USER MOD reduce.3.24.130724 H: found=0, std=0, add=956, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 956 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 102 GLN : amide:sc= -1.18 K(o=-0.23,f=-6!) USER MOD Set 1.2: A 125 THR OG1 : rot 180:sc= 0.944 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 CYS SG : rot 170:sc= -0.218 USER MOD Single : A 25 MET CE :methyl -143:sc= -0.956 (180deg=-4.28!) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 36 CYS SG : rot 163:sc= 1 USER MOD Single : A 39 THR OG1 : rot -92:sc= 0.225 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 120:sc= -0.477 USER MOD Single : A 49 GLN : amide:sc= 0.00961 K(o=0.0096,f=-1.1) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 CYS SG : rot 180:sc= -0.197 USER MOD Single : A 58 MET CE :methyl -150:sc= -0.444 (180deg=-1.44) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 HIS : no HD1:sc= -3.38! C(o=-3.4!,f=-6.4!) USER MOD Single : A 64 CYS SG : rot 180:sc= -0.11 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.434 K(o=-0.43,f=-6.3!) USER MOD Single : A 69 ASN : amide:sc= -1.85! C(o=-1.9!,f=-10!) USER MOD Single : A 73 GLN : amide:sc= -0.0513 X(o=-0.051,f=-0.41) USER MOD Single : A 75 THR OG1 : rot -9:sc= 0.403 USER MOD Single : A 77 MET CE :methyl -111:sc= -0.72 (180deg=-1.28) USER MOD Single : A 79 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 80 LYS NZ :NH3+ 153:sc= -0.0529 (180deg=-0.67) USER MOD Single : A 81 SER OG : rot 50:sc= -0.489 USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 ASN : amide:sc= -0.0673 K(o=-0.067,f=-5.4!) USER MOD Single : A 98 TYR OH : rot 150:sc= 0 USER MOD Single : A 99 SER OG : rot -73:sc= 0.117 USER MOD Single : A 101 HIS : no HE2:sc= -1.22 X(o=-1.2,f=-1.2) USER MOD Single : A 105 TYR OH : rot 165:sc= 0 USER MOD Single : A 107 GLN : amide:sc= -0.605 K(o=-0.61,f=0.53) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 TYR OH : rot 97:sc= 0.458 USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 CYS SG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot -113:sc= 0.492 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 156 N GLY A 15 9.046 -17.421 -10.552 1.00 0.00 N ATOM 157 CA GLY A 15 7.791 -17.470 -9.825 1.00 0.00 C ATOM 158 C GLY A 15 7.049 -16.148 -9.859 1.00 0.00 C ATOM 159 O GLY A 15 7.661 -15.083 -9.784 1.00 0.00 O ATOM 0 HA2 GLY A 15 7.158 -18.249 -10.250 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.985 -17.747 -8.789 1.00 0.00 H new ATOM 163 N ARG A 16 5.727 -16.217 -9.975 1.00 0.00 N ATOM 164 CA ARG A 16 4.901 -15.016 -10.022 1.00 0.00 C ATOM 165 C ARG A 16 4.966 -14.259 -8.699 1.00 0.00 C ATOM 166 O ARG A 16 5.146 -14.857 -7.638 1.00 0.00 O ATOM 167 CB ARG A 16 3.450 -15.382 -10.342 1.00 0.00 C ATOM 168 CG ARG A 16 3.065 -15.135 -11.792 1.00 0.00 C ATOM 169 CD ARG A 16 1.953 -16.070 -12.239 1.00 0.00 C ATOM 170 NE ARG A 16 0.693 -15.361 -12.447 1.00 0.00 N ATOM 171 CZ ARG A 16 -0.396 -15.931 -12.951 1.00 0.00 C ATOM 172 NH1 ARG A 16 -0.380 -17.211 -13.296 1.00 0.00 N ATOM 173 NH2 ARG A 16 -1.505 -15.220 -13.110 1.00 0.00 N ATOM 0 H ARG A 16 5.205 -17.091 -10.038 1.00 0.00 H new ATOM 0 HA ARG A 16 5.288 -14.370 -10.810 1.00 0.00 H new ATOM 0 HB2 ARG A 16 3.289 -16.434 -10.106 1.00 0.00 H new ATOM 0 HB3 ARG A 16 2.788 -14.806 -9.696 1.00 0.00 H new ATOM 0 HG2 ARG A 16 2.743 -14.101 -11.913 1.00 0.00 H new ATOM 0 HG3 ARG A 16 3.938 -15.274 -12.430 1.00 0.00 H new ATOM 0 HD2 ARG A 16 2.247 -16.567 -13.164 1.00 0.00 H new ATOM 0 HD3 ARG A 16 1.811 -16.849 -11.490 1.00 0.00 H new ATOM 0 HE ARG A 16 0.647 -14.375 -12.191 1.00 0.00 H new ATOM 0 HH11 ARG A 16 0.470 -17.761 -13.175 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -1.218 -17.645 -13.683 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -1.522 -14.235 -12.845 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -2.341 -15.658 -13.497 1.00 0.00 H new ATOM 187 N SER A 17 4.819 -12.940 -8.770 1.00 0.00 N ATOM 188 CA SER A 17 4.865 -12.101 -7.578 1.00 0.00 C ATOM 189 C SER A 17 3.865 -10.953 -7.684 1.00 0.00 C ATOM 190 O SER A 17 4.031 -10.043 -8.496 1.00 0.00 O ATOM 191 CB SER A 17 6.276 -11.546 -7.374 1.00 0.00 C ATOM 192 OG SER A 17 7.006 -12.336 -6.453 1.00 0.00 O ATOM 0 H SER A 17 4.667 -12.429 -9.640 1.00 0.00 H new ATOM 0 HA SER A 17 4.597 -12.716 -6.719 1.00 0.00 H new ATOM 0 HB2 SER A 17 6.801 -11.517 -8.329 1.00 0.00 H new ATOM 0 HB3 SER A 17 6.218 -10.520 -7.011 1.00 0.00 H new ATOM 0 HG SER A 17 7.905 -11.962 -6.341 1.00 0.00 H new ATOM 198 N TRP A 18 2.828 -11.003 -6.856 1.00 0.00 N ATOM 199 CA TRP A 18 1.801 -9.968 -6.855 1.00 0.00 C ATOM 200 C TRP A 18 2.424 -8.582 -6.732 1.00 0.00 C ATOM 201 O TRP A 18 3.576 -8.444 -6.318 1.00 0.00 O ATOM 202 CB TRP A 18 0.815 -10.200 -5.709 1.00 0.00 C ATOM 203 CG TRP A 18 -0.021 -11.432 -5.885 1.00 0.00 C ATOM 204 CD1 TRP A 18 0.354 -12.720 -5.632 1.00 0.00 C ATOM 205 CD2 TRP A 18 -1.373 -11.490 -6.354 1.00 0.00 C ATOM 206 NE1 TRP A 18 -0.683 -13.576 -5.916 1.00 0.00 N ATOM 207 CE2 TRP A 18 -1.754 -12.846 -6.359 1.00 0.00 C ATOM 208 CE3 TRP A 18 -2.299 -10.529 -6.767 1.00 0.00 C ATOM 209 CZ2 TRP A 18 -3.020 -13.262 -6.763 1.00 0.00 C ATOM 210 CZ3 TRP A 18 -3.555 -10.943 -7.169 1.00 0.00 C ATOM 211 CH2 TRP A 18 -3.906 -12.299 -7.164 1.00 0.00 C ATOM 0 H TRP A 18 2.676 -11.749 -6.177 1.00 0.00 H new ATOM 0 HA TRP A 18 1.266 -10.022 -7.803 1.00 0.00 H new ATOM 0 HB2 TRP A 18 1.368 -10.276 -4.773 1.00 0.00 H new ATOM 0 HB3 TRP A 18 0.159 -9.334 -5.623 1.00 0.00 H new ATOM 0 HD1 TRP A 18 1.323 -13.022 -5.263 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -0.659 -14.591 -5.813 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -2.038 -9.481 -6.772 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -3.293 -14.307 -6.760 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -4.278 -10.209 -7.492 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -4.896 -12.591 -7.483 1.00 0.00 H new ATOM 222 N CYS A 19 1.658 -7.559 -7.094 1.00 0.00 N ATOM 223 CA CYS A 19 2.136 -6.183 -7.025 1.00 0.00 C ATOM 224 C CYS A 19 0.986 -5.198 -7.203 1.00 0.00 C ATOM 225 O CYS A 19 -0.169 -5.596 -7.356 1.00 0.00 O ATOM 226 CB CYS A 19 3.204 -5.938 -8.092 1.00 0.00 C ATOM 227 SG CYS A 19 2.559 -5.873 -9.780 1.00 0.00 S ATOM 0 H CYS A 19 0.703 -7.657 -7.438 1.00 0.00 H new ATOM 0 HA CYS A 19 2.575 -6.026 -6.040 1.00 0.00 H new ATOM 0 HB2 CYS A 19 3.713 -5.000 -7.873 1.00 0.00 H new ATOM 0 HB3 CYS A 19 3.952 -6.728 -8.030 1.00 0.00 H new ATOM 0 HG CYS A 19 3.490 -5.453 -10.584 1.00 0.00 H new ATOM 233 N LEU A 20 1.309 -3.909 -7.182 1.00 0.00 N ATOM 234 CA LEU A 20 0.302 -2.865 -7.340 1.00 0.00 C ATOM 235 C LEU A 20 0.572 -2.034 -8.590 1.00 0.00 C ATOM 236 O LEU A 20 1.056 -0.905 -8.504 1.00 0.00 O ATOM 237 CB LEU A 20 0.279 -1.961 -6.106 1.00 0.00 C ATOM 238 CG LEU A 20 -0.080 -2.638 -4.784 1.00 0.00 C ATOM 239 CD1 LEU A 20 0.158 -1.692 -3.617 1.00 0.00 C ATOM 240 CD2 LEU A 20 -1.527 -3.111 -4.803 1.00 0.00 C ATOM 0 H LEU A 20 2.260 -3.562 -7.057 1.00 0.00 H new ATOM 0 HA LEU A 20 -0.671 -3.345 -7.449 1.00 0.00 H new ATOM 0 HB2 LEU A 20 1.261 -1.500 -6.000 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -0.434 -1.156 -6.284 1.00 0.00 H new ATOM 0 HG LEU A 20 0.565 -3.508 -4.657 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -0.103 -2.192 -2.684 1.00 0.00 H new ATOM 0 HD12 LEU A 20 1.209 -1.403 -3.592 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -0.461 -0.803 -3.738 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -1.765 -3.591 -3.854 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -2.187 -2.257 -4.954 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -1.666 -3.825 -5.615 1.00 0.00 H new ATOM 252 N ARG A 21 0.254 -2.598 -9.750 1.00 0.00 N ATOM 253 CA ARG A 21 0.461 -1.908 -11.018 1.00 0.00 C ATOM 254 C ARG A 21 -0.169 -0.519 -10.989 1.00 0.00 C ATOM 255 O ARG A 21 -1.365 -0.373 -10.737 1.00 0.00 O ATOM 256 CB ARG A 21 -0.130 -2.724 -12.169 1.00 0.00 C ATOM 257 CG ARG A 21 0.696 -2.664 -13.444 1.00 0.00 C ATOM 258 CD ARG A 21 -0.043 -3.290 -14.616 1.00 0.00 C ATOM 259 NE ARG A 21 -1.044 -2.387 -15.178 1.00 0.00 N ATOM 260 CZ ARG A 21 -1.537 -2.509 -16.406 1.00 0.00 C ATOM 261 NH1 ARG A 21 -1.125 -3.491 -17.195 1.00 0.00 N ATOM 262 NH2 ARG A 21 -2.445 -1.647 -16.846 1.00 0.00 N ATOM 0 H ARG A 21 -0.148 -3.531 -9.839 1.00 0.00 H new ATOM 0 HA ARG A 21 1.534 -1.798 -11.173 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -0.224 -3.764 -11.855 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -1.136 -2.363 -12.380 1.00 0.00 H new ATOM 0 HG2 ARG A 21 0.935 -1.626 -13.676 1.00 0.00 H new ATOM 0 HG3 ARG A 21 1.642 -3.182 -13.290 1.00 0.00 H new ATOM 0 HD2 ARG A 21 0.673 -3.565 -15.391 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -0.528 -4.210 -14.289 1.00 0.00 H new ATOM 0 HE ARG A 21 -1.383 -1.621 -14.596 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -0.428 -4.156 -16.860 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -1.505 -3.582 -18.137 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -2.765 -0.890 -16.242 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -2.823 -1.741 -17.789 1.00 0.00 H new ATOM 276 N ARG A 22 0.644 0.499 -11.250 1.00 0.00 N ATOM 277 CA ARG A 22 0.167 1.877 -11.253 1.00 0.00 C ATOM 278 C ARG A 22 -0.852 2.097 -12.366 1.00 0.00 C ATOM 279 O ARG A 22 -0.620 1.727 -13.517 1.00 0.00 O ATOM 280 CB ARG A 22 1.340 2.845 -11.421 1.00 0.00 C ATOM 281 CG ARG A 22 0.913 4.280 -11.680 1.00 0.00 C ATOM 282 CD ARG A 22 0.129 4.848 -10.508 1.00 0.00 C ATOM 283 NE ARG A 22 0.415 6.264 -10.292 1.00 0.00 N ATOM 284 CZ ARG A 22 1.524 6.709 -9.712 1.00 0.00 C ATOM 285 NH1 ARG A 22 2.447 5.854 -9.293 1.00 0.00 N ATOM 286 NH2 ARG A 22 1.713 8.013 -9.551 1.00 0.00 N ATOM 0 H ARG A 22 1.636 0.396 -11.462 1.00 0.00 H new ATOM 0 HA ARG A 22 -0.319 2.069 -10.296 1.00 0.00 H new ATOM 0 HB2 ARG A 22 1.956 2.815 -10.523 1.00 0.00 H new ATOM 0 HB3 ARG A 22 1.964 2.506 -12.248 1.00 0.00 H new ATOM 0 HG2 ARG A 22 1.794 4.896 -11.862 1.00 0.00 H new ATOM 0 HG3 ARG A 22 0.303 4.322 -12.582 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -0.938 4.717 -10.688 1.00 0.00 H new ATOM 0 HD3 ARG A 22 0.371 4.288 -9.605 1.00 0.00 H new ATOM 0 HE ARG A 22 -0.274 6.948 -10.603 1.00 0.00 H new ATOM 0 HH11 ARG A 22 2.307 4.851 -9.416 1.00 0.00 H new ATOM 0 HH12 ARG A 22 3.297 6.199 -8.848 1.00 0.00 H new ATOM 0 HH21 ARG A 22 1.006 8.674 -9.873 1.00 0.00 H new ATOM 0 HH22 ARG A 22 2.565 8.354 -9.105 1.00 0.00 H new ATOM 300 N VAL A 23 -1.983 2.702 -12.016 1.00 0.00 N ATOM 301 CA VAL A 23 -3.038 2.973 -12.985 1.00 0.00 C ATOM 302 C VAL A 23 -2.681 4.163 -13.868 1.00 0.00 C ATOM 303 O VAL A 23 -2.502 5.279 -13.382 1.00 0.00 O ATOM 304 CB VAL A 23 -4.383 3.250 -12.288 1.00 0.00 C ATOM 305 CG1 VAL A 23 -5.475 3.503 -13.316 1.00 0.00 C ATOM 306 CG2 VAL A 23 -4.757 2.093 -11.374 1.00 0.00 C ATOM 0 H VAL A 23 -2.192 3.014 -11.068 1.00 0.00 H new ATOM 0 HA VAL A 23 -3.135 2.081 -13.604 1.00 0.00 H new ATOM 0 HB VAL A 23 -4.278 4.147 -11.677 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -6.418 3.697 -12.805 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -5.208 4.367 -13.925 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.582 2.627 -13.956 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.710 2.305 -10.890 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.844 1.179 -11.961 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -3.985 1.964 -10.615 1.00 0.00 H new ATOM 316 N GLY A 24 -2.578 3.917 -15.171 1.00 0.00 N ATOM 317 CA GLY A 24 -2.243 4.978 -16.102 1.00 0.00 C ATOM 318 C GLY A 24 -0.750 5.093 -16.338 1.00 0.00 C ATOM 319 O GLY A 24 -0.312 5.766 -17.270 1.00 0.00 O ATOM 0 H GLY A 24 -2.721 3.002 -15.598 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -2.745 4.795 -17.052 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -2.621 5.926 -15.719 1.00 0.00 H new ATOM 323 N MET A 25 0.034 4.435 -15.490 1.00 0.00 N ATOM 324 CA MET A 25 1.487 4.467 -15.610 1.00 0.00 C ATOM 325 C MET A 25 2.068 3.058 -15.560 1.00 0.00 C ATOM 326 O MET A 25 1.577 2.199 -14.827 1.00 0.00 O ATOM 327 CB MET A 25 2.093 5.321 -14.495 1.00 0.00 C ATOM 328 CG MET A 25 2.883 6.515 -15.006 1.00 0.00 C ATOM 329 SD MET A 25 4.261 6.950 -13.926 1.00 0.00 S ATOM 330 CE MET A 25 3.456 6.929 -12.326 1.00 0.00 C ATOM 0 H MET A 25 -0.313 3.873 -14.712 1.00 0.00 H new ATOM 0 HA MET A 25 1.737 4.910 -16.574 1.00 0.00 H new ATOM 0 HB2 MET A 25 1.293 5.676 -13.845 1.00 0.00 H new ATOM 0 HB3 MET A 25 2.747 4.697 -13.885 1.00 0.00 H new ATOM 0 HG2 MET A 25 3.264 6.294 -16.003 1.00 0.00 H new ATOM 0 HG3 MET A 25 2.217 7.372 -15.102 1.00 0.00 H new ATOM 0 HE1 MET A 25 3.861 7.727 -11.704 1.00 0.00 H new ATOM 0 HE2 MET A 25 2.384 7.079 -12.456 1.00 0.00 H new ATOM 0 HE3 MET A 25 3.632 5.968 -11.843 1.00 0.00 H new ATOM 340 N SER A 26 3.115 2.826 -16.345 1.00 0.00 N ATOM 341 CA SER A 26 3.760 1.519 -16.393 1.00 0.00 C ATOM 342 C SER A 26 4.967 1.475 -15.461 1.00 0.00 C ATOM 343 O SER A 26 5.900 0.700 -15.672 1.00 0.00 O ATOM 344 CB SER A 26 4.194 1.193 -17.824 1.00 0.00 C ATOM 345 OG SER A 26 3.842 -0.134 -18.173 1.00 0.00 O ATOM 0 H SER A 26 3.535 3.526 -16.957 1.00 0.00 H new ATOM 0 HA SER A 26 3.039 0.772 -16.061 1.00 0.00 H new ATOM 0 HB2 SER A 26 3.726 1.891 -18.518 1.00 0.00 H new ATOM 0 HB3 SER A 26 5.272 1.324 -17.919 1.00 0.00 H new ATOM 0 HG SER A 26 4.129 -0.318 -19.092 1.00 0.00 H new ATOM 351 N ALA A 27 4.941 2.312 -14.429 1.00 0.00 N ATOM 352 CA ALA A 27 6.031 2.367 -13.463 1.00 0.00 C ATOM 353 C ALA A 27 5.498 2.414 -12.035 1.00 0.00 C ATOM 354 O ALA A 27 4.287 2.415 -11.814 1.00 0.00 O ATOM 355 CB ALA A 27 6.918 3.573 -13.736 1.00 0.00 C ATOM 0 H ALA A 27 4.177 2.961 -14.241 1.00 0.00 H new ATOM 0 HA ALA A 27 6.625 1.460 -13.572 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.728 3.602 -13.007 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.336 3.497 -14.740 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.326 4.485 -13.657 1.00 0.00 H new ATOM 361 N GLY A 28 6.410 2.451 -11.068 1.00 0.00 N ATOM 362 CA GLY A 28 6.011 2.496 -9.674 1.00 0.00 C ATOM 363 C GLY A 28 5.234 1.265 -9.253 1.00 0.00 C ATOM 364 O GLY A 28 4.245 1.365 -8.526 1.00 0.00 O ATOM 0 H GLY A 28 7.418 2.451 -11.226 1.00 0.00 H new ATOM 0 HA2 GLY A 28 6.898 2.593 -9.048 1.00 0.00 H new ATOM 0 HA3 GLY A 28 5.401 3.383 -9.502 1.00 0.00 H new ATOM 368 N TRP A 29 5.680 0.101 -9.711 1.00 0.00 N ATOM 369 CA TRP A 29 5.019 -1.156 -9.378 1.00 0.00 C ATOM 370 C TRP A 29 5.519 -1.698 -8.044 1.00 0.00 C ATOM 371 O TRP A 29 6.640 -2.201 -7.948 1.00 0.00 O ATOM 372 CB TRP A 29 5.254 -2.187 -10.483 1.00 0.00 C ATOM 373 CG TRP A 29 4.612 -1.819 -11.786 1.00 0.00 C ATOM 374 CD1 TRP A 29 3.924 -0.673 -12.066 1.00 0.00 C ATOM 375 CD2 TRP A 29 4.596 -2.602 -12.985 1.00 0.00 C ATOM 376 NE1 TRP A 29 3.482 -0.696 -13.366 1.00 0.00 N ATOM 377 CE2 TRP A 29 3.882 -1.868 -13.952 1.00 0.00 C ATOM 378 CE3 TRP A 29 5.117 -3.850 -13.336 1.00 0.00 C ATOM 379 CZ2 TRP A 29 3.676 -2.343 -15.244 1.00 0.00 C ATOM 380 CZ3 TRP A 29 4.912 -4.320 -14.619 1.00 0.00 C ATOM 381 CH2 TRP A 29 4.197 -3.568 -15.561 1.00 0.00 C ATOM 0 H TRP A 29 6.497 0.001 -10.314 1.00 0.00 H new ATOM 0 HA TRP A 29 3.950 -0.964 -9.292 1.00 0.00 H new ATOM 0 HB2 TRP A 29 6.327 -2.307 -10.636 1.00 0.00 H new ATOM 0 HB3 TRP A 29 4.869 -3.153 -10.157 1.00 0.00 H new ATOM 0 HD1 TRP A 29 3.753 0.133 -11.368 1.00 0.00 H new ATOM 0 HE1 TRP A 29 2.943 0.040 -13.822 1.00 0.00 H new ATOM 0 HE3 TRP A 29 5.670 -4.437 -12.617 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 3.124 -1.765 -15.971 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 5.310 -5.284 -14.901 1.00 0.00 H new ATOM 0 HH2 TRP A 29 4.054 -3.963 -16.556 1.00 0.00 H new ATOM 392 N LEU A 30 4.683 -1.594 -7.017 1.00 0.00 N ATOM 393 CA LEU A 30 5.041 -2.074 -5.687 1.00 0.00 C ATOM 394 C LEU A 30 4.990 -3.598 -5.626 1.00 0.00 C ATOM 395 O LEU A 30 3.922 -4.199 -5.748 1.00 0.00 O ATOM 396 CB LEU A 30 4.101 -1.479 -4.637 1.00 0.00 C ATOM 397 CG LEU A 30 3.771 0.006 -4.797 1.00 0.00 C ATOM 398 CD1 LEU A 30 2.612 0.395 -3.893 1.00 0.00 C ATOM 399 CD2 LEU A 30 4.994 0.859 -4.498 1.00 0.00 C ATOM 0 H LEU A 30 3.752 -1.181 -7.080 1.00 0.00 H new ATOM 0 HA LEU A 30 6.061 -1.754 -5.475 1.00 0.00 H new ATOM 0 HB2 LEU A 30 3.168 -2.042 -4.653 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.546 -1.628 -3.653 1.00 0.00 H new ATOM 0 HG LEU A 30 3.474 0.184 -5.830 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.391 1.455 -4.020 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.733 -0.193 -4.156 1.00 0.00 H new ATOM 0 HD13 LEU A 30 2.880 0.202 -2.854 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.741 1.912 -4.617 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.322 0.678 -3.475 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.797 0.599 -5.188 1.00 0.00 H new ATOM 411 N LEU A 31 6.150 -4.216 -5.436 1.00 0.00 N ATOM 412 CA LEU A 31 6.237 -5.670 -5.357 1.00 0.00 C ATOM 413 C LEU A 31 5.580 -6.187 -4.081 1.00 0.00 C ATOM 414 O LEU A 31 5.664 -5.555 -3.027 1.00 0.00 O ATOM 415 CB LEU A 31 7.700 -6.117 -5.407 1.00 0.00 C ATOM 416 CG LEU A 31 7.954 -7.610 -5.197 1.00 0.00 C ATOM 417 CD1 LEU A 31 7.645 -8.387 -6.467 1.00 0.00 C ATOM 418 CD2 LEU A 31 9.391 -7.850 -4.759 1.00 0.00 C ATOM 0 H LEU A 31 7.043 -3.734 -5.334 1.00 0.00 H new ATOM 0 HA LEU A 31 5.706 -6.087 -6.212 1.00 0.00 H new ATOM 0 HB2 LEU A 31 8.113 -5.831 -6.374 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.254 -5.565 -4.648 1.00 0.00 H new ATOM 0 HG LEU A 31 7.291 -7.965 -4.408 1.00 0.00 H new ATOM 0 HD11 LEU A 31 7.831 -9.448 -6.299 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.599 -8.241 -6.738 1.00 0.00 H new ATOM 0 HD13 LEU A 31 8.282 -8.030 -7.276 1.00 0.00 H new ATOM 0 HD21 LEU A 31 9.554 -8.918 -4.614 1.00 0.00 H new ATOM 0 HD22 LEU A 31 10.072 -7.480 -5.526 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.579 -7.324 -3.823 1.00 0.00 H new ATOM 430 N LEU A 32 4.928 -7.340 -4.182 1.00 0.00 N ATOM 431 CA LEU A 32 4.258 -7.943 -3.035 1.00 0.00 C ATOM 432 C LEU A 32 4.755 -9.366 -2.801 1.00 0.00 C ATOM 433 O LEU A 32 4.023 -10.332 -3.015 1.00 0.00 O ATOM 434 CB LEU A 32 2.743 -7.948 -3.249 1.00 0.00 C ATOM 435 CG LEU A 32 2.050 -6.587 -3.175 1.00 0.00 C ATOM 436 CD1 LEU A 32 0.674 -6.653 -3.819 1.00 0.00 C ATOM 437 CD2 LEU A 32 1.943 -6.122 -1.730 1.00 0.00 C ATOM 0 H LEU A 32 4.849 -7.876 -5.046 1.00 0.00 H new ATOM 0 HA LEU A 32 4.492 -7.346 -2.153 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.536 -8.386 -4.225 1.00 0.00 H new ATOM 0 HB3 LEU A 32 2.293 -8.603 -2.503 1.00 0.00 H new ATOM 0 HG LEU A 32 2.651 -5.863 -3.725 1.00 0.00 H new ATOM 0 HD11 LEU A 32 0.196 -5.675 -3.757 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.775 -6.942 -4.865 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.063 -7.389 -3.297 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.447 -5.152 -1.696 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.364 -6.846 -1.157 1.00 0.00 H new ATOM 0 HD23 LEU A 32 2.941 -6.035 -1.301 1.00 0.00 H new ATOM 449 N GLU A 33 6.002 -9.487 -2.359 1.00 0.00 N ATOM 450 CA GLU A 33 6.596 -10.792 -2.094 1.00 0.00 C ATOM 451 C GLU A 33 5.727 -11.600 -1.134 1.00 0.00 C ATOM 452 O GLU A 33 5.348 -11.116 -0.067 1.00 0.00 O ATOM 453 CB GLU A 33 8.002 -10.630 -1.514 1.00 0.00 C ATOM 454 CG GLU A 33 9.104 -11.101 -2.448 1.00 0.00 C ATOM 455 CD GLU A 33 10.466 -11.118 -1.782 1.00 0.00 C ATOM 456 OE1 GLU A 33 10.566 -10.654 -0.626 1.00 0.00 O ATOM 457 OE2 GLU A 33 11.431 -11.594 -2.415 1.00 0.00 O ATOM 0 H GLU A 33 6.621 -8.697 -2.177 1.00 0.00 H new ATOM 0 HA GLU A 33 6.662 -11.331 -3.039 1.00 0.00 H new ATOM 0 HB2 GLU A 33 8.167 -9.580 -1.271 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.067 -11.187 -0.579 1.00 0.00 H new ATOM 0 HG2 GLU A 33 8.867 -12.102 -2.807 1.00 0.00 H new ATOM 0 HG3 GLU A 33 9.139 -10.449 -3.321 1.00 0.00 H new ATOM 464 N ASP A 34 5.417 -12.832 -1.520 1.00 0.00 N ATOM 465 CA ASP A 34 4.594 -13.708 -0.694 1.00 0.00 C ATOM 466 C ASP A 34 5.283 -14.009 0.633 1.00 0.00 C ATOM 467 O ASP A 34 6.334 -14.648 0.667 1.00 0.00 O ATOM 468 CB ASP A 34 4.296 -15.012 -1.436 1.00 0.00 C ATOM 469 CG ASP A 34 3.798 -16.104 -0.510 1.00 0.00 C ATOM 470 OD1 ASP A 34 4.630 -16.695 0.211 1.00 0.00 O ATOM 471 OD2 ASP A 34 2.578 -16.368 -0.506 1.00 0.00 O ATOM 0 H ASP A 34 5.723 -13.247 -2.400 1.00 0.00 H new ATOM 0 HA ASP A 34 3.655 -13.194 -0.487 1.00 0.00 H new ATOM 0 HB2 ASP A 34 3.549 -14.825 -2.207 1.00 0.00 H new ATOM 0 HB3 ASP A 34 5.199 -15.353 -1.943 1.00 0.00 H new ATOM 476 N GLY A 35 4.684 -13.543 1.724 1.00 0.00 N ATOM 477 CA GLY A 35 5.256 -13.771 3.039 1.00 0.00 C ATOM 478 C GLY A 35 6.110 -12.611 3.509 1.00 0.00 C ATOM 479 O GLY A 35 6.811 -12.716 4.516 1.00 0.00 O ATOM 0 H GLY A 35 3.813 -13.012 1.722 1.00 0.00 H new ATOM 0 HA2 GLY A 35 4.453 -13.941 3.756 1.00 0.00 H new ATOM 0 HA3 GLY A 35 5.861 -14.678 3.016 1.00 0.00 H new ATOM 483 N CYS A 36 6.052 -11.502 2.780 1.00 0.00 N ATOM 484 CA CYS A 36 6.829 -10.317 3.127 1.00 0.00 C ATOM 485 C CYS A 36 5.922 -9.101 3.287 1.00 0.00 C ATOM 486 O CYS A 36 5.275 -8.669 2.334 1.00 0.00 O ATOM 487 CB CYS A 36 7.886 -10.044 2.057 1.00 0.00 C ATOM 488 SG CYS A 36 9.380 -11.048 2.222 1.00 0.00 S ATOM 0 H CYS A 36 5.475 -11.398 1.945 1.00 0.00 H new ATOM 0 HA CYS A 36 7.327 -10.504 4.079 1.00 0.00 H new ATOM 0 HB2 CYS A 36 7.448 -10.222 1.075 1.00 0.00 H new ATOM 0 HB3 CYS A 36 8.163 -8.991 2.096 1.00 0.00 H new ATOM 0 HG CYS A 36 10.045 -11.022 1.106 1.00 0.00 H new ATOM 494 N GLU A 37 5.881 -8.555 4.499 1.00 0.00 N ATOM 495 CA GLU A 37 5.051 -7.390 4.783 1.00 0.00 C ATOM 496 C GLU A 37 5.434 -6.218 3.885 1.00 0.00 C ATOM 497 O GLU A 37 6.612 -5.889 3.742 1.00 0.00 O ATOM 498 CB GLU A 37 5.186 -6.987 6.253 1.00 0.00 C ATOM 499 CG GLU A 37 3.893 -6.478 6.866 1.00 0.00 C ATOM 500 CD GLU A 37 4.130 -5.548 8.040 1.00 0.00 C ATOM 501 OE1 GLU A 37 5.063 -4.722 7.964 1.00 0.00 O ATOM 502 OE2 GLU A 37 3.380 -5.646 9.034 1.00 0.00 O ATOM 0 H GLU A 37 6.412 -8.900 5.298 1.00 0.00 H new ATOM 0 HA GLU A 37 4.013 -7.656 4.581 1.00 0.00 H new ATOM 0 HB2 GLU A 37 5.536 -7.846 6.826 1.00 0.00 H new ATOM 0 HB3 GLU A 37 5.949 -6.213 6.340 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.315 -5.955 6.104 1.00 0.00 H new ATOM 0 HG3 GLU A 37 3.293 -7.326 7.195 1.00 0.00 H new ATOM 509 N VAL A 38 4.430 -5.590 3.281 1.00 0.00 N ATOM 510 CA VAL A 38 4.661 -4.453 2.397 1.00 0.00 C ATOM 511 C VAL A 38 3.975 -3.198 2.926 1.00 0.00 C ATOM 512 O VAL A 38 2.767 -3.020 2.761 1.00 0.00 O ATOM 513 CB VAL A 38 4.155 -4.740 0.971 1.00 0.00 C ATOM 514 CG1 VAL A 38 4.514 -3.595 0.037 1.00 0.00 C ATOM 515 CG2 VAL A 38 4.722 -6.055 0.459 1.00 0.00 C ATOM 0 H VAL A 38 3.449 -5.849 3.388 1.00 0.00 H new ATOM 0 HA VAL A 38 5.738 -4.289 2.366 1.00 0.00 H new ATOM 0 HB VAL A 38 3.069 -4.827 1.000 1.00 0.00 H new ATOM 0 HG11 VAL A 38 4.149 -3.815 -0.966 1.00 0.00 H new ATOM 0 HG12 VAL A 38 4.054 -2.674 0.397 1.00 0.00 H new ATOM 0 HG13 VAL A 38 5.597 -3.473 0.010 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.354 -6.242 -0.550 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.811 -6.001 0.444 1.00 0.00 H new ATOM 0 HG23 VAL A 38 4.408 -6.867 1.116 1.00 0.00 H new ATOM 525 N THR A 39 4.753 -2.328 3.562 1.00 0.00 N ATOM 526 CA THR A 39 4.221 -1.089 4.115 1.00 0.00 C ATOM 527 C THR A 39 4.438 0.078 3.159 1.00 0.00 C ATOM 528 O THR A 39 5.482 0.180 2.515 1.00 0.00 O ATOM 529 CB THR A 39 4.872 -0.755 5.471 1.00 0.00 C ATOM 530 OG1 THR A 39 6.283 -0.573 5.306 1.00 0.00 O ATOM 531 CG2 THR A 39 4.614 -1.861 6.483 1.00 0.00 C ATOM 0 H THR A 39 5.754 -2.459 3.707 1.00 0.00 H new ATOM 0 HA THR A 39 3.152 -1.241 4.261 1.00 0.00 H new ATOM 0 HB THR A 39 4.428 0.168 5.844 1.00 0.00 H new ATOM 0 HG1 THR A 39 6.743 -1.425 5.459 1.00 0.00 H new ATOM 0 HG21 THR A 39 5.083 -1.602 7.432 1.00 0.00 H new ATOM 0 HG22 THR A 39 3.540 -1.977 6.629 1.00 0.00 H new ATOM 0 HG23 THR A 39 5.033 -2.797 6.114 1.00 0.00 H new ATOM 539 N VAL A 40 3.445 0.957 3.071 1.00 0.00 N ATOM 540 CA VAL A 40 3.528 2.119 2.194 1.00 0.00 C ATOM 541 C VAL A 40 3.328 3.412 2.976 1.00 0.00 C ATOM 542 O VAL A 40 2.592 3.447 3.961 1.00 0.00 O ATOM 543 CB VAL A 40 2.482 2.046 1.066 1.00 0.00 C ATOM 544 CG1 VAL A 40 2.716 3.152 0.048 1.00 0.00 C ATOM 545 CG2 VAL A 40 2.513 0.680 0.398 1.00 0.00 C ATOM 0 H VAL A 40 2.574 0.887 3.596 1.00 0.00 H new ATOM 0 HA VAL A 40 4.526 2.114 1.755 1.00 0.00 H new ATOM 0 HB VAL A 40 1.493 2.189 1.502 1.00 0.00 H new ATOM 0 HG11 VAL A 40 1.967 3.084 -0.741 1.00 0.00 H new ATOM 0 HG12 VAL A 40 2.638 4.122 0.540 1.00 0.00 H new ATOM 0 HG13 VAL A 40 3.710 3.044 -0.385 1.00 0.00 H new ATOM 0 HG21 VAL A 40 1.767 0.646 -0.396 1.00 0.00 H new ATOM 0 HG22 VAL A 40 3.502 0.504 -0.025 1.00 0.00 H new ATOM 0 HG23 VAL A 40 2.292 -0.091 1.136 1.00 0.00 H new ATOM 555 N GLY A 41 3.988 4.476 2.528 1.00 0.00 N ATOM 556 CA GLY A 41 3.870 5.758 3.197 1.00 0.00 C ATOM 557 C GLY A 41 4.909 6.756 2.727 1.00 0.00 C ATOM 558 O GLY A 41 5.434 6.640 1.619 1.00 0.00 O ATOM 0 H GLY A 41 4.602 4.473 1.714 1.00 0.00 H new ATOM 0 HA2 GLY A 41 2.874 6.165 3.022 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.970 5.613 4.273 1.00 0.00 H new ATOM 562 N ARG A 42 5.206 7.740 3.569 1.00 0.00 N ATOM 563 CA ARG A 42 6.188 8.764 3.232 1.00 0.00 C ATOM 564 C ARG A 42 7.408 8.668 4.142 1.00 0.00 C ATOM 565 O ARG A 42 8.507 9.078 3.770 1.00 0.00 O ATOM 566 CB ARG A 42 5.563 10.156 3.343 1.00 0.00 C ATOM 567 CG ARG A 42 5.171 10.535 4.762 1.00 0.00 C ATOM 568 CD ARG A 42 4.867 12.021 4.878 1.00 0.00 C ATOM 569 NE ARG A 42 4.289 12.362 6.175 1.00 0.00 N ATOM 570 CZ ARG A 42 4.285 13.592 6.677 1.00 0.00 C ATOM 571 NH1 ARG A 42 4.825 14.592 5.995 1.00 0.00 N ATOM 572 NH2 ARG A 42 3.740 13.823 7.865 1.00 0.00 N ATOM 0 H ARG A 42 4.781 7.850 4.490 1.00 0.00 H new ATOM 0 HA ARG A 42 6.510 8.599 2.204 1.00 0.00 H new ATOM 0 HB2 ARG A 42 6.269 10.894 2.960 1.00 0.00 H new ATOM 0 HB3 ARG A 42 4.679 10.200 2.707 1.00 0.00 H new ATOM 0 HG2 ARG A 42 4.297 9.959 5.065 1.00 0.00 H new ATOM 0 HG3 ARG A 42 5.978 10.273 5.446 1.00 0.00 H new ATOM 0 HD2 ARG A 42 5.784 12.591 4.729 1.00 0.00 H new ATOM 0 HD3 ARG A 42 4.177 12.313 4.086 1.00 0.00 H new ATOM 0 HE ARG A 42 3.865 11.615 6.725 1.00 0.00 H new ATOM 0 HH11 ARG A 42 5.245 14.418 5.082 1.00 0.00 H new ATOM 0 HH12 ARG A 42 4.820 15.535 6.383 1.00 0.00 H new ATOM 0 HH21 ARG A 42 3.324 13.056 8.393 1.00 0.00 H new ATOM 0 HH22 ARG A 42 3.737 14.768 8.250 1.00 0.00 H new ATOM 586 N GLY A 43 7.207 8.123 5.338 1.00 0.00 N ATOM 587 CA GLY A 43 8.299 7.984 6.283 1.00 0.00 C ATOM 588 C GLY A 43 9.496 7.272 5.685 1.00 0.00 C ATOM 589 O GLY A 43 9.414 6.718 4.589 1.00 0.00 O ATOM 0 H GLY A 43 6.307 7.775 5.669 1.00 0.00 H new ATOM 0 HA2 GLY A 43 8.603 8.972 6.630 1.00 0.00 H new ATOM 0 HA3 GLY A 43 7.951 7.433 7.157 1.00 0.00 H new ATOM 593 N PHE A 44 10.613 7.287 6.406 1.00 0.00 N ATOM 594 CA PHE A 44 11.833 6.640 5.938 1.00 0.00 C ATOM 595 C PHE A 44 12.013 5.276 6.599 1.00 0.00 C ATOM 596 O PHE A 44 13.135 4.846 6.864 1.00 0.00 O ATOM 597 CB PHE A 44 13.048 7.524 6.228 1.00 0.00 C ATOM 598 CG PHE A 44 14.193 7.299 5.282 1.00 0.00 C ATOM 599 CD1 PHE A 44 14.111 7.715 3.963 1.00 0.00 C ATOM 600 CD2 PHE A 44 15.351 6.672 5.713 1.00 0.00 C ATOM 601 CE1 PHE A 44 15.162 7.508 3.091 1.00 0.00 C ATOM 602 CE2 PHE A 44 16.406 6.463 4.845 1.00 0.00 C ATOM 603 CZ PHE A 44 16.312 6.883 3.532 1.00 0.00 C ATOM 0 H PHE A 44 10.698 7.740 7.316 1.00 0.00 H new ATOM 0 HA PHE A 44 11.747 6.494 4.861 1.00 0.00 H new ATOM 0 HB2 PHE A 44 12.746 8.570 6.178 1.00 0.00 H new ATOM 0 HB3 PHE A 44 13.387 7.338 7.247 1.00 0.00 H new ATOM 0 HD1 PHE A 44 13.215 8.207 3.613 1.00 0.00 H new ATOM 0 HD2 PHE A 44 15.430 6.343 6.739 1.00 0.00 H new ATOM 0 HE1 PHE A 44 15.085 7.835 2.065 1.00 0.00 H new ATOM 0 HE2 PHE A 44 17.303 5.972 5.193 1.00 0.00 H new ATOM 0 HZ PHE A 44 17.136 6.723 2.852 1.00 0.00 H new ATOM 613 N GLY A 45 10.898 4.601 6.862 1.00 0.00 N ATOM 614 CA GLY A 45 10.954 3.294 7.490 1.00 0.00 C ATOM 615 C GLY A 45 10.177 2.246 6.718 1.00 0.00 C ATOM 616 O GLY A 45 10.569 1.081 6.671 1.00 0.00 O ATOM 0 H GLY A 45 9.958 4.936 6.652 1.00 0.00 H new ATOM 0 HA2 GLY A 45 11.994 2.980 7.576 1.00 0.00 H new ATOM 0 HA3 GLY A 45 10.557 3.364 8.503 1.00 0.00 H new ATOM 620 N VAL A 46 9.069 2.661 6.112 1.00 0.00 N ATOM 621 CA VAL A 46 8.234 1.750 5.339 1.00 0.00 C ATOM 622 C VAL A 46 9.009 1.152 4.170 1.00 0.00 C ATOM 623 O VAL A 46 9.948 1.760 3.657 1.00 0.00 O ATOM 624 CB VAL A 46 6.979 2.461 4.798 1.00 0.00 C ATOM 625 CG1 VAL A 46 6.018 2.784 5.932 1.00 0.00 C ATOM 626 CG2 VAL A 46 7.366 3.722 4.040 1.00 0.00 C ATOM 0 H VAL A 46 8.729 3.622 6.142 1.00 0.00 H new ATOM 0 HA VAL A 46 7.928 0.952 6.015 1.00 0.00 H new ATOM 0 HB VAL A 46 6.472 1.789 4.105 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.138 3.286 5.531 1.00 0.00 H new ATOM 0 HG12 VAL A 46 5.716 1.861 6.427 1.00 0.00 H new ATOM 0 HG13 VAL A 46 6.511 3.437 6.652 1.00 0.00 H new ATOM 0 HG21 VAL A 46 6.467 4.211 3.665 1.00 0.00 H new ATOM 0 HG22 VAL A 46 7.896 4.400 4.709 1.00 0.00 H new ATOM 0 HG23 VAL A 46 8.012 3.459 3.203 1.00 0.00 H new ATOM 636 N THR A 47 8.609 -0.045 3.752 1.00 0.00 N ATOM 637 CA THR A 47 9.265 -0.727 2.644 1.00 0.00 C ATOM 638 C THR A 47 9.148 0.079 1.356 1.00 0.00 C ATOM 639 O THR A 47 9.980 -0.045 0.457 1.00 0.00 O ATOM 640 CB THR A 47 8.671 -2.129 2.415 1.00 0.00 C ATOM 641 OG1 THR A 47 8.833 -2.928 3.592 1.00 0.00 O ATOM 642 CG2 THR A 47 9.341 -2.815 1.234 1.00 0.00 C ATOM 0 H THR A 47 7.833 -0.562 4.165 1.00 0.00 H new ATOM 0 HA THR A 47 10.317 -0.827 2.913 1.00 0.00 H new ATOM 0 HB THR A 47 7.609 -2.018 2.195 1.00 0.00 H new ATOM 0 HG1 THR A 47 8.451 -3.817 3.439 1.00 0.00 H new ATOM 0 HG21 THR A 47 8.905 -3.804 1.092 1.00 0.00 H new ATOM 0 HG22 THR A 47 9.190 -2.219 0.334 1.00 0.00 H new ATOM 0 HG23 THR A 47 10.409 -2.914 1.429 1.00 0.00 H new ATOM 650 N TYR A 48 8.111 0.905 1.273 1.00 0.00 N ATOM 651 CA TYR A 48 7.884 1.731 0.092 1.00 0.00 C ATOM 652 C TYR A 48 7.576 3.172 0.487 1.00 0.00 C ATOM 653 O TYR A 48 6.634 3.433 1.234 1.00 0.00 O ATOM 654 CB TYR A 48 6.735 1.161 -0.741 1.00 0.00 C ATOM 655 CG TYR A 48 7.107 -0.084 -1.514 1.00 0.00 C ATOM 656 CD1 TYR A 48 7.934 -0.013 -2.629 1.00 0.00 C ATOM 657 CD2 TYR A 48 6.632 -1.332 -1.131 1.00 0.00 C ATOM 658 CE1 TYR A 48 8.276 -1.147 -3.339 1.00 0.00 C ATOM 659 CE2 TYR A 48 6.970 -2.472 -1.834 1.00 0.00 C ATOM 660 CZ TYR A 48 7.792 -2.375 -2.937 1.00 0.00 C ATOM 661 OH TYR A 48 8.130 -3.508 -3.641 1.00 0.00 O ATOM 0 H TYR A 48 7.414 1.021 2.009 1.00 0.00 H new ATOM 0 HA TYR A 48 8.795 1.724 -0.506 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.898 0.932 -0.081 1.00 0.00 H new ATOM 0 HB3 TYR A 48 6.391 1.923 -1.440 1.00 0.00 H new ATOM 0 HD1 TYR A 48 8.316 0.946 -2.946 1.00 0.00 H new ATOM 0 HD2 TYR A 48 5.987 -1.412 -0.268 1.00 0.00 H new ATOM 0 HE1 TYR A 48 8.919 -1.073 -4.204 1.00 0.00 H new ATOM 0 HE2 TYR A 48 6.592 -3.434 -1.521 1.00 0.00 H new ATOM 0 HH TYR A 48 8.601 -4.132 -3.050 1.00 0.00 H new ATOM 671 N GLN A 49 8.377 4.102 -0.022 1.00 0.00 N ATOM 672 CA GLN A 49 8.190 5.517 0.276 1.00 0.00 C ATOM 673 C GLN A 49 7.771 6.286 -0.972 1.00 0.00 C ATOM 674 O GLN A 49 8.433 6.215 -2.009 1.00 0.00 O ATOM 675 CB GLN A 49 9.477 6.113 0.850 1.00 0.00 C ATOM 676 CG GLN A 49 9.401 7.614 1.082 1.00 0.00 C ATOM 677 CD GLN A 49 10.732 8.208 1.498 1.00 0.00 C ATOM 678 OE1 GLN A 49 11.788 7.617 1.267 1.00 0.00 O ATOM 679 NE2 GLN A 49 10.690 9.383 2.115 1.00 0.00 N ATOM 0 H GLN A 49 9.161 3.901 -0.642 1.00 0.00 H new ATOM 0 HA GLN A 49 7.395 5.605 1.017 1.00 0.00 H new ATOM 0 HB2 GLN A 49 9.707 5.619 1.794 1.00 0.00 H new ATOM 0 HB3 GLN A 49 10.301 5.900 0.169 1.00 0.00 H new ATOM 0 HG2 GLN A 49 9.059 8.102 0.169 1.00 0.00 H new ATOM 0 HG3 GLN A 49 8.658 7.822 1.852 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.793 9.837 2.286 1.00 0.00 H new ATOM 0 HE22 GLN A 49 11.555 9.831 2.418 1.00 0.00 H new ATOM 688 N LEU A 50 6.669 7.021 -0.867 1.00 0.00 N ATOM 689 CA LEU A 50 6.162 7.804 -1.988 1.00 0.00 C ATOM 690 C LEU A 50 6.176 9.294 -1.663 1.00 0.00 C ATOM 691 O LEU A 50 5.490 9.746 -0.746 1.00 0.00 O ATOM 692 CB LEU A 50 4.741 7.361 -2.343 1.00 0.00 C ATOM 693 CG LEU A 50 4.562 5.878 -2.670 1.00 0.00 C ATOM 694 CD1 LEU A 50 3.135 5.437 -2.384 1.00 0.00 C ATOM 695 CD2 LEU A 50 4.926 5.604 -4.122 1.00 0.00 C ATOM 0 H LEU A 50 6.110 7.091 -0.017 1.00 0.00 H new ATOM 0 HA LEU A 50 6.815 7.632 -2.844 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.085 7.610 -1.509 1.00 0.00 H new ATOM 0 HB3 LEU A 50 4.403 7.945 -3.199 1.00 0.00 H new ATOM 0 HG LEU A 50 5.233 5.302 -2.033 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.026 4.379 -2.623 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.909 5.596 -1.330 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.445 6.019 -2.995 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.793 4.544 -4.337 1.00 0.00 H new ATOM 0 HD22 LEU A 50 4.281 6.191 -4.776 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.966 5.881 -4.295 1.00 0.00 H new ATOM 707 N VAL A 51 6.960 10.053 -2.422 1.00 0.00 N ATOM 708 CA VAL A 51 7.062 11.492 -2.216 1.00 0.00 C ATOM 709 C VAL A 51 6.811 12.252 -3.514 1.00 0.00 C ATOM 710 O VAL A 51 7.377 11.922 -4.557 1.00 0.00 O ATOM 711 CB VAL A 51 8.445 11.885 -1.664 1.00 0.00 C ATOM 712 CG1 VAL A 51 8.467 13.355 -1.276 1.00 0.00 C ATOM 713 CG2 VAL A 51 8.813 11.006 -0.477 1.00 0.00 C ATOM 0 H VAL A 51 7.534 9.695 -3.185 1.00 0.00 H new ATOM 0 HA VAL A 51 6.298 11.761 -1.486 1.00 0.00 H new ATOM 0 HB VAL A 51 9.188 11.730 -2.447 1.00 0.00 H new ATOM 0 HG11 VAL A 51 9.452 13.614 -0.888 1.00 0.00 H new ATOM 0 HG12 VAL A 51 8.250 13.966 -2.152 1.00 0.00 H new ATOM 0 HG13 VAL A 51 7.715 13.540 -0.509 1.00 0.00 H new ATOM 0 HG21 VAL A 51 9.793 11.297 -0.099 1.00 0.00 H new ATOM 0 HG22 VAL A 51 8.069 11.128 0.311 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.840 9.963 -0.791 1.00 0.00 H new ATOM 723 N SER A 52 5.960 13.270 -3.443 1.00 0.00 N ATOM 724 CA SER A 52 5.632 14.075 -4.614 1.00 0.00 C ATOM 725 C SER A 52 5.658 15.562 -4.275 1.00 0.00 C ATOM 726 O SER A 52 5.476 15.952 -3.121 1.00 0.00 O ATOM 727 CB SER A 52 4.254 13.688 -5.155 1.00 0.00 C ATOM 728 OG SER A 52 4.238 13.710 -6.572 1.00 0.00 O ATOM 0 H SER A 52 5.485 13.557 -2.587 1.00 0.00 H new ATOM 0 HA SER A 52 6.383 13.881 -5.380 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.987 12.692 -4.801 1.00 0.00 H new ATOM 0 HB3 SER A 52 3.502 14.376 -4.769 1.00 0.00 H new ATOM 0 HG SER A 52 3.347 13.457 -6.893 1.00 0.00 H new ATOM 734 N LYS A 53 5.885 16.390 -5.289 1.00 0.00 N ATOM 735 CA LYS A 53 5.934 17.835 -5.102 1.00 0.00 C ATOM 736 C LYS A 53 4.571 18.465 -5.370 1.00 0.00 C ATOM 737 O LYS A 53 4.467 19.673 -5.586 1.00 0.00 O ATOM 738 CB LYS A 53 6.984 18.454 -6.027 1.00 0.00 C ATOM 739 CG LYS A 53 8.410 18.271 -5.537 1.00 0.00 C ATOM 740 CD LYS A 53 9.029 16.997 -6.085 1.00 0.00 C ATOM 741 CE LYS A 53 10.033 16.400 -5.111 1.00 0.00 C ATOM 742 NZ LYS A 53 11.411 16.909 -5.354 1.00 0.00 N ATOM 0 H LYS A 53 6.038 16.084 -6.250 1.00 0.00 H new ATOM 0 HA LYS A 53 6.209 18.033 -4.066 1.00 0.00 H new ATOM 0 HB2 LYS A 53 6.890 18.010 -7.018 1.00 0.00 H new ATOM 0 HB3 LYS A 53 6.779 19.519 -6.134 1.00 0.00 H new ATOM 0 HG2 LYS A 53 9.012 19.128 -5.839 1.00 0.00 H new ATOM 0 HG3 LYS A 53 8.420 18.242 -4.447 1.00 0.00 H new ATOM 0 HD2 LYS A 53 8.244 16.269 -6.291 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.523 17.210 -7.033 1.00 0.00 H new ATOM 0 HE2 LYS A 53 9.733 16.636 -4.090 1.00 0.00 H new ATOM 0 HE3 LYS A 53 10.026 15.314 -5.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 12.066 16.479 -4.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 11.707 16.662 -6.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 11.424 17.943 -5.242 1.00 0.00 H new ATOM 756 N ILE A 54 3.529 17.640 -5.353 1.00 0.00 N ATOM 757 CA ILE A 54 2.173 18.118 -5.591 1.00 0.00 C ATOM 758 C ILE A 54 1.338 18.061 -4.316 1.00 0.00 C ATOM 759 O ILE A 54 0.809 19.076 -3.863 1.00 0.00 O ATOM 760 CB ILE A 54 1.471 17.296 -6.688 1.00 0.00 C ATOM 761 CG1 ILE A 54 2.344 17.229 -7.943 1.00 0.00 C ATOM 762 CG2 ILE A 54 0.112 17.897 -7.013 1.00 0.00 C ATOM 763 CD1 ILE A 54 2.565 18.575 -8.598 1.00 0.00 C ATOM 0 H ILE A 54 3.598 16.638 -5.177 1.00 0.00 H new ATOM 0 HA ILE A 54 2.257 19.153 -5.921 1.00 0.00 H new ATOM 0 HB ILE A 54 1.319 16.282 -6.319 1.00 0.00 H new ATOM 0 HG12 ILE A 54 3.310 16.798 -7.681 1.00 0.00 H new ATOM 0 HG13 ILE A 54 1.880 16.555 -8.663 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.371 17.305 -7.790 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -0.509 17.897 -6.117 1.00 0.00 H new ATOM 0 HG23 ILE A 54 0.242 18.920 -7.365 1.00 0.00 H new ATOM 0 HD11 ILE A 54 3.192 18.451 -9.481 1.00 0.00 H new ATOM 0 HD12 ILE A 54 1.605 18.999 -8.892 1.00 0.00 H new ATOM 0 HD13 ILE A 54 3.058 19.246 -7.894 1.00 0.00 H new ATOM 775 N CYS A 55 1.226 16.868 -3.743 1.00 0.00 N ATOM 776 CA CYS A 55 0.456 16.678 -2.518 1.00 0.00 C ATOM 777 C CYS A 55 1.009 15.514 -1.703 1.00 0.00 C ATOM 778 O CYS A 55 0.413 14.440 -1.625 1.00 0.00 O ATOM 779 CB CYS A 55 -1.016 16.430 -2.850 1.00 0.00 C ATOM 780 SG CYS A 55 -1.284 15.175 -4.124 1.00 0.00 S ATOM 0 H CYS A 55 1.658 16.018 -4.106 1.00 0.00 H new ATOM 0 HA CYS A 55 0.539 17.587 -1.922 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -1.536 16.127 -1.941 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -1.466 17.367 -3.178 1.00 0.00 H new ATOM 0 HG CYS A 55 -2.559 15.035 -4.334 1.00 0.00 H new ATOM 786 N PRO A 56 2.178 15.730 -1.082 1.00 0.00 N ATOM 787 CA PRO A 56 2.839 14.709 -0.262 1.00 0.00 C ATOM 788 C PRO A 56 2.088 14.433 1.036 1.00 0.00 C ATOM 789 O PRO A 56 2.001 13.289 1.484 1.00 0.00 O ATOM 790 CB PRO A 56 4.209 15.324 0.034 1.00 0.00 C ATOM 791 CG PRO A 56 3.995 16.795 -0.072 1.00 0.00 C ATOM 792 CD PRO A 56 2.945 16.986 -1.131 1.00 0.00 C ATOM 0 HA PRO A 56 2.889 13.747 -0.772 1.00 0.00 H new ATOM 0 HB2 PRO A 56 4.562 15.046 1.027 1.00 0.00 H new ATOM 0 HB3 PRO A 56 4.959 14.981 -0.678 1.00 0.00 H new ATOM 0 HG2 PRO A 56 3.668 17.211 0.881 1.00 0.00 H new ATOM 0 HG3 PRO A 56 4.919 17.305 -0.343 1.00 0.00 H new ATOM 0 HD2 PRO A 56 2.315 17.850 -0.921 1.00 0.00 H new ATOM 0 HD3 PRO A 56 3.390 17.147 -2.113 1.00 0.00 H new ATOM 800 N LEU A 57 1.546 15.487 1.636 1.00 0.00 N ATOM 801 CA LEU A 57 0.801 15.358 2.884 1.00 0.00 C ATOM 802 C LEU A 57 -0.324 14.337 2.743 1.00 0.00 C ATOM 803 O LEU A 57 -0.740 13.718 3.722 1.00 0.00 O ATOM 804 CB LEU A 57 0.226 16.713 3.300 1.00 0.00 C ATOM 805 CG LEU A 57 1.245 17.775 3.713 1.00 0.00 C ATOM 806 CD1 LEU A 57 0.570 19.129 3.873 1.00 0.00 C ATOM 807 CD2 LEU A 57 1.944 17.371 5.003 1.00 0.00 C ATOM 0 H LEU A 57 1.608 16.440 1.279 1.00 0.00 H new ATOM 0 HA LEU A 57 1.489 15.010 3.655 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.363 17.106 2.471 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.461 16.554 4.131 1.00 0.00 H new ATOM 0 HG LEU A 57 1.995 17.856 2.926 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.311 19.872 4.167 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.116 19.424 2.927 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -0.202 19.063 4.640 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.666 18.139 5.282 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.206 17.261 5.798 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.462 16.423 4.855 1.00 0.00 H new ATOM 819 N MET A 58 -0.811 14.165 1.518 1.00 0.00 N ATOM 820 CA MET A 58 -1.885 13.217 1.249 1.00 0.00 C ATOM 821 C MET A 58 -1.534 11.832 1.784 1.00 0.00 C ATOM 822 O MET A 58 -2.410 11.088 2.226 1.00 0.00 O ATOM 823 CB MET A 58 -2.163 13.141 -0.253 1.00 0.00 C ATOM 824 CG MET A 58 -3.520 12.545 -0.591 1.00 0.00 C ATOM 825 SD MET A 58 -4.107 13.036 -2.224 1.00 0.00 S ATOM 826 CE MET A 58 -4.719 14.684 -1.882 1.00 0.00 C ATOM 0 H MET A 58 -0.479 14.670 0.696 1.00 0.00 H new ATOM 0 HA MET A 58 -2.782 13.568 1.759 1.00 0.00 H new ATOM 0 HB2 MET A 58 -2.100 14.143 -0.677 1.00 0.00 H new ATOM 0 HB3 MET A 58 -1.385 12.544 -0.728 1.00 0.00 H new ATOM 0 HG2 MET A 58 -3.457 11.458 -0.544 1.00 0.00 H new ATOM 0 HG3 MET A 58 -4.246 12.855 0.160 1.00 0.00 H new ATOM 0 HE1 MET A 58 -5.543 14.914 -2.558 1.00 0.00 H new ATOM 0 HE2 MET A 58 -5.070 14.735 -0.851 1.00 0.00 H new ATOM 0 HE3 MET A 58 -3.917 15.408 -2.029 1.00 0.00 H new ATOM 836 N ILE A 59 -0.250 11.494 1.741 1.00 0.00 N ATOM 837 CA ILE A 59 0.215 10.199 2.222 1.00 0.00 C ATOM 838 C ILE A 59 0.807 10.313 3.623 1.00 0.00 C ATOM 839 O ILE A 59 1.484 11.290 3.944 1.00 0.00 O ATOM 840 CB ILE A 59 1.270 9.593 1.278 1.00 0.00 C ATOM 841 CG1 ILE A 59 0.781 9.645 -0.170 1.00 0.00 C ATOM 842 CG2 ILE A 59 1.587 8.162 1.686 1.00 0.00 C ATOM 843 CD1 ILE A 59 -0.534 8.928 -0.389 1.00 0.00 C ATOM 0 H ILE A 59 0.487 12.099 1.378 1.00 0.00 H new ATOM 0 HA ILE A 59 -0.654 9.542 2.250 1.00 0.00 H new ATOM 0 HB ILE A 59 2.184 10.182 1.353 1.00 0.00 H new ATOM 0 HG12 ILE A 59 0.672 10.687 -0.471 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.539 9.203 -0.817 1.00 0.00 H new ATOM 0 HG21 ILE A 59 2.334 7.748 1.009 1.00 0.00 H new ATOM 0 HG22 ILE A 59 1.975 8.151 2.705 1.00 0.00 H new ATOM 0 HG23 ILE A 59 0.680 7.560 1.637 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -0.820 9.005 -1.438 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -0.425 7.878 -0.119 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -1.305 9.384 0.232 1.00 0.00 H new ATOM 855 N SER A 60 0.548 9.307 4.452 1.00 0.00 N ATOM 856 CA SER A 60 1.054 9.295 5.820 1.00 0.00 C ATOM 857 C SER A 60 2.171 8.268 5.977 1.00 0.00 C ATOM 858 O SER A 60 2.424 7.468 5.077 1.00 0.00 O ATOM 859 CB SER A 60 -0.078 8.989 6.802 1.00 0.00 C ATOM 860 OG SER A 60 -0.732 10.177 7.214 1.00 0.00 O ATOM 0 H SER A 60 -0.009 8.490 4.201 1.00 0.00 H new ATOM 0 HA SER A 60 1.459 10.283 6.040 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.798 8.318 6.334 1.00 0.00 H new ATOM 0 HB3 SER A 60 0.322 8.470 7.673 1.00 0.00 H new ATOM 0 HG SER A 60 -1.452 9.954 7.840 1.00 0.00 H new ATOM 866 N ARG A 61 2.836 8.298 7.128 1.00 0.00 N ATOM 867 CA ARG A 61 3.927 7.371 7.403 1.00 0.00 C ATOM 868 C ARG A 61 3.488 5.929 7.168 1.00 0.00 C ATOM 869 O ARG A 61 4.182 5.158 6.506 1.00 0.00 O ATOM 870 CB ARG A 61 4.414 7.538 8.844 1.00 0.00 C ATOM 871 CG ARG A 61 5.400 8.681 9.025 1.00 0.00 C ATOM 872 CD ARG A 61 5.620 9.000 10.495 1.00 0.00 C ATOM 873 NE ARG A 61 6.227 7.882 11.212 1.00 0.00 N ATOM 874 CZ ARG A 61 7.492 7.509 11.056 1.00 0.00 C ATOM 875 NH1 ARG A 61 8.280 8.162 10.212 1.00 0.00 N ATOM 876 NH2 ARG A 61 7.973 6.482 11.744 1.00 0.00 N ATOM 0 H ARG A 61 2.638 8.954 7.884 1.00 0.00 H new ATOM 0 HA ARG A 61 4.745 7.599 6.720 1.00 0.00 H new ATOM 0 HB2 ARG A 61 3.554 7.705 9.492 1.00 0.00 H new ATOM 0 HB3 ARG A 61 4.883 6.610 9.170 1.00 0.00 H new ATOM 0 HG2 ARG A 61 6.351 8.419 8.562 1.00 0.00 H new ATOM 0 HG3 ARG A 61 5.029 9.568 8.511 1.00 0.00 H new ATOM 0 HD2 ARG A 61 6.260 9.878 10.584 1.00 0.00 H new ATOM 0 HD3 ARG A 61 4.666 9.253 10.958 1.00 0.00 H new ATOM 0 HE ARG A 61 5.648 7.359 11.869 1.00 0.00 H new ATOM 0 HH11 ARG A 61 7.915 8.953 9.681 1.00 0.00 H new ATOM 0 HH12 ARG A 61 9.251 7.874 10.094 1.00 0.00 H new ATOM 0 HH21 ARG A 61 7.371 5.977 12.394 1.00 0.00 H new ATOM 0 HH22 ARG A 61 8.945 6.197 11.623 1.00 0.00 H new ATOM 890 N ASN A 62 2.330 5.571 7.715 1.00 0.00 N ATOM 891 CA ASN A 62 1.799 4.221 7.565 1.00 0.00 C ATOM 892 C ASN A 62 0.409 4.250 6.936 1.00 0.00 C ATOM 893 O ASN A 62 -0.575 3.854 7.561 1.00 0.00 O ATOM 894 CB ASN A 62 1.741 3.520 8.924 1.00 0.00 C ATOM 895 CG ASN A 62 3.120 3.234 9.486 1.00 0.00 C ATOM 896 OD1 ASN A 62 3.527 3.819 10.491 1.00 0.00 O ATOM 897 ND2 ASN A 62 3.848 2.332 8.838 1.00 0.00 N ATOM 0 H ASN A 62 1.742 6.197 8.266 1.00 0.00 H new ATOM 0 HA ASN A 62 2.466 3.666 6.905 1.00 0.00 H new ATOM 0 HB2 ASN A 62 1.187 4.142 9.627 1.00 0.00 H new ATOM 0 HB3 ASN A 62 1.191 2.584 8.824 1.00 0.00 H new ATOM 0 HD21 ASN A 62 4.784 2.099 9.169 1.00 0.00 H new ATOM 0 HD22 ASN A 62 3.471 1.872 8.010 1.00 0.00 H new ATOM 904 N HIS A 63 0.337 4.722 5.695 1.00 0.00 N ATOM 905 CA HIS A 63 -0.932 4.802 4.980 1.00 0.00 C ATOM 906 C HIS A 63 -1.656 3.459 5.008 1.00 0.00 C ATOM 907 O HIS A 63 -2.818 3.378 5.408 1.00 0.00 O ATOM 908 CB HIS A 63 -0.699 5.239 3.534 1.00 0.00 C ATOM 909 CG HIS A 63 -1.818 6.059 2.969 1.00 0.00 C ATOM 910 ND1 HIS A 63 -1.817 7.438 2.973 1.00 0.00 N ATOM 911 CD2 HIS A 63 -2.978 5.687 2.378 1.00 0.00 C ATOM 912 CE1 HIS A 63 -2.929 7.878 2.411 1.00 0.00 C ATOM 913 NE2 HIS A 63 -3.650 6.836 2.041 1.00 0.00 N ATOM 0 H HIS A 63 1.142 5.055 5.164 1.00 0.00 H new ATOM 0 HA HIS A 63 -1.557 5.542 5.479 1.00 0.00 H new ATOM 0 HB2 HIS A 63 0.225 5.815 3.481 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -0.559 4.354 2.914 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -3.312 4.675 2.204 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -3.202 8.914 2.277 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -4.559 6.878 1.580 1.00 0.00 H new ATOM 921 N CYS A 64 -0.964 2.410 4.581 1.00 0.00 N ATOM 922 CA CYS A 64 -1.542 1.071 4.555 1.00 0.00 C ATOM 923 C CYS A 64 -0.463 0.009 4.739 1.00 0.00 C ATOM 924 O CYS A 64 0.722 0.270 4.530 1.00 0.00 O ATOM 925 CB CYS A 64 -2.284 0.838 3.238 1.00 0.00 C ATOM 926 SG CYS A 64 -1.219 0.856 1.778 1.00 0.00 S ATOM 0 H CYS A 64 -0.001 2.460 4.248 1.00 0.00 H new ATOM 0 HA CYS A 64 -2.249 0.992 5.381 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -2.798 -0.122 3.288 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -3.051 1.604 3.125 1.00 0.00 H new ATOM 0 HG CYS A 64 -1.937 0.648 0.714 1.00 0.00 H new ATOM 932 N VAL A 65 -0.880 -1.190 5.134 1.00 0.00 N ATOM 933 CA VAL A 65 0.050 -2.292 5.347 1.00 0.00 C ATOM 934 C VAL A 65 -0.478 -3.584 4.734 1.00 0.00 C ATOM 935 O VAL A 65 -1.466 -4.149 5.204 1.00 0.00 O ATOM 936 CB VAL A 65 0.316 -2.520 6.847 1.00 0.00 C ATOM 937 CG1 VAL A 65 1.306 -3.657 7.047 1.00 0.00 C ATOM 938 CG2 VAL A 65 0.821 -1.241 7.498 1.00 0.00 C ATOM 0 H VAL A 65 -1.857 -1.423 5.313 1.00 0.00 H new ATOM 0 HA VAL A 65 0.984 -2.016 4.857 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.622 -2.799 7.327 1.00 0.00 H new ATOM 0 HG11 VAL A 65 1.482 -3.803 8.113 1.00 0.00 H new ATOM 0 HG12 VAL A 65 0.900 -4.573 6.617 1.00 0.00 H new ATOM 0 HG13 VAL A 65 2.247 -3.411 6.555 1.00 0.00 H new ATOM 0 HG21 VAL A 65 1.004 -1.420 8.558 1.00 0.00 H new ATOM 0 HG22 VAL A 65 1.748 -0.930 7.017 1.00 0.00 H new ATOM 0 HG23 VAL A 65 0.073 -0.456 7.386 1.00 0.00 H new ATOM 948 N LEU A 66 0.187 -4.047 3.681 1.00 0.00 N ATOM 949 CA LEU A 66 -0.214 -5.274 3.002 1.00 0.00 C ATOM 950 C LEU A 66 0.482 -6.487 3.612 1.00 0.00 C ATOM 951 O LEU A 66 1.651 -6.419 3.992 1.00 0.00 O ATOM 952 CB LEU A 66 0.108 -5.184 1.510 1.00 0.00 C ATOM 953 CG LEU A 66 -0.793 -4.266 0.683 1.00 0.00 C ATOM 954 CD1 LEU A 66 -0.027 -3.032 0.231 1.00 0.00 C ATOM 955 CD2 LEU A 66 -1.360 -5.013 -0.516 1.00 0.00 C ATOM 0 H LEU A 66 1.006 -3.591 3.279 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.290 -5.394 3.128 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.138 -4.844 1.401 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.057 -6.187 1.087 1.00 0.00 H new ATOM 0 HG LEU A 66 -1.624 -3.943 1.310 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.684 -2.391 -0.356 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.329 -2.485 1.104 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.824 -3.335 -0.379 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -1.999 -4.344 -1.093 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.542 -5.366 -1.145 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.945 -5.865 -0.170 1.00 0.00 H new ATOM 967 N LYS A 67 -0.243 -7.597 3.700 1.00 0.00 N ATOM 968 CA LYS A 67 0.305 -8.827 4.260 1.00 0.00 C ATOM 969 C LYS A 67 -0.659 -9.992 4.059 1.00 0.00 C ATOM 970 O LYS A 67 -1.871 -9.798 3.968 1.00 0.00 O ATOM 971 CB LYS A 67 0.599 -8.646 5.751 1.00 0.00 C ATOM 972 CG LYS A 67 -0.631 -8.317 6.579 1.00 0.00 C ATOM 973 CD LYS A 67 -0.384 -7.134 7.499 1.00 0.00 C ATOM 974 CE LYS A 67 -0.012 -7.588 8.903 1.00 0.00 C ATOM 975 NZ LYS A 67 -0.549 -6.669 9.944 1.00 0.00 N ATOM 0 H LYS A 67 -1.212 -7.670 3.390 1.00 0.00 H new ATOM 0 HA LYS A 67 1.235 -9.053 3.737 1.00 0.00 H new ATOM 0 HB2 LYS A 67 1.052 -9.559 6.137 1.00 0.00 H new ATOM 0 HB3 LYS A 67 1.333 -7.849 5.874 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -1.468 -8.095 5.917 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -0.915 -9.187 7.172 1.00 0.00 H new ATOM 0 HD2 LYS A 67 0.416 -6.516 7.092 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -1.278 -6.512 7.541 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -0.396 -8.594 9.073 1.00 0.00 H new ATOM 0 HE3 LYS A 67 1.073 -7.642 8.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -0.274 -7.013 10.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -0.162 -5.715 9.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -1.586 -6.636 9.877 1.00 0.00 H new ATOM 989 N GLN A 68 -0.112 -11.202 3.992 1.00 0.00 N ATOM 990 CA GLN A 68 -0.924 -12.398 3.803 1.00 0.00 C ATOM 991 C GLN A 68 -1.372 -12.969 5.144 1.00 0.00 C ATOM 992 O GLN A 68 -0.551 -13.402 5.951 1.00 0.00 O ATOM 993 CB GLN A 68 -0.141 -13.454 3.022 1.00 0.00 C ATOM 994 CG GLN A 68 0.233 -13.016 1.615 1.00 0.00 C ATOM 995 CD GLN A 68 1.004 -14.080 0.858 1.00 0.00 C ATOM 996 OE1 GLN A 68 2.121 -14.438 1.233 1.00 0.00 O ATOM 997 NE2 GLN A 68 0.410 -14.593 -0.213 1.00 0.00 N ATOM 0 H GLN A 68 0.890 -11.380 4.066 1.00 0.00 H new ATOM 0 HA GLN A 68 -1.810 -12.118 3.233 1.00 0.00 H new ATOM 0 HB2 GLN A 68 0.768 -13.700 3.571 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -0.735 -14.366 2.964 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -0.673 -12.768 1.063 1.00 0.00 H new ATOM 0 HG3 GLN A 68 0.833 -12.107 1.669 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -0.517 -14.267 -0.488 1.00 0.00 H new ATOM 0 HE22 GLN A 68 0.880 -15.313 -0.761 1.00 0.00 H new ATOM 1006 N ASN A 69 -2.681 -12.966 5.376 1.00 0.00 N ATOM 1007 CA ASN A 69 -3.239 -13.483 6.620 1.00 0.00 C ATOM 1008 C ASN A 69 -2.714 -14.886 6.909 1.00 0.00 C ATOM 1009 O ASN A 69 -2.223 -15.587 6.024 1.00 0.00 O ATOM 1010 CB ASN A 69 -4.767 -13.503 6.549 1.00 0.00 C ATOM 1011 CG ASN A 69 -5.278 -14.170 5.287 1.00 0.00 C ATOM 1012 OD1 ASN A 69 -4.743 -15.188 4.848 1.00 0.00 O ATOM 1013 ND2 ASN A 69 -6.320 -13.596 4.696 1.00 0.00 N ATOM 0 H ASN A 69 -3.375 -12.611 4.718 1.00 0.00 H new ATOM 0 HA ASN A 69 -2.929 -12.823 7.430 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -5.162 -14.027 7.419 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -5.144 -12.481 6.595 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -6.708 -13.999 3.843 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -6.732 -12.753 5.095 1.00 0.00 H new ATOM 1020 N PRO A 70 -2.819 -15.307 8.179 1.00 0.00 N ATOM 1021 CA PRO A 70 -2.361 -16.630 8.614 1.00 0.00 C ATOM 1022 C PRO A 70 -2.874 -17.747 7.712 1.00 0.00 C ATOM 1023 O PRO A 70 -2.249 -18.801 7.598 1.00 0.00 O ATOM 1024 CB PRO A 70 -2.952 -16.765 10.020 1.00 0.00 C ATOM 1025 CG PRO A 70 -3.097 -15.364 10.506 1.00 0.00 C ATOM 1026 CD PRO A 70 -3.393 -14.525 9.286 1.00 0.00 C ATOM 0 HA PRO A 70 -1.275 -16.716 8.583 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -3.914 -17.278 9.998 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -2.297 -17.344 10.671 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -3.902 -15.287 11.237 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -2.185 -15.026 10.999 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -4.464 -14.372 9.155 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -2.936 -13.538 9.358 1.00 0.00 H new ATOM 1034 N GLU A 71 -4.015 -17.509 7.073 1.00 0.00 N ATOM 1035 CA GLU A 71 -4.611 -18.496 6.181 1.00 0.00 C ATOM 1036 C GLU A 71 -3.741 -18.710 4.946 1.00 0.00 C ATOM 1037 O GLU A 71 -3.584 -19.833 4.470 1.00 0.00 O ATOM 1038 CB GLU A 71 -6.014 -18.055 5.759 1.00 0.00 C ATOM 1039 CG GLU A 71 -6.893 -17.627 6.922 1.00 0.00 C ATOM 1040 CD GLU A 71 -8.370 -17.832 6.644 1.00 0.00 C ATOM 1041 OE1 GLU A 71 -8.901 -17.166 5.732 1.00 0.00 O ATOM 1042 OE2 GLU A 71 -8.994 -18.661 7.340 1.00 0.00 O ATOM 0 H GLU A 71 -4.545 -16.641 7.157 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.682 -19.439 6.722 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -5.929 -17.227 5.055 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -6.500 -18.875 5.230 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -6.613 -18.192 7.811 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -6.711 -16.575 7.142 1.00 0.00 H new ATOM 1049 N GLY A 72 -3.176 -17.621 4.432 1.00 0.00 N ATOM 1050 CA GLY A 72 -2.329 -17.710 3.257 1.00 0.00 C ATOM 1051 C GLY A 72 -2.853 -16.882 2.100 1.00 0.00 C ATOM 1052 O GLY A 72 -2.502 -17.126 0.946 1.00 0.00 O ATOM 0 H GLY A 72 -3.290 -16.680 4.808 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -1.323 -17.377 3.512 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -2.251 -18.752 2.948 1.00 0.00 H new ATOM 1056 N GLN A 73 -3.698 -15.904 2.410 1.00 0.00 N ATOM 1057 CA GLN A 73 -4.274 -15.040 1.386 1.00 0.00 C ATOM 1058 C GLN A 73 -3.915 -13.580 1.641 1.00 0.00 C ATOM 1059 O GLN A 73 -3.962 -13.108 2.777 1.00 0.00 O ATOM 1060 CB GLN A 73 -5.794 -15.205 1.346 1.00 0.00 C ATOM 1061 CG GLN A 73 -6.494 -14.179 0.469 1.00 0.00 C ATOM 1062 CD GLN A 73 -6.005 -14.207 -0.966 1.00 0.00 C ATOM 1063 OE1 GLN A 73 -5.674 -15.265 -1.501 1.00 0.00 O ATOM 1064 NE2 GLN A 73 -5.957 -13.040 -1.598 1.00 0.00 N ATOM 0 H GLN A 73 -3.999 -15.690 3.361 1.00 0.00 H new ATOM 0 HA GLN A 73 -3.859 -15.334 0.422 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -6.033 -16.205 0.983 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -6.186 -15.132 2.360 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -7.568 -14.364 0.486 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -6.335 -13.183 0.884 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -6.241 -12.187 -1.116 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -5.636 -12.997 -2.565 1.00 0.00 H new ATOM 1073 N TRP A 74 -3.556 -12.870 0.577 1.00 0.00 N ATOM 1074 CA TRP A 74 -3.189 -11.463 0.687 1.00 0.00 C ATOM 1075 C TRP A 74 -4.359 -10.633 1.202 1.00 0.00 C ATOM 1076 O TRP A 74 -5.505 -10.840 0.800 1.00 0.00 O ATOM 1077 CB TRP A 74 -2.727 -10.928 -0.670 1.00 0.00 C ATOM 1078 CG TRP A 74 -1.265 -11.139 -0.925 1.00 0.00 C ATOM 1079 CD1 TRP A 74 -0.706 -12.006 -1.819 1.00 0.00 C ATOM 1080 CD2 TRP A 74 -0.177 -10.471 -0.277 1.00 0.00 C ATOM 1081 NE1 TRP A 74 0.665 -11.918 -1.766 1.00 0.00 N ATOM 1082 CE2 TRP A 74 1.014 -10.983 -0.828 1.00 0.00 C ATOM 1083 CE3 TRP A 74 -0.093 -9.490 0.714 1.00 0.00 C ATOM 1084 CZ2 TRP A 74 2.271 -10.546 -0.420 1.00 0.00 C ATOM 1085 CZ3 TRP A 74 1.156 -9.057 1.119 1.00 0.00 C ATOM 1086 CH2 TRP A 74 2.324 -9.584 0.552 1.00 0.00 C ATOM 0 H TRP A 74 -3.511 -13.245 -0.370 1.00 0.00 H new ATOM 0 HA TRP A 74 -2.369 -11.382 1.401 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -3.300 -11.415 -1.459 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -2.948 -9.862 -0.727 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -1.259 -12.664 -2.472 1.00 0.00 H new ATOM 0 HE1 TRP A 74 1.316 -12.461 -2.333 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -0.988 -9.077 1.156 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 3.172 -10.952 -0.855 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 1.233 -8.300 1.885 1.00 0.00 H new ATOM 0 HH2 TRP A 74 3.285 -9.224 0.889 1.00 0.00 H new ATOM 1097 N THR A 75 -4.065 -9.692 2.094 1.00 0.00 N ATOM 1098 CA THR A 75 -5.094 -8.832 2.665 1.00 0.00 C ATOM 1099 C THR A 75 -4.526 -7.466 3.034 1.00 0.00 C ATOM 1100 O THR A 75 -3.579 -7.368 3.815 1.00 0.00 O ATOM 1101 CB THR A 75 -5.727 -9.467 3.917 1.00 0.00 C ATOM 1102 OG1 THR A 75 -4.718 -9.718 4.902 1.00 0.00 O ATOM 1103 CG2 THR A 75 -6.433 -10.768 3.565 1.00 0.00 C ATOM 0 H THR A 75 -3.122 -9.506 2.437 1.00 0.00 H new ATOM 0 HA THR A 75 -5.862 -8.709 1.902 1.00 0.00 H new ATOM 0 HB THR A 75 -6.462 -8.770 4.319 1.00 0.00 H new ATOM 0 HG1 THR A 75 -3.833 -9.564 4.510 1.00 0.00 H new ATOM 0 HG21 THR A 75 -6.872 -11.198 4.465 1.00 0.00 H new ATOM 0 HG22 THR A 75 -7.219 -10.570 2.836 1.00 0.00 H new ATOM 0 HG23 THR A 75 -5.714 -11.469 3.141 1.00 0.00 H new ATOM 1111 N ILE A 76 -5.110 -6.415 2.468 1.00 0.00 N ATOM 1112 CA ILE A 76 -4.662 -5.055 2.740 1.00 0.00 C ATOM 1113 C ILE A 76 -5.354 -4.485 3.974 1.00 0.00 C ATOM 1114 O ILE A 76 -6.581 -4.484 4.064 1.00 0.00 O ATOM 1115 CB ILE A 76 -4.926 -4.125 1.542 1.00 0.00 C ATOM 1116 CG1 ILE A 76 -4.440 -2.707 1.851 1.00 0.00 C ATOM 1117 CG2 ILE A 76 -6.407 -4.118 1.192 1.00 0.00 C ATOM 1118 CD1 ILE A 76 -4.082 -1.908 0.617 1.00 0.00 C ATOM 0 H ILE A 76 -5.894 -6.479 1.819 1.00 0.00 H new ATOM 0 HA ILE A 76 -3.588 -5.106 2.919 1.00 0.00 H new ATOM 0 HB ILE A 76 -4.371 -4.500 0.682 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -5.216 -2.178 2.404 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -3.568 -2.764 2.502 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -6.577 -3.456 0.343 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -6.725 -5.128 0.934 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -6.982 -3.765 2.048 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -3.746 -0.914 0.912 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -3.284 -2.415 0.074 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -4.958 -1.819 -0.026 1.00 0.00 H new ATOM 1130 N MET A 77 -4.558 -3.999 4.921 1.00 0.00 N ATOM 1131 CA MET A 77 -5.094 -3.422 6.148 1.00 0.00 C ATOM 1132 C MET A 77 -4.494 -2.044 6.409 1.00 0.00 C ATOM 1133 O MET A 77 -3.280 -1.903 6.554 1.00 0.00 O ATOM 1134 CB MET A 77 -4.816 -4.346 7.335 1.00 0.00 C ATOM 1135 CG MET A 77 -5.334 -3.808 8.659 1.00 0.00 C ATOM 1136 SD MET A 77 -4.143 -3.996 9.999 1.00 0.00 S ATOM 1137 CE MET A 77 -3.103 -2.563 9.731 1.00 0.00 C ATOM 0 H MET A 77 -3.540 -3.993 4.862 1.00 0.00 H new ATOM 0 HA MET A 77 -6.172 -3.312 6.027 1.00 0.00 H new ATOM 0 HB2 MET A 77 -5.272 -5.317 7.143 1.00 0.00 H new ATOM 0 HB3 MET A 77 -3.741 -4.509 7.414 1.00 0.00 H new ATOM 0 HG2 MET A 77 -5.584 -2.753 8.545 1.00 0.00 H new ATOM 0 HG3 MET A 77 -6.256 -4.327 8.922 1.00 0.00 H new ATOM 0 HE1 MET A 77 -2.119 -2.886 9.390 1.00 0.00 H new ATOM 0 HE2 MET A 77 -3.556 -1.921 8.976 1.00 0.00 H new ATOM 0 HE3 MET A 77 -3.000 -2.009 10.664 1.00 0.00 H new ATOM 1147 N ASP A 78 -5.352 -1.032 6.467 1.00 0.00 N ATOM 1148 CA ASP A 78 -4.906 0.335 6.712 1.00 0.00 C ATOM 1149 C ASP A 78 -4.482 0.516 8.166 1.00 0.00 C ATOM 1150 O ASP A 78 -5.088 -0.050 9.075 1.00 0.00 O ATOM 1151 CB ASP A 78 -6.018 1.326 6.365 1.00 0.00 C ATOM 1152 CG ASP A 78 -7.357 0.922 6.948 1.00 0.00 C ATOM 1153 OD1 ASP A 78 -7.374 0.071 7.862 1.00 0.00 O ATOM 1154 OD2 ASP A 78 -8.390 1.456 6.491 1.00 0.00 O ATOM 0 H ASP A 78 -6.360 -1.132 6.348 1.00 0.00 H new ATOM 0 HA ASP A 78 -4.044 0.530 6.074 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -5.748 2.315 6.735 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.106 1.404 5.281 1.00 0.00 H new ATOM 1159 N ASN A 79 -3.436 1.309 8.377 1.00 0.00 N ATOM 1160 CA ASN A 79 -2.929 1.563 9.721 1.00 0.00 C ATOM 1161 C ASN A 79 -3.432 2.903 10.247 1.00 0.00 C ATOM 1162 O ASN A 79 -2.652 3.831 10.464 1.00 0.00 O ATOM 1163 CB ASN A 79 -1.399 1.544 9.723 1.00 0.00 C ATOM 1164 CG ASN A 79 -0.827 1.185 11.082 1.00 0.00 C ATOM 1165 OD1 ASN A 79 -1.521 1.252 12.096 1.00 0.00 O ATOM 1166 ND2 ASN A 79 0.444 0.803 11.106 1.00 0.00 N ATOM 0 H ASN A 79 -2.924 1.786 7.635 1.00 0.00 H new ATOM 0 HA ASN A 79 -3.297 0.774 10.377 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -1.046 0.826 8.982 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -1.026 2.523 9.422 1.00 0.00 H new ATOM 0 HD21 ASN A 79 0.884 0.550 11.991 1.00 0.00 H new ATOM 0 HD22 ASN A 79 0.981 0.762 10.240 1.00 0.00 H new ATOM 1173 N LYS A 80 -4.742 2.998 10.453 1.00 0.00 N ATOM 1174 CA LYS A 80 -5.351 4.223 10.956 1.00 0.00 C ATOM 1175 C LYS A 80 -4.930 5.425 10.116 1.00 0.00 C ATOM 1176 O LYS A 80 -4.295 6.352 10.618 1.00 0.00 O ATOM 1177 CB LYS A 80 -4.962 4.447 12.419 1.00 0.00 C ATOM 1178 CG LYS A 80 -5.853 3.712 13.405 1.00 0.00 C ATOM 1179 CD LYS A 80 -5.972 4.467 14.718 1.00 0.00 C ATOM 1180 CE LYS A 80 -4.745 4.261 15.593 1.00 0.00 C ATOM 1181 NZ LYS A 80 -3.634 5.177 15.214 1.00 0.00 N ATOM 0 H LYS A 80 -5.402 2.240 10.279 1.00 0.00 H new ATOM 0 HA LYS A 80 -6.434 4.116 10.887 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -3.931 4.126 12.565 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.997 5.515 12.636 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -6.844 3.577 12.971 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -5.448 2.717 13.591 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -6.102 5.530 14.517 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -6.861 4.132 15.252 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -5.012 4.426 16.637 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -4.408 3.228 15.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -3.030 5.352 16.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -3.067 4.741 14.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -4.027 6.078 14.876 1.00 0.00 H new ATOM 1195 N SER A 81 -5.288 5.403 8.837 1.00 0.00 N ATOM 1196 CA SER A 81 -4.945 6.490 7.927 1.00 0.00 C ATOM 1197 C SER A 81 -5.753 7.743 8.250 1.00 0.00 C ATOM 1198 O SER A 81 -6.894 7.660 8.706 1.00 0.00 O ATOM 1199 CB SER A 81 -5.193 6.068 6.478 1.00 0.00 C ATOM 1200 OG SER A 81 -6.366 5.280 6.370 1.00 0.00 O ATOM 0 H SER A 81 -5.816 4.644 8.406 1.00 0.00 H new ATOM 0 HA SER A 81 -3.887 6.718 8.055 1.00 0.00 H new ATOM 0 HB2 SER A 81 -5.287 6.953 5.849 1.00 0.00 H new ATOM 0 HB3 SER A 81 -4.337 5.504 6.109 1.00 0.00 H new ATOM 0 HG SER A 81 -7.106 5.731 6.827 1.00 0.00 H new ATOM 1206 N LEU A 82 -5.153 8.904 8.009 1.00 0.00 N ATOM 1207 CA LEU A 82 -5.815 10.176 8.273 1.00 0.00 C ATOM 1208 C LEU A 82 -6.814 10.510 7.169 1.00 0.00 C ATOM 1209 O LEU A 82 -7.987 10.767 7.437 1.00 0.00 O ATOM 1210 CB LEU A 82 -4.781 11.296 8.396 1.00 0.00 C ATOM 1211 CG LEU A 82 -5.338 12.715 8.516 1.00 0.00 C ATOM 1212 CD1 LEU A 82 -5.968 12.928 9.884 1.00 0.00 C ATOM 1213 CD2 LEU A 82 -4.243 13.742 8.265 1.00 0.00 C ATOM 0 H LEU A 82 -4.209 8.990 7.631 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.358 10.086 9.214 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -4.161 11.096 9.270 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -4.127 11.257 7.525 1.00 0.00 H new ATOM 0 HG LEU A 82 -6.111 12.846 7.759 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -6.359 13.943 9.951 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -6.781 12.216 10.025 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -5.216 12.777 10.658 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -4.658 14.746 8.355 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -3.447 13.612 8.998 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -3.839 13.605 7.262 1.00 0.00 H new ATOM 1225 N ASN A 83 -6.340 10.501 5.927 1.00 0.00 N ATOM 1226 CA ASN A 83 -7.192 10.801 4.782 1.00 0.00 C ATOM 1227 C ASN A 83 -8.204 9.684 4.549 1.00 0.00 C ATOM 1228 O ASN A 83 -9.372 9.940 4.261 1.00 0.00 O ATOM 1229 CB ASN A 83 -6.341 11.004 3.527 1.00 0.00 C ATOM 1230 CG ASN A 83 -5.705 12.380 3.476 1.00 0.00 C ATOM 1231 OD1 ASN A 83 -6.284 13.324 2.939 1.00 0.00 O ATOM 1232 ND2 ASN A 83 -4.507 12.499 4.035 1.00 0.00 N ATOM 0 H ASN A 83 -5.371 10.289 5.688 1.00 0.00 H new ATOM 0 HA ASN A 83 -7.737 11.721 4.997 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -5.560 10.244 3.494 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -6.962 10.861 2.643 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -4.029 13.400 4.030 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -4.064 11.689 4.469 1.00 0.00 H new ATOM 1239 N GLY A 84 -7.746 8.442 4.678 1.00 0.00 N ATOM 1240 CA GLY A 84 -8.624 7.303 4.479 1.00 0.00 C ATOM 1241 C GLY A 84 -8.256 6.496 3.250 1.00 0.00 C ATOM 1242 O GLY A 84 -7.814 7.050 2.243 1.00 0.00 O ATOM 0 H GLY A 84 -6.783 8.204 4.917 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -8.584 6.659 5.358 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.652 7.652 4.386 1.00 0.00 H new ATOM 1246 N VAL A 85 -8.438 5.182 3.331 1.00 0.00 N ATOM 1247 CA VAL A 85 -8.122 4.296 2.217 1.00 0.00 C ATOM 1248 C VAL A 85 -9.383 3.890 1.462 1.00 0.00 C ATOM 1249 O VAL A 85 -10.436 3.678 2.063 1.00 0.00 O ATOM 1250 CB VAL A 85 -7.394 3.027 2.698 1.00 0.00 C ATOM 1251 CG1 VAL A 85 -6.878 2.225 1.513 1.00 0.00 C ATOM 1252 CG2 VAL A 85 -6.257 3.390 3.642 1.00 0.00 C ATOM 0 H VAL A 85 -8.803 4.707 4.157 1.00 0.00 H new ATOM 0 HA VAL A 85 -7.465 4.851 1.548 1.00 0.00 H new ATOM 0 HB VAL A 85 -8.105 2.407 3.244 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -6.367 1.332 1.873 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -7.715 1.933 0.879 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -6.182 2.834 0.937 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -5.754 2.481 3.972 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -5.544 4.032 3.124 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -6.657 3.918 4.508 1.00 0.00 H new ATOM 1262 N TRP A 86 -9.267 3.784 0.144 1.00 0.00 N ATOM 1263 CA TRP A 86 -10.399 3.403 -0.694 1.00 0.00 C ATOM 1264 C TRP A 86 -10.067 2.172 -1.531 1.00 0.00 C ATOM 1265 O TRP A 86 -8.946 2.025 -2.019 1.00 0.00 O ATOM 1266 CB TRP A 86 -10.797 4.563 -1.607 1.00 0.00 C ATOM 1267 CG TRP A 86 -11.004 5.853 -0.873 1.00 0.00 C ATOM 1268 CD1 TRP A 86 -10.058 6.796 -0.589 1.00 0.00 C ATOM 1269 CD2 TRP A 86 -12.235 6.341 -0.327 1.00 0.00 C ATOM 1270 NE1 TRP A 86 -10.626 7.840 0.100 1.00 0.00 N ATOM 1271 CE2 TRP A 86 -11.961 7.586 0.272 1.00 0.00 C ATOM 1272 CE3 TRP A 86 -13.542 5.848 -0.289 1.00 0.00 C ATOM 1273 CZ2 TRP A 86 -12.946 8.341 0.903 1.00 0.00 C ATOM 1274 CZ3 TRP A 86 -14.519 6.599 0.338 1.00 0.00 C ATOM 1275 CH2 TRP A 86 -14.217 7.834 0.926 1.00 0.00 C ATOM 0 H TRP A 86 -8.402 3.956 -0.368 1.00 0.00 H new ATOM 0 HA TRP A 86 -11.237 3.160 -0.041 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -10.024 4.703 -2.362 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -11.714 4.302 -2.135 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -9.016 6.731 -0.866 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -10.133 8.670 0.430 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -13.785 4.898 -0.741 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -12.715 9.293 1.358 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -15.532 6.227 0.375 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -15.003 8.397 1.407 1.00 0.00 H new ATOM 1286 N LEU A 87 -11.047 1.290 -1.693 1.00 0.00 N ATOM 1287 CA LEU A 87 -10.858 0.071 -2.471 1.00 0.00 C ATOM 1288 C LEU A 87 -12.107 -0.255 -3.284 1.00 0.00 C ATOM 1289 O LEU A 87 -13.115 -0.702 -2.739 1.00 0.00 O ATOM 1290 CB LEU A 87 -10.517 -1.100 -1.548 1.00 0.00 C ATOM 1291 CG LEU A 87 -10.431 -2.475 -2.212 1.00 0.00 C ATOM 1292 CD1 LEU A 87 -9.121 -2.620 -2.970 1.00 0.00 C ATOM 1293 CD2 LEU A 87 -10.573 -3.578 -1.173 1.00 0.00 C ATOM 0 H LEU A 87 -11.981 1.396 -1.296 1.00 0.00 H new ATOM 0 HA LEU A 87 -10.030 0.235 -3.161 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.562 -0.891 -1.066 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -11.268 -1.146 -0.759 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.251 -2.566 -2.924 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.077 -3.604 -3.436 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -9.059 -1.851 -3.740 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.286 -2.509 -2.278 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.509 -4.550 -1.663 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -9.774 -3.490 -0.437 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.538 -3.486 -0.674 1.00 0.00 H new ATOM 1305 N ASN A 88 -12.032 -0.029 -4.591 1.00 0.00 N ATOM 1306 CA ASN A 88 -13.157 -0.300 -5.480 1.00 0.00 C ATOM 1307 C ASN A 88 -14.351 0.582 -5.130 1.00 0.00 C ATOM 1308 O ASN A 88 -15.482 0.105 -5.035 1.00 0.00 O ATOM 1309 CB ASN A 88 -13.555 -1.775 -5.396 1.00 0.00 C ATOM 1310 CG ASN A 88 -12.359 -2.703 -5.477 1.00 0.00 C ATOM 1311 OD1 ASN A 88 -11.285 -2.311 -5.934 1.00 0.00 O ATOM 1312 ND2 ASN A 88 -12.540 -3.941 -5.033 1.00 0.00 N ATOM 0 H ASN A 88 -11.205 0.341 -5.059 1.00 0.00 H new ATOM 0 HA ASN A 88 -12.847 -0.072 -6.500 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -14.086 -1.952 -4.461 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -14.247 -2.008 -6.205 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -11.771 -4.611 -5.062 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -13.448 -4.222 -4.662 1.00 0.00 H new ATOM 1319 N ARG A 89 -14.092 1.872 -4.941 1.00 0.00 N ATOM 1320 CA ARG A 89 -15.146 2.821 -4.602 1.00 0.00 C ATOM 1321 C ARG A 89 -15.806 2.449 -3.278 1.00 0.00 C ATOM 1322 O ARG A 89 -17.027 2.518 -3.141 1.00 0.00 O ATOM 1323 CB ARG A 89 -16.196 2.868 -5.713 1.00 0.00 C ATOM 1324 CG ARG A 89 -15.606 3.051 -7.102 1.00 0.00 C ATOM 1325 CD ARG A 89 -14.811 4.343 -7.204 1.00 0.00 C ATOM 1326 NE ARG A 89 -14.113 4.457 -8.482 1.00 0.00 N ATOM 1327 CZ ARG A 89 -13.240 5.419 -8.759 1.00 0.00 C ATOM 1328 NH1 ARG A 89 -12.958 6.344 -7.853 1.00 0.00 N ATOM 1329 NH2 ARG A 89 -12.646 5.455 -9.945 1.00 0.00 N ATOM 0 H ARG A 89 -13.162 2.284 -5.017 1.00 0.00 H new ATOM 0 HA ARG A 89 -14.693 3.807 -4.498 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -16.776 1.945 -5.693 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -16.889 3.685 -5.512 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -14.960 2.205 -7.338 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -16.407 3.056 -7.841 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -15.483 5.193 -7.081 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -14.087 4.388 -6.390 1.00 0.00 H new ATOM 0 HE ARG A 89 -14.307 3.760 -9.201 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -13.412 6.319 -6.940 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -12.287 7.081 -8.069 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -12.860 4.744 -10.644 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -11.976 6.194 -10.157 1.00 0.00 H new ATOM 1343 N ALA A 90 -14.991 2.055 -2.306 1.00 0.00 N ATOM 1344 CA ALA A 90 -15.495 1.674 -0.993 1.00 0.00 C ATOM 1345 C ALA A 90 -14.610 2.227 0.118 1.00 0.00 C ATOM 1346 O ALA A 90 -13.413 2.440 -0.077 1.00 0.00 O ATOM 1347 CB ALA A 90 -15.596 0.159 -0.885 1.00 0.00 C ATOM 0 H ALA A 90 -13.978 1.991 -2.403 1.00 0.00 H new ATOM 0 HA ALA A 90 -16.490 2.103 -0.876 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -15.974 -0.111 0.101 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -16.277 -0.216 -1.650 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -14.610 -0.283 -1.029 1.00 0.00 H new ATOM 1353 N ARG A 91 -15.205 2.459 1.284 1.00 0.00 N ATOM 1354 CA ARG A 91 -14.470 2.991 2.425 1.00 0.00 C ATOM 1355 C ARG A 91 -13.861 1.862 3.252 1.00 0.00 C ATOM 1356 O ARG A 91 -14.562 0.948 3.687 1.00 0.00 O ATOM 1357 CB ARG A 91 -15.391 3.840 3.302 1.00 0.00 C ATOM 1358 CG ARG A 91 -14.660 4.600 4.397 1.00 0.00 C ATOM 1359 CD ARG A 91 -14.136 5.936 3.893 1.00 0.00 C ATOM 1360 NE ARG A 91 -13.257 6.580 4.865 1.00 0.00 N ATOM 1361 CZ ARG A 91 -13.699 7.282 5.903 1.00 0.00 C ATOM 1362 NH1 ARG A 91 -15.002 7.427 6.103 1.00 0.00 N ATOM 1363 NH2 ARG A 91 -12.837 7.838 6.744 1.00 0.00 N ATOM 0 H ARG A 91 -16.194 2.287 1.463 1.00 0.00 H new ATOM 0 HA ARG A 91 -13.663 3.618 2.046 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -15.924 4.552 2.672 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -16.141 3.194 3.758 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -15.333 4.766 5.238 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -13.830 3.998 4.767 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -13.595 5.784 2.959 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -14.976 6.595 3.671 1.00 0.00 H new ATOM 0 HE ARG A 91 -12.249 6.486 4.740 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -15.668 6.999 5.459 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -15.339 7.966 6.901 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -11.834 7.727 6.594 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -13.177 8.377 7.541 1.00 0.00 H new ATOM 1377 N LEU A 92 -12.551 1.933 3.466 1.00 0.00 N ATOM 1378 CA LEU A 92 -11.847 0.917 4.240 1.00 0.00 C ATOM 1379 C LEU A 92 -11.585 1.402 5.663 1.00 0.00 C ATOM 1380 O LEU A 92 -10.778 2.305 5.881 1.00 0.00 O ATOM 1381 CB LEU A 92 -10.525 0.555 3.561 1.00 0.00 C ATOM 1382 CG LEU A 92 -10.628 0.036 2.126 1.00 0.00 C ATOM 1383 CD1 LEU A 92 -9.272 0.090 1.441 1.00 0.00 C ATOM 1384 CD2 LEU A 92 -11.179 -1.382 2.111 1.00 0.00 C ATOM 0 H LEU A 92 -11.956 2.683 3.114 1.00 0.00 H new ATOM 0 HA LEU A 92 -12.478 0.030 4.288 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -9.885 1.438 3.562 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -10.025 -0.202 4.165 1.00 0.00 H new ATOM 0 HG LEU A 92 -11.316 0.678 1.576 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -9.365 -0.283 0.421 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -8.916 1.120 1.420 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -8.562 -0.528 1.990 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -11.246 -1.736 1.082 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -10.516 -2.036 2.677 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -12.171 -1.392 2.563 1.00 0.00 H new ATOM 1396 N GLU A 93 -12.270 0.794 6.626 1.00 0.00 N ATOM 1397 CA GLU A 93 -12.110 1.164 8.027 1.00 0.00 C ATOM 1398 C GLU A 93 -10.677 0.921 8.493 1.00 0.00 C ATOM 1399 O GLU A 93 -9.963 0.066 7.968 1.00 0.00 O ATOM 1400 CB GLU A 93 -13.083 0.371 8.901 1.00 0.00 C ATOM 1401 CG GLU A 93 -14.263 1.191 9.397 1.00 0.00 C ATOM 1402 CD GLU A 93 -15.473 0.336 9.720 1.00 0.00 C ATOM 1403 OE1 GLU A 93 -15.908 -0.434 8.840 1.00 0.00 O ATOM 1404 OE2 GLU A 93 -15.984 0.437 10.856 1.00 0.00 O ATOM 0 H GLU A 93 -12.941 0.043 6.462 1.00 0.00 H new ATOM 0 HA GLU A 93 -12.330 2.227 8.123 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -13.457 -0.481 8.333 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -12.544 -0.030 9.759 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -13.967 1.746 10.287 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -14.534 1.926 8.639 1.00 0.00 H new ATOM 1411 N PRO A 94 -10.245 1.691 9.502 1.00 0.00 N ATOM 1412 CA PRO A 94 -8.895 1.579 10.061 1.00 0.00 C ATOM 1413 C PRO A 94 -8.694 0.282 10.837 1.00 0.00 C ATOM 1414 O PRO A 94 -9.548 -0.118 11.630 1.00 0.00 O ATOM 1415 CB PRO A 94 -8.799 2.784 11.001 1.00 0.00 C ATOM 1416 CG PRO A 94 -10.209 3.085 11.376 1.00 0.00 C ATOM 1417 CD PRO A 94 -11.041 2.731 10.175 1.00 0.00 C ATOM 0 HA PRO A 94 -8.132 1.566 9.283 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -8.196 2.554 11.879 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -8.330 3.635 10.507 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -10.514 2.504 12.247 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -10.328 4.137 11.637 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -12.025 2.360 10.463 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -11.202 3.594 9.529 1.00 0.00 H new ATOM 1425 N LEU A 95 -7.561 -0.372 10.604 1.00 0.00 N ATOM 1426 CA LEU A 95 -7.248 -1.625 11.281 1.00 0.00 C ATOM 1427 C LEU A 95 -8.252 -2.711 10.909 1.00 0.00 C ATOM 1428 O LEU A 95 -8.763 -3.421 11.775 1.00 0.00 O ATOM 1429 CB LEU A 95 -7.240 -1.420 12.797 1.00 0.00 C ATOM 1430 CG LEU A 95 -6.557 -0.147 13.299 1.00 0.00 C ATOM 1431 CD1 LEU A 95 -6.539 -0.115 14.819 1.00 0.00 C ATOM 1432 CD2 LEU A 95 -5.144 -0.047 12.744 1.00 0.00 C ATOM 0 H LEU A 95 -6.844 -0.055 9.951 1.00 0.00 H new ATOM 0 HA LEU A 95 -6.258 -1.946 10.958 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -8.272 -1.418 13.149 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -6.749 -2.277 13.257 1.00 0.00 H new ATOM 0 HG LEU A 95 -7.127 0.713 12.945 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -6.049 0.798 15.158 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -7.562 -0.139 15.196 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -5.993 -0.981 15.195 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -4.673 0.865 13.111 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -4.564 -0.911 13.068 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -5.182 -0.023 11.655 1.00 0.00 H new ATOM 1444 N ARG A 96 -8.529 -2.836 9.615 1.00 0.00 N ATOM 1445 CA ARG A 96 -9.471 -3.836 9.128 1.00 0.00 C ATOM 1446 C ARG A 96 -8.827 -4.714 8.059 1.00 0.00 C ATOM 1447 O ARG A 96 -7.931 -4.276 7.337 1.00 0.00 O ATOM 1448 CB ARG A 96 -10.720 -3.158 8.562 1.00 0.00 C ATOM 1449 CG ARG A 96 -12.012 -3.887 8.894 1.00 0.00 C ATOM 1450 CD ARG A 96 -12.616 -3.385 10.196 1.00 0.00 C ATOM 1451 NE ARG A 96 -11.950 -3.955 11.364 1.00 0.00 N ATOM 1452 CZ ARG A 96 -12.175 -3.551 12.609 1.00 0.00 C ATOM 1453 NH1 ARG A 96 -13.045 -2.579 12.847 1.00 0.00 N ATOM 1454 NH2 ARG A 96 -11.529 -4.120 13.620 1.00 0.00 N ATOM 0 H ARG A 96 -8.114 -2.257 8.885 1.00 0.00 H new ATOM 0 HA ARG A 96 -9.758 -4.468 9.968 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -10.777 -2.140 8.948 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -10.623 -3.083 7.479 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -12.727 -3.750 8.083 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -11.818 -4.957 8.970 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -12.545 -2.298 10.233 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -13.676 -3.637 10.225 1.00 0.00 H new ATOM 0 HE ARG A 96 -11.275 -4.705 11.215 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -13.543 -2.140 12.073 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -13.216 -2.271 13.804 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -10.859 -4.868 13.441 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -11.703 -3.809 14.576 1.00 0.00 H new ATOM 1468 N VAL A 97 -9.290 -5.957 7.964 1.00 0.00 N ATOM 1469 CA VAL A 97 -8.760 -6.897 6.983 1.00 0.00 C ATOM 1470 C VAL A 97 -9.636 -6.942 5.736 1.00 0.00 C ATOM 1471 O VAL A 97 -10.859 -7.053 5.827 1.00 0.00 O ATOM 1472 CB VAL A 97 -8.648 -8.316 7.570 1.00 0.00 C ATOM 1473 CG1 VAL A 97 -7.910 -9.235 6.608 1.00 0.00 C ATOM 1474 CG2 VAL A 97 -7.953 -8.280 8.923 1.00 0.00 C ATOM 0 H VAL A 97 -10.031 -6.336 8.554 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.765 -6.544 6.712 1.00 0.00 H new ATOM 0 HB VAL A 97 -9.654 -8.711 7.714 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -7.840 -10.233 7.040 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -8.453 -9.285 5.664 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -6.907 -8.846 6.430 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -7.883 -9.292 9.323 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.952 -7.865 8.807 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.526 -7.657 9.610 1.00 0.00 H new ATOM 1484 N TYR A 98 -9.003 -6.855 4.572 1.00 0.00 N ATOM 1485 CA TYR A 98 -9.724 -6.884 3.305 1.00 0.00 C ATOM 1486 C TYR A 98 -9.020 -7.787 2.297 1.00 0.00 C ATOM 1487 O TYR A 98 -7.864 -7.558 1.943 1.00 0.00 O ATOM 1488 CB TYR A 98 -9.855 -5.471 2.736 1.00 0.00 C ATOM 1489 CG TYR A 98 -10.876 -4.619 3.456 1.00 0.00 C ATOM 1490 CD1 TYR A 98 -12.236 -4.791 3.230 1.00 0.00 C ATOM 1491 CD2 TYR A 98 -10.481 -3.643 4.362 1.00 0.00 C ATOM 1492 CE1 TYR A 98 -13.173 -4.015 3.885 1.00 0.00 C ATOM 1493 CE2 TYR A 98 -11.410 -2.864 5.023 1.00 0.00 C ATOM 1494 CZ TYR A 98 -12.755 -3.054 4.781 1.00 0.00 C ATOM 1495 OH TYR A 98 -13.684 -2.278 5.437 1.00 0.00 O ATOM 0 H TYR A 98 -7.991 -6.764 4.479 1.00 0.00 H new ATOM 0 HA TYR A 98 -10.719 -7.287 3.493 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -8.884 -4.978 2.784 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -10.127 -5.537 1.683 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -12.567 -5.544 2.530 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -9.429 -3.491 4.553 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -14.226 -4.160 3.696 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -11.086 -2.110 5.725 1.00 0.00 H new ATOM 0 HH TYR A 98 -13.333 -2.020 6.315 1.00 0.00 H new ATOM 1505 N SER A 99 -9.727 -8.815 1.839 1.00 0.00 N ATOM 1506 CA SER A 99 -9.170 -9.756 0.874 1.00 0.00 C ATOM 1507 C SER A 99 -9.142 -9.147 -0.525 1.00 0.00 C ATOM 1508 O SER A 99 -10.185 -8.820 -1.092 1.00 0.00 O ATOM 1509 CB SER A 99 -9.985 -11.051 0.863 1.00 0.00 C ATOM 1510 OG SER A 99 -11.172 -10.913 1.626 1.00 0.00 O ATOM 0 H SER A 99 -10.686 -9.018 2.120 1.00 0.00 H new ATOM 0 HA SER A 99 -8.147 -9.982 1.173 1.00 0.00 H new ATOM 0 HB2 SER A 99 -10.238 -11.317 -0.163 1.00 0.00 H new ATOM 0 HB3 SER A 99 -9.383 -11.866 1.265 1.00 0.00 H new ATOM 0 HG SER A 99 -10.948 -10.905 2.580 1.00 0.00 H new ATOM 1516 N ILE A 100 -7.942 -8.998 -1.075 1.00 0.00 N ATOM 1517 CA ILE A 100 -7.778 -8.430 -2.407 1.00 0.00 C ATOM 1518 C ILE A 100 -7.546 -9.522 -3.446 1.00 0.00 C ATOM 1519 O ILE A 100 -7.041 -10.600 -3.128 1.00 0.00 O ATOM 1520 CB ILE A 100 -6.602 -7.436 -2.454 1.00 0.00 C ATOM 1521 CG1 ILE A 100 -5.278 -8.167 -2.226 1.00 0.00 C ATOM 1522 CG2 ILE A 100 -6.795 -6.340 -1.416 1.00 0.00 C ATOM 1523 CD1 ILE A 100 -4.069 -7.259 -2.280 1.00 0.00 C ATOM 0 H ILE A 100 -7.069 -9.263 -0.619 1.00 0.00 H new ATOM 0 HA ILE A 100 -8.702 -7.900 -2.640 1.00 0.00 H new ATOM 0 HB ILE A 100 -6.574 -6.974 -3.441 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -5.308 -8.661 -1.255 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -5.169 -8.948 -2.978 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.957 -5.645 -1.461 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -7.722 -5.804 -1.621 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -6.845 -6.785 -0.422 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.166 -7.845 -2.110 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.014 -6.784 -3.260 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.155 -6.493 -1.510 1.00 0.00 H new ATOM 1535 N HIS A 101 -7.918 -9.237 -4.690 1.00 0.00 N ATOM 1536 CA HIS A 101 -7.749 -10.194 -5.777 1.00 0.00 C ATOM 1537 C HIS A 101 -7.537 -9.475 -7.106 1.00 0.00 C ATOM 1538 O HIS A 101 -7.801 -8.279 -7.223 1.00 0.00 O ATOM 1539 CB HIS A 101 -8.967 -11.113 -5.870 1.00 0.00 C ATOM 1540 CG HIS A 101 -9.266 -11.841 -4.596 1.00 0.00 C ATOM 1541 ND1 HIS A 101 -8.715 -13.065 -4.281 1.00 0.00 N ATOM 1542 CD2 HIS A 101 -10.064 -11.511 -3.553 1.00 0.00 C ATOM 1543 CE1 HIS A 101 -9.162 -13.457 -3.102 1.00 0.00 C ATOM 1544 NE2 HIS A 101 -9.981 -12.531 -2.638 1.00 0.00 N ATOM 0 H HIS A 101 -8.338 -8.351 -4.970 1.00 0.00 H new ATOM 0 HA HIS A 101 -6.865 -10.795 -5.564 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -9.837 -10.521 -6.154 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -8.803 -11.841 -6.665 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -8.063 -13.587 -4.867 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -10.656 -10.612 -3.459 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -8.902 -14.378 -2.602 1.00 0.00 H new ATOM 1552 N GLN A 102 -7.058 -10.212 -8.103 1.00 0.00 N ATOM 1553 CA GLN A 102 -6.809 -9.643 -9.422 1.00 0.00 C ATOM 1554 C GLN A 102 -8.045 -8.918 -9.944 1.00 0.00 C ATOM 1555 O GLN A 102 -9.017 -9.548 -10.360 1.00 0.00 O ATOM 1556 CB GLN A 102 -6.395 -10.741 -10.404 1.00 0.00 C ATOM 1557 CG GLN A 102 -6.189 -10.240 -11.824 1.00 0.00 C ATOM 1558 CD GLN A 102 -4.945 -9.387 -11.968 1.00 0.00 C ATOM 1559 OE1 GLN A 102 -4.976 -8.178 -11.734 1.00 0.00 O ATOM 1560 NE2 GLN A 102 -3.839 -10.012 -12.355 1.00 0.00 N ATOM 0 H GLN A 102 -6.835 -11.204 -8.022 1.00 0.00 H new ATOM 0 HA GLN A 102 -5.998 -8.921 -9.331 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -5.472 -11.202 -10.053 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -7.158 -11.519 -10.409 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -6.120 -11.093 -12.499 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -7.060 -9.660 -12.130 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -3.858 -11.015 -12.538 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -2.971 -9.489 -12.469 1.00 0.00 H new ATOM 1569 N GLY A 103 -8.001 -7.590 -9.918 1.00 0.00 N ATOM 1570 CA GLY A 103 -9.124 -6.801 -10.391 1.00 0.00 C ATOM 1571 C GLY A 103 -9.610 -5.806 -9.356 1.00 0.00 C ATOM 1572 O GLY A 103 -10.802 -5.506 -9.284 1.00 0.00 O ATOM 0 H GLY A 103 -7.208 -7.046 -9.578 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -8.833 -6.267 -11.296 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -9.943 -7.467 -10.663 1.00 0.00 H new ATOM 1576 N ASP A 104 -8.686 -5.293 -8.551 1.00 0.00 N ATOM 1577 CA ASP A 104 -9.026 -4.326 -7.514 1.00 0.00 C ATOM 1578 C ASP A 104 -8.407 -2.965 -7.815 1.00 0.00 C ATOM 1579 O ASP A 104 -7.600 -2.829 -8.735 1.00 0.00 O ATOM 1580 CB ASP A 104 -8.553 -4.824 -6.147 1.00 0.00 C ATOM 1581 CG ASP A 104 -9.603 -5.658 -5.440 1.00 0.00 C ATOM 1582 OD1 ASP A 104 -10.172 -6.564 -6.083 1.00 0.00 O ATOM 1583 OD2 ASP A 104 -9.856 -5.405 -4.243 1.00 0.00 O ATOM 0 H ASP A 104 -7.695 -5.531 -8.597 1.00 0.00 H new ATOM 0 HA ASP A 104 -10.110 -4.216 -7.497 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -7.647 -5.416 -6.273 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -8.291 -3.970 -5.523 1.00 0.00 H new ATOM 1588 N TYR A 105 -8.792 -1.960 -7.036 1.00 0.00 N ATOM 1589 CA TYR A 105 -8.277 -0.609 -7.222 1.00 0.00 C ATOM 1590 C TYR A 105 -8.060 0.081 -5.879 1.00 0.00 C ATOM 1591 O TYR A 105 -9.015 0.492 -5.218 1.00 0.00 O ATOM 1592 CB TYR A 105 -9.241 0.213 -8.080 1.00 0.00 C ATOM 1593 CG TYR A 105 -8.826 0.312 -9.531 1.00 0.00 C ATOM 1594 CD1 TYR A 105 -8.910 -0.789 -10.374 1.00 0.00 C ATOM 1595 CD2 TYR A 105 -8.352 1.506 -10.058 1.00 0.00 C ATOM 1596 CE1 TYR A 105 -8.532 -0.704 -11.700 1.00 0.00 C ATOM 1597 CE2 TYR A 105 -7.973 1.601 -11.383 1.00 0.00 C ATOM 1598 CZ TYR A 105 -8.064 0.493 -12.200 1.00 0.00 C ATOM 1599 OH TYR A 105 -7.688 0.583 -13.520 1.00 0.00 O ATOM 0 H TYR A 105 -9.459 -2.056 -6.270 1.00 0.00 H new ATOM 0 HA TYR A 105 -7.317 -0.681 -7.733 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -10.234 -0.233 -8.024 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -9.319 1.217 -7.664 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -9.277 -1.728 -9.986 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -8.278 2.375 -9.421 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -8.603 -1.570 -12.341 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -7.607 2.538 -11.777 1.00 0.00 H new ATOM 0 HH TYR A 105 -7.613 1.526 -13.775 1.00 0.00 H new ATOM 1609 N ILE A 106 -6.798 0.205 -5.482 1.00 0.00 N ATOM 1610 CA ILE A 106 -6.454 0.846 -4.218 1.00 0.00 C ATOM 1611 C ILE A 106 -6.177 2.333 -4.414 1.00 0.00 C ATOM 1612 O ILE A 106 -5.416 2.720 -5.300 1.00 0.00 O ATOM 1613 CB ILE A 106 -5.223 0.187 -3.569 1.00 0.00 C ATOM 1614 CG1 ILE A 106 -5.484 -1.301 -3.324 1.00 0.00 C ATOM 1615 CG2 ILE A 106 -4.871 0.890 -2.267 1.00 0.00 C ATOM 1616 CD1 ILE A 106 -5.118 -2.180 -4.500 1.00 0.00 C ATOM 0 H ILE A 106 -5.997 -0.130 -6.017 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.312 0.722 -3.557 1.00 0.00 H new ATOM 0 HB ILE A 106 -4.377 0.281 -4.250 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -4.917 -1.622 -2.450 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.539 -1.443 -3.089 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -3.999 0.413 -1.820 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -4.648 1.938 -2.468 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -5.713 0.824 -1.578 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.329 -3.221 -4.256 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -5.704 -1.885 -5.371 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -4.057 -2.068 -4.722 1.00 0.00 H new ATOM 1628 N GLN A 107 -6.799 3.160 -3.580 1.00 0.00 N ATOM 1629 CA GLN A 107 -6.617 4.604 -3.661 1.00 0.00 C ATOM 1630 C GLN A 107 -6.132 5.167 -2.329 1.00 0.00 C ATOM 1631 O GLN A 107 -6.895 5.259 -1.367 1.00 0.00 O ATOM 1632 CB GLN A 107 -7.927 5.282 -4.067 1.00 0.00 C ATOM 1633 CG GLN A 107 -7.735 6.468 -4.998 1.00 0.00 C ATOM 1634 CD GLN A 107 -9.049 7.090 -5.430 1.00 0.00 C ATOM 1635 OE1 GLN A 107 -9.259 7.367 -6.611 1.00 0.00 O ATOM 1636 NE2 GLN A 107 -9.942 7.313 -4.472 1.00 0.00 N ATOM 0 H GLN A 107 -7.433 2.855 -2.841 1.00 0.00 H new ATOM 0 HA GLN A 107 -5.860 4.808 -4.418 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -8.570 4.549 -4.554 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -8.447 5.616 -3.169 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -7.127 7.222 -4.498 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -7.182 6.146 -5.881 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -9.726 7.068 -3.506 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -10.844 7.730 -4.703 1.00 0.00 H new ATOM 1645 N LEU A 108 -4.858 5.543 -2.281 1.00 0.00 N ATOM 1646 CA LEU A 108 -4.270 6.098 -1.067 1.00 0.00 C ATOM 1647 C LEU A 108 -4.603 7.580 -0.928 1.00 0.00 C ATOM 1648 O LEU A 108 -3.824 8.442 -1.333 1.00 0.00 O ATOM 1649 CB LEU A 108 -2.753 5.903 -1.077 1.00 0.00 C ATOM 1650 CG LEU A 108 -2.262 4.466 -1.262 1.00 0.00 C ATOM 1651 CD1 LEU A 108 -0.752 4.437 -1.440 1.00 0.00 C ATOM 1652 CD2 LEU A 108 -2.678 3.604 -0.079 1.00 0.00 C ATOM 0 H LEU A 108 -4.213 5.474 -3.068 1.00 0.00 H new ATOM 0 HA LEU A 108 -4.693 5.569 -0.213 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.333 6.515 -1.876 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -2.351 6.285 -0.138 1.00 0.00 H new ATOM 0 HG LEU A 108 -2.721 4.058 -2.162 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -0.421 3.407 -1.570 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -0.478 5.020 -2.319 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.273 4.863 -0.558 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -2.320 2.585 -0.228 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -2.247 4.010 0.836 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -3.765 3.599 0.003 1.00 0.00 H new ATOM 1664 N GLY A 109 -5.765 7.869 -0.351 1.00 0.00 N ATOM 1665 CA GLY A 109 -6.180 9.247 -0.167 1.00 0.00 C ATOM 1666 C GLY A 109 -7.353 9.623 -1.050 1.00 0.00 C ATOM 1667 O GLY A 109 -7.914 8.774 -1.744 1.00 0.00 O ATOM 0 H GLY A 109 -6.427 7.173 -0.008 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -6.450 9.405 0.877 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -5.340 9.908 -0.383 1.00 0.00 H new ATOM 1671 N VAL A 110 -7.727 10.898 -1.025 1.00 0.00 N ATOM 1672 CA VAL A 110 -8.842 11.384 -1.829 1.00 0.00 C ATOM 1673 C VAL A 110 -8.366 12.371 -2.889 1.00 0.00 C ATOM 1674 O VAL A 110 -7.319 13.005 -2.757 1.00 0.00 O ATOM 1675 CB VAL A 110 -9.911 12.065 -0.953 1.00 0.00 C ATOM 1676 CG1 VAL A 110 -10.764 11.023 -0.245 1.00 0.00 C ATOM 1677 CG2 VAL A 110 -9.258 13.003 0.051 1.00 0.00 C ATOM 0 H VAL A 110 -7.274 11.613 -0.456 1.00 0.00 H new ATOM 0 HA VAL A 110 -9.282 10.515 -2.317 1.00 0.00 H new ATOM 0 HB VAL A 110 -10.562 12.656 -1.597 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -11.513 11.522 0.369 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -11.261 10.396 -0.985 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -10.130 10.403 0.389 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -10.028 13.475 0.661 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -8.583 12.437 0.693 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -8.695 13.770 -0.481 1.00 0.00 H new ATOM 1687 N PRO A 111 -9.153 12.507 -3.967 1.00 0.00 N ATOM 1688 CA PRO A 111 -8.833 13.416 -5.071 1.00 0.00 C ATOM 1689 C PRO A 111 -8.962 14.882 -4.671 1.00 0.00 C ATOM 1690 O PRO A 111 -9.903 15.266 -3.974 1.00 0.00 O ATOM 1691 CB PRO A 111 -9.872 13.059 -6.137 1.00 0.00 C ATOM 1692 CG PRO A 111 -11.017 12.489 -5.373 1.00 0.00 C ATOM 1693 CD PRO A 111 -10.416 11.783 -4.190 1.00 0.00 C ATOM 0 HA PRO A 111 -7.802 13.303 -5.406 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -10.174 13.938 -6.706 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -9.475 12.338 -6.852 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -11.701 13.274 -5.052 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -11.592 11.798 -5.989 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -11.068 11.834 -3.318 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -10.243 10.727 -4.397 1.00 0.00 H new ATOM 1701 N LEU A 112 -8.012 15.698 -5.115 1.00 0.00 N ATOM 1702 CA LEU A 112 -8.020 17.123 -4.803 1.00 0.00 C ATOM 1703 C LEU A 112 -9.173 17.828 -5.511 1.00 0.00 C ATOM 1704 O LEU A 112 -9.900 17.217 -6.293 1.00 0.00 O ATOM 1705 CB LEU A 112 -6.691 17.761 -5.209 1.00 0.00 C ATOM 1706 CG LEU A 112 -5.440 17.190 -4.539 1.00 0.00 C ATOM 1707 CD1 LEU A 112 -4.218 17.403 -5.420 1.00 0.00 C ATOM 1708 CD2 LEU A 112 -5.231 17.823 -3.172 1.00 0.00 C ATOM 0 H LEU A 112 -7.227 15.397 -5.692 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.156 17.234 -3.727 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -6.578 17.662 -6.289 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.741 18.828 -4.990 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.582 16.118 -4.403 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -3.338 16.990 -4.927 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -4.367 16.901 -6.376 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -4.073 18.470 -5.589 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -4.337 17.405 -2.710 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -5.111 18.901 -3.284 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -6.095 17.618 -2.540 1.00 0.00 H new ATOM 1800 N ALA A 118 -7.814 10.465 -7.932 1.00 0.00 N ATOM 1801 CA ALA A 118 -6.592 10.390 -7.142 1.00 0.00 C ATOM 1802 C ALA A 118 -5.377 10.147 -8.031 1.00 0.00 C ATOM 1803 O ALA A 118 -5.298 9.135 -8.726 1.00 0.00 O ATOM 1804 CB ALA A 118 -6.708 9.295 -6.093 1.00 0.00 C ATOM 0 HA ALA A 118 -6.455 11.347 -6.639 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -5.788 9.250 -5.510 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -7.546 9.512 -5.431 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -6.873 8.336 -6.585 1.00 0.00 H new ATOM 1810 N GLU A 119 -4.432 11.083 -8.003 1.00 0.00 N ATOM 1811 CA GLU A 119 -3.222 10.969 -8.809 1.00 0.00 C ATOM 1812 C GLU A 119 -2.489 9.665 -8.508 1.00 0.00 C ATOM 1813 O GLU A 119 -1.757 9.144 -9.350 1.00 0.00 O ATOM 1814 CB GLU A 119 -2.297 12.160 -8.550 1.00 0.00 C ATOM 1815 CG GLU A 119 -1.739 12.200 -7.137 1.00 0.00 C ATOM 1816 CD GLU A 119 -0.577 13.164 -6.996 1.00 0.00 C ATOM 1817 OE1 GLU A 119 -0.670 14.287 -7.534 1.00 0.00 O ATOM 1818 OE2 GLU A 119 0.426 12.795 -6.349 1.00 0.00 O ATOM 0 H GLU A 119 -4.481 11.927 -7.432 1.00 0.00 H new ATOM 0 HA GLU A 119 -3.514 10.967 -9.859 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -1.469 12.127 -9.258 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -2.844 13.083 -8.742 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -2.531 12.488 -6.446 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -1.414 11.200 -6.850 1.00 0.00 H new ATOM 1825 N TYR A 120 -2.689 9.145 -7.302 1.00 0.00 N ATOM 1826 CA TYR A 120 -2.045 7.905 -6.888 1.00 0.00 C ATOM 1827 C TYR A 120 -3.046 6.753 -6.864 1.00 0.00 C ATOM 1828 O TYR A 120 -3.894 6.672 -5.977 1.00 0.00 O ATOM 1829 CB TYR A 120 -1.410 8.072 -5.506 1.00 0.00 C ATOM 1830 CG TYR A 120 0.037 8.508 -5.554 1.00 0.00 C ATOM 1831 CD1 TYR A 120 0.986 7.760 -6.241 1.00 0.00 C ATOM 1832 CD2 TYR A 120 0.455 9.667 -4.912 1.00 0.00 C ATOM 1833 CE1 TYR A 120 2.309 8.154 -6.286 1.00 0.00 C ATOM 1834 CE2 TYR A 120 1.776 10.069 -4.953 1.00 0.00 C ATOM 1835 CZ TYR A 120 2.699 9.309 -5.642 1.00 0.00 C ATOM 1836 OH TYR A 120 4.016 9.706 -5.684 1.00 0.00 O ATOM 0 H TYR A 120 -3.292 9.564 -6.594 1.00 0.00 H new ATOM 0 HA TYR A 120 -1.265 7.671 -7.613 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -1.983 8.805 -4.938 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -1.478 7.127 -4.967 1.00 0.00 H new ATOM 0 HD1 TYR A 120 0.684 6.856 -6.748 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -0.265 10.264 -4.372 1.00 0.00 H new ATOM 0 HE1 TYR A 120 3.034 7.560 -6.823 1.00 0.00 H new ATOM 0 HE2 TYR A 120 2.085 10.973 -4.449 1.00 0.00 H new ATOM 0 HH TYR A 120 4.122 10.540 -5.181 1.00 0.00 H new ATOM 1846 N GLU A 121 -2.938 5.864 -7.846 1.00 0.00 N ATOM 1847 CA GLU A 121 -3.833 4.716 -7.939 1.00 0.00 C ATOM 1848 C GLU A 121 -3.079 3.475 -8.408 1.00 0.00 C ATOM 1849 O GLU A 121 -2.035 3.576 -9.052 1.00 0.00 O ATOM 1850 CB GLU A 121 -4.987 5.017 -8.897 1.00 0.00 C ATOM 1851 CG GLU A 121 -6.170 5.698 -8.229 1.00 0.00 C ATOM 1852 CD GLU A 121 -6.967 6.559 -9.190 1.00 0.00 C ATOM 1853 OE1 GLU A 121 -6.354 7.162 -10.095 1.00 0.00 O ATOM 1854 OE2 GLU A 121 -8.205 6.628 -9.038 1.00 0.00 O ATOM 0 H GLU A 121 -2.240 5.916 -8.588 1.00 0.00 H new ATOM 0 HA GLU A 121 -4.237 4.521 -6.945 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -4.622 5.651 -9.705 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -5.324 4.085 -9.351 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -6.824 4.940 -7.798 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -5.811 6.316 -7.406 1.00 0.00 H new ATOM 1861 N TYR A 122 -3.615 2.305 -8.078 1.00 0.00 N ATOM 1862 CA TYR A 122 -2.993 1.044 -8.462 1.00 0.00 C ATOM 1863 C TYR A 122 -4.049 -0.021 -8.743 1.00 0.00 C ATOM 1864 O TYR A 122 -5.247 0.232 -8.627 1.00 0.00 O ATOM 1865 CB TYR A 122 -2.047 0.562 -7.362 1.00 0.00 C ATOM 1866 CG TYR A 122 -1.138 1.646 -6.827 1.00 0.00 C ATOM 1867 CD1 TYR A 122 0.070 1.936 -7.449 1.00 0.00 C ATOM 1868 CD2 TYR A 122 -1.488 2.380 -5.701 1.00 0.00 C ATOM 1869 CE1 TYR A 122 0.904 2.925 -6.963 1.00 0.00 C ATOM 1870 CE2 TYR A 122 -0.662 3.372 -5.209 1.00 0.00 C ATOM 1871 CZ TYR A 122 0.533 3.640 -5.843 1.00 0.00 C ATOM 1872 OH TYR A 122 1.360 4.627 -5.357 1.00 0.00 O ATOM 0 H TYR A 122 -4.479 2.204 -7.545 1.00 0.00 H new ATOM 0 HA TYR A 122 -2.422 1.213 -9.375 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -2.636 0.155 -6.540 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -1.437 -0.253 -7.751 1.00 0.00 H new ATOM 0 HD1 TYR A 122 0.362 1.379 -8.327 1.00 0.00 H new ATOM 0 HD2 TYR A 122 -2.422 2.172 -5.201 1.00 0.00 H new ATOM 0 HE1 TYR A 122 1.841 3.137 -7.457 1.00 0.00 H new ATOM 0 HE2 TYR A 122 -0.950 3.934 -4.333 1.00 0.00 H new ATOM 0 HH TYR A 122 1.065 5.498 -5.696 1.00 0.00 H new ATOM 1882 N GLU A 123 -3.593 -1.214 -9.112 1.00 0.00 N ATOM 1883 CA GLU A 123 -4.498 -2.318 -9.410 1.00 0.00 C ATOM 1884 C GLU A 123 -3.848 -3.659 -9.078 1.00 0.00 C ATOM 1885 O GLU A 123 -2.881 -4.069 -9.720 1.00 0.00 O ATOM 1886 CB GLU A 123 -4.906 -2.289 -10.884 1.00 0.00 C ATOM 1887 CG GLU A 123 -5.953 -3.329 -11.247 1.00 0.00 C ATOM 1888 CD GLU A 123 -6.005 -3.611 -12.736 1.00 0.00 C ATOM 1889 OE1 GLU A 123 -6.293 -2.671 -13.507 1.00 0.00 O ATOM 1890 OE2 GLU A 123 -5.757 -4.769 -13.130 1.00 0.00 O ATOM 0 H GLU A 123 -2.603 -1.440 -9.212 1.00 0.00 H new ATOM 0 HA GLU A 123 -5.388 -2.201 -8.792 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -5.291 -1.298 -11.126 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -4.021 -2.446 -11.500 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -5.740 -4.255 -10.713 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -6.932 -2.986 -10.912 1.00 0.00 H new ATOM 1897 N VAL A 124 -4.387 -4.337 -8.069 1.00 0.00 N ATOM 1898 CA VAL A 124 -3.861 -5.631 -7.651 1.00 0.00 C ATOM 1899 C VAL A 124 -3.762 -6.591 -8.831 1.00 0.00 C ATOM 1900 O VAL A 124 -4.761 -6.896 -9.484 1.00 0.00 O ATOM 1901 CB VAL A 124 -4.740 -6.267 -6.558 1.00 0.00 C ATOM 1902 CG1 VAL A 124 -4.136 -7.580 -6.083 1.00 0.00 C ATOM 1903 CG2 VAL A 124 -4.924 -5.304 -5.395 1.00 0.00 C ATOM 0 H VAL A 124 -5.187 -4.012 -7.526 1.00 0.00 H new ATOM 0 HA VAL A 124 -2.864 -5.452 -7.247 1.00 0.00 H new ATOM 0 HB VAL A 124 -5.721 -6.479 -6.983 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -4.771 -8.014 -5.311 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -4.061 -8.271 -6.923 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -3.142 -7.397 -5.675 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -5.548 -5.770 -4.632 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -3.951 -5.059 -4.969 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -5.405 -4.393 -5.750 1.00 0.00 H new ATOM 1913 N THR A 125 -2.550 -7.067 -9.099 1.00 0.00 N ATOM 1914 CA THR A 125 -2.319 -7.993 -10.201 1.00 0.00 C ATOM 1915 C THR A 125 -1.126 -8.898 -9.918 1.00 0.00 C ATOM 1916 O THR A 125 -0.257 -8.560 -9.115 1.00 0.00 O ATOM 1917 CB THR A 125 -2.078 -7.243 -11.524 1.00 0.00 C ATOM 1918 OG1 THR A 125 -1.777 -8.175 -12.568 1.00 0.00 O ATOM 1919 CG2 THR A 125 -0.937 -6.247 -11.382 1.00 0.00 C ATOM 0 H THR A 125 -1.713 -6.826 -8.568 1.00 0.00 H new ATOM 0 HA THR A 125 -3.218 -8.602 -10.296 1.00 0.00 H new ATOM 0 HB THR A 125 -2.987 -6.697 -11.776 1.00 0.00 H new ATOM 0 HG1 THR A 125 -1.627 -7.690 -13.406 1.00 0.00 H new ATOM 0 HG21 THR A 125 -0.786 -5.730 -12.329 1.00 0.00 H new ATOM 0 HG22 THR A 125 -1.182 -5.521 -10.607 1.00 0.00 H new ATOM 0 HG23 THR A 125 -0.024 -6.776 -11.108 1.00 0.00 H new ATOM 1927 N GLU A 126 -1.089 -10.048 -10.583 1.00 0.00 N ATOM 1928 CA GLU A 126 -0.001 -11.001 -10.402 1.00 0.00 C ATOM 1929 C GLU A 126 0.887 -11.055 -11.642 1.00 0.00 C ATOM 1930 O GLU A 126 0.415 -11.334 -12.744 1.00 0.00 O ATOM 1931 CB GLU A 126 -0.557 -12.393 -10.098 1.00 0.00 C ATOM 1932 CG GLU A 126 0.360 -13.239 -9.231 1.00 0.00 C ATOM 1933 CD GLU A 126 -0.096 -14.683 -9.135 1.00 0.00 C ATOM 1934 OE1 GLU A 126 -1.183 -14.997 -9.663 1.00 0.00 O ATOM 1935 OE2 GLU A 126 0.634 -15.497 -8.533 1.00 0.00 O ATOM 0 H GLU A 126 -1.800 -10.342 -11.252 1.00 0.00 H new ATOM 0 HA GLU A 126 0.603 -10.667 -9.558 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -1.521 -12.289 -9.599 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -0.739 -12.915 -11.037 1.00 0.00 H new ATOM 0 HG2 GLU A 126 1.370 -13.207 -9.639 1.00 0.00 H new ATOM 0 HG3 GLU A 126 0.406 -12.809 -8.230 1.00 0.00 H new ATOM 1942 N GLU A 127 2.175 -10.786 -11.453 1.00 0.00 N ATOM 1943 CA GLU A 127 3.128 -10.803 -12.557 1.00 0.00 C ATOM 1944 C GLU A 127 4.481 -11.339 -12.099 1.00 0.00 C ATOM 1945 O GLU A 127 4.842 -11.225 -10.927 1.00 0.00 O ATOM 1946 CB GLU A 127 3.295 -9.397 -13.138 1.00 0.00 C ATOM 1947 CG GLU A 127 2.072 -8.901 -13.890 1.00 0.00 C ATOM 1948 CD GLU A 127 1.593 -9.885 -14.940 1.00 0.00 C ATOM 1949 OE1 GLU A 127 2.449 -10.537 -15.574 1.00 0.00 O ATOM 1950 OE2 GLU A 127 0.365 -10.002 -15.128 1.00 0.00 O ATOM 0 H GLU A 127 2.582 -10.554 -10.547 1.00 0.00 H new ATOM 0 HA GLU A 127 2.737 -11.464 -13.330 1.00 0.00 H new ATOM 0 HB2 GLU A 127 3.520 -8.703 -12.328 1.00 0.00 H new ATOM 0 HB3 GLU A 127 4.152 -9.390 -13.811 1.00 0.00 H new ATOM 0 HG2 GLU A 127 1.266 -8.712 -13.181 1.00 0.00 H new ATOM 0 HG3 GLU A 127 2.306 -7.950 -14.369 1.00 0.00 H new ATOM 1957 N ASP A 128 5.225 -11.926 -13.031 1.00 0.00 N ATOM 1958 CA ASP A 128 6.538 -12.480 -12.724 1.00 0.00 C ATOM 1959 C ASP A 128 7.510 -11.379 -12.313 1.00 0.00 C ATOM 1960 O ASP A 128 7.397 -10.238 -12.762 1.00 0.00 O ATOM 1961 CB ASP A 128 7.089 -13.239 -13.932 1.00 0.00 C ATOM 1962 CG ASP A 128 6.228 -14.427 -14.311 1.00 0.00 C ATOM 1963 OD1 ASP A 128 5.997 -15.294 -13.443 1.00 0.00 O ATOM 1964 OD2 ASP A 128 5.784 -14.491 -15.477 1.00 0.00 O ATOM 0 H ASP A 128 4.941 -12.030 -14.005 1.00 0.00 H new ATOM 0 HA ASP A 128 6.427 -13.172 -11.889 1.00 0.00 H new ATOM 0 HB2 ASP A 128 7.161 -12.560 -14.782 1.00 0.00 H new ATOM 0 HB3 ASP A 128 8.100 -13.582 -13.712 1.00 0.00 H new ATOM 1969 N TRP A 129 8.464 -11.728 -11.457 1.00 0.00 N ATOM 1970 CA TRP A 129 9.455 -10.768 -10.984 1.00 0.00 C ATOM 1971 C TRP A 129 10.221 -10.156 -12.152 1.00 0.00 C ATOM 1972 O TRP A 129 10.626 -8.996 -12.100 1.00 0.00 O ATOM 1973 CB TRP A 129 10.429 -11.444 -10.018 1.00 0.00 C ATOM 1974 CG TRP A 129 11.679 -10.651 -9.783 1.00 0.00 C ATOM 1975 CD1 TRP A 129 12.915 -10.893 -10.311 1.00 0.00 C ATOM 1976 CD2 TRP A 129 11.814 -9.489 -8.957 1.00 0.00 C ATOM 1977 NE1 TRP A 129 13.810 -9.952 -9.864 1.00 0.00 N ATOM 1978 CE2 TRP A 129 13.160 -9.079 -9.032 1.00 0.00 C ATOM 1979 CE3 TRP A 129 10.929 -8.754 -8.163 1.00 0.00 C ATOM 1980 CZ2 TRP A 129 13.638 -7.968 -8.343 1.00 0.00 C ATOM 1981 CZ3 TRP A 129 11.406 -7.652 -7.479 1.00 0.00 C ATOM 1982 CH2 TRP A 129 12.750 -7.267 -7.573 1.00 0.00 C ATOM 0 H TRP A 129 8.572 -12.668 -11.076 1.00 0.00 H new ATOM 0 HA TRP A 129 8.930 -9.969 -10.460 1.00 0.00 H new ATOM 0 HB2 TRP A 129 9.928 -11.609 -9.064 1.00 0.00 H new ATOM 0 HB3 TRP A 129 10.698 -12.424 -10.411 1.00 0.00 H new ATOM 0 HD1 TRP A 129 13.154 -11.705 -10.982 1.00 0.00 H new ATOM 0 HE1 TRP A 129 14.799 -9.910 -10.111 1.00 0.00 H new ATOM 0 HE3 TRP A 129 9.891 -9.042 -8.085 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 14.674 -7.670 -8.414 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 10.731 -7.078 -6.861 1.00 0.00 H new ATOM 0 HH2 TRP A 129 13.092 -6.400 -7.027 1.00 0.00 H new ATOM 1993 N GLU A 130 10.414 -10.945 -13.205 1.00 0.00 N ATOM 1994 CA GLU A 130 11.132 -10.479 -14.386 1.00 0.00 C ATOM 1995 C GLU A 130 10.280 -9.502 -15.191 1.00 0.00 C ATOM 1996 O GLU A 130 10.751 -8.895 -16.153 1.00 0.00 O ATOM 1997 CB GLU A 130 11.537 -11.664 -15.265 1.00 0.00 C ATOM 1998 CG GLU A 130 12.181 -12.803 -14.492 1.00 0.00 C ATOM 1999 CD GLU A 130 13.464 -13.292 -15.136 1.00 0.00 C ATOM 2000 OE1 GLU A 130 14.473 -12.558 -15.080 1.00 0.00 O ATOM 2001 OE2 GLU A 130 13.459 -14.409 -15.695 1.00 0.00 O ATOM 0 H GLU A 130 10.084 -11.908 -13.264 1.00 0.00 H new ATOM 0 HA GLU A 130 12.030 -9.960 -14.052 1.00 0.00 H new ATOM 0 HB2 GLU A 130 10.654 -12.040 -15.782 1.00 0.00 H new ATOM 0 HB3 GLU A 130 12.231 -11.317 -16.030 1.00 0.00 H new ATOM 0 HG2 GLU A 130 12.392 -12.473 -13.475 1.00 0.00 H new ATOM 0 HG3 GLU A 130 11.477 -13.632 -14.419 1.00 0.00 H new ATOM 2008 N THR A 131 9.021 -9.355 -14.790 1.00 0.00 N ATOM 2009 CA THR A 131 8.102 -8.454 -15.473 1.00 0.00 C ATOM 2010 C THR A 131 7.969 -7.132 -14.726 1.00 0.00 C ATOM 2011 O THR A 131 7.769 -6.081 -15.335 1.00 0.00 O ATOM 2012 CB THR A 131 6.706 -9.086 -15.627 1.00 0.00 C ATOM 2013 OG1 THR A 131 6.797 -10.296 -16.387 1.00 0.00 O ATOM 2014 CG2 THR A 131 5.747 -8.122 -16.310 1.00 0.00 C ATOM 0 H THR A 131 8.615 -9.849 -13.995 1.00 0.00 H new ATOM 0 HA THR A 131 8.520 -8.268 -16.462 1.00 0.00 H new ATOM 0 HB THR A 131 6.322 -9.311 -14.632 1.00 0.00 H new ATOM 0 HG1 THR A 131 5.905 -10.692 -16.479 1.00 0.00 H new ATOM 0 HG21 THR A 131 4.768 -8.591 -16.407 1.00 0.00 H new ATOM 0 HG22 THR A 131 5.657 -7.214 -15.713 1.00 0.00 H new ATOM 0 HG23 THR A 131 6.128 -7.869 -17.299 1.00 0.00 H new ATOM 2022 N ILE A 132 8.082 -7.192 -13.403 1.00 0.00 N ATOM 2023 CA ILE A 132 7.977 -5.998 -12.573 1.00 0.00 C ATOM 2024 C ILE A 132 9.355 -5.443 -12.231 1.00 0.00 C ATOM 2025 O ILE A 132 9.485 -4.294 -11.807 1.00 0.00 O ATOM 2026 CB ILE A 132 7.214 -6.287 -11.267 1.00 0.00 C ATOM 2027 CG1 ILE A 132 5.875 -6.962 -11.571 1.00 0.00 C ATOM 2028 CG2 ILE A 132 6.998 -5.000 -10.484 1.00 0.00 C ATOM 2029 CD1 ILE A 132 5.318 -7.752 -10.408 1.00 0.00 C ATOM 0 H ILE A 132 8.246 -8.054 -12.883 1.00 0.00 H new ATOM 0 HA ILE A 132 7.424 -5.258 -13.152 1.00 0.00 H new ATOM 0 HB ILE A 132 7.811 -6.965 -10.657 1.00 0.00 H new ATOM 0 HG12 ILE A 132 5.151 -6.200 -11.862 1.00 0.00 H new ATOM 0 HG13 ILE A 132 5.999 -7.627 -12.425 1.00 0.00 H new ATOM 0 HG21 ILE A 132 6.457 -5.220 -9.564 1.00 0.00 H new ATOM 0 HG22 ILE A 132 7.963 -4.556 -10.241 1.00 0.00 H new ATOM 0 HG23 ILE A 132 6.418 -4.301 -11.086 1.00 0.00 H new ATOM 0 HD11 ILE A 132 4.368 -8.202 -10.696 1.00 0.00 H new ATOM 0 HD12 ILE A 132 6.022 -8.536 -10.130 1.00 0.00 H new ATOM 0 HD13 ILE A 132 5.162 -7.087 -9.558 1.00 0.00 H new ATOM 2041 N TYR A 133 10.382 -6.265 -12.420 1.00 0.00 N ATOM 2042 CA TYR A 133 11.751 -5.856 -12.131 1.00 0.00 C ATOM 2043 C TYR A 133 12.102 -4.568 -12.869 1.00 0.00 C ATOM 2044 O TYR A 133 12.505 -3.569 -12.271 1.00 0.00 O ATOM 2045 CB TYR A 133 12.730 -6.964 -12.523 1.00 0.00 C ATOM 2046 CG TYR A 133 14.098 -6.453 -12.916 1.00 0.00 C ATOM 2047 CD1 TYR A 133 14.789 -5.566 -12.101 1.00 0.00 C ATOM 2048 CD2 TYR A 133 14.699 -6.859 -14.101 1.00 0.00 C ATOM 2049 CE1 TYR A 133 16.039 -5.096 -12.455 1.00 0.00 C ATOM 2050 CE2 TYR A 133 15.949 -6.396 -14.463 1.00 0.00 C ATOM 2051 CZ TYR A 133 16.615 -5.514 -13.637 1.00 0.00 C ATOM 2052 OH TYR A 133 17.860 -5.050 -13.993 1.00 0.00 O ATOM 0 H TYR A 133 10.292 -7.218 -12.772 1.00 0.00 H new ATOM 0 HA TYR A 133 11.830 -5.673 -11.059 1.00 0.00 H new ATOM 0 HB2 TYR A 133 12.836 -7.656 -11.687 1.00 0.00 H new ATOM 0 HB3 TYR A 133 12.310 -7.530 -13.354 1.00 0.00 H new ATOM 0 HD1 TYR A 133 14.342 -5.238 -11.174 1.00 0.00 H new ATOM 0 HD2 TYR A 133 14.180 -7.548 -14.750 1.00 0.00 H new ATOM 0 HE1 TYR A 133 16.562 -4.405 -11.810 1.00 0.00 H new ATOM 0 HE2 TYR A 133 16.402 -6.722 -15.387 1.00 0.00 H new ATOM 0 HH TYR A 133 18.122 -5.442 -14.852 1.00 0.00 H new ATOM 2062 N PRO A 134 11.946 -4.589 -14.201 1.00 0.00 N ATOM 2063 CA PRO A 134 12.240 -3.431 -15.051 1.00 0.00 C ATOM 2064 C PRO A 134 11.533 -2.167 -14.573 1.00 0.00 C ATOM 2065 O PRO A 134 12.151 -1.110 -14.441 1.00 0.00 O ATOM 2066 CB PRO A 134 11.709 -3.854 -16.423 1.00 0.00 C ATOM 2067 CG PRO A 134 11.773 -5.343 -16.411 1.00 0.00 C ATOM 2068 CD PRO A 134 11.471 -5.744 -14.980 1.00 0.00 C ATOM 0 HA PRO A 134 13.301 -3.182 -15.048 1.00 0.00 H new ATOM 0 HB2 PRO A 134 10.689 -3.503 -16.578 1.00 0.00 H new ATOM 0 HB3 PRO A 134 12.315 -3.438 -17.228 1.00 0.00 H new ATOM 0 HG2 PRO A 134 11.048 -5.774 -17.102 1.00 0.00 H new ATOM 0 HG3 PRO A 134 12.757 -5.697 -16.720 1.00 0.00 H new ATOM 0 HD2 PRO A 134 10.407 -5.922 -14.828 1.00 0.00 H new ATOM 0 HD3 PRO A 134 11.991 -6.660 -14.700 1.00 0.00 H new ATOM 2076 N CYS A 135 10.235 -2.283 -14.316 1.00 0.00 N ATOM 2077 CA CYS A 135 9.443 -1.149 -13.853 1.00 0.00 C ATOM 2078 C CYS A 135 9.063 -1.314 -12.385 1.00 0.00 C ATOM 2079 O CYS A 135 7.882 -1.343 -12.038 1.00 0.00 O ATOM 2080 CB CYS A 135 8.182 -0.998 -14.705 1.00 0.00 C ATOM 2081 SG CYS A 135 8.486 -1.036 -16.487 1.00 0.00 S ATOM 0 H CYS A 135 9.709 -3.150 -14.420 1.00 0.00 H new ATOM 0 HA CYS A 135 10.050 -0.249 -13.953 1.00 0.00 H new ATOM 0 HB2 CYS A 135 7.486 -1.797 -14.449 1.00 0.00 H new ATOM 0 HB3 CYS A 135 7.695 -0.057 -14.450 1.00 0.00 H new ATOM 0 HG CYS A 135 7.360 -0.903 -17.122 1.00 0.00 H new ATOM 2087 N LEU A 136 10.071 -1.423 -11.527 1.00 0.00 N ATOM 2088 CA LEU A 136 9.844 -1.587 -10.095 1.00 0.00 C ATOM 2089 C LEU A 136 9.591 -0.240 -9.426 1.00 0.00 C ATOM 2090 O LEU A 136 9.711 0.810 -10.057 1.00 0.00 O ATOM 2091 CB LEU A 136 11.044 -2.276 -9.444 1.00 0.00 C ATOM 2092 CG LEU A 136 10.817 -3.711 -8.966 1.00 0.00 C ATOM 2093 CD1 LEU A 136 12.052 -4.238 -8.253 1.00 0.00 C ATOM 2094 CD2 LEU A 136 9.601 -3.783 -8.055 1.00 0.00 C ATOM 0 H LEU A 136 11.054 -1.401 -11.798 1.00 0.00 H new ATOM 0 HA LEU A 136 8.959 -2.210 -9.961 1.00 0.00 H new ATOM 0 HB2 LEU A 136 11.868 -2.278 -10.158 1.00 0.00 H new ATOM 0 HB3 LEU A 136 11.363 -1.677 -8.591 1.00 0.00 H new ATOM 0 HG LEU A 136 10.631 -4.339 -9.837 1.00 0.00 H new ATOM 0 HD11 LEU A 136 11.872 -5.260 -7.920 1.00 0.00 H new ATOM 0 HD12 LEU A 136 12.901 -4.224 -8.937 1.00 0.00 H new ATOM 0 HD13 LEU A 136 12.270 -3.609 -7.390 1.00 0.00 H new ATOM 0 HD21 LEU A 136 9.454 -4.811 -7.724 1.00 0.00 H new ATOM 0 HD22 LEU A 136 9.758 -3.142 -7.188 1.00 0.00 H new ATOM 0 HD23 LEU A 136 8.718 -3.448 -8.599 1.00 0.00 H new ATOM 2106 N SER A 137 9.243 -0.278 -8.144 1.00 0.00 N ATOM 2107 CA SER A 137 8.972 0.940 -7.389 1.00 0.00 C ATOM 2108 C SER A 137 10.138 1.277 -6.465 1.00 0.00 C ATOM 2109 O SER A 137 10.967 0.429 -6.135 1.00 0.00 O ATOM 2110 CB SER A 137 7.688 0.784 -6.572 1.00 0.00 C ATOM 2111 OG SER A 137 7.870 1.240 -5.243 1.00 0.00 O ATOM 0 H SER A 137 9.142 -1.139 -7.606 1.00 0.00 H new ATOM 0 HA SER A 137 8.845 1.757 -8.099 1.00 0.00 H new ATOM 0 HB2 SER A 137 6.882 1.345 -7.045 1.00 0.00 H new ATOM 0 HB3 SER A 137 7.385 -0.263 -6.562 1.00 0.00 H new ATOM 0 HG SER A 137 7.805 0.482 -4.625 1.00 0.00 H new ATOM 2117 N PRO A 138 10.204 2.546 -6.036 1.00 0.00 N ATOM 2118 CA PRO A 138 11.263 3.026 -5.144 1.00 0.00 C ATOM 2119 C PRO A 138 11.139 2.454 -3.736 1.00 0.00 C ATOM 2120 O PRO A 138 10.372 2.958 -2.915 1.00 0.00 O ATOM 2121 CB PRO A 138 11.052 4.542 -5.125 1.00 0.00 C ATOM 2122 CG PRO A 138 9.610 4.727 -5.449 1.00 0.00 C ATOM 2123 CD PRO A 138 9.249 3.611 -6.389 1.00 0.00 C ATOM 0 HA PRO A 138 12.252 2.724 -5.488 1.00 0.00 H new ATOM 0 HB2 PRO A 138 11.296 4.964 -4.150 1.00 0.00 H new ATOM 0 HB3 PRO A 138 11.689 5.040 -5.856 1.00 0.00 H new ATOM 0 HG2 PRO A 138 9.000 4.690 -4.547 1.00 0.00 H new ATOM 0 HG3 PRO A 138 9.436 5.698 -5.912 1.00 0.00 H new ATOM 0 HD2 PRO A 138 8.217 3.287 -6.251 1.00 0.00 H new ATOM 0 HD3 PRO A 138 9.352 3.914 -7.431 1.00 0.00 H new ATOM 2131 N LYS A 139 11.898 1.398 -3.462 1.00 0.00 N ATOM 2132 CA LYS A 139 11.875 0.757 -2.153 1.00 0.00 C ATOM 2133 C LYS A 139 12.707 1.546 -1.146 1.00 0.00 C ATOM 2134 O LYS A 139 13.699 2.178 -1.507 1.00 0.00 O ATOM 2135 CB LYS A 139 12.402 -0.676 -2.254 1.00 0.00 C ATOM 2136 CG LYS A 139 11.307 -1.715 -2.424 1.00 0.00 C ATOM 2137 CD LYS A 139 11.760 -3.085 -1.946 1.00 0.00 C ATOM 2138 CE LYS A 139 11.585 -4.139 -3.028 1.00 0.00 C ATOM 2139 NZ LYS A 139 12.759 -4.195 -3.943 1.00 0.00 N ATOM 0 H LYS A 139 12.537 0.968 -4.130 1.00 0.00 H new ATOM 0 HA LYS A 139 10.842 0.734 -1.806 1.00 0.00 H new ATOM 0 HB2 LYS A 139 13.089 -0.743 -3.097 1.00 0.00 H new ATOM 0 HB3 LYS A 139 12.975 -0.908 -1.356 1.00 0.00 H new ATOM 0 HG2 LYS A 139 10.423 -1.408 -1.866 1.00 0.00 H new ATOM 0 HG3 LYS A 139 11.018 -1.772 -3.473 1.00 0.00 H new ATOM 0 HD2 LYS A 139 12.807 -3.039 -1.647 1.00 0.00 H new ATOM 0 HD3 LYS A 139 11.189 -3.371 -1.063 1.00 0.00 H new ATOM 0 HE2 LYS A 139 11.439 -5.115 -2.564 1.00 0.00 H new ATOM 0 HE3 LYS A 139 10.686 -3.922 -3.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 12.601 -4.925 -4.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 12.883 -3.272 -4.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 13.614 -4.427 -3.398 1.00 0.00 H new ATOM 2153 N SER A 140 12.296 1.503 0.117 1.00 0.00 N ATOM 2154 CA SER A 140 13.002 2.215 1.176 1.00 0.00 C ATOM 2155 C SER A 140 13.033 1.390 2.459 1.00 0.00 C ATOM 2156 O SER A 140 12.606 0.237 2.479 1.00 0.00 O ATOM 2157 CB SER A 140 12.338 3.567 1.441 1.00 0.00 C ATOM 2158 OG SER A 140 13.180 4.407 2.211 1.00 0.00 O ATOM 0 H SER A 140 11.477 0.982 0.432 1.00 0.00 H new ATOM 0 HA SER A 140 14.028 2.381 0.847 1.00 0.00 H new ATOM 0 HB2 SER A 140 12.103 4.052 0.494 1.00 0.00 H new ATOM 0 HB3 SER A 140 11.394 3.416 1.964 1.00 0.00 H new ATOM 0 HG SER A 140 12.733 5.265 2.365 1.00 0.00 H new