USER MOD reduce.3.24.130724 H: found=0, std=0, add=956, rem=0, adj=28 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 52 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 120 TYR OH : rot -141:sc= -1.27 USER MOD Set 2.1: A 102 GLN : amide:sc= -1.08 K(o=-0.17,f=-5.9!) USER MOD Set 2.2: A 125 THR OG1 : rot 180:sc= 0.904 USER MOD Set 3.1: A 73 GLN : amide:sc= -0.457 K(o=-1.2,f=-2.8) USER MOD Set 3.2: A 101 HIS : no HD1:sc= -0.727 X(o=-1.2,f=-0.82) USER MOD Set 4.1: A 55 CYS SG : rot 110:sc= -0.813 USER MOD Set 4.2: A 58 MET CE :methyl -147:sc= -3.26 (180deg=-5.05!) USER MOD Set 5.1: A 39 THR OG1 : rot 180:sc= 0.0829 USER MOD Set 5.2: A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 CYS SG : rot 180:sc= -0.248 USER MOD Single : A 25 MET CE :methyl 177:sc= -1.43 (180deg=-1.48) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 36 CYS SG : rot 180:sc= -0.305 USER MOD Single : A 48 TYR OH : rot -171:sc= 0.143 USER MOD Single : A 49 GLN : amide:sc= 0.351 K(o=0.35,f=-1.1) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= -0.0658 K(o=-0.066,f=-2.6!) USER MOD Single : A 63 HIS : no HD1:sc= -3.95! C(o=-3.9!,f=-8.1!) USER MOD Single : A 64 CYS SG : rot 180:sc= -0.236 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.0353 K(o=-0.035,f=-4.1!) USER MOD Single : A 69 ASN : amide:sc= -1.59! C(o=-1.6!,f=-10!) USER MOD Single : A 75 THR OG1 : rot 28:sc= 0.222 USER MOD Single : A 77 MET CE :methyl 173:sc= -0.0705 (180deg=-0.192) USER MOD Single : A 79 ASN : amide:sc= -0.109 K(o=-0.11,f=-0.79) USER MOD Single : A 80 LYS NZ :NH3+ -167:sc= -0.0437 (180deg=-0.271) USER MOD Single : A 81 SER OG : rot 180:sc= -0.0338 USER MOD Single : A 83 ASN : amide:sc= -0.107 X(o=-0.11,f=-0.33) USER MOD Single : A 88 ASN : amide:sc= -0.505 K(o=-0.5,f=-8.2!) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0.0604 USER MOD Single : A 105 TYR OH : rot 165:sc= 0 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 TYR OH : rot 90:sc= -0.046 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 -107:sc= 1.25 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 8.266 -18.402 -10.400 1.00 0.00 N ATOM 157 CA GLY A 15 6.881 -18.280 -9.984 1.00 0.00 C ATOM 158 C GLY A 15 6.375 -16.854 -10.066 1.00 0.00 C ATOM 159 O GLY A 15 7.163 -15.908 -10.087 1.00 0.00 O ATOM 0 HA2 GLY A 15 6.259 -18.920 -10.610 1.00 0.00 H new ATOM 0 HA3 GLY A 15 6.779 -18.640 -8.960 1.00 0.00 H new ATOM 163 N ARG A 16 5.056 -16.698 -10.115 1.00 0.00 N ATOM 164 CA ARG A 16 4.445 -15.377 -10.199 1.00 0.00 C ATOM 165 C ARG A 16 4.637 -14.606 -8.896 1.00 0.00 C ATOM 166 O ARG A 16 4.940 -15.190 -7.856 1.00 0.00 O ATOM 167 CB ARG A 16 2.954 -15.500 -10.516 1.00 0.00 C ATOM 168 CG ARG A 16 2.653 -15.589 -12.004 1.00 0.00 C ATOM 169 CD ARG A 16 2.586 -17.034 -12.473 1.00 0.00 C ATOM 170 NE ARG A 16 2.854 -17.158 -13.903 1.00 0.00 N ATOM 171 CZ ARG A 16 3.084 -18.317 -14.510 1.00 0.00 C ATOM 172 NH1 ARG A 16 3.079 -19.445 -13.814 1.00 0.00 N ATOM 173 NH2 ARG A 16 3.320 -18.348 -15.815 1.00 0.00 N ATOM 0 H ARG A 16 4.390 -17.470 -10.098 1.00 0.00 H new ATOM 0 HA ARG A 16 4.936 -14.828 -11.002 1.00 0.00 H new ATOM 0 HB2 ARG A 16 2.558 -16.386 -10.020 1.00 0.00 H new ATOM 0 HB3 ARG A 16 2.430 -14.640 -10.099 1.00 0.00 H new ATOM 0 HG2 ARG A 16 1.706 -15.092 -12.215 1.00 0.00 H new ATOM 0 HG3 ARG A 16 3.423 -15.059 -12.564 1.00 0.00 H new ATOM 0 HD2 ARG A 16 3.309 -17.630 -11.916 1.00 0.00 H new ATOM 0 HD3 ARG A 16 1.599 -17.441 -12.252 1.00 0.00 H new ATOM 0 HE ARG A 16 2.865 -16.308 -14.467 1.00 0.00 H new ATOM 0 HH11 ARG A 16 2.898 -19.424 -12.810 1.00 0.00 H new ATOM 0 HH12 ARG A 16 3.256 -20.334 -14.282 1.00 0.00 H new ATOM 0 HH21 ARG A 16 3.325 -17.481 -16.353 1.00 0.00 H new ATOM 0 HH22 ARG A 16 3.497 -19.238 -16.280 1.00 0.00 H new ATOM 187 N SER A 17 4.457 -13.290 -8.961 1.00 0.00 N ATOM 188 CA SER A 17 4.615 -12.439 -7.787 1.00 0.00 C ATOM 189 C SER A 17 3.661 -11.249 -7.848 1.00 0.00 C ATOM 190 O SER A 17 3.853 -10.326 -8.639 1.00 0.00 O ATOM 191 CB SER A 17 6.059 -11.945 -7.679 1.00 0.00 C ATOM 192 OG SER A 17 6.795 -12.721 -6.750 1.00 0.00 O ATOM 0 H SER A 17 4.202 -12.791 -9.813 1.00 0.00 H new ATOM 0 HA SER A 17 4.375 -13.031 -6.904 1.00 0.00 H new ATOM 0 HB2 SER A 17 6.537 -11.993 -8.657 1.00 0.00 H new ATOM 0 HB3 SER A 17 6.067 -10.899 -7.371 1.00 0.00 H new ATOM 0 HG SER A 17 7.715 -12.386 -6.700 1.00 0.00 H new ATOM 198 N TRP A 18 2.634 -11.279 -7.006 1.00 0.00 N ATOM 199 CA TRP A 18 1.650 -10.204 -6.963 1.00 0.00 C ATOM 200 C TRP A 18 2.331 -8.848 -6.815 1.00 0.00 C ATOM 201 O TRP A 18 3.524 -8.772 -6.516 1.00 0.00 O ATOM 202 CB TRP A 18 0.672 -10.426 -5.808 1.00 0.00 C ATOM 203 CG TRP A 18 -0.227 -11.609 -6.010 1.00 0.00 C ATOM 204 CD1 TRP A 18 0.069 -12.916 -5.750 1.00 0.00 C ATOM 205 CD2 TRP A 18 -1.566 -11.591 -6.517 1.00 0.00 C ATOM 206 NE1 TRP A 18 -1.006 -13.712 -6.064 1.00 0.00 N ATOM 207 CE2 TRP A 18 -2.022 -12.923 -6.536 1.00 0.00 C ATOM 208 CE3 TRP A 18 -2.425 -10.579 -6.954 1.00 0.00 C ATOM 209 CZ2 TRP A 18 -3.297 -13.267 -6.976 1.00 0.00 C ATOM 210 CZ3 TRP A 18 -3.690 -10.921 -7.391 1.00 0.00 C ATOM 211 CH2 TRP A 18 -4.117 -12.256 -7.398 1.00 0.00 C ATOM 0 H TRP A 18 2.461 -12.036 -6.344 1.00 0.00 H new ATOM 0 HA TRP A 18 1.099 -10.212 -7.903 1.00 0.00 H new ATOM 0 HB2 TRP A 18 1.236 -10.560 -4.885 1.00 0.00 H new ATOM 0 HB3 TRP A 18 0.061 -9.532 -5.681 1.00 0.00 H new ATOM 0 HD1 TRP A 18 1.009 -13.272 -5.356 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -1.042 -14.726 -5.962 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -2.105 -9.547 -6.950 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -3.627 -14.295 -6.984 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -4.361 -10.147 -7.733 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -5.113 -12.491 -7.743 1.00 0.00 H new ATOM 222 N CYS A 19 1.568 -7.781 -7.025 1.00 0.00 N ATOM 223 CA CYS A 19 2.099 -6.427 -6.915 1.00 0.00 C ATOM 224 C CYS A 19 0.983 -5.394 -7.029 1.00 0.00 C ATOM 225 O CYS A 19 -0.197 -5.743 -7.079 1.00 0.00 O ATOM 226 CB CYS A 19 3.152 -6.181 -7.996 1.00 0.00 C ATOM 227 SG CYS A 19 2.473 -6.022 -9.665 1.00 0.00 S ATOM 0 H CYS A 19 0.580 -7.827 -7.272 1.00 0.00 H new ATOM 0 HA CYS A 19 2.565 -6.324 -5.935 1.00 0.00 H new ATOM 0 HB2 CYS A 19 3.703 -5.273 -7.751 1.00 0.00 H new ATOM 0 HB3 CYS A 19 3.869 -7.002 -7.984 1.00 0.00 H new ATOM 0 HG CYS A 19 3.440 -5.814 -10.509 1.00 0.00 H new ATOM 233 N LEU A 20 1.364 -4.122 -7.069 1.00 0.00 N ATOM 234 CA LEU A 20 0.395 -3.037 -7.176 1.00 0.00 C ATOM 235 C LEU A 20 0.634 -2.216 -8.439 1.00 0.00 C ATOM 236 O LEU A 20 1.120 -1.087 -8.374 1.00 0.00 O ATOM 237 CB LEU A 20 0.473 -2.133 -5.944 1.00 0.00 C ATOM 238 CG LEU A 20 -0.042 -2.735 -4.636 1.00 0.00 C ATOM 239 CD1 LEU A 20 0.165 -1.765 -3.484 1.00 0.00 C ATOM 240 CD2 LEU A 20 -1.512 -3.108 -4.764 1.00 0.00 C ATOM 0 H LEU A 20 2.336 -3.817 -7.029 1.00 0.00 H new ATOM 0 HA LEU A 20 -0.601 -3.477 -7.234 1.00 0.00 H new ATOM 0 HB2 LEU A 20 1.512 -1.837 -5.800 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -0.092 -1.223 -6.149 1.00 0.00 H new ATOM 0 HG LEU A 20 0.526 -3.641 -4.427 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -0.208 -2.211 -2.562 1.00 0.00 H new ATOM 0 HD12 LEU A 20 1.228 -1.547 -3.378 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -0.377 -0.841 -3.685 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -1.862 -3.535 -3.824 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -2.095 -2.217 -4.997 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -1.633 -3.840 -5.563 1.00 0.00 H new ATOM 252 N ARG A 21 0.287 -2.790 -9.586 1.00 0.00 N ATOM 253 CA ARG A 21 0.463 -2.111 -10.864 1.00 0.00 C ATOM 254 C ARG A 21 -0.158 -0.717 -10.829 1.00 0.00 C ATOM 255 O ARG A 21 -1.375 -0.571 -10.713 1.00 0.00 O ATOM 256 CB ARG A 21 -0.164 -2.932 -11.993 1.00 0.00 C ATOM 257 CG ARG A 21 0.382 -2.591 -13.370 1.00 0.00 C ATOM 258 CD ARG A 21 0.205 -3.747 -14.341 1.00 0.00 C ATOM 259 NE ARG A 21 -0.423 -3.322 -15.590 1.00 0.00 N ATOM 260 CZ ARG A 21 -0.348 -4.012 -16.722 1.00 0.00 C ATOM 261 NH1 ARG A 21 0.323 -5.155 -16.763 1.00 0.00 N ATOM 262 NH2 ARG A 21 -0.946 -3.559 -17.817 1.00 0.00 N ATOM 0 H ARG A 21 -0.118 -3.724 -9.657 1.00 0.00 H new ATOM 0 HA ARG A 21 1.532 -2.009 -11.049 1.00 0.00 H new ATOM 0 HB2 ARG A 21 0.004 -3.991 -11.797 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -1.243 -2.774 -11.990 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -0.128 -1.708 -13.756 1.00 0.00 H new ATOM 0 HG3 ARG A 21 1.440 -2.339 -13.291 1.00 0.00 H new ATOM 0 HD2 ARG A 21 1.177 -4.191 -14.557 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -0.403 -4.522 -13.875 1.00 0.00 H new ATOM 0 HE ARG A 21 -0.948 -2.447 -15.592 1.00 0.00 H new ATOM 0 HH11 ARG A 21 0.783 -5.507 -15.923 1.00 0.00 H new ATOM 0 HH12 ARG A 21 0.379 -5.683 -17.634 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -1.463 -2.680 -17.789 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -0.888 -4.089 -18.686 1.00 0.00 H new ATOM 276 N ARG A 22 0.687 0.304 -10.931 1.00 0.00 N ATOM 277 CA ARG A 22 0.222 1.685 -10.909 1.00 0.00 C ATOM 278 C ARG A 22 -0.710 1.964 -12.085 1.00 0.00 C ATOM 279 O ARG A 22 -0.352 1.740 -13.241 1.00 0.00 O ATOM 280 CB ARG A 22 1.411 2.647 -10.948 1.00 0.00 C ATOM 281 CG ARG A 22 1.011 4.112 -10.891 1.00 0.00 C ATOM 282 CD ARG A 22 0.620 4.528 -9.482 1.00 0.00 C ATOM 283 NE ARG A 22 1.690 5.262 -8.810 1.00 0.00 N ATOM 284 CZ ARG A 22 1.922 6.556 -8.996 1.00 0.00 C ATOM 285 NH1 ARG A 22 1.163 7.257 -9.828 1.00 0.00 N ATOM 286 NH2 ARG A 22 2.915 7.153 -8.349 1.00 0.00 N ATOM 0 H ARG A 22 1.697 0.200 -11.030 1.00 0.00 H new ATOM 0 HA ARG A 22 -0.332 1.840 -9.983 1.00 0.00 H new ATOM 0 HB2 ARG A 22 2.073 2.427 -10.111 1.00 0.00 H new ATOM 0 HB3 ARG A 22 1.981 2.470 -11.860 1.00 0.00 H new ATOM 0 HG2 ARG A 22 1.839 4.730 -11.237 1.00 0.00 H new ATOM 0 HG3 ARG A 22 0.176 4.289 -11.569 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -0.275 5.149 -9.523 1.00 0.00 H new ATOM 0 HD3 ARG A 22 0.367 3.642 -8.900 1.00 0.00 H new ATOM 0 HE ARG A 22 2.291 4.752 -8.163 1.00 0.00 H new ATOM 0 HH11 ARG A 22 0.399 6.802 -10.327 1.00 0.00 H new ATOM 0 HH12 ARG A 22 1.344 8.251 -9.969 1.00 0.00 H new ATOM 0 HH21 ARG A 22 3.501 6.618 -7.708 1.00 0.00 H new ATOM 0 HH22 ARG A 22 3.092 8.147 -8.493 1.00 0.00 H new ATOM 300 N VAL A 23 -1.908 2.453 -11.780 1.00 0.00 N ATOM 301 CA VAL A 23 -2.892 2.762 -12.811 1.00 0.00 C ATOM 302 C VAL A 23 -2.460 3.968 -13.639 1.00 0.00 C ATOM 303 O VAL A 23 -2.302 5.069 -13.115 1.00 0.00 O ATOM 304 CB VAL A 23 -4.277 3.044 -12.199 1.00 0.00 C ATOM 305 CG1 VAL A 23 -5.277 3.409 -13.285 1.00 0.00 C ATOM 306 CG2 VAL A 23 -4.760 1.842 -11.400 1.00 0.00 C ATOM 0 H VAL A 23 -2.220 2.644 -10.828 1.00 0.00 H new ATOM 0 HA VAL A 23 -2.960 1.886 -13.456 1.00 0.00 H new ATOM 0 HB VAL A 23 -4.189 3.892 -11.520 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -6.249 3.605 -12.833 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.935 4.301 -13.810 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.365 2.583 -13.991 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.740 2.058 -10.974 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.832 0.974 -12.056 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -4.054 1.632 -10.597 1.00 0.00 H new ATOM 316 N GLY A 24 -2.271 3.750 -14.937 1.00 0.00 N ATOM 317 CA GLY A 24 -1.859 4.828 -15.817 1.00 0.00 C ATOM 318 C GLY A 24 -0.367 4.821 -16.083 1.00 0.00 C ATOM 319 O GLY A 24 0.077 5.167 -17.178 1.00 0.00 O ATOM 0 H GLY A 24 -2.396 2.847 -15.394 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -2.394 4.745 -16.763 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -2.141 5.783 -15.374 1.00 0.00 H new ATOM 323 N MET A 25 0.410 4.428 -15.079 1.00 0.00 N ATOM 324 CA MET A 25 1.862 4.379 -15.211 1.00 0.00 C ATOM 325 C MET A 25 2.358 2.936 -15.216 1.00 0.00 C ATOM 326 O MET A 25 1.939 2.123 -14.393 1.00 0.00 O ATOM 327 CB MET A 25 2.525 5.155 -14.071 1.00 0.00 C ATOM 328 CG MET A 25 2.694 6.637 -14.363 1.00 0.00 C ATOM 329 SD MET A 25 2.641 7.649 -12.871 1.00 0.00 S ATOM 330 CE MET A 25 3.810 6.778 -11.830 1.00 0.00 C ATOM 0 H MET A 25 0.059 4.139 -14.166 1.00 0.00 H new ATOM 0 HA MET A 25 2.132 4.841 -16.160 1.00 0.00 H new ATOM 0 HB2 MET A 25 1.928 5.037 -13.167 1.00 0.00 H new ATOM 0 HB3 MET A 25 3.503 4.719 -13.866 1.00 0.00 H new ATOM 0 HG2 MET A 25 3.644 6.797 -14.872 1.00 0.00 H new ATOM 0 HG3 MET A 25 1.908 6.961 -15.045 1.00 0.00 H new ATOM 0 HE1 MET A 25 3.928 7.314 -10.888 1.00 0.00 H new ATOM 0 HE2 MET A 25 3.441 5.772 -11.631 1.00 0.00 H new ATOM 0 HE3 MET A 25 4.773 6.718 -12.336 1.00 0.00 H new ATOM 340 N SER A 26 3.253 2.626 -16.149 1.00 0.00 N ATOM 341 CA SER A 26 3.803 1.281 -16.264 1.00 0.00 C ATOM 342 C SER A 26 4.975 1.090 -15.306 1.00 0.00 C ATOM 343 O SER A 26 5.606 0.034 -15.283 1.00 0.00 O ATOM 344 CB SER A 26 4.254 1.012 -17.701 1.00 0.00 C ATOM 345 OG SER A 26 5.338 1.851 -18.060 1.00 0.00 O ATOM 0 H SER A 26 3.612 3.289 -16.836 1.00 0.00 H new ATOM 0 HA SER A 26 3.020 0.571 -15.998 1.00 0.00 H new ATOM 0 HB2 SER A 26 4.549 -0.032 -17.804 1.00 0.00 H new ATOM 0 HB3 SER A 26 3.421 1.177 -18.384 1.00 0.00 H new ATOM 0 HG SER A 26 5.609 1.659 -18.982 1.00 0.00 H new ATOM 351 N ALA A 27 5.261 2.121 -14.518 1.00 0.00 N ATOM 352 CA ALA A 27 6.356 2.067 -13.557 1.00 0.00 C ATOM 353 C ALA A 27 5.836 2.173 -12.127 1.00 0.00 C ATOM 354 O ALA A 27 4.629 2.235 -11.897 1.00 0.00 O ATOM 355 CB ALA A 27 7.360 3.175 -13.839 1.00 0.00 C ATOM 0 H ALA A 27 4.750 3.004 -14.526 1.00 0.00 H new ATOM 0 HA ALA A 27 6.855 1.104 -13.664 1.00 0.00 H new ATOM 0 HB1 ALA A 27 8.172 3.123 -13.114 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.763 3.054 -14.845 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.865 4.143 -13.761 1.00 0.00 H new ATOM 361 N GLY A 28 6.757 2.193 -11.168 1.00 0.00 N ATOM 362 CA GLY A 28 6.372 2.290 -9.772 1.00 0.00 C ATOM 363 C GLY A 28 5.520 1.120 -9.322 1.00 0.00 C ATOM 364 O GLY A 28 4.584 1.289 -8.541 1.00 0.00 O ATOM 0 H GLY A 28 7.762 2.144 -11.333 1.00 0.00 H new ATOM 0 HA2 GLY A 28 7.268 2.341 -9.154 1.00 0.00 H new ATOM 0 HA3 GLY A 28 5.822 3.218 -9.614 1.00 0.00 H new ATOM 368 N TRP A 29 5.842 -0.069 -9.818 1.00 0.00 N ATOM 369 CA TRP A 29 5.097 -1.272 -9.464 1.00 0.00 C ATOM 370 C TRP A 29 5.569 -1.831 -8.126 1.00 0.00 C ATOM 371 O TRP A 29 6.696 -2.315 -8.007 1.00 0.00 O ATOM 372 CB TRP A 29 5.251 -2.332 -10.556 1.00 0.00 C ATOM 373 CG TRP A 29 4.636 -1.932 -11.863 1.00 0.00 C ATOM 374 CD1 TRP A 29 4.048 -0.736 -12.160 1.00 0.00 C ATOM 375 CD2 TRP A 29 4.546 -2.731 -13.048 1.00 0.00 C ATOM 376 NE1 TRP A 29 3.598 -0.743 -13.458 1.00 0.00 N ATOM 377 CE2 TRP A 29 3.893 -1.955 -14.025 1.00 0.00 C ATOM 378 CE3 TRP A 29 4.957 -4.025 -13.380 1.00 0.00 C ATOM 379 CZ2 TRP A 29 3.640 -2.432 -15.308 1.00 0.00 C ATOM 380 CZ3 TRP A 29 4.705 -4.497 -14.654 1.00 0.00 C ATOM 381 CH2 TRP A 29 4.053 -3.703 -15.605 1.00 0.00 C ATOM 0 H TRP A 29 6.614 -0.226 -10.466 1.00 0.00 H new ATOM 0 HA TRP A 29 4.044 -1.004 -9.373 1.00 0.00 H new ATOM 0 HB2 TRP A 29 6.311 -2.535 -10.708 1.00 0.00 H new ATOM 0 HB3 TRP A 29 4.794 -3.262 -10.217 1.00 0.00 H new ATOM 0 HD1 TRP A 29 3.951 0.093 -11.475 1.00 0.00 H new ATOM 0 HE1 TRP A 29 3.121 0.029 -13.924 1.00 0.00 H new ATOM 0 HE3 TRP A 29 5.462 -4.645 -12.654 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 3.136 -1.821 -16.043 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 5.017 -5.496 -14.921 1.00 0.00 H new ATOM 0 HH2 TRP A 29 3.872 -4.101 -16.593 1.00 0.00 H new ATOM 392 N LEU A 30 4.703 -1.760 -7.122 1.00 0.00 N ATOM 393 CA LEU A 30 5.032 -2.260 -5.791 1.00 0.00 C ATOM 394 C LEU A 30 4.911 -3.779 -5.735 1.00 0.00 C ATOM 395 O LEU A 30 3.808 -4.323 -5.675 1.00 0.00 O ATOM 396 CB LEU A 30 4.114 -1.625 -4.745 1.00 0.00 C ATOM 397 CG LEU A 30 3.793 -0.143 -4.945 1.00 0.00 C ATOM 398 CD1 LEU A 30 2.838 0.347 -3.867 1.00 0.00 C ATOM 399 CD2 LEU A 30 5.070 0.684 -4.945 1.00 0.00 C ATOM 0 H LEU A 30 3.768 -1.361 -7.203 1.00 0.00 H new ATOM 0 HA LEU A 30 6.065 -1.988 -5.572 1.00 0.00 H new ATOM 0 HB2 LEU A 30 3.176 -2.180 -4.729 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.574 -1.747 -3.765 1.00 0.00 H new ATOM 0 HG LEU A 30 3.307 -0.024 -5.913 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.621 1.403 -4.026 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.911 -0.225 -3.915 1.00 0.00 H new ATOM 0 HD13 LEU A 30 3.296 0.214 -2.887 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.822 1.736 -5.088 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.584 0.559 -3.992 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.719 0.351 -5.754 1.00 0.00 H new ATOM 411 N LEU A 31 6.052 -4.459 -5.751 1.00 0.00 N ATOM 412 CA LEU A 31 6.075 -5.917 -5.699 1.00 0.00 C ATOM 413 C LEU A 31 5.542 -6.423 -4.363 1.00 0.00 C ATOM 414 O LEU A 31 5.838 -5.856 -3.310 1.00 0.00 O ATOM 415 CB LEU A 31 7.498 -6.433 -5.922 1.00 0.00 C ATOM 416 CG LEU A 31 7.690 -7.945 -5.801 1.00 0.00 C ATOM 417 CD1 LEU A 31 7.507 -8.616 -7.153 1.00 0.00 C ATOM 418 CD2 LEU A 31 9.063 -8.263 -5.227 1.00 0.00 C ATOM 0 H LEU A 31 6.973 -4.024 -5.800 1.00 0.00 H new ATOM 0 HA LEU A 31 5.430 -6.294 -6.493 1.00 0.00 H new ATOM 0 HB2 LEU A 31 7.824 -6.124 -6.915 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.157 -5.945 -5.204 1.00 0.00 H new ATOM 0 HG LEU A 31 6.934 -8.335 -5.120 1.00 0.00 H new ATOM 0 HD11 LEU A 31 7.647 -9.692 -7.047 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.502 -8.416 -7.525 1.00 0.00 H new ATOM 0 HD13 LEU A 31 8.240 -8.222 -7.857 1.00 0.00 H new ATOM 0 HD21 LEU A 31 9.183 -9.343 -5.148 1.00 0.00 H new ATOM 0 HD22 LEU A 31 9.834 -7.860 -5.883 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.157 -7.814 -4.238 1.00 0.00 H new ATOM 430 N LEU A 32 4.757 -7.493 -4.412 1.00 0.00 N ATOM 431 CA LEU A 32 4.184 -8.078 -3.204 1.00 0.00 C ATOM 432 C LEU A 32 4.697 -9.498 -2.990 1.00 0.00 C ATOM 433 O LEU A 32 3.954 -10.466 -3.146 1.00 0.00 O ATOM 434 CB LEU A 32 2.657 -8.083 -3.291 1.00 0.00 C ATOM 435 CG LEU A 32 1.979 -6.712 -3.276 1.00 0.00 C ATOM 436 CD1 LEU A 32 0.541 -6.822 -3.760 1.00 0.00 C ATOM 437 CD2 LEU A 32 2.028 -6.109 -1.880 1.00 0.00 C ATOM 0 H LEU A 32 4.502 -7.974 -5.275 1.00 0.00 H new ATOM 0 HA LEU A 32 4.492 -7.469 -2.354 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.367 -8.599 -4.206 1.00 0.00 H new ATOM 0 HB3 LEU A 32 2.268 -8.668 -2.458 1.00 0.00 H new ATOM 0 HG LEU A 32 2.520 -6.053 -3.955 1.00 0.00 H new ATOM 0 HD11 LEU A 32 0.075 -5.837 -3.742 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.529 -7.211 -4.778 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.012 -7.497 -3.107 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.541 -5.134 -1.888 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.512 -6.767 -1.181 1.00 0.00 H new ATOM 0 HD23 LEU A 32 3.067 -5.994 -1.570 1.00 0.00 H new ATOM 449 N GLU A 33 5.972 -9.613 -2.631 1.00 0.00 N ATOM 450 CA GLU A 33 6.583 -10.916 -2.394 1.00 0.00 C ATOM 451 C GLU A 33 5.811 -11.695 -1.334 1.00 0.00 C ATOM 452 O GLU A 33 5.268 -11.114 -0.394 1.00 0.00 O ATOM 453 CB GLU A 33 8.041 -10.748 -1.959 1.00 0.00 C ATOM 454 CG GLU A 33 9.017 -11.587 -2.765 1.00 0.00 C ATOM 455 CD GLU A 33 9.490 -12.816 -2.013 1.00 0.00 C ATOM 456 OE1 GLU A 33 10.293 -12.661 -1.069 1.00 0.00 O ATOM 457 OE2 GLU A 33 9.058 -13.932 -2.369 1.00 0.00 O ATOM 0 H GLU A 33 6.601 -8.821 -2.498 1.00 0.00 H new ATOM 0 HA GLU A 33 6.552 -11.479 -3.327 1.00 0.00 H new ATOM 0 HB2 GLU A 33 8.319 -9.698 -2.047 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.130 -11.014 -0.906 1.00 0.00 H new ATOM 0 HG2 GLU A 33 8.542 -11.896 -3.696 1.00 0.00 H new ATOM 0 HG3 GLU A 33 9.879 -10.976 -3.034 1.00 0.00 H new ATOM 464 N ASP A 34 5.765 -13.013 -1.493 1.00 0.00 N ATOM 465 CA ASP A 34 5.059 -13.873 -0.550 1.00 0.00 C ATOM 466 C ASP A 34 5.789 -13.925 0.788 1.00 0.00 C ATOM 467 O ASP A 34 6.930 -14.379 0.868 1.00 0.00 O ATOM 468 CB ASP A 34 4.917 -15.284 -1.123 1.00 0.00 C ATOM 469 CG ASP A 34 4.579 -16.310 -0.058 1.00 0.00 C ATOM 470 OD1 ASP A 34 5.495 -16.713 0.689 1.00 0.00 O ATOM 471 OD2 ASP A 34 3.399 -16.708 0.028 1.00 0.00 O ATOM 0 H ASP A 34 6.208 -13.509 -2.266 1.00 0.00 H new ATOM 0 HA ASP A 34 4.066 -13.454 -0.386 1.00 0.00 H new ATOM 0 HB2 ASP A 34 4.139 -15.287 -1.886 1.00 0.00 H new ATOM 0 HB3 ASP A 34 5.847 -15.568 -1.615 1.00 0.00 H new ATOM 476 N GLY A 35 5.122 -13.457 1.839 1.00 0.00 N ATOM 477 CA GLY A 35 5.723 -13.458 3.160 1.00 0.00 C ATOM 478 C GLY A 35 6.538 -12.208 3.427 1.00 0.00 C ATOM 479 O GLY A 35 7.359 -12.179 4.344 1.00 0.00 O ATOM 0 H GLY A 35 4.176 -13.077 1.799 1.00 0.00 H new ATOM 0 HA2 GLY A 35 4.939 -13.544 3.912 1.00 0.00 H new ATOM 0 HA3 GLY A 35 6.363 -14.334 3.264 1.00 0.00 H new ATOM 483 N CYS A 36 6.313 -11.174 2.624 1.00 0.00 N ATOM 484 CA CYS A 36 7.035 -9.916 2.777 1.00 0.00 C ATOM 485 C CYS A 36 6.066 -8.752 2.959 1.00 0.00 C ATOM 486 O CYS A 36 5.274 -8.446 2.069 1.00 0.00 O ATOM 487 CB CYS A 36 7.928 -9.666 1.561 1.00 0.00 C ATOM 488 SG CYS A 36 9.441 -10.656 1.541 1.00 0.00 S ATOM 0 H CYS A 36 5.637 -11.182 1.861 1.00 0.00 H new ATOM 0 HA CYS A 36 7.658 -9.989 3.668 1.00 0.00 H new ATOM 0 HB2 CYS A 36 7.358 -9.875 0.656 1.00 0.00 H new ATOM 0 HB3 CYS A 36 8.197 -8.610 1.532 1.00 0.00 H new ATOM 0 HG CYS A 36 10.129 -10.376 0.474 1.00 0.00 H new ATOM 494 N GLU A 37 6.135 -8.108 4.120 1.00 0.00 N ATOM 495 CA GLU A 37 5.262 -6.979 4.420 1.00 0.00 C ATOM 496 C GLU A 37 5.512 -5.826 3.452 1.00 0.00 C ATOM 497 O GLU A 37 6.651 -5.553 3.075 1.00 0.00 O ATOM 498 CB GLU A 37 5.477 -6.507 5.859 1.00 0.00 C ATOM 499 CG GLU A 37 4.467 -7.074 6.843 1.00 0.00 C ATOM 500 CD GLU A 37 5.037 -8.205 7.677 1.00 0.00 C ATOM 501 OE1 GLU A 37 5.342 -9.270 7.101 1.00 0.00 O ATOM 502 OE2 GLU A 37 5.177 -8.026 8.905 1.00 0.00 O ATOM 0 H GLU A 37 6.786 -8.349 4.868 1.00 0.00 H new ATOM 0 HA GLU A 37 4.230 -7.310 4.305 1.00 0.00 H new ATOM 0 HB2 GLU A 37 6.480 -6.788 6.179 1.00 0.00 H new ATOM 0 HB3 GLU A 37 5.427 -5.418 5.887 1.00 0.00 H new ATOM 0 HG2 GLU A 37 4.123 -6.278 7.504 1.00 0.00 H new ATOM 0 HG3 GLU A 37 3.595 -7.434 6.296 1.00 0.00 H new ATOM 509 N VAL A 38 4.437 -5.153 3.053 1.00 0.00 N ATOM 510 CA VAL A 38 4.539 -4.029 2.130 1.00 0.00 C ATOM 511 C VAL A 38 3.824 -2.800 2.680 1.00 0.00 C ATOM 512 O VAL A 38 2.626 -2.615 2.462 1.00 0.00 O ATOM 513 CB VAL A 38 3.948 -4.380 0.752 1.00 0.00 C ATOM 514 CG1 VAL A 38 4.063 -3.195 -0.196 1.00 0.00 C ATOM 515 CG2 VAL A 38 4.638 -5.605 0.172 1.00 0.00 C ATOM 0 H VAL A 38 3.486 -5.367 3.354 1.00 0.00 H new ATOM 0 HA VAL A 38 5.600 -3.807 2.016 1.00 0.00 H new ATOM 0 HB VAL A 38 2.891 -4.613 0.879 1.00 0.00 H new ATOM 0 HG11 VAL A 38 3.640 -3.462 -1.165 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.519 -2.345 0.216 1.00 0.00 H new ATOM 0 HG13 VAL A 38 5.113 -2.928 -0.319 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.207 -5.838 -0.802 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.703 -5.403 0.059 1.00 0.00 H new ATOM 0 HG23 VAL A 38 4.499 -6.453 0.843 1.00 0.00 H new ATOM 525 N THR A 39 4.567 -1.960 3.394 1.00 0.00 N ATOM 526 CA THR A 39 4.005 -0.748 3.976 1.00 0.00 C ATOM 527 C THR A 39 4.233 0.455 3.068 1.00 0.00 C ATOM 528 O THR A 39 5.332 0.657 2.551 1.00 0.00 O ATOM 529 CB THR A 39 4.613 -0.454 5.360 1.00 0.00 C ATOM 530 OG1 THR A 39 5.983 -0.061 5.219 1.00 0.00 O ATOM 531 CG2 THR A 39 4.521 -1.676 6.261 1.00 0.00 C ATOM 0 H THR A 39 5.560 -2.097 3.583 1.00 0.00 H new ATOM 0 HA THR A 39 2.934 -0.919 4.087 1.00 0.00 H new ATOM 0 HB THR A 39 4.047 0.358 5.817 1.00 0.00 H new ATOM 0 HG1 THR A 39 6.362 0.126 6.103 1.00 0.00 H new ATOM 0 HG21 THR A 39 4.957 -1.445 7.233 1.00 0.00 H new ATOM 0 HG22 THR A 39 3.475 -1.956 6.389 1.00 0.00 H new ATOM 0 HG23 THR A 39 5.065 -2.504 5.807 1.00 0.00 H new ATOM 539 N VAL A 40 3.187 1.254 2.877 1.00 0.00 N ATOM 540 CA VAL A 40 3.274 2.439 2.032 1.00 0.00 C ATOM 541 C VAL A 40 3.116 3.713 2.854 1.00 0.00 C ATOM 542 O VAL A 40 2.337 3.757 3.805 1.00 0.00 O ATOM 543 CB VAL A 40 2.203 2.419 0.925 1.00 0.00 C ATOM 544 CG1 VAL A 40 2.425 3.563 -0.053 1.00 0.00 C ATOM 545 CG2 VAL A 40 2.210 1.080 0.202 1.00 0.00 C ATOM 0 H VAL A 40 2.270 1.102 3.296 1.00 0.00 H new ATOM 0 HA VAL A 40 4.262 2.427 1.572 1.00 0.00 H new ATOM 0 HB VAL A 40 1.225 2.552 1.387 1.00 0.00 H new ATOM 0 HG11 VAL A 40 1.659 3.533 -0.828 1.00 0.00 H new ATOM 0 HG12 VAL A 40 2.366 4.513 0.479 1.00 0.00 H new ATOM 0 HG13 VAL A 40 3.409 3.464 -0.511 1.00 0.00 H new ATOM 0 HG21 VAL A 40 1.447 1.083 -0.577 1.00 0.00 H new ATOM 0 HG22 VAL A 40 3.189 0.915 -0.249 1.00 0.00 H new ATOM 0 HG23 VAL A 40 1.999 0.281 0.913 1.00 0.00 H new ATOM 555 N GLY A 41 3.861 4.749 2.480 1.00 0.00 N ATOM 556 CA GLY A 41 3.789 6.010 3.194 1.00 0.00 C ATOM 557 C GLY A 41 4.824 7.008 2.713 1.00 0.00 C ATOM 558 O GLY A 41 5.505 6.774 1.715 1.00 0.00 O ATOM 0 H GLY A 41 4.513 4.737 1.696 1.00 0.00 H new ATOM 0 HA2 GLY A 41 2.793 6.437 3.072 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.930 5.829 4.260 1.00 0.00 H new ATOM 562 N ARG A 42 4.941 8.125 3.424 1.00 0.00 N ATOM 563 CA ARG A 42 5.899 9.163 3.063 1.00 0.00 C ATOM 564 C ARG A 42 7.165 9.053 3.908 1.00 0.00 C ATOM 565 O ARG A 42 8.238 9.491 3.496 1.00 0.00 O ATOM 566 CB ARG A 42 5.273 10.548 3.241 1.00 0.00 C ATOM 567 CG ARG A 42 5.065 10.940 4.695 1.00 0.00 C ATOM 568 CD ARG A 42 4.469 12.334 4.816 1.00 0.00 C ATOM 569 NE ARG A 42 4.144 12.671 6.199 1.00 0.00 N ATOM 570 CZ ARG A 42 5.039 13.102 7.081 1.00 0.00 C ATOM 571 NH1 ARG A 42 6.308 13.247 6.725 1.00 0.00 N ATOM 572 NH2 ARG A 42 4.666 13.389 8.321 1.00 0.00 N ATOM 0 H ARG A 42 4.385 8.334 4.253 1.00 0.00 H new ATOM 0 HA ARG A 42 6.169 9.025 2.016 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.911 11.290 2.761 1.00 0.00 H new ATOM 0 HB3 ARG A 42 4.313 10.572 2.726 1.00 0.00 H new ATOM 0 HG2 ARG A 42 4.406 10.218 5.177 1.00 0.00 H new ATOM 0 HG3 ARG A 42 6.018 10.903 5.223 1.00 0.00 H new ATOM 0 HD2 ARG A 42 5.174 13.065 4.421 1.00 0.00 H new ATOM 0 HD3 ARG A 42 3.568 12.397 4.206 1.00 0.00 H new ATOM 0 HE ARG A 42 3.176 12.570 6.505 1.00 0.00 H new ATOM 0 HH11 ARG A 42 6.599 13.027 5.772 1.00 0.00 H new ATOM 0 HH12 ARG A 42 6.993 13.578 7.404 1.00 0.00 H new ATOM 0 HH21 ARG A 42 3.691 13.279 8.599 1.00 0.00 H new ATOM 0 HH22 ARG A 42 5.354 13.720 8.997 1.00 0.00 H new ATOM 586 N GLY A 43 7.031 8.464 5.093 1.00 0.00 N ATOM 587 CA GLY A 43 8.171 8.308 5.977 1.00 0.00 C ATOM 588 C GLY A 43 9.352 7.653 5.289 1.00 0.00 C ATOM 589 O GLY A 43 9.201 7.033 4.236 1.00 0.00 O ATOM 0 H GLY A 43 6.153 8.092 5.456 1.00 0.00 H new ATOM 0 HA2 GLY A 43 8.471 9.286 6.355 1.00 0.00 H new ATOM 0 HA3 GLY A 43 7.879 7.709 6.840 1.00 0.00 H new ATOM 593 N PHE A 44 10.532 7.791 5.884 1.00 0.00 N ATOM 594 CA PHE A 44 11.745 7.209 5.320 1.00 0.00 C ATOM 595 C PHE A 44 12.056 5.864 5.970 1.00 0.00 C ATOM 596 O PHE A 44 13.218 5.494 6.131 1.00 0.00 O ATOM 597 CB PHE A 44 12.927 8.163 5.506 1.00 0.00 C ATOM 598 CG PHE A 44 12.808 9.429 4.706 1.00 0.00 C ATOM 599 CD1 PHE A 44 11.880 10.398 5.051 1.00 0.00 C ATOM 600 CD2 PHE A 44 13.623 9.648 3.607 1.00 0.00 C ATOM 601 CE1 PHE A 44 11.768 11.564 4.317 1.00 0.00 C ATOM 602 CE2 PHE A 44 13.516 10.812 2.869 1.00 0.00 C ATOM 603 CZ PHE A 44 12.587 11.770 3.224 1.00 0.00 C ATOM 0 H PHE A 44 10.674 8.300 6.756 1.00 0.00 H new ATOM 0 HA PHE A 44 11.580 7.048 4.255 1.00 0.00 H new ATOM 0 HB2 PHE A 44 13.016 8.417 6.562 1.00 0.00 H new ATOM 0 HB3 PHE A 44 13.846 7.649 5.224 1.00 0.00 H new ATOM 0 HD1 PHE A 44 11.236 10.241 5.904 1.00 0.00 H new ATOM 0 HD2 PHE A 44 14.350 8.901 3.324 1.00 0.00 H new ATOM 0 HE1 PHE A 44 11.042 12.312 4.598 1.00 0.00 H new ATOM 0 HE2 PHE A 44 14.158 10.972 2.016 1.00 0.00 H new ATOM 0 HZ PHE A 44 12.501 12.679 2.648 1.00 0.00 H new ATOM 613 N GLY A 45 11.007 5.136 6.341 1.00 0.00 N ATOM 614 CA GLY A 45 11.188 3.840 6.969 1.00 0.00 C ATOM 615 C GLY A 45 10.394 2.747 6.282 1.00 0.00 C ATOM 616 O GLY A 45 10.833 1.599 6.215 1.00 0.00 O ATOM 0 H GLY A 45 10.035 5.421 6.218 1.00 0.00 H new ATOM 0 HA2 GLY A 45 12.246 3.578 6.957 1.00 0.00 H new ATOM 0 HA3 GLY A 45 10.887 3.901 8.015 1.00 0.00 H new ATOM 620 N VAL A 46 9.219 3.103 5.771 1.00 0.00 N ATOM 621 CA VAL A 46 8.361 2.143 5.086 1.00 0.00 C ATOM 622 C VAL A 46 9.095 1.480 3.926 1.00 0.00 C ATOM 623 O VAL A 46 10.161 1.935 3.508 1.00 0.00 O ATOM 624 CB VAL A 46 7.082 2.815 4.553 1.00 0.00 C ATOM 625 CG1 VAL A 46 6.142 3.159 5.699 1.00 0.00 C ATOM 626 CG2 VAL A 46 7.429 4.057 3.746 1.00 0.00 C ATOM 0 H VAL A 46 8.840 4.049 5.819 1.00 0.00 H new ATOM 0 HA VAL A 46 8.086 1.384 5.819 1.00 0.00 H new ATOM 0 HB VAL A 46 6.571 2.113 3.894 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.244 3.633 5.303 1.00 0.00 H new ATOM 0 HG12 VAL A 46 5.867 2.248 6.230 1.00 0.00 H new ATOM 0 HG13 VAL A 46 6.641 3.843 6.386 1.00 0.00 H new ATOM 0 HG21 VAL A 46 6.513 4.519 3.377 1.00 0.00 H new ATOM 0 HG22 VAL A 46 7.963 4.765 4.380 1.00 0.00 H new ATOM 0 HG23 VAL A 46 8.060 3.778 2.902 1.00 0.00 H new ATOM 636 N THR A 47 8.518 0.401 3.407 1.00 0.00 N ATOM 637 CA THR A 47 9.116 -0.326 2.295 1.00 0.00 C ATOM 638 C THR A 47 9.052 0.488 1.007 1.00 0.00 C ATOM 639 O THR A 47 9.985 0.472 0.204 1.00 0.00 O ATOM 640 CB THR A 47 8.418 -1.680 2.068 1.00 0.00 C ATOM 641 OG1 THR A 47 8.386 -2.425 3.291 1.00 0.00 O ATOM 642 CG2 THR A 47 9.136 -2.486 0.996 1.00 0.00 C ATOM 0 H THR A 47 7.636 0.011 3.740 1.00 0.00 H new ATOM 0 HA THR A 47 10.159 -0.503 2.558 1.00 0.00 H new ATOM 0 HB THR A 47 7.399 -1.487 1.733 1.00 0.00 H new ATOM 0 HG1 THR A 47 7.939 -3.284 3.139 1.00 0.00 H new ATOM 0 HG21 THR A 47 8.625 -3.438 0.853 1.00 0.00 H new ATOM 0 HG22 THR A 47 9.134 -1.929 0.059 1.00 0.00 H new ATOM 0 HG23 THR A 47 10.165 -2.669 1.307 1.00 0.00 H new ATOM 650 N TYR A 48 7.946 1.198 0.817 1.00 0.00 N ATOM 651 CA TYR A 48 7.759 2.018 -0.375 1.00 0.00 C ATOM 652 C TYR A 48 7.396 3.451 0.001 1.00 0.00 C ATOM 653 O TYR A 48 6.295 3.717 0.483 1.00 0.00 O ATOM 654 CB TYR A 48 6.669 1.419 -1.265 1.00 0.00 C ATOM 655 CG TYR A 48 7.040 0.079 -1.859 1.00 0.00 C ATOM 656 CD1 TYR A 48 8.187 -0.068 -2.628 1.00 0.00 C ATOM 657 CD2 TYR A 48 6.243 -1.039 -1.650 1.00 0.00 C ATOM 658 CE1 TYR A 48 8.529 -1.290 -3.174 1.00 0.00 C ATOM 659 CE2 TYR A 48 6.578 -2.266 -2.190 1.00 0.00 C ATOM 660 CZ TYR A 48 7.721 -2.386 -2.952 1.00 0.00 C ATOM 661 OH TYR A 48 8.060 -3.606 -3.492 1.00 0.00 O ATOM 0 H TYR A 48 7.165 1.223 1.473 1.00 0.00 H new ATOM 0 HA TYR A 48 8.699 2.034 -0.926 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.755 1.308 -0.681 1.00 0.00 H new ATOM 0 HB3 TYR A 48 6.448 2.116 -2.073 1.00 0.00 H new ATOM 0 HD1 TYR A 48 8.823 0.788 -2.802 1.00 0.00 H new ATOM 0 HD2 TYR A 48 5.346 -0.948 -1.055 1.00 0.00 H new ATOM 0 HE1 TYR A 48 9.424 -1.387 -3.771 1.00 0.00 H new ATOM 0 HE2 TYR A 48 5.948 -3.126 -2.016 1.00 0.00 H new ATOM 0 HH TYR A 48 7.321 -4.237 -3.364 1.00 0.00 H new ATOM 671 N GLN A 49 8.329 4.370 -0.223 1.00 0.00 N ATOM 672 CA GLN A 49 8.108 5.776 0.092 1.00 0.00 C ATOM 673 C GLN A 49 7.411 6.489 -1.063 1.00 0.00 C ATOM 674 O GLN A 49 7.637 6.170 -2.231 1.00 0.00 O ATOM 675 CB GLN A 49 9.436 6.466 0.405 1.00 0.00 C ATOM 676 CG GLN A 49 9.309 7.966 0.614 1.00 0.00 C ATOM 677 CD GLN A 49 10.651 8.646 0.800 1.00 0.00 C ATOM 678 OE1 GLN A 49 11.699 8.064 0.519 1.00 0.00 O ATOM 679 NE2 GLN A 49 10.626 9.885 1.276 1.00 0.00 N ATOM 0 H GLN A 49 9.246 4.166 -0.622 1.00 0.00 H new ATOM 0 HA GLN A 49 7.464 5.829 0.970 1.00 0.00 H new ATOM 0 HB2 GLN A 49 9.866 6.018 1.301 1.00 0.00 H new ATOM 0 HB3 GLN A 49 10.134 6.279 -0.411 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.799 8.406 -0.243 1.00 0.00 H new ATOM 0 HG3 GLN A 49 8.686 8.156 1.488 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.734 10.329 1.495 1.00 0.00 H new ATOM 0 HE22 GLN A 49 11.498 10.393 1.422 1.00 0.00 H new ATOM 688 N LEU A 50 6.562 7.455 -0.728 1.00 0.00 N ATOM 689 CA LEU A 50 5.830 8.213 -1.737 1.00 0.00 C ATOM 690 C LEU A 50 5.816 9.700 -1.396 1.00 0.00 C ATOM 691 O LEU A 50 5.495 10.087 -0.273 1.00 0.00 O ATOM 692 CB LEU A 50 4.397 7.692 -1.857 1.00 0.00 C ATOM 693 CG LEU A 50 4.245 6.256 -2.359 1.00 0.00 C ATOM 694 CD1 LEU A 50 2.780 5.851 -2.384 1.00 0.00 C ATOM 695 CD2 LEU A 50 4.865 6.105 -3.741 1.00 0.00 C ATOM 0 H LEU A 50 6.364 7.732 0.234 1.00 0.00 H new ATOM 0 HA LEU A 50 6.338 8.082 -2.693 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.922 7.766 -0.879 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.847 8.351 -2.529 1.00 0.00 H new ATOM 0 HG LEU A 50 4.772 5.594 -1.672 1.00 0.00 H new ATOM 0 HD11 LEU A 50 2.692 4.826 -2.744 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.367 5.919 -1.378 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.230 6.517 -3.048 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.747 5.076 -4.082 1.00 0.00 H new ATOM 0 HD22 LEU A 50 4.367 6.778 -4.439 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.926 6.352 -3.693 1.00 0.00 H new ATOM 707 N VAL A 51 6.165 10.530 -2.375 1.00 0.00 N ATOM 708 CA VAL A 51 6.189 11.974 -2.180 1.00 0.00 C ATOM 709 C VAL A 51 5.415 12.691 -3.280 1.00 0.00 C ATOM 710 O VAL A 51 5.509 12.331 -4.454 1.00 0.00 O ATOM 711 CB VAL A 51 7.631 12.513 -2.148 1.00 0.00 C ATOM 712 CG1 VAL A 51 7.637 14.011 -1.888 1.00 0.00 C ATOM 713 CG2 VAL A 51 8.451 11.778 -1.098 1.00 0.00 C ATOM 0 H VAL A 51 6.435 10.226 -3.311 1.00 0.00 H new ATOM 0 HA VAL A 51 5.714 12.170 -1.219 1.00 0.00 H new ATOM 0 HB VAL A 51 8.087 12.337 -3.122 1.00 0.00 H new ATOM 0 HG11 VAL A 51 8.665 14.373 -1.869 1.00 0.00 H new ATOM 0 HG12 VAL A 51 7.088 14.520 -2.680 1.00 0.00 H new ATOM 0 HG13 VAL A 51 7.163 14.216 -0.928 1.00 0.00 H new ATOM 0 HG21 VAL A 51 9.467 12.172 -1.089 1.00 0.00 H new ATOM 0 HG22 VAL A 51 7.998 11.921 -0.117 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.476 10.714 -1.335 1.00 0.00 H new ATOM 723 N SER A 52 4.649 13.706 -2.894 1.00 0.00 N ATOM 724 CA SER A 52 3.856 14.472 -3.847 1.00 0.00 C ATOM 725 C SER A 52 4.177 15.960 -3.751 1.00 0.00 C ATOM 726 O SER A 52 4.116 16.552 -2.673 1.00 0.00 O ATOM 727 CB SER A 52 2.363 14.244 -3.600 1.00 0.00 C ATOM 728 OG SER A 52 1.658 14.112 -4.822 1.00 0.00 O ATOM 0 H SER A 52 4.561 14.017 -1.927 1.00 0.00 H new ATOM 0 HA SER A 52 4.108 14.128 -4.850 1.00 0.00 H new ATOM 0 HB2 SER A 52 2.224 13.346 -2.998 1.00 0.00 H new ATOM 0 HB3 SER A 52 1.954 15.078 -3.029 1.00 0.00 H new ATOM 0 HG SER A 52 0.707 13.965 -4.637 1.00 0.00 H new ATOM 734 N LYS A 53 4.520 16.560 -4.886 1.00 0.00 N ATOM 735 CA LYS A 53 4.851 17.979 -4.933 1.00 0.00 C ATOM 736 C LYS A 53 3.630 18.833 -4.608 1.00 0.00 C ATOM 737 O LYS A 53 3.758 19.997 -4.227 1.00 0.00 O ATOM 738 CB LYS A 53 5.395 18.352 -6.314 1.00 0.00 C ATOM 739 CG LYS A 53 6.902 18.536 -6.345 1.00 0.00 C ATOM 740 CD LYS A 53 7.628 17.250 -5.987 1.00 0.00 C ATOM 741 CE LYS A 53 7.560 16.238 -7.121 1.00 0.00 C ATOM 742 NZ LYS A 53 8.793 15.406 -7.196 1.00 0.00 N ATOM 0 H LYS A 53 4.576 16.085 -5.787 1.00 0.00 H new ATOM 0 HA LYS A 53 5.618 18.173 -4.183 1.00 0.00 H new ATOM 0 HB2 LYS A 53 5.118 17.575 -7.026 1.00 0.00 H new ATOM 0 HB3 LYS A 53 4.918 19.274 -6.646 1.00 0.00 H new ATOM 0 HG2 LYS A 53 7.209 18.864 -7.338 1.00 0.00 H new ATOM 0 HG3 LYS A 53 7.188 19.323 -5.647 1.00 0.00 H new ATOM 0 HD2 LYS A 53 8.670 17.471 -5.757 1.00 0.00 H new ATOM 0 HD3 LYS A 53 7.187 16.820 -5.087 1.00 0.00 H new ATOM 0 HE2 LYS A 53 6.694 15.592 -6.980 1.00 0.00 H new ATOM 0 HE3 LYS A 53 7.417 16.761 -8.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 8.708 14.729 -7.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 9.617 16.020 -7.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 8.916 14.887 -6.303 1.00 0.00 H new ATOM 756 N ILE A 54 2.447 18.248 -4.760 1.00 0.00 N ATOM 757 CA ILE A 54 1.203 18.955 -4.480 1.00 0.00 C ATOM 758 C ILE A 54 0.798 18.797 -3.019 1.00 0.00 C ATOM 759 O ILE A 54 0.830 19.757 -2.248 1.00 0.00 O ATOM 760 CB ILE A 54 0.056 18.453 -5.376 1.00 0.00 C ATOM 761 CG1 ILE A 54 0.422 18.621 -6.853 1.00 0.00 C ATOM 762 CG2 ILE A 54 -1.231 19.198 -5.056 1.00 0.00 C ATOM 763 CD1 ILE A 54 0.600 20.063 -7.271 1.00 0.00 C ATOM 0 H ILE A 54 2.323 17.286 -5.076 1.00 0.00 H new ATOM 0 HA ILE A 54 1.384 20.009 -4.692 1.00 0.00 H new ATOM 0 HB ILE A 54 -0.102 17.393 -5.178 1.00 0.00 H new ATOM 0 HG12 ILE A 54 1.344 18.076 -7.055 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -0.357 18.167 -7.466 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -2.032 18.832 -5.698 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -1.497 19.032 -4.012 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -1.087 20.265 -5.229 1.00 0.00 H new ATOM 0 HD11 ILE A 54 0.858 20.106 -8.329 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -0.329 20.608 -7.102 1.00 0.00 H new ATOM 0 HD13 ILE A 54 1.399 20.516 -6.684 1.00 0.00 H new ATOM 775 N CYS A 55 0.418 17.581 -2.644 1.00 0.00 N ATOM 776 CA CYS A 55 0.008 17.296 -1.273 1.00 0.00 C ATOM 777 C CYS A 55 0.863 16.188 -0.668 1.00 0.00 C ATOM 778 O CYS A 55 0.431 15.045 -0.524 1.00 0.00 O ATOM 779 CB CYS A 55 -1.468 16.897 -1.234 1.00 0.00 C ATOM 780 SG CYS A 55 -2.301 17.301 0.319 1.00 0.00 S ATOM 0 H CYS A 55 0.385 16.776 -3.270 1.00 0.00 H new ATOM 0 HA CYS A 55 0.149 18.201 -0.682 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -1.989 17.393 -2.053 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -1.548 15.824 -1.408 1.00 0.00 H new ATOM 0 HG CYS A 55 -3.146 18.268 0.119 1.00 0.00 H new ATOM 786 N PRO A 56 2.108 16.533 -0.306 1.00 0.00 N ATOM 787 CA PRO A 56 3.051 15.581 0.289 1.00 0.00 C ATOM 788 C PRO A 56 2.648 15.171 1.701 1.00 0.00 C ATOM 789 O PRO A 56 3.235 14.258 2.284 1.00 0.00 O ATOM 790 CB PRO A 56 4.370 16.357 0.313 1.00 0.00 C ATOM 791 CG PRO A 56 3.966 17.791 0.343 1.00 0.00 C ATOM 792 CD PRO A 56 2.690 17.878 -0.448 1.00 0.00 C ATOM 0 HA PRO A 56 3.099 14.649 -0.274 1.00 0.00 H new ATOM 0 HB2 PRO A 56 4.967 16.096 1.187 1.00 0.00 H new ATOM 0 HB3 PRO A 56 4.976 16.135 -0.565 1.00 0.00 H new ATOM 0 HG2 PRO A 56 3.814 18.132 1.367 1.00 0.00 H new ATOM 0 HG3 PRO A 56 4.739 18.424 -0.093 1.00 0.00 H new ATOM 0 HD2 PRO A 56 2.025 18.647 -0.055 1.00 0.00 H new ATOM 0 HD3 PRO A 56 2.881 18.125 -1.492 1.00 0.00 H new ATOM 800 N LEU A 57 1.645 15.850 2.245 1.00 0.00 N ATOM 801 CA LEU A 57 1.163 15.556 3.590 1.00 0.00 C ATOM 802 C LEU A 57 0.017 14.550 3.550 1.00 0.00 C ATOM 803 O LEU A 57 -0.273 13.884 4.544 1.00 0.00 O ATOM 804 CB LEU A 57 0.705 16.841 4.282 1.00 0.00 C ATOM 805 CG LEU A 57 1.656 18.034 4.180 1.00 0.00 C ATOM 806 CD1 LEU A 57 0.931 19.326 4.525 1.00 0.00 C ATOM 807 CD2 LEU A 57 2.859 17.836 5.090 1.00 0.00 C ATOM 0 H LEU A 57 1.149 16.608 1.776 1.00 0.00 H new ATOM 0 HA LEU A 57 1.986 15.120 4.156 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.258 17.133 3.862 1.00 0.00 H new ATOM 0 HB3 LEU A 57 0.540 16.623 5.337 1.00 0.00 H new ATOM 0 HG LEU A 57 2.011 18.104 3.152 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.624 20.164 4.447 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.102 19.474 3.832 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.547 19.267 5.543 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.525 18.695 5.005 1.00 0.00 H new ATOM 0 HD22 LEU A 57 2.522 17.739 6.122 1.00 0.00 H new ATOM 0 HD23 LEU A 57 3.393 16.932 4.796 1.00 0.00 H new ATOM 819 N MET A 58 -0.630 14.444 2.394 1.00 0.00 N ATOM 820 CA MET A 58 -1.743 13.517 2.224 1.00 0.00 C ATOM 821 C MET A 58 -1.354 12.113 2.676 1.00 0.00 C ATOM 822 O MET A 58 -1.980 11.543 3.570 1.00 0.00 O ATOM 823 CB MET A 58 -2.192 13.489 0.762 1.00 0.00 C ATOM 824 CG MET A 58 -3.529 12.798 0.550 1.00 0.00 C ATOM 825 SD MET A 58 -4.353 13.327 -0.964 1.00 0.00 S ATOM 826 CE MET A 58 -5.011 14.913 -0.455 1.00 0.00 C ATOM 0 H MET A 58 -0.403 14.988 1.562 1.00 0.00 H new ATOM 0 HA MET A 58 -2.570 13.863 2.844 1.00 0.00 H new ATOM 0 HB2 MET A 58 -2.258 14.512 0.391 1.00 0.00 H new ATOM 0 HB3 MET A 58 -1.432 12.983 0.167 1.00 0.00 H new ATOM 0 HG2 MET A 58 -3.375 11.719 0.517 1.00 0.00 H new ATOM 0 HG3 MET A 58 -4.178 13.001 1.402 1.00 0.00 H new ATOM 0 HE1 MET A 58 -5.956 15.096 -0.966 1.00 0.00 H new ATOM 0 HE2 MET A 58 -5.176 14.910 0.622 1.00 0.00 H new ATOM 0 HE3 MET A 58 -4.302 15.700 -0.711 1.00 0.00 H new ATOM 836 N ILE A 59 -0.319 11.561 2.052 1.00 0.00 N ATOM 837 CA ILE A 59 0.153 10.224 2.391 1.00 0.00 C ATOM 838 C ILE A 59 0.827 10.210 3.759 1.00 0.00 C ATOM 839 O ILE A 59 1.808 10.917 3.986 1.00 0.00 O ATOM 840 CB ILE A 59 1.142 9.692 1.338 1.00 0.00 C ATOM 841 CG1 ILE A 59 0.557 9.847 -0.067 1.00 0.00 C ATOM 842 CG2 ILE A 59 1.482 8.236 1.618 1.00 0.00 C ATOM 843 CD1 ILE A 59 -0.772 9.148 -0.249 1.00 0.00 C ATOM 0 H ILE A 59 0.209 12.019 1.309 1.00 0.00 H new ATOM 0 HA ILE A 59 -0.723 9.576 2.414 1.00 0.00 H new ATOM 0 HB ILE A 59 2.060 10.277 1.396 1.00 0.00 H new ATOM 0 HG12 ILE A 59 0.433 10.908 -0.285 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.268 9.453 -0.793 1.00 0.00 H new ATOM 0 HG21 ILE A 59 2.182 7.875 0.865 1.00 0.00 H new ATOM 0 HG22 ILE A 59 1.936 8.152 2.605 1.00 0.00 H new ATOM 0 HG23 ILE A 59 0.572 7.637 1.585 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -1.127 9.300 -1.268 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -0.650 8.081 -0.063 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -1.498 9.558 0.453 1.00 0.00 H new ATOM 855 N SER A 60 0.294 9.398 4.667 1.00 0.00 N ATOM 856 CA SER A 60 0.843 9.292 6.014 1.00 0.00 C ATOM 857 C SER A 60 1.992 8.288 6.055 1.00 0.00 C ATOM 858 O SER A 60 2.220 7.551 5.096 1.00 0.00 O ATOM 859 CB SER A 60 -0.248 8.876 7.001 1.00 0.00 C ATOM 860 OG SER A 60 -0.972 10.002 7.466 1.00 0.00 O ATOM 0 H SER A 60 -0.517 8.804 4.494 1.00 0.00 H new ATOM 0 HA SER A 60 1.228 10.271 6.301 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.930 8.175 6.520 1.00 0.00 H new ATOM 0 HB3 SER A 60 0.201 8.354 7.846 1.00 0.00 H new ATOM 0 HG SER A 60 -1.665 9.709 8.094 1.00 0.00 H new ATOM 866 N ARG A 61 2.711 8.267 7.172 1.00 0.00 N ATOM 867 CA ARG A 61 3.837 7.356 7.339 1.00 0.00 C ATOM 868 C ARG A 61 3.420 5.918 7.046 1.00 0.00 C ATOM 869 O ARG A 61 4.168 5.156 6.435 1.00 0.00 O ATOM 870 CB ARG A 61 4.395 7.457 8.760 1.00 0.00 C ATOM 871 CG ARG A 61 5.878 7.138 8.855 1.00 0.00 C ATOM 872 CD ARG A 61 6.400 7.331 10.270 1.00 0.00 C ATOM 873 NE ARG A 61 7.663 6.630 10.489 1.00 0.00 N ATOM 874 CZ ARG A 61 8.379 6.736 11.602 1.00 0.00 C ATOM 875 NH1 ARG A 61 7.959 7.510 12.593 1.00 0.00 N ATOM 876 NH2 ARG A 61 9.518 6.067 11.726 1.00 0.00 N ATOM 0 H ARG A 61 2.534 8.870 7.975 1.00 0.00 H new ATOM 0 HA ARG A 61 4.613 7.643 6.630 1.00 0.00 H new ATOM 0 HB2 ARG A 61 4.224 8.465 9.138 1.00 0.00 H new ATOM 0 HB3 ARG A 61 3.843 6.776 9.407 1.00 0.00 H new ATOM 0 HG2 ARG A 61 6.051 6.109 8.540 1.00 0.00 H new ATOM 0 HG3 ARG A 61 6.434 7.779 8.170 1.00 0.00 H new ATOM 0 HD2 ARG A 61 6.538 8.395 10.463 1.00 0.00 H new ATOM 0 HD3 ARG A 61 5.658 6.971 10.982 1.00 0.00 H new ATOM 0 HE ARG A 61 8.014 6.026 9.746 1.00 0.00 H new ATOM 0 HH11 ARG A 61 7.084 8.026 12.501 1.00 0.00 H new ATOM 0 HH12 ARG A 61 8.511 7.590 13.447 1.00 0.00 H new ATOM 0 HH21 ARG A 61 9.844 5.470 10.966 1.00 0.00 H new ATOM 0 HH22 ARG A 61 10.067 6.149 12.582 1.00 0.00 H new ATOM 890 N ASN A 62 2.220 5.553 7.487 1.00 0.00 N ATOM 891 CA ASN A 62 1.704 4.206 7.273 1.00 0.00 C ATOM 892 C ASN A 62 0.280 4.249 6.727 1.00 0.00 C ATOM 893 O ASN A 62 -0.658 3.777 7.371 1.00 0.00 O ATOM 894 CB ASN A 62 1.737 3.411 8.579 1.00 0.00 C ATOM 895 CG ASN A 62 3.150 3.181 9.080 1.00 0.00 C ATOM 896 OD1 ASN A 62 3.852 4.124 9.446 1.00 0.00 O ATOM 897 ND2 ASN A 62 3.574 1.922 9.098 1.00 0.00 N ATOM 0 H ASN A 62 1.587 6.171 7.995 1.00 0.00 H new ATOM 0 HA ASN A 62 2.341 3.713 6.539 1.00 0.00 H new ATOM 0 HB2 ASN A 62 1.167 3.944 9.340 1.00 0.00 H new ATOM 0 HB3 ASN A 62 1.247 2.449 8.428 1.00 0.00 H new ATOM 0 HD21 ASN A 62 4.516 1.706 9.425 1.00 0.00 H new ATOM 0 HD22 ASN A 62 2.958 1.172 8.785 1.00 0.00 H new ATOM 904 N HIS A 63 0.125 4.819 5.536 1.00 0.00 N ATOM 905 CA HIS A 63 -1.184 4.923 4.902 1.00 0.00 C ATOM 906 C HIS A 63 -1.868 3.560 4.841 1.00 0.00 C ATOM 907 O HIS A 63 -3.093 3.465 4.929 1.00 0.00 O ATOM 908 CB HIS A 63 -1.048 5.503 3.494 1.00 0.00 C ATOM 909 CG HIS A 63 -2.217 6.341 3.076 1.00 0.00 C ATOM 910 ND1 HIS A 63 -2.221 7.718 3.153 1.00 0.00 N ATOM 911 CD2 HIS A 63 -3.424 5.990 2.573 1.00 0.00 C ATOM 912 CE1 HIS A 63 -3.380 8.178 2.717 1.00 0.00 C ATOM 913 NE2 HIS A 63 -4.128 7.150 2.359 1.00 0.00 N ATOM 0 H HIS A 63 0.890 5.216 4.991 1.00 0.00 H new ATOM 0 HA HIS A 63 -1.800 5.592 5.503 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -0.142 6.107 3.445 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -0.925 4.686 2.784 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -3.769 4.986 2.377 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -3.667 9.218 2.663 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -5.075 7.208 1.984 1.00 0.00 H new ATOM 921 N CYS A 64 -1.070 2.510 4.688 1.00 0.00 N ATOM 922 CA CYS A 64 -1.598 1.152 4.612 1.00 0.00 C ATOM 923 C CYS A 64 -0.478 0.125 4.738 1.00 0.00 C ATOM 924 O CYS A 64 0.696 0.445 4.550 1.00 0.00 O ATOM 925 CB CYS A 64 -2.349 0.948 3.296 1.00 0.00 C ATOM 926 SG CYS A 64 -1.290 0.965 1.831 1.00 0.00 S ATOM 0 H CYS A 64 -0.055 2.572 4.614 1.00 0.00 H new ATOM 0 HA CYS A 64 -2.290 1.010 5.442 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -2.879 -0.003 3.337 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -3.103 1.729 3.195 1.00 0.00 H new ATOM 0 HG CYS A 64 -2.016 0.782 0.768 1.00 0.00 H new ATOM 932 N VAL A 65 -0.848 -1.111 5.058 1.00 0.00 N ATOM 933 CA VAL A 65 0.125 -2.186 5.210 1.00 0.00 C ATOM 934 C VAL A 65 -0.424 -3.504 4.676 1.00 0.00 C ATOM 935 O VAL A 65 -1.347 -4.082 5.250 1.00 0.00 O ATOM 936 CB VAL A 65 0.532 -2.371 6.684 1.00 0.00 C ATOM 937 CG1 VAL A 65 1.605 -3.442 6.812 1.00 0.00 C ATOM 938 CG2 VAL A 65 1.010 -1.053 7.274 1.00 0.00 C ATOM 0 H VAL A 65 -1.815 -1.393 5.217 1.00 0.00 H new ATOM 0 HA VAL A 65 1.004 -1.901 4.632 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.343 -2.698 7.246 1.00 0.00 H new ATOM 0 HG11 VAL A 65 1.880 -3.558 7.860 1.00 0.00 H new ATOM 0 HG12 VAL A 65 1.222 -4.388 6.430 1.00 0.00 H new ATOM 0 HG13 VAL A 65 2.483 -3.148 6.237 1.00 0.00 H new ATOM 0 HG21 VAL A 65 1.293 -1.202 8.316 1.00 0.00 H new ATOM 0 HG22 VAL A 65 1.872 -0.694 6.711 1.00 0.00 H new ATOM 0 HG23 VAL A 65 0.208 -0.317 7.218 1.00 0.00 H new ATOM 948 N LEU A 66 0.150 -3.974 3.574 1.00 0.00 N ATOM 949 CA LEU A 66 -0.282 -5.226 2.961 1.00 0.00 C ATOM 950 C LEU A 66 0.449 -6.414 3.578 1.00 0.00 C ATOM 951 O LEU A 66 1.613 -6.308 3.966 1.00 0.00 O ATOM 952 CB LEU A 66 -0.036 -5.189 1.452 1.00 0.00 C ATOM 953 CG LEU A 66 -1.028 -4.364 0.631 1.00 0.00 C ATOM 954 CD1 LEU A 66 -0.416 -3.027 0.242 1.00 0.00 C ATOM 955 CD2 LEU A 66 -1.465 -5.132 -0.608 1.00 0.00 C ATOM 0 H LEU A 66 0.915 -3.508 3.087 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.350 -5.344 3.146 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.965 -4.796 1.277 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -0.047 -6.212 1.077 1.00 0.00 H new ATOM 0 HG LEU A 66 -1.908 -4.174 1.245 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.136 -2.453 -0.342 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.154 -2.471 1.142 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.481 -3.197 -0.354 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.171 -4.529 -1.180 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.594 -5.353 -1.225 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.944 -6.064 -0.308 1.00 0.00 H new ATOM 967 N LYS A 67 -0.240 -7.547 3.664 1.00 0.00 N ATOM 968 CA LYS A 67 0.343 -8.757 4.230 1.00 0.00 C ATOM 969 C LYS A 67 -0.595 -9.947 4.052 1.00 0.00 C ATOM 970 O LYS A 67 -1.811 -9.783 3.971 1.00 0.00 O ATOM 971 CB LYS A 67 0.650 -8.554 5.715 1.00 0.00 C ATOM 972 CG LYS A 67 -0.571 -8.204 6.547 1.00 0.00 C ATOM 973 CD LYS A 67 -0.319 -6.990 7.425 1.00 0.00 C ATOM 974 CE LYS A 67 0.133 -7.394 8.819 1.00 0.00 C ATOM 975 NZ LYS A 67 -0.859 -7.005 9.859 1.00 0.00 N ATOM 0 H LYS A 67 -1.204 -7.652 3.348 1.00 0.00 H new ATOM 0 HA LYS A 67 1.272 -8.966 3.699 1.00 0.00 H new ATOM 0 HB2 LYS A 67 1.101 -9.464 6.112 1.00 0.00 H new ATOM 0 HB3 LYS A 67 1.390 -7.760 5.819 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -1.417 -8.008 5.888 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -0.843 -9.055 7.171 1.00 0.00 H new ATOM 0 HD2 LYS A 67 0.440 -6.358 6.964 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -1.230 -6.395 7.495 1.00 0.00 H new ATOM 0 HE2 LYS A 67 0.289 -8.472 8.852 1.00 0.00 H new ATOM 0 HE3 LYS A 67 1.092 -6.926 9.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -0.514 -7.298 10.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -0.990 -5.973 9.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -1.768 -7.472 9.664 1.00 0.00 H new ATOM 989 N GLN A 68 -0.020 -11.144 3.995 1.00 0.00 N ATOM 990 CA GLN A 68 -0.805 -12.361 3.828 1.00 0.00 C ATOM 991 C GLN A 68 -1.226 -12.927 5.180 1.00 0.00 C ATOM 992 O GLN A 68 -0.387 -13.346 5.977 1.00 0.00 O ATOM 993 CB GLN A 68 -0.005 -13.407 3.050 1.00 0.00 C ATOM 994 CG GLN A 68 0.369 -12.966 1.644 1.00 0.00 C ATOM 995 CD GLN A 68 1.228 -13.985 0.922 1.00 0.00 C ATOM 996 OE1 GLN A 68 2.407 -14.154 1.235 1.00 0.00 O ATOM 997 NE2 GLN A 68 0.640 -14.672 -0.051 1.00 0.00 N ATOM 0 H GLN A 68 0.986 -11.297 4.062 1.00 0.00 H new ATOM 0 HA GLN A 68 -1.703 -12.109 3.265 1.00 0.00 H new ATOM 0 HB2 GLN A 68 0.905 -13.641 3.602 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -0.587 -14.327 2.990 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -0.540 -12.790 1.069 1.00 0.00 H new ATOM 0 HG3 GLN A 68 0.903 -12.017 1.695 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -0.340 -14.500 -0.277 1.00 0.00 H new ATOM 0 HE22 GLN A 68 1.168 -15.372 -0.572 1.00 0.00 H new ATOM 1006 N ASN A 69 -2.531 -12.936 5.432 1.00 0.00 N ATOM 1007 CA ASN A 69 -3.063 -13.450 6.689 1.00 0.00 C ATOM 1008 C ASN A 69 -2.518 -14.845 6.980 1.00 0.00 C ATOM 1009 O ASN A 69 -2.037 -15.549 6.092 1.00 0.00 O ATOM 1010 CB ASN A 69 -4.592 -13.487 6.642 1.00 0.00 C ATOM 1011 CG ASN A 69 -5.116 -14.160 5.389 1.00 0.00 C ATOM 1012 OD1 ASN A 69 -4.581 -15.177 4.946 1.00 0.00 O ATOM 1013 ND2 ASN A 69 -6.168 -13.594 4.809 1.00 0.00 N ATOM 0 H ASN A 69 -3.239 -12.593 4.783 1.00 0.00 H new ATOM 0 HA ASN A 69 -2.747 -12.781 7.490 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -4.967 -14.015 7.519 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -4.979 -12.469 6.693 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -6.564 -14.002 3.962 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -6.580 -12.752 5.210 1.00 0.00 H new ATOM 1020 N PRO A 70 -2.595 -15.256 8.255 1.00 0.00 N ATOM 1021 CA PRO A 70 -2.115 -16.570 8.693 1.00 0.00 C ATOM 1022 C PRO A 70 -2.626 -17.699 7.805 1.00 0.00 C ATOM 1023 O PRO A 70 -1.985 -18.743 7.684 1.00 0.00 O ATOM 1024 CB PRO A 70 -2.686 -16.702 10.107 1.00 0.00 C ATOM 1025 CG PRO A 70 -2.844 -15.300 10.585 1.00 0.00 C ATOM 1026 CD PRO A 70 -3.156 -14.469 9.366 1.00 0.00 C ATOM 0 HA PRO A 70 -1.028 -16.643 8.648 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -3.641 -17.228 10.101 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -2.015 -17.267 10.754 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -3.646 -15.228 11.320 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -1.933 -14.950 11.071 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -4.229 -14.318 9.248 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -2.700 -13.481 9.427 1.00 0.00 H new ATOM 1034 N GLU A 71 -3.782 -17.482 7.185 1.00 0.00 N ATOM 1035 CA GLU A 71 -4.377 -18.484 6.308 1.00 0.00 C ATOM 1036 C GLU A 71 -3.524 -18.690 5.060 1.00 0.00 C ATOM 1037 O GLU A 71 -3.348 -19.815 4.594 1.00 0.00 O ATOM 1038 CB GLU A 71 -5.794 -18.065 5.907 1.00 0.00 C ATOM 1039 CG GLU A 71 -6.634 -17.569 7.072 1.00 0.00 C ATOM 1040 CD GLU A 71 -8.117 -17.808 6.865 1.00 0.00 C ATOM 1041 OE1 GLU A 71 -8.621 -17.490 5.767 1.00 0.00 O ATOM 1042 OE2 GLU A 71 -8.774 -18.313 7.799 1.00 0.00 O ATOM 0 H GLU A 71 -4.324 -16.623 7.274 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.424 -19.426 6.854 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -5.732 -17.279 5.154 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -6.297 -18.913 5.442 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -6.313 -18.070 7.986 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -6.458 -16.503 7.214 1.00 0.00 H new ATOM 1049 N GLY A 72 -2.996 -17.594 4.523 1.00 0.00 N ATOM 1050 CA GLY A 72 -2.168 -17.675 3.334 1.00 0.00 C ATOM 1051 C GLY A 72 -2.730 -16.869 2.180 1.00 0.00 C ATOM 1052 O GLY A 72 -2.436 -17.149 1.019 1.00 0.00 O ATOM 0 H GLY A 72 -3.127 -16.652 4.890 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -1.165 -17.318 3.568 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -2.072 -18.718 3.032 1.00 0.00 H new ATOM 1056 N GLN A 73 -3.542 -15.867 2.501 1.00 0.00 N ATOM 1057 CA GLN A 73 -4.148 -15.019 1.481 1.00 0.00 C ATOM 1058 C GLN A 73 -3.817 -13.551 1.725 1.00 0.00 C ATOM 1059 O GLN A 73 -3.765 -13.099 2.869 1.00 0.00 O ATOM 1060 CB GLN A 73 -5.665 -15.215 1.460 1.00 0.00 C ATOM 1061 CG GLN A 73 -6.396 -14.215 0.579 1.00 0.00 C ATOM 1062 CD GLN A 73 -6.015 -14.338 -0.883 1.00 0.00 C ATOM 1063 OE1 GLN A 73 -5.322 -15.276 -1.280 1.00 0.00 O ATOM 1064 NE2 GLN A 73 -6.465 -13.388 -1.694 1.00 0.00 N ATOM 0 H GLN A 73 -3.795 -15.623 3.458 1.00 0.00 H new ATOM 0 HA GLN A 73 -3.737 -15.309 0.514 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -5.888 -16.224 1.112 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -6.047 -15.137 2.478 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -7.471 -14.362 0.684 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -6.177 -13.204 0.924 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -7.036 -12.629 -1.323 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -6.240 -13.417 -2.688 1.00 0.00 H new ATOM 1073 N TRP A 74 -3.593 -12.812 0.645 1.00 0.00 N ATOM 1074 CA TRP A 74 -3.265 -11.394 0.743 1.00 0.00 C ATOM 1075 C TRP A 74 -4.455 -10.596 1.265 1.00 0.00 C ATOM 1076 O TRP A 74 -5.602 -10.863 0.903 1.00 0.00 O ATOM 1077 CB TRP A 74 -2.832 -10.854 -0.621 1.00 0.00 C ATOM 1078 CG TRP A 74 -1.398 -11.143 -0.946 1.00 0.00 C ATOM 1079 CD1 TRP A 74 -0.930 -12.033 -1.871 1.00 0.00 C ATOM 1080 CD2 TRP A 74 -0.245 -10.542 -0.346 1.00 0.00 C ATOM 1081 NE1 TRP A 74 0.444 -12.020 -1.882 1.00 0.00 N ATOM 1082 CE2 TRP A 74 0.888 -11.113 -0.956 1.00 0.00 C ATOM 1083 CE3 TRP A 74 -0.061 -9.574 0.645 1.00 0.00 C ATOM 1084 CZ2 TRP A 74 2.185 -10.749 -0.605 1.00 0.00 C ATOM 1085 CZ3 TRP A 74 1.227 -9.214 0.993 1.00 0.00 C ATOM 1086 CH2 TRP A 74 2.337 -9.800 0.369 1.00 0.00 C ATOM 0 H TRP A 74 -3.632 -13.171 -0.309 1.00 0.00 H new ATOM 0 HA TRP A 74 -2.440 -11.285 1.447 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -3.467 -11.288 -1.394 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -2.992 -9.776 -0.645 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -1.549 -12.655 -2.501 1.00 0.00 H new ATOM 0 HE1 TRP A 74 1.037 -12.593 -2.482 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -0.910 -9.116 1.130 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 3.041 -11.200 -1.085 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 1.381 -8.468 1.759 1.00 0.00 H new ATOM 0 HH2 TRP A 74 3.331 -9.497 0.663 1.00 0.00 H new ATOM 1097 N THR A 75 -4.175 -9.615 2.118 1.00 0.00 N ATOM 1098 CA THR A 75 -5.223 -8.779 2.690 1.00 0.00 C ATOM 1099 C THR A 75 -4.700 -7.382 3.007 1.00 0.00 C ATOM 1100 O THR A 75 -3.705 -7.228 3.716 1.00 0.00 O ATOM 1101 CB THR A 75 -5.800 -9.402 3.975 1.00 0.00 C ATOM 1102 OG1 THR A 75 -4.766 -9.550 4.955 1.00 0.00 O ATOM 1103 CG2 THR A 75 -6.428 -10.757 3.684 1.00 0.00 C ATOM 0 H THR A 75 -3.232 -9.380 2.428 1.00 0.00 H new ATOM 0 HA THR A 75 -6.013 -8.708 1.943 1.00 0.00 H new ATOM 0 HB THR A 75 -6.572 -8.736 4.360 1.00 0.00 H new ATOM 0 HG1 THR A 75 -4.081 -8.864 4.814 1.00 0.00 H new ATOM 0 HG21 THR A 75 -6.829 -11.178 4.606 1.00 0.00 H new ATOM 0 HG22 THR A 75 -7.234 -10.637 2.960 1.00 0.00 H new ATOM 0 HG23 THR A 75 -5.672 -11.429 3.277 1.00 0.00 H new ATOM 1111 N ILE A 76 -5.376 -6.368 2.478 1.00 0.00 N ATOM 1112 CA ILE A 76 -4.979 -4.984 2.707 1.00 0.00 C ATOM 1113 C ILE A 76 -5.511 -4.474 4.042 1.00 0.00 C ATOM 1114 O ILE A 76 -6.706 -4.561 4.320 1.00 0.00 O ATOM 1115 CB ILE A 76 -5.481 -4.061 1.580 1.00 0.00 C ATOM 1116 CG1 ILE A 76 -5.064 -2.615 1.853 1.00 0.00 C ATOM 1117 CG2 ILE A 76 -6.993 -4.166 1.444 1.00 0.00 C ATOM 1118 CD1 ILE A 76 -4.812 -1.811 0.596 1.00 0.00 C ATOM 0 H ILE A 76 -6.201 -6.478 1.888 1.00 0.00 H new ATOM 0 HA ILE A 76 -3.889 -4.966 2.722 1.00 0.00 H new ATOM 0 HB ILE A 76 -5.029 -4.379 0.641 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -5.842 -2.125 2.438 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -4.160 -2.615 2.462 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -7.333 -3.508 0.644 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -7.267 -5.195 1.209 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.464 -3.870 2.381 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -4.520 -0.796 0.866 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -4.013 -2.277 0.020 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -5.721 -1.780 -0.004 1.00 0.00 H new ATOM 1130 N MET A 77 -4.614 -3.939 4.863 1.00 0.00 N ATOM 1131 CA MET A 77 -4.993 -3.410 6.169 1.00 0.00 C ATOM 1132 C MET A 77 -4.473 -1.988 6.352 1.00 0.00 C ATOM 1133 O MET A 77 -3.266 -1.750 6.325 1.00 0.00 O ATOM 1134 CB MET A 77 -4.454 -4.310 7.283 1.00 0.00 C ATOM 1135 CG MET A 77 -4.935 -3.914 8.670 1.00 0.00 C ATOM 1136 SD MET A 77 -3.615 -3.945 9.897 1.00 0.00 S ATOM 1137 CE MET A 77 -2.743 -2.433 9.495 1.00 0.00 C ATOM 0 H MET A 77 -3.620 -3.860 4.648 1.00 0.00 H new ATOM 0 HA MET A 77 -6.081 -3.389 6.223 1.00 0.00 H new ATOM 0 HB2 MET A 77 -4.753 -5.339 7.084 1.00 0.00 H new ATOM 0 HB3 MET A 77 -3.364 -4.285 7.264 1.00 0.00 H new ATOM 0 HG2 MET A 77 -5.365 -2.913 8.629 1.00 0.00 H new ATOM 0 HG3 MET A 77 -5.731 -4.590 8.981 1.00 0.00 H new ATOM 0 HE1 MET A 77 -1.974 -2.246 10.244 1.00 0.00 H new ATOM 0 HE2 MET A 77 -2.278 -2.531 8.514 1.00 0.00 H new ATOM 0 HE3 MET A 77 -3.446 -1.600 9.482 1.00 0.00 H new ATOM 1147 N ASP A 78 -5.392 -1.047 6.537 1.00 0.00 N ATOM 1148 CA ASP A 78 -5.026 0.352 6.725 1.00 0.00 C ATOM 1149 C ASP A 78 -4.546 0.601 8.152 1.00 0.00 C ATOM 1150 O ASP A 78 -5.260 0.324 9.115 1.00 0.00 O ATOM 1151 CB ASP A 78 -6.216 1.260 6.409 1.00 0.00 C ATOM 1152 CG ASP A 78 -6.009 2.678 6.902 1.00 0.00 C ATOM 1153 OD1 ASP A 78 -4.867 3.177 6.815 1.00 0.00 O ATOM 1154 OD2 ASP A 78 -6.990 3.291 7.374 1.00 0.00 O ATOM 0 H ASP A 78 -6.396 -1.227 6.561 1.00 0.00 H new ATOM 0 HA ASP A 78 -4.210 0.583 6.040 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -6.383 1.274 5.332 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -7.116 0.847 6.866 1.00 0.00 H new ATOM 1159 N ASN A 79 -3.331 1.125 8.279 1.00 0.00 N ATOM 1160 CA ASN A 79 -2.754 1.410 9.588 1.00 0.00 C ATOM 1161 C ASN A 79 -3.295 2.723 10.146 1.00 0.00 C ATOM 1162 O ASN A 79 -2.534 3.646 10.438 1.00 0.00 O ATOM 1163 CB ASN A 79 -1.228 1.472 9.493 1.00 0.00 C ATOM 1164 CG ASN A 79 -0.551 1.030 10.776 1.00 0.00 C ATOM 1165 OD1 ASN A 79 -1.075 1.238 11.871 1.00 0.00 O ATOM 1166 ND2 ASN A 79 0.620 0.417 10.646 1.00 0.00 N ATOM 0 H ASN A 79 -2.727 1.361 7.492 1.00 0.00 H new ATOM 0 HA ASN A 79 -3.036 0.604 10.266 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -0.892 0.840 8.671 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -0.922 2.491 9.256 1.00 0.00 H new ATOM 0 HD21 ASN A 79 1.123 0.097 11.474 1.00 0.00 H new ATOM 0 HD22 ASN A 79 1.016 0.266 9.718 1.00 0.00 H new ATOM 1173 N LYS A 80 -4.613 2.799 10.293 1.00 0.00 N ATOM 1174 CA LYS A 80 -5.257 3.997 10.818 1.00 0.00 C ATOM 1175 C LYS A 80 -4.800 5.238 10.058 1.00 0.00 C ATOM 1176 O LYS A 80 -3.893 5.946 10.495 1.00 0.00 O ATOM 1177 CB LYS A 80 -4.947 4.156 12.308 1.00 0.00 C ATOM 1178 CG LYS A 80 -5.845 3.324 13.208 1.00 0.00 C ATOM 1179 CD LYS A 80 -5.786 3.801 14.650 1.00 0.00 C ATOM 1180 CE LYS A 80 -6.588 2.894 15.570 1.00 0.00 C ATOM 1181 NZ LYS A 80 -7.969 2.668 15.061 1.00 0.00 N ATOM 0 H LYS A 80 -5.257 2.044 10.056 1.00 0.00 H new ATOM 0 HA LYS A 80 -6.333 3.888 10.686 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -3.909 3.877 12.486 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -5.046 5.207 12.581 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -6.872 3.377 12.848 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -5.544 2.278 13.157 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -4.748 3.832 14.982 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -6.172 4.819 14.714 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -6.077 1.936 15.671 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -6.636 3.337 16.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -8.548 2.236 15.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -8.389 3.577 14.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -7.936 2.033 14.238 1.00 0.00 H new ATOM 1195 N SER A 81 -5.435 5.496 8.920 1.00 0.00 N ATOM 1196 CA SER A 81 -5.091 6.651 8.098 1.00 0.00 C ATOM 1197 C SER A 81 -6.010 7.829 8.406 1.00 0.00 C ATOM 1198 O SER A 81 -7.136 7.649 8.871 1.00 0.00 O ATOM 1199 CB SER A 81 -5.183 6.292 6.613 1.00 0.00 C ATOM 1200 OG SER A 81 -6.463 5.779 6.291 1.00 0.00 O ATOM 0 H SER A 81 -6.190 4.922 8.546 1.00 0.00 H new ATOM 0 HA SER A 81 -4.067 6.941 8.332 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.980 7.176 6.009 1.00 0.00 H new ATOM 0 HB3 SER A 81 -4.419 5.554 6.366 1.00 0.00 H new ATOM 0 HG SER A 81 -6.497 5.559 5.337 1.00 0.00 H new ATOM 1206 N LEU A 82 -5.522 9.036 8.142 1.00 0.00 N ATOM 1207 CA LEU A 82 -6.298 10.246 8.390 1.00 0.00 C ATOM 1208 C LEU A 82 -7.225 10.549 7.217 1.00 0.00 C ATOM 1209 O LEU A 82 -8.363 10.978 7.407 1.00 0.00 O ATOM 1210 CB LEU A 82 -5.365 11.433 8.637 1.00 0.00 C ATOM 1211 CG LEU A 82 -6.024 12.813 8.656 1.00 0.00 C ATOM 1212 CD1 LEU A 82 -6.951 12.945 9.855 1.00 0.00 C ATOM 1213 CD2 LEU A 82 -4.968 13.908 8.673 1.00 0.00 C ATOM 0 H LEU A 82 -4.593 9.203 7.756 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.908 10.080 9.278 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -4.861 11.280 9.591 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -4.595 11.431 7.865 1.00 0.00 H new ATOM 0 HG LEU A 82 -6.618 12.923 7.749 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -7.411 13.933 9.852 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.728 12.183 9.800 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -6.379 12.814 10.773 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -5.455 14.883 8.686 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -4.347 13.801 9.562 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -4.345 13.826 7.783 1.00 0.00 H new ATOM 1225 N ASN A 83 -6.731 10.320 6.005 1.00 0.00 N ATOM 1226 CA ASN A 83 -7.516 10.566 4.801 1.00 0.00 C ATOM 1227 C ASN A 83 -8.464 9.404 4.522 1.00 0.00 C ATOM 1228 O ASN A 83 -9.648 9.606 4.254 1.00 0.00 O ATOM 1229 CB ASN A 83 -6.592 10.784 3.601 1.00 0.00 C ATOM 1230 CG ASN A 83 -5.840 12.099 3.681 1.00 0.00 C ATOM 1231 OD1 ASN A 83 -6.162 13.055 2.976 1.00 0.00 O ATOM 1232 ND2 ASN A 83 -4.832 12.152 4.543 1.00 0.00 N ATOM 0 H ASN A 83 -5.791 9.965 5.830 1.00 0.00 H new ATOM 0 HA ASN A 83 -8.110 11.465 4.962 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -5.877 9.963 3.542 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -7.181 10.760 2.684 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -4.289 13.010 4.641 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -4.600 11.335 5.108 1.00 0.00 H new ATOM 1239 N GLY A 84 -7.935 8.186 4.588 1.00 0.00 N ATOM 1240 CA GLY A 84 -8.748 7.010 4.341 1.00 0.00 C ATOM 1241 C GLY A 84 -8.348 6.285 3.071 1.00 0.00 C ATOM 1242 O GLY A 84 -7.886 6.905 2.113 1.00 0.00 O ATOM 0 H GLY A 84 -6.958 7.993 4.808 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -8.662 6.328 5.187 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.795 7.304 4.273 1.00 0.00 H new ATOM 1246 N VAL A 85 -8.523 4.967 3.063 1.00 0.00 N ATOM 1247 CA VAL A 85 -8.177 4.157 1.902 1.00 0.00 C ATOM 1248 C VAL A 85 -9.428 3.655 1.189 1.00 0.00 C ATOM 1249 O VAL A 85 -10.407 3.272 1.829 1.00 0.00 O ATOM 1250 CB VAL A 85 -7.307 2.949 2.299 1.00 0.00 C ATOM 1251 CG1 VAL A 85 -5.895 3.399 2.644 1.00 0.00 C ATOM 1252 CG2 VAL A 85 -7.936 2.200 3.464 1.00 0.00 C ATOM 0 H VAL A 85 -8.903 4.438 3.848 1.00 0.00 H new ATOM 0 HA VAL A 85 -7.610 4.798 1.227 1.00 0.00 H new ATOM 0 HB VAL A 85 -7.249 2.269 1.449 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -5.295 2.533 2.922 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -5.447 3.888 1.779 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -5.930 4.099 3.479 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -7.308 1.350 3.731 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -8.026 2.868 4.320 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -8.925 1.844 3.176 1.00 0.00 H new ATOM 1262 N TRP A 86 -9.387 3.660 -0.138 1.00 0.00 N ATOM 1263 CA TRP A 86 -10.518 3.204 -0.939 1.00 0.00 C ATOM 1264 C TRP A 86 -10.164 1.937 -1.709 1.00 0.00 C ATOM 1265 O TRP A 86 -9.084 1.835 -2.293 1.00 0.00 O ATOM 1266 CB TRP A 86 -10.956 4.301 -1.911 1.00 0.00 C ATOM 1267 CG TRP A 86 -11.209 5.620 -1.243 1.00 0.00 C ATOM 1268 CD1 TRP A 86 -10.290 6.595 -0.982 1.00 0.00 C ATOM 1269 CD2 TRP A 86 -12.463 6.104 -0.752 1.00 0.00 C ATOM 1270 NE1 TRP A 86 -10.897 7.658 -0.357 1.00 0.00 N ATOM 1271 CE2 TRP A 86 -12.230 7.382 -0.205 1.00 0.00 C ATOM 1272 CE3 TRP A 86 -13.760 5.585 -0.722 1.00 0.00 C ATOM 1273 CZ2 TRP A 86 -13.247 8.144 0.364 1.00 0.00 C ATOM 1274 CZ3 TRP A 86 -14.768 6.342 -0.156 1.00 0.00 C ATOM 1275 CH2 TRP A 86 -14.507 7.610 0.380 1.00 0.00 C ATOM 0 H TRP A 86 -8.584 3.974 -0.682 1.00 0.00 H new ATOM 0 HA TRP A 86 -11.342 2.977 -0.263 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -10.187 4.429 -2.673 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -11.863 3.981 -2.424 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -9.240 6.539 -1.230 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -10.431 8.513 -0.055 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -13.971 4.609 -1.134 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -13.049 9.122 0.778 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -15.774 5.950 -0.126 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -15.317 8.178 0.815 1.00 0.00 H new ATOM 1286 N LEU A 87 -11.079 0.974 -1.708 1.00 0.00 N ATOM 1287 CA LEU A 87 -10.863 -0.287 -2.408 1.00 0.00 C ATOM 1288 C LEU A 87 -12.079 -0.657 -3.251 1.00 0.00 C ATOM 1289 O LEU A 87 -13.085 -1.139 -2.730 1.00 0.00 O ATOM 1290 CB LEU A 87 -10.564 -1.404 -1.406 1.00 0.00 C ATOM 1291 CG LEU A 87 -10.463 -2.816 -1.986 1.00 0.00 C ATOM 1292 CD1 LEU A 87 -9.172 -2.978 -2.773 1.00 0.00 C ATOM 1293 CD2 LEU A 87 -10.547 -3.854 -0.877 1.00 0.00 C ATOM 0 H LEU A 87 -11.978 1.042 -1.230 1.00 0.00 H new ATOM 0 HA LEU A 87 -10.007 -0.164 -3.072 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.626 -1.172 -0.902 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -11.344 -1.400 -0.645 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.301 -2.970 -2.666 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.117 -3.988 -3.178 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -9.152 -2.258 -3.591 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.321 -2.804 -2.115 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.474 -4.853 -1.307 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -9.729 -3.701 -0.173 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.499 -3.753 -0.355 1.00 0.00 H new ATOM 1305 N ASN A 88 -11.979 -0.430 -4.557 1.00 0.00 N ATOM 1306 CA ASN A 88 -13.070 -0.742 -5.473 1.00 0.00 C ATOM 1307 C ASN A 88 -14.304 0.097 -5.154 1.00 0.00 C ATOM 1308 O ASN A 88 -15.410 -0.429 -5.030 1.00 0.00 O ATOM 1309 CB ASN A 88 -13.418 -2.230 -5.398 1.00 0.00 C ATOM 1310 CG ASN A 88 -12.185 -3.109 -5.336 1.00 0.00 C ATOM 1311 OD1 ASN A 88 -11.110 -2.725 -5.798 1.00 0.00 O ATOM 1312 ND2 ASN A 88 -12.334 -4.298 -4.763 1.00 0.00 N ATOM 0 H ASN A 88 -11.154 -0.031 -5.004 1.00 0.00 H new ATOM 0 HA ASN A 88 -12.741 -0.504 -6.485 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -14.035 -2.412 -4.518 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -14.014 -2.505 -6.268 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -11.539 -4.933 -4.693 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -13.243 -4.576 -4.393 1.00 0.00 H new ATOM 1319 N ARG A 89 -14.106 1.405 -5.022 1.00 0.00 N ATOM 1320 CA ARG A 89 -15.202 2.317 -4.717 1.00 0.00 C ATOM 1321 C ARG A 89 -15.830 1.980 -3.368 1.00 0.00 C ATOM 1322 O ARG A 89 -17.049 2.034 -3.209 1.00 0.00 O ATOM 1323 CB ARG A 89 -16.264 2.257 -5.816 1.00 0.00 C ATOM 1324 CG ARG A 89 -15.701 2.426 -7.218 1.00 0.00 C ATOM 1325 CD ARG A 89 -15.008 3.769 -7.381 1.00 0.00 C ATOM 1326 NE ARG A 89 -15.663 4.605 -8.384 1.00 0.00 N ATOM 1327 CZ ARG A 89 -15.068 5.622 -8.996 1.00 0.00 C ATOM 1328 NH1 ARG A 89 -13.810 5.928 -8.709 1.00 0.00 N ATOM 1329 NH2 ARG A 89 -15.730 6.336 -9.898 1.00 0.00 N ATOM 0 H ARG A 89 -13.197 1.857 -5.122 1.00 0.00 H new ATOM 0 HA ARG A 89 -14.798 3.328 -4.667 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -16.784 1.301 -5.755 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -17.006 3.035 -5.635 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -14.994 1.623 -7.427 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -16.506 2.340 -7.948 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -14.999 4.291 -6.424 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -13.968 3.608 -7.666 1.00 0.00 H new ATOM 0 HE ARG A 89 -16.631 4.396 -8.628 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -13.297 5.382 -8.017 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -13.355 6.710 -9.180 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -16.698 6.104 -10.122 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -15.271 7.117 -10.367 1.00 0.00 H new ATOM 1343 N ALA A 90 -14.989 1.632 -2.400 1.00 0.00 N ATOM 1344 CA ALA A 90 -15.461 1.287 -1.065 1.00 0.00 C ATOM 1345 C ALA A 90 -14.414 1.622 -0.009 1.00 0.00 C ATOM 1346 O ALA A 90 -13.291 1.118 -0.053 1.00 0.00 O ATOM 1347 CB ALA A 90 -15.828 -0.188 -0.999 1.00 0.00 C ATOM 0 H ALA A 90 -13.977 1.582 -2.515 1.00 0.00 H new ATOM 0 HA ALA A 90 -16.351 1.881 -0.857 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -16.179 -0.431 0.004 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -16.617 -0.399 -1.721 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -14.951 -0.792 -1.233 1.00 0.00 H new ATOM 1353 N ARG A 91 -14.787 2.475 0.939 1.00 0.00 N ATOM 1354 CA ARG A 91 -13.879 2.878 2.006 1.00 0.00 C ATOM 1355 C ARG A 91 -13.601 1.714 2.952 1.00 0.00 C ATOM 1356 O ARG A 91 -14.509 0.966 3.317 1.00 0.00 O ATOM 1357 CB ARG A 91 -14.465 4.056 2.787 1.00 0.00 C ATOM 1358 CG ARG A 91 -13.484 4.692 3.757 1.00 0.00 C ATOM 1359 CD ARG A 91 -13.755 6.179 3.928 1.00 0.00 C ATOM 1360 NE ARG A 91 -14.289 6.489 5.252 1.00 0.00 N ATOM 1361 CZ ARG A 91 -14.742 7.688 5.599 1.00 0.00 C ATOM 1362 NH1 ARG A 91 -14.726 8.685 4.725 1.00 0.00 N ATOM 1363 NH2 ARG A 91 -15.212 7.892 6.823 1.00 0.00 N ATOM 0 H ARG A 91 -15.712 2.901 0.990 1.00 0.00 H new ATOM 0 HA ARG A 91 -12.938 3.186 1.550 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -14.808 4.813 2.082 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -15.340 3.715 3.340 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -13.553 4.195 4.725 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -12.466 4.546 3.395 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -12.832 6.736 3.770 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -14.461 6.509 3.166 1.00 0.00 H new ATOM 0 HE ARG A 91 -14.315 5.744 5.948 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -14.365 8.532 3.783 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -15.075 9.605 4.994 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -15.225 7.128 7.498 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -15.560 8.813 7.089 1.00 0.00 H new ATOM 1377 N LEU A 92 -12.341 1.567 3.347 1.00 0.00 N ATOM 1378 CA LEU A 92 -11.943 0.494 4.251 1.00 0.00 C ATOM 1379 C LEU A 92 -11.706 1.028 5.660 1.00 0.00 C ATOM 1380 O LEU A 92 -11.128 2.100 5.838 1.00 0.00 O ATOM 1381 CB LEU A 92 -10.677 -0.192 3.734 1.00 0.00 C ATOM 1382 CG LEU A 92 -10.685 -0.592 2.258 1.00 0.00 C ATOM 1383 CD1 LEU A 92 -9.265 -0.704 1.727 1.00 0.00 C ATOM 1384 CD2 LEU A 92 -11.434 -1.902 2.064 1.00 0.00 C ATOM 0 H LEU A 92 -11.578 2.177 3.055 1.00 0.00 H new ATOM 0 HA LEU A 92 -12.754 -0.234 4.290 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -9.831 0.474 3.905 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -10.503 -1.087 4.331 1.00 0.00 H new ATOM 0 HG LEU A 92 -11.201 0.185 1.694 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -9.291 -0.989 0.675 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -8.761 0.257 1.830 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -8.723 -1.460 2.295 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -11.429 -2.171 1.008 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -10.947 -2.688 2.641 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -12.463 -1.787 2.404 1.00 0.00 H new ATOM 1396 N GLU A 93 -12.154 0.272 6.657 1.00 0.00 N ATOM 1397 CA GLU A 93 -11.988 0.671 8.050 1.00 0.00 C ATOM 1398 C GLU A 93 -10.543 0.483 8.502 1.00 0.00 C ATOM 1399 O GLU A 93 -9.767 -0.256 7.896 1.00 0.00 O ATOM 1400 CB GLU A 93 -12.924 -0.139 8.950 1.00 0.00 C ATOM 1401 CG GLU A 93 -14.125 0.649 9.445 1.00 0.00 C ATOM 1402 CD GLU A 93 -15.443 0.055 8.984 1.00 0.00 C ATOM 1403 OE1 GLU A 93 -15.613 -0.135 7.762 1.00 0.00 O ATOM 1404 OE2 GLU A 93 -16.303 -0.219 9.847 1.00 0.00 O ATOM 0 H GLU A 93 -12.634 -0.619 6.527 1.00 0.00 H new ATOM 0 HA GLU A 93 -12.241 1.728 8.131 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -13.275 -1.013 8.402 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -12.362 -0.506 9.809 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -14.108 0.684 10.534 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -14.051 1.677 9.092 1.00 0.00 H new ATOM 1411 N PRO A 94 -10.170 1.169 9.593 1.00 0.00 N ATOM 1412 CA PRO A 94 -8.817 1.095 10.151 1.00 0.00 C ATOM 1413 C PRO A 94 -8.524 -0.261 10.783 1.00 0.00 C ATOM 1414 O PRO A 94 -9.332 -0.788 11.549 1.00 0.00 O ATOM 1415 CB PRO A 94 -8.812 2.194 11.216 1.00 0.00 C ATOM 1416 CG PRO A 94 -10.241 2.350 11.607 1.00 0.00 C ATOM 1417 CD PRO A 94 -11.043 2.069 10.366 1.00 0.00 C ATOM 0 HA PRO A 94 -8.052 1.222 9.385 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -8.196 1.914 12.071 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -8.406 3.125 10.822 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -10.504 1.658 12.407 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -10.436 3.356 11.978 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -11.997 1.598 10.602 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -11.266 2.983 9.816 1.00 0.00 H new ATOM 1425 N LEU A 95 -7.364 -0.821 10.460 1.00 0.00 N ATOM 1426 CA LEU A 95 -6.963 -2.117 10.997 1.00 0.00 C ATOM 1427 C LEU A 95 -8.001 -3.186 10.672 1.00 0.00 C ATOM 1428 O LEU A 95 -8.333 -4.021 11.514 1.00 0.00 O ATOM 1429 CB LEU A 95 -6.768 -2.025 12.512 1.00 0.00 C ATOM 1430 CG LEU A 95 -6.103 -0.747 13.026 1.00 0.00 C ATOM 1431 CD1 LEU A 95 -5.997 -0.774 14.543 1.00 0.00 C ATOM 1432 CD2 LEU A 95 -4.729 -0.571 12.397 1.00 0.00 C ATOM 0 H LEU A 95 -6.684 -0.398 9.828 1.00 0.00 H new ATOM 0 HA LEU A 95 -6.019 -2.399 10.531 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -7.743 -2.121 12.990 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -6.169 -2.877 12.834 1.00 0.00 H new ATOM 0 HG LEU A 95 -6.723 0.103 12.740 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -5.521 0.143 14.891 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -6.994 -0.852 14.976 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -5.399 -1.632 14.851 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -4.271 0.343 12.774 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -4.100 -1.424 12.652 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.830 -0.506 11.314 1.00 0.00 H new ATOM 1444 N ARG A 96 -8.509 -3.155 9.444 1.00 0.00 N ATOM 1445 CA ARG A 96 -9.509 -4.122 9.006 1.00 0.00 C ATOM 1446 C ARG A 96 -8.937 -5.050 7.938 1.00 0.00 C ATOM 1447 O ARG A 96 -7.971 -4.707 7.256 1.00 0.00 O ATOM 1448 CB ARG A 96 -10.744 -3.401 8.463 1.00 0.00 C ATOM 1449 CG ARG A 96 -12.038 -4.172 8.664 1.00 0.00 C ATOM 1450 CD ARG A 96 -13.030 -3.386 9.506 1.00 0.00 C ATOM 1451 NE ARG A 96 -13.760 -4.244 10.436 1.00 0.00 N ATOM 1452 CZ ARG A 96 -13.266 -4.655 11.598 1.00 0.00 C ATOM 1453 NH1 ARG A 96 -12.048 -4.289 11.972 1.00 0.00 N ATOM 1454 NH2 ARG A 96 -13.991 -5.435 12.390 1.00 0.00 N ATOM 0 H ARG A 96 -8.245 -2.471 8.735 1.00 0.00 H new ATOM 0 HA ARG A 96 -9.798 -4.723 9.868 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -10.830 -2.430 8.950 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -10.605 -3.212 7.398 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -12.482 -4.399 7.695 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -11.824 -5.125 9.148 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -12.500 -2.615 10.065 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -13.737 -2.877 8.852 1.00 0.00 H new ATOM 0 HE ARG A 96 -14.700 -4.544 10.179 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -11.487 -3.690 11.366 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -11.672 -4.607 12.865 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -14.929 -5.719 12.106 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -13.611 -5.750 13.282 1.00 0.00 H new ATOM 1468 N VAL A 97 -9.540 -6.226 7.799 1.00 0.00 N ATOM 1469 CA VAL A 97 -9.092 -7.203 6.813 1.00 0.00 C ATOM 1470 C VAL A 97 -9.990 -7.193 5.581 1.00 0.00 C ATOM 1471 O VAL A 97 -11.209 -7.324 5.688 1.00 0.00 O ATOM 1472 CB VAL A 97 -9.066 -8.625 7.405 1.00 0.00 C ATOM 1473 CG1 VAL A 97 -8.430 -9.600 6.425 1.00 0.00 C ATOM 1474 CG2 VAL A 97 -8.328 -8.636 8.734 1.00 0.00 C ATOM 0 H VAL A 97 -10.340 -6.526 8.356 1.00 0.00 H new ATOM 0 HA VAL A 97 -8.080 -6.919 6.523 1.00 0.00 H new ATOM 0 HB VAL A 97 -10.093 -8.944 7.583 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -8.420 -10.599 6.860 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -9.006 -9.613 5.499 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -7.408 -9.287 6.212 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.320 -9.649 9.137 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -7.303 -8.297 8.584 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.831 -7.970 9.435 1.00 0.00 H new ATOM 1484 N TYR A 98 -9.379 -7.036 4.412 1.00 0.00 N ATOM 1485 CA TYR A 98 -10.123 -7.007 3.159 1.00 0.00 C ATOM 1486 C TYR A 98 -9.387 -7.782 2.070 1.00 0.00 C ATOM 1487 O TYR A 98 -8.492 -7.252 1.412 1.00 0.00 O ATOM 1488 CB TYR A 98 -10.347 -5.562 2.709 1.00 0.00 C ATOM 1489 CG TYR A 98 -11.489 -4.876 3.423 1.00 0.00 C ATOM 1490 CD1 TYR A 98 -12.791 -4.975 2.949 1.00 0.00 C ATOM 1491 CD2 TYR A 98 -11.266 -4.128 4.572 1.00 0.00 C ATOM 1492 CE1 TYR A 98 -13.838 -4.349 3.598 1.00 0.00 C ATOM 1493 CE2 TYR A 98 -12.307 -3.499 5.229 1.00 0.00 C ATOM 1494 CZ TYR A 98 -13.591 -3.613 4.738 1.00 0.00 C ATOM 1495 OH TYR A 98 -14.630 -2.988 5.388 1.00 0.00 O ATOM 0 H TYR A 98 -8.370 -6.927 4.306 1.00 0.00 H new ATOM 0 HA TYR A 98 -11.089 -7.483 3.328 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -9.432 -4.993 2.874 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -10.541 -5.550 1.636 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -12.988 -5.552 2.057 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -10.262 -4.036 4.959 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -14.844 -4.436 3.215 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -12.116 -2.922 6.122 1.00 0.00 H new ATOM 0 HH TYR A 98 -14.286 -2.513 6.173 1.00 0.00 H new ATOM 1505 N SER A 99 -9.772 -9.041 1.887 1.00 0.00 N ATOM 1506 CA SER A 99 -9.148 -9.892 0.880 1.00 0.00 C ATOM 1507 C SER A 99 -9.140 -9.206 -0.482 1.00 0.00 C ATOM 1508 O SER A 99 -10.177 -8.753 -0.967 1.00 0.00 O ATOM 1509 CB SER A 99 -9.883 -11.230 0.786 1.00 0.00 C ATOM 1510 OG SER A 99 -11.209 -11.119 1.273 1.00 0.00 O ATOM 0 H SER A 99 -10.513 -9.494 2.422 1.00 0.00 H new ATOM 0 HA SER A 99 -8.116 -10.073 1.182 1.00 0.00 H new ATOM 0 HB2 SER A 99 -9.900 -11.567 -0.250 1.00 0.00 H new ATOM 0 HB3 SER A 99 -9.344 -11.985 1.358 1.00 0.00 H new ATOM 0 HG SER A 99 -11.658 -11.987 1.200 1.00 0.00 H new ATOM 1516 N ILE A 100 -7.963 -9.134 -1.095 1.00 0.00 N ATOM 1517 CA ILE A 100 -7.820 -8.505 -2.401 1.00 0.00 C ATOM 1518 C ILE A 100 -7.562 -9.544 -3.487 1.00 0.00 C ATOM 1519 O ILE A 100 -7.027 -10.620 -3.217 1.00 0.00 O ATOM 1520 CB ILE A 100 -6.673 -7.477 -2.409 1.00 0.00 C ATOM 1521 CG1 ILE A 100 -5.327 -8.180 -2.216 1.00 0.00 C ATOM 1522 CG2 ILE A 100 -6.891 -6.432 -1.324 1.00 0.00 C ATOM 1523 CD1 ILE A 100 -4.145 -7.237 -2.238 1.00 0.00 C ATOM 0 H ILE A 100 -7.095 -9.504 -0.707 1.00 0.00 H new ATOM 0 HA ILE A 100 -8.759 -7.992 -2.607 1.00 0.00 H new ATOM 0 HB ILE A 100 -6.663 -6.973 -3.375 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -5.338 -8.714 -1.266 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -5.200 -8.927 -3.000 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -6.072 -5.713 -1.342 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -7.833 -5.914 -1.502 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -6.924 -6.920 -0.350 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.225 -7.804 -2.095 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.109 -6.721 -3.198 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.248 -6.505 -1.437 1.00 0.00 H new ATOM 1535 N HIS A 101 -7.946 -9.216 -4.717 1.00 0.00 N ATOM 1536 CA HIS A 101 -7.754 -10.120 -5.845 1.00 0.00 C ATOM 1537 C HIS A 101 -7.517 -9.339 -7.133 1.00 0.00 C ATOM 1538 O HIS A 101 -7.528 -8.108 -7.134 1.00 0.00 O ATOM 1539 CB HIS A 101 -8.970 -11.034 -6.005 1.00 0.00 C ATOM 1540 CG HIS A 101 -9.289 -11.827 -4.776 1.00 0.00 C ATOM 1541 ND1 HIS A 101 -8.648 -13.004 -4.452 1.00 0.00 N ATOM 1542 CD2 HIS A 101 -10.187 -11.605 -3.788 1.00 0.00 C ATOM 1543 CE1 HIS A 101 -9.139 -13.473 -3.318 1.00 0.00 C ATOM 1544 NE2 HIS A 101 -10.074 -12.642 -2.895 1.00 0.00 N ATOM 0 H HIS A 101 -8.392 -8.331 -4.957 1.00 0.00 H new ATOM 0 HA HIS A 101 -6.873 -10.730 -5.644 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -9.836 -10.429 -6.272 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -8.792 -11.719 -6.834 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -10.866 -10.768 -3.715 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -8.829 -14.381 -2.822 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -10.623 -12.753 -2.043 1.00 0.00 H new ATOM 1552 N GLN A 102 -7.301 -10.062 -8.227 1.00 0.00 N ATOM 1553 CA GLN A 102 -7.059 -9.436 -9.521 1.00 0.00 C ATOM 1554 C GLN A 102 -8.267 -8.618 -9.965 1.00 0.00 C ATOM 1555 O GLN A 102 -9.334 -9.167 -10.240 1.00 0.00 O ATOM 1556 CB GLN A 102 -6.733 -10.498 -10.573 1.00 0.00 C ATOM 1557 CG GLN A 102 -6.527 -9.930 -11.968 1.00 0.00 C ATOM 1558 CD GLN A 102 -5.228 -9.160 -12.099 1.00 0.00 C ATOM 1559 OE1 GLN A 102 -5.179 -7.955 -11.852 1.00 0.00 O ATOM 1560 NE2 GLN A 102 -4.165 -9.854 -12.488 1.00 0.00 N ATOM 0 H GLN A 102 -7.289 -11.082 -8.243 1.00 0.00 H new ATOM 0 HA GLN A 102 -6.207 -8.764 -9.417 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -5.832 -11.032 -10.271 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -7.542 -11.228 -10.603 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -6.537 -10.744 -12.693 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -7.361 -9.273 -12.215 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -4.250 -10.852 -12.682 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -3.263 -9.389 -12.592 1.00 0.00 H new ATOM 1569 N GLY A 103 -8.093 -7.301 -10.031 1.00 0.00 N ATOM 1570 CA GLY A 103 -9.178 -6.429 -10.441 1.00 0.00 C ATOM 1571 C GLY A 103 -9.629 -5.503 -9.329 1.00 0.00 C ATOM 1572 O GLY A 103 -10.822 -5.237 -9.179 1.00 0.00 O ATOM 0 H GLY A 103 -7.220 -6.823 -9.808 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -8.859 -5.835 -11.297 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -10.022 -7.035 -10.770 1.00 0.00 H new ATOM 1576 N ASP A 104 -8.675 -5.012 -8.547 1.00 0.00 N ATOM 1577 CA ASP A 104 -8.980 -4.111 -7.442 1.00 0.00 C ATOM 1578 C ASP A 104 -8.383 -2.728 -7.687 1.00 0.00 C ATOM 1579 O ASP A 104 -7.608 -2.533 -8.624 1.00 0.00 O ATOM 1580 CB ASP A 104 -8.449 -4.683 -6.127 1.00 0.00 C ATOM 1581 CG ASP A 104 -9.390 -5.703 -5.517 1.00 0.00 C ATOM 1582 OD1 ASP A 104 -10.478 -5.923 -6.090 1.00 0.00 O ATOM 1583 OD2 ASP A 104 -9.040 -6.280 -4.466 1.00 0.00 O ATOM 0 H ASP A 104 -7.683 -5.223 -8.658 1.00 0.00 H new ATOM 0 HA ASP A 104 -10.064 -4.013 -7.375 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -7.479 -5.147 -6.302 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -8.290 -3.870 -5.418 1.00 0.00 H new ATOM 1588 N TYR A 105 -8.750 -1.772 -6.841 1.00 0.00 N ATOM 1589 CA TYR A 105 -8.253 -0.407 -6.968 1.00 0.00 C ATOM 1590 C TYR A 105 -8.013 0.215 -5.596 1.00 0.00 C ATOM 1591 O TYR A 105 -8.946 0.681 -4.942 1.00 0.00 O ATOM 1592 CB TYR A 105 -9.244 0.446 -7.762 1.00 0.00 C ATOM 1593 CG TYR A 105 -8.862 0.626 -9.214 1.00 0.00 C ATOM 1594 CD1 TYR A 105 -8.946 -0.432 -10.110 1.00 0.00 C ATOM 1595 CD2 TYR A 105 -8.416 1.853 -9.689 1.00 0.00 C ATOM 1596 CE1 TYR A 105 -8.597 -0.273 -11.437 1.00 0.00 C ATOM 1597 CE2 TYR A 105 -8.067 2.022 -11.014 1.00 0.00 C ATOM 1598 CZ TYR A 105 -8.159 0.955 -11.885 1.00 0.00 C ATOM 1599 OH TYR A 105 -7.810 1.119 -13.206 1.00 0.00 O ATOM 0 H TYR A 105 -9.390 -1.917 -6.060 1.00 0.00 H new ATOM 0 HA TYR A 105 -7.303 -0.440 -7.502 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -10.230 -0.015 -7.709 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -9.324 1.426 -7.292 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -9.290 -1.395 -9.763 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -8.341 2.689 -9.010 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -8.667 -1.107 -12.120 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -7.724 2.983 -11.367 1.00 0.00 H new ATOM 0 HH TYR A 105 -7.755 2.075 -13.414 1.00 0.00 H new ATOM 1609 N ILE A 106 -6.755 0.220 -5.168 1.00 0.00 N ATOM 1610 CA ILE A 106 -6.391 0.786 -3.875 1.00 0.00 C ATOM 1611 C ILE A 106 -6.074 2.272 -3.996 1.00 0.00 C ATOM 1612 O ILE A 106 -5.134 2.662 -4.689 1.00 0.00 O ATOM 1613 CB ILE A 106 -5.177 0.061 -3.265 1.00 0.00 C ATOM 1614 CG1 ILE A 106 -5.480 -1.428 -3.089 1.00 0.00 C ATOM 1615 CG2 ILE A 106 -4.798 0.691 -1.933 1.00 0.00 C ATOM 1616 CD1 ILE A 106 -4.954 -2.289 -4.216 1.00 0.00 C ATOM 0 H ILE A 106 -5.971 -0.161 -5.698 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.251 0.653 -3.218 1.00 0.00 H new ATOM 0 HB ILE A 106 -4.332 0.162 -3.946 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -5.047 -1.770 -2.149 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.559 -1.564 -3.011 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -3.938 0.168 -1.514 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -4.545 1.740 -2.086 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -5.639 0.617 -1.243 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.205 -3.332 -4.025 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -5.406 -1.974 -5.156 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -3.871 -2.182 -4.280 1.00 0.00 H new ATOM 1628 N GLN A 107 -6.863 3.098 -3.316 1.00 0.00 N ATOM 1629 CA GLN A 107 -6.665 4.542 -3.346 1.00 0.00 C ATOM 1630 C GLN A 107 -6.192 5.055 -1.990 1.00 0.00 C ATOM 1631 O GLN A 107 -6.884 4.905 -0.982 1.00 0.00 O ATOM 1632 CB GLN A 107 -7.961 5.247 -3.748 1.00 0.00 C ATOM 1633 CG GLN A 107 -7.738 6.510 -4.565 1.00 0.00 C ATOM 1634 CD GLN A 107 -8.990 6.964 -5.291 1.00 0.00 C ATOM 1635 OE1 GLN A 107 -9.211 6.611 -6.450 1.00 0.00 O ATOM 1636 NE2 GLN A 107 -9.816 7.750 -4.612 1.00 0.00 N ATOM 0 H GLN A 107 -7.645 2.792 -2.738 1.00 0.00 H new ATOM 0 HA GLN A 107 -5.895 4.763 -4.086 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -8.577 4.556 -4.323 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -8.521 5.500 -2.848 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -7.395 7.308 -3.907 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -6.945 6.333 -5.292 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -9.593 8.017 -3.653 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -10.674 8.087 -5.049 1.00 0.00 H new ATOM 1645 N LEU A 108 -5.010 5.662 -1.972 1.00 0.00 N ATOM 1646 CA LEU A 108 -4.445 6.198 -0.738 1.00 0.00 C ATOM 1647 C LEU A 108 -4.900 7.635 -0.510 1.00 0.00 C ATOM 1648 O LEU A 108 -4.252 8.581 -0.957 1.00 0.00 O ATOM 1649 CB LEU A 108 -2.917 6.136 -0.786 1.00 0.00 C ATOM 1650 CG LEU A 108 -2.308 4.755 -1.031 1.00 0.00 C ATOM 1651 CD1 LEU A 108 -0.804 4.861 -1.224 1.00 0.00 C ATOM 1652 CD2 LEU A 108 -2.635 3.816 0.122 1.00 0.00 C ATOM 0 H LEU A 108 -4.425 5.795 -2.797 1.00 0.00 H new ATOM 0 HA LEU A 108 -4.802 5.588 0.092 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.571 6.808 -1.571 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -2.528 6.520 0.157 1.00 0.00 H new ATOM 0 HG LEU A 108 -2.742 4.344 -1.943 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -0.389 3.868 -1.397 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -0.591 5.498 -2.082 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.352 5.293 -0.331 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -2.194 2.838 -0.069 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -2.229 4.222 1.048 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -3.716 3.715 0.213 1.00 0.00 H new ATOM 1664 N GLY A 109 -6.019 7.792 0.191 1.00 0.00 N ATOM 1665 CA GLY A 109 -6.540 9.118 0.468 1.00 0.00 C ATOM 1666 C GLY A 109 -7.576 9.558 -0.547 1.00 0.00 C ATOM 1667 O GLY A 109 -8.048 8.754 -1.352 1.00 0.00 O ATOM 0 H GLY A 109 -6.574 7.025 0.572 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -6.983 9.130 1.464 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -5.718 9.833 0.477 1.00 0.00 H new ATOM 1671 N VAL A 110 -7.933 10.838 -0.510 1.00 0.00 N ATOM 1672 CA VAL A 110 -8.920 11.383 -1.434 1.00 0.00 C ATOM 1673 C VAL A 110 -8.290 12.409 -2.369 1.00 0.00 C ATOM 1674 O VAL A 110 -7.261 13.013 -2.065 1.00 0.00 O ATOM 1675 CB VAL A 110 -10.090 12.042 -0.680 1.00 0.00 C ATOM 1676 CG1 VAL A 110 -11.047 10.986 -0.150 1.00 0.00 C ATOM 1677 CG2 VAL A 110 -9.570 12.918 0.450 1.00 0.00 C ATOM 0 H VAL A 110 -7.553 11.517 0.150 1.00 0.00 H new ATOM 0 HA VAL A 110 -9.300 10.547 -2.021 1.00 0.00 H new ATOM 0 HB VAL A 110 -10.637 12.676 -1.378 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -11.867 11.471 0.380 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -11.445 10.406 -0.982 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -10.516 10.323 0.533 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -10.410 13.376 0.972 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -8.997 12.308 1.149 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -8.929 13.699 0.040 1.00 0.00 H new ATOM 1687 N PRO A 111 -8.920 12.612 -3.536 1.00 0.00 N ATOM 1688 CA PRO A 111 -8.439 13.566 -4.540 1.00 0.00 C ATOM 1689 C PRO A 111 -8.601 15.014 -4.088 1.00 0.00 C ATOM 1690 O PRO A 111 -9.615 15.380 -3.493 1.00 0.00 O ATOM 1691 CB PRO A 111 -9.328 13.282 -5.753 1.00 0.00 C ATOM 1692 CG PRO A 111 -10.575 12.701 -5.181 1.00 0.00 C ATOM 1693 CD PRO A 111 -10.151 11.927 -3.964 1.00 0.00 C ATOM 0 HA PRO A 111 -7.374 13.448 -4.738 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -9.537 14.194 -6.313 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -8.847 12.587 -6.442 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -11.285 13.485 -4.917 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -11.070 12.052 -5.903 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -10.915 11.950 -3.187 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -9.967 10.879 -4.199 1.00 0.00 H new ATOM 1701 N LEU A 112 -7.595 15.833 -4.374 1.00 0.00 N ATOM 1702 CA LEU A 112 -7.626 17.242 -3.997 1.00 0.00 C ATOM 1703 C LEU A 112 -8.706 17.990 -4.773 1.00 0.00 C ATOM 1704 O LEU A 112 -9.301 17.449 -5.704 1.00 0.00 O ATOM 1705 CB LEU A 112 -6.262 17.888 -4.249 1.00 0.00 C ATOM 1706 CG LEU A 112 -5.156 17.526 -3.257 1.00 0.00 C ATOM 1707 CD1 LEU A 112 -5.608 17.797 -1.830 1.00 0.00 C ATOM 1708 CD2 LEU A 112 -4.747 16.070 -3.421 1.00 0.00 C ATOM 0 H LEU A 112 -6.748 15.546 -4.865 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.860 17.303 -2.934 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -5.930 17.611 -5.250 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.388 18.971 -4.243 1.00 0.00 H new ATOM 0 HG LEU A 112 -4.289 18.152 -3.467 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -4.808 17.533 -1.139 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -5.849 18.854 -1.719 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -6.491 17.198 -1.608 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -3.959 15.831 -2.707 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -5.609 15.427 -3.240 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -4.380 15.907 -4.434 1.00 0.00 H new ATOM 1800 N ALA A 118 -7.453 11.021 -7.918 1.00 0.00 N ATOM 1801 CA ALA A 118 -6.400 10.852 -6.925 1.00 0.00 C ATOM 1802 C ALA A 118 -5.020 10.909 -7.572 1.00 0.00 C ATOM 1803 O ALA A 118 -4.896 10.849 -8.795 1.00 0.00 O ATOM 1804 CB ALA A 118 -6.582 9.537 -6.181 1.00 0.00 C ATOM 0 HA ALA A 118 -6.472 11.673 -6.212 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -5.788 9.424 -5.442 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -7.549 9.534 -5.678 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -6.539 8.709 -6.889 1.00 0.00 H new ATOM 1810 N GLU A 119 -3.987 11.024 -6.744 1.00 0.00 N ATOM 1811 CA GLU A 119 -2.617 11.090 -7.238 1.00 0.00 C ATOM 1812 C GLU A 119 -2.022 9.692 -7.382 1.00 0.00 C ATOM 1813 O GLU A 119 -1.509 9.330 -8.441 1.00 0.00 O ATOM 1814 CB GLU A 119 -1.751 11.930 -6.295 1.00 0.00 C ATOM 1815 CG GLU A 119 -2.430 13.203 -5.819 1.00 0.00 C ATOM 1816 CD GLU A 119 -2.790 13.156 -4.346 1.00 0.00 C ATOM 1817 OE1 GLU A 119 -1.865 13.210 -3.508 1.00 0.00 O ATOM 1818 OE2 GLU A 119 -3.995 13.066 -4.032 1.00 0.00 O ATOM 0 H GLU A 119 -4.073 11.073 -5.729 1.00 0.00 H new ATOM 0 HA GLU A 119 -2.635 11.561 -8.221 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -1.481 11.326 -5.429 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -0.823 12.191 -6.803 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -1.771 14.052 -6.001 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -3.334 13.369 -6.405 1.00 0.00 H new ATOM 1825 N TYR A 120 -2.094 8.912 -6.309 1.00 0.00 N ATOM 1826 CA TYR A 120 -1.561 7.555 -6.314 1.00 0.00 C ATOM 1827 C TYR A 120 -2.679 6.531 -6.487 1.00 0.00 C ATOM 1828 O TYR A 120 -3.619 6.484 -5.695 1.00 0.00 O ATOM 1829 CB TYR A 120 -0.798 7.280 -5.017 1.00 0.00 C ATOM 1830 CG TYR A 120 0.214 8.349 -4.671 1.00 0.00 C ATOM 1831 CD1 TYR A 120 -0.175 9.520 -4.033 1.00 0.00 C ATOM 1832 CD2 TYR A 120 1.558 8.188 -4.983 1.00 0.00 C ATOM 1833 CE1 TYR A 120 0.745 10.500 -3.715 1.00 0.00 C ATOM 1834 CE2 TYR A 120 2.486 9.162 -4.669 1.00 0.00 C ATOM 1835 CZ TYR A 120 2.075 10.316 -4.035 1.00 0.00 C ATOM 1836 OH TYR A 120 2.995 11.289 -3.721 1.00 0.00 O ATOM 0 H TYR A 120 -2.516 9.196 -5.425 1.00 0.00 H new ATOM 0 HA TYR A 120 -0.876 7.464 -7.157 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -1.512 7.188 -4.198 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -0.286 6.321 -5.103 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -1.215 9.667 -3.781 1.00 0.00 H new ATOM 0 HD2 TYR A 120 1.883 7.286 -5.480 1.00 0.00 H new ATOM 0 HE1 TYR A 120 0.426 11.405 -3.219 1.00 0.00 H new ATOM 0 HE2 TYR A 120 3.527 9.021 -4.918 1.00 0.00 H new ATOM 0 HH TYR A 120 3.646 11.370 -4.449 1.00 0.00 H new ATOM 1846 N GLU A 121 -2.566 5.712 -7.528 1.00 0.00 N ATOM 1847 CA GLU A 121 -3.567 4.689 -7.806 1.00 0.00 C ATOM 1848 C GLU A 121 -2.913 3.419 -8.341 1.00 0.00 C ATOM 1849 O GLU A 121 -2.067 3.472 -9.234 1.00 0.00 O ATOM 1850 CB GLU A 121 -4.595 5.209 -8.812 1.00 0.00 C ATOM 1851 CG GLU A 121 -5.642 6.122 -8.196 1.00 0.00 C ATOM 1852 CD GLU A 121 -6.170 7.150 -9.178 1.00 0.00 C ATOM 1853 OE1 GLU A 121 -6.485 6.767 -10.325 1.00 0.00 O ATOM 1854 OE2 GLU A 121 -6.268 8.336 -8.801 1.00 0.00 O ATOM 0 H GLU A 121 -1.792 5.737 -8.192 1.00 0.00 H new ATOM 0 HA GLU A 121 -4.074 4.450 -6.871 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -4.075 5.749 -9.604 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -5.095 4.361 -9.279 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -6.471 5.519 -7.825 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -5.211 6.634 -7.336 1.00 0.00 H new ATOM 1861 N TYR A 122 -3.310 2.278 -7.789 1.00 0.00 N ATOM 1862 CA TYR A 122 -2.760 0.994 -8.208 1.00 0.00 C ATOM 1863 C TYR A 122 -3.875 -0.002 -8.514 1.00 0.00 C ATOM 1864 O TYR A 122 -5.055 0.298 -8.337 1.00 0.00 O ATOM 1865 CB TYR A 122 -1.841 0.430 -7.123 1.00 0.00 C ATOM 1866 CG TYR A 122 -0.878 1.449 -6.555 1.00 0.00 C ATOM 1867 CD1 TYR A 122 0.348 1.689 -7.163 1.00 0.00 C ATOM 1868 CD2 TYR A 122 -1.195 2.171 -5.411 1.00 0.00 C ATOM 1869 CE1 TYR A 122 1.231 2.618 -6.648 1.00 0.00 C ATOM 1870 CE2 TYR A 122 -0.319 3.103 -4.890 1.00 0.00 C ATOM 1871 CZ TYR A 122 0.893 3.323 -5.511 1.00 0.00 C ATOM 1872 OH TYR A 122 1.769 4.249 -4.994 1.00 0.00 O ATOM 0 H TYR A 122 -4.011 2.216 -7.050 1.00 0.00 H new ATOM 0 HA TYR A 122 -2.181 1.155 -9.117 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -2.451 0.029 -6.314 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -1.273 -0.403 -7.537 1.00 0.00 H new ATOM 0 HD1 TYR A 122 0.615 1.140 -8.054 1.00 0.00 H new ATOM 0 HD2 TYR A 122 -2.142 2.001 -4.921 1.00 0.00 H new ATOM 0 HE1 TYR A 122 2.181 2.792 -7.132 1.00 0.00 H new ATOM 0 HE2 TYR A 122 -0.582 3.657 -4.001 1.00 0.00 H new ATOM 0 HH TYR A 122 1.592 5.126 -5.394 1.00 0.00 H new ATOM 1882 N GLU A 123 -3.489 -1.189 -8.973 1.00 0.00 N ATOM 1883 CA GLU A 123 -4.456 -2.229 -9.304 1.00 0.00 C ATOM 1884 C GLU A 123 -3.887 -3.614 -9.008 1.00 0.00 C ATOM 1885 O GLU A 123 -2.951 -4.067 -9.667 1.00 0.00 O ATOM 1886 CB GLU A 123 -4.856 -2.135 -10.778 1.00 0.00 C ATOM 1887 CG GLU A 123 -5.959 -3.102 -11.173 1.00 0.00 C ATOM 1888 CD GLU A 123 -6.049 -3.304 -12.673 1.00 0.00 C ATOM 1889 OE1 GLU A 123 -5.000 -3.228 -13.346 1.00 0.00 O ATOM 1890 OE2 GLU A 123 -7.169 -3.539 -13.173 1.00 0.00 O ATOM 0 H GLU A 123 -2.516 -1.454 -9.124 1.00 0.00 H new ATOM 0 HA GLU A 123 -5.340 -2.077 -8.685 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -5.183 -1.117 -10.993 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -3.979 -2.326 -11.396 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -5.784 -4.064 -10.691 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -6.914 -2.729 -10.803 1.00 0.00 H new ATOM 1897 N VAL A 124 -4.459 -4.281 -8.011 1.00 0.00 N ATOM 1898 CA VAL A 124 -4.011 -5.614 -7.627 1.00 0.00 C ATOM 1899 C VAL A 124 -3.951 -6.543 -8.834 1.00 0.00 C ATOM 1900 O VAL A 124 -4.958 -6.775 -9.504 1.00 0.00 O ATOM 1901 CB VAL A 124 -4.936 -6.233 -6.562 1.00 0.00 C ATOM 1902 CG1 VAL A 124 -4.414 -7.593 -6.125 1.00 0.00 C ATOM 1903 CG2 VAL A 124 -5.076 -5.298 -5.370 1.00 0.00 C ATOM 0 H VAL A 124 -5.234 -3.920 -7.454 1.00 0.00 H new ATOM 0 HA VAL A 124 -3.011 -5.502 -7.208 1.00 0.00 H new ATOM 0 HB VAL A 124 -5.923 -6.375 -7.002 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -5.081 -8.014 -5.373 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -4.371 -8.260 -6.986 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -3.415 -7.481 -5.703 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -5.733 -5.751 -4.627 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -4.095 -5.122 -4.928 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -5.500 -4.350 -5.699 1.00 0.00 H new ATOM 1913 N THR A 125 -2.763 -7.075 -9.107 1.00 0.00 N ATOM 1914 CA THR A 125 -2.571 -7.979 -10.234 1.00 0.00 C ATOM 1915 C THR A 125 -1.439 -8.963 -9.962 1.00 0.00 C ATOM 1916 O THR A 125 -0.569 -8.708 -9.130 1.00 0.00 O ATOM 1917 CB THR A 125 -2.262 -7.204 -11.529 1.00 0.00 C ATOM 1918 OG1 THR A 125 -2.022 -8.121 -12.602 1.00 0.00 O ATOM 1919 CG2 THR A 125 -1.052 -6.302 -11.344 1.00 0.00 C ATOM 0 H THR A 125 -1.919 -6.895 -8.562 1.00 0.00 H new ATOM 0 HA THR A 125 -3.504 -8.528 -10.362 1.00 0.00 H new ATOM 0 HB THR A 125 -3.124 -6.582 -11.770 1.00 0.00 H new ATOM 0 HG1 THR A 125 -1.828 -7.621 -13.422 1.00 0.00 H new ATOM 0 HG21 THR A 125 -0.853 -5.765 -12.272 1.00 0.00 H new ATOM 0 HG22 THR A 125 -1.250 -5.587 -10.546 1.00 0.00 H new ATOM 0 HG23 THR A 125 -0.184 -6.907 -11.082 1.00 0.00 H new ATOM 1927 N GLU A 126 -1.457 -10.088 -10.669 1.00 0.00 N ATOM 1928 CA GLU A 126 -0.431 -11.111 -10.503 1.00 0.00 C ATOM 1929 C GLU A 126 0.483 -11.169 -11.724 1.00 0.00 C ATOM 1930 O GLU A 126 0.043 -11.499 -12.825 1.00 0.00 O ATOM 1931 CB GLU A 126 -1.076 -12.479 -10.270 1.00 0.00 C ATOM 1932 CG GLU A 126 -0.170 -13.464 -9.550 1.00 0.00 C ATOM 1933 CD GLU A 126 -0.932 -14.637 -8.965 1.00 0.00 C ATOM 1934 OE1 GLU A 126 -2.139 -14.767 -9.258 1.00 0.00 O ATOM 1935 OE2 GLU A 126 -0.320 -15.426 -8.215 1.00 0.00 O ATOM 0 H GLU A 126 -2.170 -10.314 -11.362 1.00 0.00 H new ATOM 0 HA GLU A 126 0.170 -10.848 -9.633 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -1.989 -12.347 -9.689 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -1.368 -12.902 -11.231 1.00 0.00 H new ATOM 0 HG2 GLU A 126 0.583 -13.835 -10.246 1.00 0.00 H new ATOM 0 HG3 GLU A 126 0.362 -12.946 -8.752 1.00 0.00 H new ATOM 1942 N GLU A 127 1.755 -10.845 -11.520 1.00 0.00 N ATOM 1943 CA GLU A 127 2.730 -10.858 -12.604 1.00 0.00 C ATOM 1944 C GLU A 127 4.049 -11.473 -12.143 1.00 0.00 C ATOM 1945 O GLU A 127 4.402 -11.400 -10.966 1.00 0.00 O ATOM 1946 CB GLU A 127 2.970 -9.439 -13.122 1.00 0.00 C ATOM 1947 CG GLU A 127 1.833 -8.902 -13.975 1.00 0.00 C ATOM 1948 CD GLU A 127 1.775 -9.549 -15.344 1.00 0.00 C ATOM 1949 OE1 GLU A 127 2.575 -10.474 -15.597 1.00 0.00 O ATOM 1950 OE2 GLU A 127 0.930 -9.131 -16.163 1.00 0.00 O ATOM 0 H GLU A 127 2.135 -10.570 -10.614 1.00 0.00 H new ATOM 0 HA GLU A 127 2.327 -11.468 -13.412 1.00 0.00 H new ATOM 0 HB2 GLU A 127 3.122 -8.772 -12.273 1.00 0.00 H new ATOM 0 HB3 GLU A 127 3.890 -9.426 -13.707 1.00 0.00 H new ATOM 0 HG2 GLU A 127 0.887 -9.067 -13.459 1.00 0.00 H new ATOM 0 HG3 GLU A 127 1.949 -7.824 -14.091 1.00 0.00 H new ATOM 1957 N ASP A 128 4.772 -12.078 -13.078 1.00 0.00 N ATOM 1958 CA ASP A 128 6.051 -12.706 -12.769 1.00 0.00 C ATOM 1959 C ASP A 128 7.096 -11.656 -12.401 1.00 0.00 C ATOM 1960 O ASP A 128 7.018 -10.509 -12.839 1.00 0.00 O ATOM 1961 CB ASP A 128 6.539 -13.533 -13.960 1.00 0.00 C ATOM 1962 CG ASP A 128 5.643 -14.722 -14.245 1.00 0.00 C ATOM 1963 OD1 ASP A 128 5.732 -15.722 -13.503 1.00 0.00 O ATOM 1964 OD2 ASP A 128 4.853 -14.652 -15.210 1.00 0.00 O ATOM 0 H ASP A 128 4.494 -12.147 -14.057 1.00 0.00 H new ATOM 0 HA ASP A 128 5.907 -13.366 -11.914 1.00 0.00 H new ATOM 0 HB2 ASP A 128 6.587 -12.898 -14.844 1.00 0.00 H new ATOM 0 HB3 ASP A 128 7.552 -13.884 -13.764 1.00 0.00 H new ATOM 1969 N TRP A 129 8.071 -12.058 -11.594 1.00 0.00 N ATOM 1970 CA TRP A 129 9.131 -11.152 -11.166 1.00 0.00 C ATOM 1971 C TRP A 129 9.871 -10.574 -12.367 1.00 0.00 C ATOM 1972 O TRP A 129 10.324 -9.431 -12.337 1.00 0.00 O ATOM 1973 CB TRP A 129 10.113 -11.881 -10.248 1.00 0.00 C ATOM 1974 CG TRP A 129 11.405 -11.145 -10.057 1.00 0.00 C ATOM 1975 CD1 TRP A 129 12.609 -11.439 -10.630 1.00 0.00 C ATOM 1976 CD2 TRP A 129 11.621 -9.993 -9.233 1.00 0.00 C ATOM 1977 NE1 TRP A 129 13.561 -10.540 -10.213 1.00 0.00 N ATOM 1978 CE2 TRP A 129 12.980 -9.643 -9.356 1.00 0.00 C ATOM 1979 CE3 TRP A 129 10.799 -9.223 -8.406 1.00 0.00 C ATOM 1980 CZ2 TRP A 129 13.532 -8.557 -8.682 1.00 0.00 C ATOM 1981 CZ3 TRP A 129 11.349 -8.147 -7.737 1.00 0.00 C ATOM 1982 CH2 TRP A 129 12.705 -7.821 -7.879 1.00 0.00 C ATOM 0 H TRP A 129 8.150 -13.005 -11.223 1.00 0.00 H new ATOM 0 HA TRP A 129 8.673 -10.330 -10.616 1.00 0.00 H new ATOM 0 HB2 TRP A 129 9.644 -12.036 -9.276 1.00 0.00 H new ATOM 0 HB3 TRP A 129 10.323 -12.867 -10.662 1.00 0.00 H new ATOM 0 HD1 TRP A 129 12.787 -12.258 -11.311 1.00 0.00 H new ATOM 0 HE1 TRP A 129 14.541 -10.541 -10.496 1.00 0.00 H new ATOM 0 HE3 TRP A 129 9.753 -9.465 -8.292 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 14.577 -8.305 -8.790 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 10.723 -7.546 -7.093 1.00 0.00 H new ATOM 0 HH2 TRP A 129 13.104 -6.972 -7.344 1.00 0.00 H new ATOM 1993 N GLU A 130 9.990 -11.372 -13.424 1.00 0.00 N ATOM 1994 CA GLU A 130 10.677 -10.938 -14.635 1.00 0.00 C ATOM 1995 C GLU A 130 9.832 -9.929 -15.407 1.00 0.00 C ATOM 1996 O GLU A 130 10.287 -9.344 -16.391 1.00 0.00 O ATOM 1997 CB GLU A 130 10.995 -12.141 -15.526 1.00 0.00 C ATOM 1998 CG GLU A 130 11.579 -13.322 -14.769 1.00 0.00 C ATOM 1999 CD GLU A 130 12.816 -13.889 -15.437 1.00 0.00 C ATOM 2000 OE1 GLU A 130 12.735 -14.250 -16.629 1.00 0.00 O ATOM 2001 OE2 GLU A 130 13.867 -13.973 -14.766 1.00 0.00 O ATOM 0 H GLU A 130 9.620 -12.322 -13.466 1.00 0.00 H new ATOM 0 HA GLU A 130 11.609 -10.456 -14.341 1.00 0.00 H new ATOM 0 HB2 GLU A 130 10.083 -12.459 -16.031 1.00 0.00 H new ATOM 0 HB3 GLU A 130 11.698 -11.833 -16.300 1.00 0.00 H new ATOM 0 HG2 GLU A 130 11.829 -13.011 -13.755 1.00 0.00 H new ATOM 0 HG3 GLU A 130 10.825 -14.104 -14.686 1.00 0.00 H new ATOM 2008 N THR A 131 8.598 -9.730 -14.955 1.00 0.00 N ATOM 2009 CA THR A 131 7.688 -8.793 -15.603 1.00 0.00 C ATOM 2010 C THR A 131 7.645 -7.464 -14.858 1.00 0.00 C ATOM 2011 O THR A 131 7.475 -6.407 -15.466 1.00 0.00 O ATOM 2012 CB THR A 131 6.261 -9.366 -15.691 1.00 0.00 C ATOM 2013 OG1 THR A 131 6.266 -10.578 -16.454 1.00 0.00 O ATOM 2014 CG2 THR A 131 5.314 -8.363 -16.331 1.00 0.00 C ATOM 0 H THR A 131 8.205 -10.205 -14.142 1.00 0.00 H new ATOM 0 HA THR A 131 8.068 -8.629 -16.611 1.00 0.00 H new ATOM 0 HB THR A 131 5.914 -9.575 -14.679 1.00 0.00 H new ATOM 0 HG1 THR A 131 5.355 -10.937 -16.504 1.00 0.00 H new ATOM 0 HG21 THR A 131 4.312 -8.790 -16.382 1.00 0.00 H new ATOM 0 HG22 THR A 131 5.290 -7.452 -15.733 1.00 0.00 H new ATOM 0 HG23 THR A 131 5.660 -8.127 -17.337 1.00 0.00 H new ATOM 2022 N ILE A 132 7.800 -7.525 -13.540 1.00 0.00 N ATOM 2023 CA ILE A 132 7.780 -6.325 -12.713 1.00 0.00 C ATOM 2024 C ILE A 132 9.194 -5.832 -12.424 1.00 0.00 C ATOM 2025 O ILE A 132 9.393 -4.689 -12.013 1.00 0.00 O ATOM 2026 CB ILE A 132 7.053 -6.573 -11.378 1.00 0.00 C ATOM 2027 CG1 ILE A 132 5.683 -7.207 -11.629 1.00 0.00 C ATOM 2028 CG2 ILE A 132 6.906 -5.271 -10.605 1.00 0.00 C ATOM 2029 CD1 ILE A 132 5.143 -7.969 -10.439 1.00 0.00 C ATOM 0 H ILE A 132 7.941 -8.392 -13.022 1.00 0.00 H new ATOM 0 HA ILE A 132 7.240 -5.564 -13.276 1.00 0.00 H new ATOM 0 HB ILE A 132 7.648 -7.263 -10.780 1.00 0.00 H new ATOM 0 HG12 ILE A 132 4.974 -6.425 -11.902 1.00 0.00 H new ATOM 0 HG13 ILE A 132 5.755 -7.883 -12.481 1.00 0.00 H new ATOM 0 HG21 ILE A 132 6.390 -5.463 -9.664 1.00 0.00 H new ATOM 0 HG22 ILE A 132 7.893 -4.856 -10.400 1.00 0.00 H new ATOM 0 HG23 ILE A 132 6.329 -4.560 -11.196 1.00 0.00 H new ATOM 0 HD11 ILE A 132 4.170 -8.391 -10.689 1.00 0.00 H new ATOM 0 HD12 ILE A 132 5.831 -8.773 -10.179 1.00 0.00 H new ATOM 0 HD13 ILE A 132 5.038 -7.293 -9.591 1.00 0.00 H new ATOM 2041 N TYR A 133 10.174 -6.702 -12.644 1.00 0.00 N ATOM 2042 CA TYR A 133 11.570 -6.357 -12.407 1.00 0.00 C ATOM 2043 C TYR A 133 11.955 -5.093 -13.170 1.00 0.00 C ATOM 2044 O TYR A 133 12.425 -4.110 -12.597 1.00 0.00 O ATOM 2045 CB TYR A 133 12.481 -7.514 -12.822 1.00 0.00 C ATOM 2046 CG TYR A 133 13.856 -7.072 -13.269 1.00 0.00 C ATOM 2047 CD1 TYR A 133 14.618 -6.209 -12.491 1.00 0.00 C ATOM 2048 CD2 TYR A 133 14.393 -7.517 -14.471 1.00 0.00 C ATOM 2049 CE1 TYR A 133 15.874 -5.802 -12.896 1.00 0.00 C ATOM 2050 CE2 TYR A 133 15.649 -7.117 -14.884 1.00 0.00 C ATOM 2051 CZ TYR A 133 16.385 -6.259 -14.093 1.00 0.00 C ATOM 2052 OH TYR A 133 17.637 -5.857 -14.500 1.00 0.00 O ATOM 0 H TYR A 133 10.027 -7.652 -12.986 1.00 0.00 H new ATOM 0 HA TYR A 133 11.696 -6.169 -11.341 1.00 0.00 H new ATOM 0 HB2 TYR A 133 12.585 -8.202 -11.983 1.00 0.00 H new ATOM 0 HB3 TYR A 133 12.005 -8.067 -13.632 1.00 0.00 H new ATOM 0 HD1 TYR A 133 14.221 -5.850 -11.553 1.00 0.00 H new ATOM 0 HD2 TYR A 133 13.818 -8.187 -15.093 1.00 0.00 H new ATOM 0 HE1 TYR A 133 16.453 -5.130 -12.279 1.00 0.00 H new ATOM 0 HE2 TYR A 133 16.052 -7.474 -15.820 1.00 0.00 H new ATOM 0 HH TYR A 133 17.848 -6.269 -15.363 1.00 0.00 H new ATOM 2062 N PRO A 134 11.752 -5.119 -14.496 1.00 0.00 N ATOM 2063 CA PRO A 134 12.070 -3.983 -15.367 1.00 0.00 C ATOM 2064 C PRO A 134 11.439 -2.683 -14.879 1.00 0.00 C ATOM 2065 O PRO A 134 12.100 -1.646 -14.822 1.00 0.00 O ATOM 2066 CB PRO A 134 11.472 -4.393 -16.716 1.00 0.00 C ATOM 2067 CG PRO A 134 11.467 -5.883 -16.691 1.00 0.00 C ATOM 2068 CD PRO A 134 11.196 -6.257 -15.246 1.00 0.00 C ATOM 0 HA PRO A 134 13.141 -3.784 -15.402 1.00 0.00 H new ATOM 0 HB2 PRO A 134 10.465 -3.996 -16.840 1.00 0.00 H new ATOM 0 HB3 PRO A 134 12.068 -4.013 -17.545 1.00 0.00 H new ATOM 0 HG2 PRO A 134 10.699 -6.285 -17.352 1.00 0.00 H new ATOM 0 HG3 PRO A 134 12.422 -6.285 -17.029 1.00 0.00 H new ATOM 0 HD2 PRO A 134 10.130 -6.383 -15.055 1.00 0.00 H new ATOM 0 HD3 PRO A 134 11.681 -7.194 -14.974 1.00 0.00 H new ATOM 2076 N CYS A 135 10.160 -2.747 -14.528 1.00 0.00 N ATOM 2077 CA CYS A 135 9.440 -1.574 -14.045 1.00 0.00 C ATOM 2078 C CYS A 135 9.065 -1.734 -12.575 1.00 0.00 C ATOM 2079 O CYS A 135 7.885 -1.740 -12.222 1.00 0.00 O ATOM 2080 CB CYS A 135 8.183 -1.340 -14.882 1.00 0.00 C ATOM 2081 SG CYS A 135 8.462 -1.405 -16.668 1.00 0.00 S ATOM 0 H CYS A 135 9.600 -3.598 -14.569 1.00 0.00 H new ATOM 0 HA CYS A 135 10.097 -0.710 -14.142 1.00 0.00 H new ATOM 0 HB2 CYS A 135 7.437 -2.088 -14.614 1.00 0.00 H new ATOM 0 HB3 CYS A 135 7.765 -0.367 -14.626 1.00 0.00 H new ATOM 0 HG CYS A 135 7.340 -1.197 -17.290 1.00 0.00 H new ATOM 2087 N LEU A 136 10.075 -1.865 -11.723 1.00 0.00 N ATOM 2088 CA LEU A 136 9.851 -2.028 -10.290 1.00 0.00 C ATOM 2089 C LEU A 136 9.674 -0.674 -9.610 1.00 0.00 C ATOM 2090 O LEU A 136 9.885 0.372 -10.223 1.00 0.00 O ATOM 2091 CB LEU A 136 11.020 -2.782 -9.654 1.00 0.00 C ATOM 2092 CG LEU A 136 10.713 -4.192 -9.147 1.00 0.00 C ATOM 2093 CD1 LEU A 136 11.932 -4.790 -8.461 1.00 0.00 C ATOM 2094 CD2 LEU A 136 9.522 -4.170 -8.200 1.00 0.00 C ATOM 0 H LEU A 136 11.057 -1.862 -11.999 1.00 0.00 H new ATOM 0 HA LEU A 136 8.937 -2.605 -10.153 1.00 0.00 H new ATOM 0 HB2 LEU A 136 11.825 -2.848 -10.386 1.00 0.00 H new ATOM 0 HB3 LEU A 136 11.396 -2.191 -8.819 1.00 0.00 H new ATOM 0 HG LEU A 136 10.460 -4.818 -10.002 1.00 0.00 H new ATOM 0 HD11 LEU A 136 11.695 -5.793 -8.107 1.00 0.00 H new ATOM 0 HD12 LEU A 136 12.759 -4.841 -9.169 1.00 0.00 H new ATOM 0 HD13 LEU A 136 12.217 -4.165 -7.615 1.00 0.00 H new ATOM 0 HD21 LEU A 136 9.318 -5.181 -7.849 1.00 0.00 H new ATOM 0 HD22 LEU A 136 9.747 -3.529 -7.348 1.00 0.00 H new ATOM 0 HD23 LEU A 136 8.648 -3.784 -8.724 1.00 0.00 H new ATOM 2106 N SER A 137 9.287 -0.702 -8.339 1.00 0.00 N ATOM 2107 CA SER A 137 9.080 0.523 -7.575 1.00 0.00 C ATOM 2108 C SER A 137 10.296 0.834 -6.708 1.00 0.00 C ATOM 2109 O SER A 137 11.122 -0.031 -6.418 1.00 0.00 O ATOM 2110 CB SER A 137 7.832 0.398 -6.698 1.00 0.00 C ATOM 2111 OG SER A 137 8.090 0.844 -5.378 1.00 0.00 O ATOM 0 H SER A 137 9.110 -1.560 -7.816 1.00 0.00 H new ATOM 0 HA SER A 137 8.939 1.342 -8.280 1.00 0.00 H new ATOM 0 HB2 SER A 137 7.020 0.982 -7.130 1.00 0.00 H new ATOM 0 HB3 SER A 137 7.501 -0.640 -6.676 1.00 0.00 H new ATOM 0 HG SER A 137 8.139 0.072 -4.776 1.00 0.00 H new ATOM 2117 N PRO A 138 10.409 2.101 -6.283 1.00 0.00 N ATOM 2118 CA PRO A 138 11.520 2.558 -5.442 1.00 0.00 C ATOM 2119 C PRO A 138 11.451 1.987 -4.030 1.00 0.00 C ATOM 2120 O PRO A 138 10.537 2.301 -3.266 1.00 0.00 O ATOM 2121 CB PRO A 138 11.342 4.078 -5.414 1.00 0.00 C ATOM 2122 CG PRO A 138 9.890 4.294 -5.668 1.00 0.00 C ATOM 2123 CD PRO A 138 9.461 3.186 -6.590 1.00 0.00 C ATOM 0 HA PRO A 138 12.486 2.236 -5.832 1.00 0.00 H new ATOM 0 HB2 PRO A 138 11.642 4.494 -4.452 1.00 0.00 H new ATOM 0 HB3 PRO A 138 11.953 4.562 -6.175 1.00 0.00 H new ATOM 0 HG2 PRO A 138 9.323 4.269 -4.737 1.00 0.00 H new ATOM 0 HG3 PRO A 138 9.714 5.269 -6.122 1.00 0.00 H new ATOM 0 HD2 PRO A 138 8.430 2.884 -6.403 1.00 0.00 H new ATOM 0 HD3 PRO A 138 9.520 3.488 -7.636 1.00 0.00 H new ATOM 2131 N LYS A 139 12.422 1.147 -3.688 1.00 0.00 N ATOM 2132 CA LYS A 139 12.473 0.533 -2.367 1.00 0.00 C ATOM 2133 C LYS A 139 13.344 1.352 -1.419 1.00 0.00 C ATOM 2134 O LYS A 139 14.490 1.672 -1.735 1.00 0.00 O ATOM 2135 CB LYS A 139 13.013 -0.896 -2.466 1.00 0.00 C ATOM 2136 CG LYS A 139 11.936 -1.937 -2.720 1.00 0.00 C ATOM 2137 CD LYS A 139 12.531 -3.325 -2.888 1.00 0.00 C ATOM 2138 CE LYS A 139 11.463 -4.351 -3.232 1.00 0.00 C ATOM 2139 NZ LYS A 139 11.998 -5.740 -3.203 1.00 0.00 N ATOM 0 H LYS A 139 13.185 0.876 -4.308 1.00 0.00 H new ATOM 0 HA LYS A 139 11.459 0.505 -1.968 1.00 0.00 H new ATOM 0 HB2 LYS A 139 13.748 -0.943 -3.269 1.00 0.00 H new ATOM 0 HB3 LYS A 139 13.535 -1.143 -1.541 1.00 0.00 H new ATOM 0 HG2 LYS A 139 11.230 -1.941 -1.890 1.00 0.00 H new ATOM 0 HG3 LYS A 139 11.374 -1.670 -3.615 1.00 0.00 H new ATOM 0 HD2 LYS A 139 13.285 -3.306 -3.674 1.00 0.00 H new ATOM 0 HD3 LYS A 139 13.037 -3.619 -1.968 1.00 0.00 H new ATOM 0 HE2 LYS A 139 10.637 -4.265 -2.526 1.00 0.00 H new ATOM 0 HE3 LYS A 139 11.060 -4.138 -4.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 11.239 -6.409 -3.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 12.770 -5.829 -3.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 12.359 -5.953 -2.251 1.00 0.00 H new ATOM 2153 N SER A 140 12.793 1.687 -0.257 1.00 0.00 N ATOM 2154 CA SER A 140 13.519 2.471 0.735 1.00 0.00 C ATOM 2155 C SER A 140 14.120 1.567 1.808 1.00 0.00 C ATOM 2156 O SER A 140 15.138 1.897 2.415 1.00 0.00 O ATOM 2157 CB SER A 140 12.591 3.501 1.382 1.00 0.00 C ATOM 2158 OG SER A 140 13.021 3.823 2.693 1.00 0.00 O ATOM 0 H SER A 140 11.846 1.428 0.021 1.00 0.00 H new ATOM 0 HA SER A 140 14.330 2.992 0.227 1.00 0.00 H new ATOM 0 HB2 SER A 140 12.564 4.404 0.773 1.00 0.00 H new ATOM 0 HB3 SER A 140 11.575 3.109 1.415 1.00 0.00 H new ATOM 0 HG SER A 140 12.412 4.484 3.084 1.00 0.00 H new