0.00 H new ATOM 2171 N MET A 147 4.085 -6.282 0.885 1.00 0.00 N ATOM 2172 CA MET A 147 5.327 -6.133 1.635 1.00 0.00 C ATOM 2173 C MET A 147 6.017 -7.481 1.817 1.00 0.00 C ATOM 2174 O MET A 147 5.445 -8.528 1.513 1.00 0.00 O ATOM 2175 CB MET A 147 5.051 -5.500 3.000 1.00 0.00 C ATOM 2176 CG MET A 147 4.360 -6.437 3.976 1.00 0.00 C ATOM 2177 SD MET A 147 3.366 -5.559 5.198 1.00 0.00 S ATOM 2178 CE MET A 147 4.430 -5.660 6.636 1.00 0.00 C ATOM 0 H MET A 147 3.347 -6.777 1.386 1.00 0.00 H new ATOM 0 HA MET A 147 5.989 -5.479 1.067 1.00 0.00 H new ATOM 0 HB2 MET A 147 5.994 -5.167 3.434 1.00 0.00 H new ATOM 0 HB3 MET A 147 4.433 -4.613 2.862 1.00 0.00 H new ATOM 0 HG2 MET A 147 3.722 -7.126 3.422 1.00 0.00 H new ATOM 0 HG3 MET A 147 5.110 -7.039 4.489 1.00 0.00 H new ATOM 0 HE1 MET A 147 4.050 -5.001 7.417 1.00 0.00 H new ATOM 0 HE2 MET A 147 4.448 -6.686 7.004 1.00 0.00 H new ATOM 0 HE3 MET A 147 5.440 -5.355 6.363 1.00 0.00 H new ATOM 2188 N ASP A 148 7.249 -7.448 2.314 1.00 0.00 N ATOM 2189 CA ASP A 148 8.017 -8.667 2.537 1.00 0.00 C ATOM 2190 C ASP A 148 8.187 -8.937 4.029 1.00 0.00 C ATOM 2191 O ASP A 148 8.765 -8.128 4.756 1.00 0.00 O ATOM 2192 CB ASP A 148 9.387 -8.563 1.866 1.00 0.00 C ATOM 2193 CG ASP A 148 10.259 -7.492 2.492 1.00 0.00 C ATOM 2194 OD1 ASP A 148 9.866 -6.308 2.450 1.00 0.00 O ATOM 2195 OD2 ASP A 148 11.334 -7.839 3.025 1.00 0.00 O ATOM 0 H ASP A 148 7.737 -6.590 2.570 1.00 0.00 H new ATOM 0 HA ASP A 148 7.467 -9.498 2.096 1.00 0.00 H new ATOM 0 HB2 ASP A 148 9.895 -9.525 1.932 1.00 0.00 H new ATOM 0 HB3 ASP A 148 9.254 -8.345 0.806 1.00 0.00 H new ATOM 2200 N THR A 149 7.679 -10.080 4.481 1.00 0.00 N ATOM 2201 CA THR A 149 7.772 -10.455 5.886 1.00 0.00 C ATOM 2202 C THR A 149 8.833 -11.529 6.098 1.00 0.00 C ATOM 2203 O THR A 149 9.638 -11.445 7.025 1.00 0.00 O ATOM 2204 CB THR A 149 6.422 -10.970 6.420 1.00 0.00 C ATOM 2205 OG1 THR A 149 6.036 -12.156 5.716 1.00 0.00 O ATOM 2206 CG2 THR A 149 5.341 -9.911 6.271 1.00 0.00 C ATOM 0 H THR A 149 7.199 -10.762 3.894 1.00 0.00 H new ATOM 0 HA THR A 149 8.053 -9.557 6.436 1.00 0.00 H new ATOM 0 HB THR A 149 6.540 -11.199 7.479 1.00 0.00 H new ATOM 0 HG1 THR A 149 5.327 -11.940 5.075 1.00 0.00 H new ATOM 0 HG21 THR A 149 4.397 -10.298 6.655 1.00 0.00 H new ATOM 0 HG22 THR A 149 5.624 -9.021 6.833 1.00 0.00 H new ATOM 0 HG23 THR A 149 5.226 -9.654 5.218 1.00 0.00 H new ATOM 2214 N GLY A 150 8.829 -12.538 5.233 1.00 0.00 N ATOM 2215 CA GLY A 150 9.797 -13.614 5.344 1.00 0.00 C ATOM 2216 C GLY A 150 10.744 -13.666 4.161 1.00 0.00 C ATOM 2217 O GLY A 150 11.184 -12.630 3.665 1.00 0.00 O ATOM 0 H GLY A 150 8.173 -12.630 4.457 1.00 0.00 H new ATOM 0 HA2 GLY A 150 10.373 -13.488 6.261 1.00 0.00 H new ATOM 0 HA3 GLY A 150 9.271 -14.565 5.426 1.00 0.00 H new ATOM 2221 N ASN A 151 11.059 -14.876 3.710 1.00 0.00 N ATOM 2222 CA ASN A 151 11.963 -15.058 2.580 1.00 0.00 C ATOM 2223 C ASN A 151 11.218 -14.902 1.258 1.00 0.00 C ATOM 2224 O ASN A 151 11.526 -14.015 0.462 1.00 0.00 O ATOM 2225 CB ASN A 151 12.624 -16.437 2.646 1.00 0.00 C ATOM 2226 CG ASN A 151 13.492 -16.603 3.878 1.00 0.00 C ATOM 2227 OD1 ASN A 151 13.100 -17.259 4.843 1.00 0.00 O ATOM 2228 ND2 ASN A 151 14.678 -16.007 3.851 1.00 0.00 N ATOM 0 H ASN A 151 10.702 -15.744 4.109 1.00 0.00 H new ATOM 0 HA ASN A 151 12.734 -14.290 2.636 1.00 0.00 H new ATOM 0 HB2 ASN A 151 11.853 -17.207 2.642 1.00 0.00 H new ATOM 0 HB3 ASN A 151 13.231 -16.589 1.754 1.00 0.00 H new ATOM 0 HD21 ASN A 151 15.305 -16.083 4.652 1.00 0.00 H new ATOM 0 HD22 ASN A 151 14.962 -15.473 3.030 1.00 0.00 H new ATOM 2235 N GLN A 152 10.236 -15.770 1.032 1.00 0.00 N ATOM 2236 CA GLN A 152 9.448 -15.728 -0.194 1.00 0.00 C ATOM 2237 C GLN A 152 7.979 -15.452 0.112 1.00 0.00 C ATOM 2238 O GLN A 152 7.118 -15.588 -0.756 1.00 0.00 O ATOM 2239 CB GLN A 152 9.583 -17.046 -0.958 1.00 0.00 C ATOM 2240 CG GLN A 152 10.942 -17.234 -1.613 1.00 0.00 C ATOM 2241 CD GLN A 152 11.226 -18.681 -1.964 1.00 0.00 C ATOM 2242 OE1 GLN A 152 11.115 -19.084 -3.122 1.00 0.00 O ATOM 2243 NE2 GLN A 152 11.596 -19.471 -0.963 1.00 0.00 N ATOM 0 H GLN A 152 9.968 -16.510 1.681 1.00 0.00 H new ATOM 0 HA GLN A 152 9.830 -14.917 -0.814 1.00 0.00 H new ATOM 0 HB2 GLN A 152 9.402 -17.874 -0.272 1.00 0.00 H new ATOM 0 HB3 GLN A 152 8.810 -17.092 -1.725 1.00 0.00 H new ATOM 0 HG2 GLN A 152 10.992 -16.628 -2.518 1.00 0.00 H new ATOM 0 HG3 GLN A 152 11.718 -16.868 -0.941 1.00 0.00 H new ATOM 0 HE21 GLN A 152 11.675 -19.094 -0.018 1.00 0.00 H new ATOM 0 HE22 GLN A 152 11.801 -20.455 -1.139 1.00 0.00 H new ATOM 2252 N ARG A 153 7.702 -15.065 1.353 1.00 0.00 N ATOM 2253 CA ARG A 153 6.337 -14.772 1.774 1.00 0.00 C ATOM 2254 C ARG A 153 5.984 -13.313 1.497 1.00 0.00 C ATOM 2255 O ARG A 153 6.792 -12.413 1.727 1.00 0.00 O ATOM 2256 CB ARG A 153 6.164 -15.075 3.264 1.00 0.00 C ATOM 2257 CG ARG A 153 5.740 -16.507 3.548 1.00 0.00 C ATOM 2258 CD ARG A 153 4.288 -16.744 3.167 1.00 0.00 C ATOM 2259 NE ARG A 153 3.995 -18.163 2.982 1.00 0.00 N ATOM 2260 CZ ARG A 153 2.968 -18.615 2.271 1.00 0.00 C ATOM 2261 NH1 ARG A 153 2.141 -17.764 1.680 1.00 0.00 N ATOM 2262 NH2 ARG A 153 2.767 -19.921 2.149 1.00 0.00 N ATOM 0 H ARG A 153 8.404 -14.947 2.084 1.00 0.00 H new ATOM 0 HA ARG A 153 5.662 -15.407 1.200 1.00 0.00 H new ATOM 0 HB2 ARG A 153 7.104 -14.874 3.779 1.00 0.00 H new ATOM 0 HB3 ARG A 153 5.421 -14.395 3.681 1.00 0.00 H new ATOM 0 HG2 ARG A 153 6.379 -17.194 2.993 1.00 0.00 H new ATOM 0 HG3 ARG A 153 5.880 -16.726 4.607 1.00 0.00 H new ATOM 0 HD2 ARG A 153 3.639 -16.338 3.943 1.00 0.00 H new ATOM 0 HD3 ARG A 153 4.062 -16.204 2.247 1.00 0.00 H new ATOM 0 HE ARG A 153 4.613 -18.844 3.423 1.00 0.00 H new ATOM 0 HH11 ARG A 153 2.293 -16.759 1.771 1.00 0.00 H new ATOM 0 HH12 ARG A 153 1.353 -18.114 1.135 1.00 0.00 H new ATOM 0 HH21 ARG A 153 3.401 -20.579 2.601 1.00 0.00 H new ATOM 0 HH22 ARG A 153 1.978 -20.267 1.603 1.00 0.00 H new ATOM 2276 N PHE A 154 4.772 -13.087 1.002 1.00 0.00 N ATOM 2277 CA PHE A 154 4.312 -11.738 0.692 1.00 0.00 C ATOM 2278 C PHE A 154 2.873 -11.534 1.157 1.00 0.00 C ATOM 2279 O PHE A 154 2.009 -12.378 0.921 1.00 0.00 O ATOM 2280 CB PHE A 154 4.417 -11.474 -0.811 1.00 0.00 C ATOM 2281 CG PHE A 154 5.559 -12.195 -1.469 1.00 0.00 C ATOM 2282 CD1 PHE A 154 6.865 -11.957 -1.073 1.00 0.00 C ATOM 2283 CD2 PHE A 154 5.325 -13.112 -2.482 1.00 0.00 C ATOM 2284 CE1 PHE A 154 7.917 -12.619 -1.677 1.00 0.00 C ATOM 2285 CE2 PHE A 154 6.374 -13.777 -3.089 1.00 0.00 C ATOM 2286 CZ PHE A 154 7.672 -13.531 -2.685 1.00 0.00 C ATOM 0 H PHE A 154 4.090 -13.820 0.807 1.00 0.00 H new ATOM 0 HA PHE A 154 4.950 -11.032 1.223 1.00 0.00 H new ATOM 0 HB2 PHE A 154 3.485 -11.773 -1.290 1.00 0.00 H new ATOM 0 HB3 PHE A 154 4.531 -10.403 -0.976 1.00 0.00 H new ATOM 0 HD1 PHE A 154 7.063 -11.247 -0.284 1.00 0.00 H new ATOM 0 HD2 PHE A 154 4.312 -13.309 -2.800 1.00 0.00 H new ATOM 0 HE1 PHE A 154 8.931 -12.423 -1.361 1.00 0.00 H new ATOM 0 HE2 PHE A 154 6.179 -14.488 -3.878 1.00 0.00 H new ATOM 0 HZ PHE A 154 8.493 -14.051 -3.156 1.00 0.00 H new ATOM 2296 N GLU A 155 2.625 -10.408 1.818 1.00 0.00 N ATOM 2297 CA GLU A 155 1.291 -10.094 2.317 1.00 0.00 C ATOM 2298 C GLU A 155 0.683 -8.926 1.545 1.00 0.00 C ATOM 2299 O GLU A 155 1.277 -7.851 1.456 1.00 0.00 O ATOM 2300 CB GLU A 155 1.346 -9.760 3.809 1.00 0.00 C ATOM 2301 CG GLU A 155 1.382 -10.986 4.706 1.00 0.00 C ATOM 2302 CD GLU A 155 2.770 -11.584 4.822 1.00 0.00 C ATOM 2303 OE1 GLU A 155 3.686 -11.096 4.127 1.00 0.00 O ATOM 2304 OE2 GLU A 155 2.941 -12.540 5.607 1.00 0.00 O ATOM 0 H GLU A 155 3.329 -9.699 2.020 1.00 0.00 H new ATOM 0 HA GLU A 155 0.660 -10.971 2.172 1.00 0.00 H new ATOM 0 HB2 GLU A 155 2.229 -9.151 4.004 1.00 0.00 H new ATOM 0 HB3 GLU A 155 0.478 -9.155 4.070 1.00 0.00 H new ATOM 0 HG2 GLU A 155 1.023 -10.716 5.699 1.00 0.00 H new ATOM 0 HG3 GLU A 155 0.698 -11.739 4.314 1.00 0.00 H new ATOM 2311 N CYS A 156 -0.503 -9.146 0.990 1.00 0.00 N ATOM 2312 CA CYS A 156 -1.193 -8.114 0.224 1.00 0.00 C ATOM 2313 C CYS A 156 -2.339 -7.512 1.031 1.00 0.00 C ATOM 2314 O CYS A 156 -3.361 -8.161 1.256 1.00 0.00 O ATOM 2315 CB CYS A 156 -1.725 -8.692 -1.088 1.00 0.00 C ATOM 2316 SG CYS A 156 -2.075 -7.449 -2.354 1.00 0.00 S ATOM 0 H CYS A 156 -1.007 -10.030 1.056 1.00 0.00 H new ATOM 0 HA CYS A 156 -0.477 -7.324 -0.000 1.00 0.00 H new ATOM 0 HB2 CYS A 156 -0.997 -9.401 -1.482 1.00 0.00 H new ATOM 0 HB3 CYS A 156 -2.637 -9.252 -0.882 1.00 0.00 H new ATOM 0 HG CYS A 156 -2.518 -8.035 -3.427 1.00 0.00 H new ATOM 2322 N HIS A 157 -2.161 -6.269 1.466 1.00 0.00 N ATOM 2323 CA HIS A 157 -3.181 -5.580 2.249 1.00 0.00 C ATOM 2324 C HIS A 157 -3.921 -4.555 1.396 1.00 0.00 C ATOM 2325 O HIS A 157 -3.304 -3.696 0.765 1.00 0.00 O ATOM 2326 CB HIS A 157 -2.547 -4.892 3.459 1.00 0.00 C ATOM 2327 CG HIS A 157 -1.869 -5.840 4.400 1.00 0.00 C ATOM 2328 ND1 HIS A 157 -2.510 -6.421 5.474 1.00 0.00 N ATOM 2329 CD2 HIS A 157 -0.600 -6.310 4.423 1.00 0.00 C ATOM 2330 CE1 HIS A 157 -1.664 -7.205 6.118 1.00 0.00 C ATOM 2331 NE2 HIS A 157 -0.497 -7.156 5.499 1.00 0.00 N ATOM 0 H HIS A 157 -1.321 -5.718 1.290 1.00 0.00 H new ATOM 0 HA HIS A 157 -3.899 -6.322 2.597 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -1.821 -4.158 3.110 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -3.318 -4.345 4.001 1.00 0.00 H new ATOM 0 HD2 HIS A 157 0.186 -6.065 3.724 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -1.888 -7.787 7.000 1.00 0.00 H new ATOM 0 HE2 HIS A 157 0.343 -7.664 5.776 1.00 0.00 H new ATOM 2339 N VAL A 158 -5.247 -4.651 1.381 1.00 0.00 N ATOM 2340 CA VAL A 158 -6.071 -3.731 0.605 1.00 0.00 C ATOM 2341 C VAL A 158 -6.713 -2.679 1.502 1.00 0.00 C ATOM 2342 O VAL A 158 -7.086 -2.962 2.641 1.00 0.00 O ATOM 2343 CB VAL A 158 -7.177 -4.480 -0.162 1.00 0.00 C ATOM 2344 CG1 VAL A 158 -7.955 -3.520 -1.049 1.00 0.00 C ATOM 2345 CG2 VAL A 158 -6.581 -5.614 -0.982 1.00 0.00 C ATOM 0 H VAL A 158 -5.773 -5.356 1.897 1.00 0.00 H new ATOM 0 HA VAL A 158 -5.411 -3.240 -0.110 1.00 0.00 H new ATOM 0 HB VAL A 158 -7.870 -4.911 0.561 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -8.732 -4.067 -1.583 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -8.414 -2.746 -0.433 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -7.278 -3.058 -1.767 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -7.376 -6.133 -1.518 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -5.866 -5.209 -1.698 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -6.073 -6.315 -0.319 1.00 0.00 H new ATOM 2355 N PHE A 159 -6.839 -1.463 0.982 1.00 0.00 N ATOM 2356 CA PHE A 159 -7.436 -0.366 1.736 1.00 0.00 C ATOM 2357 C PHE A 159 -8.260 0.536 0.822 1.00 0.00 C ATOM 2358 O PHE A 159 -7.887 0.782 -0.325 1.00 0.00 O ATOM 2359 CB PHE A 159 -6.348 0.452 2.434 1.00 0.00 C ATOM 2360 CG PHE A 159 -5.405 -0.381 3.254 1.00 0.00 C ATOM 2361 CD1 PHE A 159 -4.361 -1.065 2.652 1.00 0.00 C ATOM 2362 CD2 PHE A 159 -5.562 -0.480 4.627 1.00 0.00 C ATOM 2363 CE1 PHE A 159 -3.491 -1.832 3.404 1.00 0.00 C ATOM 2364 CE2 PHE A 159 -4.695 -1.245 5.384 1.00 0.00 C ATOM 2365 CZ PHE A 159 -3.659 -1.923 4.772 1.00 0.00 C ATOM 0 H PHE A 159 -6.536 -1.212 0.041 1.00 0.00 H new ATOM 0 HA PHE A 159 -8.099 -0.793 2.489 1.00 0.00 H new ATOM 0 HB2 PHE A 159 -5.778 0.999 1.683 1.00 0.00 H new ATOM 0 HB3 PHE A 159 -6.820 1.194 3.079 1.00 0.00 H new ATOM 0 HD1 PHE A 159 -4.225 -0.998 1.583 1.00 0.00 H new ATOM 0 HD2 PHE A 159 -6.371 0.047 5.111 1.00 0.00 H new ATOM 0 HE1 PHE A 159 -2.681 -2.359 2.923 1.00 0.00 H new ATOM 0 HE2 PHE A 159 -4.828 -1.313 6.454 1.00 0.00 H new ATOM 0 HZ PHE A 159 -2.982 -2.523 5.362 1.00 0.00 H new ATOM 2375 N TRP A 160 -9.381 1.026 1.339 1.00 0.00 N ATOM 2376 CA TRP A 160 -10.258 1.901 0.570 1.00 0.00 C ATOM 2377 C TRP A 160 -10.001 3.365 0.910 1.00 0.00 C ATOM 2378 O TRP A 160 -9.947 3.740 2.082 1.00 0.00 O ATOM 2379 CB TRP A 160 -11.723 1.552 0.840 1.00 0.00 C ATOM 2380 CG TRP A 160 -12.674 2.203 -0.118 1.00 0.00 C ATOM 2381 CD1 TRP A 160 -13.178 3.470 -0.040 1.00 0.00 C ATOM 2382 CD2 TRP A 160 -13.237 1.618 -1.298 1.00 0.00 C ATOM 2383 NE1 TRP A 160 -14.020 3.708 -1.099 1.00 0.00 N ATOM 2384 CE2 TRP A 160 -14.073 2.588 -1.886 1.00 0.00 C ATOM 2385 CE3 TRP A 160 -13.115 0.371 -1.915 1.00 0.00 C ATOM 2386 CZ2 TRP A 160 -14.782 2.346 -3.059 1.00 0.00 C ATOM 2387 CZ3 TRP A 160 -13.820 0.132 -3.080 1.00 0.00 C ATOM 2388 CH2 TRP A 160 -14.644 1.116 -3.643 1.00 0.00 C ATOM 0 H TRP A 160 -9.704 0.832 2.287 1.00 0.00 H new ATOM 0 HA TRP A 160 -10.044 1.750 -0.488 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -11.847 0.470 0.786 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -11.979 1.852 1.856 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -12.948 4.181 0.740 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -14.524 4.578 -1.271 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -12.481 -0.393 -1.490 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -15.419 3.102 -3.493 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -13.734 -0.829 -3.565 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -15.180 0.900 -4.555 1.00 0.00 H new ATOM 2399 N CYS A 161 -9.843 4.188 -0.121 1.00 0.00 N ATOM 2400 CA CYS A 161 -9.590 5.612 0.069 1.00 0.00 C ATOM 2401 C CYS A 161 -10.733 6.447 -0.497 1.00 0.00 C ATOM 2402 O CYS A 161 -11.495 5.981 -1.343 1.00 0.00 O ATOM 2403 CB CYS A 161 -8.272 6.010 -0.596 1.00 0.00 C ATOM 2404 SG CYS A 161 -6.835 5.092 0.003 1.00 0.00 S ATOM 0 H CYS A 161 -9.886 3.894 -1.097 1.00 0.00 H new ATOM 0 HA CYS A 161 -9.520 5.804 1.140 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -8.361 5.862 -1.672 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -8.103 7.075 -0.434 1.00 0.00 H new ATOM 0 HG CYS A 161 -5.769 5.499 -0.621 1.00 0.00 H new ATOM 2410 N GLU A 162 -10.847 7.684 -0.023 1.00 0.00 N ATOM 2411 CA GLU A 162 -11.899 8.583 -0.481 1.00 0.00 C ATOM 2412 C GLU A 162 -11.429 10.034 -0.445 1.00 0.00 C ATOM 2413 O GLU A 162 -10.645 10.438 0.414 1.00 0.00 O ATOM 2414 CB GLU A 162 -13.152 8.420 0.382 1.00 0.00 C ATOM 2415 CG GLU A 162 -13.856 7.088 0.187 1.00 0.00 C ATOM 2416 CD GLU A 162 -15.069 6.933 1.084 1.00 0.00 C ATOM 2417 OE1 GLU A 162 -14.895 6.925 2.320 1.00 0.00 O ATOM 2418 OE2 GLU A 162 -16.192 6.819 0.549 1.00 0.00 O ATOM 0 H GLU A 162 -10.224 8.086 0.678 1.00 0.00 H new ATOM 0 HA GLU A 162 -12.140 8.323 -1.512 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -12.876 8.526 1.431 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -13.848 9.227 0.153 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -14.164 6.993 -0.854 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -13.155 6.278 0.387 1.00 0.00 H new ATOM 2425 N PRO A 163 -11.919 10.839 -1.400 1.00 0.00 N ATOM 2426 CA PRO A 163 -12.853 10.369 -2.428 1.00 0.00 C ATOM 2427 C PRO A 163 -12.191 9.425 -3.426 1.00 0.00 C ATOM 2428 O PRO A 163 -12.827 8.958 -4.369 1.00 0.00 O ATOM 2429 CB PRO A 163 -13.292 11.660 -3.124 1.00 0.00 C ATOM 2430 CG PRO A 163 -12.170 12.613 -2.899 1.00 0.00 C ATOM 2431 CD PRO A 163 -11.598 12.268 -1.551 1.00 0.00 C ATOM 0 HA PRO A 163 -13.676 9.797 -2.000 1.00 0.00 H new ATOM 0 HB2 PRO A 163 -13.465 11.497 -4.188 1.00 0.00 H new ATOM 0 HB3 PRO A 163 -14.224 12.039 -2.704 1.00 0.00 H new ATOM 0 HG2 PRO A 163 -11.415 12.518 -3.679 1.00 0.00 H new ATOM 0 HG3 PRO A 163 -12.523 13.644 -2.921 1.00 0.00 H new ATOM 0 HD2 PRO A 163 -10.523 12.445 -1.513 1.00 0.00 H new ATOM 0 HD3 PRO A 163 -12.047 12.867 -0.759 1.00 0.00 H new ATOM 2439 N ASN A 164 -10.909 9.147 -3.209 1.00 0.00 N ATOM 2440 CA ASN A 164 -10.160 8.258 -4.090 1.00 0.00 C ATOM 2441 C ASN A 164 -8.783 7.950 -3.510 1.00 0.00 C ATOM 2442 O ASN A 164 -8.384 8.522 -2.496 1.00 0.00 O ATOM 2443 CB ASN A 164 -10.012 8.886 -5.478 1.00 0.00 C ATOM 2444 CG ASN A 164 -9.662 10.360 -5.410 1.00 0.00 C ATOM 2445 OD1 ASN A 164 -9.603 10.947 -4.330 1.00 0.00 O ATOM 2446 ND2 ASN A 164 -9.427 10.965 -6.569 1.00 0.00 N ATOM 0 H ASN A 164 -10.368 9.524 -2.431 1.00 0.00 H new ATOM 0 HA ASN A 164 -10.715 7.324 -4.178 1.00 0.00 H new ATOM 0 HB2 ASN A 164 -9.238 8.356 -6.033 1.00 0.00 H new ATOM 0 HB3 ASN A 164 -10.943 8.761 -6.032 1.00 0.00 H new ATOM 0 HD21 ASN A 164 -9.186 11.956 -6.587 1.00 0.00 H new ATOM 0 HD22 ASN A 164 -9.487 10.439 -7.441 1.00 0.00 H new ATOM 2453 N ALA A 165 -8.063 7.042 -4.160 1.00 0.00 N ATOM 2454 CA ALA A 165 -6.730 6.660 -3.711 1.00 0.00 C ATOM 2455 C ALA A 165 -5.655 7.465 -4.433 1.00 0.00 C ATOM 2456 O ALA A 165 -4.524 7.006 -4.592 1.00 0.00 O ATOM 2457 CB ALA A 165 -6.508 5.170 -3.924 1.00 0.00 C ATOM 0 H ALA A 165 -8.380 6.557 -4.999 1.00 0.00 H new ATOM 0 HA ALA A 165 -6.656 6.879 -2.646 1.00 0.00 H new ATOM 0 HB1 ALA A 165 -5.508 4.899 -3.584 1.00 0.00 H new ATOM 0 HB2 ALA A 165 -7.249 4.607 -3.357 1.00 0.00 H new ATOM 0 HB3 ALA A 165 -6.607 4.935 -4.984 1.00 0.00 H new ATOM 2463 N ALA A 166 -6.016 8.668 -4.868 1.00 0.00 N ATOM 2464 CA ALA A 166 -5.081 9.537 -5.573 1.00 0.00 C ATOM 2465 C ALA A 166 -4.074 10.155 -4.609 1.00 0.00 C ATOM 2466 O ALA A 166 -2.865 10.012 -4.784 1.00 0.00 O ATOM 2467 CB ALA A 166 -5.835 10.626 -6.321 1.00 0.00 C ATOM 0 H ALA A 166 -6.948 9.063 -4.745 1.00 0.00 H new ATOM 0 HA ALA A 166 -4.531 8.931 -6.293 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -5.125 11.268 -6.843 1.00 0.00 H new ATOM 0 HB2 ALA A 166 -6.511 10.170 -7.044 1.00 0.00 H new ATOM 0 HB3 ALA A 166 -6.410 11.222 -5.613 1.00 0.00 H new ATOM 2473 N ASN A 167 -4.581 10.844 -3.592 1.00 0.00 N ATOM 2474 CA ASN A 167 -3.725 11.486 -2.601 1.00 0.00 C ATOM 2475 C ASN A 167 -2.773 10.475 -1.968 1.00 0.00 C ATOM 2476 O ASN A 167 -1.559 10.679 -1.945 1.00 0.00 O ATOM 2477 CB ASN A 167 -4.574 12.151 -1.516 1.00 0.00 C ATOM 2478 CG ASN A 167 -5.024 13.545 -1.908 1.00 0.00 C ATOM 2479 OD1 ASN A 167 -4.203 14.428 -2.155 1.00 0.00 O ATOM 2480 ND2 ASN A 167 -6.335 13.748 -1.966 1.00 0.00 N ATOM 0 H ASN A 167 -5.580 10.972 -3.432 1.00 0.00 H new ATOM 0 HA ASN A 167 -3.134 12.248 -3.108 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -5.449 11.533 -1.313 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -4.000 12.204 -0.591 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -6.698 14.666 -2.224 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -6.979 12.986 -1.753 1.00 0.00 H new ATOM 2487 N VAL A 168 -3.332 9.383 -1.457 1.00 0.00 N ATOM 2488 CA VAL A 168 -2.534 8.339 -0.826 1.00 0.00 C ATOM 2489 C VAL A 168 -1.493 7.783 -1.792 1.00 0.00 C ATOM 2490 O VAL A 168 -0.290 7.913 -1.566 1.00 0.00 O ATOM 2491 CB VAL A 168 -3.419 7.183 -0.321 1.00 0.00 C ATOM 2492 CG1 VAL A 168 -2.564 6.085 0.292 1.00 0.00 C ATOM 2493 CG2 VAL A 168 -4.443 7.695 0.680 1.00 0.00 C ATOM 0 H VAL A 168 -4.335 9.198 -1.468 1.00 0.00 H new ATOM 0 HA VAL A 168 -2.029 8.798 0.024 1.00 0.00 H new ATOM 0 HB VAL A 168 -3.955 6.761 -1.171 1.00 0.00 H new ATOM 0 HG11 VAL A 168 -3.206 5.277 0.643 1.00 0.00 H new ATOM 0 HG12 VAL A 168 -1.874 5.700 -0.458 1.00 0.00 H new ATOM 0 HG13 VAL A 168 -1.999 6.490 1.131 1.00 0.00 H new ATOM 0 HG21 VAL A 168 -5.060 6.866 1.026 1.00 0.00 H new ATOM 0 HG22 VAL A 168 -3.928 8.144 1.529 1.00 0.00 H new ATOM 0 HG23 VAL A 168 -5.076 8.443 0.203 1.00 0.00 H new ATOM 2503 N SER A 169 -1.965 7.164 -2.869 1.00 0.00 N ATOM 2504 CA SER A 169 -1.075 6.585 -3.869 1.00 0.00 C ATOM 2505 C SER A 169 0.069 7.540 -4.196 1.00 0.00 C ATOM 2506 O SER A 169 1.229 7.135 -4.264 1.00 0.00 O ATOM 2507 CB SER A 169 -1.854 6.249 -5.142 1.00 0.00 C ATOM 2508 OG SER A 169 -2.265 7.427 -5.814 1.00 0.00 O ATOM 0 H SER A 169 -2.958 7.050 -3.072 1.00 0.00 H new ATOM 0 HA SER A 169 -0.653 5.668 -3.457 1.00 0.00 H new ATOM 0 HB2 SER A 169 -1.232 5.647 -5.804 1.00 0.00 H new ATOM 0 HB3 SER A 169 -2.727 5.647 -4.890 1.00 0.00 H new ATOM 0 HG SER A 169 -3.108 7.746 -5.429 1.00 0.00 H new ATOM 2514 N GLU A 170 -0.268 8.810 -4.398 1.00 0.00 N ATOM 2515 CA GLU A 170 0.730 9.823 -4.719 1.00 0.00 C ATOM 2516 C GLU A 170 1.690 10.031 -3.551 1.00 0.00 C ATOM 2517 O GLU A 170 2.899 10.155 -3.742 1.00 0.00 O ATOM 2518 CB GLU A 170 0.050 11.146 -5.077 1.00 0.00 C ATOM 2519 CG GLU A 170 1.019 12.306 -5.233 1.00 0.00 C ATOM 2520 CD GLU A 170 1.549 12.437 -6.648 1.00 0.00 C ATOM 2521 OE1 GLU A 170 2.284 11.531 -7.093 1.00 0.00 O ATOM 2522 OE2 GLU A 170 1.228 13.446 -7.310 1.00 0.00 O ATOM 0 H GLU A 170 -1.224 9.161 -4.345 1.00 0.00 H new ATOM 0 HA GLU A 170 1.302 9.473 -5.578 1.00 0.00 H new ATOM 0 HB2 GLU A 170 -0.505 11.020 -6.007 1.00 0.00 H new ATOM 0 HB3 GLU A 170 -0.677 11.392 -4.303 1.00 0.00 H new ATOM 0 HG2 GLU A 170 0.520 13.232 -4.949 1.00 0.00 H new ATOM 0 HG3 GLU A 170 1.855 12.171 -4.547 1.00 0.00 H new ATOM 2529 N ALA A 171 1.140 10.068 -2.341 1.00 0.00 N ATOM 2530 CA ALA A 171 1.946 10.260 -1.142 1.00 0.00 C ATOM 2531 C ALA A 171 2.968 9.139 -0.983 1.00 0.00 C ATOM 2532 O ALA A 171 4.132 9.387 -0.666 1.00 0.00 O ATOM 2533 CB ALA A 171 1.052 10.341 0.087 1.00 0.00 C ATOM 0 H ALA A 171 0.140 9.968 -2.166 1.00 0.00 H new ATOM 0 HA ALA A 171 2.489 11.199 -1.245 1.00 0.00 H new ATOM 0 HB1 ALA A 171 1.667 10.484 0.975 1.00 0.00 H new ATOM 0 HB2 ALA A 171 0.365 11.180 -0.018 1.00 0.00 H new ATOM 0 HB3 ALA A 171 0.483 9.416 0.185 1.00 0.00 H new ATOM 2539 N VAL A 172 2.525 7.905 -1.203 1.00 0.00 N ATOM 2540 CA VAL A 172 3.402 6.746 -1.084 1.00 0.00 C ATOM 2541 C VAL A 172 4.492 6.770 -2.150 1.00 0.00 C ATOM 2542 O VAL A 172 5.633 6.388 -1.892 1.00 0.00 O ATOM 2543 CB VAL A 172 2.611 5.430 -1.203 1.00 0.00 C ATOM 2544 CG1 VAL A 172 3.553 4.236 -1.174 1.00 0.00 C ATOM 2545 CG2 VAL A 172 1.575 5.329 -0.094 1.00 0.00 C ATOM 0 H VAL A 172 1.565 7.682 -1.464 1.00 0.00 H new ATOM 0 HA VAL A 172 3.862 6.797 -0.097 1.00 0.00 H new ATOM 0 HB VAL A 172 2.088 5.426 -2.159 1.00 0.00 H new ATOM 0 HG11 VAL A 172 2.976 3.315 -1.259 1.00 0.00 H new ATOM 0 HG12 VAL A 172 4.253 4.304 -2.007 1.00 0.00 H new ATOM 0 HG13 VAL A 172 4.106 4.232 -0.235 1.00 0.00 H new ATOM 0 HG21 VAL A 172 1.025 4.393 -0.194 1.00 0.00 H new ATOM 0 HG22 VAL A 172 2.075 5.355 0.874 1.00 0.00 H new ATOM 0 HG23 VAL A 172 0.881 6.167 -0.167 1.00 0.00 H new ATOM 2555 N GLN A 173 4.132 7.221 -3.347 1.00 0.00 N ATOM 2556 CA GLN A 173 5.080 7.294 -4.452 1.00 0.00 C ATOM 2557 C GLN A 173 6.310 8.106 -4.061 1.00 0.00 C ATOM 2558 O GLN A 173 7.423 7.582 -4.019 1.00 0.00 O ATOM 2559 CB GLN A 173 4.415 7.915 -5.682 1.00 0.00 C ATOM 2560 CG GLN A 173 3.745 6.896 -6.590 1.00 0.00 C ATOM 2561 CD GLN A 173 3.701 7.345 -8.038 1.00 0.00 C ATOM 2562 OE1 GLN A 173 4.242 6.681 -8.922 1.00 0.00 O ATOM 2563 NE2 GLN A 173 3.055 8.478 -8.287 1.00 0.00 N ATOM 0 H GLN A 173 3.191 7.541 -3.576 1.00 0.00 H new ATOM 0 HA GLN A 173 5.398 6.279 -4.692 1.00 0.00 H new ATOM 0 HB2 GLN A 173 3.672 8.642 -5.355 1.00 0.00 H new ATOM 0 HB3 GLN A 173 5.165 8.461 -6.254 1.00 0.00 H new ATOM 0 HG2 GLN A 173 4.280 5.948 -6.523 1.00 0.00 H new ATOM 0 HG3 GLN A 173 2.729 6.714 -6.239 1.00 0.00 H new ATOM 0 HE21 GLN A 173 2.621 8.996 -7.523 1.00 0.00 H new ATOM 0 HE22 GLN A 173 2.993 8.830 -9.242 1.00 0.00 H new ATOM 2572 N ALA A 174 6.102 9.387 -3.776 1.00 0.00 N ATOM 2573 CA ALA A 174 7.194 10.270 -3.386 1.00 0.00 C ATOM 2574 C ALA A 174 8.051 9.636 -2.296 1.00 0.00 C ATOM 2575 O ALA A 174 9.279 9.713 -2.335 1.00 0.00 O ATOM 2576 CB ALA A 174 6.647 11.611 -2.918 1.00 0.00 C ATOM 0 H ALA A 174 5.187 9.837 -3.808 1.00 0.00 H new ATOM 0 HA ALA A 174 7.826 10.433 -4.259 1.00 0.00 H new ATOM 0 HB1 ALA A 174 7.474 12.261 -2.630 1.00 0.00 H new ATOM 0 HB2 ALA A 174 6.084 12.077 -3.727 1.00 0.00 H new ATOM 0 HB3 ALA A 174 5.991 11.457 -2.061 1.00 0.00 H new ATOM 2582 N ALA A 175 7.396 9.010 -1.324 1.00 0.00 N ATOM 2583 CA ALA A 175 8.098 8.361 -0.224 1.00 0.00 C ATOM 2584 C ALA A 175 9.333 7.618 -0.723 1.00 0.00 C ATOM 2585 O ALA A 175 10.423 7.764 -0.169 1.00 0.00 O ATOM 2586 CB ALA A 175 7.166 7.408 0.509 1.00 0.00 C ATOM 0 H ALA A 175 6.380 8.939 -1.276 1.00 0.00 H new ATOM 0 HA ALA A 175 8.427 9.134 0.470 1.00 0.00 H new ATOM 0 HB1 ALA A 175 7.704 6.931 1.328 1.00 0.00 H new ATOM 0 HB2 ALA A 175 6.317 7.964 0.908 1.00 0.00 H new ATOM 0 HB3 ALA A 175 6.808 6.646 -0.183 1.00 0.00 H new ATOM 2592 N CYS A 176 9.154 6.821 -1.770 1.00 0.00 N ATOM 2593 CA CYS A 176 10.254 6.053 -2.343 1.00 0.00 C ATOM 2594 C CYS A 176 11.408 6.968 -2.738 1.00 0.00 C ATOM 2595 O CYS A 176 12.292 6.576 -3.500 1.00 0.00 O ATOM 2596 CB CYS A 176 9.773 5.264 -3.561 1.00 0.00 C ATOM 2597 SG CYS A 176 8.403 4.135 -3.216 1.00 0.00 S ATOM 0 H CYS A 176 8.258 6.689 -2.240 1.00 0.00 H new ATOM 0 HA CYS A 176 10.610 5.355 -1.585 1.00 0.00 H new ATOM 0 HB2 CYS A 176 9.465 5.966 -4.336 1.00 0.00 H new ATOM 0 HB3 CYS A 176 10.609 4.692 -3.963 1.00 0.00 H new ATOM 0 HG CYS A 176 8.066 3.515 -4.308 1.00 0.00 H new