USER MOD reduce.3.24.130724 H: found=0, std=0, add=1111, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1112 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 99 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 100 ASN :FLIP amide:sc= -0.127 F(o=-1.3,f=-0.13) USER MOD Set 2.1: A 69 LYS NZ :NH3+ -169:sc= 0.951 (180deg=0) USER MOD Set 2.2: A 110 SER OG : rot -150:sc= 0.824 USER MOD Set 3.1: A 56 MET CE :methyl -110:sc= -0.228 (180deg=-1.08) USER MOD Set 3.2: A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 52 TYR OH : rot 55:sc= 1.25 USER MOD Set 4.2: A 136 HIS : no HE2:sc= 0.541 K(o=1.8,f=-5.9!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 GLN : amide:sc= 0.0229 K(o=0.023,f=-5.5!) USER MOD Single : A 29 THR OG1 : rot 72:sc= 1.28 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -166:sc= -0.0346 (180deg=-0.216) USER MOD Single : A 35 THR OG1 : rot 3:sc= -0.738 USER MOD Single : A 36 SER OG : rot 87:sc= 1.17 USER MOD Single : A 40 SER OG : rot 180:sc=0.000291 USER MOD Single : A 41 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0303) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.315 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN :FLIP amide:sc= -1.08! C(o=-2.8!,f=-1.1!) USER MOD Single : A 62 TYR OH : rot -90:sc= 0.32 USER MOD Single : A 70 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0159) USER MOD Single : A 72 THR OG1 : rot 74:sc= 0.112 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 THR OG1 : rot -111:sc= 0.303 USER MOD Single : A 79 LYS NZ :NH3+ -123:sc= 0.515 (180deg=-0.816!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -7:sc= 0.677 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ -168:sc= 0.694 (180deg=0.505) USER MOD Single : A 103 THR OG1 : rot 73:sc= 0.279 USER MOD Single : A 107 THR OG1 : rot -158:sc= 0.764 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 GLN : amide:sc= -0.0429 X(o=-0.043,f=-0.043) USER MOD Single : A 117 THR OG1 : rot -129:sc= 0.0954 USER MOD Single : A 118 THR OG1 : rot -25:sc= 1.12 USER MOD Single : A 119 CYS SG : rot 9:sc= 0.0731 USER MOD Single : A 125 GLN : amide:sc= -0.211 K(o=-0.21,f=-3!) USER MOD Single : A 127 TYR OH : rot 15:sc= 0.0106 USER MOD Single : A 134 ASN : amide:sc= 0.0375 K(o=0.038,f=-0.86) USER MOD Single : A 135 LYS NZ :NH3+ -119:sc= 0.361 (180deg=-1.18!) USER MOD Single : A 139 ASN : amide:sc= -1.27 K(o=-1.3,f=-3.6!) USER MOD Single : A 145 GLN : amide:sc= -0.0476 X(o=-0.048,f=0.11) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 200 N ILE A 15 11.862 8.108 -16.976 1.00 0.00 N ATOM 201 CA ILE A 15 10.744 8.096 -16.017 1.00 0.00 C ATOM 202 C ILE A 15 10.803 6.819 -15.160 1.00 0.00 C ATOM 203 O ILE A 15 10.789 6.894 -13.939 1.00 0.00 O ATOM 204 CB ILE A 15 9.349 8.216 -16.753 1.00 0.00 C ATOM 205 CG1 ILE A 15 9.224 9.593 -17.487 1.00 0.00 C ATOM 206 CG2 ILE A 15 8.154 7.992 -15.787 1.00 0.00 C ATOM 207 CD1 ILE A 15 9.311 10.817 -16.586 1.00 0.00 C ATOM 0 HA ILE A 15 10.842 8.964 -15.366 1.00 0.00 H new ATOM 0 HB ILE A 15 9.310 7.421 -17.498 1.00 0.00 H new ATOM 0 HG12 ILE A 15 10.010 9.659 -18.239 1.00 0.00 H new ATOM 0 HG13 ILE A 15 8.272 9.619 -18.018 1.00 0.00 H new ATOM 0 HG21 ILE A 15 7.218 8.084 -16.338 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.221 6.996 -15.350 1.00 0.00 H new ATOM 0 HG23 ILE A 15 8.183 8.739 -14.993 1.00 0.00 H new ATOM 0 HD11 ILE A 15 9.214 11.720 -17.189 1.00 0.00 H new ATOM 0 HD12 ILE A 15 8.508 10.784 -15.849 1.00 0.00 H new ATOM 0 HD13 ILE A 15 10.273 10.824 -16.074 1.00 0.00 H new ATOM 219 N GLU A 16 10.928 5.655 -15.817 1.00 0.00 N ATOM 220 CA GLU A 16 10.993 4.350 -15.127 1.00 0.00 C ATOM 221 C GLU A 16 12.347 4.146 -14.421 1.00 0.00 C ATOM 222 O GLU A 16 12.455 3.296 -13.542 1.00 0.00 O ATOM 223 CB GLU A 16 10.715 3.193 -16.111 1.00 0.00 C ATOM 224 CG GLU A 16 9.306 3.205 -16.727 1.00 0.00 C ATOM 225 CD GLU A 16 9.011 1.942 -17.550 1.00 0.00 C ATOM 226 OE1 GLU A 16 9.499 1.832 -18.690 1.00 0.00 O ATOM 227 OE2 GLU A 16 8.307 1.039 -17.048 1.00 0.00 O ATOM 0 H GLU A 16 10.987 5.588 -16.833 1.00 0.00 H new ATOM 0 HA GLU A 16 10.217 4.348 -14.362 1.00 0.00 H new ATOM 0 HB2 GLU A 16 11.450 3.232 -16.915 1.00 0.00 H new ATOM 0 HB3 GLU A 16 10.862 2.247 -15.590 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.566 3.297 -15.932 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.199 4.083 -17.364 1.00 0.00 H new ATOM 234 N LYS A 17 13.366 4.927 -14.821 1.00 0.00 N ATOM 235 CA LYS A 17 14.691 4.924 -14.171 1.00 0.00 C ATOM 236 C LYS A 17 14.553 5.420 -12.722 1.00 0.00 C ATOM 237 O LYS A 17 14.822 4.674 -11.769 1.00 0.00 O ATOM 238 CB LYS A 17 15.663 5.837 -14.962 1.00 0.00 C ATOM 239 CG LYS A 17 17.108 5.917 -14.413 1.00 0.00 C ATOM 240 CD LYS A 17 17.931 7.047 -15.085 1.00 0.00 C ATOM 241 CE LYS A 17 18.018 6.906 -16.617 1.00 0.00 C ATOM 242 NZ LYS A 17 18.592 8.123 -17.251 1.00 0.00 N ATOM 0 H LYS A 17 13.296 5.578 -15.603 1.00 0.00 H new ATOM 0 HA LYS A 17 15.091 3.910 -14.162 1.00 0.00 H new ATOM 0 HB2 LYS A 17 15.705 5.485 -15.993 1.00 0.00 H new ATOM 0 HB3 LYS A 17 15.247 6.844 -14.986 1.00 0.00 H new ATOM 0 HG2 LYS A 17 17.077 6.084 -13.336 1.00 0.00 H new ATOM 0 HG3 LYS A 17 17.608 4.962 -14.573 1.00 0.00 H new ATOM 0 HD2 LYS A 17 17.482 8.010 -14.840 1.00 0.00 H new ATOM 0 HD3 LYS A 17 18.939 7.050 -14.669 1.00 0.00 H new ATOM 0 HE2 LYS A 17 18.632 6.041 -16.868 1.00 0.00 H new ATOM 0 HE3 LYS A 17 17.023 6.720 -17.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 18.635 7.990 -18.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 17.992 8.944 -17.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 19.551 8.287 -16.883 1.00 0.00 H new ATOM 256 N GLN A 18 14.072 6.674 -12.583 1.00 0.00 N ATOM 257 CA GLN A 18 13.891 7.332 -11.279 1.00 0.00 C ATOM 258 C GLN A 18 12.766 6.662 -10.468 1.00 0.00 C ATOM 259 O GLN A 18 12.837 6.592 -9.247 1.00 0.00 O ATOM 260 CB GLN A 18 13.589 8.837 -11.469 1.00 0.00 C ATOM 261 CG GLN A 18 12.327 9.118 -12.297 1.00 0.00 C ATOM 262 CD GLN A 18 12.037 10.591 -12.451 1.00 0.00 C ATOM 263 OE1 GLN A 18 12.475 11.222 -13.403 1.00 0.00 O ATOM 264 NE2 GLN A 18 11.331 11.149 -11.494 1.00 0.00 N ATOM 0 H GLN A 18 13.799 7.256 -13.375 1.00 0.00 H new ATOM 0 HA GLN A 18 14.821 7.227 -10.720 1.00 0.00 H new ATOM 0 HB2 GLN A 18 13.480 9.302 -10.489 1.00 0.00 H new ATOM 0 HB3 GLN A 18 14.443 9.311 -11.954 1.00 0.00 H new ATOM 0 HG2 GLN A 18 12.440 8.671 -13.285 1.00 0.00 H new ATOM 0 HG3 GLN A 18 11.473 8.633 -11.823 1.00 0.00 H new ATOM 0 HE21 GLN A 18 10.986 10.583 -10.719 1.00 0.00 H new ATOM 0 HE22 GLN A 18 11.128 12.148 -11.526 1.00 0.00 H new ATOM 273 N PHE A 19 11.741 6.178 -11.180 1.00 0.00 N ATOM 274 CA PHE A 19 10.568 5.508 -10.593 1.00 0.00 C ATOM 275 C PHE A 19 10.973 4.194 -9.910 1.00 0.00 C ATOM 276 O PHE A 19 10.610 3.962 -8.757 1.00 0.00 O ATOM 277 CB PHE A 19 9.518 5.276 -11.715 1.00 0.00 C ATOM 278 CG PHE A 19 8.337 4.363 -11.389 1.00 0.00 C ATOM 279 CD1 PHE A 19 7.614 4.511 -10.213 1.00 0.00 C ATOM 280 CD2 PHE A 19 7.941 3.365 -12.281 1.00 0.00 C ATOM 281 CE1 PHE A 19 6.537 3.691 -9.936 1.00 0.00 C ATOM 282 CE2 PHE A 19 6.869 2.550 -11.998 1.00 0.00 C ATOM 283 CZ PHE A 19 6.167 2.717 -10.829 1.00 0.00 C ATOM 0 H PHE A 19 11.700 6.241 -12.197 1.00 0.00 H new ATOM 0 HA PHE A 19 10.128 6.138 -9.820 1.00 0.00 H new ATOM 0 HB2 PHE A 19 9.122 6.247 -12.013 1.00 0.00 H new ATOM 0 HB3 PHE A 19 10.035 4.863 -12.581 1.00 0.00 H new ATOM 0 HD1 PHE A 19 7.897 5.277 -9.506 1.00 0.00 H new ATOM 0 HD2 PHE A 19 8.483 3.231 -13.205 1.00 0.00 H new ATOM 0 HE1 PHE A 19 5.986 3.817 -9.016 1.00 0.00 H new ATOM 0 HE2 PHE A 19 6.579 1.778 -12.696 1.00 0.00 H new ATOM 0 HZ PHE A 19 5.322 2.080 -10.612 1.00 0.00 H new ATOM 293 N ALA A 20 11.749 3.363 -10.625 1.00 0.00 N ATOM 294 CA ALA A 20 12.165 2.042 -10.130 1.00 0.00 C ATOM 295 C ALA A 20 13.065 2.179 -8.894 1.00 0.00 C ATOM 296 O ALA A 20 12.833 1.509 -7.875 1.00 0.00 O ATOM 297 CB ALA A 20 12.869 1.239 -11.233 1.00 0.00 C ATOM 0 H ALA A 20 12.103 3.586 -11.555 1.00 0.00 H new ATOM 0 HA ALA A 20 11.269 1.496 -9.836 1.00 0.00 H new ATOM 0 HB1 ALA A 20 13.167 0.266 -10.841 1.00 0.00 H new ATOM 0 HB2 ALA A 20 12.188 1.099 -12.072 1.00 0.00 H new ATOM 0 HB3 ALA A 20 13.753 1.781 -11.569 1.00 0.00 H new ATOM 303 N VAL A 21 14.071 3.083 -8.986 1.00 0.00 N ATOM 304 CA VAL A 21 15.028 3.295 -7.890 1.00 0.00 C ATOM 305 C VAL A 21 14.318 3.861 -6.642 1.00 0.00 C ATOM 306 O VAL A 21 14.383 3.245 -5.587 1.00 0.00 O ATOM 307 CB VAL A 21 16.276 4.184 -8.300 1.00 0.00 C ATOM 308 CG1 VAL A 21 15.876 5.567 -8.831 1.00 0.00 C ATOM 309 CG2 VAL A 21 17.276 4.330 -7.128 1.00 0.00 C ATOM 0 H VAL A 21 14.234 3.669 -9.804 1.00 0.00 H new ATOM 0 HA VAL A 21 15.434 2.314 -7.645 1.00 0.00 H new ATOM 0 HB VAL A 21 16.765 3.653 -9.117 1.00 0.00 H new ATOM 0 HG11 VAL A 21 16.772 6.129 -9.095 1.00 0.00 H new ATOM 0 HG12 VAL A 21 15.248 5.450 -9.714 1.00 0.00 H new ATOM 0 HG13 VAL A 21 15.323 6.106 -8.062 1.00 0.00 H new ATOM 0 HG21 VAL A 21 18.119 4.945 -7.443 1.00 0.00 H new ATOM 0 HG22 VAL A 21 16.778 4.803 -6.282 1.00 0.00 H new ATOM 0 HG23 VAL A 21 17.636 3.345 -6.832 1.00 0.00 H new ATOM 319 N VAL A 22 13.561 4.978 -6.788 1.00 0.00 N ATOM 320 CA VAL A 22 12.953 5.676 -5.630 1.00 0.00 C ATOM 321 C VAL A 22 11.938 4.772 -4.908 1.00 0.00 C ATOM 322 O VAL A 22 11.838 4.801 -3.683 1.00 0.00 O ATOM 323 CB VAL A 22 12.277 7.048 -6.025 1.00 0.00 C ATOM 324 CG1 VAL A 22 10.923 6.877 -6.766 1.00 0.00 C ATOM 325 CG2 VAL A 22 12.144 7.978 -4.791 1.00 0.00 C ATOM 0 H VAL A 22 13.359 5.411 -7.689 1.00 0.00 H new ATOM 0 HA VAL A 22 13.773 5.906 -4.950 1.00 0.00 H new ATOM 0 HB VAL A 22 12.945 7.526 -6.742 1.00 0.00 H new ATOM 0 HG11 VAL A 22 10.514 7.858 -7.008 1.00 0.00 H new ATOM 0 HG12 VAL A 22 11.080 6.313 -7.685 1.00 0.00 H new ATOM 0 HG13 VAL A 22 10.223 6.340 -6.126 1.00 0.00 H new ATOM 0 HG21 VAL A 22 11.676 8.916 -5.091 1.00 0.00 H new ATOM 0 HG22 VAL A 22 11.530 7.492 -4.033 1.00 0.00 H new ATOM 0 HG23 VAL A 22 13.133 8.182 -4.381 1.00 0.00 H new ATOM 335 N ALA A 23 11.243 3.922 -5.688 1.00 0.00 N ATOM 336 CA ALA A 23 10.227 3.016 -5.179 1.00 0.00 C ATOM 337 C ALA A 23 10.859 2.011 -4.206 1.00 0.00 C ATOM 338 O ALA A 23 10.427 1.890 -3.050 1.00 0.00 O ATOM 339 CB ALA A 23 9.549 2.307 -6.363 1.00 0.00 C ATOM 0 H ALA A 23 11.381 3.854 -6.696 1.00 0.00 H new ATOM 0 HA ALA A 23 9.469 3.573 -4.629 1.00 0.00 H new ATOM 0 HB1 ALA A 23 8.785 1.625 -5.990 1.00 0.00 H new ATOM 0 HB2 ALA A 23 9.087 3.048 -7.015 1.00 0.00 H new ATOM 0 HB3 ALA A 23 10.294 1.744 -6.925 1.00 0.00 H new ATOM 345 N VAL A 24 11.920 1.326 -4.678 1.00 0.00 N ATOM 346 CA VAL A 24 12.614 0.283 -3.898 1.00 0.00 C ATOM 347 C VAL A 24 13.412 0.890 -2.722 1.00 0.00 C ATOM 348 O VAL A 24 13.678 0.186 -1.738 1.00 0.00 O ATOM 349 CB VAL A 24 13.534 -0.635 -4.792 1.00 0.00 C ATOM 350 CG1 VAL A 24 12.709 -1.320 -5.914 1.00 0.00 C ATOM 351 CG2 VAL A 24 14.737 0.143 -5.377 1.00 0.00 C ATOM 0 H VAL A 24 12.317 1.479 -5.605 1.00 0.00 H new ATOM 0 HA VAL A 24 11.835 -0.358 -3.484 1.00 0.00 H new ATOM 0 HB VAL A 24 13.942 -1.413 -4.146 1.00 0.00 H new ATOM 0 HG11 VAL A 24 13.365 -1.948 -6.517 1.00 0.00 H new ATOM 0 HG12 VAL A 24 11.928 -1.936 -5.467 1.00 0.00 H new ATOM 0 HG13 VAL A 24 12.253 -0.559 -6.547 1.00 0.00 H new ATOM 0 HG21 VAL A 24 15.343 -0.528 -5.986 1.00 0.00 H new ATOM 0 HG22 VAL A 24 14.374 0.964 -5.995 1.00 0.00 H new ATOM 0 HG23 VAL A 24 15.343 0.542 -4.563 1.00 0.00 H new ATOM 361 N GLU A 25 13.791 2.197 -2.828 1.00 0.00 N ATOM 362 CA GLU A 25 14.432 2.925 -1.710 1.00 0.00 C ATOM 363 C GLU A 25 13.468 2.994 -0.512 1.00 0.00 C ATOM 364 O GLU A 25 13.849 2.641 0.604 1.00 0.00 O ATOM 365 CB GLU A 25 14.888 4.367 -2.093 1.00 0.00 C ATOM 366 CG GLU A 25 15.917 4.467 -3.242 1.00 0.00 C ATOM 367 CD GLU A 25 17.048 3.416 -3.181 1.00 0.00 C ATOM 368 OE1 GLU A 25 17.952 3.546 -2.324 1.00 0.00 O ATOM 369 OE2 GLU A 25 17.048 2.453 -3.994 1.00 0.00 O ATOM 0 H GLU A 25 13.662 2.757 -3.671 1.00 0.00 H new ATOM 0 HA GLU A 25 15.331 2.366 -1.449 1.00 0.00 H new ATOM 0 HB2 GLU A 25 14.006 4.945 -2.370 1.00 0.00 H new ATOM 0 HB3 GLU A 25 15.314 4.840 -1.208 1.00 0.00 H new ATOM 0 HG2 GLU A 25 15.393 4.364 -4.192 1.00 0.00 H new ATOM 0 HG3 GLU A 25 16.362 5.462 -3.229 1.00 0.00 H new ATOM 376 N GLN A 26 12.205 3.428 -0.764 1.00 0.00 N ATOM 377 CA GLN A 26 11.162 3.470 0.288 1.00 0.00 C ATOM 378 C GLN A 26 10.848 2.057 0.809 1.00 0.00 C ATOM 379 O GLN A 26 10.709 1.872 2.014 1.00 0.00 O ATOM 380 CB GLN A 26 9.845 4.178 -0.182 1.00 0.00 C ATOM 381 CG GLN A 26 9.893 5.727 -0.179 1.00 0.00 C ATOM 382 CD GLN A 26 10.562 6.349 -1.405 1.00 0.00 C ATOM 383 OE1 GLN A 26 9.890 6.657 -2.394 1.00 0.00 O ATOM 384 NE2 GLN A 26 11.880 6.512 -1.367 1.00 0.00 N ATOM 0 H GLN A 26 11.889 3.750 -1.679 1.00 0.00 H new ATOM 0 HA GLN A 26 11.574 4.069 1.100 1.00 0.00 H new ATOM 0 HB2 GLN A 26 9.609 3.839 -1.191 1.00 0.00 H new ATOM 0 HB3 GLN A 26 9.027 3.854 0.462 1.00 0.00 H new ATOM 0 HG2 GLN A 26 8.874 6.108 -0.106 1.00 0.00 H new ATOM 0 HG3 GLN A 26 10.423 6.059 0.714 1.00 0.00 H new ATOM 0 HE21 GLN A 26 12.403 6.246 -0.533 1.00 0.00 H new ATOM 0 HE22 GLN A 26 12.369 6.903 -2.172 1.00 0.00 H new ATOM 393 N ALA A 27 10.785 1.067 -0.105 1.00 0.00 N ATOM 394 CA ALA A 27 10.428 -0.333 0.235 1.00 0.00 C ATOM 395 C ALA A 27 11.351 -0.911 1.327 1.00 0.00 C ATOM 396 O ALA A 27 10.872 -1.481 2.320 1.00 0.00 O ATOM 397 CB ALA A 27 10.472 -1.215 -1.021 1.00 0.00 C ATOM 0 H ALA A 27 10.979 1.211 -1.096 1.00 0.00 H new ATOM 0 HA ALA A 27 9.413 -0.326 0.632 1.00 0.00 H new ATOM 0 HB1 ALA A 27 10.208 -2.239 -0.756 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.763 -0.836 -1.757 1.00 0.00 H new ATOM 0 HB3 ALA A 27 11.477 -1.197 -1.443 1.00 0.00 H new ATOM 403 N GLU A 28 12.679 -0.729 1.146 1.00 0.00 N ATOM 404 CA GLU A 28 13.680 -1.200 2.119 1.00 0.00 C ATOM 405 C GLU A 28 13.715 -0.287 3.357 1.00 0.00 C ATOM 406 O GLU A 28 14.024 -0.765 4.438 1.00 0.00 O ATOM 407 CB GLU A 28 15.098 -1.325 1.496 1.00 0.00 C ATOM 408 CG GLU A 28 15.720 0.000 1.008 1.00 0.00 C ATOM 409 CD GLU A 28 17.174 -0.147 0.545 1.00 0.00 C ATOM 410 OE1 GLU A 28 17.445 -1.015 -0.309 1.00 0.00 O ATOM 411 OE2 GLU A 28 18.056 0.617 1.009 1.00 0.00 O ATOM 0 H GLU A 28 13.078 -0.259 0.334 1.00 0.00 H new ATOM 0 HA GLU A 28 13.373 -2.199 2.427 1.00 0.00 H new ATOM 0 HB2 GLU A 28 15.764 -1.770 2.235 1.00 0.00 H new ATOM 0 HB3 GLU A 28 15.048 -2.016 0.655 1.00 0.00 H new ATOM 0 HG2 GLU A 28 15.122 0.393 0.186 1.00 0.00 H new ATOM 0 HG3 GLU A 28 15.675 0.733 1.814 1.00 0.00 H new ATOM 418 N THR A 29 13.384 1.020 3.194 1.00 0.00 N ATOM 419 CA THR A 29 13.320 1.973 4.326 1.00 0.00 C ATOM 420 C THR A 29 12.287 1.493 5.362 1.00 0.00 C ATOM 421 O THR A 29 12.614 1.353 6.536 1.00 0.00 O ATOM 422 CB THR A 29 12.979 3.426 3.847 1.00 0.00 C ATOM 423 OG1 THR A 29 14.021 3.904 2.985 1.00 0.00 O ATOM 424 CG2 THR A 29 12.791 4.420 5.014 1.00 0.00 C ATOM 0 H THR A 29 13.158 1.435 2.290 1.00 0.00 H new ATOM 0 HA THR A 29 14.306 2.006 4.789 1.00 0.00 H new ATOM 0 HB THR A 29 12.029 3.368 3.315 1.00 0.00 H new ATOM 0 HG1 THR A 29 13.974 3.436 2.125 1.00 0.00 H new ATOM 0 HG21 THR A 29 12.557 5.408 4.617 1.00 0.00 H new ATOM 0 HG22 THR A 29 11.974 4.082 5.651 1.00 0.00 H new ATOM 0 HG23 THR A 29 13.709 4.472 5.599 1.00 0.00 H new ATOM 432 N TYR A 30 11.066 1.181 4.884 1.00 0.00 N ATOM 433 CA TYR A 30 9.965 0.677 5.728 1.00 0.00 C ATOM 434 C TYR A 30 10.321 -0.685 6.351 1.00 0.00 C ATOM 435 O TYR A 30 10.024 -0.924 7.519 1.00 0.00 O ATOM 436 CB TYR A 30 8.645 0.600 4.913 1.00 0.00 C ATOM 437 CG TYR A 30 8.003 1.974 4.637 1.00 0.00 C ATOM 438 CD1 TYR A 30 7.246 2.628 5.616 1.00 0.00 C ATOM 439 CD2 TYR A 30 8.145 2.613 3.405 1.00 0.00 C ATOM 440 CE1 TYR A 30 6.660 3.859 5.369 1.00 0.00 C ATOM 441 CE2 TYR A 30 7.565 3.842 3.157 1.00 0.00 C ATOM 442 CZ TYR A 30 6.823 4.460 4.138 1.00 0.00 C ATOM 443 OH TYR A 30 6.228 5.681 3.876 1.00 0.00 O ATOM 0 H TYR A 30 10.815 1.272 3.899 1.00 0.00 H new ATOM 0 HA TYR A 30 9.814 1.379 6.548 1.00 0.00 H new ATOM 0 HB2 TYR A 30 8.844 0.105 3.963 1.00 0.00 H new ATOM 0 HB3 TYR A 30 7.931 -0.022 5.453 1.00 0.00 H new ATOM 0 HD1 TYR A 30 7.116 2.164 6.583 1.00 0.00 H new ATOM 0 HD2 TYR A 30 8.722 2.136 2.627 1.00 0.00 H new ATOM 0 HE1 TYR A 30 6.078 4.346 6.137 1.00 0.00 H new ATOM 0 HE2 TYR A 30 7.693 4.317 2.196 1.00 0.00 H new ATOM 0 HH TYR A 30 6.445 5.962 2.963 1.00 0.00 H new ATOM 453 N TRP A 31 10.990 -1.557 5.571 1.00 0.00 N ATOM 454 CA TRP A 31 11.463 -2.869 6.066 1.00 0.00 C ATOM 455 C TRP A 31 12.433 -2.678 7.255 1.00 0.00 C ATOM 456 O TRP A 31 12.289 -3.318 8.300 1.00 0.00 O ATOM 457 CB TRP A 31 12.151 -3.666 4.920 1.00 0.00 C ATOM 458 CG TRP A 31 12.653 -5.046 5.327 1.00 0.00 C ATOM 459 CD1 TRP A 31 13.868 -5.355 5.886 1.00 0.00 C ATOM 460 CD2 TRP A 31 11.949 -6.293 5.207 1.00 0.00 C ATOM 461 NE1 TRP A 31 13.948 -6.697 6.137 1.00 0.00 N ATOM 462 CE2 TRP A 31 12.791 -7.297 5.722 1.00 0.00 C ATOM 463 CE3 TRP A 31 10.686 -6.658 4.716 1.00 0.00 C ATOM 464 CZ2 TRP A 31 12.416 -8.637 5.764 1.00 0.00 C ATOM 465 CZ3 TRP A 31 10.315 -7.990 4.755 1.00 0.00 C ATOM 466 CH2 TRP A 31 11.180 -8.965 5.278 1.00 0.00 C ATOM 0 H TRP A 31 11.216 -1.377 4.593 1.00 0.00 H new ATOM 0 HA TRP A 31 10.602 -3.441 6.413 1.00 0.00 H new ATOM 0 HB2 TRP A 31 11.445 -3.778 4.097 1.00 0.00 H new ATOM 0 HB3 TRP A 31 12.992 -3.084 4.543 1.00 0.00 H new ATOM 0 HD1 TRP A 31 14.649 -4.640 6.097 1.00 0.00 H new ATOM 0 HE1 TRP A 31 14.742 -7.173 6.565 1.00 0.00 H new ATOM 0 HE3 TRP A 31 10.016 -5.912 4.315 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 13.077 -9.391 6.166 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 9.347 -8.284 4.378 1.00 0.00 H new ATOM 0 HH2 TRP A 31 10.862 -9.997 5.297 1.00 0.00 H new ATOM 477 N LYS A 32 13.403 -1.764 7.076 1.00 0.00 N ATOM 478 CA LYS A 32 14.464 -1.508 8.065 1.00 0.00 C ATOM 479 C LYS A 32 13.927 -0.742 9.285 1.00 0.00 C ATOM 480 O LYS A 32 14.482 -0.861 10.378 1.00 0.00 O ATOM 481 CB LYS A 32 15.662 -0.770 7.412 1.00 0.00 C ATOM 482 CG LYS A 32 16.366 -1.561 6.280 1.00 0.00 C ATOM 483 CD LYS A 32 16.923 -2.932 6.731 1.00 0.00 C ATOM 484 CE LYS A 32 18.127 -2.811 7.679 1.00 0.00 C ATOM 485 NZ LYS A 32 19.274 -2.109 7.031 1.00 0.00 N ATOM 0 H LYS A 32 13.473 -1.182 6.241 1.00 0.00 H new ATOM 0 HA LYS A 32 14.822 -2.472 8.425 1.00 0.00 H new ATOM 0 HB2 LYS A 32 15.311 0.180 7.010 1.00 0.00 H new ATOM 0 HB3 LYS A 32 16.394 -0.538 8.185 1.00 0.00 H new ATOM 0 HG2 LYS A 32 15.660 -1.716 5.464 1.00 0.00 H new ATOM 0 HG3 LYS A 32 17.184 -0.960 5.883 1.00 0.00 H new ATOM 0 HD2 LYS A 32 16.132 -3.493 7.228 1.00 0.00 H new ATOM 0 HD3 LYS A 32 17.217 -3.505 5.852 1.00 0.00 H new ATOM 0 HE2 LYS A 32 17.830 -2.269 8.577 1.00 0.00 H new ATOM 0 HE3 LYS A 32 18.442 -3.805 7.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 20.134 -2.252 7.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 19.422 -2.493 6.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 19.067 -1.092 6.967 1.00 0.00 H new ATOM 499 N LEU A 33 12.839 0.027 9.089 1.00 0.00 N ATOM 500 CA LEU A 33 12.116 0.694 10.189 1.00 0.00 C ATOM 501 C LEU A 33 11.504 -0.368 11.119 1.00 0.00 C ATOM 502 O LEU A 33 11.705 -0.320 12.332 1.00 0.00 O ATOM 503 CB LEU A 33 11.004 1.637 9.633 1.00 0.00 C ATOM 504 CG LEU A 33 11.484 2.977 8.993 1.00 0.00 C ATOM 505 CD1 LEU A 33 10.312 3.737 8.321 1.00 0.00 C ATOM 506 CD2 LEU A 33 12.208 3.859 10.036 1.00 0.00 C ATOM 0 H LEU A 33 12.438 0.203 8.168 1.00 0.00 H new ATOM 0 HA LEU A 33 12.820 1.305 10.754 1.00 0.00 H new ATOM 0 HB2 LEU A 33 10.433 1.087 8.885 1.00 0.00 H new ATOM 0 HB3 LEU A 33 10.319 1.874 10.447 1.00 0.00 H new ATOM 0 HG LEU A 33 12.201 2.734 8.209 1.00 0.00 H new ATOM 0 HD11 LEU A 33 10.682 4.665 7.886 1.00 0.00 H new ATOM 0 HD12 LEU A 33 9.878 3.116 7.537 1.00 0.00 H new ATOM 0 HD13 LEU A 33 9.551 3.964 9.067 1.00 0.00 H new ATOM 0 HD21 LEU A 33 12.533 4.787 9.565 1.00 0.00 H new ATOM 0 HD22 LEU A 33 11.526 4.087 10.856 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.076 3.326 10.424 1.00 0.00 H new ATOM 518 N LEU A 34 10.774 -1.332 10.515 1.00 0.00 N ATOM 519 CA LEU A 34 10.096 -2.419 11.252 1.00 0.00 C ATOM 520 C LEU A 34 11.110 -3.327 11.985 1.00 0.00 C ATOM 521 O LEU A 34 10.910 -3.650 13.154 1.00 0.00 O ATOM 522 CB LEU A 34 9.165 -3.251 10.307 1.00 0.00 C ATOM 523 CG LEU A 34 7.699 -2.715 10.119 1.00 0.00 C ATOM 524 CD1 LEU A 34 7.646 -1.316 9.471 1.00 0.00 C ATOM 525 CD2 LEU A 34 6.838 -3.727 9.332 1.00 0.00 C ATOM 0 H LEU A 34 10.639 -1.377 9.505 1.00 0.00 H new ATOM 0 HA LEU A 34 9.467 -1.955 12.012 1.00 0.00 H new ATOM 0 HB2 LEU A 34 9.637 -3.307 9.326 1.00 0.00 H new ATOM 0 HB3 LEU A 34 9.109 -4.269 10.692 1.00 0.00 H new ATOM 0 HG LEU A 34 7.279 -2.605 11.119 1.00 0.00 H new ATOM 0 HD11 LEU A 34 6.607 -1.002 9.368 1.00 0.00 H new ATOM 0 HD12 LEU A 34 8.180 -0.603 10.099 1.00 0.00 H new ATOM 0 HD13 LEU A 34 8.113 -1.353 8.487 1.00 0.00 H new ATOM 0 HD21 LEU A 34 5.829 -3.333 9.215 1.00 0.00 H new ATOM 0 HD22 LEU A 34 7.279 -3.893 8.349 1.00 0.00 H new ATOM 0 HD23 LEU A 34 6.798 -4.671 9.875 1.00 0.00 H new ATOM 537 N THR A 35 12.211 -3.706 11.306 1.00 0.00 N ATOM 538 CA THR A 35 13.246 -4.600 11.889 1.00 0.00 C ATOM 539 C THR A 35 14.005 -3.936 13.069 1.00 0.00 C ATOM 540 O THR A 35 14.585 -4.637 13.906 1.00 0.00 O ATOM 541 CB THR A 35 14.268 -5.079 10.805 1.00 0.00 C ATOM 542 OG1 THR A 35 14.849 -3.950 10.150 1.00 0.00 O ATOM 543 CG2 THR A 35 13.610 -5.992 9.755 1.00 0.00 C ATOM 0 H THR A 35 12.412 -3.409 10.351 1.00 0.00 H new ATOM 0 HA THR A 35 12.712 -5.467 12.278 1.00 0.00 H new ATOM 0 HB THR A 35 15.039 -5.655 11.317 1.00 0.00 H new ATOM 0 HG1 THR A 35 14.507 -3.125 10.554 1.00 0.00 H new ATOM 0 HG21 THR A 35 14.356 -6.301 9.023 1.00 0.00 H new ATOM 0 HG22 THR A 35 13.198 -6.873 10.246 1.00 0.00 H new ATOM 0 HG23 THR A 35 12.810 -5.450 9.251 1.00 0.00 H new ATOM 551 N SER A 36 13.992 -2.590 13.124 1.00 0.00 N ATOM 552 CA SER A 36 14.626 -1.824 14.218 1.00 0.00 C ATOM 553 C SER A 36 13.641 -1.636 15.390 1.00 0.00 C ATOM 554 O SER A 36 13.946 -1.983 16.543 1.00 0.00 O ATOM 555 CB SER A 36 15.119 -0.458 13.681 1.00 0.00 C ATOM 556 OG SER A 36 16.066 -0.640 12.638 1.00 0.00 O ATOM 0 H SER A 36 13.545 -2.005 12.417 1.00 0.00 H new ATOM 0 HA SER A 36 15.485 -2.381 14.593 1.00 0.00 H new ATOM 0 HB2 SER A 36 14.272 0.121 13.313 1.00 0.00 H new ATOM 0 HB3 SER A 36 15.569 0.116 14.491 1.00 0.00 H new ATOM 0 HG SER A 36 15.597 -0.732 11.782 1.00 0.00 H new ATOM 562 N VAL A 37 12.455 -1.092 15.077 1.00 0.00 N ATOM 563 CA VAL A 37 11.393 -0.787 16.062 1.00 0.00 C ATOM 564 C VAL A 37 10.028 -1.307 15.528 1.00 0.00 C ATOM 565 O VAL A 37 9.806 -1.287 14.317 1.00 0.00 O ATOM 566 CB VAL A 37 11.312 0.765 16.376 1.00 0.00 C ATOM 567 CG1 VAL A 37 12.584 1.260 17.119 1.00 0.00 C ATOM 568 CG2 VAL A 37 11.060 1.599 15.092 1.00 0.00 C ATOM 0 H VAL A 37 12.198 -0.846 14.121 1.00 0.00 H new ATOM 0 HA VAL A 37 11.637 -1.292 16.997 1.00 0.00 H new ATOM 0 HB VAL A 37 10.458 0.913 17.037 1.00 0.00 H new ATOM 0 HG11 VAL A 37 12.496 2.328 17.319 1.00 0.00 H new ATOM 0 HG12 VAL A 37 12.688 0.722 18.061 1.00 0.00 H new ATOM 0 HG13 VAL A 37 13.462 1.078 16.499 1.00 0.00 H new ATOM 0 HG21 VAL A 37 11.011 2.657 15.349 1.00 0.00 H new ATOM 0 HG22 VAL A 37 11.874 1.435 14.386 1.00 0.00 H new ATOM 0 HG23 VAL A 37 10.118 1.292 14.638 1.00 0.00 H new ATOM 578 N PRO A 38 9.105 -1.811 16.422 1.00 0.00 N ATOM 579 CA PRO A 38 7.789 -2.385 16.002 1.00 0.00 C ATOM 580 C PRO A 38 6.903 -1.421 15.177 1.00 0.00 C ATOM 581 O PRO A 38 7.041 -0.200 15.266 1.00 0.00 O ATOM 582 CB PRO A 38 7.113 -2.770 17.350 1.00 0.00 C ATOM 583 CG PRO A 38 8.262 -2.956 18.296 1.00 0.00 C ATOM 584 CD PRO A 38 9.279 -1.906 17.899 1.00 0.00 C ATOM 0 HA PRO A 38 7.930 -3.226 15.322 1.00 0.00 H new ATOM 0 HB2 PRO A 38 6.436 -1.988 17.694 1.00 0.00 H new ATOM 0 HB3 PRO A 38 6.524 -3.682 17.254 1.00 0.00 H new ATOM 0 HG2 PRO A 38 7.945 -2.825 19.331 1.00 0.00 H new ATOM 0 HG3 PRO A 38 8.680 -3.959 18.215 1.00 0.00 H new ATOM 0 HD2 PRO A 38 9.087 -0.952 18.390 1.00 0.00 H new ATOM 0 HD3 PRO A 38 10.292 -2.204 18.167 1.00 0.00 H new ATOM 592 N GLY A 39 5.963 -2.004 14.402 1.00 0.00 N ATOM 593 CA GLY A 39 5.036 -1.233 13.561 1.00 0.00 C ATOM 594 C GLY A 39 3.906 -0.564 14.358 1.00 0.00 C ATOM 595 O GLY A 39 3.029 0.079 13.768 1.00 0.00 O ATOM 0 H GLY A 39 5.830 -3.014 14.345 1.00 0.00 H new ATOM 0 HA2 GLY A 39 5.595 -0.467 13.024 1.00 0.00 H new ATOM 0 HA3 GLY A 39 4.601 -1.894 12.812 1.00 0.00 H new ATOM 599 N SER A 40 3.933 -0.741 15.699 1.00 0.00 N ATOM 600 CA SER A 40 2.989 -0.119 16.642 1.00 0.00 C ATOM 601 C SER A 40 3.006 1.423 16.528 1.00 0.00 C ATOM 602 O SER A 40 1.956 2.067 16.416 1.00 0.00 O ATOM 603 CB SER A 40 3.364 -0.546 18.085 1.00 0.00 C ATOM 604 OG SER A 40 3.508 -1.959 18.181 1.00 0.00 O ATOM 0 H SER A 40 4.626 -1.332 16.159 1.00 0.00 H new ATOM 0 HA SER A 40 1.982 -0.456 16.398 1.00 0.00 H new ATOM 0 HB2 SER A 40 4.295 -0.062 18.380 1.00 0.00 H new ATOM 0 HB3 SER A 40 2.595 -0.208 18.779 1.00 0.00 H new ATOM 0 HG SER A 40 3.746 -2.202 19.100 1.00 0.00 H new ATOM 610 N LYS A 41 4.223 1.990 16.526 1.00 0.00 N ATOM 611 CA LYS A 41 4.441 3.454 16.513 1.00 0.00 C ATOM 612 C LYS A 41 4.649 3.974 15.082 1.00 0.00 C ATOM 613 O LYS A 41 4.453 5.168 14.813 1.00 0.00 O ATOM 614 CB LYS A 41 5.647 3.861 17.423 1.00 0.00 C ATOM 615 CG LYS A 41 7.041 3.273 17.054 1.00 0.00 C ATOM 616 CD LYS A 41 7.296 1.843 17.595 1.00 0.00 C ATOM 617 CE LYS A 41 7.244 1.753 19.131 1.00 0.00 C ATOM 618 NZ LYS A 41 8.269 2.620 19.779 1.00 0.00 N ATOM 0 H LYS A 41 5.088 1.449 16.533 1.00 0.00 H new ATOM 0 HA LYS A 41 3.541 3.917 16.917 1.00 0.00 H new ATOM 0 HB2 LYS A 41 5.725 4.948 17.416 1.00 0.00 H new ATOM 0 HB3 LYS A 41 5.415 3.565 18.446 1.00 0.00 H new ATOM 0 HG2 LYS A 41 7.141 3.261 15.969 1.00 0.00 H new ATOM 0 HG3 LYS A 41 7.815 3.937 17.438 1.00 0.00 H new ATOM 0 HD2 LYS A 41 6.554 1.165 17.173 1.00 0.00 H new ATOM 0 HD3 LYS A 41 8.272 1.501 17.251 1.00 0.00 H new ATOM 0 HE2 LYS A 41 6.252 2.044 19.477 1.00 0.00 H new ATOM 0 HE3 LYS A 41 7.398 0.719 19.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 8.244 2.477 20.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 9.212 2.371 19.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 8.067 3.617 19.563 1.00 0.00 H new ATOM 632 N LEU A 42 5.038 3.067 14.173 1.00 0.00 N ATOM 633 CA LEU A 42 5.364 3.410 12.783 1.00 0.00 C ATOM 634 C LEU A 42 4.083 3.624 11.961 1.00 0.00 C ATOM 635 O LEU A 42 3.353 2.672 11.652 1.00 0.00 O ATOM 636 CB LEU A 42 6.257 2.306 12.161 1.00 0.00 C ATOM 637 CG LEU A 42 7.639 2.097 12.859 1.00 0.00 C ATOM 638 CD1 LEU A 42 8.377 0.882 12.276 1.00 0.00 C ATOM 639 CD2 LEU A 42 8.505 3.379 12.785 1.00 0.00 C ATOM 0 H LEU A 42 5.135 2.074 14.383 1.00 0.00 H new ATOM 0 HA LEU A 42 5.921 4.347 12.771 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.710 1.363 12.183 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.430 2.549 11.113 1.00 0.00 H new ATOM 0 HG LEU A 42 7.452 1.891 13.913 1.00 0.00 H new ATOM 0 HD11 LEU A 42 9.335 0.762 12.781 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.774 -0.014 12.422 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.546 1.036 11.210 1.00 0.00 H new ATOM 0 HD21 LEU A 42 9.460 3.202 13.279 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.679 3.640 11.741 1.00 0.00 H new ATOM 0 HD23 LEU A 42 7.986 4.198 13.282 1.00 0.00 H new ATOM 651 N ARG A 43 3.812 4.901 11.651 1.00 0.00 N ATOM 652 CA ARG A 43 2.682 5.321 10.811 1.00 0.00 C ATOM 653 C ARG A 43 3.169 5.723 9.414 1.00 0.00 C ATOM 654 O ARG A 43 4.311 6.170 9.241 1.00 0.00 O ATOM 655 CB ARG A 43 1.901 6.483 11.494 1.00 0.00 C ATOM 656 CG ARG A 43 1.045 6.047 12.712 1.00 0.00 C ATOM 657 CD ARG A 43 0.052 4.929 12.327 1.00 0.00 C ATOM 658 NE ARG A 43 -0.958 4.641 13.358 1.00 0.00 N ATOM 659 CZ ARG A 43 -2.189 4.177 13.101 1.00 0.00 C ATOM 660 NH1 ARG A 43 -2.593 3.962 11.845 1.00 0.00 N ATOM 661 NH2 ARG A 43 -3.015 3.934 14.102 1.00 0.00 N ATOM 0 H ARG A 43 4.380 5.681 11.982 1.00 0.00 H new ATOM 0 HA ARG A 43 2.000 4.479 10.696 1.00 0.00 H new ATOM 0 HB2 ARG A 43 2.613 7.242 11.818 1.00 0.00 H new ATOM 0 HB3 ARG A 43 1.250 6.951 10.756 1.00 0.00 H new ATOM 0 HG2 ARG A 43 1.698 5.697 13.512 1.00 0.00 H new ATOM 0 HG3 ARG A 43 0.497 6.905 13.100 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -0.456 5.211 11.405 1.00 0.00 H new ATOM 0 HD3 ARG A 43 0.611 4.017 12.117 1.00 0.00 H new ATOM 0 HE ARG A 43 -0.705 4.805 14.332 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -1.962 4.151 11.067 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -3.533 3.609 11.665 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -2.715 4.100 15.063 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -3.953 3.581 13.915 1.00 0.00 H new ATOM 675 N LEU A 44 2.282 5.550 8.429 1.00 0.00 N ATOM 676 CA LEU A 44 2.592 5.763 7.010 1.00 0.00 C ATOM 677 C LEU A 44 2.518 7.268 6.668 1.00 0.00 C ATOM 678 O LEU A 44 3.393 7.800 5.969 1.00 0.00 O ATOM 679 CB LEU A 44 1.616 4.925 6.125 1.00 0.00 C ATOM 680 CG LEU A 44 1.775 3.361 6.135 1.00 0.00 C ATOM 681 CD1 LEU A 44 3.175 2.929 5.668 1.00 0.00 C ATOM 682 CD2 LEU A 44 1.408 2.732 7.502 1.00 0.00 C ATOM 0 H LEU A 44 1.320 5.255 8.595 1.00 0.00 H new ATOM 0 HA LEU A 44 3.608 5.427 6.805 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.598 5.160 6.435 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.722 5.266 5.095 1.00 0.00 H new ATOM 0 HG LEU A 44 1.055 2.974 5.414 1.00 0.00 H new ATOM 0 HD11 LEU A 44 3.246 1.842 5.689 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.345 3.285 4.652 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.927 3.354 6.332 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.536 1.651 7.451 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.059 3.139 8.276 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.370 2.963 7.742 1.00 0.00 H new ATOM 694 N THR A 45 1.464 7.938 7.177 1.00 0.00 N ATOM 695 CA THR A 45 1.246 9.401 7.023 1.00 0.00 C ATOM 696 C THR A 45 0.588 9.967 8.307 1.00 0.00 C ATOM 697 O THR A 45 0.574 9.306 9.349 1.00 0.00 O ATOM 698 CB THR A 45 0.336 9.742 5.777 1.00 0.00 C ATOM 699 OG1 THR A 45 -0.888 9.007 5.832 1.00 0.00 O ATOM 700 CG2 THR A 45 1.023 9.482 4.431 1.00 0.00 C ATOM 0 H THR A 45 0.729 7.478 7.714 1.00 0.00 H new ATOM 0 HA THR A 45 2.221 9.861 6.859 1.00 0.00 H new ATOM 0 HB THR A 45 0.137 10.812 5.837 1.00 0.00 H new ATOM 0 HG1 THR A 45 -1.440 9.232 5.054 1.00 0.00 H new ATOM 0 HG21 THR A 45 0.342 9.737 3.619 1.00 0.00 H new ATOM 0 HG22 THR A 45 1.922 10.095 4.357 1.00 0.00 H new ATOM 0 HG23 THR A 45 1.295 8.429 4.359 1.00 0.00 H new ATOM 708 N LYS A 46 0.089 11.217 8.225 1.00 0.00 N ATOM 709 CA LYS A 46 -0.760 11.825 9.265 1.00 0.00 C ATOM 710 C LYS A 46 -2.182 11.223 9.200 1.00 0.00 C ATOM 711 O LYS A 46 -2.844 11.034 10.230 1.00 0.00 O ATOM 712 CB LYS A 46 -0.819 13.368 9.064 1.00 0.00 C ATOM 713 CG LYS A 46 -1.694 14.123 10.087 1.00 0.00 C ATOM 714 CD LYS A 46 -1.805 15.634 9.787 1.00 0.00 C ATOM 715 CE LYS A 46 -2.711 16.372 10.788 1.00 0.00 C ATOM 716 NZ LYS A 46 -2.810 17.824 10.485 1.00 0.00 N ATOM 0 H LYS A 46 0.265 11.834 7.432 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.333 11.614 10.245 1.00 0.00 H new ATOM 0 HB2 LYS A 46 0.195 13.765 9.112 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -1.196 13.575 8.062 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -2.692 13.686 10.096 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -1.277 13.986 11.085 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -0.810 16.079 9.807 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.196 15.773 8.779 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -3.707 15.929 10.770 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -2.321 16.238 11.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -3.429 18.283 11.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -1.863 18.253 10.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -3.207 17.954 9.532 1.00 0.00 H new ATOM 730 N PHE A 47 -2.626 10.911 7.969 1.00 0.00 N ATOM 731 CA PHE A 47 -4.014 10.501 7.682 1.00 0.00 C ATOM 732 C PHE A 47 -4.116 8.990 7.418 1.00 0.00 C ATOM 733 O PHE A 47 -5.181 8.510 7.048 1.00 0.00 O ATOM 734 CB PHE A 47 -4.556 11.281 6.450 1.00 0.00 C ATOM 735 CG PHE A 47 -4.374 12.786 6.546 1.00 0.00 C ATOM 736 CD1 PHE A 47 -5.243 13.566 7.302 1.00 0.00 C ATOM 737 CD2 PHE A 47 -3.328 13.422 5.882 1.00 0.00 C ATOM 738 CE1 PHE A 47 -5.077 14.931 7.387 1.00 0.00 C ATOM 739 CE2 PHE A 47 -3.162 14.785 5.967 1.00 0.00 C ATOM 740 CZ PHE A 47 -4.037 15.542 6.722 1.00 0.00 C ATOM 0 H PHE A 47 -2.030 10.936 7.141 1.00 0.00 H new ATOM 0 HA PHE A 47 -4.615 10.734 8.561 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -4.052 10.920 5.553 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -5.617 11.060 6.330 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -6.059 13.095 7.830 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -2.638 12.837 5.292 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -5.763 15.522 7.975 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -2.347 15.263 5.443 1.00 0.00 H new ATOM 0 HZ PHE A 47 -3.906 16.612 6.791 1.00 0.00 H new ATOM 750 N ASP A 48 -3.026 8.235 7.638 1.00 0.00 N ATOM 751 CA ASP A 48 -2.966 6.806 7.243 1.00 0.00 C ATOM 752 C ASP A 48 -4.011 5.954 7.993 1.00 0.00 C ATOM 753 O ASP A 48 -4.613 5.039 7.416 1.00 0.00 O ATOM 754 CB ASP A 48 -1.544 6.236 7.445 1.00 0.00 C ATOM 755 CG ASP A 48 -1.177 5.939 8.905 1.00 0.00 C ATOM 756 OD1 ASP A 48 -1.092 6.894 9.702 1.00 0.00 O ATOM 757 OD2 ASP A 48 -0.989 4.748 9.256 1.00 0.00 O ATOM 0 H ASP A 48 -2.177 8.582 8.084 1.00 0.00 H new ATOM 0 HA ASP A 48 -3.209 6.756 6.182 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.449 5.317 6.866 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.822 6.944 7.039 1.00 0.00 H new ATOM 762 N ASP A 49 -4.245 6.300 9.269 1.00 0.00 N ATOM 763 CA ASP A 49 -5.204 5.587 10.124 1.00 0.00 C ATOM 764 C ASP A 49 -6.620 5.672 9.530 1.00 0.00 C ATOM 765 O ASP A 49 -7.271 4.636 9.334 1.00 0.00 O ATOM 766 CB ASP A 49 -5.184 6.150 11.568 1.00 0.00 C ATOM 767 CG ASP A 49 -6.074 5.346 12.530 1.00 0.00 C ATOM 768 OD1 ASP A 49 -5.668 4.233 12.921 1.00 0.00 O ATOM 769 OD2 ASP A 49 -7.184 5.809 12.883 1.00 0.00 O ATOM 0 H ASP A 49 -3.777 7.078 9.734 1.00 0.00 H new ATOM 0 HA ASP A 49 -4.908 4.539 10.166 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -4.160 6.148 11.940 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.516 7.188 11.554 1.00 0.00 H new ATOM 774 N GLU A 50 -7.060 6.917 9.190 1.00 0.00 N ATOM 775 CA GLU A 50 -8.404 7.149 8.624 1.00 0.00 C ATOM 776 C GLU A 50 -8.546 6.446 7.266 1.00 0.00 C ATOM 777 O GLU A 50 -9.613 5.921 6.972 1.00 0.00 O ATOM 778 CB GLU A 50 -8.771 8.662 8.465 1.00 0.00 C ATOM 779 CG GLU A 50 -8.020 9.412 7.341 1.00 0.00 C ATOM 780 CD GLU A 50 -8.611 10.777 6.980 1.00 0.00 C ATOM 781 OE1 GLU A 50 -9.578 10.821 6.189 1.00 0.00 O ATOM 782 OE2 GLU A 50 -8.106 11.816 7.469 1.00 0.00 O ATOM 0 H GLU A 50 -6.502 7.764 9.300 1.00 0.00 H new ATOM 0 HA GLU A 50 -9.103 6.727 9.346 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -9.842 8.741 8.278 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -8.574 9.167 9.410 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -6.982 9.549 7.644 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -8.011 8.787 6.448 1.00 0.00 H new ATOM 789 N ILE A 51 -7.441 6.420 6.465 1.00 0.00 N ATOM 790 CA ILE A 51 -7.421 5.804 5.110 1.00 0.00 C ATOM 791 C ILE A 51 -7.883 4.353 5.179 1.00 0.00 C ATOM 792 O ILE A 51 -8.749 3.945 4.408 1.00 0.00 O ATOM 793 CB ILE A 51 -5.980 5.875 4.437 1.00 0.00 C ATOM 794 CG1 ILE A 51 -5.566 7.354 4.158 1.00 0.00 C ATOM 795 CG2 ILE A 51 -5.875 5.018 3.138 1.00 0.00 C ATOM 796 CD1 ILE A 51 -4.136 7.556 3.661 1.00 0.00 C ATOM 0 H ILE A 51 -6.546 6.824 6.741 1.00 0.00 H new ATOM 0 HA ILE A 51 -8.107 6.379 4.489 1.00 0.00 H new ATOM 0 HB ILE A 51 -5.282 5.444 5.155 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -6.251 7.771 3.419 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -5.698 7.929 5.075 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -4.870 5.106 2.724 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -6.080 3.974 3.373 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -6.601 5.375 2.407 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -3.954 8.618 3.499 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -3.435 7.177 4.405 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -3.997 7.017 2.724 1.00 0.00 H new ATOM 808 N TYR A 52 -7.308 3.598 6.132 1.00 0.00 N ATOM 809 CA TYR A 52 -7.727 2.214 6.396 1.00 0.00 C ATOM 810 C TYR A 52 -9.220 2.151 6.794 1.00 0.00 C ATOM 811 O TYR A 52 -9.944 1.286 6.304 1.00 0.00 O ATOM 812 CB TYR A 52 -6.845 1.548 7.490 1.00 0.00 C ATOM 813 CG TYR A 52 -7.460 0.261 8.061 1.00 0.00 C ATOM 814 CD1 TYR A 52 -7.570 -0.893 7.293 1.00 0.00 C ATOM 815 CD2 TYR A 52 -8.001 0.235 9.339 1.00 0.00 C ATOM 816 CE1 TYR A 52 -8.186 -2.025 7.786 1.00 0.00 C ATOM 817 CE2 TYR A 52 -8.627 -0.880 9.834 1.00 0.00 C ATOM 818 CZ TYR A 52 -8.715 -2.012 9.057 1.00 0.00 C ATOM 819 OH TYR A 52 -9.353 -3.127 9.541 1.00 0.00 O ATOM 0 H TYR A 52 -6.551 3.926 6.732 1.00 0.00 H new ATOM 0 HA TYR A 52 -7.593 1.654 5.470 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.866 1.320 7.069 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -6.686 2.258 8.301 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -7.166 -0.903 6.292 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -7.927 1.116 9.960 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -8.253 -2.916 7.179 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -9.049 -0.870 10.828 1.00 0.00 H new ATOM 0 HH TYR A 52 -8.755 -3.901 9.474 1.00 0.00 H new ATOM 829 N GLU A 53 -9.652 3.056 7.698 1.00 0.00 N ATOM 830 CA GLU A 53 -11.035 3.059 8.235 1.00 0.00 C ATOM 831 C GLU A 53 -12.068 3.180 7.094 1.00 0.00 C ATOM 832 O GLU A 53 -12.942 2.330 6.952 1.00 0.00 O ATOM 833 CB GLU A 53 -11.234 4.221 9.249 1.00 0.00 C ATOM 834 CG GLU A 53 -10.235 4.267 10.426 1.00 0.00 C ATOM 835 CD GLU A 53 -10.365 3.104 11.416 1.00 0.00 C ATOM 836 OE1 GLU A 53 -11.176 3.199 12.361 1.00 0.00 O ATOM 837 OE2 GLU A 53 -9.649 2.096 11.274 1.00 0.00 O ATOM 0 H GLU A 53 -9.062 3.798 8.074 1.00 0.00 H new ATOM 0 HA GLU A 53 -11.190 2.112 8.751 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -11.171 5.165 8.707 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -12.243 4.153 9.656 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -9.221 4.275 10.025 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -10.372 5.204 10.966 1.00 0.00 H new ATOM 844 N ASN A 54 -11.925 4.215 6.247 1.00 0.00 N ATOM 845 CA ASN A 54 -12.852 4.455 5.130 1.00 0.00 C ATOM 846 C ASN A 54 -12.605 3.467 3.966 1.00 0.00 C ATOM 847 O ASN A 54 -13.463 3.318 3.098 1.00 0.00 O ATOM 848 CB ASN A 54 -12.777 5.916 4.640 1.00 0.00 C ATOM 849 CG ASN A 54 -11.483 6.264 3.970 1.00 0.00 C ATOM 850 OD1 ASN A 54 -10.582 6.841 4.721 1.00 0.00 O flip ATOM 851 ND2 ASN A 54 -11.316 6.045 2.769 1.00 0.00 N flip ATOM 0 H ASN A 54 -11.173 4.900 6.317 1.00 0.00 H new ATOM 0 HA ASN A 54 -13.861 4.280 5.504 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -13.596 6.098 3.944 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -12.926 6.582 5.490 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -12.051 5.591 2.226 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -10.443 6.317 2.318 1.00 0.00 H new ATOM 858 N PHE A 55 -11.416 2.820 3.939 1.00 0.00 N ATOM 859 CA PHE A 55 -11.117 1.741 2.970 1.00 0.00 C ATOM 860 C PHE A 55 -11.978 0.512 3.309 1.00 0.00 C ATOM 861 O PHE A 55 -12.614 -0.062 2.438 1.00 0.00 O ATOM 862 CB PHE A 55 -9.598 1.366 2.987 1.00 0.00 C ATOM 863 CG PHE A 55 -9.072 0.496 1.826 1.00 0.00 C ATOM 864 CD1 PHE A 55 -9.864 0.164 0.722 1.00 0.00 C ATOM 865 CD2 PHE A 55 -7.754 0.032 1.840 1.00 0.00 C ATOM 866 CE1 PHE A 55 -9.364 -0.604 -0.311 1.00 0.00 C ATOM 867 CE2 PHE A 55 -7.258 -0.735 0.801 1.00 0.00 C ATOM 868 CZ PHE A 55 -8.061 -1.052 -0.272 1.00 0.00 C ATOM 0 H PHE A 55 -10.648 3.027 4.578 1.00 0.00 H new ATOM 0 HA PHE A 55 -11.354 2.092 1.966 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -9.022 2.291 3.003 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -9.390 0.844 3.921 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -10.885 0.514 0.677 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -7.113 0.276 2.674 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -9.995 -0.854 -1.151 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -6.237 -1.086 0.831 1.00 0.00 H new ATOM 0 HZ PHE A 55 -7.670 -1.651 -1.082 1.00 0.00 H new ATOM 878 N MET A 56 -12.013 0.141 4.601 1.00 0.00 N ATOM 879 CA MET A 56 -12.739 -1.054 5.065 1.00 0.00 C ATOM 880 C MET A 56 -14.263 -0.797 5.138 1.00 0.00 C ATOM 881 O MET A 56 -15.041 -1.747 5.200 1.00 0.00 O ATOM 882 CB MET A 56 -12.140 -1.580 6.412 1.00 0.00 C ATOM 883 CG MET A 56 -12.233 -0.649 7.631 1.00 0.00 C ATOM 884 SD MET A 56 -13.903 -0.477 8.298 1.00 0.00 S ATOM 885 CE MET A 56 -14.279 -2.153 8.823 1.00 0.00 C ATOM 0 H MET A 56 -11.544 0.655 5.346 1.00 0.00 H new ATOM 0 HA MET A 56 -12.603 -1.848 4.331 1.00 0.00 H new ATOM 0 HB2 MET A 56 -12.640 -2.516 6.662 1.00 0.00 H new ATOM 0 HB3 MET A 56 -11.089 -1.815 6.246 1.00 0.00 H new ATOM 0 HG2 MET A 56 -11.577 -1.027 8.415 1.00 0.00 H new ATOM 0 HG3 MET A 56 -11.861 0.337 7.352 1.00 0.00 H new ATOM 0 HE1 MET A 56 -15.040 -2.578 8.168 1.00 0.00 H new ATOM 0 HE2 MET A 56 -13.376 -2.761 8.773 1.00 0.00 H new ATOM 0 HE3 MET A 56 -14.650 -2.139 9.848 1.00 0.00 H new ATOM 895 N GLU A 57 -14.670 0.494 5.144 1.00 0.00 N ATOM 896 CA GLU A 57 -16.089 0.905 5.064 1.00 0.00 C ATOM 897 C GLU A 57 -16.591 0.962 3.603 1.00 0.00 C ATOM 898 O GLU A 57 -17.567 0.292 3.256 1.00 0.00 O ATOM 899 CB GLU A 57 -16.270 2.281 5.748 1.00 0.00 C ATOM 900 CG GLU A 57 -16.039 2.257 7.268 1.00 0.00 C ATOM 901 CD GLU A 57 -17.153 1.540 8.055 1.00 0.00 C ATOM 902 OE1 GLU A 57 -18.204 2.172 8.303 1.00 0.00 O ATOM 903 OE2 GLU A 57 -16.990 0.357 8.436 1.00 0.00 O ATOM 0 H GLU A 57 -14.022 1.280 5.205 1.00 0.00 H new ATOM 0 HA GLU A 57 -16.687 0.156 5.583 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -15.580 2.994 5.297 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -17.278 2.645 5.549 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -15.088 1.766 7.474 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -15.954 3.282 7.629 1.00 0.00 H new ATOM 910 N ARG A 58 -15.922 1.775 2.760 1.00 0.00 N ATOM 911 CA ARG A 58 -16.364 2.043 1.360 1.00 0.00 C ATOM 912 C ARG A 58 -15.987 0.899 0.405 1.00 0.00 C ATOM 913 O ARG A 58 -16.585 0.756 -0.666 1.00 0.00 O ATOM 914 CB ARG A 58 -15.811 3.405 0.822 1.00 0.00 C ATOM 915 CG ARG A 58 -16.570 4.658 1.325 1.00 0.00 C ATOM 916 CD ARG A 58 -16.370 4.954 2.824 1.00 0.00 C ATOM 917 NE ARG A 58 -17.382 5.897 3.337 1.00 0.00 N ATOM 918 CZ ARG A 58 -17.180 6.833 4.274 1.00 0.00 C ATOM 919 NH1 ARG A 58 -15.963 7.073 4.754 1.00 0.00 N ATOM 920 NH2 ARG A 58 -18.200 7.554 4.697 1.00 0.00 N ATOM 0 H ARG A 58 -15.066 2.265 3.020 1.00 0.00 H new ATOM 0 HA ARG A 58 -17.452 2.108 1.393 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -14.763 3.494 1.107 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -15.845 3.390 -0.267 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -16.244 5.523 0.748 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -17.634 4.528 1.130 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -16.422 4.023 3.388 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -15.374 5.368 2.983 1.00 0.00 H new ATOM 0 HE ARG A 58 -18.320 5.830 2.943 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -15.164 6.540 4.409 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -15.828 7.790 5.467 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -19.131 7.396 4.311 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -18.058 8.269 5.410 1.00 0.00 H new ATOM 934 N PHE A 59 -14.986 0.099 0.793 1.00 0.00 N ATOM 935 CA PHE A 59 -14.583 -1.119 0.056 1.00 0.00 C ATOM 936 C PHE A 59 -14.568 -2.308 1.045 1.00 0.00 C ATOM 937 O PHE A 59 -13.511 -2.895 1.295 1.00 0.00 O ATOM 938 CB PHE A 59 -13.175 -0.932 -0.599 1.00 0.00 C ATOM 939 CG PHE A 59 -13.068 0.211 -1.605 1.00 0.00 C ATOM 940 CD1 PHE A 59 -12.931 1.535 -1.180 1.00 0.00 C ATOM 941 CD2 PHE A 59 -13.095 -0.038 -2.970 1.00 0.00 C ATOM 942 CE1 PHE A 59 -12.832 2.568 -2.093 1.00 0.00 C ATOM 943 CE2 PHE A 59 -12.993 0.998 -3.879 1.00 0.00 C ATOM 944 CZ PHE A 59 -12.862 2.298 -3.442 1.00 0.00 C ATOM 0 H PHE A 59 -14.427 0.273 1.628 1.00 0.00 H new ATOM 0 HA PHE A 59 -15.295 -1.313 -0.746 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -12.444 -0.767 0.192 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -12.899 -1.861 -1.099 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -12.902 1.754 -0.123 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -13.197 -1.053 -3.326 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -12.731 3.586 -1.748 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -13.016 0.787 -4.938 1.00 0.00 H new ATOM 0 HZ PHE A 59 -12.783 3.104 -4.157 1.00 0.00 H new ATOM 954 N PRO A 60 -15.747 -2.717 1.621 1.00 0.00 N ATOM 955 CA PRO A 60 -15.786 -3.741 2.686 1.00 0.00 C ATOM 956 C PRO A 60 -15.666 -5.174 2.137 1.00 0.00 C ATOM 957 O PRO A 60 -15.819 -6.138 2.884 1.00 0.00 O ATOM 958 CB PRO A 60 -17.160 -3.488 3.342 1.00 0.00 C ATOM 959 CG PRO A 60 -18.028 -3.056 2.201 1.00 0.00 C ATOM 960 CD PRO A 60 -17.124 -2.267 1.263 1.00 0.00 C ATOM 0 HA PRO A 60 -14.949 -3.662 3.380 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -17.547 -4.388 3.820 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -17.100 -2.719 4.112 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -18.462 -3.917 1.693 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -18.857 -2.442 2.552 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -17.353 -2.477 0.218 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -17.242 -1.193 1.405 1.00 0.00 H new ATOM 968 N GLU A 61 -15.401 -5.307 0.828 1.00 0.00 N ATOM 969 CA GLU A 61 -15.216 -6.619 0.188 1.00 0.00 C ATOM 970 C GLU A 61 -13.789 -7.164 0.432 1.00 0.00 C ATOM 971 O GLU A 61 -13.555 -8.374 0.328 1.00 0.00 O ATOM 972 CB GLU A 61 -15.533 -6.511 -1.324 1.00 0.00 C ATOM 973 CG GLU A 61 -14.630 -5.543 -2.116 1.00 0.00 C ATOM 974 CD GLU A 61 -14.988 -5.497 -3.608 1.00 0.00 C ATOM 975 OE1 GLU A 61 -14.431 -6.297 -4.392 1.00 0.00 O ATOM 976 OE2 GLU A 61 -15.845 -4.675 -4.003 1.00 0.00 O ATOM 0 H GLU A 61 -15.310 -4.517 0.189 1.00 0.00 H new ATOM 0 HA GLU A 61 -15.908 -7.331 0.637 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -15.452 -7.503 -1.768 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -16.569 -6.193 -1.440 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -14.716 -4.542 -1.693 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -13.589 -5.847 -2.004 1.00 0.00 H new ATOM 983 N TYR A 62 -12.838 -6.264 0.762 1.00 0.00 N ATOM 984 CA TYR A 62 -11.422 -6.638 1.005 1.00 0.00 C ATOM 985 C TYR A 62 -11.171 -6.900 2.513 1.00 0.00 C ATOM 986 O TYR A 62 -10.078 -7.315 2.895 1.00 0.00 O ATOM 987 CB TYR A 62 -10.455 -5.522 0.435 1.00 0.00 C ATOM 988 CG TYR A 62 -9.843 -4.556 1.482 1.00 0.00 C ATOM 989 CD1 TYR A 62 -10.634 -3.638 2.180 1.00 0.00 C ATOM 990 CD2 TYR A 62 -8.475 -4.597 1.800 1.00 0.00 C ATOM 991 CE1 TYR A 62 -10.093 -2.808 3.137 1.00 0.00 C ATOM 992 CE2 TYR A 62 -7.935 -3.759 2.755 1.00 0.00 C ATOM 993 CZ TYR A 62 -8.751 -2.877 3.425 1.00 0.00 C ATOM 994 OH TYR A 62 -8.217 -2.040 4.377 1.00 0.00 O ATOM 0 H TYR A 62 -13.024 -5.267 0.867 1.00 0.00 H new ATOM 0 HA TYR A 62 -11.209 -7.567 0.476 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -9.640 -6.012 -0.098 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -11.005 -4.931 -0.297 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -11.691 -3.579 1.964 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -7.833 -5.298 1.287 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -10.723 -2.104 3.660 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -6.878 -3.796 2.975 1.00 0.00 H new ATOM 0 HH TYR A 62 -7.911 -1.213 3.950 1.00 0.00 H new ATOM 1004 N LYS A 63 -12.206 -6.680 3.359 1.00 0.00 N ATOM 1005 CA LYS A 63 -12.053 -6.649 4.834 1.00 0.00 C ATOM 1006 C LYS A 63 -11.741 -8.046 5.433 1.00 0.00 C ATOM 1007 O LYS A 63 -11.563 -8.172 6.648 1.00 0.00 O ATOM 1008 CB LYS A 63 -13.318 -6.031 5.496 1.00 0.00 C ATOM 1009 CG LYS A 63 -14.529 -6.992 5.653 1.00 0.00 C ATOM 1010 CD LYS A 63 -15.830 -6.276 6.090 1.00 0.00 C ATOM 1011 CE LYS A 63 -15.649 -5.381 7.323 1.00 0.00 C ATOM 1012 NZ LYS A 63 -16.936 -4.798 7.777 1.00 0.00 N ATOM 0 H LYS A 63 -13.162 -6.520 3.042 1.00 0.00 H new ATOM 0 HA LYS A 63 -11.192 -6.018 5.054 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -13.044 -5.656 6.482 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -13.633 -5.171 4.904 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -14.704 -7.501 4.705 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -14.282 -7.759 6.386 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -16.198 -5.671 5.262 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -16.594 -7.024 6.302 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -15.208 -5.963 8.133 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -14.949 -4.579 7.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -16.771 -4.200 8.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -17.345 -4.222 7.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -17.596 -5.563 8.024 1.00 0.00 H new ATOM 1026 N ASP A 64 -11.697 -9.082 4.572 1.00 0.00 N ATOM 1027 CA ASP A 64 -11.167 -10.415 4.925 1.00 0.00 C ATOM 1028 C ASP A 64 -9.682 -10.276 5.311 1.00 0.00 C ATOM 1029 O ASP A 64 -8.966 -9.486 4.694 1.00 0.00 O ATOM 1030 CB ASP A 64 -11.304 -11.383 3.716 1.00 0.00 C ATOM 1031 CG ASP A 64 -10.870 -12.828 4.021 1.00 0.00 C ATOM 1032 OD1 ASP A 64 -11.675 -13.590 4.600 1.00 0.00 O ATOM 1033 OD2 ASP A 64 -9.726 -13.202 3.695 1.00 0.00 O ATOM 0 H ASP A 64 -12.029 -9.018 3.610 1.00 0.00 H new ATOM 0 HA ASP A 64 -11.733 -10.820 5.764 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -12.342 -11.388 3.383 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -10.706 -11.002 2.888 1.00 0.00 H new ATOM 1038 N VAL A 65 -9.228 -11.052 6.307 1.00 0.00 N ATOM 1039 CA VAL A 65 -7.858 -10.938 6.863 1.00 0.00 C ATOM 1040 C VAL A 65 -6.788 -11.201 5.781 1.00 0.00 C ATOM 1041 O VAL A 65 -5.732 -10.546 5.756 1.00 0.00 O ATOM 1042 CB VAL A 65 -7.669 -11.911 8.082 1.00 0.00 C ATOM 1043 CG1 VAL A 65 -6.260 -11.778 8.707 1.00 0.00 C ATOM 1044 CG2 VAL A 65 -8.772 -11.682 9.149 1.00 0.00 C ATOM 0 H VAL A 65 -9.792 -11.775 6.753 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.727 -9.915 7.217 1.00 0.00 H new ATOM 0 HB VAL A 65 -7.764 -12.929 7.705 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.168 -12.467 9.547 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -5.505 -12.017 7.957 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -6.112 -10.757 9.058 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.620 -12.367 9.983 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.722 -10.655 9.510 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -9.751 -11.863 8.705 1.00 0.00 H new ATOM 1054 N GLU A 66 -7.098 -12.136 4.868 1.00 0.00 N ATOM 1055 CA GLU A 66 -6.225 -12.463 3.741 1.00 0.00 C ATOM 1056 C GLU A 66 -6.321 -11.377 2.659 1.00 0.00 C ATOM 1057 O GLU A 66 -5.308 -10.907 2.170 1.00 0.00 O ATOM 1058 CB GLU A 66 -6.557 -13.866 3.178 1.00 0.00 C ATOM 1059 CG GLU A 66 -6.353 -14.998 4.201 1.00 0.00 C ATOM 1060 CD GLU A 66 -6.607 -16.398 3.623 1.00 0.00 C ATOM 1061 OE1 GLU A 66 -5.787 -16.872 2.803 1.00 0.00 O ATOM 1062 OE2 GLU A 66 -7.622 -17.032 3.979 1.00 0.00 O ATOM 0 H GLU A 66 -7.959 -12.682 4.895 1.00 0.00 H new ATOM 0 HA GLU A 66 -5.194 -12.491 4.092 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -7.592 -13.877 2.836 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -5.932 -14.057 2.306 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -5.334 -14.951 4.585 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -7.020 -14.837 5.048 1.00 0.00 H new ATOM 1069 N ARG A 67 -7.542 -10.935 2.331 1.00 0.00 N ATOM 1070 CA ARG A 67 -7.756 -9.859 1.319 1.00 0.00 C ATOM 1071 C ARG A 67 -7.179 -8.485 1.775 1.00 0.00 C ATOM 1072 O ARG A 67 -7.016 -7.568 0.963 1.00 0.00 O ATOM 1073 CB ARG A 67 -9.261 -9.756 0.982 1.00 0.00 C ATOM 1074 CG ARG A 67 -9.836 -11.003 0.270 1.00 0.00 C ATOM 1075 CD ARG A 67 -9.259 -11.174 -1.147 1.00 0.00 C ATOM 1076 NE ARG A 67 -9.683 -10.064 -2.022 1.00 0.00 N ATOM 1077 CZ ARG A 67 -8.989 -9.541 -3.043 1.00 0.00 C ATOM 1078 NH1 ARG A 67 -7.762 -9.959 -3.344 1.00 0.00 N ATOM 1079 NH2 ARG A 67 -9.537 -8.579 -3.759 1.00 0.00 N ATOM 0 H ARG A 67 -8.402 -11.296 2.743 1.00 0.00 H new ATOM 0 HA ARG A 67 -7.206 -10.131 0.418 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -9.818 -9.588 1.904 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -9.422 -8.883 0.349 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -9.616 -11.892 0.861 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -10.921 -10.920 0.212 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -8.171 -11.210 -1.100 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -9.592 -12.123 -1.568 1.00 0.00 H new ATOM 0 HE ARG A 67 -10.597 -9.653 -1.831 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -7.325 -10.697 -2.792 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -7.259 -9.542 -4.127 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -10.474 -8.245 -3.532 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -9.024 -8.169 -4.540 1.00 0.00 H new ATOM 1093 N VAL A 68 -6.885 -8.381 3.082 1.00 0.00 N ATOM 1094 CA VAL A 68 -6.197 -7.239 3.700 1.00 0.00 C ATOM 1095 C VAL A 68 -4.667 -7.372 3.522 1.00 0.00 C ATOM 1096 O VAL A 68 -3.977 -6.376 3.246 1.00 0.00 O ATOM 1097 CB VAL A 68 -6.606 -7.131 5.234 1.00 0.00 C ATOM 1098 CG1 VAL A 68 -5.518 -6.477 6.119 1.00 0.00 C ATOM 1099 CG2 VAL A 68 -7.948 -6.367 5.385 1.00 0.00 C ATOM 0 H VAL A 68 -7.126 -9.109 3.754 1.00 0.00 H new ATOM 0 HA VAL A 68 -6.503 -6.318 3.204 1.00 0.00 H new ATOM 0 HB VAL A 68 -6.721 -8.155 5.590 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -5.865 -6.436 7.152 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -4.603 -7.067 6.067 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.319 -5.466 5.763 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -8.213 -6.302 6.440 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -7.843 -5.363 4.975 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -8.732 -6.899 4.846 1.00 0.00 H new ATOM 1109 N LYS A 69 -4.144 -8.606 3.677 1.00 0.00 N ATOM 1110 CA LYS A 69 -2.690 -8.850 3.656 1.00 0.00 C ATOM 1111 C LYS A 69 -2.145 -8.930 2.228 1.00 0.00 C ATOM 1112 O LYS A 69 -1.005 -8.514 1.983 1.00 0.00 O ATOM 1113 CB LYS A 69 -2.303 -10.122 4.458 1.00 0.00 C ATOM 1114 CG LYS A 69 -2.625 -11.476 3.794 1.00 0.00 C ATOM 1115 CD LYS A 69 -2.105 -12.690 4.597 1.00 0.00 C ATOM 1116 CE LYS A 69 -0.579 -12.653 4.808 1.00 0.00 C ATOM 1117 NZ LYS A 69 -0.058 -13.916 5.377 1.00 0.00 N ATOM 0 H LYS A 69 -4.706 -9.445 3.818 1.00 0.00 H new ATOM 0 HA LYS A 69 -2.227 -7.992 4.145 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -1.232 -10.086 4.659 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -2.810 -10.085 5.422 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -3.704 -11.565 3.672 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -2.189 -11.496 2.795 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -2.601 -12.719 5.567 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -2.373 -13.608 4.074 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -0.088 -12.457 3.855 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -0.327 -11.827 5.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 0.930 -13.782 5.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -0.632 -14.189 6.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -0.105 -14.666 4.658 1.00 0.00 H new ATOM 1131 N LYS A 70 -2.949 -9.463 1.284 1.00 0.00 N ATOM 1132 CA LYS A 70 -2.517 -9.615 -0.109 1.00 0.00 C ATOM 1133 C LYS A 70 -3.638 -9.376 -1.114 1.00 0.00 C ATOM 1134 O LYS A 70 -4.833 -9.424 -0.800 1.00 0.00 O ATOM 1135 CB LYS A 70 -1.816 -10.992 -0.396 1.00 0.00 C ATOM 1136 CG LYS A 70 -2.713 -12.215 -0.716 1.00 0.00 C ATOM 1137 CD LYS A 70 -3.482 -12.741 0.505 1.00 0.00 C ATOM 1138 CE LYS A 70 -4.374 -13.949 0.184 1.00 0.00 C ATOM 1139 NZ LYS A 70 -3.581 -15.146 -0.190 1.00 0.00 N ATOM 0 H LYS A 70 -3.897 -9.792 1.467 1.00 0.00 H new ATOM 0 HA LYS A 70 -1.773 -8.830 -0.247 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -1.134 -10.851 -1.234 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -1.207 -11.243 0.472 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -3.425 -11.941 -1.494 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -2.093 -13.016 -1.119 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -2.770 -13.019 1.282 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -4.099 -11.939 0.910 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.994 -14.182 1.050 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -5.050 -13.693 -0.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -4.221 -15.950 -0.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -3.047 -14.951 -1.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -2.918 -15.377 0.577 1.00 0.00 H new ATOM 1153 N PHE A 71 -3.171 -9.135 -2.332 1.00 0.00 N ATOM 1154 CA PHE A 71 -3.964 -8.963 -3.541 1.00 0.00 C ATOM 1155 C PHE A 71 -3.172 -9.593 -4.706 1.00 0.00 C ATOM 1156 O PHE A 71 -2.115 -10.210 -4.497 1.00 0.00 O ATOM 1157 CB PHE A 71 -4.239 -7.443 -3.783 1.00 0.00 C ATOM 1158 CG PHE A 71 -2.978 -6.566 -3.798 1.00 0.00 C ATOM 1159 CD1 PHE A 71 -2.237 -6.386 -4.968 1.00 0.00 C ATOM 1160 CD2 PHE A 71 -2.521 -5.939 -2.636 1.00 0.00 C ATOM 1161 CE1 PHE A 71 -1.090 -5.618 -4.979 1.00 0.00 C ATOM 1162 CE2 PHE A 71 -1.375 -5.168 -2.650 1.00 0.00 C ATOM 1163 CZ PHE A 71 -0.660 -5.008 -3.821 1.00 0.00 C ATOM 0 H PHE A 71 -2.171 -9.050 -2.512 1.00 0.00 H new ATOM 0 HA PHE A 71 -4.934 -9.453 -3.454 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -4.759 -7.327 -4.734 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -4.911 -7.079 -3.006 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.568 -6.857 -5.882 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -3.071 -6.059 -1.714 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -0.530 -5.495 -5.894 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -1.037 -4.689 -1.743 1.00 0.00 H new ATOM 0 HZ PHE A 71 0.236 -4.405 -3.829 1.00 0.00 H new ATOM 1173 N THR A 72 -3.685 -9.439 -5.921 1.00 0.00 N ATOM 1174 CA THR A 72 -2.975 -9.813 -7.149 1.00 0.00 C ATOM 1175 C THR A 72 -2.873 -8.560 -8.042 1.00 0.00 C ATOM 1176 O THR A 72 -3.617 -7.600 -7.839 1.00 0.00 O ATOM 1177 CB THR A 72 -3.708 -10.987 -7.901 1.00 0.00 C ATOM 1178 OG1 THR A 72 -4.357 -11.851 -6.947 1.00 0.00 O ATOM 1179 CG2 THR A 72 -2.725 -11.830 -8.736 1.00 0.00 C ATOM 0 H THR A 72 -4.612 -9.048 -6.088 1.00 0.00 H new ATOM 0 HA THR A 72 -1.978 -10.177 -6.901 1.00 0.00 H new ATOM 0 HB THR A 72 -4.441 -10.537 -8.571 1.00 0.00 H new ATOM 0 HG1 THR A 72 -5.153 -11.405 -6.590 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.268 -12.630 -9.240 1.00 0.00 H new ATOM 0 HG22 THR A 72 -2.242 -11.196 -9.479 1.00 0.00 H new ATOM 0 HG23 THR A 72 -1.969 -12.262 -8.081 1.00 0.00 H new ATOM 1187 N GLU A 73 -1.947 -8.556 -9.011 1.00 0.00 N ATOM 1188 CA GLU A 73 -1.788 -7.430 -9.943 1.00 0.00 C ATOM 1189 C GLU A 73 -2.914 -7.465 -10.995 1.00 0.00 C ATOM 1190 O GLU A 73 -3.479 -6.434 -11.338 1.00 0.00 O ATOM 1191 CB GLU A 73 -0.390 -7.454 -10.632 1.00 0.00 C ATOM 1192 CG GLU A 73 -0.108 -8.697 -11.501 1.00 0.00 C ATOM 1193 CD GLU A 73 1.133 -8.534 -12.392 1.00 0.00 C ATOM 1194 OE1 GLU A 73 1.009 -7.914 -13.474 1.00 0.00 O ATOM 1195 OE2 GLU A 73 2.230 -9.005 -12.019 1.00 0.00 O ATOM 0 H GLU A 73 -1.294 -9.323 -9.170 1.00 0.00 H new ATOM 0 HA GLU A 73 -1.855 -6.501 -9.376 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -0.295 -6.565 -11.256 1.00 0.00 H new ATOM 0 HB3 GLU A 73 0.378 -7.387 -9.862 1.00 0.00 H new ATOM 0 HG2 GLU A 73 0.027 -9.564 -10.854 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -0.976 -8.900 -12.129 1.00 0.00 H new ATOM 1202 N GLU A 74 -3.263 -8.695 -11.436 1.00 0.00 N ATOM 1203 CA GLU A 74 -4.176 -8.950 -12.574 1.00 0.00 C ATOM 1204 C GLU A 74 -5.633 -8.526 -12.274 1.00 0.00 C ATOM 1205 O GLU A 74 -6.364 -8.121 -13.183 1.00 0.00 O ATOM 1206 CB GLU A 74 -4.100 -10.448 -12.984 1.00 0.00 C ATOM 1207 CG GLU A 74 -4.400 -11.440 -11.851 1.00 0.00 C ATOM 1208 CD GLU A 74 -4.246 -12.909 -12.275 1.00 0.00 C ATOM 1209 OE1 GLU A 74 -5.235 -13.508 -12.759 1.00 0.00 O ATOM 1210 OE2 GLU A 74 -3.135 -13.469 -12.132 1.00 0.00 O ATOM 0 H GLU A 74 -2.913 -9.551 -11.005 1.00 0.00 H new ATOM 0 HA GLU A 74 -3.845 -8.332 -13.409 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -4.803 -10.624 -13.798 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -3.103 -10.654 -13.374 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -3.732 -11.238 -11.014 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -5.417 -11.277 -11.494 1.00 0.00 H new ATOM 1217 N GLU A 75 -6.030 -8.607 -10.989 1.00 0.00 N ATOM 1218 CA GLU A 75 -7.363 -8.161 -10.525 1.00 0.00 C ATOM 1219 C GLU A 75 -7.456 -6.615 -10.523 1.00 0.00 C ATOM 1220 O GLU A 75 -8.550 -6.051 -10.587 1.00 0.00 O ATOM 1221 CB GLU A 75 -7.662 -8.728 -9.108 1.00 0.00 C ATOM 1222 CG GLU A 75 -6.668 -8.280 -8.026 1.00 0.00 C ATOM 1223 CD GLU A 75 -7.049 -8.716 -6.605 1.00 0.00 C ATOM 1224 OE1 GLU A 75 -6.652 -9.824 -6.175 1.00 0.00 O ATOM 1225 OE2 GLU A 75 -7.741 -7.948 -5.908 1.00 0.00 O ATOM 0 H GLU A 75 -5.441 -8.981 -10.245 1.00 0.00 H new ATOM 0 HA GLU A 75 -8.112 -8.545 -11.217 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -8.666 -8.423 -8.812 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -7.661 -9.817 -9.157 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -5.683 -8.680 -8.265 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -6.586 -7.193 -8.051 1.00 0.00 H new ATOM 1232 N LEU A 76 -6.287 -5.953 -10.447 1.00 0.00 N ATOM 1233 CA LEU A 76 -6.171 -4.479 -10.446 1.00 0.00 C ATOM 1234 C LEU A 76 -6.104 -3.927 -11.885 1.00 0.00 C ATOM 1235 O LEU A 76 -6.318 -2.733 -12.108 1.00 0.00 O ATOM 1236 CB LEU A 76 -4.905 -4.065 -9.653 1.00 0.00 C ATOM 1237 CG LEU A 76 -4.808 -4.614 -8.197 1.00 0.00 C ATOM 1238 CD1 LEU A 76 -3.467 -4.231 -7.549 1.00 0.00 C ATOM 1239 CD2 LEU A 76 -6.013 -4.162 -7.334 1.00 0.00 C ATOM 0 H LEU A 76 -5.387 -6.429 -10.384 1.00 0.00 H new ATOM 0 HA LEU A 76 -7.056 -4.058 -9.968 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -4.027 -4.399 -10.206 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -4.863 -2.976 -9.615 1.00 0.00 H new ATOM 0 HG LEU A 76 -4.847 -5.702 -8.251 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -3.427 -4.627 -6.534 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -2.648 -4.649 -8.134 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -3.374 -3.145 -7.519 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.910 -4.564 -6.326 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -6.040 -3.073 -7.289 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -6.938 -4.530 -7.779 1.00 0.00 H new ATOM 1251 N LYS A 77 -5.810 -4.825 -12.853 1.00 0.00 N ATOM 1252 CA LYS A 77 -5.661 -4.468 -14.282 1.00 0.00 C ATOM 1253 C LYS A 77 -7.034 -4.293 -14.971 1.00 0.00 C ATOM 1254 O LYS A 77 -7.102 -3.835 -16.119 1.00 0.00 O ATOM 1255 CB LYS A 77 -4.842 -5.559 -15.024 1.00 0.00 C ATOM 1256 CG LYS A 77 -3.463 -5.874 -14.416 1.00 0.00 C ATOM 1257 CD LYS A 77 -2.460 -4.706 -14.483 1.00 0.00 C ATOM 1258 CE LYS A 77 -1.106 -5.077 -13.850 1.00 0.00 C ATOM 1259 NZ LYS A 77 -0.096 -4.007 -14.021 1.00 0.00 N ATOM 0 H LYS A 77 -5.669 -5.818 -12.665 1.00 0.00 H new ATOM 0 HA LYS A 77 -5.132 -3.516 -14.330 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -5.429 -6.477 -15.047 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -4.701 -5.244 -16.058 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -3.596 -6.164 -13.374 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -3.038 -6.733 -14.935 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -2.308 -4.417 -15.523 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -2.876 -3.840 -13.969 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -1.246 -5.276 -12.787 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -0.737 -5.998 -14.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.799 -4.300 -13.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 0.058 -3.834 -15.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -0.435 -3.134 -13.569 1.00 0.00 H new ATOM 1273 N THR A 78 -8.125 -4.659 -14.264 1.00 0.00 N ATOM 1274 CA THR A 78 -9.486 -4.585 -14.813 1.00 0.00 C ATOM 1275 C THR A 78 -10.013 -3.138 -14.763 1.00 0.00 C ATOM 1276 O THR A 78 -9.501 -2.303 -13.996 1.00 0.00 O ATOM 1277 CB THR A 78 -10.470 -5.563 -14.067 1.00 0.00 C ATOM 1278 OG1 THR A 78 -11.686 -5.709 -14.825 1.00 0.00 O ATOM 1279 CG2 THR A 78 -10.819 -5.095 -12.645 1.00 0.00 C ATOM 0 H THR A 78 -8.083 -5.010 -13.307 1.00 0.00 H new ATOM 0 HA THR A 78 -9.438 -4.902 -15.855 1.00 0.00 H new ATOM 0 HB THR A 78 -9.952 -6.518 -13.980 1.00 0.00 H new ATOM 0 HG1 THR A 78 -12.426 -5.288 -14.340 1.00 0.00 H new ATOM 0 HG21 THR A 78 -11.500 -5.810 -12.183 1.00 0.00 H new ATOM 0 HG22 THR A 78 -9.908 -5.026 -12.051 1.00 0.00 H new ATOM 0 HG23 THR A 78 -11.297 -4.117 -12.691 1.00 0.00 H new ATOM 1287 N LYS A 79 -11.051 -2.872 -15.574 1.00 0.00 N ATOM 1288 CA LYS A 79 -11.689 -1.549 -15.693 1.00 0.00 C ATOM 1289 C LYS A 79 -12.198 -1.065 -14.323 1.00 0.00 C ATOM 1290 O LYS A 79 -11.848 0.031 -13.874 1.00 0.00 O ATOM 1291 CB LYS A 79 -12.864 -1.646 -16.698 1.00 0.00 C ATOM 1292 CG LYS A 79 -13.662 -0.339 -16.920 1.00 0.00 C ATOM 1293 CD LYS A 79 -14.808 -0.513 -17.941 1.00 0.00 C ATOM 1294 CE LYS A 79 -15.681 0.748 -18.069 1.00 0.00 C ATOM 1295 NZ LYS A 79 -16.442 1.033 -16.821 1.00 0.00 N ATOM 0 H LYS A 79 -11.476 -3.579 -16.174 1.00 0.00 H new ATOM 0 HA LYS A 79 -10.956 -0.827 -16.053 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -12.471 -1.978 -17.659 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -13.552 -2.417 -16.352 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -14.075 -0.003 -15.969 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.985 0.442 -17.267 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -14.387 -0.760 -18.916 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -15.433 -1.354 -17.641 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -15.049 1.603 -18.311 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -16.378 0.623 -18.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -17.459 1.070 -17.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -16.262 0.281 -16.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -16.137 1.947 -16.429 1.00 0.00 H new ATOM 1309 N GLU A 80 -12.960 -1.956 -13.651 1.00 0.00 N ATOM 1310 CA GLU A 80 -13.656 -1.659 -12.384 1.00 0.00 C ATOM 1311 C GLU A 80 -12.667 -1.219 -11.291 1.00 0.00 C ATOM 1312 O GLU A 80 -12.938 -0.268 -10.569 1.00 0.00 O ATOM 1313 CB GLU A 80 -14.476 -2.888 -11.884 1.00 0.00 C ATOM 1314 CG GLU A 80 -15.670 -3.303 -12.777 1.00 0.00 C ATOM 1315 CD GLU A 80 -15.271 -3.861 -14.158 1.00 0.00 C ATOM 1316 OE1 GLU A 80 -14.466 -4.816 -14.202 1.00 0.00 O ATOM 1317 OE2 GLU A 80 -15.756 -3.365 -15.194 1.00 0.00 O ATOM 0 H GLU A 80 -13.109 -2.911 -13.978 1.00 0.00 H new ATOM 0 HA GLU A 80 -14.344 -0.838 -12.586 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -13.801 -3.739 -11.792 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -14.852 -2.669 -10.884 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -16.257 -4.056 -12.251 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -16.317 -2.438 -12.922 1.00 0.00 H new ATOM 1324 N ALA A 81 -11.509 -1.908 -11.213 1.00 0.00 N ATOM 1325 CA ALA A 81 -10.498 -1.676 -10.170 1.00 0.00 C ATOM 1326 C ALA A 81 -9.851 -0.295 -10.336 1.00 0.00 C ATOM 1327 O ALA A 81 -9.712 0.429 -9.369 1.00 0.00 O ATOM 1328 CB ALA A 81 -9.427 -2.775 -10.177 1.00 0.00 C ATOM 0 H ALA A 81 -11.252 -2.641 -11.874 1.00 0.00 H new ATOM 0 HA ALA A 81 -11.005 -1.707 -9.206 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -8.695 -2.574 -9.395 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -9.897 -3.742 -9.995 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -8.928 -2.790 -11.146 1.00 0.00 H new ATOM 1334 N LYS A 82 -9.490 0.060 -11.579 1.00 0.00 N ATOM 1335 CA LYS A 82 -8.839 1.356 -11.895 1.00 0.00 C ATOM 1336 C LYS A 82 -9.772 2.537 -11.595 1.00 0.00 C ATOM 1337 O LYS A 82 -9.329 3.594 -11.114 1.00 0.00 O ATOM 1338 CB LYS A 82 -8.396 1.372 -13.372 1.00 0.00 C ATOM 1339 CG LYS A 82 -7.365 0.282 -13.694 1.00 0.00 C ATOM 1340 CD LYS A 82 -6.953 0.258 -15.175 1.00 0.00 C ATOM 1341 CE LYS A 82 -5.876 -0.794 -15.440 1.00 0.00 C ATOM 1342 NZ LYS A 82 -5.473 -0.819 -16.860 1.00 0.00 N ATOM 0 H LYS A 82 -9.637 -0.535 -12.394 1.00 0.00 H new ATOM 0 HA LYS A 82 -7.960 1.464 -11.259 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -9.270 1.240 -14.010 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -7.973 2.348 -13.609 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -6.478 0.436 -13.079 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -7.776 -0.690 -13.422 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -7.826 0.050 -15.793 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -6.583 1.241 -15.467 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -5.005 -0.587 -14.818 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -6.248 -1.777 -15.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.741 -1.545 -17.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -6.299 -1.041 -17.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -5.094 0.111 -17.130 1.00 0.00 H new ATOM 1356 N GLU A 83 -11.069 2.336 -11.886 1.00 0.00 N ATOM 1357 CA GLU A 83 -12.129 3.287 -11.519 1.00 0.00 C ATOM 1358 C GLU A 83 -12.219 3.385 -9.983 1.00 0.00 C ATOM 1359 O GLU A 83 -12.257 4.474 -9.444 1.00 0.00 O ATOM 1360 CB GLU A 83 -13.491 2.859 -12.139 1.00 0.00 C ATOM 1361 CG GLU A 83 -13.478 2.788 -13.677 1.00 0.00 C ATOM 1362 CD GLU A 83 -14.800 2.288 -14.287 1.00 0.00 C ATOM 1363 OE1 GLU A 83 -15.114 1.086 -14.145 1.00 0.00 O ATOM 1364 OE2 GLU A 83 -15.518 3.086 -14.941 1.00 0.00 O ATOM 0 H GLU A 83 -11.410 1.512 -12.381 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.885 4.271 -11.919 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -13.770 1.883 -11.742 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -14.261 3.563 -11.823 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -13.256 3.778 -14.075 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -12.670 2.129 -13.994 1.00 0.00 H new ATOM 1371 N ARG A 84 -12.170 2.225 -9.299 1.00 0.00 N ATOM 1372 CA ARG A 84 -12.206 2.132 -7.816 1.00 0.00 C ATOM 1373 C ARG A 84 -11.018 2.868 -7.168 1.00 0.00 C ATOM 1374 O ARG A 84 -11.177 3.473 -6.113 1.00 0.00 O ATOM 1375 CB ARG A 84 -12.215 0.645 -7.364 1.00 0.00 C ATOM 1376 CG ARG A 84 -13.572 -0.067 -7.546 1.00 0.00 C ATOM 1377 CD ARG A 84 -13.516 -1.565 -7.195 1.00 0.00 C ATOM 1378 NE ARG A 84 -14.834 -2.211 -7.323 1.00 0.00 N ATOM 1379 CZ ARG A 84 -15.116 -3.469 -6.964 1.00 0.00 C ATOM 1380 NH1 ARG A 84 -14.166 -4.293 -6.522 1.00 0.00 N ATOM 1381 NH2 ARG A 84 -16.363 -3.897 -7.026 1.00 0.00 N ATOM 0 H ARG A 84 -12.104 1.317 -9.758 1.00 0.00 H new ATOM 0 HA ARG A 84 -13.124 2.616 -7.483 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -11.455 0.102 -7.926 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -11.930 0.595 -6.313 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -14.319 0.420 -6.919 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -13.900 0.047 -8.579 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -12.802 -2.064 -7.850 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -13.151 -1.685 -6.175 1.00 0.00 H new ATOM 0 HE ARG A 84 -15.593 -1.655 -7.717 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -13.202 -3.969 -6.452 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -14.404 -5.248 -6.254 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -17.102 -3.271 -7.345 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -16.588 -4.854 -6.755 1.00 0.00 H new ATOM 1395 N TRP A 85 -9.842 2.801 -7.827 1.00 0.00 N ATOM 1396 CA TRP A 85 -8.611 3.505 -7.394 1.00 0.00 C ATOM 1397 C TRP A 85 -8.841 5.028 -7.419 1.00 0.00 C ATOM 1398 O TRP A 85 -8.399 5.749 -6.524 1.00 0.00 O ATOM 1399 CB TRP A 85 -7.402 3.154 -8.322 1.00 0.00 C ATOM 1400 CG TRP A 85 -6.777 1.779 -8.143 1.00 0.00 C ATOM 1401 CD1 TRP A 85 -7.361 0.621 -7.697 1.00 0.00 C ATOM 1402 CD2 TRP A 85 -5.411 1.441 -8.441 1.00 0.00 C ATOM 1403 NE1 TRP A 85 -6.443 -0.398 -7.695 1.00 0.00 N ATOM 1404 CE2 TRP A 85 -5.241 0.082 -8.140 1.00 0.00 C ATOM 1405 CE3 TRP A 85 -4.316 2.168 -8.924 1.00 0.00 C ATOM 1406 CZ2 TRP A 85 -4.032 -0.571 -8.309 1.00 0.00 C ATOM 1407 CZ3 TRP A 85 -3.107 1.517 -9.091 1.00 0.00 C ATOM 1408 CH2 TRP A 85 -2.974 0.156 -8.782 1.00 0.00 C ATOM 0 H TRP A 85 -9.717 2.255 -8.679 1.00 0.00 H new ATOM 0 HA TRP A 85 -8.379 3.179 -6.380 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -7.731 3.246 -9.357 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -6.626 3.903 -8.166 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -8.393 0.525 -7.392 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -6.627 -1.359 -7.408 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -4.414 3.217 -9.162 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -3.927 -1.620 -8.075 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -2.254 2.064 -9.464 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -2.018 -0.328 -8.920 1.00 0.00 H new ATOM 1419 N ARG A 86 -9.532 5.484 -8.476 1.00 0.00 N ATOM 1420 CA ARG A 86 -9.869 6.906 -8.688 1.00 0.00 C ATOM 1421 C ARG A 86 -10.920 7.386 -7.665 1.00 0.00 C ATOM 1422 O ARG A 86 -10.781 8.465 -7.096 1.00 0.00 O ATOM 1423 CB ARG A 86 -10.392 7.103 -10.132 1.00 0.00 C ATOM 1424 CG ARG A 86 -10.882 8.527 -10.454 1.00 0.00 C ATOM 1425 CD ARG A 86 -11.369 8.661 -11.899 1.00 0.00 C ATOM 1426 NE ARG A 86 -11.874 10.016 -12.189 1.00 0.00 N ATOM 1427 CZ ARG A 86 -12.116 10.498 -13.414 1.00 0.00 C ATOM 1428 NH1 ARG A 86 -11.840 9.776 -14.496 1.00 0.00 N ATOM 1429 NH2 ARG A 86 -12.609 11.720 -13.555 1.00 0.00 N ATOM 0 H ARG A 86 -9.877 4.872 -9.216 1.00 0.00 H new ATOM 0 HA ARG A 86 -8.969 7.503 -8.544 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -9.597 6.841 -10.830 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -11.211 6.405 -10.305 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -11.691 8.793 -9.774 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -10.073 9.236 -10.279 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -10.551 8.425 -12.580 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -12.158 7.933 -12.084 1.00 0.00 H new ATOM 0 HE ARG A 86 -12.052 10.632 -11.396 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -11.439 8.843 -14.398 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -12.029 10.155 -15.424 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -12.803 12.290 -12.732 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -12.795 12.091 -14.487 1.00 0.00 H new ATOM 1443 N LYS A 87 -11.967 6.561 -7.450 1.00 0.00 N ATOM 1444 CA LYS A 87 -13.034 6.817 -6.443 1.00 0.00 C ATOM 1445 C LYS A 87 -12.436 6.870 -5.027 1.00 0.00 C ATOM 1446 O LYS A 87 -12.909 7.612 -4.161 1.00 0.00 O ATOM 1447 CB LYS A 87 -14.144 5.712 -6.518 1.00 0.00 C ATOM 1448 CG LYS A 87 -15.265 5.942 -7.568 1.00 0.00 C ATOM 1449 CD LYS A 87 -14.741 6.220 -8.993 1.00 0.00 C ATOM 1450 CE LYS A 87 -15.851 6.285 -10.051 1.00 0.00 C ATOM 1451 NZ LYS A 87 -15.333 6.764 -11.362 1.00 0.00 N ATOM 0 H LYS A 87 -12.102 5.693 -7.969 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.489 7.781 -6.668 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -13.664 4.757 -6.732 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -14.607 5.623 -5.535 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -15.910 5.064 -7.594 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -15.882 6.782 -7.248 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -14.194 7.163 -8.993 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -14.032 5.440 -9.269 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -16.295 5.297 -10.174 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -16.643 6.950 -9.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -16.110 6.795 -12.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -14.932 7.717 -11.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -14.595 6.115 -11.702 1.00 0.00 H new ATOM 1465 N PHE A 88 -11.387 6.068 -4.829 1.00 0.00 N ATOM 1466 CA PHE A 88 -10.658 5.977 -3.563 1.00 0.00 C ATOM 1467 C PHE A 88 -9.779 7.233 -3.363 1.00 0.00 C ATOM 1468 O PHE A 88 -9.674 7.748 -2.253 1.00 0.00 O ATOM 1469 CB PHE A 88 -9.816 4.677 -3.566 1.00 0.00 C ATOM 1470 CG PHE A 88 -9.268 4.243 -2.218 1.00 0.00 C ATOM 1471 CD1 PHE A 88 -10.056 4.304 -1.070 1.00 0.00 C ATOM 1472 CD2 PHE A 88 -7.982 3.741 -2.105 1.00 0.00 C ATOM 1473 CE1 PHE A 88 -9.569 3.878 0.143 1.00 0.00 C ATOM 1474 CE2 PHE A 88 -7.494 3.325 -0.893 1.00 0.00 C ATOM 1475 CZ PHE A 88 -8.283 3.393 0.231 1.00 0.00 C ATOM 0 H PHE A 88 -11.015 5.455 -5.555 1.00 0.00 H new ATOM 0 HA PHE A 88 -11.355 5.937 -2.726 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -10.430 3.869 -3.965 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.979 4.810 -4.252 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -11.062 4.691 -1.134 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -7.356 3.676 -2.983 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -10.193 3.924 1.024 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -6.487 2.943 -0.821 1.00 0.00 H new ATOM 0 HZ PHE A 88 -7.894 3.066 1.184 1.00 0.00 H new ATOM 1485 N PHE A 89 -9.169 7.726 -4.464 1.00 0.00 N ATOM 1486 CA PHE A 89 -8.424 9.003 -4.480 1.00 0.00 C ATOM 1487 C PHE A 89 -9.362 10.186 -4.151 1.00 0.00 C ATOM 1488 O PHE A 89 -8.996 11.065 -3.373 1.00 0.00 O ATOM 1489 CB PHE A 89 -7.719 9.226 -5.865 1.00 0.00 C ATOM 1490 CG PHE A 89 -7.469 10.703 -6.243 1.00 0.00 C ATOM 1491 CD1 PHE A 89 -6.657 11.519 -5.450 1.00 0.00 C ATOM 1492 CD2 PHE A 89 -8.093 11.284 -7.353 1.00 0.00 C ATOM 1493 CE1 PHE A 89 -6.471 12.852 -5.759 1.00 0.00 C ATOM 1494 CE2 PHE A 89 -7.906 12.624 -7.655 1.00 0.00 C ATOM 1495 CZ PHE A 89 -7.097 13.405 -6.858 1.00 0.00 C ATOM 0 H PHE A 89 -9.180 7.249 -5.366 1.00 0.00 H new ATOM 0 HA PHE A 89 -7.652 8.952 -3.712 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -6.763 8.702 -5.857 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -8.328 8.766 -6.643 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -6.168 11.101 -4.583 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -8.729 10.680 -7.983 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -5.833 13.464 -5.138 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -8.395 13.056 -8.516 1.00 0.00 H new ATOM 0 HZ PHE A 89 -6.953 14.449 -7.093 1.00 0.00 H new ATOM 1505 N THR A 90 -10.559 10.204 -4.764 1.00 0.00 N ATOM 1506 CA THR A 90 -11.517 11.322 -4.616 1.00 0.00 C ATOM 1507 C THR A 90 -12.023 11.461 -3.158 1.00 0.00 C ATOM 1508 O THR A 90 -12.610 12.485 -2.799 1.00 0.00 O ATOM 1509 CB THR A 90 -12.705 11.230 -5.634 1.00 0.00 C ATOM 1510 OG1 THR A 90 -13.407 9.988 -5.483 1.00 0.00 O ATOM 1511 CG2 THR A 90 -12.215 11.381 -7.096 1.00 0.00 C ATOM 0 H THR A 90 -10.890 9.454 -5.371 1.00 0.00 H new ATOM 0 HA THR A 90 -10.968 12.232 -4.856 1.00 0.00 H new ATOM 0 HB THR A 90 -13.384 12.054 -5.415 1.00 0.00 H new ATOM 0 HG1 THR A 90 -12.928 9.417 -4.847 1.00 0.00 H new ATOM 0 HG21 THR A 90 -13.066 11.312 -7.774 1.00 0.00 H new ATOM 0 HG22 THR A 90 -11.731 12.350 -7.219 1.00 0.00 H new ATOM 0 HG23 THR A 90 -11.503 10.588 -7.325 1.00 0.00 H new ATOM 1519 N ILE A 91 -11.810 10.411 -2.338 1.00 0.00 N ATOM 1520 CA ILE A 91 -11.982 10.484 -0.872 1.00 0.00 C ATOM 1521 C ILE A 91 -10.838 11.341 -0.258 1.00 0.00 C ATOM 1522 O ILE A 91 -11.079 12.253 0.540 1.00 0.00 O ATOM 1523 CB ILE A 91 -11.974 9.039 -0.219 1.00 0.00 C ATOM 1524 CG1 ILE A 91 -13.017 8.098 -0.908 1.00 0.00 C ATOM 1525 CG2 ILE A 91 -12.216 9.107 1.312 1.00 0.00 C ATOM 1526 CD1 ILE A 91 -13.032 6.658 -0.394 1.00 0.00 C ATOM 0 H ILE A 91 -11.515 9.493 -2.671 1.00 0.00 H new ATOM 0 HA ILE A 91 -12.947 10.946 -0.663 1.00 0.00 H new ATOM 0 HB ILE A 91 -10.983 8.615 -0.380 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -14.011 8.525 -0.775 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -12.817 8.083 -1.979 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -12.204 8.099 1.727 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -11.430 9.701 1.779 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -13.184 9.569 1.507 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -13.787 6.087 -0.934 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -12.053 6.205 -0.552 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -13.266 6.654 0.671 1.00 0.00 H new ATOM 1538 N PHE A 92 -9.590 11.055 -0.681 1.00 0.00 N ATOM 1539 CA PHE A 92 -8.362 11.629 -0.073 1.00 0.00 C ATOM 1540 C PHE A 92 -7.803 12.834 -0.832 1.00 0.00 C ATOM 1541 O PHE A 92 -6.712 13.303 -0.504 1.00 0.00 O ATOM 1542 CB PHE A 92 -7.271 10.546 0.021 1.00 0.00 C ATOM 1543 CG PHE A 92 -7.750 9.300 0.718 1.00 0.00 C ATOM 1544 CD1 PHE A 92 -8.266 9.362 2.007 1.00 0.00 C ATOM 1545 CD2 PHE A 92 -7.708 8.075 0.080 1.00 0.00 C ATOM 1546 CE1 PHE A 92 -8.722 8.228 2.616 1.00 0.00 C ATOM 1547 CE2 PHE A 92 -8.161 6.947 0.700 1.00 0.00 C ATOM 1548 CZ PHE A 92 -8.663 7.024 1.959 1.00 0.00 C ATOM 0 H PHE A 92 -9.400 10.419 -1.455 1.00 0.00 H new ATOM 0 HA PHE A 92 -8.652 11.983 0.916 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -6.932 10.289 -0.983 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -6.410 10.948 0.555 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -8.306 10.308 2.527 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -7.311 8.009 -0.922 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -9.129 8.278 3.615 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -8.120 5.996 0.191 1.00 0.00 H new ATOM 0 HZ PHE A 92 -9.019 6.130 2.448 1.00 0.00 H new ATOM 1558 N GLU A 93 -8.538 13.344 -1.828 1.00 0.00 N ATOM 1559 CA GLU A 93 -8.100 14.533 -2.586 1.00 0.00 C ATOM 1560 C GLU A 93 -8.101 15.795 -1.680 1.00 0.00 C ATOM 1561 O GLU A 93 -7.408 16.773 -1.970 1.00 0.00 O ATOM 1562 CB GLU A 93 -8.949 14.695 -3.888 1.00 0.00 C ATOM 1563 CG GLU A 93 -10.478 14.857 -3.722 1.00 0.00 C ATOM 1564 CD GLU A 93 -10.939 16.288 -3.404 1.00 0.00 C ATOM 1565 OE1 GLU A 93 -10.754 17.187 -4.255 1.00 0.00 O ATOM 1566 OE2 GLU A 93 -11.508 16.517 -2.326 1.00 0.00 O ATOM 0 H GLU A 93 -9.433 12.959 -2.130 1.00 0.00 H new ATOM 0 HA GLU A 93 -7.068 14.397 -2.909 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -8.574 15.564 -4.429 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -8.769 13.825 -4.519 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -10.967 14.527 -4.639 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -10.816 14.195 -2.925 1.00 0.00 H new ATOM 1573 N LYS A 94 -8.862 15.734 -0.560 1.00 0.00 N ATOM 1574 CA LYS A 94 -8.838 16.763 0.505 1.00 0.00 C ATOM 1575 C LYS A 94 -7.506 16.729 1.298 1.00 0.00 C ATOM 1576 O LYS A 94 -7.015 17.782 1.728 1.00 0.00 O ATOM 1577 CB LYS A 94 -10.021 16.557 1.499 1.00 0.00 C ATOM 1578 CG LYS A 94 -11.436 16.799 0.927 1.00 0.00 C ATOM 1579 CD LYS A 94 -11.689 18.269 0.511 1.00 0.00 C ATOM 1580 CE LYS A 94 -11.682 19.245 1.700 1.00 0.00 C ATOM 1581 NZ LYS A 94 -11.864 20.650 1.258 1.00 0.00 N ATOM 0 H LYS A 94 -9.510 14.969 -0.371 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.934 17.732 0.014 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -9.975 15.537 1.882 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -9.875 17.223 2.349 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -11.585 16.154 0.061 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.176 16.508 1.673 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -10.926 18.574 -0.205 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -12.650 18.335 0.001 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -12.477 18.977 2.396 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -10.740 19.153 2.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -11.854 21.279 2.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -11.092 20.914 0.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -12.774 20.743 0.764 1.00 0.00 H new ATOM 1595 N LYS A 95 -6.928 15.515 1.495 1.00 0.00 N ATOM 1596 CA LYS A 95 -5.781 15.308 2.418 1.00 0.00 C ATOM 1597 C LYS A 95 -4.498 14.815 1.697 1.00 0.00 C ATOM 1598 O LYS A 95 -3.502 15.551 1.664 1.00 0.00 O ATOM 1599 CB LYS A 95 -6.155 14.394 3.644 1.00 0.00 C ATOM 1600 CG LYS A 95 -6.966 13.096 3.386 1.00 0.00 C ATOM 1601 CD LYS A 95 -8.468 13.346 3.109 1.00 0.00 C ATOM 1602 CE LYS A 95 -9.180 14.185 4.193 1.00 0.00 C ATOM 1603 NZ LYS A 95 -9.260 13.509 5.507 1.00 0.00 N ATOM 0 H LYS A 95 -7.238 14.664 1.026 1.00 0.00 H new ATOM 0 HA LYS A 95 -5.544 16.294 2.816 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -5.227 14.111 4.140 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -6.721 15.003 4.349 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -6.532 12.569 2.536 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -6.869 12.440 4.251 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -8.570 13.852 2.149 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -8.974 12.385 3.018 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -8.653 15.132 4.312 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -10.188 14.422 3.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -9.917 14.027 6.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -9.602 12.536 5.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -8.317 13.488 5.945 1.00 0.00 H new ATOM 1617 N ILE A 96 -4.508 13.584 1.125 1.00 0.00 N ATOM 1618 CA ILE A 96 -3.295 12.990 0.508 1.00 0.00 C ATOM 1619 C ILE A 96 -3.031 13.617 -0.880 1.00 0.00 C ATOM 1620 O ILE A 96 -3.609 13.206 -1.895 1.00 0.00 O ATOM 1621 CB ILE A 96 -3.358 11.417 0.388 1.00 0.00 C ATOM 1622 CG1 ILE A 96 -3.829 10.748 1.722 1.00 0.00 C ATOM 1623 CG2 ILE A 96 -1.979 10.847 -0.053 1.00 0.00 C ATOM 1624 CD1 ILE A 96 -3.020 11.115 2.962 1.00 0.00 C ATOM 0 H ILE A 96 -5.335 12.988 1.078 1.00 0.00 H new ATOM 0 HA ILE A 96 -2.469 13.220 1.181 1.00 0.00 H new ATOM 0 HB ILE A 96 -4.098 11.177 -0.376 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -4.870 11.019 1.896 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.798 9.666 1.596 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.042 9.762 -0.130 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -1.706 11.265 -1.022 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -1.222 11.115 0.684 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -3.430 10.598 3.830 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -1.981 10.818 2.820 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -3.071 12.192 3.124 1.00 0.00 H new ATOM 1636 N GLU A 97 -2.188 14.655 -0.877 1.00 0.00 N ATOM 1637 CA GLU A 97 -1.723 15.353 -2.091 1.00 0.00 C ATOM 1638 C GLU A 97 -0.619 14.538 -2.791 1.00 0.00 C ATOM 1639 O GLU A 97 -0.513 14.527 -4.022 1.00 0.00 O ATOM 1640 CB GLU A 97 -1.168 16.742 -1.697 1.00 0.00 C ATOM 1641 CG GLU A 97 -2.122 17.598 -0.852 1.00 0.00 C ATOM 1642 CD GLU A 97 -1.459 18.882 -0.315 1.00 0.00 C ATOM 1643 OE1 GLU A 97 -0.718 18.802 0.695 1.00 0.00 O ATOM 1644 OE2 GLU A 97 -1.650 19.964 -0.917 1.00 0.00 O ATOM 0 H GLU A 97 -1.800 15.044 -0.018 1.00 0.00 H new ATOM 0 HA GLU A 97 -2.561 15.468 -2.778 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -0.239 16.603 -1.143 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -0.919 17.290 -2.606 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -2.990 17.868 -1.454 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -2.487 17.006 -0.013 1.00 0.00 H new ATOM 1651 N ASP A 98 0.188 13.838 -1.968 1.00 0.00 N ATOM 1652 CA ASP A 98 1.357 13.039 -2.412 1.00 0.00 C ATOM 1653 C ASP A 98 0.941 11.645 -2.947 1.00 0.00 C ATOM 1654 O ASP A 98 1.766 10.730 -2.983 1.00 0.00 O ATOM 1655 CB ASP A 98 2.353 12.867 -1.221 1.00 0.00 C ATOM 1656 CG ASP A 98 3.019 14.180 -0.766 1.00 0.00 C ATOM 1657 OD1 ASP A 98 4.033 14.584 -1.380 1.00 0.00 O ATOM 1658 OD2 ASP A 98 2.541 14.811 0.206 1.00 0.00 O ATOM 0 H ASP A 98 0.046 13.809 -0.958 1.00 0.00 H new ATOM 0 HA ASP A 98 1.835 13.577 -3.231 1.00 0.00 H new ATOM 0 HB2 ASP A 98 1.821 12.430 -0.376 1.00 0.00 H new ATOM 0 HB3 ASP A 98 3.130 12.159 -1.510 1.00 0.00 H new ATOM 1663 N TYR A 99 -0.303 11.520 -3.444 1.00 0.00 N ATOM 1664 CA TYR A 99 -0.927 10.217 -3.740 1.00 0.00 C ATOM 1665 C TYR A 99 -0.320 9.532 -4.990 1.00 0.00 C ATOM 1666 O TYR A 99 -0.173 8.312 -5.010 1.00 0.00 O ATOM 1667 CB TYR A 99 -2.471 10.387 -3.897 1.00 0.00 C ATOM 1668 CG TYR A 99 -2.945 10.909 -5.258 1.00 0.00 C ATOM 1669 CD1 TYR A 99 -2.826 12.255 -5.607 1.00 0.00 C ATOM 1670 CD2 TYR A 99 -3.492 10.032 -6.208 1.00 0.00 C ATOM 1671 CE1 TYR A 99 -3.239 12.709 -6.849 1.00 0.00 C ATOM 1672 CE2 TYR A 99 -3.899 10.476 -7.446 1.00 0.00 C ATOM 1673 CZ TYR A 99 -3.771 11.813 -7.769 1.00 0.00 C ATOM 1674 OH TYR A 99 -4.175 12.256 -9.010 1.00 0.00 O ATOM 0 H TYR A 99 -0.903 12.318 -3.652 1.00 0.00 H new ATOM 0 HA TYR A 99 -0.719 9.560 -2.896 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -2.945 9.423 -3.713 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -2.824 11.069 -3.123 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -2.406 12.953 -4.898 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -3.596 8.985 -5.962 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -3.148 13.755 -7.101 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -4.316 9.782 -8.161 1.00 0.00 H new ATOM 0 HH TYR A 99 -4.522 11.501 -9.530 1.00 0.00 H new ATOM 1684 N ASN A 100 0.045 10.332 -6.020 1.00 0.00 N ATOM 1685 CA ASN A 100 0.428 9.806 -7.360 1.00 0.00 C ATOM 1686 C ASN A 100 1.950 9.659 -7.531 1.00 0.00 C ATOM 1687 O ASN A 100 2.449 9.602 -8.660 1.00 0.00 O ATOM 1688 CB ASN A 100 -0.203 10.675 -8.505 1.00 0.00 C ATOM 1689 CG ASN A 100 0.070 12.199 -8.473 1.00 0.00 C ATOM 1690 OD1 ASN A 100 1.256 12.639 -8.073 1.00 0.00 O flip ATOM 1691 ND2 ASN A 100 -0.792 12.987 -8.862 1.00 0.00 N flip ATOM 0 H ASN A 100 0.083 11.349 -5.952 1.00 0.00 H new ATOM 0 HA ASN A 100 0.018 8.799 -7.433 1.00 0.00 H new ATOM 0 HB2 ASN A 100 0.156 10.288 -9.459 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -1.283 10.525 -8.486 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -1.701 12.639 -9.168 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -0.597 13.988 -8.879 1.00 0.00 H new ATOM 1698 N PHE A 101 2.679 9.569 -6.409 1.00 0.00 N ATOM 1699 CA PHE A 101 4.139 9.410 -6.421 1.00 0.00 C ATOM 1700 C PHE A 101 4.489 7.914 -6.539 1.00 0.00 C ATOM 1701 O PHE A 101 3.859 7.072 -5.883 1.00 0.00 O ATOM 1702 CB PHE A 101 4.770 10.039 -5.151 1.00 0.00 C ATOM 1703 CG PHE A 101 6.297 9.977 -5.117 1.00 0.00 C ATOM 1704 CD1 PHE A 101 7.058 10.773 -5.975 1.00 0.00 C ATOM 1705 CD2 PHE A 101 6.971 9.132 -4.232 1.00 0.00 C ATOM 1706 CE1 PHE A 101 8.438 10.724 -5.952 1.00 0.00 C ATOM 1707 CE2 PHE A 101 8.351 9.085 -4.211 1.00 0.00 C ATOM 1708 CZ PHE A 101 9.084 9.884 -5.069 1.00 0.00 C ATOM 0 H PHE A 101 2.275 9.604 -5.473 1.00 0.00 H new ATOM 0 HA PHE A 101 4.553 9.935 -7.282 1.00 0.00 H new ATOM 0 HB2 PHE A 101 4.458 11.081 -5.081 1.00 0.00 H new ATOM 0 HB3 PHE A 101 4.377 9.529 -4.272 1.00 0.00 H new ATOM 0 HD1 PHE A 101 6.560 11.437 -6.667 1.00 0.00 H new ATOM 0 HD2 PHE A 101 6.406 8.508 -3.556 1.00 0.00 H new ATOM 0 HE1 PHE A 101 9.012 11.344 -6.626 1.00 0.00 H new ATOM 0 HE2 PHE A 101 8.858 8.424 -3.524 1.00 0.00 H new ATOM 0 HZ PHE A 101 10.163 9.850 -5.048 1.00 0.00 H new ATOM 1718 N GLY A 102 5.489 7.614 -7.383 1.00 0.00 N ATOM 1719 CA GLY A 102 5.892 6.247 -7.682 1.00 0.00 C ATOM 1720 C GLY A 102 6.531 5.534 -6.499 1.00 0.00 C ATOM 1721 O GLY A 102 7.608 5.932 -6.042 1.00 0.00 O ATOM 0 H GLY A 102 6.037 8.320 -7.874 1.00 0.00 H new ATOM 0 HA2 GLY A 102 5.019 5.682 -8.009 1.00 0.00 H new ATOM 0 HA3 GLY A 102 6.596 6.257 -8.514 1.00 0.00 H new ATOM 1725 N THR A 103 5.849 4.489 -5.995 1.00 0.00 N ATOM 1726 CA THR A 103 6.273 3.749 -4.788 1.00 0.00 C ATOM 1727 C THR A 103 6.158 2.220 -4.997 1.00 0.00 C ATOM 1728 O THR A 103 5.356 1.750 -5.813 1.00 0.00 O ATOM 1729 CB THR A 103 5.406 4.189 -3.568 1.00 0.00 C ATOM 1730 OG1 THR A 103 5.264 5.614 -3.598 1.00 0.00 O ATOM 1731 CG2 THR A 103 6.020 3.775 -2.214 1.00 0.00 C ATOM 0 H THR A 103 4.989 4.133 -6.411 1.00 0.00 H new ATOM 0 HA THR A 103 7.320 3.983 -4.594 1.00 0.00 H new ATOM 0 HB THR A 103 4.442 3.687 -3.652 1.00 0.00 H new ATOM 0 HG1 THR A 103 4.655 5.867 -4.323 1.00 0.00 H new ATOM 0 HG21 THR A 103 5.372 4.109 -1.403 1.00 0.00 H new ATOM 0 HG22 THR A 103 6.119 2.690 -2.176 1.00 0.00 H new ATOM 0 HG23 THR A 103 7.003 4.233 -2.105 1.00 0.00 H new ATOM 1739 N LEU A 104 6.968 1.461 -4.241 1.00 0.00 N ATOM 1740 CA LEU A 104 7.023 -0.005 -4.312 1.00 0.00 C ATOM 1741 C LEU A 104 6.196 -0.580 -3.155 1.00 0.00 C ATOM 1742 O LEU A 104 6.530 -0.367 -1.986 1.00 0.00 O ATOM 1743 CB LEU A 104 8.513 -0.455 -4.235 1.00 0.00 C ATOM 1744 CG LEU A 104 8.896 -1.883 -4.715 1.00 0.00 C ATOM 1745 CD1 LEU A 104 8.462 -2.969 -3.727 1.00 0.00 C ATOM 1746 CD2 LEU A 104 8.348 -2.136 -6.124 1.00 0.00 C ATOM 0 H LEU A 104 7.611 1.856 -3.555 1.00 0.00 H new ATOM 0 HA LEU A 104 6.605 -0.373 -5.249 1.00 0.00 H new ATOM 0 HB2 LEU A 104 9.102 0.256 -4.815 1.00 0.00 H new ATOM 0 HB3 LEU A 104 8.832 -0.360 -3.197 1.00 0.00 H new ATOM 0 HG LEU A 104 9.984 -1.937 -4.758 1.00 0.00 H new ATOM 0 HD11 LEU A 104 8.753 -3.947 -4.110 1.00 0.00 H new ATOM 0 HD12 LEU A 104 8.943 -2.798 -2.764 1.00 0.00 H new ATOM 0 HD13 LEU A 104 7.380 -2.936 -3.602 1.00 0.00 H new ATOM 0 HD21 LEU A 104 8.624 -3.140 -6.447 1.00 0.00 H new ATOM 0 HD22 LEU A 104 7.262 -2.044 -6.114 1.00 0.00 H new ATOM 0 HD23 LEU A 104 8.768 -1.404 -6.814 1.00 0.00 H new ATOM 1758 N LEU A 105 5.123 -1.303 -3.496 1.00 0.00 N ATOM 1759 CA LEU A 105 4.245 -1.972 -2.526 1.00 0.00 C ATOM 1760 C LEU A 105 4.457 -3.479 -2.602 1.00 0.00 C ATOM 1761 O LEU A 105 4.629 -4.036 -3.685 1.00 0.00 O ATOM 1762 CB LEU A 105 2.759 -1.626 -2.814 1.00 0.00 C ATOM 1763 CG LEU A 105 1.677 -2.302 -1.906 1.00 0.00 C ATOM 1764 CD1 LEU A 105 1.908 -2.009 -0.407 1.00 0.00 C ATOM 1765 CD2 LEU A 105 0.252 -1.894 -2.342 1.00 0.00 C ATOM 0 H LEU A 105 4.836 -1.442 -4.465 1.00 0.00 H new ATOM 0 HA LEU A 105 4.492 -1.624 -1.523 1.00 0.00 H new ATOM 0 HB2 LEU A 105 2.642 -0.545 -2.731 1.00 0.00 H new ATOM 0 HB3 LEU A 105 2.545 -1.892 -3.849 1.00 0.00 H new ATOM 0 HG LEU A 105 1.777 -3.379 -2.038 1.00 0.00 H new ATOM 0 HD11 LEU A 105 1.133 -2.498 0.183 1.00 0.00 H new ATOM 0 HD12 LEU A 105 2.885 -2.388 -0.109 1.00 0.00 H new ATOM 0 HD13 LEU A 105 1.869 -0.933 -0.236 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -0.479 -2.378 -1.694 1.00 0.00 H new ATOM 0 HD22 LEU A 105 0.144 -0.812 -2.266 1.00 0.00 H new ATOM 0 HD23 LEU A 105 0.084 -2.204 -3.373 1.00 0.00 H new ATOM 1777 N ARG A 106 4.452 -4.130 -1.437 1.00 0.00 N ATOM 1778 CA ARG A 106 4.480 -5.590 -1.345 1.00 0.00 C ATOM 1779 C ARG A 106 3.078 -6.123 -1.661 1.00 0.00 C ATOM 1780 O ARG A 106 2.090 -5.608 -1.125 1.00 0.00 O ATOM 1781 CB ARG A 106 4.954 -6.017 0.067 1.00 0.00 C ATOM 1782 CG ARG A 106 6.280 -5.345 0.502 1.00 0.00 C ATOM 1783 CD ARG A 106 6.746 -5.795 1.889 1.00 0.00 C ATOM 1784 NE ARG A 106 5.713 -5.569 2.914 1.00 0.00 N ATOM 1785 CZ ARG A 106 5.376 -6.446 3.863 1.00 0.00 C ATOM 1786 NH1 ARG A 106 5.990 -7.627 3.957 1.00 0.00 N ATOM 1787 NH2 ARG A 106 4.420 -6.142 4.715 1.00 0.00 N ATOM 0 H ARG A 106 4.428 -3.660 -0.532 1.00 0.00 H new ATOM 0 HA ARG A 106 5.183 -6.010 -2.064 1.00 0.00 H new ATOM 0 HB2 ARG A 106 4.177 -5.773 0.792 1.00 0.00 H new ATOM 0 HB3 ARG A 106 5.080 -7.099 0.087 1.00 0.00 H new ATOM 0 HG2 ARG A 106 7.055 -5.575 -0.229 1.00 0.00 H new ATOM 0 HG3 ARG A 106 6.151 -4.263 0.500 1.00 0.00 H new ATOM 0 HD2 ARG A 106 7.003 -6.854 1.860 1.00 0.00 H new ATOM 0 HD3 ARG A 106 7.652 -5.254 2.161 1.00 0.00 H new ATOM 0 HE ARG A 106 5.219 -4.677 2.898 1.00 0.00 H new ATOM 0 HH11 ARG A 106 6.729 -7.871 3.298 1.00 0.00 H new ATOM 0 HH12 ARG A 106 5.720 -8.285 4.688 1.00 0.00 H new ATOM 0 HH21 ARG A 106 3.943 -5.243 4.647 1.00 0.00 H new ATOM 0 HH22 ARG A 106 4.156 -6.806 5.443 1.00 0.00 H new ATOM 1801 N THR A 107 2.980 -7.115 -2.557 1.00 0.00 N ATOM 1802 CA THR A 107 1.681 -7.695 -2.937 1.00 0.00 C ATOM 1803 C THR A 107 1.081 -8.497 -1.774 1.00 0.00 C ATOM 1804 O THR A 107 -0.132 -8.613 -1.682 1.00 0.00 O ATOM 1805 CB THR A 107 1.789 -8.598 -4.203 1.00 0.00 C ATOM 1806 OG1 THR A 107 2.678 -9.686 -3.934 1.00 0.00 O ATOM 1807 CG2 THR A 107 2.290 -7.811 -5.429 1.00 0.00 C ATOM 0 H THR A 107 3.781 -7.532 -3.032 1.00 0.00 H new ATOM 0 HA THR A 107 1.021 -6.861 -3.177 1.00 0.00 H new ATOM 0 HB THR A 107 0.792 -8.973 -4.435 1.00 0.00 H new ATOM 0 HG1 THR A 107 3.022 -10.044 -4.779 1.00 0.00 H new ATOM 0 HG21 THR A 107 2.351 -8.478 -6.289 1.00 0.00 H new ATOM 0 HG22 THR A 107 1.597 -6.998 -5.648 1.00 0.00 H new ATOM 0 HG23 THR A 107 3.277 -7.399 -5.219 1.00 0.00 H new ATOM 1815 N ASP A 108 1.959 -9.013 -0.878 1.00 0.00 N ATOM 1816 CA ASP A 108 1.562 -9.801 0.310 1.00 0.00 C ATOM 1817 C ASP A 108 2.317 -9.311 1.569 1.00 0.00 C ATOM 1818 O ASP A 108 3.451 -8.821 1.468 1.00 0.00 O ATOM 1819 CB ASP A 108 1.811 -11.314 0.051 1.00 0.00 C ATOM 1820 CG ASP A 108 1.516 -12.210 1.268 1.00 0.00 C ATOM 1821 OD1 ASP A 108 0.351 -12.292 1.693 1.00 0.00 O ATOM 1822 OD2 ASP A 108 2.446 -12.840 1.804 1.00 0.00 O ATOM 0 H ASP A 108 2.968 -8.892 -0.962 1.00 0.00 H new ATOM 0 HA ASP A 108 0.497 -9.657 0.491 1.00 0.00 H new ATOM 0 HB2 ASP A 108 1.190 -11.637 -0.785 1.00 0.00 H new ATOM 0 HB3 ASP A 108 2.849 -11.456 -0.249 1.00 0.00 H new ATOM 1827 N ALA A 109 1.661 -9.455 2.743 1.00 0.00 N ATOM 1828 CA ALA A 109 2.204 -9.041 4.055 1.00 0.00 C ATOM 1829 C ALA A 109 3.373 -9.925 4.497 1.00 0.00 C ATOM 1830 O ALA A 109 4.331 -9.438 5.091 1.00 0.00 O ATOM 1831 CB ALA A 109 1.111 -9.082 5.132 1.00 0.00 C ATOM 0 H ALA A 109 0.730 -9.866 2.806 1.00 0.00 H new ATOM 0 HA ALA A 109 2.568 -8.021 3.936 1.00 0.00 H new ATOM 0 HB1 ALA A 109 1.532 -8.774 6.089 1.00 0.00 H new ATOM 0 HB2 ALA A 109 0.303 -8.405 4.856 1.00 0.00 H new ATOM 0 HB3 ALA A 109 0.721 -10.096 5.217 1.00 0.00 H new ATOM 1837 N SER A 110 3.275 -11.230 4.206 1.00 0.00 N ATOM 1838 CA SER A 110 4.291 -12.222 4.604 1.00 0.00 C ATOM 1839 C SER A 110 5.320 -12.453 3.474 1.00 0.00 C ATOM 1840 O SER A 110 6.100 -13.402 3.527 1.00 0.00 O ATOM 1841 CB SER A 110 3.590 -13.537 5.005 1.00 0.00 C ATOM 1842 OG SER A 110 2.689 -13.328 6.088 1.00 0.00 O ATOM 0 H SER A 110 2.492 -11.630 3.689 1.00 0.00 H new ATOM 0 HA SER A 110 4.844 -11.841 5.462 1.00 0.00 H new ATOM 0 HB2 SER A 110 3.048 -13.939 4.149 1.00 0.00 H new ATOM 0 HB3 SER A 110 4.337 -14.279 5.287 1.00 0.00 H new ATOM 0 HG SER A 110 2.626 -14.146 6.624 1.00 0.00 H new ATOM 1848 N ALA A 111 5.333 -11.549 2.475 1.00 0.00 N ATOM 1849 CA ALA A 111 6.219 -11.647 1.299 1.00 0.00 C ATOM 1850 C ALA A 111 7.434 -10.709 1.407 1.00 0.00 C ATOM 1851 O ALA A 111 7.443 -9.751 2.198 1.00 0.00 O ATOM 1852 CB ALA A 111 5.421 -11.344 0.028 1.00 0.00 C ATOM 0 H ALA A 111 4.728 -10.728 2.461 1.00 0.00 H new ATOM 0 HA ALA A 111 6.606 -12.665 1.256 1.00 0.00 H new ATOM 0 HB1 ALA A 111 6.077 -11.417 -0.839 1.00 0.00 H new ATOM 0 HB2 ALA A 111 4.607 -12.063 -0.071 1.00 0.00 H new ATOM 0 HB3 ALA A 111 5.010 -10.336 0.088 1.00 0.00 H new ATOM 1858 N GLU A 112 8.452 -11.007 0.579 1.00 0.00 N ATOM 1859 CA GLU A 112 9.688 -10.208 0.454 1.00 0.00 C ATOM 1860 C GLU A 112 9.703 -9.467 -0.906 1.00 0.00 C ATOM 1861 O GLU A 112 8.690 -9.449 -1.614 1.00 0.00 O ATOM 1862 CB GLU A 112 10.941 -11.128 0.668 1.00 0.00 C ATOM 1863 CG GLU A 112 10.916 -12.508 -0.050 1.00 0.00 C ATOM 1864 CD GLU A 112 10.951 -12.445 -1.593 1.00 0.00 C ATOM 1865 OE1 GLU A 112 11.967 -11.977 -2.158 1.00 0.00 O ATOM 1866 OE2 GLU A 112 9.979 -12.887 -2.242 1.00 0.00 O ATOM 0 H GLU A 112 8.440 -11.823 -0.033 1.00 0.00 H new ATOM 0 HA GLU A 112 9.722 -9.443 1.229 1.00 0.00 H new ATOM 0 HB2 GLU A 112 11.825 -10.585 0.334 1.00 0.00 H new ATOM 0 HB3 GLU A 112 11.059 -11.301 1.738 1.00 0.00 H new ATOM 0 HG2 GLU A 112 11.768 -13.094 0.294 1.00 0.00 H new ATOM 0 HG3 GLU A 112 10.017 -13.043 0.256 1.00 0.00 H new ATOM 1873 N TYR A 113 10.855 -8.865 -1.265 1.00 0.00 N ATOM 1874 CA TYR A 113 10.987 -8.025 -2.475 1.00 0.00 C ATOM 1875 C TYR A 113 11.361 -8.870 -3.718 1.00 0.00 C ATOM 1876 O TYR A 113 12.516 -8.917 -4.154 1.00 0.00 O ATOM 1877 CB TYR A 113 11.959 -6.822 -2.213 1.00 0.00 C ATOM 1878 CG TYR A 113 13.400 -7.176 -1.781 1.00 0.00 C ATOM 1879 CD1 TYR A 113 13.692 -7.622 -0.485 1.00 0.00 C ATOM 1880 CD2 TYR A 113 14.474 -7.047 -2.670 1.00 0.00 C ATOM 1881 CE1 TYR A 113 14.989 -7.929 -0.104 1.00 0.00 C ATOM 1882 CE2 TYR A 113 15.764 -7.354 -2.291 1.00 0.00 C ATOM 1883 CZ TYR A 113 16.019 -7.793 -1.014 1.00 0.00 C ATOM 1884 OH TYR A 113 17.314 -8.095 -0.645 1.00 0.00 O ATOM 0 H TYR A 113 11.718 -8.946 -0.727 1.00 0.00 H new ATOM 0 HA TYR A 113 10.015 -7.588 -2.705 1.00 0.00 H new ATOM 0 HB2 TYR A 113 12.014 -6.224 -3.123 1.00 0.00 H new ATOM 0 HB3 TYR A 113 11.518 -6.190 -1.442 1.00 0.00 H new ATOM 0 HD1 TYR A 113 12.891 -7.729 0.231 1.00 0.00 H new ATOM 0 HD2 TYR A 113 14.288 -6.699 -3.675 1.00 0.00 H new ATOM 0 HE1 TYR A 113 15.193 -8.273 0.899 1.00 0.00 H new ATOM 0 HE2 TYR A 113 16.574 -7.249 -2.998 1.00 0.00 H new ATOM 0 HH TYR A 113 17.914 -7.945 -1.405 1.00 0.00 H new ATOM 1894 N GLY A 114 10.353 -9.573 -4.267 1.00 0.00 N ATOM 1895 CA GLY A 114 10.515 -10.383 -5.485 1.00 0.00 C ATOM 1896 C GLY A 114 9.572 -9.923 -6.589 1.00 0.00 C ATOM 1897 O GLY A 114 8.740 -9.046 -6.366 1.00 0.00 O ATOM 0 H GLY A 114 9.409 -9.595 -3.880 1.00 0.00 H new ATOM 0 HA2 GLY A 114 11.546 -10.316 -5.834 1.00 0.00 H new ATOM 0 HA3 GLY A 114 10.324 -11.431 -5.255 1.00 0.00 H new ATOM 1901 N GLN A 115 9.667 -10.550 -7.771 1.00 0.00 N ATOM 1902 CA GLN A 115 8.983 -10.069 -8.993 1.00 0.00 C ATOM 1903 C GLN A 115 7.437 -10.086 -8.872 1.00 0.00 C ATOM 1904 O GLN A 115 6.763 -9.162 -9.342 1.00 0.00 O ATOM 1905 CB GLN A 115 9.443 -10.912 -10.202 1.00 0.00 C ATOM 1906 CG GLN A 115 10.959 -10.854 -10.493 1.00 0.00 C ATOM 1907 CD GLN A 115 11.478 -9.431 -10.722 1.00 0.00 C ATOM 1908 OE1 GLN A 115 11.446 -8.924 -11.843 1.00 0.00 O ATOM 1909 NE2 GLN A 115 11.969 -8.782 -9.667 1.00 0.00 N ATOM 0 H GLN A 115 10.214 -11.399 -7.912 1.00 0.00 H new ATOM 0 HA GLN A 115 9.264 -9.025 -9.135 1.00 0.00 H new ATOM 0 HB2 GLN A 115 9.159 -11.951 -10.032 1.00 0.00 H new ATOM 0 HB3 GLN A 115 8.904 -10.576 -11.088 1.00 0.00 H new ATOM 0 HG2 GLN A 115 11.499 -11.300 -9.658 1.00 0.00 H new ATOM 0 HG3 GLN A 115 11.176 -11.459 -11.373 1.00 0.00 H new ATOM 0 HE21 GLN A 115 11.980 -9.232 -8.752 1.00 0.00 H new ATOM 0 HE22 GLN A 115 12.333 -7.835 -9.775 1.00 0.00 H new ATOM 1918 N PHE A 116 6.893 -11.142 -8.247 1.00 0.00 N ATOM 1919 CA PHE A 116 5.434 -11.298 -8.037 1.00 0.00 C ATOM 1920 C PHE A 116 5.028 -11.052 -6.574 1.00 0.00 C ATOM 1921 O PHE A 116 3.833 -10.915 -6.279 1.00 0.00 O ATOM 1922 CB PHE A 116 4.963 -12.700 -8.508 1.00 0.00 C ATOM 1923 CG PHE A 116 5.094 -12.913 -10.014 1.00 0.00 C ATOM 1924 CD1 PHE A 116 4.273 -12.214 -10.900 1.00 0.00 C ATOM 1925 CD2 PHE A 116 6.035 -13.794 -10.546 1.00 0.00 C ATOM 1926 CE1 PHE A 116 4.385 -12.394 -12.262 1.00 0.00 C ATOM 1927 CE2 PHE A 116 6.144 -13.975 -11.912 1.00 0.00 C ATOM 1928 CZ PHE A 116 5.324 -13.272 -12.769 1.00 0.00 C ATOM 0 H PHE A 116 7.445 -11.913 -7.872 1.00 0.00 H new ATOM 0 HA PHE A 116 4.937 -10.538 -8.640 1.00 0.00 H new ATOM 0 HB2 PHE A 116 5.544 -13.463 -7.989 1.00 0.00 H new ATOM 0 HB3 PHE A 116 3.922 -12.841 -8.218 1.00 0.00 H new ATOM 0 HD1 PHE A 116 3.539 -11.522 -10.513 1.00 0.00 H new ATOM 0 HD2 PHE A 116 6.687 -14.342 -9.882 1.00 0.00 H new ATOM 0 HE1 PHE A 116 3.738 -11.848 -12.933 1.00 0.00 H new ATOM 0 HE2 PHE A 116 6.872 -14.667 -12.308 1.00 0.00 H new ATOM 0 HZ PHE A 116 5.416 -13.408 -13.837 1.00 0.00 H new ATOM 1938 N THR A 117 6.016 -10.999 -5.665 1.00 0.00 N ATOM 1939 CA THR A 117 5.773 -10.747 -4.232 1.00 0.00 C ATOM 1940 C THR A 117 5.786 -9.233 -3.915 1.00 0.00 C ATOM 1941 O THR A 117 5.390 -8.821 -2.813 1.00 0.00 O ATOM 1942 CB THR A 117 6.815 -11.511 -3.355 1.00 0.00 C ATOM 1943 OG1 THR A 117 8.122 -11.332 -3.888 1.00 0.00 O ATOM 1944 CG2 THR A 117 6.516 -13.017 -3.262 1.00 0.00 C ATOM 0 H THR A 117 7.000 -11.129 -5.899 1.00 0.00 H new ATOM 0 HA THR A 117 4.779 -11.124 -3.990 1.00 0.00 H new ATOM 0 HB THR A 117 6.750 -11.093 -2.350 1.00 0.00 H new ATOM 0 HG1 THR A 117 8.556 -12.205 -3.990 1.00 0.00 H new ATOM 0 HG21 THR A 117 7.270 -13.500 -2.641 1.00 0.00 H new ATOM 0 HG22 THR A 117 5.531 -13.166 -2.819 1.00 0.00 H new ATOM 0 HG23 THR A 117 6.534 -13.454 -4.260 1.00 0.00 H new ATOM 1952 N THR A 118 6.240 -8.417 -4.889 1.00 0.00 N ATOM 1953 CA THR A 118 6.149 -6.945 -4.841 1.00 0.00 C ATOM 1954 C THR A 118 5.816 -6.391 -6.242 1.00 0.00 C ATOM 1955 O THR A 118 6.229 -6.966 -7.255 1.00 0.00 O ATOM 1956 CB THR A 118 7.470 -6.271 -4.328 1.00 0.00 C ATOM 1957 OG1 THR A 118 8.608 -6.723 -5.072 1.00 0.00 O ATOM 1958 CG2 THR A 118 7.721 -6.506 -2.828 1.00 0.00 C ATOM 0 H THR A 118 6.684 -8.766 -5.738 1.00 0.00 H new ATOM 0 HA THR A 118 5.356 -6.704 -4.133 1.00 0.00 H new ATOM 0 HB THR A 118 7.332 -5.201 -4.481 1.00 0.00 H new ATOM 0 HG1 THR A 118 8.419 -7.605 -5.456 1.00 0.00 H new ATOM 0 HG21 THR A 118 8.649 -6.016 -2.533 1.00 0.00 H new ATOM 0 HG22 THR A 118 6.893 -6.093 -2.252 1.00 0.00 H new ATOM 0 HG23 THR A 118 7.799 -7.576 -2.635 1.00 0.00 H new ATOM 1966 N CYS A 119 5.069 -5.272 -6.278 1.00 0.00 N ATOM 1967 CA CYS A 119 4.687 -4.569 -7.511 1.00 0.00 C ATOM 1968 C CYS A 119 4.747 -3.047 -7.300 1.00 0.00 C ATOM 1969 O CYS A 119 4.631 -2.550 -6.173 1.00 0.00 O ATOM 1970 CB CYS A 119 3.275 -4.996 -7.969 1.00 0.00 C ATOM 1971 SG CYS A 119 3.193 -6.701 -8.545 1.00 0.00 S ATOM 0 H CYS A 119 4.709 -4.825 -5.435 1.00 0.00 H new ATOM 0 HA CYS A 119 5.396 -4.840 -8.294 1.00 0.00 H new ATOM 0 HB2 CYS A 119 2.578 -4.866 -7.141 1.00 0.00 H new ATOM 0 HB3 CYS A 119 2.945 -4.334 -8.770 1.00 0.00 H new ATOM 0 HG CYS A 119 4.314 -7.303 -8.279 1.00 0.00 H new ATOM 1977 N PHE A 120 4.925 -2.328 -8.409 1.00 0.00 N ATOM 1978 CA PHE A 120 5.040 -0.866 -8.435 1.00 0.00 C ATOM 1979 C PHE A 120 3.641 -0.231 -8.573 1.00 0.00 C ATOM 1980 O PHE A 120 2.936 -0.489 -9.559 1.00 0.00 O ATOM 1981 CB PHE A 120 5.932 -0.448 -9.629 1.00 0.00 C ATOM 1982 CG PHE A 120 7.386 -0.911 -9.554 1.00 0.00 C ATOM 1983 CD1 PHE A 120 7.750 -2.205 -9.927 1.00 0.00 C ATOM 1984 CD2 PHE A 120 8.395 -0.040 -9.133 1.00 0.00 C ATOM 1985 CE1 PHE A 120 9.070 -2.616 -9.872 1.00 0.00 C ATOM 1986 CE2 PHE A 120 9.711 -0.451 -9.082 1.00 0.00 C ATOM 1987 CZ PHE A 120 10.050 -1.738 -9.453 1.00 0.00 C ATOM 0 H PHE A 120 4.995 -2.752 -9.334 1.00 0.00 H new ATOM 0 HA PHE A 120 5.491 -0.519 -7.505 1.00 0.00 H new ATOM 0 HB2 PHE A 120 5.490 -0.840 -10.545 1.00 0.00 H new ATOM 0 HB3 PHE A 120 5.918 0.639 -9.708 1.00 0.00 H new ATOM 0 HD1 PHE A 120 6.991 -2.896 -10.263 1.00 0.00 H new ATOM 0 HD2 PHE A 120 8.141 0.969 -8.844 1.00 0.00 H new ATOM 0 HE1 PHE A 120 9.334 -3.624 -10.157 1.00 0.00 H new ATOM 0 HE2 PHE A 120 10.477 0.234 -8.752 1.00 0.00 H new ATOM 0 HZ PHE A 120 11.081 -2.057 -9.415 1.00 0.00 H new ATOM 1997 N VAL A 121 3.245 0.578 -7.573 1.00 0.00 N ATOM 1998 CA VAL A 121 1.957 1.313 -7.560 1.00 0.00 C ATOM 1999 C VAL A 121 2.213 2.799 -7.199 1.00 0.00 C ATOM 2000 O VAL A 121 3.366 3.252 -7.162 1.00 0.00 O ATOM 2001 CB VAL A 121 0.926 0.671 -6.537 1.00 0.00 C ATOM 2002 CG1 VAL A 121 0.550 -0.784 -6.926 1.00 0.00 C ATOM 2003 CG2 VAL A 121 1.464 0.741 -5.088 1.00 0.00 C ATOM 0 H VAL A 121 3.812 0.744 -6.742 1.00 0.00 H new ATOM 0 HA VAL A 121 1.517 1.246 -8.555 1.00 0.00 H new ATOM 0 HB VAL A 121 0.012 1.262 -6.588 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -0.157 -1.184 -6.199 1.00 0.00 H new ATOM 0 HG12 VAL A 121 0.095 -0.790 -7.916 1.00 0.00 H new ATOM 0 HG13 VAL A 121 1.448 -1.402 -6.936 1.00 0.00 H new ATOM 0 HG21 VAL A 121 0.738 0.294 -4.408 1.00 0.00 H new ATOM 0 HG22 VAL A 121 2.406 0.196 -5.023 1.00 0.00 H new ATOM 0 HG23 VAL A 121 1.628 1.782 -4.811 1.00 0.00 H new ATOM 2013 N VAL A 122 1.128 3.559 -6.986 1.00 0.00 N ATOM 2014 CA VAL A 122 1.194 4.937 -6.458 1.00 0.00 C ATOM 2015 C VAL A 122 1.229 4.919 -4.913 1.00 0.00 C ATOM 2016 O VAL A 122 0.959 3.884 -4.295 1.00 0.00 O ATOM 2017 CB VAL A 122 -0.018 5.803 -6.976 1.00 0.00 C ATOM 2018 CG1 VAL A 122 0.013 5.939 -8.521 1.00 0.00 C ATOM 2019 CG2 VAL A 122 -1.378 5.235 -6.483 1.00 0.00 C ATOM 0 H VAL A 122 0.178 3.239 -7.174 1.00 0.00 H new ATOM 0 HA VAL A 122 2.113 5.397 -6.823 1.00 0.00 H new ATOM 0 HB VAL A 122 0.087 6.802 -6.553 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.834 6.541 -8.850 1.00 0.00 H new ATOM 0 HG12 VAL A 122 0.942 6.422 -8.825 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -0.047 4.950 -8.975 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -2.190 5.857 -6.859 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -1.501 4.216 -6.850 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.398 5.233 -5.393 1.00 0.00 H new ATOM 2029 N ARG A 123 1.564 6.075 -4.305 1.00 0.00 N ATOM 2030 CA ARG A 123 1.609 6.236 -2.830 1.00 0.00 C ATOM 2031 C ARG A 123 0.274 5.871 -2.170 1.00 0.00 C ATOM 2032 O ARG A 123 0.274 5.236 -1.128 1.00 0.00 O ATOM 2033 CB ARG A 123 1.992 7.689 -2.428 1.00 0.00 C ATOM 2034 CG ARG A 123 3.497 7.989 -2.440 1.00 0.00 C ATOM 2035 CD ARG A 123 4.251 7.297 -1.295 1.00 0.00 C ATOM 2036 NE ARG A 123 5.710 7.453 -1.444 1.00 0.00 N ATOM 2037 CZ ARG A 123 6.503 8.194 -0.656 1.00 0.00 C ATOM 2038 NH1 ARG A 123 5.995 8.930 0.330 1.00 0.00 N ATOM 2039 NH2 ARG A 123 7.809 8.229 -0.880 1.00 0.00 N ATOM 0 H ARG A 123 1.811 6.922 -4.816 1.00 0.00 H new ATOM 0 HA ARG A 123 2.376 5.548 -2.473 1.00 0.00 H new ATOM 0 HB2 ARG A 123 1.493 8.381 -3.106 1.00 0.00 H new ATOM 0 HB3 ARG A 123 1.605 7.888 -1.429 1.00 0.00 H new ATOM 0 HG2 ARG A 123 3.919 7.669 -3.393 1.00 0.00 H new ATOM 0 HG3 ARG A 123 3.649 9.066 -2.370 1.00 0.00 H new ATOM 0 HD2 ARG A 123 3.934 7.718 -0.341 1.00 0.00 H new ATOM 0 HD3 ARG A 123 3.996 6.237 -1.277 1.00 0.00 H new ATOM 0 HE ARG A 123 6.155 6.953 -2.214 1.00 0.00 H new ATOM 0 HH11 ARG A 123 4.989 8.936 0.495 1.00 0.00 H new ATOM 0 HH12 ARG A 123 6.612 9.488 0.920 1.00 0.00 H new ATOM 0 HH21 ARG A 123 8.209 7.693 -1.650 1.00 0.00 H new ATOM 0 HH22 ARG A 123 8.414 8.792 -0.282 1.00 0.00 H new ATOM 2053 N LEU A 124 -0.843 6.274 -2.801 1.00 0.00 N ATOM 2054 CA LEU A 124 -2.198 6.093 -2.233 1.00 0.00 C ATOM 2055 C LEU A 124 -2.484 4.592 -1.984 1.00 0.00 C ATOM 2056 O LEU A 124 -2.887 4.207 -0.881 1.00 0.00 O ATOM 2057 CB LEU A 124 -3.268 6.733 -3.183 1.00 0.00 C ATOM 2058 CG LEU A 124 -4.600 7.252 -2.531 1.00 0.00 C ATOM 2059 CD1 LEU A 124 -5.453 6.129 -1.935 1.00 0.00 C ATOM 2060 CD2 LEU A 124 -4.313 8.327 -1.467 1.00 0.00 C ATOM 0 H LEU A 124 -0.837 6.731 -3.713 1.00 0.00 H new ATOM 0 HA LEU A 124 -2.254 6.602 -1.271 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -2.800 7.569 -3.702 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -3.530 5.994 -3.940 1.00 0.00 H new ATOM 0 HG LEU A 124 -5.180 7.696 -3.340 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -6.359 6.552 -1.500 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -5.723 5.422 -2.719 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -4.885 5.613 -1.161 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -5.252 8.668 -1.032 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -3.683 7.905 -0.684 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -3.800 9.170 -1.930 1.00 0.00 H new ATOM 2072 N GLN A 125 -2.226 3.761 -3.010 1.00 0.00 N ATOM 2073 CA GLN A 125 -2.475 2.308 -2.944 1.00 0.00 C ATOM 2074 C GLN A 125 -1.425 1.607 -2.068 1.00 0.00 C ATOM 2075 O GLN A 125 -1.761 0.651 -1.345 1.00 0.00 O ATOM 2076 CB GLN A 125 -2.504 1.694 -4.365 1.00 0.00 C ATOM 2077 CG GLN A 125 -3.569 2.298 -5.298 1.00 0.00 C ATOM 2078 CD GLN A 125 -4.983 2.292 -4.703 1.00 0.00 C ATOM 2079 OE1 GLN A 125 -5.408 3.263 -4.077 1.00 0.00 O ATOM 2080 NE2 GLN A 125 -5.707 1.191 -4.866 1.00 0.00 N ATOM 0 H GLN A 125 -1.842 4.074 -3.902 1.00 0.00 H new ATOM 0 HA GLN A 125 -3.451 2.154 -2.484 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -1.523 1.822 -4.823 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -2.679 0.621 -4.280 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -3.290 3.324 -5.538 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -3.576 1.742 -6.235 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -5.326 0.403 -5.390 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -6.644 1.133 -4.467 1.00 0.00 H new ATOM 2089 N PHE A 126 -0.160 2.100 -2.144 1.00 0.00 N ATOM 2090 CA PHE A 126 0.943 1.623 -1.287 1.00 0.00 C ATOM 2091 C PHE A 126 0.533 1.688 0.187 1.00 0.00 C ATOM 2092 O PHE A 126 0.545 0.671 0.891 1.00 0.00 O ATOM 2093 CB PHE A 126 2.250 2.443 -1.519 1.00 0.00 C ATOM 2094 CG PHE A 126 3.321 2.202 -0.447 1.00 0.00 C ATOM 2095 CD1 PHE A 126 4.016 0.998 -0.394 1.00 0.00 C ATOM 2096 CD2 PHE A 126 3.597 3.159 0.532 1.00 0.00 C ATOM 2097 CE1 PHE A 126 4.953 0.756 0.591 1.00 0.00 C ATOM 2098 CE2 PHE A 126 4.528 2.913 1.521 1.00 0.00 C ATOM 2099 CZ PHE A 126 5.205 1.711 1.548 1.00 0.00 C ATOM 0 H PHE A 126 0.116 2.833 -2.798 1.00 0.00 H new ATOM 0 HA PHE A 126 1.149 0.588 -1.558 1.00 0.00 H new ATOM 0 HB2 PHE A 126 2.661 2.188 -2.496 1.00 0.00 H new ATOM 0 HB3 PHE A 126 2.004 3.505 -1.544 1.00 0.00 H new ATOM 0 HD1 PHE A 126 3.819 0.239 -1.137 1.00 0.00 H new ATOM 0 HD2 PHE A 126 3.075 4.104 0.515 1.00 0.00 H new ATOM 0 HE1 PHE A 126 5.487 -0.182 0.610 1.00 0.00 H new ATOM 0 HE2 PHE A 126 4.727 3.662 2.274 1.00 0.00 H new ATOM 0 HZ PHE A 126 5.934 1.520 2.322 1.00 0.00 H new ATOM 2109 N TYR A 127 0.147 2.905 0.610 1.00 0.00 N ATOM 2110 CA TYR A 127 -0.305 3.181 1.967 1.00 0.00 C ATOM 2111 C TYR A 127 -1.475 2.252 2.301 1.00 0.00 C ATOM 2112 O TYR A 127 -1.314 1.369 3.115 1.00 0.00 O ATOM 2113 CB TYR A 127 -0.693 4.685 2.140 1.00 0.00 C ATOM 2114 CG TYR A 127 0.492 5.667 2.057 1.00 0.00 C ATOM 2115 CD1 TYR A 127 1.719 5.360 2.645 1.00 0.00 C ATOM 2116 CD2 TYR A 127 0.377 6.900 1.410 1.00 0.00 C ATOM 2117 CE1 TYR A 127 2.783 6.235 2.592 1.00 0.00 C ATOM 2118 CE2 TYR A 127 1.444 7.778 1.348 1.00 0.00 C ATOM 2119 CZ TYR A 127 2.640 7.442 1.944 1.00 0.00 C ATOM 2120 OH TYR A 127 3.699 8.324 1.892 1.00 0.00 O ATOM 0 H TYR A 127 0.144 3.727 0.006 1.00 0.00 H new ATOM 0 HA TYR A 127 0.509 2.989 2.666 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -1.421 4.949 1.373 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -1.185 4.811 3.104 1.00 0.00 H new ATOM 0 HD1 TYR A 127 1.838 4.415 3.154 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -0.562 7.172 0.950 1.00 0.00 H new ATOM 0 HE1 TYR A 127 3.723 5.976 3.056 1.00 0.00 H new ATOM 0 HE2 TYR A 127 1.340 8.723 0.835 1.00 0.00 H new ATOM 0 HH TYR A 127 4.525 7.859 2.142 1.00 0.00 H new ATOM 2130 N ALA A 128 -2.573 2.376 1.537 1.00 0.00 N ATOM 2131 CA ALA A 128 -3.882 1.724 1.809 1.00 0.00 C ATOM 2132 C ALA A 128 -3.777 0.259 2.304 1.00 0.00 C ATOM 2133 O ALA A 128 -4.214 -0.071 3.428 1.00 0.00 O ATOM 2134 CB ALA A 128 -4.725 1.790 0.534 1.00 0.00 C ATOM 0 H ALA A 128 -2.584 2.945 0.690 1.00 0.00 H new ATOM 0 HA ALA A 128 -4.349 2.270 2.629 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -5.691 1.317 0.711 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -4.878 2.832 0.252 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -4.208 1.268 -0.271 1.00 0.00 H new ATOM 2140 N PHE A 129 -3.152 -0.599 1.479 1.00 0.00 N ATOM 2141 CA PHE A 129 -3.009 -2.040 1.781 1.00 0.00 C ATOM 2142 C PHE A 129 -1.994 -2.283 2.923 1.00 0.00 C ATOM 2143 O PHE A 129 -2.230 -3.133 3.793 1.00 0.00 O ATOM 2144 CB PHE A 129 -2.591 -2.824 0.512 1.00 0.00 C ATOM 2145 CG PHE A 129 -3.642 -2.821 -0.597 1.00 0.00 C ATOM 2146 CD1 PHE A 129 -4.778 -3.627 -0.494 1.00 0.00 C ATOM 2147 CD2 PHE A 129 -3.496 -2.029 -1.739 1.00 0.00 C ATOM 2148 CE1 PHE A 129 -5.731 -3.634 -1.496 1.00 0.00 C ATOM 2149 CE2 PHE A 129 -4.450 -2.037 -2.739 1.00 0.00 C ATOM 2150 CZ PHE A 129 -5.567 -2.840 -2.618 1.00 0.00 C ATOM 0 H PHE A 129 -2.734 -0.320 0.591 1.00 0.00 H new ATOM 0 HA PHE A 129 -3.980 -2.404 2.115 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -1.666 -2.398 0.123 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -2.374 -3.855 0.790 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -4.913 -4.251 0.377 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -2.624 -1.401 -1.842 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -6.606 -4.261 -1.403 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -4.322 -1.416 -3.614 1.00 0.00 H new ATOM 0 HZ PHE A 129 -6.313 -2.849 -3.399 1.00 0.00 H new ATOM 2160 N GLU A 130 -0.888 -1.502 2.926 1.00 0.00 N ATOM 2161 CA GLU A 130 0.210 -1.651 3.911 1.00 0.00 C ATOM 2162 C GLU A 130 -0.272 -1.257 5.332 1.00 0.00 C ATOM 2163 O GLU A 130 0.102 -1.903 6.307 1.00 0.00 O ATOM 2164 CB GLU A 130 1.453 -0.805 3.490 1.00 0.00 C ATOM 2165 CG GLU A 130 2.774 -1.153 4.222 1.00 0.00 C ATOM 2166 CD GLU A 130 3.308 -2.568 3.894 1.00 0.00 C ATOM 2167 OE1 GLU A 130 3.978 -2.749 2.847 1.00 0.00 O ATOM 2168 OE2 GLU A 130 3.028 -3.521 4.657 1.00 0.00 O ATOM 0 H GLU A 130 -0.732 -0.755 2.250 1.00 0.00 H new ATOM 0 HA GLU A 130 0.508 -2.699 3.932 1.00 0.00 H new ATOM 0 HB2 GLU A 130 1.608 -0.928 2.418 1.00 0.00 H new ATOM 0 HB3 GLU A 130 1.229 0.248 3.661 1.00 0.00 H new ATOM 0 HG2 GLU A 130 3.532 -0.417 3.956 1.00 0.00 H new ATOM 0 HG3 GLU A 130 2.616 -1.073 5.298 1.00 0.00 H new ATOM 2175 N ILE A 131 -1.152 -0.222 5.415 1.00 0.00 N ATOM 2176 CA ILE A 131 -1.735 0.285 6.686 1.00 0.00 C ATOM 2177 C ILE A 131 -2.626 -0.798 7.290 1.00 0.00 C ATOM 2178 O ILE A 131 -2.557 -1.077 8.485 1.00 0.00 O ATOM 2179 CB ILE A 131 -2.638 1.572 6.484 1.00 0.00 C ATOM 2180 CG1 ILE A 131 -1.868 2.730 5.792 1.00 0.00 C ATOM 2181 CG2 ILE A 131 -3.247 2.061 7.832 1.00 0.00 C ATOM 2182 CD1 ILE A 131 -2.764 3.772 5.137 1.00 0.00 C ATOM 0 H ILE A 131 -1.479 0.287 4.594 1.00 0.00 H new ATOM 0 HA ILE A 131 -0.897 0.547 7.332 1.00 0.00 H new ATOM 0 HB ILE A 131 -3.452 1.273 5.824 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -1.236 3.223 6.530 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -1.206 2.310 5.035 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -3.860 2.945 7.655 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -3.864 1.271 8.260 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -2.444 2.310 8.525 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -2.148 4.545 4.677 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -3.378 3.295 4.373 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -3.409 4.223 5.891 1.00 0.00 H new ATOM 2194 N ALA A 132 -3.473 -1.381 6.419 1.00 0.00 N ATOM 2195 CA ALA A 132 -4.441 -2.414 6.798 1.00 0.00 C ATOM 2196 C ALA A 132 -3.756 -3.577 7.540 1.00 0.00 C ATOM 2197 O ALA A 132 -4.053 -3.849 8.705 1.00 0.00 O ATOM 2198 CB ALA A 132 -5.193 -2.901 5.548 1.00 0.00 C ATOM 0 H ALA A 132 -3.500 -1.143 5.428 1.00 0.00 H new ATOM 0 HA ALA A 132 -5.164 -1.983 7.490 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -5.912 -3.669 5.832 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -5.719 -2.063 5.090 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -4.482 -3.316 4.834 1.00 0.00 H new ATOM 2204 N ARG A 133 -2.782 -4.195 6.870 1.00 0.00 N ATOM 2205 CA ARG A 133 -2.041 -5.356 7.407 1.00 0.00 C ATOM 2206 C ARG A 133 -1.033 -4.954 8.520 1.00 0.00 C ATOM 2207 O ARG A 133 -0.600 -5.812 9.291 1.00 0.00 O ATOM 2208 CB ARG A 133 -1.366 -6.117 6.238 1.00 0.00 C ATOM 2209 CG ARG A 133 -0.401 -5.265 5.386 1.00 0.00 C ATOM 2210 CD ARG A 133 -0.141 -5.870 4.000 1.00 0.00 C ATOM 2211 NE ARG A 133 0.891 -5.132 3.265 1.00 0.00 N ATOM 2212 CZ ARG A 133 1.223 -5.341 1.992 1.00 0.00 C ATOM 2213 NH1 ARG A 133 0.599 -6.261 1.252 1.00 0.00 N ATOM 2214 NH2 ARG A 133 2.197 -4.631 1.466 1.00 0.00 N ATOM 0 H ARG A 133 -2.478 -3.911 5.939 1.00 0.00 H new ATOM 0 HA ARG A 133 -2.748 -6.027 7.894 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -0.817 -6.966 6.644 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -2.143 -6.521 5.589 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -0.815 -4.263 5.269 1.00 0.00 H new ATOM 0 HG3 ARG A 133 0.546 -5.159 5.915 1.00 0.00 H new ATOM 0 HD2 ARG A 133 0.166 -6.910 4.110 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -1.067 -5.870 3.424 1.00 0.00 H new ATOM 0 HE ARG A 133 1.394 -4.401 3.768 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -0.149 -6.822 1.660 1.00 0.00 H new ATOM 0 HH12 ARG A 133 0.871 -6.403 0.279 1.00 0.00 H new ATOM 0 HH21 ARG A 133 2.683 -3.935 2.031 1.00 0.00 H new ATOM 0 HH22 ARG A 133 2.466 -4.776 0.493 1.00 0.00 H new ATOM 2228 N ASN A 134 -0.663 -3.651 8.596 1.00 0.00 N ATOM 2229 CA ASN A 134 0.191 -3.115 9.694 1.00 0.00 C ATOM 2230 C ASN A 134 -0.608 -3.056 11.010 1.00 0.00 C ATOM 2231 O ASN A 134 -0.143 -3.532 12.051 1.00 0.00 O ATOM 2232 CB ASN A 134 0.740 -1.699 9.338 1.00 0.00 C ATOM 2233 CG ASN A 134 1.717 -1.112 10.377 1.00 0.00 C ATOM 2234 OD1 ASN A 134 2.437 -1.848 11.054 1.00 0.00 O ATOM 2235 ND2 ASN A 134 1.752 0.215 10.506 1.00 0.00 N ATOM 0 H ASN A 134 -0.941 -2.949 7.911 1.00 0.00 H new ATOM 0 HA ASN A 134 1.039 -3.788 9.821 1.00 0.00 H new ATOM 0 HB2 ASN A 134 1.244 -1.751 8.373 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -0.101 -1.016 9.222 1.00 0.00 H new ATOM 0 HD21 ASN A 134 2.387 0.645 11.179 1.00 0.00 H new ATOM 0 HD22 ASN A 134 1.144 0.799 9.932 1.00 0.00 H new ATOM 2242 N LYS A 135 -1.836 -2.495 10.932 1.00 0.00 N ATOM 2243 CA LYS A 135 -2.743 -2.341 12.095 1.00 0.00 C ATOM 2244 C LYS A 135 -3.209 -3.716 12.611 1.00 0.00 C ATOM 2245 O LYS A 135 -3.401 -3.912 13.817 1.00 0.00 O ATOM 2246 CB LYS A 135 -3.974 -1.463 11.726 1.00 0.00 C ATOM 2247 CG LYS A 135 -3.644 0.006 11.373 1.00 0.00 C ATOM 2248 CD LYS A 135 -4.906 0.859 11.098 1.00 0.00 C ATOM 2249 CE LYS A 135 -5.878 0.904 12.295 1.00 0.00 C ATOM 2250 NZ LYS A 135 -6.994 1.865 12.076 1.00 0.00 N ATOM 0 H LYS A 135 -2.227 -2.136 10.061 1.00 0.00 H new ATOM 0 HA LYS A 135 -2.186 -1.842 12.888 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -4.486 -1.919 10.879 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -4.672 -1.472 12.563 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -3.081 0.453 12.192 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -2.999 0.027 10.494 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -4.603 1.875 10.845 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -5.427 0.457 10.229 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -6.287 -0.092 12.467 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -5.331 1.184 13.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -6.965 2.603 12.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -6.896 2.303 11.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -7.902 1.361 12.129 1.00 0.00 H new ATOM 2264 N HIS A 136 -3.386 -4.660 11.669 1.00 0.00 N ATOM 2265 CA HIS A 136 -3.753 -6.055 11.983 1.00 0.00 C ATOM 2266 C HIS A 136 -2.539 -6.854 12.505 1.00 0.00 C ATOM 2267 O HIS A 136 -2.711 -7.929 13.090 1.00 0.00 O ATOM 2268 CB HIS A 136 -4.392 -6.741 10.739 1.00 0.00 C ATOM 2269 CG HIS A 136 -5.827 -6.351 10.501 1.00 0.00 C ATOM 2270 ND1 HIS A 136 -6.878 -7.199 10.757 1.00 0.00 N ATOM 2271 CD2 HIS A 136 -6.385 -5.198 10.062 1.00 0.00 C ATOM 2272 CE1 HIS A 136 -8.009 -6.586 10.491 1.00 0.00 C ATOM 2273 NE2 HIS A 136 -7.739 -5.375 10.064 1.00 0.00 N ATOM 0 H HIS A 136 -3.279 -4.479 10.671 1.00 0.00 H new ATOM 0 HA HIS A 136 -4.494 -6.040 12.782 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -3.805 -6.489 9.855 1.00 0.00 H new ATOM 0 HB3 HIS A 136 -4.335 -7.822 10.862 1.00 0.00 H new ATOM 0 HD1 HIS A 136 -6.793 -8.156 11.100 1.00 0.00 H new ATOM 0 HD2 HIS A 136 -5.857 -4.304 9.765 1.00 0.00 H new ATOM 0 HE1 HIS A 136 -8.996 -7.008 10.605 1.00 0.00 H new ATOM 2282 N GLY A 137 -1.318 -6.320 12.289 1.00 0.00 N ATOM 2283 CA GLY A 137 -0.090 -6.931 12.817 1.00 0.00 C ATOM 2284 C GLY A 137 0.380 -8.138 12.018 1.00 0.00 C ATOM 2285 O GLY A 137 1.097 -8.999 12.532 1.00 0.00 O ATOM 0 H GLY A 137 -1.161 -5.467 11.752 1.00 0.00 H new ATOM 0 HA2 GLY A 137 0.702 -6.183 12.829 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -0.259 -7.233 13.851 1.00 0.00 H new ATOM 2289 N LEU A 138 -0.027 -8.194 10.745 1.00 0.00 N ATOM 2290 CA LEU A 138 0.424 -9.224 9.783 1.00 0.00 C ATOM 2291 C LEU A 138 1.801 -8.840 9.184 1.00 0.00 C ATOM 2292 O LEU A 138 2.356 -9.573 8.361 1.00 0.00 O ATOM 2293 CB LEU A 138 -0.660 -9.435 8.679 1.00 0.00 C ATOM 2294 CG LEU A 138 -1.889 -10.337 9.066 1.00 0.00 C ATOM 2295 CD1 LEU A 138 -2.576 -9.912 10.377 1.00 0.00 C ATOM 2296 CD2 LEU A 138 -2.906 -10.385 7.919 1.00 0.00 C ATOM 0 H LEU A 138 -0.683 -7.524 10.344 1.00 0.00 H new ATOM 0 HA LEU A 138 0.554 -10.173 10.303 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -1.036 -8.457 8.378 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -0.177 -9.873 7.806 1.00 0.00 H new ATOM 0 HG LEU A 138 -1.489 -11.336 9.240 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.414 -10.578 10.581 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -1.860 -9.968 11.197 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -2.940 -8.889 10.282 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -3.749 -11.014 8.206 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -3.262 -9.377 7.706 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -2.431 -10.798 7.029 1.00 0.00 H new ATOM 2308 N ASN A 139 2.332 -7.674 9.613 1.00 0.00 N ATOM 2309 CA ASN A 139 3.699 -7.210 9.295 1.00 0.00 C ATOM 2310 C ASN A 139 4.617 -7.326 10.537 1.00 0.00 C ATOM 2311 O ASN A 139 5.794 -6.955 10.484 1.00 0.00 O ATOM 2312 CB ASN A 139 3.661 -5.734 8.806 1.00 0.00 C ATOM 2313 CG ASN A 139 2.801 -5.510 7.560 1.00 0.00 C ATOM 2314 OD1 ASN A 139 2.573 -6.424 6.765 1.00 0.00 O ATOM 2315 ND2 ASN A 139 2.346 -4.282 7.368 1.00 0.00 N ATOM 0 H ASN A 139 1.814 -7.019 10.199 1.00 0.00 H new ATOM 0 HA ASN A 139 4.101 -7.842 8.503 1.00 0.00 H new ATOM 0 HB2 ASN A 139 3.284 -5.105 9.612 1.00 0.00 H new ATOM 0 HB3 ASN A 139 4.679 -5.406 8.595 1.00 0.00 H new ATOM 0 HD21 ASN A 139 1.788 -4.068 6.542 1.00 0.00 H new ATOM 0 HD22 ASN A 139 2.554 -3.549 8.047 1.00 0.00 H new ATOM 2322 N ASP A 140 4.069 -7.872 11.647 1.00 0.00 N ATOM 2323 CA ASP A 140 4.784 -7.964 12.944 1.00 0.00 C ATOM 2324 C ASP A 140 5.942 -8.990 12.878 1.00 0.00 C ATOM 2325 O ASP A 140 6.878 -8.931 13.674 1.00 0.00 O ATOM 2326 CB ASP A 140 3.787 -8.320 14.085 1.00 0.00 C ATOM 2327 CG ASP A 140 4.389 -8.225 15.507 1.00 0.00 C ATOM 2328 OD1 ASP A 140 4.403 -7.119 16.090 1.00 0.00 O ATOM 2329 OD2 ASP A 140 4.850 -9.253 16.050 1.00 0.00 O ATOM 0 H ASP A 140 3.126 -8.259 11.671 1.00 0.00 H new ATOM 0 HA ASP A 140 5.224 -6.990 13.160 1.00 0.00 H new ATOM 0 HB2 ASP A 140 2.927 -7.653 14.022 1.00 0.00 H new ATOM 0 HB3 ASP A 140 3.417 -9.333 13.926 1.00 0.00 H new ATOM 2334 N TRP A 141 5.888 -9.920 11.903 1.00 0.00 N ATOM 2335 CA TRP A 141 6.975 -10.900 11.687 1.00 0.00 C ATOM 2336 C TRP A 141 8.275 -10.195 11.234 1.00 0.00 C ATOM 2337 O TRP A 141 9.373 -10.670 11.513 1.00 0.00 O ATOM 2338 CB TRP A 141 6.548 -12.001 10.675 1.00 0.00 C ATOM 2339 CG TRP A 141 6.335 -11.495 9.269 1.00 0.00 C ATOM 2340 CD1 TRP A 141 5.219 -10.881 8.781 1.00 0.00 C ATOM 2341 CD2 TRP A 141 7.276 -11.546 8.185 1.00 0.00 C ATOM 2342 NE1 TRP A 141 5.411 -10.541 7.473 1.00 0.00 N ATOM 2343 CE2 TRP A 141 6.661 -10.948 7.080 1.00 0.00 C ATOM 2344 CE3 TRP A 141 8.574 -12.051 8.045 1.00 0.00 C ATOM 2345 CZ2 TRP A 141 7.302 -10.819 5.848 1.00 0.00 C ATOM 2346 CZ3 TRP A 141 9.209 -11.927 6.823 1.00 0.00 C ATOM 2347 CH2 TRP A 141 8.568 -11.321 5.735 1.00 0.00 C ATOM 0 H TRP A 141 5.107 -10.014 11.254 1.00 0.00 H new ATOM 0 HA TRP A 141 7.177 -11.390 12.640 1.00 0.00 H new ATOM 0 HB2 TRP A 141 7.311 -12.780 10.658 1.00 0.00 H new ATOM 0 HB3 TRP A 141 5.626 -12.465 11.026 1.00 0.00 H new ATOM 0 HD1 TRP A 141 4.318 -10.692 9.345 1.00 0.00 H new ATOM 0 HE1 TRP A 141 4.733 -10.061 6.882 1.00 0.00 H new ATOM 0 HE3 TRP A 141 9.071 -12.529 8.877 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 6.815 -10.339 5.012 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 10.215 -12.303 6.706 1.00 0.00 H new ATOM 0 HH2 TRP A 141 9.084 -11.249 4.789 1.00 0.00 H new ATOM 2358 N ILE A 142 8.122 -9.043 10.553 1.00 0.00 N ATOM 2359 CA ILE A 142 9.257 -8.213 10.093 1.00 0.00 C ATOM 2360 C ILE A 142 9.922 -7.521 11.296 1.00 0.00 C ATOM 2361 O ILE A 142 11.142 -7.374 11.348 1.00 0.00 O ATOM 2362 CB ILE A 142 8.781 -7.131 9.054 1.00 0.00 C ATOM 2363 CG1 ILE A 142 7.937 -7.797 7.927 1.00 0.00 C ATOM 2364 CG2 ILE A 142 9.975 -6.339 8.453 1.00 0.00 C ATOM 2365 CD1 ILE A 142 7.160 -6.830 7.058 1.00 0.00 C ATOM 0 H ILE A 142 7.210 -8.660 10.305 1.00 0.00 H new ATOM 0 HA ILE A 142 9.979 -8.866 9.603 1.00 0.00 H new ATOM 0 HB ILE A 142 8.155 -6.415 9.587 1.00 0.00 H new ATOM 0 HG12 ILE A 142 8.603 -8.381 7.291 1.00 0.00 H new ATOM 0 HG13 ILE A 142 7.237 -8.497 8.383 1.00 0.00 H new ATOM 0 HG21 ILE A 142 9.602 -5.603 7.741 1.00 0.00 H new ATOM 0 HG22 ILE A 142 10.513 -5.830 9.253 1.00 0.00 H new ATOM 0 HG23 ILE A 142 10.649 -7.028 7.943 1.00 0.00 H new ATOM 0 HD11 ILE A 142 6.604 -7.386 6.303 1.00 0.00 H new ATOM 0 HD12 ILE A 142 6.465 -6.263 7.677 1.00 0.00 H new ATOM 0 HD13 ILE A 142 7.852 -6.145 6.568 1.00 0.00 H new ATOM 2377 N VAL A 143 9.097 -7.135 12.290 1.00 0.00 N ATOM 2378 CA VAL A 143 9.598 -6.507 13.528 1.00 0.00 C ATOM 2379 C VAL A 143 10.258 -7.567 14.446 1.00 0.00 C ATOM 2380 O VAL A 143 10.928 -7.223 15.429 1.00 0.00 O ATOM 2381 CB VAL A 143 8.479 -5.671 14.289 1.00 0.00 C ATOM 2382 CG1 VAL A 143 7.494 -5.008 13.290 1.00 0.00 C ATOM 2383 CG2 VAL A 143 7.727 -6.481 15.375 1.00 0.00 C ATOM 0 H VAL A 143 8.084 -7.247 12.259 1.00 0.00 H new ATOM 0 HA VAL A 143 10.362 -5.784 13.241 1.00 0.00 H new ATOM 0 HB VAL A 143 9.008 -4.882 14.824 1.00 0.00 H new ATOM 0 HG11 VAL A 143 6.741 -4.444 13.841 1.00 0.00 H new ATOM 0 HG12 VAL A 143 8.042 -4.334 12.631 1.00 0.00 H new ATOM 0 HG13 VAL A 143 7.005 -5.779 12.695 1.00 0.00 H new ATOM 0 HG21 VAL A 143 6.980 -5.846 15.851 1.00 0.00 H new ATOM 0 HG22 VAL A 143 7.235 -7.338 14.914 1.00 0.00 H new ATOM 0 HG23 VAL A 143 8.437 -6.830 16.125 1.00 0.00 H new ATOM 2393 N GLY A 144 10.068 -8.858 14.094 1.00 0.00 N ATOM 2394 CA GLY A 144 10.704 -9.978 14.782 1.00 0.00 C ATOM 2395 C GLY A 144 11.461 -10.879 13.819 1.00 0.00 C ATOM 2396 O GLY A 144 11.198 -12.090 13.750 1.00 0.00 O ATOM 0 H GLY A 144 9.466 -9.142 13.321 1.00 0.00 H new ATOM 0 HA2 GLY A 144 11.390 -9.597 15.538 1.00 0.00 H new ATOM 0 HA3 GLY A 144 9.946 -10.561 15.305 1.00 0.00 H new ATOM 2400 N GLN A 145 12.382 -10.276 13.033 1.00 0.00 N ATOM 2401 CA GLN A 145 13.336 -11.035 12.189 1.00 0.00 C ATOM 2402 C GLN A 145 14.386 -11.763 13.063 1.00 0.00 C ATOM 2403 O GLN A 145 14.427 -11.594 14.294 1.00 0.00 O ATOM 2404 CB GLN A 145 14.053 -10.098 11.174 1.00 0.00 C ATOM 2405 CG GLN A 145 13.177 -9.549 10.030 1.00 0.00 C ATOM 2406 CD GLN A 145 12.665 -10.622 9.065 1.00 0.00 C ATOM 2407 OE1 GLN A 145 11.573 -11.151 9.230 1.00 0.00 O ATOM 2408 NE2 GLN A 145 13.466 -10.958 8.061 1.00 0.00 N ATOM 0 H GLN A 145 12.485 -9.264 12.965 1.00 0.00 H new ATOM 0 HA GLN A 145 12.764 -11.778 11.633 1.00 0.00 H new ATOM 0 HB2 GLN A 145 14.472 -9.254 11.722 1.00 0.00 H new ATOM 0 HB3 GLN A 145 14.890 -10.641 10.736 1.00 0.00 H new ATOM 0 HG2 GLN A 145 12.323 -9.025 10.460 1.00 0.00 H new ATOM 0 HG3 GLN A 145 13.752 -8.814 9.467 1.00 0.00 H new ATOM 0 HE21 GLN A 145 14.369 -10.497 7.953 1.00 0.00 H new ATOM 0 HE22 GLN A 145 13.178 -11.677 7.398 1.00 0.00 H new ATOM 2417 N LYS A 146 15.252 -12.553 12.405 1.00 0.00 N ATOM 2418 CA LYS A 146 16.282 -13.357 13.084 1.00 0.00 C ATOM 2419 C LYS A 146 17.529 -12.488 13.406 1.00 0.00 C ATOM 2420 O LYS A 146 17.635 -11.979 14.541 1.00 0.00 O ATOM 2421 CB LYS A 146 16.650 -14.578 12.201 1.00 0.00 C ATOM 2422 CG LYS A 146 15.457 -15.497 11.866 1.00 0.00 C ATOM 2423 CD LYS A 146 15.838 -16.663 10.925 1.00 0.00 C ATOM 2424 CE LYS A 146 16.359 -16.190 9.555 1.00 0.00 C ATOM 2425 NZ LYS A 146 16.687 -17.331 8.655 1.00 0.00 N ATOM 2426 OXT LYS A 146 18.380 -12.286 12.512 1.00 0.00 O ATOM 0 H LYS A 146 15.257 -12.652 11.390 1.00 0.00 H new ATOM 0 HA LYS A 146 15.890 -13.724 14.033 1.00 0.00 H new ATOM 0 HB2 LYS A 146 17.091 -14.220 11.271 1.00 0.00 H new ATOM 0 HB3 LYS A 146 17.414 -15.164 12.711 1.00 0.00 H new ATOM 0 HG2 LYS A 146 15.047 -15.903 12.791 1.00 0.00 H new ATOM 0 HG3 LYS A 146 14.669 -14.905 11.401 1.00 0.00 H new ATOM 0 HD2 LYS A 146 16.601 -17.275 11.406 1.00 0.00 H new ATOM 0 HD3 LYS A 146 14.967 -17.300 10.775 1.00 0.00 H new ATOM 0 HE2 LYS A 146 15.608 -15.559 9.080 1.00 0.00 H new ATOM 0 HE3 LYS A 146 17.247 -15.575 9.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 17.034 -16.967 7.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 17.423 -17.920 9.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 15.834 -17.904 8.496 1.00 0.00 H new