USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1204 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 61 TYR OH : rot -91:sc= 1.35 USER MOD Set 1.2: D 307 TYR OH : rot -15:sc= -0.103 USER MOD Set 2.1: A 30 ASN : amide:sc= 1.54 K(o=5.1,f=1.3!) USER MOD Set 2.2: B 107 TYR OH : rot -127:sc= 1.82 USER MOD Set 2.3: C 261 TYR OH : rot 100:sc= 1.75 USER MOD Set 3.1: C 222 ASN : amide:sc= -0.027 X(o=-0.26,f=-0.36) USER MOD Set 3.2: C 245 ASN : amide:sc= -0.229 X(o=-0.26,f=-0.36) USER MOD Set 4.1: A 54 LYS NZ :NH3+ 166:sc= 1.57 (180deg=0.856) USER MOD Set 4.2: C 267 ASN : amide:sc= -0.818 K(o=0.75,f=-7!) USER MOD Set 5.1: A 22 ASN : amide:sc= -1.54! K(o=-1.5!,f=-2.5) USER MOD Set 5.2: A 45 ASN : amide:sc= 0.0505 K(o=-1.5,f=-2.5) USER MOD Single : A 16 SER OG : rot 107:sc= 0.887 USER MOD Single : A 17 HIS : no HE2:sc= 0.768 K(o=0.77,f=-4.4!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HE2:sc= -1.44 K(o=-1.4,f=-3.7!) USER MOD Single : A 27 LYS NZ :NH3+ -126:sc= -2.64 (180deg=-3.43!) USER MOD Single : A 31 THR OG1 : rot 160:sc= 0.00923 USER MOD Single : A 33 ASN :FLIP amide:sc= 0 F(o=-2.4!,f=0) USER MOD Single : A 37 GLN : amide:sc= -0.569 X(o=-0.57,f=-0.48) USER MOD Single : A 43 LYS NZ :NH3+ 161:sc= 1.13 (180deg=0.883) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 46 ASN : amide:sc= -0.948! C(o=-0.95!,f=-3!) USER MOD Single : A 48 GLN : amide:sc= 1.03 K(o=1,f=-4.9!) USER MOD Single : A 56 LYS NZ :NH3+ -170:sc= 0.929 (180deg=0.816) USER MOD Single : A 59 GLN : amide:sc= -4.02! C(o=-4!,f=-9.3!) USER MOD Single : A 64 LYS NZ :NH3+ 168:sc= 0.934 (180deg=0.833) USER MOD Single : A 67 ASN : amide:sc= -0.129 X(o=-0.13,f=-0.017) USER MOD Single : A 68 LYS NZ :NH3+ 138:sc= 0.975 (180deg=-0.468) USER MOD Single : B 108 THR OG1 : rot 68:sc= 0.24 USER MOD Single : B 109 SER OG : rot 180:sc= 0.227 USER MOD Single : B 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 121 TYR OH : rot 180:sc= 0 USER MOD Single : B 123 SER OG : rot 180:sc= 0 USER MOD Single : B 124 MET CE :methyl -179:sc= -0.572 (180deg=-0.595) USER MOD Single : B 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 216 SER OG : rot -33:sc= -0.529 USER MOD Single : C 217 HIS : no HD1:sc= 0.221 K(o=0.22,f=-6!) USER MOD Single : C 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 225 HIS : no HD1:sc= -2.35! X(o=-2.4!,f=-2.5) USER MOD Single : C 227 LYS NZ :NH3+ -167:sc= -1.75! (180deg=-2.04!) USER MOD Single : C 230 ASN : amide:sc= -0.463 X(o=-0.46,f=0) USER MOD Single : C 231 THR OG1 : rot 43:sc= -2.21! USER MOD Single : C 233 ASN :FLIP amide:sc=-0.00903 F(o=-0.99,f=-0.009) USER MOD Single : C 237 GLN : amide:sc= -0.27 K(o=-0.27,f=-2.5) USER MOD Single : C 243 LYS NZ :NH3+ -136:sc= -0.852 (180deg=-2.98!) USER MOD Single : C 244 ASN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : C 246 ASN : amide:sc= -0.482 X(o=-0.48,f=0) USER MOD Single : C 248 GLN : amide:sc= 0.912 K(o=0.91,f=-6.9!) USER MOD Single : C 254 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 256 LYS NZ :NH3+ -134:sc= 0.287 (180deg=0.131) USER MOD Single : C 259 GLN : amide:sc= -3.25! C(o=-3.3!,f=-6.6!) USER MOD Single : C 264 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 268 LYS NZ :NH3+ 158:sc= 0.149 (180deg=-0.202) USER MOD Single : D 308 THR OG1 : rot 180:sc= 0 USER MOD Single : D 309 SER OG : rot 180:sc= 0 USER MOD Single : D 311 ASN : amide:sc= -0.291 X(o=-0.29,f=-0.67) USER MOD Single : D 321 TYR OH : rot 180:sc= 0 USER MOD Single : D 323 SER OG : rot 95:sc= 1.08 USER MOD Single : D 324 MET CE :methyl 141:sc= -0.153 (180deg=-0.681) USER MOD Single : D 325 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 139 N CYS A 9 -10.526 -7.912 12.851 1.00 55.43 N ATOM 140 CA CYS A 9 -9.280 -7.510 12.231 1.00 45.44 C ATOM 141 C CYS A 9 -9.426 -7.709 10.730 1.00 44.44 C ATOM 142 O CYS A 9 -10.309 -8.456 10.299 1.00 31.52 O ATOM 143 CB CYS A 9 -8.033 -8.257 12.822 1.00 3.14 C ATOM 144 SG CYS A 9 -7.414 -7.572 14.426 1.00 31.35 S ATOM 0 HA CYS A 9 -9.088 -6.459 12.447 1.00 45.44 H new ATOM 0 HB2 CYS A 9 -8.289 -9.307 12.965 1.00 3.14 H new ATOM 0 HB3 CYS A 9 -7.225 -8.222 12.091 1.00 3.14 H new ATOM 149 N PRO A 10 -8.594 -7.041 9.904 1.00 44.01 N ATOM 150 CA PRO A 10 -8.779 -7.027 8.452 1.00 10.21 C ATOM 151 C PRO A 10 -8.625 -8.397 7.774 1.00 33.23 C ATOM 152 O PRO A 10 -9.059 -8.590 6.629 1.00 40.33 O ATOM 153 CB PRO A 10 -7.754 -5.992 7.988 1.00 40.01 C ATOM 154 CG PRO A 10 -6.715 -5.974 9.010 1.00 43.35 C ATOM 155 CD PRO A 10 -7.401 -6.254 10.304 1.00 30.11 C ATOM 0 HA PRO A 10 -9.801 -6.772 8.171 1.00 10.21 H new ATOM 0 HB2 PRO A 10 -7.341 -6.260 7.016 1.00 40.01 H new ATOM 0 HB3 PRO A 10 -8.213 -5.009 7.880 1.00 40.01 H new ATOM 0 HG2 PRO A 10 -5.952 -6.725 8.803 1.00 43.35 H new ATOM 0 HG3 PRO A 10 -6.212 -5.007 9.037 1.00 43.35 H new ATOM 0 HD2 PRO A 10 -6.760 -6.815 10.984 1.00 30.11 H new ATOM 0 HD3 PRO A 10 -7.681 -5.334 10.816 1.00 30.11 H new ATOM 163 N CYS A 11 -8.039 -9.335 8.471 1.00 13.43 N ATOM 164 CA CYS A 11 -7.941 -10.679 7.976 1.00 51.01 C ATOM 165 C CYS A 11 -9.030 -11.544 8.566 1.00 52.10 C ATOM 166 O CYS A 11 -9.171 -11.630 9.789 1.00 31.11 O ATOM 167 CB CYS A 11 -6.569 -11.306 8.273 1.00 31.45 C ATOM 168 SG CYS A 11 -5.149 -10.585 7.368 1.00 73.42 S ATOM 0 H CYS A 11 -7.620 -9.189 9.390 1.00 13.43 H new ATOM 0 HA CYS A 11 -8.061 -10.627 6.894 1.00 51.01 H new ATOM 0 HB2 CYS A 11 -6.375 -11.220 9.342 1.00 31.45 H new ATOM 0 HB3 CYS A 11 -6.620 -12.370 8.043 1.00 31.45 H new ATOM 173 N ARG A 12 -9.809 -12.176 7.706 1.00 12.00 N ATOM 174 CA ARG A 12 -10.785 -13.155 8.151 1.00 33.15 C ATOM 175 C ARG A 12 -9.963 -14.383 8.459 1.00 44.44 C ATOM 176 O ARG A 12 -9.990 -14.941 9.561 1.00 70.32 O ATOM 177 CB ARG A 12 -11.760 -13.466 7.007 1.00 54.34 C ATOM 178 CG ARG A 12 -12.858 -14.443 7.362 1.00 33.32 C ATOM 179 CD ARG A 12 -13.668 -14.823 6.137 1.00 24.13 C ATOM 180 NE ARG A 12 -14.319 -13.669 5.500 1.00 64.34 N ATOM 181 CZ ARG A 12 -14.770 -13.659 4.241 1.00 71.52 C ATOM 182 NH1 ARG A 12 -14.595 -14.727 3.463 1.00 12.04 N ATOM 183 NH2 ARG A 12 -15.386 -12.580 3.756 1.00 34.04 N ATOM 0 H ARG A 12 -9.785 -12.029 6.697 1.00 12.00 H new ATOM 0 HA ARG A 12 -11.370 -12.811 9.004 1.00 33.15 H new ATOM 0 HB2 ARG A 12 -12.216 -12.534 6.672 1.00 54.34 H new ATOM 0 HB3 ARG A 12 -11.195 -13.865 6.165 1.00 54.34 H new ATOM 0 HG2 ARG A 12 -12.423 -15.338 7.806 1.00 33.32 H new ATOM 0 HG3 ARG A 12 -13.513 -14.001 8.113 1.00 33.32 H new ATOM 0 HD2 ARG A 12 -13.015 -15.311 5.413 1.00 24.13 H new ATOM 0 HD3 ARG A 12 -14.428 -15.551 6.422 1.00 24.13 H new ATOM 0 HE ARG A 12 -14.434 -12.821 6.054 1.00 64.34 H new ATOM 0 HH11 ARG A 12 -14.117 -15.551 3.828 1.00 12.04 H new ATOM 0 HH12 ARG A 12 -14.939 -14.720 2.503 1.00 12.04 H new ATOM 0 HH21 ARG A 12 -15.515 -11.758 4.346 1.00 34.04 H new ATOM 0 HH22 ARG A 12 -15.728 -12.577 2.795 1.00 34.04 H new ATOM 197 N PHE A 13 -9.241 -14.767 7.458 1.00 62.13 N ATOM 198 CA PHE A 13 -8.201 -15.731 7.496 1.00 63.30 C ATOM 199 C PHE A 13 -7.161 -15.085 6.653 1.00 20.12 C ATOM 200 O PHE A 13 -7.532 -14.377 5.699 1.00 70.41 O ATOM 201 CB PHE A 13 -8.639 -17.067 6.869 1.00 53.34 C ATOM 202 CG PHE A 13 -9.820 -17.708 7.548 1.00 72.20 C ATOM 203 CD1 PHE A 13 -9.656 -18.435 8.715 1.00 72.41 C ATOM 204 CD2 PHE A 13 -11.091 -17.586 7.012 1.00 54.33 C ATOM 205 CE1 PHE A 13 -10.740 -19.024 9.337 1.00 65.43 C ATOM 206 CE2 PHE A 13 -12.176 -18.169 7.629 1.00 13.35 C ATOM 207 CZ PHE A 13 -12.003 -18.890 8.792 1.00 2.42 C ATOM 0 H PHE A 13 -9.377 -14.383 6.523 1.00 62.13 H new ATOM 0 HA PHE A 13 -7.880 -15.980 8.507 1.00 63.30 H new ATOM 0 HB2 PHE A 13 -8.883 -16.901 5.820 1.00 53.34 H new ATOM 0 HB3 PHE A 13 -7.799 -17.761 6.895 1.00 53.34 H new ATOM 0 HD1 PHE A 13 -8.670 -18.543 9.143 1.00 72.41 H new ATOM 0 HD2 PHE A 13 -11.233 -17.027 6.099 1.00 54.33 H new ATOM 0 HE1 PHE A 13 -10.601 -19.588 10.247 1.00 65.43 H new ATOM 0 HE2 PHE A 13 -13.162 -18.061 7.202 1.00 13.35 H new ATOM 0 HZ PHE A 13 -12.853 -19.349 9.276 1.00 2.42 H new ATOM 217 N PHE A 14 -5.915 -15.213 6.971 1.00 22.21 N ATOM 218 CA PHE A 14 -4.969 -14.556 6.136 1.00 74.11 C ATOM 219 C PHE A 14 -4.496 -15.494 5.063 1.00 75.43 C ATOM 220 O PHE A 14 -4.130 -16.639 5.315 1.00 4.14 O ATOM 221 CB PHE A 14 -3.819 -13.875 6.893 1.00 11.41 C ATOM 222 CG PHE A 14 -2.828 -14.777 7.528 1.00 40.10 C ATOM 223 CD1 PHE A 14 -1.747 -15.206 6.798 1.00 31.50 C ATOM 224 CD2 PHE A 14 -2.957 -15.175 8.842 1.00 63.43 C ATOM 225 CE1 PHE A 14 -0.797 -16.020 7.349 1.00 12.23 C ATOM 226 CE2 PHE A 14 -2.011 -15.999 9.414 1.00 22.13 C ATOM 227 CZ PHE A 14 -0.925 -16.422 8.665 1.00 5.00 C ATOM 0 H PHE A 14 -5.542 -15.739 7.762 1.00 22.21 H new ATOM 0 HA PHE A 14 -5.486 -13.722 5.662 1.00 74.11 H new ATOM 0 HB2 PHE A 14 -3.291 -13.221 6.198 1.00 11.41 H new ATOM 0 HB3 PHE A 14 -4.248 -13.238 7.667 1.00 11.41 H new ATOM 0 HD1 PHE A 14 -1.645 -14.894 5.769 1.00 31.50 H new ATOM 0 HD2 PHE A 14 -3.802 -14.840 9.425 1.00 63.43 H new ATOM 0 HE1 PHE A 14 0.047 -16.347 6.760 1.00 12.23 H new ATOM 0 HE2 PHE A 14 -2.116 -16.313 10.442 1.00 22.13 H new ATOM 0 HZ PHE A 14 -0.179 -17.065 9.109 1.00 5.00 H new ATOM 237 N GLU A 15 -4.515 -15.015 3.898 1.00 20.40 N ATOM 238 CA GLU A 15 -4.231 -15.781 2.767 1.00 24.32 C ATOM 239 C GLU A 15 -2.769 -15.668 2.407 1.00 13.01 C ATOM 240 O GLU A 15 -2.216 -14.567 2.295 1.00 13.02 O ATOM 241 CB GLU A 15 -5.104 -15.313 1.629 1.00 43.22 C ATOM 242 CG GLU A 15 -6.607 -15.366 1.909 1.00 11.11 C ATOM 243 CD GLU A 15 -7.150 -16.734 2.275 1.00 0.41 C ATOM 244 OE1 GLU A 15 -6.781 -17.273 3.329 1.00 74.43 O ATOM 245 OE2 GLU A 15 -8.001 -17.269 1.507 1.00 64.13 O ATOM 0 H GLU A 15 -4.737 -14.041 3.694 1.00 20.40 H new ATOM 0 HA GLU A 15 -4.440 -16.831 2.972 1.00 24.32 H new ATOM 0 HB2 GLU A 15 -4.831 -14.288 1.379 1.00 43.22 H new ATOM 0 HB3 GLU A 15 -4.891 -15.923 0.751 1.00 43.22 H new ATOM 0 HG2 GLU A 15 -6.833 -14.674 2.721 1.00 11.11 H new ATOM 0 HG3 GLU A 15 -7.137 -15.007 1.027 1.00 11.11 H new ATOM 252 N SER A 16 -2.151 -16.797 2.239 1.00 54.40 N ATOM 253 CA SER A 16 -0.780 -16.859 1.917 1.00 72.44 C ATOM 254 C SER A 16 -0.568 -17.028 0.395 1.00 64.43 C ATOM 255 O SER A 16 -0.139 -16.108 -0.274 1.00 22.51 O ATOM 256 CB SER A 16 -0.152 -17.990 2.699 1.00 31.10 C ATOM 257 OG SER A 16 -0.851 -19.214 2.468 1.00 63.21 O ATOM 0 H SER A 16 -2.602 -17.708 2.326 1.00 54.40 H new ATOM 0 HA SER A 16 -0.296 -15.922 2.192 1.00 72.44 H new ATOM 0 HB2 SER A 16 0.893 -18.102 2.410 1.00 31.10 H new ATOM 0 HB3 SER A 16 -0.165 -17.754 3.763 1.00 31.10 H new ATOM 0 HG SER A 16 -0.305 -19.801 1.904 1.00 63.21 H new ATOM 263 N HIS A 17 -0.905 -18.200 -0.156 1.00 54.13 N ATOM 264 CA HIS A 17 -0.703 -18.426 -1.595 1.00 70.42 C ATOM 265 C HIS A 17 -1.784 -17.807 -2.452 1.00 13.52 C ATOM 266 O HIS A 17 -2.632 -18.491 -2.997 1.00 11.22 O ATOM 267 CB HIS A 17 -0.457 -19.899 -1.991 1.00 32.44 C ATOM 268 CG HIS A 17 0.835 -20.477 -1.496 1.00 34.14 C ATOM 269 ND1 HIS A 17 1.089 -21.825 -1.434 1.00 3.13 N ATOM 270 CD2 HIS A 17 1.955 -19.876 -1.054 1.00 10.14 C ATOM 271 CE1 HIS A 17 2.299 -22.021 -0.980 1.00 12.40 C ATOM 272 NE2 HIS A 17 2.847 -20.856 -0.740 1.00 42.10 N ATOM 0 H HIS A 17 -1.307 -18.987 0.353 1.00 54.13 H new ATOM 0 HA HIS A 17 0.229 -17.901 -1.804 1.00 70.42 H new ATOM 0 HB2 HIS A 17 -1.279 -20.505 -1.610 1.00 32.44 H new ATOM 0 HB3 HIS A 17 -0.481 -19.977 -3.078 1.00 32.44 H new ATOM 0 HD1 HIS A 17 0.434 -22.560 -1.701 1.00 3.13 H new ATOM 0 HD2 HIS A 17 2.117 -18.812 -0.965 1.00 10.14 H new ATOM 0 HE1 HIS A 17 2.768 -22.982 -0.828 1.00 12.40 H new ATOM 281 N VAL A 18 -1.776 -16.518 -2.509 1.00 24.24 N ATOM 282 CA VAL A 18 -2.677 -15.769 -3.336 1.00 54.21 C ATOM 283 C VAL A 18 -1.928 -15.339 -4.562 1.00 31.03 C ATOM 284 O VAL A 18 -0.775 -14.906 -4.469 1.00 20.31 O ATOM 285 CB VAL A 18 -3.232 -14.544 -2.588 1.00 23.24 C ATOM 286 CG1 VAL A 18 -4.047 -13.641 -3.510 1.00 40.23 C ATOM 287 CG2 VAL A 18 -4.096 -15.002 -1.445 1.00 62.24 C ATOM 0 H VAL A 18 -1.131 -15.938 -1.972 1.00 24.24 H new ATOM 0 HA VAL A 18 -3.529 -16.392 -3.608 1.00 54.21 H new ATOM 0 HB VAL A 18 -2.386 -13.968 -2.214 1.00 23.24 H new ATOM 0 HG11 VAL A 18 -4.422 -12.787 -2.945 1.00 40.23 H new ATOM 0 HG12 VAL A 18 -3.415 -13.288 -4.325 1.00 40.23 H new ATOM 0 HG13 VAL A 18 -4.887 -14.202 -3.919 1.00 40.23 H new ATOM 0 HG21 VAL A 18 -4.489 -14.134 -0.915 1.00 62.24 H new ATOM 0 HG22 VAL A 18 -4.924 -15.597 -1.830 1.00 62.24 H new ATOM 0 HG23 VAL A 18 -3.502 -15.607 -0.760 1.00 62.24 H new ATOM 297 N ALA A 19 -2.542 -15.469 -5.696 1.00 45.31 N ATOM 298 CA ALA A 19 -1.868 -15.152 -6.920 1.00 32.03 C ATOM 299 C ALA A 19 -1.749 -13.645 -7.117 1.00 71.50 C ATOM 300 O ALA A 19 -2.736 -12.912 -7.094 1.00 55.32 O ATOM 301 CB ALA A 19 -2.528 -15.830 -8.108 1.00 21.44 C ATOM 0 H ALA A 19 -3.504 -15.791 -5.802 1.00 45.31 H new ATOM 0 HA ALA A 19 -0.854 -15.546 -6.850 1.00 32.03 H new ATOM 0 HB1 ALA A 19 -1.992 -15.568 -9.020 1.00 21.44 H new ATOM 0 HB2 ALA A 19 -2.503 -16.911 -7.970 1.00 21.44 H new ATOM 0 HB3 ALA A 19 -3.563 -15.498 -8.188 1.00 21.44 H new ATOM 307 N ARG A 20 -0.529 -13.214 -7.314 1.00 3.24 N ATOM 308 CA ARG A 20 -0.172 -11.819 -7.516 1.00 1.54 C ATOM 309 C ARG A 20 -0.695 -11.306 -8.875 1.00 13.43 C ATOM 310 O ARG A 20 -0.829 -10.109 -9.094 1.00 35.30 O ATOM 311 CB ARG A 20 1.366 -11.689 -7.302 1.00 44.00 C ATOM 312 CG ARG A 20 2.054 -10.334 -7.538 1.00 25.51 C ATOM 313 CD ARG A 20 2.376 -10.082 -8.993 1.00 13.40 C ATOM 314 NE ARG A 20 3.235 -8.904 -9.159 1.00 3.05 N ATOM 315 CZ ARG A 20 4.521 -8.953 -9.568 1.00 10.41 C ATOM 316 NH1 ARG A 20 5.121 -10.126 -9.764 1.00 24.54 N ATOM 317 NH2 ARG A 20 5.204 -7.832 -9.742 1.00 43.04 N ATOM 0 H ARG A 20 0.276 -13.840 -7.340 1.00 3.24 H new ATOM 0 HA ARG A 20 -0.656 -11.166 -6.790 1.00 1.54 H new ATOM 0 HB2 ARG A 20 1.579 -11.988 -6.276 1.00 44.00 H new ATOM 0 HB3 ARG A 20 1.849 -12.418 -7.953 1.00 44.00 H new ATOM 0 HG2 ARG A 20 1.409 -9.536 -7.171 1.00 25.51 H new ATOM 0 HG3 ARG A 20 2.974 -10.293 -6.955 1.00 25.51 H new ATOM 0 HD2 ARG A 20 2.872 -10.957 -9.414 1.00 13.40 H new ATOM 0 HD3 ARG A 20 1.451 -9.940 -9.552 1.00 13.40 H new ATOM 0 HE ARG A 20 2.835 -7.989 -8.952 1.00 3.05 H new ATOM 0 HH11 ARG A 20 4.609 -10.994 -9.605 1.00 24.54 H new ATOM 0 HH12 ARG A 20 6.093 -10.157 -10.073 1.00 24.54 H new ATOM 0 HH21 ARG A 20 4.759 -6.931 -9.567 1.00 43.04 H new ATOM 0 HH22 ARG A 20 6.175 -7.869 -10.051 1.00 43.04 H new ATOM 331 N ALA A 21 -0.964 -12.229 -9.770 1.00 30.32 N ATOM 332 CA ALA A 21 -1.601 -11.929 -11.047 1.00 71.41 C ATOM 333 C ALA A 21 -3.141 -11.862 -10.907 1.00 30.41 C ATOM 334 O ALA A 21 -3.851 -11.446 -11.829 1.00 21.30 O ATOM 335 CB ALA A 21 -1.214 -12.969 -12.084 1.00 70.40 C ATOM 0 H ALA A 21 -0.749 -13.217 -9.639 1.00 30.32 H new ATOM 0 HA ALA A 21 -1.251 -10.950 -11.374 1.00 71.41 H new ATOM 0 HB1 ALA A 21 -1.696 -12.734 -13.033 1.00 70.40 H new ATOM 0 HB2 ALA A 21 -0.132 -12.966 -12.216 1.00 70.40 H new ATOM 0 HB3 ALA A 21 -1.536 -13.955 -11.748 1.00 70.40 H new ATOM 341 N ASN A 22 -3.648 -12.297 -9.754 1.00 45.22 N ATOM 342 CA ASN A 22 -5.100 -12.417 -9.528 1.00 24.13 C ATOM 343 C ASN A 22 -5.600 -11.313 -8.578 1.00 61.31 C ATOM 344 O ASN A 22 -6.724 -11.333 -8.118 1.00 34.42 O ATOM 345 CB ASN A 22 -5.405 -13.821 -8.936 1.00 0.41 C ATOM 346 CG ASN A 22 -6.895 -14.164 -8.819 1.00 44.34 C ATOM 347 OD1 ASN A 22 -7.731 -13.691 -9.597 1.00 63.50 O ATOM 348 ND2 ASN A 22 -7.229 -15.007 -7.867 1.00 20.41 N ATOM 0 H ASN A 22 -3.078 -12.575 -8.955 1.00 45.22 H new ATOM 0 HA ASN A 22 -5.622 -12.299 -10.478 1.00 24.13 H new ATOM 0 HB2 ASN A 22 -4.922 -14.574 -9.558 1.00 0.41 H new ATOM 0 HB3 ASN A 22 -4.953 -13.888 -7.946 1.00 0.41 H new ATOM 0 HD21 ASN A 22 -8.203 -15.289 -7.754 1.00 20.41 H new ATOM 0 HD22 ASN A 22 -6.514 -15.379 -7.241 1.00 20.41 H new ATOM 355 N VAL A 23 -4.770 -10.344 -8.331 1.00 32.33 N ATOM 356 CA VAL A 23 -5.106 -9.244 -7.435 1.00 72.33 C ATOM 357 C VAL A 23 -5.275 -7.909 -8.203 1.00 73.11 C ATOM 358 O VAL A 23 -4.658 -7.706 -9.225 1.00 41.10 O ATOM 359 CB VAL A 23 -4.063 -9.124 -6.254 1.00 12.11 C ATOM 360 CG1 VAL A 23 -2.662 -9.264 -6.759 1.00 73.44 C ATOM 361 CG2 VAL A 23 -4.160 -7.791 -5.598 1.00 13.31 C ATOM 0 H VAL A 23 -3.837 -10.281 -8.738 1.00 32.33 H new ATOM 0 HA VAL A 23 -6.073 -9.471 -6.986 1.00 72.33 H new ATOM 0 HB VAL A 23 -4.295 -9.920 -5.547 1.00 12.11 H new ATOM 0 HG11 VAL A 23 -1.965 -9.177 -5.926 1.00 73.44 H new ATOM 0 HG12 VAL A 23 -2.542 -10.238 -7.233 1.00 73.44 H new ATOM 0 HG13 VAL A 23 -2.457 -8.479 -7.487 1.00 73.44 H new ATOM 0 HG21 VAL A 23 -3.433 -7.730 -4.788 1.00 13.31 H new ATOM 0 HG22 VAL A 23 -3.954 -7.010 -6.330 1.00 13.31 H new ATOM 0 HG23 VAL A 23 -5.164 -7.656 -5.195 1.00 13.31 H new ATOM 371 N LYS A 24 -6.174 -7.032 -7.727 1.00 70.30 N ATOM 372 CA LYS A 24 -6.357 -5.714 -8.357 1.00 15.43 C ATOM 373 C LYS A 24 -5.552 -4.608 -7.680 1.00 44.40 C ATOM 374 O LYS A 24 -5.169 -3.644 -8.330 1.00 25.23 O ATOM 375 CB LYS A 24 -7.821 -5.318 -8.382 1.00 41.05 C ATOM 376 CG LYS A 24 -8.675 -6.278 -9.154 1.00 52.12 C ATOM 377 CD LYS A 24 -10.103 -5.802 -9.292 1.00 53.11 C ATOM 378 CE LYS A 24 -10.793 -5.637 -7.956 1.00 74.23 C ATOM 379 NZ LYS A 24 -12.210 -5.248 -8.124 1.00 41.52 N ATOM 0 H LYS A 24 -6.776 -7.207 -6.922 1.00 70.30 H new ATOM 0 HA LYS A 24 -5.984 -5.822 -9.375 1.00 15.43 H new ATOM 0 HB2 LYS A 24 -8.191 -5.253 -7.359 1.00 41.05 H new ATOM 0 HB3 LYS A 24 -7.915 -4.324 -8.819 1.00 41.05 H new ATOM 0 HG2 LYS A 24 -8.247 -6.424 -10.146 1.00 52.12 H new ATOM 0 HG3 LYS A 24 -8.665 -7.248 -8.657 1.00 52.12 H new ATOM 0 HD2 LYS A 24 -10.115 -4.850 -9.823 1.00 53.11 H new ATOM 0 HD3 LYS A 24 -10.662 -6.513 -9.900 1.00 53.11 H new ATOM 0 HE2 LYS A 24 -10.734 -6.571 -7.397 1.00 74.23 H new ATOM 0 HE3 LYS A 24 -10.274 -4.880 -7.368 1.00 74.23 H new ATOM 0 HZ1 LYS A 24 -12.654 -5.143 -7.190 1.00 41.52 H new ATOM 0 HZ2 LYS A 24 -12.264 -4.345 -8.636 1.00 41.52 H new ATOM 0 HZ3 LYS A 24 -12.710 -5.983 -8.664 1.00 41.52 H new ATOM 393 N HIS A 25 -5.332 -4.742 -6.374 1.00 63.05 N ATOM 394 CA HIS A 25 -4.600 -3.728 -5.555 1.00 54.41 C ATOM 395 C HIS A 25 -4.517 -4.168 -4.106 1.00 71.13 C ATOM 396 O HIS A 25 -5.295 -5.047 -3.688 1.00 2.41 O ATOM 397 CB HIS A 25 -5.249 -2.316 -5.636 1.00 1.51 C ATOM 398 CG HIS A 25 -6.719 -2.252 -5.289 1.00 54.31 C ATOM 399 ND1 HIS A 25 -7.374 -3.210 -4.541 1.00 41.24 N ATOM 400 CD2 HIS A 25 -7.668 -1.350 -5.633 1.00 44.03 C ATOM 401 CE1 HIS A 25 -8.646 -2.905 -4.453 1.00 14.11 C ATOM 402 NE2 HIS A 25 -8.853 -1.785 -5.101 1.00 73.32 N ATOM 0 H HIS A 25 -5.648 -5.549 -5.837 1.00 63.05 H new ATOM 0 HA HIS A 25 -3.596 -3.656 -5.974 1.00 54.41 H new ATOM 0 HB2 HIS A 25 -4.707 -1.648 -4.967 1.00 1.51 H new ATOM 0 HB3 HIS A 25 -5.116 -1.932 -6.647 1.00 1.51 H new ATOM 0 HD1 HIS A 25 -6.935 -4.030 -4.121 1.00 41.24 H new ATOM 0 HD2 HIS A 25 -7.519 -0.454 -6.218 1.00 44.03 H new ATOM 0 HE1 HIS A 25 -9.398 -3.481 -3.933 1.00 14.11 H new ATOM 411 N LEU A 26 -3.653 -3.522 -3.334 1.00 24.45 N ATOM 412 CA LEU A 26 -3.441 -3.885 -1.929 1.00 53.03 C ATOM 413 C LEU A 26 -3.852 -2.742 -0.990 1.00 65.23 C ATOM 414 O LEU A 26 -3.608 -1.585 -1.278 1.00 24.21 O ATOM 415 CB LEU A 26 -1.938 -4.185 -1.662 1.00 1.30 C ATOM 416 CG LEU A 26 -1.267 -5.314 -2.461 1.00 21.35 C ATOM 417 CD1 LEU A 26 0.192 -5.479 -2.027 1.00 33.04 C ATOM 418 CD2 LEU A 26 -2.007 -6.614 -2.272 1.00 73.31 C ATOM 0 H LEU A 26 -3.083 -2.739 -3.654 1.00 24.45 H new ATOM 0 HA LEU A 26 -4.052 -4.767 -1.736 1.00 53.03 H new ATOM 0 HB2 LEU A 26 -1.378 -3.268 -1.847 1.00 1.30 H new ATOM 0 HB3 LEU A 26 -1.828 -4.417 -0.603 1.00 1.30 H new ATOM 0 HG LEU A 26 -1.296 -5.046 -3.517 1.00 21.35 H new ATOM 0 HD11 LEU A 26 0.654 -6.282 -2.601 1.00 33.04 H new ATOM 0 HD12 LEU A 26 0.732 -4.549 -2.205 1.00 33.04 H new ATOM 0 HD13 LEU A 26 0.230 -5.724 -0.966 1.00 33.04 H new ATOM 0 HD21 LEU A 26 -1.515 -7.399 -2.846 1.00 73.31 H new ATOM 0 HD22 LEU A 26 -2.007 -6.883 -1.216 1.00 73.31 H new ATOM 0 HD23 LEU A 26 -3.035 -6.501 -2.618 1.00 73.31 H new ATOM 430 N LYS A 27 -4.502 -3.081 0.101 1.00 11.12 N ATOM 431 CA LYS A 27 -4.789 -2.144 1.163 1.00 3.12 C ATOM 432 C LYS A 27 -4.028 -2.558 2.382 1.00 63.12 C ATOM 433 O LYS A 27 -4.259 -3.627 2.910 1.00 71.22 O ATOM 434 CB LYS A 27 -6.277 -2.095 1.472 1.00 31.20 C ATOM 435 CG LYS A 27 -6.608 -1.208 2.655 1.00 31.34 C ATOM 436 CD LYS A 27 -8.043 -0.760 2.667 1.00 13.41 C ATOM 437 CE LYS A 27 -9.055 -1.867 2.874 1.00 33.32 C ATOM 438 NZ LYS A 27 -9.162 -2.847 1.767 1.00 22.11 N ATOM 0 H LYS A 27 -4.849 -4.024 0.277 1.00 11.12 H new ATOM 0 HA LYS A 27 -4.486 -1.146 0.846 1.00 3.12 H new ATOM 0 HB2 LYS A 27 -6.813 -1.735 0.594 1.00 31.20 H new ATOM 0 HB3 LYS A 27 -6.634 -3.105 1.671 1.00 31.20 H new ATOM 0 HG2 LYS A 27 -6.393 -1.747 3.578 1.00 31.34 H new ATOM 0 HG3 LYS A 27 -5.959 -0.332 2.639 1.00 31.34 H new ATOM 0 HD2 LYS A 27 -8.170 -0.019 3.456 1.00 13.41 H new ATOM 0 HD3 LYS A 27 -8.260 -0.261 1.723 1.00 13.41 H new ATOM 0 HE2 LYS A 27 -8.799 -2.403 3.788 1.00 33.32 H new ATOM 0 HE3 LYS A 27 -10.034 -1.416 3.033 1.00 33.32 H new ATOM 0 HZ1 LYS A 27 -10.153 -2.915 1.458 1.00 22.11 H new ATOM 0 HZ2 LYS A 27 -8.571 -2.536 0.970 1.00 22.11 H new ATOM 0 HZ3 LYS A 27 -8.837 -3.779 2.096 1.00 22.11 H new ATOM 452 N ILE A 28 -3.142 -1.728 2.838 1.00 33.21 N ATOM 453 CA ILE A 28 -2.314 -2.082 3.964 1.00 72.42 C ATOM 454 C ILE A 28 -2.815 -1.377 5.194 1.00 71.00 C ATOM 455 O ILE A 28 -3.182 -0.163 5.137 1.00 63.15 O ATOM 456 CB ILE A 28 -0.828 -1.705 3.761 1.00 71.54 C ATOM 457 CG1 ILE A 28 -0.302 -2.236 2.436 1.00 20.45 C ATOM 458 CG2 ILE A 28 0.011 -2.281 4.902 1.00 42.13 C ATOM 459 CD1 ILE A 28 1.149 -1.899 2.207 1.00 5.11 C ATOM 0 H ILE A 28 -2.969 -0.800 2.453 1.00 33.21 H new ATOM 0 HA ILE A 28 -2.374 -3.165 4.071 1.00 72.42 H new ATOM 0 HB ILE A 28 -0.754 -0.618 3.754 1.00 71.54 H new ATOM 0 HG12 ILE A 28 -0.428 -3.318 2.408 1.00 20.45 H new ATOM 0 HG13 ILE A 28 -0.899 -1.824 1.622 1.00 20.45 H new ATOM 0 HG21 ILE A 28 1.057 -2.013 4.755 1.00 42.13 H new ATOM 0 HG22 ILE A 28 -0.338 -1.875 5.851 1.00 42.13 H new ATOM 0 HG23 ILE A 28 -0.087 -3.366 4.914 1.00 42.13 H new ATOM 0 HD11 ILE A 28 1.469 -2.303 1.247 1.00 5.11 H new ATOM 0 HD12 ILE A 28 1.275 -0.816 2.205 1.00 5.11 H new ATOM 0 HD13 ILE A 28 1.753 -2.333 3.003 1.00 5.11 H new ATOM 471 N LEU A 29 -2.871 -2.108 6.287 1.00 14.55 N ATOM 472 CA LEU A 29 -3.276 -1.560 7.530 1.00 54.21 C ATOM 473 C LEU A 29 -2.668 -2.342 8.704 1.00 50.43 C ATOM 474 O LEU A 29 -2.919 -3.540 8.872 1.00 3.14 O ATOM 475 CB LEU A 29 -4.839 -1.470 7.587 1.00 41.13 C ATOM 476 CG LEU A 29 -5.514 -0.861 8.848 1.00 41.22 C ATOM 477 CD1 LEU A 29 -6.944 -0.505 8.534 1.00 34.13 C ATOM 478 CD2 LEU A 29 -5.541 -1.857 9.984 1.00 5.53 C ATOM 0 H LEU A 29 -2.633 -3.099 6.321 1.00 14.55 H new ATOM 0 HA LEU A 29 -2.893 -0.544 7.622 1.00 54.21 H new ATOM 0 HB2 LEU A 29 -5.167 -0.888 6.725 1.00 41.13 H new ATOM 0 HB3 LEU A 29 -5.231 -2.479 7.459 1.00 41.13 H new ATOM 0 HG LEU A 29 -4.939 0.019 9.137 1.00 41.22 H new ATOM 0 HD11 LEU A 29 -7.416 -0.078 9.419 1.00 34.13 H new ATOM 0 HD12 LEU A 29 -6.968 0.223 7.723 1.00 34.13 H new ATOM 0 HD13 LEU A 29 -7.484 -1.402 8.232 1.00 34.13 H new ATOM 0 HD21 LEU A 29 -6.018 -1.405 10.853 1.00 5.53 H new ATOM 0 HD22 LEU A 29 -6.103 -2.740 9.680 1.00 5.53 H new ATOM 0 HD23 LEU A 29 -4.521 -2.145 10.239 1.00 5.53 H new ATOM 490 N ASN A 30 -1.849 -1.666 9.491 1.00 3.32 N ATOM 491 CA ASN A 30 -1.364 -2.233 10.740 1.00 44.42 C ATOM 492 C ASN A 30 -2.416 -2.023 11.743 1.00 14.42 C ATOM 493 O ASN A 30 -2.723 -0.891 12.129 1.00 4.53 O ATOM 494 CB ASN A 30 -0.040 -1.629 11.232 1.00 23.54 C ATOM 495 CG ASN A 30 1.206 -2.246 10.622 1.00 41.42 C ATOM 496 OD1 ASN A 30 1.768 -3.192 11.165 1.00 3.41 O ATOM 497 ND2 ASN A 30 1.644 -1.731 9.516 1.00 43.32 N ATOM 0 H ASN A 30 -1.506 -0.727 9.289 1.00 3.32 H new ATOM 0 HA ASN A 30 -1.150 -3.289 10.575 1.00 44.42 H new ATOM 0 HB2 ASN A 30 -0.042 -0.560 11.017 1.00 23.54 H new ATOM 0 HB3 ASN A 30 0.012 -1.736 12.316 1.00 23.54 H new ATOM 0 HD21 ASN A 30 2.479 -2.112 9.072 1.00 43.32 H new ATOM 0 HD22 ASN A 30 1.153 -0.945 9.090 1.00 43.32 H new ATOM 504 N THR A 31 -2.984 -3.095 12.140 1.00 75.15 N ATOM 505 CA THR A 31 -4.116 -3.085 12.973 1.00 74.25 C ATOM 506 C THR A 31 -3.683 -2.756 14.412 1.00 42.32 C ATOM 507 O THR A 31 -2.645 -3.209 14.855 1.00 32.20 O ATOM 508 CB THR A 31 -4.733 -4.480 12.904 1.00 53.04 C ATOM 509 OG1 THR A 31 -4.676 -4.922 11.542 1.00 22.40 O ATOM 510 CG2 THR A 31 -6.184 -4.450 13.295 1.00 42.31 C ATOM 0 H THR A 31 -2.664 -4.030 11.886 1.00 75.15 H new ATOM 0 HA THR A 31 -4.841 -2.335 12.657 1.00 74.25 H new ATOM 0 HB THR A 31 -4.186 -5.136 13.581 1.00 53.04 H new ATOM 0 HG1 THR A 31 -4.757 -5.898 11.511 1.00 22.40 H new ATOM 0 HG21 THR A 31 -6.597 -5.457 13.237 1.00 42.31 H new ATOM 0 HG22 THR A 31 -6.278 -4.078 14.315 1.00 42.31 H new ATOM 0 HG23 THR A 31 -6.730 -3.794 12.617 1.00 42.31 H new ATOM 518 N PRO A 32 -4.448 -1.950 15.151 1.00 5.23 N ATOM 519 CA PRO A 32 -4.104 -1.609 16.543 1.00 54.33 C ATOM 520 C PRO A 32 -4.126 -2.834 17.478 1.00 11.00 C ATOM 521 O PRO A 32 -3.707 -2.761 18.619 1.00 55.22 O ATOM 522 CB PRO A 32 -5.203 -0.626 16.956 1.00 12.35 C ATOM 523 CG PRO A 32 -5.773 -0.125 15.674 1.00 14.02 C ATOM 524 CD PRO A 32 -5.666 -1.253 14.704 1.00 62.04 C ATOM 0 HA PRO A 32 -3.093 -1.207 16.614 1.00 54.33 H new ATOM 0 HB2 PRO A 32 -5.965 -1.117 17.562 1.00 12.35 H new ATOM 0 HB3 PRO A 32 -4.798 0.191 17.554 1.00 12.35 H new ATOM 0 HG2 PRO A 32 -6.811 0.181 15.803 1.00 14.02 H new ATOM 0 HG3 PRO A 32 -5.225 0.748 15.319 1.00 14.02 H new ATOM 0 HD2 PRO A 32 -6.541 -1.903 14.740 1.00 62.04 H new ATOM 0 HD3 PRO A 32 -5.575 -0.897 13.678 1.00 62.04 H new ATOM 532 N ASN A 33 -4.651 -3.944 16.988 1.00 50.55 N ATOM 533 CA ASN A 33 -4.757 -5.193 17.768 1.00 70.23 C ATOM 534 C ASN A 33 -4.158 -6.393 17.028 1.00 55.32 C ATOM 535 O ASN A 33 -4.100 -7.487 17.562 1.00 52.14 O ATOM 536 CB ASN A 33 -6.234 -5.494 18.107 1.00 40.12 C ATOM 537 CG ASN A 33 -6.838 -4.690 19.266 1.00 24.23 C ATOM 538 OD1 ASN A 33 -6.282 -3.552 19.584 1.00 65.21 O flip ATOM 539 ND2 ASN A 33 -7.782 -5.140 19.898 1.00 3.15 N flip ATOM 0 H ASN A 33 -5.019 -4.018 16.040 1.00 50.55 H new ATOM 0 HA ASN A 33 -4.187 -5.040 18.684 1.00 70.23 H new ATOM 0 HB2 ASN A 33 -6.834 -5.314 17.215 1.00 40.12 H new ATOM 0 HB3 ASN A 33 -6.323 -6.555 18.342 1.00 40.12 H new ATOM 0 HD21 ASN A 33 -8.198 -6.031 19.628 1.00 3.15 H new ATOM 0 HD22 ASN A 33 -8.154 -4.624 20.695 1.00 3.15 H new ATOM 546 N CYS A 34 -3.698 -6.182 15.824 1.00 32.45 N ATOM 547 CA CYS A 34 -3.189 -7.271 14.979 1.00 71.31 C ATOM 548 C CYS A 34 -1.957 -6.780 14.209 1.00 2.10 C ATOM 549 O CYS A 34 -1.730 -5.588 14.145 1.00 24.40 O ATOM 550 CB CYS A 34 -4.312 -7.820 14.019 1.00 23.53 C ATOM 551 SG CYS A 34 -5.734 -8.654 14.870 1.00 23.13 S ATOM 0 H CYS A 34 -3.658 -5.261 15.387 1.00 32.45 H new ATOM 0 HA CYS A 34 -2.889 -8.109 15.609 1.00 71.31 H new ATOM 0 HB2 CYS A 34 -4.699 -6.991 13.426 1.00 23.53 H new ATOM 0 HB3 CYS A 34 -3.860 -8.527 13.323 1.00 23.53 H new ATOM 556 N ALA A 35 -1.135 -7.696 13.689 1.00 10.23 N ATOM 557 CA ALA A 35 0.092 -7.328 12.920 1.00 70.24 C ATOM 558 C ALA A 35 -0.237 -6.513 11.647 1.00 41.10 C ATOM 559 O ALA A 35 -1.389 -6.093 11.440 1.00 70.41 O ATOM 560 CB ALA A 35 0.869 -8.597 12.544 1.00 40.23 C ATOM 0 H ALA A 35 -1.283 -8.701 13.778 1.00 10.23 H new ATOM 0 HA ALA A 35 0.704 -6.694 13.562 1.00 70.24 H new ATOM 0 HB1 ALA A 35 1.763 -8.324 11.983 1.00 40.23 H new ATOM 0 HB2 ALA A 35 1.158 -9.129 13.451 1.00 40.23 H new ATOM 0 HB3 ALA A 35 0.239 -9.241 11.931 1.00 40.23 H new ATOM 566 N CYS A 36 0.767 -6.269 10.818 1.00 61.52 N ATOM 567 CA CYS A 36 0.540 -5.590 9.554 1.00 73.02 C ATOM 568 C CYS A 36 -0.313 -6.494 8.706 1.00 51.03 C ATOM 569 O CYS A 36 0.006 -7.651 8.546 1.00 71.33 O ATOM 570 CB CYS A 36 1.873 -5.285 8.827 1.00 60.44 C ATOM 571 SG CYS A 36 1.693 -4.243 7.321 1.00 51.11 S ATOM 0 H CYS A 36 1.737 -6.529 10.996 1.00 61.52 H new ATOM 0 HA CYS A 36 0.047 -4.635 9.733 1.00 73.02 H new ATOM 0 HB2 CYS A 36 2.546 -4.784 9.523 1.00 60.44 H new ATOM 0 HB3 CYS A 36 2.345 -6.227 8.548 1.00 60.44 H new ATOM 576 N GLN A 37 -1.413 -6.002 8.226 1.00 21.23 N ATOM 577 CA GLN A 37 -2.272 -6.818 7.423 1.00 2.20 C ATOM 578 C GLN A 37 -2.506 -6.122 6.113 1.00 50.31 C ATOM 579 O GLN A 37 -2.514 -4.876 6.049 1.00 12.32 O ATOM 580 CB GLN A 37 -3.611 -7.053 8.114 1.00 25.42 C ATOM 581 CG GLN A 37 -3.539 -7.589 9.551 1.00 42.10 C ATOM 582 CD GLN A 37 -2.759 -8.882 9.718 1.00 41.22 C ATOM 583 OE1 GLN A 37 -2.678 -9.711 8.827 1.00 21.23 O ATOM 584 NE2 GLN A 37 -2.182 -9.056 10.875 1.00 41.40 N ATOM 0 H GLN A 37 -1.736 -5.046 8.374 1.00 21.23 H new ATOM 0 HA GLN A 37 -1.795 -7.786 7.267 1.00 2.20 H new ATOM 0 HB2 GLN A 37 -4.162 -6.113 8.125 1.00 25.42 H new ATOM 0 HB3 GLN A 37 -4.190 -7.755 7.514 1.00 25.42 H new ATOM 0 HG2 GLN A 37 -3.087 -6.826 10.185 1.00 42.10 H new ATOM 0 HG3 GLN A 37 -4.554 -7.746 9.915 1.00 42.10 H new ATOM 0 HE21 GLN A 37 -2.268 -8.344 11.600 1.00 41.40 H new ATOM 0 HE22 GLN A 37 -1.645 -9.904 11.054 1.00 41.40 H new ATOM 593 N ILE A 38 -2.676 -6.886 5.080 1.00 11.04 N ATOM 594 CA ILE A 38 -2.912 -6.349 3.775 1.00 22.45 C ATOM 595 C ILE A 38 -4.198 -6.946 3.223 1.00 55.24 C ATOM 596 O ILE A 38 -4.409 -8.111 3.322 1.00 63.44 O ATOM 597 CB ILE A 38 -1.722 -6.662 2.824 1.00 61.45 C ATOM 598 CG1 ILE A 38 -0.419 -6.072 3.394 1.00 33.34 C ATOM 599 CG2 ILE A 38 -1.989 -6.120 1.428 1.00 5.20 C ATOM 600 CD1 ILE A 38 0.809 -6.320 2.546 1.00 13.24 C ATOM 0 H ILE A 38 -2.655 -7.905 5.117 1.00 11.04 H new ATOM 0 HA ILE A 38 -3.007 -5.265 3.845 1.00 22.45 H new ATOM 0 HB ILE A 38 -1.613 -7.744 2.750 1.00 61.45 H new ATOM 0 HG12 ILE A 38 -0.547 -4.997 3.519 1.00 33.34 H new ATOM 0 HG13 ILE A 38 -0.250 -6.490 4.386 1.00 33.34 H new ATOM 0 HG21 ILE A 38 -1.143 -6.351 0.780 1.00 5.20 H new ATOM 0 HG22 ILE A 38 -2.891 -6.581 1.025 1.00 5.20 H new ATOM 0 HG23 ILE A 38 -2.124 -5.040 1.477 1.00 5.20 H new ATOM 0 HD11 ILE A 38 1.679 -5.869 3.024 1.00 13.24 H new ATOM 0 HD12 ILE A 38 0.968 -7.393 2.441 1.00 13.24 H new ATOM 0 HD13 ILE A 38 0.666 -5.876 1.561 1.00 13.24 H new ATOM 612 N VAL A 39 -5.054 -6.141 2.690 1.00 34.20 N ATOM 613 CA VAL A 39 -6.293 -6.627 2.128 1.00 53.42 C ATOM 614 C VAL A 39 -6.253 -6.471 0.615 1.00 64.21 C ATOM 615 O VAL A 39 -5.990 -5.377 0.112 1.00 21.20 O ATOM 616 CB VAL A 39 -7.517 -5.860 2.702 1.00 3.54 C ATOM 617 CG1 VAL A 39 -8.817 -6.397 2.131 1.00 22.12 C ATOM 618 CG2 VAL A 39 -7.537 -5.930 4.222 1.00 51.53 C ATOM 0 H VAL A 39 -4.927 -5.131 2.626 1.00 34.20 H new ATOM 0 HA VAL A 39 -6.402 -7.678 2.394 1.00 53.42 H new ATOM 0 HB VAL A 39 -7.421 -4.815 2.406 1.00 3.54 H new ATOM 0 HG11 VAL A 39 -9.656 -5.841 2.551 1.00 22.12 H new ATOM 0 HG12 VAL A 39 -8.813 -6.284 1.047 1.00 22.12 H new ATOM 0 HG13 VAL A 39 -8.918 -7.452 2.385 1.00 22.12 H new ATOM 0 HG21 VAL A 39 -8.403 -5.386 4.600 1.00 51.53 H new ATOM 0 HG22 VAL A 39 -7.597 -6.972 4.538 1.00 51.53 H new ATOM 0 HG23 VAL A 39 -6.626 -5.483 4.619 1.00 51.53 H new ATOM 628 N ALA A 40 -6.512 -7.539 -0.098 1.00 1.55 N ATOM 629 CA ALA A 40 -6.468 -7.520 -1.536 1.00 54.00 C ATOM 630 C ALA A 40 -7.735 -8.113 -2.122 1.00 62.14 C ATOM 631 O ALA A 40 -8.303 -9.066 -1.584 1.00 73.13 O ATOM 632 CB ALA A 40 -5.250 -8.293 -2.036 1.00 45.40 C ATOM 0 H ALA A 40 -6.759 -8.444 0.303 1.00 1.55 H new ATOM 0 HA ALA A 40 -6.390 -6.483 -1.861 1.00 54.00 H new ATOM 0 HB1 ALA A 40 -5.228 -8.272 -3.126 1.00 45.40 H new ATOM 0 HB2 ALA A 40 -4.342 -7.834 -1.645 1.00 45.40 H new ATOM 0 HB3 ALA A 40 -5.310 -9.326 -1.695 1.00 45.40 H new ATOM 638 N ARG A 41 -8.198 -7.541 -3.197 1.00 23.54 N ATOM 639 CA ARG A 41 -9.337 -8.090 -3.880 1.00 12.41 C ATOM 640 C ARG A 41 -8.945 -8.782 -5.152 1.00 21.14 C ATOM 641 O ARG A 41 -8.277 -8.193 -6.027 1.00 45.11 O ATOM 642 CB ARG A 41 -10.490 -7.102 -4.106 1.00 62.12 C ATOM 643 CG ARG A 41 -11.303 -6.801 -2.859 1.00 35.43 C ATOM 644 CD ARG A 41 -12.558 -5.992 -3.182 1.00 4.35 C ATOM 645 NE ARG A 41 -13.425 -5.844 -1.999 1.00 5.23 N ATOM 646 CZ ARG A 41 -14.732 -5.533 -2.019 1.00 12.42 C ATOM 647 NH1 ARG A 41 -15.340 -5.215 -3.163 1.00 41.30 N ATOM 648 NH2 ARG A 41 -15.422 -5.541 -0.890 1.00 24.21 N ATOM 0 H ARG A 41 -7.807 -6.698 -3.619 1.00 23.54 H new ATOM 0 HA ARG A 41 -9.737 -8.836 -3.193 1.00 12.41 H new ATOM 0 HB2 ARG A 41 -10.083 -6.169 -4.495 1.00 62.12 H new ATOM 0 HB3 ARG A 41 -11.154 -7.504 -4.871 1.00 62.12 H new ATOM 0 HG2 ARG A 41 -11.587 -7.736 -2.376 1.00 35.43 H new ATOM 0 HG3 ARG A 41 -10.688 -6.249 -2.148 1.00 35.43 H new ATOM 0 HD2 ARG A 41 -12.272 -5.007 -3.550 1.00 4.35 H new ATOM 0 HD3 ARG A 41 -13.113 -6.483 -3.982 1.00 4.35 H new ATOM 0 HE ARG A 41 -12.995 -5.990 -1.086 1.00 5.23 H new ATOM 0 HH11 ARG A 41 -14.812 -5.206 -4.036 1.00 41.30 H new ATOM 0 HH12 ARG A 41 -16.333 -4.981 -3.165 1.00 41.30 H new ATOM 0 HH21 ARG A 41 -14.961 -5.782 -0.012 1.00 24.21 H new ATOM 0 HH22 ARG A 41 -16.415 -5.306 -0.897 1.00 24.21 H new ATOM 662 N LEU A 42 -9.326 -10.037 -5.213 1.00 71.32 N ATOM 663 CA LEU A 42 -9.109 -10.909 -6.349 1.00 33.01 C ATOM 664 C LEU A 42 -9.871 -10.401 -7.573 1.00 11.24 C ATOM 665 O LEU A 42 -10.975 -9.833 -7.447 1.00 34.32 O ATOM 666 CB LEU A 42 -9.581 -12.333 -6.003 1.00 2.45 C ATOM 667 CG LEU A 42 -8.910 -13.013 -4.803 1.00 33.35 C ATOM 668 CD1 LEU A 42 -9.560 -14.364 -4.516 1.00 13.34 C ATOM 669 CD2 LEU A 42 -7.421 -13.181 -5.041 1.00 63.52 C ATOM 0 H LEU A 42 -9.814 -10.498 -4.445 1.00 71.32 H new ATOM 0 HA LEU A 42 -8.044 -10.919 -6.581 1.00 33.01 H new ATOM 0 HB2 LEU A 42 -10.655 -12.299 -5.817 1.00 2.45 H new ATOM 0 HB3 LEU A 42 -9.429 -12.963 -6.879 1.00 2.45 H new ATOM 0 HG LEU A 42 -9.047 -12.372 -3.932 1.00 33.35 H new ATOM 0 HD11 LEU A 42 -9.069 -14.830 -3.661 1.00 13.34 H new ATOM 0 HD12 LEU A 42 -10.617 -14.219 -4.293 1.00 13.34 H new ATOM 0 HD13 LEU A 42 -9.458 -15.009 -5.389 1.00 13.34 H new ATOM 0 HD21 LEU A 42 -6.967 -13.665 -4.177 1.00 63.52 H new ATOM 0 HD22 LEU A 42 -7.261 -13.796 -5.927 1.00 63.52 H new ATOM 0 HD23 LEU A 42 -6.964 -12.203 -5.191 1.00 63.52 H new ATOM 681 N LYS A 43 -9.292 -10.613 -8.731 1.00 75.22 N ATOM 682 CA LYS A 43 -9.851 -10.186 -10.004 1.00 64.33 C ATOM 683 C LYS A 43 -11.030 -11.073 -10.422 1.00 4.01 C ATOM 684 O LYS A 43 -10.842 -12.084 -11.110 1.00 31.14 O ATOM 685 CB LYS A 43 -8.754 -10.209 -11.081 1.00 3.21 C ATOM 686 CG LYS A 43 -7.592 -9.259 -10.801 1.00 20.34 C ATOM 687 CD LYS A 43 -6.400 -9.500 -11.726 1.00 41.21 C ATOM 688 CE LYS A 43 -6.744 -9.331 -13.189 1.00 34.21 C ATOM 689 NZ LYS A 43 -5.580 -9.615 -14.059 1.00 34.13 N ATOM 0 H LYS A 43 -8.399 -11.097 -8.823 1.00 75.22 H new ATOM 0 HA LYS A 43 -10.228 -9.169 -9.892 1.00 64.33 H new ATOM 0 HB2 LYS A 43 -8.367 -11.224 -11.170 1.00 3.21 H new ATOM 0 HB3 LYS A 43 -9.197 -9.951 -12.043 1.00 3.21 H new ATOM 0 HG2 LYS A 43 -7.933 -8.230 -10.915 1.00 20.34 H new ATOM 0 HG3 LYS A 43 -7.273 -9.376 -9.765 1.00 20.34 H new ATOM 0 HD2 LYS A 43 -5.599 -8.809 -11.465 1.00 41.21 H new ATOM 0 HD3 LYS A 43 -6.018 -10.508 -11.562 1.00 41.21 H new ATOM 0 HE2 LYS A 43 -7.565 -9.999 -13.450 1.00 34.21 H new ATOM 0 HE3 LYS A 43 -7.092 -8.313 -13.366 1.00 34.21 H new ATOM 0 HZ1 LYS A 43 -5.909 -9.807 -15.027 1.00 34.13 H new ATOM 0 HZ2 LYS A 43 -4.943 -8.793 -14.066 1.00 34.13 H new ATOM 0 HZ3 LYS A 43 -5.070 -10.445 -13.696 1.00 34.13 H new ATOM 703 N ASN A 44 -12.229 -10.722 -9.910 1.00 42.03 N ATOM 704 CA ASN A 44 -13.550 -11.400 -10.191 1.00 14.42 C ATOM 705 C ASN A 44 -13.649 -12.839 -9.621 1.00 30.34 C ATOM 706 O ASN A 44 -14.732 -13.288 -9.233 1.00 71.44 O ATOM 707 CB ASN A 44 -13.871 -11.416 -11.701 1.00 2.53 C ATOM 708 CG ASN A 44 -15.263 -11.975 -12.009 1.00 64.25 C ATOM 709 OD1 ASN A 44 -16.201 -11.831 -11.217 1.00 11.23 O ATOM 710 ND2 ASN A 44 -15.407 -12.607 -13.142 1.00 24.11 N ATOM 0 H ASN A 44 -12.327 -9.936 -9.267 1.00 42.03 H new ATOM 0 HA ASN A 44 -14.292 -10.797 -9.668 1.00 14.42 H new ATOM 0 HB2 ASN A 44 -13.797 -10.402 -12.094 1.00 2.53 H new ATOM 0 HB3 ASN A 44 -13.122 -12.014 -12.220 1.00 2.53 H new ATOM 0 HD21 ASN A 44 -16.314 -12.999 -13.396 1.00 24.11 H new ATOM 0 HD22 ASN A 44 -14.613 -12.709 -13.774 1.00 24.11 H new ATOM 717 N ASN A 45 -12.511 -13.499 -9.556 1.00 71.43 N ATOM 718 CA ASN A 45 -12.333 -14.907 -9.175 1.00 0.51 C ATOM 719 C ASN A 45 -13.246 -15.408 -8.032 1.00 51.44 C ATOM 720 O ASN A 45 -14.179 -16.174 -8.277 1.00 45.32 O ATOM 721 CB ASN A 45 -10.861 -15.149 -8.815 1.00 21.41 C ATOM 722 CG ASN A 45 -10.532 -16.585 -8.416 1.00 62.23 C ATOM 723 OD1 ASN A 45 -9.668 -16.801 -7.572 1.00 4.23 O ATOM 724 ND2 ASN A 45 -11.167 -17.563 -9.035 1.00 71.21 N ATOM 0 H ASN A 45 -11.623 -13.049 -9.780 1.00 71.43 H new ATOM 0 HA ASN A 45 -12.635 -15.488 -10.046 1.00 0.51 H new ATOM 0 HB2 ASN A 45 -10.242 -14.872 -9.668 1.00 21.41 H new ATOM 0 HB3 ASN A 45 -10.588 -14.486 -7.994 1.00 21.41 H new ATOM 0 HD21 ASN A 45 -10.944 -18.534 -8.817 1.00 71.21 H new ATOM 0 HD22 ASN A 45 -11.880 -17.347 -9.732 1.00 71.21 H new ATOM 731 N ASN A 46 -12.998 -14.982 -6.810 1.00 55.11 N ATOM 732 CA ASN A 46 -13.713 -15.550 -5.649 1.00 15.11 C ATOM 733 C ASN A 46 -14.173 -14.516 -4.646 1.00 42.20 C ATOM 734 O ASN A 46 -15.343 -14.142 -4.613 1.00 11.41 O ATOM 735 CB ASN A 46 -12.864 -16.608 -4.901 1.00 51.21 C ATOM 736 CG ASN A 46 -12.920 -18.049 -5.418 1.00 11.04 C ATOM 737 OD1 ASN A 46 -12.717 -18.977 -4.635 1.00 13.11 O ATOM 738 ND2 ASN A 46 -13.224 -18.256 -6.669 1.00 51.33 N ATOM 0 H ASN A 46 -12.320 -14.256 -6.581 1.00 55.11 H new ATOM 0 HA ASN A 46 -14.596 -16.017 -6.086 1.00 15.11 H new ATOM 0 HB2 ASN A 46 -11.824 -16.282 -4.923 1.00 51.21 H new ATOM 0 HB3 ASN A 46 -13.175 -16.612 -3.856 1.00 51.21 H new ATOM 0 HD21 ASN A 46 -13.300 -19.209 -7.024 1.00 51.33 H new ATOM 0 HD22 ASN A 46 -13.386 -17.465 -7.292 1.00 51.33 H new ATOM 745 N ARG A 47 -13.249 -14.041 -3.832 1.00 41.30 N ATOM 746 CA ARG A 47 -13.609 -13.190 -2.732 1.00 71.22 C ATOM 747 C ARG A 47 -12.530 -12.167 -2.457 1.00 44.43 C ATOM 748 O ARG A 47 -11.606 -11.982 -3.255 1.00 11.21 O ATOM 749 CB ARG A 47 -13.880 -14.036 -1.436 1.00 15.20 C ATOM 750 CG ARG A 47 -12.666 -14.764 -0.768 1.00 4.11 C ATOM 751 CD ARG A 47 -12.123 -15.955 -1.564 1.00 22.33 C ATOM 752 NE ARG A 47 -10.978 -16.600 -0.876 1.00 5.40 N ATOM 753 CZ ARG A 47 -10.452 -17.822 -1.165 1.00 24.34 C ATOM 754 NH1 ARG A 47 -10.979 -18.586 -2.135 1.00 30.54 N ATOM 755 NH2 ARG A 47 -9.398 -18.274 -0.474 1.00 5.04 N ATOM 0 H ARG A 47 -12.251 -14.233 -3.917 1.00 41.30 H new ATOM 0 HA ARG A 47 -14.523 -12.666 -3.010 1.00 71.22 H new ATOM 0 HB2 ARG A 47 -14.324 -13.375 -0.692 1.00 15.20 H new ATOM 0 HB3 ARG A 47 -14.629 -14.790 -1.679 1.00 15.20 H new ATOM 0 HG2 ARG A 47 -11.861 -14.043 -0.623 1.00 4.11 H new ATOM 0 HG3 ARG A 47 -12.966 -15.111 0.221 1.00 4.11 H new ATOM 0 HD2 ARG A 47 -12.918 -16.686 -1.712 1.00 22.33 H new ATOM 0 HD3 ARG A 47 -11.811 -15.620 -2.553 1.00 22.33 H new ATOM 0 HE ARG A 47 -10.544 -16.079 -0.114 1.00 5.40 H new ATOM 0 HH11 ARG A 47 -11.784 -18.253 -2.666 1.00 30.54 H new ATOM 0 HH12 ARG A 47 -10.575 -19.500 -2.341 1.00 30.54 H new ATOM 0 HH21 ARG A 47 -8.991 -17.703 0.267 1.00 5.04 H new ATOM 0 HH22 ARG A 47 -9.002 -19.189 -0.688 1.00 5.04 H new ATOM 769 N GLN A 48 -12.643 -11.523 -1.329 1.00 53.35 N ATOM 770 CA GLN A 48 -11.669 -10.585 -0.887 1.00 45.21 C ATOM 771 C GLN A 48 -10.770 -11.326 0.054 1.00 12.43 C ATOM 772 O GLN A 48 -11.242 -12.024 0.956 1.00 2.40 O ATOM 773 CB GLN A 48 -12.361 -9.441 -0.141 1.00 21.51 C ATOM 774 CG GLN A 48 -11.417 -8.410 0.455 1.00 13.52 C ATOM 775 CD GLN A 48 -12.151 -7.316 1.191 1.00 32.33 C ATOM 776 OE1 GLN A 48 -12.510 -6.291 0.606 1.00 25.32 O ATOM 777 NE2 GLN A 48 -12.376 -7.511 2.471 1.00 11.45 N ATOM 0 H GLN A 48 -13.427 -11.642 -0.688 1.00 53.35 H new ATOM 0 HA GLN A 48 -11.112 -10.162 -1.723 1.00 45.21 H new ATOM 0 HB2 GLN A 48 -13.042 -8.937 -0.827 1.00 21.51 H new ATOM 0 HB3 GLN A 48 -12.969 -9.862 0.659 1.00 21.51 H new ATOM 0 HG2 GLN A 48 -10.728 -8.905 1.139 1.00 13.52 H new ATOM 0 HG3 GLN A 48 -10.816 -7.969 -0.340 1.00 13.52 H new ATOM 0 HE21 GLN A 48 -12.063 -8.373 2.918 1.00 11.45 H new ATOM 0 HE22 GLN A 48 -12.864 -6.801 3.017 1.00 11.45 H new ATOM 786 N VAL A 49 -9.505 -11.198 -0.145 1.00 34.15 N ATOM 787 CA VAL A 49 -8.566 -11.930 0.631 1.00 62.42 C ATOM 788 C VAL A 49 -7.640 -11.017 1.380 1.00 20.00 C ATOM 789 O VAL A 49 -7.345 -9.913 0.938 1.00 74.43 O ATOM 790 CB VAL A 49 -7.777 -12.983 -0.209 1.00 23.53 C ATOM 791 CG1 VAL A 49 -8.695 -14.105 -0.657 1.00 24.25 C ATOM 792 CG2 VAL A 49 -7.126 -12.371 -1.438 1.00 24.11 C ATOM 0 H VAL A 49 -9.093 -10.585 -0.848 1.00 34.15 H new ATOM 0 HA VAL A 49 -9.144 -12.492 1.364 1.00 62.42 H new ATOM 0 HB VAL A 49 -6.993 -13.371 0.441 1.00 23.53 H new ATOM 0 HG11 VAL A 49 -8.127 -14.829 -1.241 1.00 24.25 H new ATOM 0 HG12 VAL A 49 -9.120 -14.598 0.217 1.00 24.25 H new ATOM 0 HG13 VAL A 49 -9.498 -13.695 -1.269 1.00 24.25 H new ATOM 0 HG21 VAL A 49 -6.590 -13.144 -1.989 1.00 24.11 H new ATOM 0 HG22 VAL A 49 -7.894 -11.936 -2.078 1.00 24.11 H new ATOM 0 HG23 VAL A 49 -6.427 -11.593 -1.130 1.00 24.11 H new ATOM 802 N CYS A 50 -7.223 -11.446 2.512 1.00 50.24 N ATOM 803 CA CYS A 50 -6.321 -10.680 3.297 1.00 53.22 C ATOM 804 C CYS A 50 -4.994 -11.345 3.132 1.00 60.43 C ATOM 805 O CYS A 50 -4.908 -12.532 3.236 1.00 1.32 O ATOM 806 CB CYS A 50 -6.770 -10.694 4.745 1.00 63.35 C ATOM 807 SG CYS A 50 -5.923 -9.492 5.835 1.00 3.33 S ATOM 0 H CYS A 50 -7.495 -12.338 2.924 1.00 50.24 H new ATOM 0 HA CYS A 50 -6.276 -9.635 2.990 1.00 53.22 H new ATOM 0 HB2 CYS A 50 -7.842 -10.498 4.778 1.00 63.35 H new ATOM 0 HB3 CYS A 50 -6.616 -11.696 5.147 1.00 63.35 H new ATOM 812 N ILE A 51 -3.993 -10.603 2.870 1.00 21.44 N ATOM 813 CA ILE A 51 -2.738 -11.152 2.488 1.00 21.13 C ATOM 814 C ILE A 51 -1.737 -11.043 3.610 1.00 44.05 C ATOM 815 O ILE A 51 -1.709 -10.047 4.348 1.00 52.23 O ATOM 816 CB ILE A 51 -2.165 -10.400 1.247 1.00 54.24 C ATOM 817 CG1 ILE A 51 -3.194 -10.283 0.127 1.00 35.21 C ATOM 818 CG2 ILE A 51 -0.947 -11.102 0.718 1.00 60.52 C ATOM 819 CD1 ILE A 51 -3.704 -11.603 -0.395 1.00 32.35 C ATOM 0 H ILE A 51 -4.012 -9.584 2.912 1.00 21.44 H new ATOM 0 HA ILE A 51 -2.904 -12.202 2.245 1.00 21.13 H new ATOM 0 HB ILE A 51 -1.900 -9.397 1.581 1.00 54.24 H new ATOM 0 HG12 ILE A 51 -4.040 -9.698 0.488 1.00 35.21 H new ATOM 0 HG13 ILE A 51 -2.751 -9.727 -0.699 1.00 35.21 H new ATOM 0 HG21 ILE A 51 -0.563 -10.562 -0.147 1.00 60.52 H new ATOM 0 HG22 ILE A 51 -0.182 -11.137 1.493 1.00 60.52 H new ATOM 0 HG23 ILE A 51 -1.212 -12.118 0.423 1.00 60.52 H new ATOM 0 HD11 ILE A 51 -4.430 -11.425 -1.188 1.00 32.35 H new ATOM 0 HD12 ILE A 51 -2.871 -12.184 -0.790 1.00 32.35 H new ATOM 0 HD13 ILE A 51 -4.180 -12.155 0.415 1.00 32.35 H new ATOM 831 N ASP A 52 -0.949 -12.076 3.733 1.00 71.24 N ATOM 832 CA ASP A 52 0.153 -12.127 4.658 1.00 14.42 C ATOM 833 C ASP A 52 1.254 -11.174 4.177 1.00 13.22 C ATOM 834 O ASP A 52 1.729 -11.285 3.045 1.00 13.04 O ATOM 835 CB ASP A 52 0.685 -13.559 4.733 1.00 53.35 C ATOM 836 CG ASP A 52 1.899 -13.699 5.603 1.00 34.43 C ATOM 837 OD1 ASP A 52 1.758 -13.769 6.843 1.00 61.31 O ATOM 838 OD2 ASP A 52 2.995 -13.743 5.069 1.00 50.23 O ATOM 0 H ASP A 52 -1.057 -12.926 3.180 1.00 71.24 H new ATOM 0 HA ASP A 52 -0.176 -11.821 5.651 1.00 14.42 H new ATOM 0 HB2 ASP A 52 -0.102 -14.211 5.112 1.00 53.35 H new ATOM 0 HB3 ASP A 52 0.927 -13.902 3.727 1.00 53.35 H new ATOM 843 N PRO A 53 1.672 -10.226 5.017 1.00 13.22 N ATOM 844 CA PRO A 53 2.676 -9.217 4.644 1.00 25.25 C ATOM 845 C PRO A 53 4.105 -9.751 4.738 1.00 2.20 C ATOM 846 O PRO A 53 5.080 -9.003 4.620 1.00 25.02 O ATOM 847 CB PRO A 53 2.466 -8.152 5.701 1.00 4.41 C ATOM 848 CG PRO A 53 2.084 -8.925 6.904 1.00 12.20 C ATOM 849 CD PRO A 53 1.203 -10.037 6.405 1.00 11.14 C ATOM 0 HA PRO A 53 2.560 -8.879 3.614 1.00 25.25 H new ATOM 0 HB2 PRO A 53 3.372 -7.570 5.869 1.00 4.41 H new ATOM 0 HB3 PRO A 53 1.685 -7.449 5.412 1.00 4.41 H new ATOM 0 HG2 PRO A 53 2.964 -9.320 7.412 1.00 12.20 H new ATOM 0 HG3 PRO A 53 1.555 -8.298 7.622 1.00 12.20 H new ATOM 0 HD2 PRO A 53 1.320 -10.944 6.999 1.00 11.14 H new ATOM 0 HD3 PRO A 53 0.148 -9.765 6.442 1.00 11.14 H new ATOM 857 N LYS A 54 4.215 -11.029 4.950 1.00 32.24 N ATOM 858 CA LYS A 54 5.471 -11.693 5.124 1.00 4.22 C ATOM 859 C LYS A 54 5.767 -12.564 3.887 1.00 71.41 C ATOM 860 O LYS A 54 6.803 -13.225 3.798 1.00 31.34 O ATOM 861 CB LYS A 54 5.382 -12.496 6.428 1.00 2.30 C ATOM 862 CG LYS A 54 5.163 -11.599 7.651 1.00 54.14 C ATOM 863 CD LYS A 54 4.625 -12.372 8.843 1.00 51.44 C ATOM 864 CE LYS A 54 5.550 -13.479 9.312 1.00 62.01 C ATOM 865 NZ LYS A 54 6.850 -12.989 9.811 1.00 23.21 N ATOM 0 H LYS A 54 3.411 -11.654 5.008 1.00 32.24 H new ATOM 0 HA LYS A 54 6.303 -10.994 5.207 1.00 4.22 H new ATOM 0 HB2 LYS A 54 4.564 -13.213 6.355 1.00 2.30 H new ATOM 0 HB3 LYS A 54 6.299 -13.071 6.561 1.00 2.30 H new ATOM 0 HG2 LYS A 54 6.105 -11.124 7.924 1.00 54.14 H new ATOM 0 HG3 LYS A 54 4.467 -10.801 7.394 1.00 54.14 H new ATOM 0 HD2 LYS A 54 4.452 -11.680 9.667 1.00 51.44 H new ATOM 0 HD3 LYS A 54 3.659 -12.803 8.581 1.00 51.44 H new ATOM 0 HE2 LYS A 54 5.056 -14.044 10.103 1.00 62.01 H new ATOM 0 HE3 LYS A 54 5.724 -14.170 8.487 1.00 62.01 H new ATOM 0 HZ1 LYS A 54 7.333 -13.751 10.328 1.00 23.21 H new ATOM 0 HZ2 LYS A 54 7.439 -12.688 9.008 1.00 23.21 H new ATOM 0 HZ3 LYS A 54 6.695 -12.182 10.449 1.00 23.21 H new ATOM 879 N LEU A 55 4.834 -12.530 2.922 1.00 15.31 N ATOM 880 CA LEU A 55 4.981 -13.220 1.634 1.00 2.31 C ATOM 881 C LEU A 55 6.120 -12.656 0.843 1.00 43.32 C ATOM 882 O LEU A 55 6.336 -11.447 0.848 1.00 72.53 O ATOM 883 CB LEU A 55 3.722 -13.083 0.801 1.00 75.04 C ATOM 884 CG LEU A 55 2.518 -13.852 1.266 1.00 53.31 C ATOM 885 CD1 LEU A 55 1.340 -13.489 0.412 1.00 50.12 C ATOM 886 CD2 LEU A 55 2.786 -15.323 1.134 1.00 4.24 C ATOM 0 H LEU A 55 3.955 -12.021 3.015 1.00 15.31 H new ATOM 0 HA LEU A 55 5.171 -14.269 1.859 1.00 2.31 H new ATOM 0 HB2 LEU A 55 3.456 -12.027 0.758 1.00 75.04 H new ATOM 0 HB3 LEU A 55 3.952 -13.395 -0.218 1.00 75.04 H new ATOM 0 HG LEU A 55 2.309 -13.608 2.308 1.00 53.31 H new ATOM 0 HD11 LEU A 55 0.464 -14.045 0.746 1.00 50.12 H new ATOM 0 HD12 LEU A 55 1.145 -12.420 0.496 1.00 50.12 H new ATOM 0 HD13 LEU A 55 1.554 -13.738 -0.627 1.00 50.12 H new ATOM 0 HD21 LEU A 55 1.914 -15.883 1.471 1.00 4.24 H new ATOM 0 HD22 LEU A 55 2.991 -15.563 0.091 1.00 4.24 H new ATOM 0 HD23 LEU A 55 3.648 -15.592 1.744 1.00 4.24 H new ATOM 898 N LYS A 56 6.801 -13.513 0.105 1.00 4.12 N ATOM 899 CA LYS A 56 7.959 -13.116 -0.662 1.00 31.11 C ATOM 900 C LYS A 56 7.567 -12.156 -1.787 1.00 21.34 C ATOM 901 O LYS A 56 8.314 -11.220 -2.085 1.00 72.34 O ATOM 902 CB LYS A 56 8.710 -14.345 -1.208 1.00 3.21 C ATOM 903 CG LYS A 56 10.050 -14.032 -1.896 1.00 21.21 C ATOM 904 CD LYS A 56 11.021 -13.331 -0.936 1.00 72.44 C ATOM 905 CE LYS A 56 12.400 -13.123 -1.562 1.00 52.02 C ATOM 906 NZ LYS A 56 12.360 -12.294 -2.790 1.00 54.23 N ATOM 0 H LYS A 56 6.564 -14.502 0.023 1.00 4.12 H new ATOM 0 HA LYS A 56 8.639 -12.585 0.004 1.00 31.11 H new ATOM 0 HB2 LYS A 56 8.893 -15.036 -0.385 1.00 3.21 H new ATOM 0 HB3 LYS A 56 8.065 -14.861 -1.919 1.00 3.21 H new ATOM 0 HG2 LYS A 56 10.499 -14.956 -2.260 1.00 21.21 H new ATOM 0 HG3 LYS A 56 9.875 -13.399 -2.766 1.00 21.21 H new ATOM 0 HD2 LYS A 56 10.607 -12.366 -0.643 1.00 72.44 H new ATOM 0 HD3 LYS A 56 11.122 -13.924 -0.027 1.00 72.44 H new ATOM 0 HE2 LYS A 56 13.057 -12.650 -0.832 1.00 52.02 H new ATOM 0 HE3 LYS A 56 12.835 -14.094 -1.800 1.00 52.02 H new ATOM 0 HZ1 LYS A 56 13.286 -12.327 -3.261 1.00 54.23 H new ATOM 0 HZ2 LYS A 56 11.631 -12.662 -3.434 1.00 54.23 H new ATOM 0 HZ3 LYS A 56 12.135 -11.311 -2.538 1.00 54.23 H new ATOM 920 N TRP A 57 6.384 -12.355 -2.396 1.00 4.25 N ATOM 921 CA TRP A 57 5.961 -11.433 -3.446 1.00 52.51 C ATOM 922 C TRP A 57 5.567 -10.094 -2.853 1.00 25.52 C ATOM 923 O TRP A 57 5.717 -9.055 -3.485 1.00 62.33 O ATOM 924 CB TRP A 57 4.874 -11.995 -4.411 1.00 72.34 C ATOM 925 CG TRP A 57 3.495 -12.300 -3.845 1.00 64.45 C ATOM 926 CD1 TRP A 57 3.054 -13.481 -3.314 1.00 1.10 C ATOM 927 CD2 TRP A 57 2.364 -11.406 -3.820 1.00 44.42 C ATOM 928 NE1 TRP A 57 1.723 -13.377 -2.978 1.00 53.01 N ATOM 929 CE2 TRP A 57 1.279 -12.116 -3.266 1.00 12.44 C ATOM 930 CE3 TRP A 57 2.169 -10.079 -4.210 1.00 24.41 C ATOM 931 CZ2 TRP A 57 0.012 -11.536 -3.102 1.00 54.53 C ATOM 932 CZ3 TRP A 57 0.921 -9.512 -4.047 1.00 11.14 C ATOM 933 CH2 TRP A 57 -0.140 -10.241 -3.497 1.00 5.35 C ATOM 0 H TRP A 57 5.734 -13.113 -2.187 1.00 4.25 H new ATOM 0 HA TRP A 57 6.832 -11.291 -4.086 1.00 52.51 H new ATOM 0 HB2 TRP A 57 4.749 -11.279 -5.224 1.00 72.34 H new ATOM 0 HB3 TRP A 57 5.263 -12.913 -4.852 1.00 72.34 H new ATOM 0 HD1 TRP A 57 3.660 -14.364 -3.178 1.00 1.10 H new ATOM 0 HE1 TRP A 57 1.156 -14.124 -2.577 1.00 53.01 H new ATOM 0 HE3 TRP A 57 2.981 -9.506 -4.632 1.00 24.41 H new ATOM 0 HZ2 TRP A 57 -0.810 -12.094 -2.679 1.00 54.53 H new ATOM 0 HZ3 TRP A 57 0.760 -8.488 -4.349 1.00 11.14 H new ATOM 0 HH2 TRP A 57 -1.103 -9.765 -3.383 1.00 5.35 H new ATOM 944 N ILE A 58 5.086 -10.126 -1.620 1.00 55.04 N ATOM 945 CA ILE A 58 4.776 -8.912 -0.901 1.00 10.31 C ATOM 946 C ILE A 58 6.072 -8.191 -0.524 1.00 2.41 C ATOM 947 O ILE A 58 6.153 -6.970 -0.626 1.00 33.44 O ATOM 948 CB ILE A 58 3.889 -9.173 0.366 1.00 72.43 C ATOM 949 CG1 ILE A 58 2.453 -9.610 -0.027 1.00 15.13 C ATOM 950 CG2 ILE A 58 3.848 -7.943 1.266 1.00 54.43 C ATOM 951 CD1 ILE A 58 1.675 -8.544 -0.759 1.00 22.11 C ATOM 0 H ILE A 58 4.903 -10.984 -1.100 1.00 55.04 H new ATOM 0 HA ILE A 58 4.187 -8.276 -1.562 1.00 10.31 H new ATOM 0 HB ILE A 58 4.347 -9.991 0.923 1.00 72.43 H new ATOM 0 HG12 ILE A 58 2.512 -10.500 -0.654 1.00 15.13 H new ATOM 0 HG13 ILE A 58 1.908 -9.891 0.874 1.00 15.13 H new ATOM 0 HG21 ILE A 58 3.227 -8.150 2.137 1.00 54.43 H new ATOM 0 HG22 ILE A 58 4.859 -7.696 1.592 1.00 54.43 H new ATOM 0 HG23 ILE A 58 3.429 -7.102 0.714 1.00 54.43 H new ATOM 0 HD11 ILE A 58 0.681 -8.921 -1.001 1.00 22.11 H new ATOM 0 HD12 ILE A 58 1.584 -7.661 -0.126 1.00 22.11 H new ATOM 0 HD13 ILE A 58 2.197 -8.279 -1.679 1.00 22.11 H new ATOM 963 N GLN A 59 7.096 -8.970 -0.126 1.00 11.40 N ATOM 964 CA GLN A 59 8.403 -8.400 0.239 1.00 30.43 C ATOM 965 C GLN A 59 8.937 -7.626 -0.940 1.00 42.52 C ATOM 966 O GLN A 59 9.316 -6.467 -0.818 1.00 10.11 O ATOM 967 CB GLN A 59 9.436 -9.487 0.608 1.00 21.43 C ATOM 968 CG GLN A 59 9.013 -10.475 1.682 1.00 22.30 C ATOM 969 CD GLN A 59 8.527 -9.828 2.948 1.00 73.32 C ATOM 970 OE1 GLN A 59 9.293 -9.551 3.848 1.00 0.54 O ATOM 971 NE2 GLN A 59 7.241 -9.620 3.028 1.00 31.31 N ATOM 0 H GLN A 59 7.043 -9.986 -0.050 1.00 11.40 H new ATOM 0 HA GLN A 59 8.254 -7.763 1.111 1.00 30.43 H new ATOM 0 HB2 GLN A 59 9.683 -10.046 -0.295 1.00 21.43 H new ATOM 0 HB3 GLN A 59 10.350 -8.993 0.937 1.00 21.43 H new ATOM 0 HG2 GLN A 59 8.223 -11.112 1.285 1.00 22.30 H new ATOM 0 HG3 GLN A 59 9.857 -11.123 1.918 1.00 22.30 H new ATOM 0 HE21 GLN A 59 6.635 -9.869 2.246 1.00 31.31 H new ATOM 0 HE22 GLN A 59 6.842 -9.209 3.872 1.00 31.31 H new ATOM 980 N GLU A 60 8.931 -8.281 -2.101 1.00 42.53 N ATOM 981 CA GLU A 60 9.376 -7.663 -3.330 1.00 34.05 C ATOM 982 C GLU A 60 8.553 -6.427 -3.616 1.00 24.15 C ATOM 983 O GLU A 60 9.100 -5.367 -3.798 1.00 65.43 O ATOM 984 CB GLU A 60 9.241 -8.634 -4.519 1.00 71.43 C ATOM 985 CG GLU A 60 10.074 -9.904 -4.436 1.00 45.01 C ATOM 986 CD GLU A 60 11.554 -9.636 -4.383 1.00 73.11 C ATOM 987 OE1 GLU A 60 12.167 -9.387 -5.440 1.00 71.41 O ATOM 988 OE2 GLU A 60 12.127 -9.680 -3.287 1.00 13.12 O ATOM 0 H GLU A 60 8.619 -9.246 -2.206 1.00 42.53 H new ATOM 0 HA GLU A 60 10.425 -7.395 -3.206 1.00 34.05 H new ATOM 0 HB2 GLU A 60 8.193 -8.916 -4.616 1.00 71.43 H new ATOM 0 HB3 GLU A 60 9.514 -8.102 -5.430 1.00 71.43 H new ATOM 0 HG2 GLU A 60 9.781 -10.467 -3.550 1.00 45.01 H new ATOM 0 HG3 GLU A 60 9.855 -10.532 -5.299 1.00 45.01 H new ATOM 995 N TYR A 61 7.236 -6.573 -3.589 1.00 55.13 N ATOM 996 CA TYR A 61 6.325 -5.496 -3.950 1.00 43.13 C ATOM 997 C TYR A 61 6.556 -4.243 -3.085 1.00 61.22 C ATOM 998 O TYR A 61 6.626 -3.128 -3.605 1.00 74.50 O ATOM 999 CB TYR A 61 4.869 -5.967 -3.845 1.00 20.40 C ATOM 1000 CG TYR A 61 3.885 -5.009 -4.460 1.00 15.34 C ATOM 1001 CD1 TYR A 61 3.327 -3.973 -3.726 1.00 15.41 C ATOM 1002 CD2 TYR A 61 3.526 -5.134 -5.796 1.00 52.42 C ATOM 1003 CE1 TYR A 61 2.448 -3.094 -4.302 1.00 21.12 C ATOM 1004 CE2 TYR A 61 2.644 -4.262 -6.380 1.00 13.45 C ATOM 1005 CZ TYR A 61 2.108 -3.238 -5.624 1.00 75.42 C ATOM 1006 OH TYR A 61 1.241 -2.347 -6.193 1.00 71.24 O ATOM 0 H TYR A 61 6.770 -7.439 -3.317 1.00 55.13 H new ATOM 0 HA TYR A 61 6.530 -5.221 -4.985 1.00 43.13 H new ATOM 0 HB2 TYR A 61 4.773 -6.937 -4.332 1.00 20.40 H new ATOM 0 HB3 TYR A 61 4.616 -6.111 -2.795 1.00 20.40 H new ATOM 0 HD1 TYR A 61 3.589 -3.857 -2.685 1.00 15.41 H new ATOM 0 HD2 TYR A 61 3.950 -5.933 -6.386 1.00 52.42 H new ATOM 0 HE1 TYR A 61 2.024 -2.291 -3.718 1.00 21.12 H new ATOM 0 HE2 TYR A 61 2.372 -4.374 -7.419 1.00 13.45 H new ATOM 0 HH TYR A 61 0.324 -2.679 -6.101 1.00 71.24 H new ATOM 1016 N LEU A 62 6.685 -4.439 -1.778 1.00 54.31 N ATOM 1017 CA LEU A 62 6.937 -3.334 -0.857 1.00 51.44 C ATOM 1018 C LEU A 62 8.302 -2.713 -1.143 1.00 1.41 C ATOM 1019 O LEU A 62 8.456 -1.482 -1.156 1.00 30.43 O ATOM 1020 CB LEU A 62 6.865 -3.816 0.603 1.00 53.44 C ATOM 1021 CG LEU A 62 5.512 -4.378 1.075 1.00 71.51 C ATOM 1022 CD1 LEU A 62 5.618 -4.890 2.496 1.00 1.44 C ATOM 1023 CD2 LEU A 62 4.433 -3.322 0.997 1.00 0.43 C ATOM 0 H LEU A 62 6.619 -5.353 -1.331 1.00 54.31 H new ATOM 0 HA LEU A 62 6.167 -2.577 -1.006 1.00 51.44 H new ATOM 0 HB2 LEU A 62 7.623 -4.586 0.746 1.00 53.44 H new ATOM 0 HB3 LEU A 62 7.133 -2.982 1.251 1.00 53.44 H new ATOM 0 HG LEU A 62 5.244 -5.203 0.415 1.00 71.51 H new ATOM 0 HD11 LEU A 62 4.653 -5.284 2.814 1.00 1.44 H new ATOM 0 HD12 LEU A 62 6.366 -5.682 2.543 1.00 1.44 H new ATOM 0 HD13 LEU A 62 5.912 -4.074 3.156 1.00 1.44 H new ATOM 0 HD21 LEU A 62 3.486 -3.743 1.336 1.00 0.43 H new ATOM 0 HD22 LEU A 62 4.703 -2.478 1.632 1.00 0.43 H new ATOM 0 HD23 LEU A 62 4.331 -2.982 -0.033 1.00 0.43 H new ATOM 1035 N GLU A 63 9.281 -3.564 -1.398 1.00 51.14 N ATOM 1036 CA GLU A 63 10.616 -3.115 -1.702 1.00 12.12 C ATOM 1037 C GLU A 63 10.715 -2.358 -3.007 1.00 54.43 C ATOM 1038 O GLU A 63 11.358 -1.334 -3.060 1.00 1.44 O ATOM 1039 CB GLU A 63 11.621 -4.243 -1.699 1.00 11.41 C ATOM 1040 CG GLU A 63 11.957 -4.805 -0.344 1.00 32.12 C ATOM 1041 CD GLU A 63 13.158 -5.688 -0.448 1.00 22.05 C ATOM 1042 OE1 GLU A 63 14.272 -5.150 -0.602 1.00 61.45 O ATOM 1043 OE2 GLU A 63 13.022 -6.921 -0.447 1.00 50.32 O ATOM 0 H GLU A 63 9.168 -4.578 -1.399 1.00 51.14 H new ATOM 0 HA GLU A 63 10.859 -2.423 -0.895 1.00 12.12 H new ATOM 0 HB2 GLU A 63 11.238 -5.050 -2.323 1.00 11.41 H new ATOM 0 HB3 GLU A 63 12.541 -3.889 -2.165 1.00 11.41 H new ATOM 0 HG2 GLU A 63 12.150 -3.994 0.359 1.00 32.12 H new ATOM 0 HG3 GLU A 63 11.111 -5.371 0.046 1.00 32.12 H new ATOM 1050 N LYS A 64 10.048 -2.843 -4.058 1.00 63.22 N ATOM 1051 CA LYS A 64 10.141 -2.218 -5.402 1.00 54.41 C ATOM 1052 C LYS A 64 9.463 -0.831 -5.401 1.00 75.24 C ATOM 1053 O LYS A 64 9.488 -0.109 -6.390 1.00 62.53 O ATOM 1054 CB LYS A 64 9.485 -3.093 -6.504 1.00 62.44 C ATOM 1055 CG LYS A 64 9.844 -4.577 -6.486 1.00 14.52 C ATOM 1056 CD LYS A 64 11.340 -4.885 -6.553 1.00 13.20 C ATOM 1057 CE LYS A 64 11.534 -6.391 -6.365 1.00 52.33 C ATOM 1058 NZ LYS A 64 12.948 -6.836 -6.352 1.00 33.25 N ATOM 0 H LYS A 64 9.439 -3.660 -4.016 1.00 63.22 H new ATOM 0 HA LYS A 64 11.203 -2.119 -5.627 1.00 54.41 H new ATOM 0 HB2 LYS A 64 8.402 -3.001 -6.416 1.00 62.44 H new ATOM 0 HB3 LYS A 64 9.762 -2.685 -7.476 1.00 62.44 H new ATOM 0 HG2 LYS A 64 9.438 -5.022 -5.577 1.00 14.52 H new ATOM 0 HG3 LYS A 64 9.351 -5.064 -7.327 1.00 14.52 H new ATOM 0 HD2 LYS A 64 11.750 -4.567 -7.512 1.00 13.20 H new ATOM 0 HD3 LYS A 64 11.875 -4.335 -5.779 1.00 13.20 H new ATOM 0 HE2 LYS A 64 11.064 -6.690 -5.428 1.00 52.33 H new ATOM 0 HE3 LYS A 64 11.010 -6.914 -7.165 1.00 52.33 H new ATOM 0 HZ1 LYS A 64 12.999 -7.821 -6.021 1.00 33.25 H new ATOM 0 HZ2 LYS A 64 13.341 -6.773 -7.313 1.00 33.25 H new ATOM 0 HZ3 LYS A 64 13.498 -6.227 -5.713 1.00 33.25 H new ATOM 1072 N CYS A 65 8.885 -0.483 -4.284 1.00 75.11 N ATOM 1073 CA CYS A 65 8.135 0.740 -4.147 1.00 4.41 C ATOM 1074 C CYS A 65 9.000 1.830 -3.531 1.00 22.42 C ATOM 1075 O CYS A 65 9.114 2.937 -4.091 1.00 53.13 O ATOM 1076 CB CYS A 65 6.855 0.509 -3.325 1.00 5.25 C ATOM 1077 SG CYS A 65 5.822 1.999 -3.074 1.00 64.22 S ATOM 0 H CYS A 65 8.921 -1.045 -3.433 1.00 75.11 H new ATOM 0 HA CYS A 65 7.833 1.072 -5.140 1.00 4.41 H new ATOM 0 HB2 CYS A 65 6.254 -0.253 -3.822 1.00 5.25 H new ATOM 0 HB3 CYS A 65 7.134 0.109 -2.350 1.00 5.25 H new ATOM 1082 N LEU A 66 9.633 1.540 -2.399 1.00 72.12 N ATOM 1083 CA LEU A 66 10.472 2.520 -1.781 1.00 2.53 C ATOM 1084 C LEU A 66 11.841 2.526 -2.420 1.00 22.00 C ATOM 1085 O LEU A 66 12.505 1.502 -2.490 1.00 74.13 O ATOM 1086 CB LEU A 66 10.501 2.417 -0.213 1.00 21.10 C ATOM 1087 CG LEU A 66 11.075 1.165 0.521 1.00 73.13 C ATOM 1088 CD1 LEU A 66 12.586 1.044 0.389 1.00 54.22 C ATOM 1089 CD2 LEU A 66 10.718 1.242 1.979 1.00 41.32 C ATOM 0 H LEU A 66 9.574 0.647 -1.910 1.00 72.12 H new ATOM 0 HA LEU A 66 10.029 3.498 -1.968 1.00 2.53 H new ATOM 0 HB2 LEU A 66 11.062 3.279 0.149 1.00 21.10 H new ATOM 0 HB3 LEU A 66 9.473 2.539 0.130 1.00 21.10 H new ATOM 0 HG LEU A 66 10.634 0.285 0.052 1.00 73.13 H new ATOM 0 HD11 LEU A 66 12.928 0.155 0.919 1.00 54.22 H new ATOM 0 HD12 LEU A 66 12.854 0.963 -0.664 1.00 54.22 H new ATOM 0 HD13 LEU A 66 13.061 1.927 0.817 1.00 54.22 H new ATOM 0 HD21 LEU A 66 11.116 0.370 2.498 1.00 41.32 H new ATOM 0 HD22 LEU A 66 11.145 2.147 2.411 1.00 41.32 H new ATOM 0 HD23 LEU A 66 9.634 1.265 2.087 1.00 41.32 H new ATOM 1101 N ASN A 67 12.203 3.669 -2.986 1.00 73.24 N ATOM 1102 CA ASN A 67 13.532 3.913 -3.632 1.00 65.32 C ATOM 1103 C ASN A 67 13.700 3.139 -4.957 1.00 44.50 C ATOM 1104 O ASN A 67 14.423 3.580 -5.873 1.00 70.22 O ATOM 1105 CB ASN A 67 14.700 3.571 -2.660 1.00 22.23 C ATOM 1106 CG ASN A 67 16.087 3.859 -3.239 1.00 40.13 C ATOM 1107 OD1 ASN A 67 16.702 3.008 -3.899 1.00 23.21 O ATOM 1108 ND2 ASN A 67 16.604 5.039 -2.971 1.00 64.45 N ATOM 0 H ASN A 67 11.587 4.481 -3.022 1.00 73.24 H new ATOM 0 HA ASN A 67 13.566 4.976 -3.869 1.00 65.32 H new ATOM 0 HB2 ASN A 67 14.574 4.142 -1.740 1.00 22.23 H new ATOM 0 HB3 ASN A 67 14.640 2.516 -2.391 1.00 22.23 H new ATOM 0 HD21 ASN A 67 17.537 5.276 -3.309 1.00 64.45 H new ATOM 0 HD22 ASN A 67 16.072 5.717 -2.425 1.00 64.45 H new ATOM 1115 N LYS A 68 13.036 2.019 -5.060 1.00 33.34 N ATOM 1116 CA LYS A 68 13.155 1.136 -6.192 1.00 14.24 C ATOM 1117 C LYS A 68 12.064 1.404 -7.217 1.00 44.11 C ATOM 1118 O LYS A 68 11.443 2.479 -7.210 1.00 62.41 O ATOM 1119 CB LYS A 68 13.095 -0.309 -5.709 1.00 65.01 C ATOM 1120 CG LYS A 68 14.049 -0.590 -4.566 1.00 10.15 C ATOM 1121 CD LYS A 68 14.140 -2.065 -4.223 1.00 61.31 C ATOM 1122 CE LYS A 68 15.178 -2.305 -3.130 1.00 12.20 C ATOM 1123 NZ LYS A 68 15.321 -3.742 -2.772 1.00 52.55 N ATOM 0 H LYS A 68 12.385 1.688 -4.348 1.00 33.34 H new ATOM 0 HA LYS A 68 14.112 1.317 -6.681 1.00 14.24 H new ATOM 0 HB2 LYS A 68 12.078 -0.538 -5.391 1.00 65.01 H new ATOM 0 HB3 LYS A 68 13.327 -0.974 -6.541 1.00 65.01 H new ATOM 0 HG2 LYS A 68 15.041 -0.221 -4.828 1.00 10.15 H new ATOM 0 HG3 LYS A 68 13.725 -0.036 -3.685 1.00 10.15 H new ATOM 0 HD2 LYS A 68 13.167 -2.427 -3.892 1.00 61.31 H new ATOM 0 HD3 LYS A 68 14.405 -2.634 -5.114 1.00 61.31 H new ATOM 0 HE2 LYS A 68 16.143 -1.921 -3.462 1.00 12.20 H new ATOM 0 HE3 LYS A 68 14.899 -1.740 -2.240 1.00 12.20 H new ATOM 0 HZ1 LYS A 68 16.328 -3.972 -2.653 1.00 52.55 H new ATOM 0 HZ2 LYS A 68 14.816 -3.930 -1.883 1.00 52.55 H new ATOM 0 HZ3 LYS A 68 14.919 -4.330 -3.530 1.00 52.55 H new ATOM 1207 N ILE B 106 2.130 3.679 13.393 1.00 42.14 N ATOM 1208 CA ILE B 106 0.920 3.365 12.712 1.00 35.43 C ATOM 1209 C ILE B 106 -0.052 4.551 12.693 1.00 54.31 C ATOM 1210 O ILE B 106 0.153 5.547 13.404 1.00 61.23 O ATOM 1211 CB ILE B 106 0.279 2.095 13.293 1.00 51.13 C ATOM 1212 CG1 ILE B 106 -0.044 2.256 14.785 1.00 71.24 C ATOM 1213 CG2 ILE B 106 1.220 0.915 13.081 1.00 52.02 C ATOM 1214 CD1 ILE B 106 -0.661 1.014 15.405 1.00 51.30 C ATOM 0 HA ILE B 106 1.168 3.158 11.671 1.00 35.43 H new ATOM 0 HB ILE B 106 -0.662 1.916 12.774 1.00 51.13 H new ATOM 0 HG12 ILE B 106 0.871 2.505 15.323 1.00 71.24 H new ATOM 0 HG13 ILE B 106 -0.728 3.095 14.913 1.00 71.24 H new ATOM 0 HG21 ILE B 106 0.769 0.012 13.492 1.00 52.02 H new ATOM 0 HG22 ILE B 106 1.398 0.779 12.014 1.00 52.02 H new ATOM 0 HG23 ILE B 106 2.167 1.109 13.585 1.00 52.02 H new ATOM 0 HD11 ILE B 106 -0.864 1.197 16.460 1.00 51.30 H new ATOM 0 HD12 ILE B 106 -1.593 0.776 14.892 1.00 51.30 H new ATOM 0 HD13 ILE B 106 0.031 0.177 15.308 1.00 51.30 H new ATOM 1226 N TYR B 107 -1.113 4.413 11.903 1.00 61.11 N ATOM 1227 CA TYR B 107 -2.071 5.494 11.587 1.00 20.42 C ATOM 1228 C TYR B 107 -2.669 6.121 12.839 1.00 74.42 C ATOM 1229 O TYR B 107 -2.893 7.329 12.895 1.00 32.42 O ATOM 1230 CB TYR B 107 -3.215 4.942 10.754 1.00 42.31 C ATOM 1231 CG TYR B 107 -2.808 4.041 9.651 1.00 61.04 C ATOM 1232 CD1 TYR B 107 -2.257 4.546 8.520 1.00 63.52 C ATOM 1233 CD2 TYR B 107 -3.001 2.674 9.736 1.00 60.35 C ATOM 1234 CE1 TYR B 107 -1.901 3.762 7.500 1.00 73.15 C ATOM 1235 CE2 TYR B 107 -2.650 1.859 8.702 1.00 73.44 C ATOM 1236 CZ TYR B 107 -2.094 2.420 7.568 1.00 5.05 C ATOM 1237 OH TYR B 107 -1.743 1.643 6.494 1.00 64.52 O ATOM 0 H TYR B 107 -1.345 3.530 11.449 1.00 61.11 H new ATOM 0 HA TYR B 107 -1.515 6.257 11.042 1.00 20.42 H new ATOM 0 HB2 TYR B 107 -3.896 4.402 11.412 1.00 42.31 H new ATOM 0 HB3 TYR B 107 -3.774 5.778 10.333 1.00 42.31 H new ATOM 0 HD1 TYR B 107 -2.102 5.612 8.442 1.00 63.52 H new ATOM 0 HD2 TYR B 107 -3.434 2.249 10.630 1.00 60.35 H new ATOM 0 HE1 TYR B 107 -1.457 4.197 6.617 1.00 73.15 H new ATOM 0 HE2 TYR B 107 -2.804 0.792 8.768 1.00 73.44 H new ATOM 0 HH TYR B 107 -2.504 1.083 6.233 1.00 64.52 H new ATOM 1247 N THR B 108 -2.923 5.276 13.822 1.00 21.22 N ATOM 1248 CA THR B 108 -3.513 5.664 15.081 1.00 44.50 C ATOM 1249 C THR B 108 -5.013 5.943 14.912 1.00 1.10 C ATOM 1250 O THR B 108 -5.443 7.076 14.663 1.00 65.04 O ATOM 1251 CB THR B 108 -2.778 6.856 15.738 1.00 25.31 C ATOM 1252 OG1 THR B 108 -1.370 6.555 15.781 1.00 71.43 O ATOM 1253 CG2 THR B 108 -3.279 7.082 17.157 1.00 71.42 C ATOM 0 H THR B 108 -2.718 4.279 13.761 1.00 21.22 H new ATOM 0 HA THR B 108 -3.398 4.824 15.766 1.00 44.50 H new ATOM 0 HB THR B 108 -2.966 7.758 15.155 1.00 25.31 H new ATOM 0 HG1 THR B 108 -1.011 6.539 14.869 1.00 71.43 H new ATOM 0 HG21 THR B 108 -2.749 7.925 17.600 1.00 71.42 H new ATOM 0 HG22 THR B 108 -4.348 7.296 17.136 1.00 71.42 H new ATOM 0 HG23 THR B 108 -3.100 6.187 17.753 1.00 71.42 H new ATOM 1261 N SER B 109 -5.776 4.882 14.982 1.00 41.42 N ATOM 1262 CA SER B 109 -7.203 4.916 14.837 1.00 2.11 C ATOM 1263 C SER B 109 -7.703 3.532 15.231 1.00 74.54 C ATOM 1264 O SER B 109 -6.939 2.751 15.805 1.00 40.50 O ATOM 1265 CB SER B 109 -7.579 5.241 13.361 1.00 34.20 C ATOM 1266 OG SER B 109 -8.992 5.423 13.197 1.00 71.20 O ATOM 0 H SER B 109 -5.408 3.945 15.146 1.00 41.42 H new ATOM 0 HA SER B 109 -7.655 5.686 15.463 1.00 2.11 H new ATOM 0 HB2 SER B 109 -7.057 6.144 13.044 1.00 34.20 H new ATOM 0 HB3 SER B 109 -7.239 4.433 12.713 1.00 34.20 H new ATOM 0 HG SER B 109 -9.189 5.627 12.259 1.00 71.20 H new ATOM 1272 N ASP B 110 -8.940 3.233 14.949 1.00 64.03 N ATOM 1273 CA ASP B 110 -9.487 1.918 15.236 1.00 33.33 C ATOM 1274 C ASP B 110 -9.628 1.136 13.946 1.00 33.50 C ATOM 1275 O ASP B 110 -8.736 0.372 13.578 1.00 74.42 O ATOM 1276 CB ASP B 110 -10.839 2.018 15.969 1.00 41.35 C ATOM 1277 CG ASP B 110 -11.490 0.662 16.246 1.00 54.00 C ATOM 1278 OD1 ASP B 110 -11.115 -0.004 17.240 1.00 44.05 O ATOM 1279 OD2 ASP B 110 -12.415 0.276 15.486 1.00 53.54 O ATOM 0 H ASP B 110 -9.600 3.880 14.518 1.00 64.03 H new ATOM 0 HA ASP B 110 -8.800 1.393 15.899 1.00 33.33 H new ATOM 0 HB2 ASP B 110 -10.692 2.540 16.914 1.00 41.35 H new ATOM 0 HB3 ASP B 110 -11.522 2.624 15.373 1.00 41.35 H new ATOM 1284 N ASN B 111 -10.733 1.394 13.241 1.00 73.10 N ATOM 1285 CA ASN B 111 -11.081 0.795 11.942 1.00 73.42 C ATOM 1286 C ASN B 111 -11.279 -0.751 12.023 1.00 34.04 C ATOM 1287 O ASN B 111 -12.356 -1.255 11.705 1.00 13.30 O ATOM 1288 CB ASN B 111 -10.073 1.200 10.852 1.00 4.32 C ATOM 1289 CG ASN B 111 -10.548 0.845 9.460 1.00 65.52 C ATOM 1290 OD1 ASN B 111 -11.220 1.635 8.799 1.00 24.44 O ATOM 1291 ND2 ASN B 111 -10.202 -0.305 8.998 1.00 11.42 N ATOM 0 H ASN B 111 -11.440 2.052 13.569 1.00 73.10 H new ATOM 0 HA ASN B 111 -12.051 1.202 11.655 1.00 73.42 H new ATOM 0 HB2 ASN B 111 -9.894 2.274 10.908 1.00 4.32 H new ATOM 0 HB3 ASN B 111 -9.119 0.708 11.043 1.00 4.32 H new ATOM 0 HD21 ASN B 111 -10.486 -0.584 8.059 1.00 11.42 H new ATOM 0 HD22 ASN B 111 -9.644 -0.938 9.571 1.00 11.42 H new ATOM 1417 N TYR B 121 -4.380 -19.476 3.237 1.00 70.44 N ATOM 1418 CA TYR B 121 -4.874 -19.860 1.923 1.00 44.01 C ATOM 1419 C TYR B 121 -4.250 -21.206 1.561 1.00 3.22 C ATOM 1420 O TYR B 121 -4.932 -22.116 1.111 1.00 71.14 O ATOM 1421 CB TYR B 121 -4.451 -18.776 0.899 1.00 20.30 C ATOM 1422 CG TYR B 121 -5.099 -18.824 -0.472 1.00 25.12 C ATOM 1423 CD1 TYR B 121 -4.845 -19.839 -1.375 1.00 11.12 C ATOM 1424 CD2 TYR B 121 -5.931 -17.798 -0.865 1.00 60.25 C ATOM 1425 CE1 TYR B 121 -5.414 -19.823 -2.641 1.00 14.53 C ATOM 1426 CE2 TYR B 121 -6.513 -17.763 -2.109 1.00 33.23 C ATOM 1427 CZ TYR B 121 -6.250 -18.778 -3.001 1.00 71.22 C ATOM 1428 OH TYR B 121 -6.818 -18.753 -4.259 1.00 12.21 O ATOM 0 HA TYR B 121 -5.961 -19.947 1.917 1.00 44.01 H new ATOM 0 HB2 TYR B 121 -4.659 -17.799 1.336 1.00 20.30 H new ATOM 0 HB3 TYR B 121 -3.371 -18.842 0.764 1.00 20.30 H new ATOM 0 HD1 TYR B 121 -4.196 -20.655 -1.092 1.00 11.12 H new ATOM 0 HD2 TYR B 121 -6.132 -16.995 -0.172 1.00 60.25 H new ATOM 0 HE1 TYR B 121 -5.207 -20.619 -3.341 1.00 14.53 H new ATOM 0 HE2 TYR B 121 -7.168 -16.950 -2.384 1.00 33.23 H new ATOM 0 HH TYR B 121 -7.378 -17.954 -4.349 1.00 12.21 H new ATOM 1438 N ASP B 122 -2.937 -21.308 1.806 1.00 72.34 N ATOM 1439 CA ASP B 122 -2.139 -22.514 1.549 1.00 33.35 C ATOM 1440 C ASP B 122 -0.695 -22.240 1.913 1.00 53.53 C ATOM 1441 O ASP B 122 -0.005 -21.594 1.166 1.00 22.52 O ATOM 1442 CB ASP B 122 -2.230 -22.950 0.064 1.00 13.41 C ATOM 1443 CG ASP B 122 -1.383 -24.168 -0.278 1.00 14.21 C ATOM 1444 OD1 ASP B 122 -1.739 -25.298 0.135 1.00 53.05 O ATOM 1445 OD2 ASP B 122 -0.379 -24.023 -1.012 1.00 25.32 O ATOM 0 H ASP B 122 -2.390 -20.540 2.196 1.00 72.34 H new ATOM 0 HA ASP B 122 -2.535 -23.325 2.160 1.00 33.35 H new ATOM 0 HB2 ASP B 122 -3.271 -23.165 -0.177 1.00 13.41 H new ATOM 0 HB3 ASP B 122 -1.922 -22.117 -0.568 1.00 13.41 H new ATOM 1450 N SER B 123 -0.303 -22.627 3.121 1.00 15.45 N ATOM 1451 CA SER B 123 1.096 -22.519 3.618 1.00 32.01 C ATOM 1452 C SER B 123 1.614 -21.056 3.725 1.00 15.24 C ATOM 1453 O SER B 123 1.760 -20.347 2.727 1.00 45.03 O ATOM 1454 CB SER B 123 2.039 -23.390 2.778 1.00 25.13 C ATOM 1455 OG SER B 123 1.660 -24.760 2.855 1.00 63.01 O ATOM 0 H SER B 123 -0.943 -23.032 3.804 1.00 15.45 H new ATOM 0 HA SER B 123 1.086 -22.897 4.640 1.00 32.01 H new ATOM 0 HB2 SER B 123 2.019 -23.060 1.739 1.00 25.13 H new ATOM 0 HB3 SER B 123 3.063 -23.270 3.131 1.00 25.13 H new ATOM 0 HG SER B 123 2.272 -25.300 2.312 1.00 63.01 H new ATOM 1461 N MET B 124 1.893 -20.627 4.935 1.00 5.13 N ATOM 1462 CA MET B 124 2.357 -19.263 5.206 1.00 71.22 C ATOM 1463 C MET B 124 3.893 -19.225 5.193 1.00 32.32 C ATOM 1464 O MET B 124 4.537 -20.236 5.480 1.00 51.12 O ATOM 1465 CB MET B 124 1.809 -18.790 6.575 1.00 1.42 C ATOM 1466 CG MET B 124 2.331 -19.598 7.767 1.00 11.42 C ATOM 1467 SD MET B 124 1.541 -19.187 9.347 1.00 21.43 S ATOM 1468 CE MET B 124 -0.147 -19.732 9.039 1.00 13.53 C ATOM 0 H MET B 124 1.808 -21.207 5.769 1.00 5.13 H new ATOM 0 HA MET B 124 1.988 -18.590 4.432 1.00 71.22 H new ATOM 0 HB2 MET B 124 2.071 -17.742 6.717 1.00 1.42 H new ATOM 0 HB3 MET B 124 0.721 -18.847 6.559 1.00 1.42 H new ATOM 0 HG2 MET B 124 2.183 -20.659 7.565 1.00 11.42 H new ATOM 0 HG3 MET B 124 3.405 -19.437 7.858 1.00 11.42 H new ATOM 0 HE1 MET B 124 -0.761 -19.528 9.916 1.00 13.53 H new ATOM 0 HE2 MET B 124 -0.552 -19.196 8.180 1.00 13.53 H new ATOM 0 HE3 MET B 124 -0.152 -20.802 8.833 1.00 13.53 H new ATOM 1478 N LYS B 125 4.475 -18.082 4.839 1.00 12.23 N ATOM 1479 CA LYS B 125 5.936 -17.942 4.797 1.00 25.41 C ATOM 1480 C LYS B 125 6.371 -16.627 5.400 1.00 74.13 C ATOM 1481 O LYS B 125 5.554 -15.854 5.897 1.00 72.21 O ATOM 1482 CB LYS B 125 6.502 -17.997 3.353 1.00 24.52 C ATOM 1483 CG LYS B 125 6.271 -19.286 2.598 1.00 50.24 C ATOM 1484 CD LYS B 125 6.996 -19.294 1.239 1.00 41.15 C ATOM 1485 CE LYS B 125 8.526 -19.267 1.392 1.00 14.04 C ATOM 1486 NZ LYS B 125 9.221 -19.306 0.081 1.00 52.14 N ATOM 0 H LYS B 125 3.963 -17.239 4.577 1.00 12.23 H new ATOM 0 HA LYS B 125 6.326 -18.784 5.369 1.00 25.41 H new ATOM 0 HB2 LYS B 125 6.062 -17.180 2.781 1.00 24.52 H new ATOM 0 HB3 LYS B 125 7.575 -17.813 3.398 1.00 24.52 H new ATOM 0 HG2 LYS B 125 6.618 -20.126 3.199 1.00 50.24 H new ATOM 0 HG3 LYS B 125 5.202 -19.427 2.440 1.00 50.24 H new ATOM 0 HD2 LYS B 125 6.705 -20.183 0.680 1.00 41.15 H new ATOM 0 HD3 LYS B 125 6.677 -18.431 0.654 1.00 41.15 H new ATOM 0 HE2 LYS B 125 8.820 -18.366 1.930 1.00 14.04 H new ATOM 0 HE3 LYS B 125 8.844 -20.117 1.996 1.00 14.04 H new ATOM 0 HZ1 LYS B 125 10.250 -19.286 0.233 1.00 52.14 H new ATOM 0 HZ2 LYS B 125 8.962 -20.178 -0.423 1.00 52.14 H new ATOM 0 HZ3 LYS B 125 8.939 -18.481 -0.486 1.00 52.14 H new ATOM 1500 N GLU B 126 7.666 -16.408 5.347 1.00 45.21 N ATOM 1501 CA GLU B 126 8.323 -15.219 5.731 1.00 40.15 C ATOM 1502 C GLU B 126 9.734 -15.317 5.193 1.00 2.21 C ATOM 1503 O GLU B 126 10.258 -16.434 5.045 1.00 72.43 O ATOM 1504 CB GLU B 126 8.306 -14.990 7.251 1.00 63.53 C ATOM 1505 CG GLU B 126 8.928 -16.075 8.106 1.00 21.45 C ATOM 1506 CD GLU B 126 8.908 -15.680 9.558 1.00 35.34 C ATOM 1507 OE1 GLU B 126 7.803 -15.573 10.136 1.00 1.32 O ATOM 1508 OE2 GLU B 126 9.982 -15.410 10.127 1.00 21.21 O ATOM 0 H GLU B 126 8.316 -17.117 5.008 1.00 45.21 H new ATOM 0 HA GLU B 126 7.803 -14.354 5.319 1.00 40.15 H new ATOM 0 HB2 GLU B 126 8.822 -14.053 7.460 1.00 63.53 H new ATOM 0 HB3 GLU B 126 7.270 -14.860 7.565 1.00 63.53 H new ATOM 0 HG2 GLU B 126 8.384 -17.010 7.970 1.00 21.45 H new ATOM 0 HG3 GLU B 126 9.954 -16.254 7.786 1.00 21.45 H new ATOM 1515 N PRO B 127 10.344 -14.206 4.832 1.00 34.31 N ATOM 1516 CA PRO B 127 11.688 -14.189 4.275 1.00 55.01 C ATOM 1517 C PRO B 127 12.762 -14.369 5.339 1.00 63.45 C ATOM 1518 O PRO B 127 12.517 -14.216 6.545 1.00 64.21 O ATOM 1519 CB PRO B 127 11.786 -12.786 3.687 1.00 61.52 C ATOM 1520 CG PRO B 127 10.955 -11.980 4.605 1.00 72.23 C ATOM 1521 CD PRO B 127 9.777 -12.854 4.921 1.00 22.42 C ATOM 0 HA PRO B 127 11.846 -14.998 3.562 1.00 55.01 H new ATOM 0 HB2 PRO B 127 12.816 -12.431 3.659 1.00 61.52 H new ATOM 0 HB3 PRO B 127 11.409 -12.750 2.665 1.00 61.52 H new ATOM 0 HG2 PRO B 127 11.505 -11.716 5.508 1.00 72.23 H new ATOM 0 HG3 PRO B 127 10.641 -11.046 4.138 1.00 72.23 H new ATOM 0 HD2 PRO B 127 9.375 -12.648 5.913 1.00 22.42 H new ATOM 0 HD3 PRO B 127 8.963 -12.709 4.211 1.00 22.42 H new ATOM 1846 N CYS C 209 -4.421 8.290 -13.224 1.00 73.33 N ATOM 1847 CA CYS C 209 -3.716 7.397 -12.327 1.00 72.44 C ATOM 1848 C CYS C 209 -4.428 7.512 -10.980 1.00 5.40 C ATOM 1849 O CYS C 209 -5.224 8.442 -10.803 1.00 14.25 O ATOM 1850 CB CYS C 209 -2.167 7.691 -12.261 1.00 45.13 C ATOM 1851 SG CYS C 209 -1.228 7.086 -13.741 1.00 4.33 S ATOM 0 HA CYS C 209 -3.750 6.368 -12.684 1.00 72.44 H new ATOM 0 HB2 CYS C 209 -2.014 8.765 -12.160 1.00 45.13 H new ATOM 0 HB3 CYS C 209 -1.756 7.225 -11.366 1.00 45.13 H new ATOM 1856 N PRO C 210 -4.229 6.598 -10.011 1.00 14.51 N ATOM 1857 CA PRO C 210 -5.019 6.627 -8.787 1.00 40.34 C ATOM 1858 C PRO C 210 -4.685 7.847 -7.936 1.00 33.34 C ATOM 1859 O PRO C 210 -5.447 8.248 -7.056 1.00 61.20 O ATOM 1860 CB PRO C 210 -4.677 5.297 -8.116 1.00 43.15 C ATOM 1861 CG PRO C 210 -3.332 4.947 -8.605 1.00 31.23 C ATOM 1862 CD PRO C 210 -3.219 5.516 -9.994 1.00 0.11 C ATOM 0 HA PRO C 210 -6.091 6.725 -8.958 1.00 40.34 H new ATOM 0 HB2 PRO C 210 -4.688 5.390 -7.030 1.00 43.15 H new ATOM 0 HB3 PRO C 210 -5.403 4.527 -8.377 1.00 43.15 H new ATOM 0 HG2 PRO C 210 -2.563 5.361 -7.953 1.00 31.23 H new ATOM 0 HG3 PRO C 210 -3.193 3.866 -8.616 1.00 31.23 H new ATOM 0 HD2 PRO C 210 -2.218 5.899 -10.190 1.00 0.11 H new ATOM 0 HD3 PRO C 210 -3.426 4.762 -10.754 1.00 0.11 H new ATOM 1870 N CYS C 211 -3.571 8.439 -8.245 1.00 3.42 N ATOM 1871 CA CYS C 211 -3.124 9.634 -7.628 1.00 34.41 C ATOM 1872 C CYS C 211 -3.461 10.822 -8.496 1.00 72.33 C ATOM 1873 O CYS C 211 -3.046 10.893 -9.636 1.00 2.42 O ATOM 1874 CB CYS C 211 -1.630 9.541 -7.417 1.00 41.15 C ATOM 1875 SG CYS C 211 -1.181 8.201 -6.264 1.00 54.35 S ATOM 0 H CYS C 211 -2.933 8.085 -8.958 1.00 3.42 H new ATOM 0 HA CYS C 211 -3.620 9.764 -6.666 1.00 34.41 H new ATOM 0 HB2 CYS C 211 -1.139 9.373 -8.376 1.00 41.15 H new ATOM 0 HB3 CYS C 211 -1.259 10.490 -7.031 1.00 41.15 H new ATOM 1880 N ARG C 212 -4.250 11.738 -7.971 1.00 22.24 N ATOM 1881 CA ARG C 212 -4.552 12.955 -8.699 1.00 32.15 C ATOM 1882 C ARG C 212 -3.340 13.850 -8.563 1.00 3.11 C ATOM 1883 O ARG C 212 -2.844 14.418 -9.528 1.00 53.13 O ATOM 1884 CB ARG C 212 -5.784 13.632 -8.099 1.00 23.24 C ATOM 1885 CG ARG C 212 -6.246 14.881 -8.831 1.00 21.23 C ATOM 1886 CD ARG C 212 -7.467 15.485 -8.154 1.00 75.43 C ATOM 1887 NE ARG C 212 -8.565 14.517 -8.061 1.00 3.21 N ATOM 1888 CZ ARG C 212 -9.674 14.661 -7.329 1.00 50.10 C ATOM 1889 NH1 ARG C 212 -9.903 15.782 -6.666 1.00 21.13 N ATOM 1890 NH2 ARG C 212 -10.560 13.676 -7.284 1.00 53.31 N ATOM 0 H ARG C 212 -4.690 11.665 -7.053 1.00 22.24 H new ATOM 0 HA ARG C 212 -4.769 12.747 -9.747 1.00 32.15 H new ATOM 0 HB2 ARG C 212 -6.604 12.914 -8.082 1.00 23.24 H new ATOM 0 HB3 ARG C 212 -5.569 13.894 -7.063 1.00 23.24 H new ATOM 0 HG2 ARG C 212 -5.439 15.613 -8.855 1.00 21.23 H new ATOM 0 HG3 ARG C 212 -6.483 14.634 -9.866 1.00 21.23 H new ATOM 0 HD2 ARG C 212 -7.198 15.828 -7.155 1.00 75.43 H new ATOM 0 HD3 ARG C 212 -7.799 16.360 -8.713 1.00 75.43 H new ATOM 0 HE ARG C 212 -8.474 13.658 -8.603 1.00 3.21 H new ATOM 0 HH11 ARG C 212 -9.230 16.547 -6.710 1.00 21.13 H new ATOM 0 HH12 ARG C 212 -10.753 15.881 -6.110 1.00 21.13 H new ATOM 0 HH21 ARG C 212 -10.393 12.816 -7.806 1.00 53.31 H new ATOM 0 HH22 ARG C 212 -11.409 13.778 -6.728 1.00 53.31 H new ATOM 1904 N PHE C 213 -2.908 13.963 -7.336 1.00 75.22 N ATOM 1905 CA PHE C 213 -1.698 14.635 -6.945 1.00 35.21 C ATOM 1906 C PHE C 213 -1.087 13.722 -5.912 1.00 71.40 C ATOM 1907 O PHE C 213 -1.807 12.867 -5.374 1.00 2.14 O ATOM 1908 CB PHE C 213 -1.997 15.987 -6.274 1.00 41.14 C ATOM 1909 CG PHE C 213 -2.906 16.898 -7.042 1.00 34.20 C ATOM 1910 CD1 PHE C 213 -2.525 17.430 -8.261 1.00 75.14 C ATOM 1911 CD2 PHE C 213 -4.146 17.235 -6.527 1.00 13.11 C ATOM 1912 CE1 PHE C 213 -3.365 18.276 -8.951 1.00 35.10 C ATOM 1913 CE2 PHE C 213 -4.988 18.077 -7.210 1.00 42.33 C ATOM 1914 CZ PHE C 213 -4.599 18.600 -8.422 1.00 12.10 C ATOM 0 H PHE C 213 -3.415 13.570 -6.543 1.00 75.22 H new ATOM 0 HA PHE C 213 -1.059 14.832 -7.806 1.00 35.21 H new ATOM 0 HB2 PHE C 213 -2.441 15.798 -5.297 1.00 41.14 H new ATOM 0 HB3 PHE C 213 -1.053 16.504 -6.101 1.00 41.14 H new ATOM 0 HD1 PHE C 213 -1.560 17.180 -8.676 1.00 75.14 H new ATOM 0 HD2 PHE C 213 -4.455 16.830 -5.575 1.00 13.11 H new ATOM 0 HE1 PHE C 213 -3.060 18.685 -9.903 1.00 35.10 H new ATOM 0 HE2 PHE C 213 -5.954 18.328 -6.797 1.00 42.33 H new ATOM 0 HZ PHE C 213 -5.259 19.264 -8.960 1.00 12.10 H new ATOM 1924 N PHE C 214 0.162 13.841 -5.624 1.00 33.33 N ATOM 1925 CA PHE C 214 0.710 13.038 -4.565 1.00 32.33 C ATOM 1926 C PHE C 214 1.086 13.951 -3.412 1.00 24.42 C ATOM 1927 O PHE C 214 1.701 14.994 -3.600 1.00 45.24 O ATOM 1928 CB PHE C 214 1.887 12.148 -5.025 1.00 30.32 C ATOM 1929 CG PHE C 214 3.112 12.881 -5.460 1.00 55.53 C ATOM 1930 CD1 PHE C 214 4.057 13.245 -4.527 1.00 35.34 C ATOM 1931 CD2 PHE C 214 3.323 13.198 -6.791 1.00 24.03 C ATOM 1932 CE1 PHE C 214 5.201 13.921 -4.907 1.00 73.22 C ATOM 1933 CE2 PHE C 214 4.465 13.874 -7.181 1.00 1.01 C ATOM 1934 CZ PHE C 214 5.405 14.235 -6.236 1.00 72.34 C ATOM 0 H PHE C 214 0.818 14.469 -6.089 1.00 33.33 H new ATOM 0 HA PHE C 214 -0.050 12.331 -4.233 1.00 32.33 H new ATOM 0 HB2 PHE C 214 2.156 11.479 -4.207 1.00 30.32 H new ATOM 0 HB3 PHE C 214 1.546 11.522 -5.850 1.00 30.32 H new ATOM 0 HD1 PHE C 214 3.903 13.000 -3.487 1.00 35.34 H new ATOM 0 HD2 PHE C 214 2.589 12.915 -7.531 1.00 24.03 H new ATOM 0 HE1 PHE C 214 5.934 14.203 -4.166 1.00 73.22 H new ATOM 0 HE2 PHE C 214 4.621 14.119 -8.221 1.00 1.01 H new ATOM 0 HZ PHE C 214 6.299 14.762 -6.536 1.00 72.34 H new ATOM 1944 N GLU C 215 0.701 13.594 -2.249 1.00 21.23 N ATOM 1945 CA GLU C 215 0.936 14.423 -1.130 1.00 35.14 C ATOM 1946 C GLU C 215 2.290 14.083 -0.525 1.00 72.43 C ATOM 1947 O GLU C 215 2.506 12.972 -0.026 1.00 23.02 O ATOM 1948 CB GLU C 215 -0.176 14.273 -0.102 1.00 55.03 C ATOM 1949 CG GLU C 215 -1.622 14.365 -0.654 1.00 70.24 C ATOM 1950 CD GLU C 215 -1.991 15.614 -1.460 1.00 43.10 C ATOM 1951 OE1 GLU C 215 -1.516 15.752 -2.591 1.00 35.20 O ATOM 1952 OE2 GLU C 215 -2.816 16.437 -0.985 1.00 1.53 O ATOM 0 H GLU C 215 0.215 12.721 -2.043 1.00 21.23 H new ATOM 0 HA GLU C 215 0.944 15.464 -1.452 1.00 35.14 H new ATOM 0 HB2 GLU C 215 -0.058 13.310 0.396 1.00 55.03 H new ATOM 0 HB3 GLU C 215 -0.048 15.043 0.659 1.00 55.03 H new ATOM 0 HG2 GLU C 215 -1.798 13.493 -1.284 1.00 70.24 H new ATOM 0 HG3 GLU C 215 -2.309 14.293 0.189 1.00 70.24 H new ATOM 1959 N SER C 216 3.187 15.037 -0.578 1.00 21.24 N ATOM 1960 CA SER C 216 4.552 14.857 -0.141 1.00 13.14 C ATOM 1961 C SER C 216 4.735 14.968 1.383 1.00 4.41 C ATOM 1962 O SER C 216 5.827 14.824 1.878 1.00 44.42 O ATOM 1963 CB SER C 216 5.408 15.836 -0.862 1.00 42.10 C ATOM 1964 OG SER C 216 5.200 15.716 -2.250 1.00 65.23 O ATOM 0 H SER C 216 2.988 15.973 -0.930 1.00 21.24 H new ATOM 0 HA SER C 216 4.851 13.837 -0.383 1.00 13.14 H new ATOM 0 HB2 SER C 216 5.173 16.849 -0.535 1.00 42.10 H new ATOM 0 HB3 SER C 216 6.457 15.660 -0.625 1.00 42.10 H new ATOM 0 HG SER C 216 5.000 14.782 -2.471 1.00 65.23 H new ATOM 1970 N HIS C 217 3.661 15.277 2.090 1.00 43.32 N ATOM 1971 CA HIS C 217 3.617 15.201 3.556 1.00 60.44 C ATOM 1972 C HIS C 217 2.241 15.373 4.100 1.00 63.30 C ATOM 1973 O HIS C 217 1.711 16.473 4.185 1.00 14.44 O ATOM 1974 CB HIS C 217 4.681 15.987 4.380 1.00 52.34 C ATOM 1975 CG HIS C 217 4.780 17.439 4.159 1.00 52.41 C ATOM 1976 ND1 HIS C 217 4.030 18.381 4.833 1.00 73.11 N ATOM 1977 CD2 HIS C 217 5.591 18.105 3.368 1.00 52.40 C ATOM 1978 CE1 HIS C 217 4.402 19.578 4.448 1.00 64.35 C ATOM 1979 NE2 HIS C 217 5.353 19.436 3.557 1.00 64.33 N ATOM 0 H HIS C 217 2.786 15.590 1.669 1.00 43.32 H new ATOM 0 HA HIS C 217 3.940 14.172 3.716 1.00 60.44 H new ATOM 0 HB2 HIS C 217 4.476 15.822 5.438 1.00 52.34 H new ATOM 0 HB3 HIS C 217 5.657 15.549 4.173 1.00 52.34 H new ATOM 0 HD2 HIS C 217 6.315 17.677 2.691 1.00 52.40 H new ATOM 0 HE1 HIS C 217 3.997 20.514 4.802 1.00 64.35 H new ATOM 0 HE2 HIS C 217 5.837 20.197 3.081 1.00 64.33 H new ATOM 1988 N VAL C 218 1.672 14.268 4.415 1.00 64.11 N ATOM 1989 CA VAL C 218 0.382 14.150 5.019 1.00 63.11 C ATOM 1990 C VAL C 218 0.570 13.527 6.380 1.00 44.00 C ATOM 1991 O VAL C 218 1.547 12.797 6.594 1.00 63.55 O ATOM 1992 CB VAL C 218 -0.560 13.330 4.093 1.00 52.21 C ATOM 1993 CG1 VAL C 218 -1.688 12.631 4.843 1.00 25.55 C ATOM 1994 CG2 VAL C 218 -1.185 14.272 3.114 1.00 75.12 C ATOM 0 H VAL C 218 2.115 13.364 4.251 1.00 64.11 H new ATOM 0 HA VAL C 218 -0.095 15.121 5.150 1.00 63.11 H new ATOM 0 HB VAL C 218 0.048 12.561 3.616 1.00 52.21 H new ATOM 0 HG11 VAL C 218 -2.307 12.078 4.136 1.00 25.55 H new ATOM 0 HG12 VAL C 218 -1.266 11.941 5.574 1.00 25.55 H new ATOM 0 HG13 VAL C 218 -2.299 13.374 5.356 1.00 25.55 H new ATOM 0 HG21 VAL C 218 -1.852 13.719 2.452 1.00 75.12 H new ATOM 0 HG22 VAL C 218 -1.754 15.030 3.651 1.00 75.12 H new ATOM 0 HG23 VAL C 218 -0.405 14.754 2.524 1.00 75.12 H new ATOM 2004 N ALA C 219 -0.323 13.815 7.288 1.00 11.15 N ATOM 2005 CA ALA C 219 -0.166 13.385 8.647 1.00 14.30 C ATOM 2006 C ALA C 219 -0.450 11.907 8.810 1.00 22.32 C ATOM 2007 O ALA C 219 -1.544 11.427 8.514 1.00 50.25 O ATOM 2008 CB ALA C 219 -1.014 14.219 9.590 1.00 41.04 C ATOM 0 H ALA C 219 -1.172 14.350 7.107 1.00 11.15 H new ATOM 0 HA ALA C 219 0.879 13.540 8.914 1.00 14.30 H new ATOM 0 HB1 ALA C 219 -0.873 13.868 10.612 1.00 41.04 H new ATOM 0 HB2 ALA C 219 -0.714 15.265 9.520 1.00 41.04 H new ATOM 0 HB3 ALA C 219 -2.065 14.124 9.315 1.00 41.04 H new ATOM 2014 N ARG C 220 0.544 11.211 9.303 1.00 63.34 N ATOM 2015 CA ARG C 220 0.489 9.786 9.567 1.00 11.14 C ATOM 2016 C ARG C 220 -0.478 9.507 10.737 1.00 41.01 C ATOM 2017 O ARG C 220 -0.969 8.411 10.905 1.00 15.25 O ATOM 2018 CB ARG C 220 1.955 9.287 9.786 1.00 21.44 C ATOM 2019 CG ARG C 220 2.202 7.814 10.172 1.00 0.31 C ATOM 2020 CD ARG C 220 1.893 7.519 11.621 1.00 74.02 C ATOM 2021 NE ARG C 220 2.689 8.341 12.551 1.00 3.11 N ATOM 2022 CZ ARG C 220 2.439 8.470 13.867 1.00 51.02 C ATOM 2023 NH1 ARG C 220 1.427 7.811 14.427 1.00 13.00 N ATOM 2024 NH2 ARG C 220 3.210 9.239 14.617 1.00 63.42 N ATOM 0 H ARG C 220 1.444 11.629 9.541 1.00 63.34 H new ATOM 0 HA ARG C 220 0.081 9.221 8.729 1.00 11.14 H new ATOM 0 HB2 ARG C 220 2.508 9.482 8.867 1.00 21.44 H new ATOM 0 HB3 ARG C 220 2.400 9.908 10.563 1.00 21.44 H new ATOM 0 HG2 ARG C 220 1.590 7.172 9.539 1.00 0.31 H new ATOM 0 HG3 ARG C 220 3.243 7.562 9.971 1.00 0.31 H new ATOM 0 HD2 ARG C 220 0.833 7.693 11.805 1.00 74.02 H new ATOM 0 HD3 ARG C 220 2.082 6.464 11.821 1.00 74.02 H new ATOM 0 HE ARG C 220 3.487 8.849 12.169 1.00 3.11 H new ATOM 0 HH11 ARG C 220 0.836 7.204 13.858 1.00 13.00 H new ATOM 0 HH12 ARG C 220 1.242 7.913 15.425 1.00 13.00 H new ATOM 0 HH21 ARG C 220 3.996 9.736 14.198 1.00 63.42 H new ATOM 0 HH22 ARG C 220 3.019 9.335 15.614 1.00 63.42 H new ATOM 2038 N ALA C 221 -0.729 10.523 11.524 1.00 22.43 N ATOM 2039 CA ALA C 221 -1.706 10.467 12.597 1.00 23.31 C ATOM 2040 C ALA C 221 -3.150 10.737 12.086 1.00 63.34 C ATOM 2041 O ALA C 221 -4.119 10.572 12.829 1.00 44.20 O ATOM 2042 CB ALA C 221 -1.337 11.454 13.696 1.00 23.15 C ATOM 0 H ALA C 221 -0.259 11.424 11.442 1.00 22.43 H new ATOM 0 HA ALA C 221 -1.690 9.456 13.003 1.00 23.31 H new ATOM 0 HB1 ALA C 221 -2.077 11.403 14.495 1.00 23.15 H new ATOM 0 HB2 ALA C 221 -0.354 11.203 14.095 1.00 23.15 H new ATOM 0 HB3 ALA C 221 -1.315 12.464 13.286 1.00 23.15 H new ATOM 2048 N ASN C 222 -3.283 11.175 10.837 1.00 0.44 N ATOM 2049 CA ASN C 222 -4.595 11.614 10.300 1.00 52.30 C ATOM 2050 C ASN C 222 -5.077 10.671 9.174 1.00 72.25 C ATOM 2051 O ASN C 222 -5.975 10.995 8.402 1.00 32.13 O ATOM 2052 CB ASN C 222 -4.450 13.056 9.765 1.00 70.41 C ATOM 2053 CG ASN C 222 -5.766 13.726 9.376 1.00 74.45 C ATOM 2054 OD1 ASN C 222 -6.826 13.448 9.953 1.00 60.33 O ATOM 2055 ND2 ASN C 222 -5.708 14.602 8.402 1.00 65.32 N ATOM 0 H ASN C 222 -2.513 11.240 10.172 1.00 0.44 H new ATOM 0 HA ASN C 222 -5.339 11.583 11.096 1.00 52.30 H new ATOM 0 HB2 ASN C 222 -3.959 13.664 10.525 1.00 70.41 H new ATOM 0 HB3 ASN C 222 -3.794 13.042 8.895 1.00 70.41 H new ATOM 0 HD21 ASN C 222 -6.555 15.081 8.096 1.00 65.32 H new ATOM 0 HD22 ASN C 222 -4.816 14.805 7.951 1.00 65.32 H new ATOM 2062 N VAL C 223 -4.519 9.502 9.132 1.00 43.34 N ATOM 2063 CA VAL C 223 -4.819 8.529 8.088 1.00 51.03 C ATOM 2064 C VAL C 223 -5.464 7.255 8.679 1.00 53.34 C ATOM 2065 O VAL C 223 -5.245 6.938 9.835 1.00 61.44 O ATOM 2066 CB VAL C 223 -3.516 8.188 7.286 1.00 42.04 C ATOM 2067 CG1 VAL C 223 -2.386 7.923 8.237 1.00 31.15 C ATOM 2068 CG2 VAL C 223 -3.701 6.981 6.398 1.00 64.43 C ATOM 0 H VAL C 223 -3.836 9.178 9.817 1.00 43.34 H new ATOM 0 HA VAL C 223 -5.544 8.967 7.402 1.00 51.03 H new ATOM 0 HB VAL C 223 -3.289 9.047 6.655 1.00 42.04 H new ATOM 0 HG11 VAL C 223 -1.484 7.687 7.673 1.00 31.15 H new ATOM 0 HG12 VAL C 223 -2.210 8.808 8.849 1.00 31.15 H new ATOM 0 HG13 VAL C 223 -2.642 7.082 8.881 1.00 31.15 H new ATOM 0 HG21 VAL C 223 -2.775 6.779 5.860 1.00 64.43 H new ATOM 0 HG22 VAL C 223 -3.962 6.117 7.009 1.00 64.43 H new ATOM 0 HG23 VAL C 223 -4.501 7.174 5.683 1.00 64.43 H new ATOM 2078 N LYS C 224 -6.309 6.567 7.888 1.00 42.32 N ATOM 2079 CA LYS C 224 -6.904 5.303 8.329 1.00 1.02 C ATOM 2080 C LYS C 224 -6.157 4.079 7.771 1.00 43.12 C ATOM 2081 O LYS C 224 -6.031 3.069 8.447 1.00 42.04 O ATOM 2082 CB LYS C 224 -8.392 5.217 7.954 1.00 10.43 C ATOM 2083 CG LYS C 224 -9.229 6.317 8.575 1.00 31.42 C ATOM 2084 CD LYS C 224 -10.725 6.139 8.326 1.00 72.25 C ATOM 2085 CE LYS C 224 -11.095 6.192 6.853 1.00 51.45 C ATOM 2086 NZ LYS C 224 -12.554 6.005 6.659 1.00 72.21 N ATOM 0 H LYS C 224 -6.589 6.865 6.953 1.00 42.32 H new ATOM 0 HA LYS C 224 -6.812 5.289 9.415 1.00 1.02 H new ATOM 0 HB2 LYS C 224 -8.490 5.263 6.869 1.00 10.43 H new ATOM 0 HB3 LYS C 224 -8.784 4.250 8.268 1.00 10.43 H new ATOM 0 HG2 LYS C 224 -9.045 6.344 9.649 1.00 31.42 H new ATOM 0 HG3 LYS C 224 -8.911 7.279 8.173 1.00 31.42 H new ATOM 0 HD2 LYS C 224 -11.045 5.183 8.741 1.00 72.25 H new ATOM 0 HD3 LYS C 224 -11.271 6.917 8.860 1.00 72.25 H new ATOM 0 HE2 LYS C 224 -10.790 7.150 6.433 1.00 51.45 H new ATOM 0 HE3 LYS C 224 -10.551 5.418 6.311 1.00 51.45 H new ATOM 0 HZ1 LYS C 224 -12.777 6.046 5.644 1.00 72.21 H new ATOM 0 HZ2 LYS C 224 -12.839 5.080 7.039 1.00 72.21 H new ATOM 0 HZ3 LYS C 224 -13.070 6.758 7.158 1.00 72.21 H new ATOM 2100 N HIS C 225 -5.687 4.180 6.518 1.00 51.21 N ATOM 2101 CA HIS C 225 -4.962 3.067 5.823 1.00 0.22 C ATOM 2102 C HIS C 225 -4.504 3.462 4.432 1.00 2.12 C ATOM 2103 O HIS C 225 -4.966 4.481 3.896 1.00 14.24 O ATOM 2104 CB HIS C 225 -5.782 1.750 5.750 1.00 60.32 C ATOM 2105 CG HIS C 225 -7.192 1.873 5.223 1.00 1.54 C ATOM 2106 ND1 HIS C 225 -7.595 2.829 4.313 1.00 54.35 N ATOM 2107 CD2 HIS C 225 -8.310 1.182 5.543 1.00 72.42 C ATOM 2108 CE1 HIS C 225 -8.894 2.717 4.114 1.00 24.54 C ATOM 2109 NE2 HIS C 225 -9.344 1.733 4.843 1.00 2.21 N ATOM 0 H HIS C 225 -5.789 5.021 5.949 1.00 51.21 H new ATOM 0 HA HIS C 225 -4.085 2.876 6.441 1.00 0.22 H new ATOM 0 HB2 HIS C 225 -5.241 1.044 5.120 1.00 60.32 H new ATOM 0 HB3 HIS C 225 -5.826 1.317 6.750 1.00 60.32 H new ATOM 0 HD2 HIS C 225 -8.373 0.348 6.226 1.00 72.42 H new ATOM 0 HE1 HIS C 225 -9.486 3.337 3.457 1.00 24.54 H new ATOM 0 HE2 HIS C 225 -10.315 1.424 4.883 1.00 2.21 H new ATOM 2118 N LEU C 226 -3.675 2.606 3.821 1.00 5.34 N ATOM 2119 CA LEU C 226 -3.092 2.872 2.491 1.00 12.43 C ATOM 2120 C LEU C 226 -3.583 1.871 1.463 1.00 40.51 C ATOM 2121 O LEU C 226 -3.908 0.734 1.791 1.00 55.15 O ATOM 2122 CB LEU C 226 -1.527 2.776 2.506 1.00 4.22 C ATOM 2123 CG LEU C 226 -0.682 3.968 3.029 1.00 62.43 C ATOM 2124 CD1 LEU C 226 -1.030 4.336 4.425 1.00 33.33 C ATOM 2125 CD2 LEU C 226 0.810 3.627 2.950 1.00 40.20 C ATOM 0 H LEU C 226 -3.389 1.715 4.227 1.00 5.34 H new ATOM 0 HA LEU C 226 -3.405 3.883 2.230 1.00 12.43 H new ATOM 0 HB2 LEU C 226 -1.261 1.904 3.103 1.00 4.22 H new ATOM 0 HB3 LEU C 226 -1.205 2.573 1.485 1.00 4.22 H new ATOM 0 HG LEU C 226 -0.907 4.824 2.393 1.00 62.43 H new ATOM 0 HD11 LEU C 226 -0.412 5.175 4.745 1.00 33.33 H new ATOM 0 HD12 LEU C 226 -2.081 4.620 4.475 1.00 33.33 H new ATOM 0 HD13 LEU C 226 -0.853 3.484 5.081 1.00 33.33 H new ATOM 0 HD21 LEU C 226 1.396 4.469 3.319 1.00 40.20 H new ATOM 0 HD22 LEU C 226 1.015 2.747 3.560 1.00 40.20 H new ATOM 0 HD23 LEU C 226 1.082 3.422 1.915 1.00 40.20 H new ATOM 2137 N LYS C 227 -3.658 2.326 0.245 1.00 50.21 N ATOM 2138 CA LYS C 227 -3.961 1.522 -0.911 1.00 73.04 C ATOM 2139 C LYS C 227 -2.767 1.621 -1.802 1.00 52.11 C ATOM 2140 O LYS C 227 -2.421 2.722 -2.223 1.00 54.41 O ATOM 2141 CB LYS C 227 -5.148 2.112 -1.715 1.00 10.34 C ATOM 2142 CG LYS C 227 -5.532 1.299 -2.965 1.00 11.52 C ATOM 2143 CD LYS C 227 -6.329 0.058 -2.615 1.00 54.35 C ATOM 2144 CE LYS C 227 -7.825 0.371 -2.463 1.00 71.01 C ATOM 2145 NZ LYS C 227 -8.128 1.429 -1.471 1.00 10.42 N ATOM 0 H LYS C 227 -3.504 3.308 0.018 1.00 50.21 H new ATOM 0 HA LYS C 227 -4.208 0.508 -0.596 1.00 73.04 H new ATOM 0 HB2 LYS C 227 -6.017 2.182 -1.060 1.00 10.34 H new ATOM 0 HB3 LYS C 227 -4.896 3.128 -2.020 1.00 10.34 H new ATOM 0 HG2 LYS C 227 -6.115 1.926 -3.640 1.00 11.52 H new ATOM 0 HG3 LYS C 227 -4.628 1.010 -3.501 1.00 11.52 H new ATOM 0 HD2 LYS C 227 -6.191 -0.695 -3.391 1.00 54.35 H new ATOM 0 HD3 LYS C 227 -5.950 -0.369 -1.686 1.00 54.35 H new ATOM 0 HE2 LYS C 227 -8.221 0.674 -3.432 1.00 71.01 H new ATOM 0 HE3 LYS C 227 -8.348 -0.541 -2.175 1.00 71.01 H new ATOM 0 HZ1 LYS C 227 -9.147 1.430 -1.265 1.00 10.42 H new ATOM 0 HZ2 LYS C 227 -7.598 1.246 -0.595 1.00 10.42 H new ATOM 0 HZ3 LYS C 227 -7.852 2.355 -1.856 1.00 10.42 H new ATOM 2159 N ILE C 228 -2.127 0.543 -2.085 1.00 52.14 N ATOM 2160 CA ILE C 228 -1.051 0.612 -3.009 1.00 13.13 C ATOM 2161 C ILE C 228 -1.546 0.001 -4.279 1.00 75.02 C ATOM 2162 O ILE C 228 -2.196 -1.059 -4.244 1.00 31.24 O ATOM 2163 CB ILE C 228 0.233 -0.131 -2.551 1.00 72.41 C ATOM 2164 CG1 ILE C 228 0.637 0.288 -1.141 1.00 5.02 C ATOM 2165 CG2 ILE C 228 1.384 0.188 -3.515 1.00 22.40 C ATOM 2166 CD1 ILE C 228 1.932 -0.350 -0.677 1.00 65.05 C ATOM 0 H ILE C 228 -2.323 -0.381 -1.699 1.00 52.14 H new ATOM 0 HA ILE C 228 -0.759 1.657 -3.116 1.00 13.13 H new ATOM 0 HB ILE C 228 0.024 -1.201 -2.552 1.00 72.41 H new ATOM 0 HG12 ILE C 228 0.741 1.372 -1.107 1.00 5.02 H new ATOM 0 HG13 ILE C 228 -0.161 0.022 -0.447 1.00 5.02 H new ATOM 0 HG21 ILE C 228 2.285 -0.334 -3.192 1.00 22.40 H new ATOM 0 HG22 ILE C 228 1.117 -0.137 -4.521 1.00 22.40 H new ATOM 0 HG23 ILE C 228 1.569 1.262 -3.518 1.00 22.40 H new ATOM 0 HD11 ILE C 228 2.163 -0.011 0.333 1.00 65.05 H new ATOM 0 HD12 ILE C 228 1.825 -1.435 -0.680 1.00 65.05 H new ATOM 0 HD13 ILE C 228 2.740 -0.063 -1.350 1.00 65.05 H new ATOM 2178 N LEU C 229 -1.319 0.672 -5.365 1.00 73.23 N ATOM 2179 CA LEU C 229 -1.697 0.181 -6.651 1.00 24.44 C ATOM 2180 C LEU C 229 -0.677 0.693 -7.637 1.00 24.32 C ATOM 2181 O LEU C 229 -0.606 1.883 -7.902 1.00 50.01 O ATOM 2182 CB LEU C 229 -3.157 0.630 -6.987 1.00 4.21 C ATOM 2183 CG LEU C 229 -3.846 0.007 -8.221 1.00 70.13 C ATOM 2184 CD1 LEU C 229 -5.317 0.320 -8.158 1.00 54.41 C ATOM 2185 CD2 LEU C 229 -3.290 0.564 -9.523 1.00 63.23 C ATOM 0 H LEU C 229 -0.862 1.584 -5.383 1.00 73.23 H new ATOM 0 HA LEU C 229 -1.706 -0.908 -6.687 1.00 24.44 H new ATOM 0 HB2 LEU C 229 -3.779 0.420 -6.117 1.00 4.21 H new ATOM 0 HB3 LEU C 229 -3.150 1.712 -7.120 1.00 4.21 H new ATOM 0 HG LEU C 229 -3.664 -1.068 -8.205 1.00 70.13 H new ATOM 0 HD11 LEU C 229 -5.819 -0.113 -9.023 1.00 54.41 H new ATOM 0 HD12 LEU C 229 -5.740 -0.100 -7.245 1.00 54.41 H new ATOM 0 HD13 LEU C 229 -5.459 1.401 -8.160 1.00 54.41 H new ATOM 0 HD21 LEU C 229 -3.802 0.099 -10.366 1.00 63.23 H new ATOM 0 HD22 LEU C 229 -3.446 1.642 -9.553 1.00 63.23 H new ATOM 0 HD23 LEU C 229 -2.223 0.350 -9.584 1.00 63.23 H new ATOM 2197 N ASN C 230 0.144 -0.189 -8.133 1.00 13.31 N ATOM 2198 CA ASN C 230 1.193 0.206 -9.049 1.00 35.34 C ATOM 2199 C ASN C 230 0.633 0.304 -10.449 1.00 75.43 C ATOM 2200 O ASN C 230 -0.122 -0.557 -10.885 1.00 14.03 O ATOM 2201 CB ASN C 230 2.375 -0.791 -9.003 1.00 10.35 C ATOM 2202 CG ASN C 230 3.561 -0.415 -9.914 1.00 10.40 C ATOM 2203 OD1 ASN C 230 4.255 -1.295 -10.436 1.00 63.12 O ATOM 2204 ND2 ASN C 230 3.834 0.876 -10.073 1.00 31.34 N ATOM 0 H ASN C 230 0.113 -1.187 -7.923 1.00 13.31 H new ATOM 0 HA ASN C 230 1.572 1.182 -8.747 1.00 35.34 H new ATOM 0 HB2 ASN C 230 2.731 -0.866 -7.976 1.00 10.35 H new ATOM 0 HB3 ASN C 230 2.013 -1.779 -9.288 1.00 10.35 H new ATOM 0 HD21 ASN C 230 4.634 1.162 -10.638 1.00 31.34 H new ATOM 0 HD22 ASN C 230 3.244 1.580 -9.630 1.00 31.34 H new ATOM 2211 N THR C 231 0.969 1.371 -11.114 1.00 2.40 N ATOM 2212 CA THR C 231 0.555 1.610 -12.463 1.00 2.24 C ATOM 2213 C THR C 231 1.778 1.560 -13.385 1.00 22.21 C ATOM 2214 O THR C 231 2.904 1.719 -12.914 1.00 52.34 O ATOM 2215 CB THR C 231 -0.102 2.990 -12.544 1.00 2.11 C ATOM 2216 OG1 THR C 231 0.790 3.961 -11.981 1.00 63.43 O ATOM 2217 CG2 THR C 231 -1.412 3.009 -11.780 1.00 2.34 C ATOM 0 H THR C 231 1.550 2.113 -10.724 1.00 2.40 H new ATOM 0 HA THR C 231 -0.159 0.848 -12.776 1.00 2.24 H new ATOM 0 HB THR C 231 -0.308 3.223 -13.589 1.00 2.11 H new ATOM 0 HG1 THR C 231 1.704 3.781 -12.286 1.00 63.43 H new ATOM 0 HG21 THR C 231 -1.861 4.000 -11.852 1.00 2.34 H new ATOM 0 HG22 THR C 231 -2.092 2.271 -12.205 1.00 2.34 H new ATOM 0 HG23 THR C 231 -1.226 2.770 -10.733 1.00 2.34 H new ATOM 2225 N PRO C 232 1.589 1.331 -14.688 1.00 1.25 N ATOM 2226 CA PRO C 232 2.703 1.266 -15.640 1.00 62.12 C ATOM 2227 C PRO C 232 3.376 2.633 -15.916 1.00 51.45 C ATOM 2228 O PRO C 232 4.596 2.735 -15.931 1.00 65.23 O ATOM 2229 CB PRO C 232 2.045 0.732 -16.915 1.00 65.14 C ATOM 2230 CG PRO C 232 0.618 1.136 -16.795 1.00 14.43 C ATOM 2231 CD PRO C 232 0.289 1.059 -15.336 1.00 63.25 C ATOM 0 HA PRO C 232 3.512 0.646 -15.252 1.00 62.12 H new ATOM 0 HB2 PRO C 232 2.504 1.158 -17.807 1.00 65.14 H new ATOM 0 HB3 PRO C 232 2.146 -0.351 -16.990 1.00 65.14 H new ATOM 0 HG2 PRO C 232 0.465 2.145 -17.177 1.00 14.43 H new ATOM 0 HG3 PRO C 232 -0.025 0.474 -17.376 1.00 14.43 H new ATOM 0 HD2 PRO C 232 -0.465 1.794 -15.053 1.00 63.25 H new ATOM 0 HD3 PRO C 232 -0.102 0.079 -15.061 1.00 63.25 H new ATOM 2239 N ASN C 233 2.580 3.675 -16.124 1.00 72.05 N ATOM 2240 CA ASN C 233 3.138 4.986 -16.515 1.00 10.15 C ATOM 2241 C ASN C 233 3.247 5.970 -15.359 1.00 11.15 C ATOM 2242 O ASN C 233 3.725 7.086 -15.521 1.00 44.02 O ATOM 2243 CB ASN C 233 2.374 5.591 -17.700 1.00 31.03 C ATOM 2244 CG ASN C 233 2.511 4.768 -18.989 1.00 4.11 C ATOM 2245 OD1 ASN C 233 3.671 4.195 -19.221 1.00 2.13 O flip ATOM 2246 ND2 ASN C 233 1.577 4.691 -19.793 1.00 13.24 N flip ATOM 0 H ASN C 233 1.564 3.651 -16.034 1.00 72.05 H new ATOM 0 HA ASN C 233 4.161 4.791 -16.835 1.00 10.15 H new ATOM 0 HB2 ASN C 233 1.319 5.674 -17.440 1.00 31.03 H new ATOM 0 HB3 ASN C 233 2.738 6.602 -17.881 1.00 31.03 H new ATOM 0 HD21 ASN C 233 0.688 5.146 -19.587 1.00 13.24 H new ATOM 0 HD22 ASN C 233 1.695 4.173 -20.663 1.00 13.24 H new ATOM 2253 N CYS C 234 2.840 5.556 -14.211 1.00 23.42 N ATOM 2254 CA CYS C 234 2.980 6.358 -13.017 1.00 71.24 C ATOM 2255 C CYS C 234 3.725 5.497 -12.019 1.00 5.25 C ATOM 2256 O CYS C 234 3.629 4.266 -12.099 1.00 62.25 O ATOM 2257 CB CYS C 234 1.594 6.827 -12.470 1.00 63.43 C ATOM 2258 SG CYS C 234 0.636 7.922 -13.610 1.00 61.11 S ATOM 0 H CYS C 234 2.397 4.650 -14.058 1.00 23.42 H new ATOM 0 HA CYS C 234 3.529 7.277 -13.221 1.00 71.24 H new ATOM 0 HB2 CYS C 234 0.992 5.947 -12.245 1.00 63.43 H new ATOM 0 HB3 CYS C 234 1.751 7.355 -11.529 1.00 63.43 H new ATOM 2263 N ALA C 235 4.493 6.105 -11.121 1.00 61.35 N ATOM 2264 CA ALA C 235 5.334 5.360 -10.163 1.00 55.13 C ATOM 2265 C ALA C 235 4.490 4.569 -9.155 1.00 34.42 C ATOM 2266 O ALA C 235 3.307 4.303 -9.381 1.00 54.44 O ATOM 2267 CB ALA C 235 6.265 6.331 -9.436 1.00 32.15 C ATOM 0 H ALA C 235 4.557 7.119 -11.029 1.00 61.35 H new ATOM 0 HA ALA C 235 5.926 4.637 -10.724 1.00 55.13 H new ATOM 0 HB1 ALA C 235 6.885 5.780 -8.729 1.00 32.15 H new ATOM 0 HB2 ALA C 235 6.903 6.836 -10.162 1.00 32.15 H new ATOM 0 HB3 ALA C 235 5.672 7.070 -8.898 1.00 32.15 H new ATOM 2273 N CYS C 236 5.103 4.151 -8.067 1.00 73.30 N ATOM 2274 CA CYS C 236 4.366 3.463 -7.029 1.00 74.14 C ATOM 2275 C CYS C 236 3.300 4.427 -6.505 1.00 32.14 C ATOM 2276 O CYS C 236 3.608 5.530 -6.104 1.00 12.03 O ATOM 2277 CB CYS C 236 5.308 3.007 -5.901 1.00 12.04 C ATOM 2278 SG CYS C 236 4.505 1.982 -4.622 1.00 2.04 S ATOM 0 H CYS C 236 6.098 4.274 -7.880 1.00 73.30 H new ATOM 0 HA CYS C 236 3.894 2.564 -7.427 1.00 74.14 H new ATOM 0 HB2 CYS C 236 6.132 2.443 -6.337 1.00 12.04 H new ATOM 0 HB3 CYS C 236 5.740 3.888 -5.426 1.00 12.04 H new ATOM 2283 N GLN C 237 2.067 4.030 -6.586 1.00 22.31 N ATOM 2284 CA GLN C 237 0.968 4.888 -6.219 1.00 71.11 C ATOM 2285 C GLN C 237 0.415 4.437 -4.899 1.00 51.14 C ATOM 2286 O GLN C 237 0.031 3.264 -4.746 1.00 15.42 O ATOM 2287 CB GLN C 237 -0.136 4.800 -7.267 1.00 72.23 C ATOM 2288 CG GLN C 237 0.283 5.112 -8.705 1.00 11.45 C ATOM 2289 CD GLN C 237 0.663 6.556 -8.939 1.00 73.15 C ATOM 2290 OE1 GLN C 237 -0.181 7.378 -9.285 1.00 3.24 O ATOM 2291 NE2 GLN C 237 1.920 6.866 -8.775 1.00 61.41 N ATOM 0 H GLN C 237 1.788 3.103 -6.908 1.00 22.31 H new ATOM 0 HA GLN C 237 1.324 5.916 -6.152 1.00 71.11 H new ATOM 0 HB2 GLN C 237 -0.556 3.794 -7.241 1.00 72.23 H new ATOM 0 HB3 GLN C 237 -0.934 5.486 -6.984 1.00 72.23 H new ATOM 0 HG2 GLN C 237 1.128 4.478 -8.971 1.00 11.45 H new ATOM 0 HG3 GLN C 237 -0.536 4.850 -9.375 1.00 11.45 H new ATOM 0 HE21 GLN C 237 2.588 6.151 -8.486 1.00 61.41 H new ATOM 0 HE22 GLN C 237 2.234 7.823 -8.935 1.00 61.41 H new ATOM 2300 N ILE C 238 0.384 5.330 -3.955 1.00 12.22 N ATOM 2301 CA ILE C 238 -0.143 5.037 -2.658 1.00 24.34 C ATOM 2302 C ILE C 238 -1.254 5.999 -2.326 1.00 12.20 C ATOM 2303 O ILE C 238 -1.044 7.181 -2.257 1.00 42.43 O ATOM 2304 CB ILE C 238 0.949 5.070 -1.553 1.00 2.41 C ATOM 2305 CG1 ILE C 238 1.981 3.957 -1.811 1.00 74.21 C ATOM 2306 CG2 ILE C 238 0.322 4.933 -0.179 1.00 11.12 C ATOM 2307 CD1 ILE C 238 3.027 3.797 -0.731 1.00 60.53 C ATOM 0 H ILE C 238 0.725 6.285 -4.064 1.00 12.22 H new ATOM 0 HA ILE C 238 -0.535 4.021 -2.687 1.00 24.34 H new ATOM 0 HB ILE C 238 1.462 6.031 -1.584 1.00 2.41 H new ATOM 0 HG12 ILE C 238 1.452 3.011 -1.928 1.00 74.21 H new ATOM 0 HG13 ILE C 238 2.484 4.160 -2.757 1.00 74.21 H new ATOM 0 HG21 ILE C 238 1.103 4.958 0.581 1.00 11.12 H new ATOM 0 HG22 ILE C 238 -0.373 5.756 -0.013 1.00 11.12 H new ATOM 0 HG23 ILE C 238 -0.215 3.986 -0.117 1.00 11.12 H new ATOM 0 HD11 ILE C 238 3.708 2.990 -1.001 1.00 60.53 H new ATOM 0 HD12 ILE C 238 3.588 4.726 -0.627 1.00 60.53 H new ATOM 0 HD13 ILE C 238 2.540 3.559 0.215 1.00 60.53 H new ATOM 2319 N VAL C 239 -2.422 5.483 -2.129 1.00 61.25 N ATOM 2320 CA VAL C 239 -3.571 6.298 -1.835 1.00 61.25 C ATOM 2321 C VAL C 239 -3.991 6.060 -0.391 1.00 61.04 C ATOM 2322 O VAL C 239 -4.148 4.928 0.030 1.00 51.30 O ATOM 2323 CB VAL C 239 -4.752 5.980 -2.794 1.00 4.33 C ATOM 2324 CG1 VAL C 239 -5.924 6.907 -2.542 1.00 0.52 C ATOM 2325 CG2 VAL C 239 -4.310 6.061 -4.251 1.00 63.23 C ATOM 0 H VAL C 239 -2.615 4.482 -2.166 1.00 61.25 H new ATOM 0 HA VAL C 239 -3.303 7.345 -1.978 1.00 61.25 H new ATOM 0 HB VAL C 239 -5.076 4.959 -2.592 1.00 4.33 H new ATOM 0 HG11 VAL C 239 -6.736 6.662 -3.227 1.00 0.52 H new ATOM 0 HG12 VAL C 239 -6.268 6.788 -1.515 1.00 0.52 H new ATOM 0 HG13 VAL C 239 -5.613 7.939 -2.703 1.00 0.52 H new ATOM 0 HG21 VAL C 239 -5.155 5.834 -4.901 1.00 63.23 H new ATOM 0 HG22 VAL C 239 -3.947 7.066 -4.466 1.00 63.23 H new ATOM 0 HG23 VAL C 239 -3.512 5.341 -4.430 1.00 63.23 H new ATOM 2335 N ALA C 240 -4.158 7.109 0.353 1.00 35.43 N ATOM 2336 CA ALA C 240 -4.512 7.007 1.740 1.00 12.51 C ATOM 2337 C ALA C 240 -5.769 7.809 2.028 1.00 30.52 C ATOM 2338 O ALA C 240 -5.968 8.906 1.498 1.00 52.30 O ATOM 2339 CB ALA C 240 -3.360 7.492 2.620 1.00 32.41 C ATOM 0 H ALA C 240 -4.053 8.066 0.016 1.00 35.43 H new ATOM 0 HA ALA C 240 -4.709 5.960 1.970 1.00 12.51 H new ATOM 0 HB1 ALA C 240 -3.644 7.409 3.669 1.00 32.41 H new ATOM 0 HB2 ALA C 240 -2.477 6.881 2.433 1.00 32.41 H new ATOM 0 HB3 ALA C 240 -3.137 8.533 2.386 1.00 32.41 H new ATOM 2345 N ARG C 241 -6.630 7.260 2.843 1.00 52.44 N ATOM 2346 CA ARG C 241 -7.811 7.980 3.240 1.00 23.43 C ATOM 2347 C ARG C 241 -7.606 8.630 4.567 1.00 61.52 C ATOM 2348 O ARG C 241 -7.225 7.961 5.552 1.00 32.35 O ATOM 2349 CB ARG C 241 -9.085 7.128 3.269 1.00 61.40 C ATOM 2350 CG ARG C 241 -9.604 6.701 1.914 1.00 71.15 C ATOM 2351 CD ARG C 241 -10.981 6.075 2.045 1.00 34.22 C ATOM 2352 NE ARG C 241 -11.563 5.693 0.756 1.00 72.23 N ATOM 2353 CZ ARG C 241 -12.808 5.211 0.590 1.00 61.21 C ATOM 2354 NH1 ARG C 241 -13.638 5.105 1.637 1.00 41.15 N ATOM 2355 NH2 ARG C 241 -13.228 4.867 -0.619 1.00 15.24 N ATOM 0 H ARG C 241 -6.538 6.326 3.242 1.00 52.44 H new ATOM 0 HA ARG C 241 -7.966 8.736 2.470 1.00 23.43 H new ATOM 0 HB2 ARG C 241 -8.893 6.236 3.865 1.00 61.40 H new ATOM 0 HB3 ARG C 241 -9.867 7.690 3.780 1.00 61.40 H new ATOM 0 HG2 ARG C 241 -9.652 7.563 1.248 1.00 71.15 H new ATOM 0 HG3 ARG C 241 -8.915 5.987 1.463 1.00 71.15 H new ATOM 0 HD2 ARG C 241 -10.914 5.193 2.682 1.00 34.22 H new ATOM 0 HD3 ARG C 241 -11.648 6.779 2.544 1.00 34.22 H new ATOM 0 HE ARG C 241 -10.982 5.800 -0.076 1.00 72.23 H new ATOM 0 HH11 ARG C 241 -13.327 5.390 2.565 1.00 41.15 H new ATOM 0 HH12 ARG C 241 -14.581 4.739 1.505 1.00 41.15 H new ATOM 0 HH21 ARG C 241 -12.608 4.968 -1.422 1.00 15.24 H new ATOM 0 HH22 ARG C 241 -14.172 4.501 -0.746 1.00 15.24 H new ATOM 2369 N LEU C 242 -7.837 9.915 4.589 1.00 72.01 N ATOM 2370 CA LEU C 242 -7.736 10.716 5.782 1.00 62.21 C ATOM 2371 C LEU C 242 -8.896 10.386 6.709 1.00 34.42 C ATOM 2372 O LEU C 242 -9.966 9.933 6.251 1.00 73.42 O ATOM 2373 CB LEU C 242 -7.779 12.204 5.400 1.00 15.45 C ATOM 2374 CG LEU C 242 -6.660 12.702 4.473 1.00 14.52 C ATOM 2375 CD1 LEU C 242 -6.915 14.144 4.038 1.00 75.24 C ATOM 2376 CD2 LEU C 242 -5.311 12.592 5.162 1.00 24.22 C ATOM 0 H LEU C 242 -8.106 10.447 3.761 1.00 72.01 H new ATOM 0 HA LEU C 242 -6.797 10.503 6.292 1.00 62.21 H new ATOM 0 HB2 LEU C 242 -8.736 12.406 4.920 1.00 15.45 H new ATOM 0 HB3 LEU C 242 -7.751 12.793 6.317 1.00 15.45 H new ATOM 0 HG LEU C 242 -6.652 12.072 3.584 1.00 14.52 H new ATOM 0 HD11 LEU C 242 -6.109 14.474 3.382 1.00 75.24 H new ATOM 0 HD12 LEU C 242 -7.864 14.201 3.504 1.00 75.24 H new ATOM 0 HD13 LEU C 242 -6.954 14.788 4.917 1.00 75.24 H new ATOM 0 HD21 LEU C 242 -4.530 12.949 4.491 1.00 24.22 H new ATOM 0 HD22 LEU C 242 -5.315 13.197 6.069 1.00 24.22 H new ATOM 0 HD23 LEU C 242 -5.119 11.551 5.421 1.00 24.22 H new ATOM 2388 N LYS C 243 -8.691 10.588 7.986 1.00 72.21 N ATOM 2389 CA LYS C 243 -9.709 10.343 8.987 1.00 40.45 C ATOM 2390 C LYS C 243 -10.738 11.479 8.995 1.00 32.12 C ATOM 2391 O LYS C 243 -10.700 12.349 9.876 1.00 25.11 O ATOM 2392 CB LYS C 243 -9.063 10.199 10.365 1.00 14.11 C ATOM 2393 CG LYS C 243 -8.094 9.035 10.481 1.00 61.31 C ATOM 2394 CD LYS C 243 -7.286 9.006 11.802 1.00 70.32 C ATOM 2395 CE LYS C 243 -8.134 8.877 13.087 1.00 53.00 C ATOM 2396 NZ LYS C 243 -8.928 10.087 13.416 1.00 2.30 N ATOM 0 H LYS C 243 -7.809 10.929 8.367 1.00 72.21 H new ATOM 0 HA LYS C 243 -10.225 9.415 8.742 1.00 40.45 H new ATOM 0 HB2 LYS C 243 -8.535 11.122 10.604 1.00 14.11 H new ATOM 0 HB3 LYS C 243 -9.848 10.079 11.111 1.00 14.11 H new ATOM 0 HG2 LYS C 243 -8.652 8.103 10.390 1.00 61.31 H new ATOM 0 HG3 LYS C 243 -7.397 9.073 9.644 1.00 61.31 H new ATOM 0 HD2 LYS C 243 -6.585 8.172 11.763 1.00 70.32 H new ATOM 0 HD3 LYS C 243 -6.693 9.918 11.867 1.00 70.32 H new ATOM 0 HE2 LYS C 243 -8.811 8.030 12.978 1.00 53.00 H new ATOM 0 HE3 LYS C 243 -7.473 8.651 13.924 1.00 53.00 H new ATOM 0 HZ1 LYS C 243 -8.848 10.288 14.433 1.00 2.30 H new ATOM 0 HZ2 LYS C 243 -8.567 10.897 12.873 1.00 2.30 H new ATOM 0 HZ3 LYS C 243 -9.926 9.924 13.172 1.00 2.30 H new ATOM 2410 N ASN C 244 -11.593 11.476 7.956 1.00 75.45 N ATOM 2411 CA ASN C 244 -12.652 12.485 7.690 1.00 21.13 C ATOM 2412 C ASN C 244 -12.198 13.892 8.033 1.00 3.41 C ATOM 2413 O ASN C 244 -12.424 14.385 9.145 1.00 3.15 O ATOM 2414 CB ASN C 244 -13.991 12.162 8.369 1.00 24.12 C ATOM 2415 CG ASN C 244 -15.099 13.116 7.928 1.00 53.33 C ATOM 2416 OD1 ASN C 244 -15.105 13.604 6.790 1.00 13.12 O ATOM 2417 ND2 ASN C 244 -16.021 13.407 8.809 1.00 50.24 N ATOM 0 H ASN C 244 -11.570 10.744 7.246 1.00 75.45 H new ATOM 0 HA ASN C 244 -12.829 12.437 6.616 1.00 21.13 H new ATOM 0 HB2 ASN C 244 -14.279 11.138 8.134 1.00 24.12 H new ATOM 0 HB3 ASN C 244 -13.872 12.219 9.451 1.00 24.12 H new ATOM 0 HD21 ASN C 244 -16.773 14.053 8.566 1.00 50.24 H new ATOM 0 HD22 ASN C 244 -15.988 12.988 9.739 1.00 50.24 H new ATOM 2424 N ASN C 245 -11.532 14.517 7.116 1.00 21.11 N ATOM 2425 CA ASN C 245 -10.946 15.810 7.385 1.00 14.41 C ATOM 2426 C ASN C 245 -10.941 16.675 6.145 1.00 41.33 C ATOM 2427 O ASN C 245 -11.418 17.804 6.158 1.00 32.13 O ATOM 2428 CB ASN C 245 -9.508 15.609 7.883 1.00 34.24 C ATOM 2429 CG ASN C 245 -8.771 16.895 8.228 1.00 12.31 C ATOM 2430 OD1 ASN C 245 -7.559 16.968 8.076 1.00 22.32 O ATOM 2431 ND2 ASN C 245 -9.470 17.892 8.713 1.00 73.32 N ATOM 0 H ASN C 245 -11.375 14.162 6.173 1.00 21.11 H new ATOM 0 HA ASN C 245 -11.542 16.316 8.145 1.00 14.41 H new ATOM 0 HB2 ASN C 245 -9.529 14.970 8.766 1.00 34.24 H new ATOM 0 HB3 ASN C 245 -8.944 15.076 7.118 1.00 34.24 H new ATOM 0 HD21 ASN C 245 -9.005 18.761 8.976 1.00 73.32 H new ATOM 0 HD22 ASN C 245 -10.479 17.799 8.827 1.00 73.32 H new ATOM 2438 N ASN C 246 -10.415 16.140 5.075 1.00 45.14 N ATOM 2439 CA ASN C 246 -10.274 16.897 3.847 1.00 35.25 C ATOM 2440 C ASN C 246 -10.810 16.109 2.672 1.00 41.34 C ATOM 2441 O ASN C 246 -11.886 16.393 2.155 1.00 51.54 O ATOM 2442 CB ASN C 246 -8.794 17.256 3.585 1.00 20.21 C ATOM 2443 CG ASN C 246 -8.146 18.198 4.590 1.00 34.33 C ATOM 2444 OD1 ASN C 246 -6.956 18.084 4.856 1.00 42.41 O ATOM 2445 ND2 ASN C 246 -8.887 19.137 5.114 1.00 32.25 N ATOM 0 H ASN C 246 -10.074 15.180 5.023 1.00 45.14 H new ATOM 0 HA ASN C 246 -10.848 17.817 3.959 1.00 35.25 H new ATOM 0 HB2 ASN C 246 -8.216 16.332 3.559 1.00 20.21 H new ATOM 0 HB3 ASN C 246 -8.720 17.707 2.595 1.00 20.21 H new ATOM 0 HD21 ASN C 246 -8.478 19.805 5.767 1.00 32.25 H new ATOM 0 HD22 ASN C 246 -9.875 19.203 4.870 1.00 32.25 H new ATOM 2452 N ARG C 247 -10.071 15.091 2.278 1.00 4.20 N ATOM 2453 CA ARG C 247 -10.413 14.271 1.139 1.00 4.30 C ATOM 2454 C ARG C 247 -9.607 12.987 1.197 1.00 4.11 C ATOM 2455 O ARG C 247 -9.018 12.677 2.231 1.00 20.25 O ATOM 2456 CB ARG C 247 -10.136 15.021 -0.210 1.00 41.04 C ATOM 2457 CG ARG C 247 -8.667 15.406 -0.534 1.00 12.32 C ATOM 2458 CD ARG C 247 -8.128 16.544 0.335 1.00 63.41 C ATOM 2459 NE ARG C 247 -6.707 16.833 0.062 1.00 32.34 N ATOM 2460 CZ ARG C 247 -6.000 17.870 0.564 1.00 20.41 C ATOM 2461 NH1 ARG C 247 -6.609 18.837 1.252 1.00 33.31 N ATOM 2462 NH2 ARG C 247 -4.684 17.956 0.334 1.00 54.31 N ATOM 0 H ARG C 247 -9.209 14.809 2.745 1.00 4.20 H new ATOM 0 HA ARG C 247 -11.479 14.046 1.177 1.00 4.30 H new ATOM 0 HB2 ARG C 247 -10.506 14.396 -1.023 1.00 41.04 H new ATOM 0 HB3 ARG C 247 -10.731 15.934 -0.214 1.00 41.04 H new ATOM 0 HG2 ARG C 247 -8.033 14.529 -0.404 1.00 12.32 H new ATOM 0 HG3 ARG C 247 -8.599 15.696 -1.582 1.00 12.32 H new ATOM 0 HD2 ARG C 247 -8.719 17.443 0.160 1.00 63.41 H new ATOM 0 HD3 ARG C 247 -8.248 16.283 1.387 1.00 63.41 H new ATOM 0 HE ARG C 247 -6.214 16.193 -0.561 1.00 32.34 H new ATOM 0 HH11 ARG C 247 -7.617 18.798 1.403 1.00 33.31 H new ATOM 0 HH12 ARG C 247 -6.067 19.615 1.627 1.00 33.31 H new ATOM 0 HH21 ARG C 247 -4.215 17.239 -0.220 1.00 54.31 H new ATOM 0 HH22 ARG C 247 -4.150 18.738 0.713 1.00 54.31 H new ATOM 2476 N GLN C 248 -9.602 12.246 0.128 1.00 61.44 N ATOM 2477 CA GLN C 248 -8.761 11.091 0.013 1.00 13.54 C ATOM 2478 C GLN C 248 -7.544 11.538 -0.754 1.00 32.11 C ATOM 2479 O GLN C 248 -7.667 12.178 -1.801 1.00 32.34 O ATOM 2480 CB GLN C 248 -9.494 9.963 -0.731 1.00 30.32 C ATOM 2481 CG GLN C 248 -8.635 8.746 -1.023 1.00 34.40 C ATOM 2482 CD GLN C 248 -9.369 7.689 -1.820 1.00 73.21 C ATOM 2483 OE1 GLN C 248 -9.995 6.785 -1.262 1.00 1.11 O ATOM 2484 NE2 GLN C 248 -9.295 7.786 -3.118 1.00 74.01 N ATOM 0 H GLN C 248 -10.183 12.426 -0.691 1.00 61.44 H new ATOM 0 HA GLN C 248 -8.487 10.696 0.991 1.00 13.54 H new ATOM 0 HB2 GLN C 248 -10.354 9.652 -0.139 1.00 30.32 H new ATOM 0 HB3 GLN C 248 -9.880 10.355 -1.672 1.00 30.32 H new ATOM 0 HG2 GLN C 248 -7.746 9.057 -1.572 1.00 34.40 H new ATOM 0 HG3 GLN C 248 -8.293 8.314 -0.083 1.00 34.40 H new ATOM 0 HE21 GLN C 248 -8.767 8.548 -3.543 1.00 74.01 H new ATOM 0 HE22 GLN C 248 -9.765 7.100 -3.708 1.00 74.01 H new ATOM 2493 N VAL C 249 -6.387 11.218 -0.256 1.00 44.21 N ATOM 2494 CA VAL C 249 -5.172 11.731 -0.829 1.00 45.34 C ATOM 2495 C VAL C 249 -4.198 10.650 -1.189 1.00 32.33 C ATOM 2496 O VAL C 249 -4.265 9.553 -0.679 1.00 5.31 O ATOM 2497 CB VAL C 249 -4.482 12.832 0.051 1.00 33.20 C ATOM 2498 CG1 VAL C 249 -5.357 14.038 0.176 1.00 61.15 C ATOM 2499 CG2 VAL C 249 -4.077 12.347 1.449 1.00 23.11 C ATOM 0 H VAL C 249 -6.255 10.603 0.547 1.00 44.21 H new ATOM 0 HA VAL C 249 -5.486 12.215 -1.754 1.00 45.34 H new ATOM 0 HB VAL C 249 -3.562 13.087 -0.474 1.00 33.20 H new ATOM 0 HG11 VAL C 249 -4.858 14.788 0.790 1.00 61.15 H new ATOM 0 HG12 VAL C 249 -5.551 14.451 -0.814 1.00 61.15 H new ATOM 0 HG13 VAL C 249 -6.301 13.756 0.643 1.00 61.15 H new ATOM 0 HG21 VAL C 249 -3.607 13.164 1.996 1.00 23.11 H new ATOM 0 HG22 VAL C 249 -4.963 12.012 1.989 1.00 23.11 H new ATOM 0 HG23 VAL C 249 -3.373 11.520 1.357 1.00 23.11 H new ATOM 2509 N CYS C 250 -3.324 10.960 -2.079 1.00 53.21 N ATOM 2510 CA CYS C 250 -2.295 10.046 -2.477 1.00 0.31 C ATOM 2511 C CYS C 250 -1.052 10.468 -1.804 1.00 75.21 C ATOM 2512 O CYS C 250 -0.850 11.618 -1.588 1.00 12.30 O ATOM 2513 CB CYS C 250 -2.102 10.072 -3.974 1.00 73.41 C ATOM 2514 SG CYS C 250 -0.610 9.164 -4.574 1.00 61.33 S ATOM 0 H CYS C 250 -3.296 11.859 -2.559 1.00 53.21 H new ATOM 0 HA CYS C 250 -2.568 9.028 -2.198 1.00 0.31 H new ATOM 0 HB2 CYS C 250 -2.986 9.645 -4.448 1.00 73.41 H new ATOM 0 HB3 CYS C 250 -2.035 11.110 -4.300 1.00 73.41 H new ATOM 2519 N ILE C 251 -0.243 9.554 -1.460 1.00 33.11 N ATOM 2520 CA ILE C 251 0.915 9.839 -0.695 1.00 33.21 C ATOM 2521 C ILE C 251 2.133 9.549 -1.506 1.00 2.00 C ATOM 2522 O ILE C 251 2.143 8.624 -2.316 1.00 11.03 O ATOM 2523 CB ILE C 251 0.936 8.963 0.592 1.00 14.45 C ATOM 2524 CG1 ILE C 251 -0.376 9.083 1.377 1.00 53.53 C ATOM 2525 CG2 ILE C 251 2.103 9.321 1.475 1.00 73.11 C ATOM 2526 CD1 ILE C 251 -0.705 10.488 1.841 1.00 3.43 C ATOM 0 H ILE C 251 -0.359 8.569 -1.700 1.00 33.11 H new ATOM 0 HA ILE C 251 0.901 10.892 -0.413 1.00 33.21 H new ATOM 0 HB ILE C 251 1.047 7.927 0.272 1.00 14.45 H new ATOM 0 HG12 ILE C 251 -1.192 8.720 0.753 1.00 53.53 H new ATOM 0 HG13 ILE C 251 -0.325 8.429 2.248 1.00 53.53 H new ATOM 0 HG21 ILE C 251 2.091 8.693 2.366 1.00 73.11 H new ATOM 0 HG22 ILE C 251 3.034 9.161 0.931 1.00 73.11 H new ATOM 0 HG23 ILE C 251 2.029 10.368 1.768 1.00 73.11 H new ATOM 0 HD11 ILE C 251 -1.648 10.479 2.387 1.00 3.43 H new ATOM 0 HD12 ILE C 251 0.089 10.851 2.494 1.00 3.43 H new ATOM 0 HD13 ILE C 251 -0.792 11.146 0.976 1.00 3.43 H new ATOM 2538 N ASP C 252 3.128 10.367 -1.310 1.00 35.25 N ATOM 2539 CA ASP C 252 4.412 10.168 -1.909 1.00 23.41 C ATOM 2540 C ASP C 252 5.026 8.917 -1.282 1.00 13.51 C ATOM 2541 O ASP C 252 5.299 8.891 -0.077 1.00 65.43 O ATOM 2542 CB ASP C 252 5.301 11.385 -1.636 1.00 1.23 C ATOM 2543 CG ASP C 252 6.667 11.265 -2.250 1.00 51.31 C ATOM 2544 OD1 ASP C 252 6.815 11.568 -3.450 1.00 24.34 O ATOM 2545 OD2 ASP C 252 7.588 10.873 -1.557 1.00 1.15 O ATOM 0 H ASP C 252 3.067 11.199 -0.723 1.00 35.25 H new ATOM 0 HA ASP C 252 4.321 10.045 -2.988 1.00 23.41 H new ATOM 0 HB2 ASP C 252 4.812 12.279 -2.023 1.00 1.23 H new ATOM 0 HB3 ASP C 252 5.403 11.519 -0.559 1.00 1.23 H new ATOM 2550 N PRO C 253 5.231 7.848 -2.068 1.00 62.22 N ATOM 2551 CA PRO C 253 5.744 6.574 -1.545 1.00 42.15 C ATOM 2552 C PRO C 253 7.236 6.636 -1.237 1.00 74.52 C ATOM 2553 O PRO C 253 7.871 5.630 -0.901 1.00 55.54 O ATOM 2554 CB PRO C 253 5.481 5.594 -2.684 1.00 33.42 C ATOM 2555 CG PRO C 253 5.490 6.425 -3.920 1.00 33.22 C ATOM 2556 CD PRO C 253 4.979 7.787 -3.524 1.00 42.23 C ATOM 0 HA PRO C 253 5.267 6.297 -0.605 1.00 42.15 H new ATOM 0 HB2 PRO C 253 6.248 4.820 -2.723 1.00 33.42 H new ATOM 0 HB3 PRO C 253 4.524 5.088 -2.556 1.00 33.42 H new ATOM 0 HG2 PRO C 253 6.496 6.493 -4.334 1.00 33.22 H new ATOM 0 HG3 PRO C 253 4.858 5.982 -4.690 1.00 33.22 H new ATOM 0 HD2 PRO C 253 5.504 8.581 -4.055 1.00 42.23 H new ATOM 0 HD3 PRO C 253 3.919 7.898 -3.752 1.00 42.23 H new ATOM 2564 N LYS C 254 7.780 7.807 -1.353 1.00 31.12 N ATOM 2565 CA LYS C 254 9.157 8.044 -1.143 1.00 75.12 C ATOM 2566 C LYS C 254 9.349 8.752 0.219 1.00 45.14 C ATOM 2567 O LYS C 254 10.469 9.043 0.633 1.00 33.05 O ATOM 2568 CB LYS C 254 9.664 8.871 -2.327 1.00 73.13 C ATOM 2569 CG LYS C 254 9.385 8.196 -3.674 1.00 33.30 C ATOM 2570 CD LYS C 254 9.723 9.089 -4.859 1.00 70.23 C ATOM 2571 CE LYS C 254 11.185 9.461 -4.896 1.00 11.23 C ATOM 2572 NZ LYS C 254 11.517 10.288 -6.080 1.00 15.00 N ATOM 0 H LYS C 254 7.254 8.644 -1.604 1.00 31.12 H new ATOM 0 HA LYS C 254 9.734 7.121 -1.097 1.00 75.12 H new ATOM 0 HB2 LYS C 254 9.190 9.852 -2.311 1.00 73.13 H new ATOM 0 HB3 LYS C 254 10.737 9.033 -2.220 1.00 73.13 H new ATOM 0 HG2 LYS C 254 9.964 7.275 -3.741 1.00 33.30 H new ATOM 0 HG3 LYS C 254 8.333 7.915 -3.724 1.00 33.30 H new ATOM 0 HD2 LYS C 254 9.457 8.578 -5.784 1.00 70.23 H new ATOM 0 HD3 LYS C 254 9.120 9.996 -4.811 1.00 70.23 H new ATOM 0 HE2 LYS C 254 11.443 10.007 -3.989 1.00 11.23 H new ATOM 0 HE3 LYS C 254 11.790 8.554 -4.906 1.00 11.23 H new ATOM 0 HZ1 LYS C 254 12.530 10.522 -6.067 1.00 15.00 H new ATOM 0 HZ2 LYS C 254 11.295 9.758 -6.947 1.00 15.00 H new ATOM 0 HZ3 LYS C 254 10.959 11.165 -6.058 1.00 15.00 H new ATOM 2586 N LEU C 255 8.215 9.004 0.898 1.00 15.31 N ATOM 2587 CA LEU C 255 8.177 9.583 2.251 1.00 41.24 C ATOM 2588 C LEU C 255 8.816 8.694 3.279 1.00 53.34 C ATOM 2589 O LEU C 255 8.713 7.470 3.198 1.00 62.14 O ATOM 2590 CB LEU C 255 6.743 9.888 2.674 1.00 74.41 C ATOM 2591 CG LEU C 255 6.209 11.242 2.279 1.00 35.11 C ATOM 2592 CD1 LEU C 255 4.725 11.327 2.566 1.00 13.10 C ATOM 2593 CD2 LEU C 255 6.918 12.278 3.102 1.00 51.22 C ATOM 0 H LEU C 255 7.289 8.809 0.517 1.00 15.31 H new ATOM 0 HA LEU C 255 8.752 10.508 2.201 1.00 41.24 H new ATOM 0 HB2 LEU C 255 6.090 9.125 2.250 1.00 74.41 H new ATOM 0 HB3 LEU C 255 6.678 9.796 3.758 1.00 74.41 H new ATOM 0 HG LEU C 255 6.373 11.403 1.214 1.00 35.11 H new ATOM 0 HD11 LEU C 255 4.354 12.310 2.276 1.00 13.10 H new ATOM 0 HD12 LEU C 255 4.200 10.559 1.998 1.00 13.10 H new ATOM 0 HD13 LEU C 255 4.551 11.174 3.631 1.00 13.10 H new ATOM 0 HD21 LEU C 255 6.550 13.269 2.836 1.00 51.22 H new ATOM 0 HD22 LEU C 255 6.730 12.093 4.160 1.00 51.22 H new ATOM 0 HD23 LEU C 255 7.989 12.225 2.909 1.00 51.22 H new ATOM 2605 N LYS C 256 9.428 9.317 4.285 1.00 60.44 N ATOM 2606 CA LYS C 256 10.144 8.606 5.327 1.00 12.14 C ATOM 2607 C LYS C 256 9.206 7.753 6.178 1.00 22.24 C ATOM 2608 O LYS C 256 9.554 6.621 6.527 1.00 33.15 O ATOM 2609 CB LYS C 256 10.967 9.568 6.200 1.00 3.45 C ATOM 2610 CG LYS C 256 11.831 8.892 7.270 1.00 4.34 C ATOM 2611 CD LYS C 256 12.859 7.936 6.666 1.00 61.11 C ATOM 2612 CE LYS C 256 13.776 7.357 7.740 1.00 2.21 C ATOM 2613 NZ LYS C 256 13.036 6.591 8.768 1.00 5.04 N ATOM 0 H LYS C 256 9.438 10.331 4.395 1.00 60.44 H new ATOM 0 HA LYS C 256 10.840 7.929 4.833 1.00 12.14 H new ATOM 0 HB2 LYS C 256 11.614 10.159 5.552 1.00 3.45 H new ATOM 0 HB3 LYS C 256 10.286 10.263 6.690 1.00 3.45 H new ATOM 0 HG2 LYS C 256 12.346 9.655 7.853 1.00 4.34 H new ATOM 0 HG3 LYS C 256 11.189 8.344 7.959 1.00 4.34 H new ATOM 0 HD2 LYS C 256 12.345 7.126 6.148 1.00 61.11 H new ATOM 0 HD3 LYS C 256 13.455 8.463 5.921 1.00 61.11 H new ATOM 0 HE2 LYS C 256 14.515 6.708 7.270 1.00 2.21 H new ATOM 0 HE3 LYS C 256 14.324 8.168 8.220 1.00 2.21 H new ATOM 0 HZ1 LYS C 256 13.371 6.866 9.714 1.00 5.04 H new ATOM 0 HZ2 LYS C 256 12.019 6.795 8.688 1.00 5.04 H new ATOM 0 HZ3 LYS C 256 13.198 5.573 8.626 1.00 5.04 H new ATOM 2627 N TRP C 257 8.005 8.268 6.512 1.00 70.43 N ATOM 2628 CA TRP C 257 7.076 7.430 7.277 1.00 71.32 C ATOM 2629 C TRP C 257 6.566 6.285 6.433 1.00 40.33 C ATOM 2630 O TRP C 257 6.251 5.228 6.948 1.00 23.23 O ATOM 2631 CB TRP C 257 5.920 8.183 8.004 1.00 53.20 C ATOM 2632 CG TRP C 257 4.930 8.942 7.160 1.00 64.34 C ATOM 2633 CD1 TRP C 257 5.042 10.219 6.701 1.00 42.43 C ATOM 2634 CD2 TRP C 257 3.643 8.475 6.736 1.00 52.43 C ATOM 2635 NE1 TRP C 257 3.906 10.570 6.013 1.00 0.20 N ATOM 2636 CE2 TRP C 257 3.034 9.516 6.018 1.00 63.44 C ATOM 2637 CE3 TRP C 257 2.950 7.271 6.895 1.00 73.55 C ATOM 2638 CZ2 TRP C 257 1.759 9.394 5.459 1.00 43.14 C ATOM 2639 CZ3 TRP C 257 1.690 7.154 6.345 1.00 33.44 C ATOM 2640 CH2 TRP C 257 1.110 8.209 5.635 1.00 14.50 C ATOM 0 H TRP C 257 7.674 9.204 6.279 1.00 70.43 H new ATOM 0 HA TRP C 257 7.672 7.033 8.099 1.00 71.32 H new ATOM 0 HB2 TRP C 257 5.366 7.453 8.594 1.00 53.20 H new ATOM 0 HB3 TRP C 257 6.369 8.886 8.706 1.00 53.20 H new ATOM 0 HD1 TRP C 257 5.897 10.861 6.855 1.00 42.43 H new ATOM 0 HE1 TRP C 257 3.739 11.473 5.569 1.00 0.20 H new ATOM 0 HE3 TRP C 257 3.392 6.449 7.438 1.00 73.55 H new ATOM 0 HZ2 TRP C 257 1.306 10.206 4.910 1.00 43.14 H new ATOM 0 HZ3 TRP C 257 1.142 6.231 6.465 1.00 33.44 H new ATOM 0 HH2 TRP C 257 0.123 8.082 5.216 1.00 14.50 H new ATOM 2651 N ILE C 258 6.520 6.491 5.120 1.00 33.21 N ATOM 2652 CA ILE C 258 6.141 5.425 4.218 1.00 34.34 C ATOM 2653 C ILE C 258 7.269 4.403 4.142 1.00 15.00 C ATOM 2654 O ILE C 258 7.016 3.203 4.111 1.00 35.41 O ATOM 2655 CB ILE C 258 5.768 5.933 2.785 1.00 1.11 C ATOM 2656 CG1 ILE C 258 4.533 6.853 2.831 1.00 64.32 C ATOM 2657 CG2 ILE C 258 5.517 4.760 1.841 1.00 54.05 C ATOM 2658 CD1 ILE C 258 3.290 6.173 3.343 1.00 1.40 C ATOM 0 H ILE C 258 6.739 7.378 4.667 1.00 33.21 H new ATOM 0 HA ILE C 258 5.239 4.964 4.621 1.00 34.34 H new ATOM 0 HB ILE C 258 6.613 6.508 2.406 1.00 1.11 H new ATOM 0 HG12 ILE C 258 4.754 7.712 3.465 1.00 64.32 H new ATOM 0 HG13 ILE C 258 4.340 7.237 1.830 1.00 64.32 H new ATOM 0 HG21 ILE C 258 5.260 5.138 0.852 1.00 54.05 H new ATOM 0 HG22 ILE C 258 6.417 4.149 1.773 1.00 54.05 H new ATOM 0 HG23 ILE C 258 4.695 4.155 2.223 1.00 54.05 H new ATOM 0 HD11 ILE C 258 2.463 6.882 3.347 1.00 1.40 H new ATOM 0 HD12 ILE C 258 3.043 5.331 2.696 1.00 1.40 H new ATOM 0 HD13 ILE C 258 3.464 5.813 4.357 1.00 1.40 H new ATOM 2670 N GLN C 259 8.525 4.893 4.154 1.00 40.40 N ATOM 2671 CA GLN C 259 9.694 4.009 4.131 1.00 31.01 C ATOM 2672 C GLN C 259 9.631 3.078 5.311 1.00 51.32 C ATOM 2673 O GLN C 259 9.701 1.868 5.158 1.00 43.45 O ATOM 2674 CB GLN C 259 11.023 4.789 4.197 1.00 63.25 C ATOM 2675 CG GLN C 259 11.248 5.820 3.104 1.00 23.24 C ATOM 2676 CD GLN C 259 11.061 5.266 1.722 1.00 55.24 C ATOM 2677 OE1 GLN C 259 11.985 4.752 1.118 1.00 10.42 O ATOM 2678 NE2 GLN C 259 9.867 5.409 1.204 1.00 33.33 N ATOM 0 H GLN C 259 8.749 5.888 4.179 1.00 40.40 H new ATOM 0 HA GLN C 259 9.669 3.461 3.189 1.00 31.01 H new ATOM 0 HB2 GLN C 259 11.077 5.294 5.161 1.00 63.25 H new ATOM 0 HB3 GLN C 259 11.843 4.072 4.166 1.00 63.25 H new ATOM 0 HG2 GLN C 259 10.560 6.652 3.251 1.00 23.24 H new ATOM 0 HG3 GLN C 259 12.257 6.221 3.194 1.00 23.24 H new ATOM 0 HE21 GLN C 259 9.124 5.846 1.749 1.00 33.33 H new ATOM 0 HE22 GLN C 259 9.680 5.083 0.256 1.00 33.33 H new ATOM 2687 N GLU C 260 9.444 3.664 6.494 1.00 44.40 N ATOM 2688 CA GLU C 260 9.311 2.892 7.710 1.00 54.12 C ATOM 2689 C GLU C 260 8.143 1.961 7.589 1.00 3.24 C ATOM 2690 O GLU C 260 8.290 0.791 7.788 1.00 42.33 O ATOM 2691 CB GLU C 260 9.084 3.797 8.926 1.00 50.52 C ATOM 2692 CG GLU C 260 10.224 4.725 9.279 1.00 11.42 C ATOM 2693 CD GLU C 260 11.480 3.993 9.682 1.00 51.32 C ATOM 2694 OE1 GLU C 260 11.578 3.548 10.828 1.00 42.23 O ATOM 2695 OE2 GLU C 260 12.402 3.894 8.864 1.00 2.11 O ATOM 0 H GLU C 260 9.382 4.673 6.626 1.00 44.40 H new ATOM 0 HA GLU C 260 10.237 2.335 7.852 1.00 54.12 H new ATOM 0 HB2 GLU C 260 8.193 4.399 8.746 1.00 50.52 H new ATOM 0 HB3 GLU C 260 8.873 3.167 9.790 1.00 50.52 H new ATOM 0 HG2 GLU C 260 10.442 5.365 8.424 1.00 11.42 H new ATOM 0 HG3 GLU C 260 9.914 5.378 10.095 1.00 11.42 H new ATOM 2702 N TYR C 261 6.996 2.494 7.209 1.00 13.32 N ATOM 2703 CA TYR C 261 5.771 1.725 7.178 1.00 32.01 C ATOM 2704 C TYR C 261 5.893 0.469 6.290 1.00 1.32 C ATOM 2705 O TYR C 261 5.482 -0.621 6.694 1.00 65.53 O ATOM 2706 CB TYR C 261 4.583 2.593 6.744 1.00 10.11 C ATOM 2707 CG TYR C 261 3.290 1.905 6.999 1.00 42.33 C ATOM 2708 CD1 TYR C 261 2.737 1.936 8.267 1.00 65.34 C ATOM 2709 CD2 TYR C 261 2.647 1.181 6.012 1.00 75.42 C ATOM 2710 CE1 TYR C 261 1.581 1.276 8.545 1.00 3.15 C ATOM 2711 CE2 TYR C 261 1.493 0.499 6.288 1.00 32.42 C ATOM 2712 CZ TYR C 261 0.961 0.553 7.558 1.00 34.53 C ATOM 2713 OH TYR C 261 -0.171 -0.165 7.854 1.00 53.01 O ATOM 0 H TYR C 261 6.890 3.465 6.916 1.00 13.32 H new ATOM 0 HA TYR C 261 5.587 1.380 8.196 1.00 32.01 H new ATOM 0 HB2 TYR C 261 4.606 3.540 7.283 1.00 10.11 H new ATOM 0 HB3 TYR C 261 4.670 2.828 5.683 1.00 10.11 H new ATOM 0 HD1 TYR C 261 3.232 2.493 9.049 1.00 65.34 H new ATOM 0 HD2 TYR C 261 3.059 1.153 5.014 1.00 75.42 H new ATOM 0 HE1 TYR C 261 1.154 1.321 9.536 1.00 3.15 H new ATOM 0 HE2 TYR C 261 1.003 -0.077 5.517 1.00 32.42 H new ATOM 0 HH TYR C 261 -0.961 0.336 7.563 1.00 53.01 H new ATOM 2723 N LEU C 262 6.465 0.629 5.109 1.00 14.20 N ATOM 2724 CA LEU C 262 6.668 -0.497 4.198 1.00 4.34 C ATOM 2725 C LEU C 262 7.670 -1.479 4.805 1.00 33.52 C ATOM 2726 O LEU C 262 7.431 -2.697 4.846 1.00 11.01 O ATOM 2727 CB LEU C 262 7.179 -0.006 2.835 1.00 25.12 C ATOM 2728 CG LEU C 262 6.265 0.950 2.051 1.00 15.24 C ATOM 2729 CD1 LEU C 262 6.948 1.403 0.776 1.00 4.20 C ATOM 2730 CD2 LEU C 262 4.946 0.287 1.713 1.00 51.22 C ATOM 0 H LEU C 262 6.799 1.525 4.754 1.00 14.20 H new ATOM 0 HA LEU C 262 5.713 -1.000 4.049 1.00 4.34 H new ATOM 0 HB2 LEU C 262 8.136 0.492 2.991 1.00 25.12 H new ATOM 0 HB3 LEU C 262 7.372 -0.879 2.211 1.00 25.12 H new ATOM 0 HG LEU C 262 6.067 1.816 2.682 1.00 15.24 H new ATOM 0 HD11 LEU C 262 6.289 2.079 0.231 1.00 4.20 H new ATOM 0 HD12 LEU C 262 7.875 1.920 1.024 1.00 4.20 H new ATOM 0 HD13 LEU C 262 7.172 0.536 0.155 1.00 4.20 H new ATOM 0 HD21 LEU C 262 4.319 0.986 1.159 1.00 51.22 H new ATOM 0 HD22 LEU C 262 5.129 -0.598 1.104 1.00 51.22 H new ATOM 0 HD23 LEU C 262 4.439 -0.004 2.633 1.00 51.22 H new ATOM 2742 N GLU C 263 8.775 -0.939 5.308 1.00 24.34 N ATOM 2743 CA GLU C 263 9.822 -1.739 5.913 1.00 4.20 C ATOM 2744 C GLU C 263 9.334 -2.486 7.151 1.00 73.51 C ATOM 2745 O GLU C 263 9.543 -3.672 7.276 1.00 61.24 O ATOM 2746 CB GLU C 263 11.053 -0.889 6.242 1.00 74.15 C ATOM 2747 CG GLU C 263 11.788 -0.354 5.023 1.00 24.35 C ATOM 2748 CD GLU C 263 13.099 0.288 5.393 1.00 44.24 C ATOM 2749 OE1 GLU C 263 14.083 -0.458 5.592 1.00 4.42 O ATOM 2750 OE2 GLU C 263 13.179 1.532 5.491 1.00 42.12 O ATOM 0 H GLU C 263 8.965 0.063 5.306 1.00 24.34 H new ATOM 0 HA GLU C 263 10.111 -2.487 5.175 1.00 4.20 H new ATOM 0 HB2 GLU C 263 10.744 -0.048 6.863 1.00 74.15 H new ATOM 0 HB3 GLU C 263 11.745 -1.487 6.835 1.00 74.15 H new ATOM 0 HG2 GLU C 263 11.968 -1.169 4.322 1.00 24.35 H new ATOM 0 HG3 GLU C 263 11.159 0.374 4.511 1.00 24.35 H new ATOM 2757 N LYS C 264 8.640 -1.792 8.027 1.00 15.35 N ATOM 2758 CA LYS C 264 8.137 -2.350 9.298 1.00 2.44 C ATOM 2759 C LYS C 264 7.026 -3.371 9.068 1.00 22.31 C ATOM 2760 O LYS C 264 6.524 -3.991 10.009 1.00 61.51 O ATOM 2761 CB LYS C 264 7.627 -1.232 10.216 1.00 25.31 C ATOM 2762 CG LYS C 264 8.661 -0.166 10.552 1.00 61.12 C ATOM 2763 CD LYS C 264 9.876 -0.721 11.268 1.00 74.42 C ATOM 2764 CE LYS C 264 10.897 0.378 11.489 1.00 31.34 C ATOM 2765 NZ LYS C 264 12.070 -0.091 12.242 1.00 42.53 N ATOM 0 H LYS C 264 8.398 -0.811 7.890 1.00 15.35 H new ATOM 0 HA LYS C 264 8.973 -2.859 9.778 1.00 2.44 H new ATOM 0 HB2 LYS C 264 6.771 -0.752 9.741 1.00 25.31 H new ATOM 0 HB3 LYS C 264 7.269 -1.677 11.144 1.00 25.31 H new ATOM 0 HG2 LYS C 264 8.981 0.324 9.632 1.00 61.12 H new ATOM 0 HG3 LYS C 264 8.197 0.598 11.175 1.00 61.12 H new ATOM 0 HD2 LYS C 264 9.579 -1.150 12.225 1.00 74.42 H new ATOM 0 HD3 LYS C 264 10.318 -1.526 10.681 1.00 74.42 H new ATOM 0 HE2 LYS C 264 11.220 0.769 10.524 1.00 31.34 H new ATOM 0 HE3 LYS C 264 10.429 1.202 12.027 1.00 31.34 H new ATOM 0 HZ1 LYS C 264 12.739 0.695 12.368 1.00 42.53 H new ATOM 0 HZ2 LYS C 264 11.767 -0.440 13.174 1.00 42.53 H new ATOM 0 HZ3 LYS C 264 12.534 -0.860 11.718 1.00 42.53 H new ATOM 2779 N CYS C 265 6.654 -3.534 7.837 1.00 61.52 N ATOM 2780 CA CYS C 265 5.603 -4.439 7.484 1.00 62.20 C ATOM 2781 C CYS C 265 6.203 -5.709 6.923 1.00 21.40 C ATOM 2782 O CYS C 265 5.750 -6.812 7.252 1.00 11.01 O ATOM 2783 CB CYS C 265 4.620 -3.796 6.497 1.00 64.13 C ATOM 2784 SG CYS C 265 3.184 -4.842 6.062 1.00 11.52 S ATOM 0 H CYS C 265 7.071 -3.043 7.046 1.00 61.52 H new ATOM 0 HA CYS C 265 5.031 -4.686 8.379 1.00 62.20 H new ATOM 0 HB2 CYS C 265 4.256 -2.861 6.924 1.00 64.13 H new ATOM 0 HB3 CYS C 265 5.157 -3.541 5.583 1.00 64.13 H new ATOM 2789 N LEU C 266 7.253 -5.575 6.092 1.00 44.00 N ATOM 2790 CA LEU C 266 7.919 -6.748 5.570 1.00 32.44 C ATOM 2791 C LEU C 266 8.781 -7.515 6.596 1.00 64.30 C ATOM 2792 O LEU C 266 9.994 -7.378 6.663 1.00 21.24 O ATOM 2793 CB LEU C 266 8.557 -6.600 4.138 1.00 40.34 C ATOM 2794 CG LEU C 266 9.531 -5.437 3.781 1.00 24.43 C ATOM 2795 CD1 LEU C 266 10.754 -5.403 4.657 1.00 25.32 C ATOM 2796 CD2 LEU C 266 9.969 -5.614 2.353 1.00 14.41 C ATOM 0 H LEU C 266 7.640 -4.683 5.783 1.00 44.00 H new ATOM 0 HA LEU C 266 7.086 -7.424 5.378 1.00 32.44 H new ATOM 0 HB2 LEU C 266 9.090 -7.529 3.934 1.00 40.34 H new ATOM 0 HB3 LEU C 266 7.730 -6.545 3.430 1.00 40.34 H new ATOM 0 HG LEU C 266 8.997 -4.499 3.935 1.00 24.43 H new ATOM 0 HD11 LEU C 266 11.392 -4.571 4.359 1.00 25.32 H new ATOM 0 HD12 LEU C 266 10.453 -5.275 5.697 1.00 25.32 H new ATOM 0 HD13 LEU C 266 11.304 -6.338 4.551 1.00 25.32 H new ATOM 0 HD21 LEU C 266 10.653 -4.810 2.080 1.00 14.41 H new ATOM 0 HD22 LEU C 266 10.475 -6.573 2.244 1.00 14.41 H new ATOM 0 HD23 LEU C 266 9.097 -5.587 1.699 1.00 14.41 H new ATOM 2808 N ASN C 267 8.086 -8.256 7.460 1.00 4.22 N ATOM 2809 CA ASN C 267 8.675 -9.176 8.462 1.00 40.35 C ATOM 2810 C ASN C 267 9.395 -8.436 9.622 1.00 65.11 C ATOM 2811 O ASN C 267 9.784 -9.048 10.630 1.00 72.43 O ATOM 2812 CB ASN C 267 9.618 -10.190 7.773 1.00 10.15 C ATOM 2813 CG ASN C 267 10.014 -11.357 8.664 1.00 34.44 C ATOM 2814 OD1 ASN C 267 9.305 -12.358 8.724 1.00 54.52 O ATOM 2815 ND2 ASN C 267 11.141 -11.267 9.328 1.00 45.23 N ATOM 0 H ASN C 267 7.067 -8.240 7.491 1.00 4.22 H new ATOM 0 HA ASN C 267 7.847 -9.717 8.921 1.00 40.35 H new ATOM 0 HB2 ASN C 267 9.130 -10.576 6.878 1.00 10.15 H new ATOM 0 HB3 ASN C 267 10.519 -9.671 7.446 1.00 10.15 H new ATOM 0 HD21 ASN C 267 11.450 -12.042 9.915 1.00 45.23 H new ATOM 0 HD22 ASN C 267 11.708 -10.422 9.258 1.00 45.23 H new ATOM 2822 N LYS C 268 9.552 -7.133 9.497 1.00 61.54 N ATOM 2823 CA LYS C 268 10.241 -6.349 10.520 1.00 24.32 C ATOM 2824 C LYS C 268 9.294 -5.996 11.670 1.00 64.22 C ATOM 2825 O LYS C 268 8.149 -6.503 11.738 1.00 54.21 O ATOM 2826 CB LYS C 268 10.839 -5.068 9.929 1.00 14.02 C ATOM 2827 CG LYS C 268 11.712 -5.290 8.708 1.00 41.44 C ATOM 2828 CD LYS C 268 12.473 -4.023 8.307 1.00 23.35 C ATOM 2829 CE LYS C 268 13.322 -4.269 7.068 1.00 53.00 C ATOM 2830 NZ LYS C 268 14.112 -3.077 6.642 1.00 41.33 N ATOM 0 H LYS C 268 9.215 -6.590 8.702 1.00 61.54 H new ATOM 0 HA LYS C 268 11.053 -6.964 10.908 1.00 24.32 H new ATOM 0 HB2 LYS C 268 10.027 -4.392 9.662 1.00 14.02 H new ATOM 0 HB3 LYS C 268 11.430 -4.569 10.697 1.00 14.02 H new ATOM 0 HG2 LYS C 268 12.423 -6.090 8.912 1.00 41.44 H new ATOM 0 HG3 LYS C 268 11.092 -5.619 7.874 1.00 41.44 H new ATOM 0 HD2 LYS C 268 11.767 -3.215 8.114 1.00 23.35 H new ATOM 0 HD3 LYS C 268 13.110 -3.700 9.131 1.00 23.35 H new ATOM 0 HE2 LYS C 268 14.004 -5.096 7.263 1.00 53.00 H new ATOM 0 HE3 LYS C 268 12.673 -4.577 6.248 1.00 53.00 H new ATOM 0 HZ1 LYS C 268 14.918 -3.384 6.062 1.00 41.33 H new ATOM 0 HZ2 LYS C 268 13.507 -2.441 6.085 1.00 41.33 H new ATOM 0 HZ3 LYS C 268 14.462 -2.574 7.482 1.00 41.33 H new ATOM 2914 N ILE D 306 3.381 -4.531 -11.528 1.00 53.10 N ATOM 2915 CA ILE D 306 1.952 -4.532 -11.305 1.00 24.14 C ATOM 2916 C ILE D 306 1.376 -5.965 -11.176 1.00 64.02 C ATOM 2917 O ILE D 306 2.098 -6.966 -11.316 1.00 34.54 O ATOM 2918 CB ILE D 306 1.195 -3.757 -12.400 1.00 22.24 C ATOM 2919 CG1 ILE D 306 1.263 -4.463 -13.747 1.00 32.24 C ATOM 2920 CG2 ILE D 306 1.756 -2.348 -12.525 1.00 24.32 C ATOM 2921 CD1 ILE D 306 0.472 -3.759 -14.815 1.00 64.03 C ATOM 0 HA ILE D 306 1.800 -4.020 -10.355 1.00 24.14 H new ATOM 0 HB ILE D 306 0.147 -3.710 -12.103 1.00 22.24 H new ATOM 0 HG12 ILE D 306 2.304 -4.536 -14.061 1.00 32.24 H new ATOM 0 HG13 ILE D 306 0.891 -5.482 -13.637 1.00 32.24 H new ATOM 0 HG21 ILE D 306 1.214 -1.808 -13.302 1.00 24.32 H new ATOM 0 HG22 ILE D 306 1.644 -1.826 -11.575 1.00 24.32 H new ATOM 0 HG23 ILE D 306 2.812 -2.399 -12.788 1.00 24.32 H new ATOM 0 HD11 ILE D 306 0.558 -4.308 -15.753 1.00 64.03 H new ATOM 0 HD12 ILE D 306 -0.576 -3.709 -14.518 1.00 64.03 H new ATOM 0 HD13 ILE D 306 0.860 -2.749 -14.949 1.00 64.03 H new ATOM 2933 N TYR D 307 0.078 -6.038 -10.951 1.00 64.32 N ATOM 2934 CA TYR D 307 -0.650 -7.286 -10.675 1.00 70.01 C ATOM 2935 C TYR D 307 -1.128 -7.917 -11.991 1.00 24.14 C ATOM 2936 O TYR D 307 -2.020 -8.756 -11.990 1.00 23.02 O ATOM 2937 CB TYR D 307 -1.912 -6.913 -9.898 1.00 21.13 C ATOM 2938 CG TYR D 307 -1.733 -5.879 -8.861 1.00 40.54 C ATOM 2939 CD1 TYR D 307 -1.323 -6.215 -7.602 1.00 25.44 C ATOM 2940 CD2 TYR D 307 -2.004 -4.555 -9.146 1.00 71.41 C ATOM 2941 CE1 TYR D 307 -1.189 -5.277 -6.639 1.00 43.40 C ATOM 2942 CE2 TYR D 307 -1.878 -3.599 -8.201 1.00 32.01 C ATOM 2943 CZ TYR D 307 -1.472 -3.958 -6.937 1.00 72.25 C ATOM 2944 OH TYR D 307 -1.349 -3.012 -5.984 1.00 31.03 O ATOM 0 H TYR D 307 -0.525 -5.216 -10.953 1.00 64.32 H new ATOM 0 HA TYR D 307 -0.001 -7.975 -10.133 1.00 70.01 H new ATOM 0 HB2 TYR D 307 -2.665 -6.567 -10.606 1.00 21.13 H new ATOM 0 HB3 TYR D 307 -2.307 -7.813 -9.426 1.00 21.13 H new ATOM 0 HD1 TYR D 307 -1.102 -7.247 -7.373 1.00 25.44 H new ATOM 0 HD2 TYR D 307 -2.322 -4.280 -10.141 1.00 71.41 H new ATOM 0 HE1 TYR D 307 -0.864 -5.555 -5.647 1.00 43.40 H new ATOM 0 HE2 TYR D 307 -2.093 -2.567 -8.434 1.00 32.01 H new ATOM 0 HH TYR D 307 -1.290 -3.440 -5.104 1.00 31.03 H new ATOM 2954 N THR D 308 -0.514 -7.518 -13.095 1.00 34.32 N ATOM 2955 CA THR D 308 -0.993 -7.870 -14.422 1.00 62.41 C ATOM 2956 C THR D 308 -2.402 -7.268 -14.614 1.00 13.22 C ATOM 2957 O THR D 308 -3.430 -7.967 -14.631 1.00 32.55 O ATOM 2958 CB THR D 308 -0.949 -9.403 -14.705 1.00 23.22 C ATOM 2959 OG1 THR D 308 0.403 -9.872 -14.493 1.00 13.12 O ATOM 2960 CG2 THR D 308 -1.347 -9.707 -16.149 1.00 53.34 C ATOM 0 H THR D 308 0.328 -6.943 -13.096 1.00 34.32 H new ATOM 0 HA THR D 308 -0.317 -7.442 -15.162 1.00 62.41 H new ATOM 0 HB THR D 308 -1.650 -9.902 -14.036 1.00 23.22 H new ATOM 0 HG1 THR D 308 0.446 -10.836 -14.666 1.00 13.12 H new ATOM 0 HG21 THR D 308 -1.308 -10.783 -16.318 1.00 53.34 H new ATOM 0 HG22 THR D 308 -2.360 -9.348 -16.330 1.00 53.34 H new ATOM 0 HG23 THR D 308 -0.658 -9.207 -16.829 1.00 53.34 H new ATOM 2968 N SER D 309 -2.403 -5.948 -14.655 1.00 65.44 N ATOM 2969 CA SER D 309 -3.573 -5.114 -14.761 1.00 10.33 C ATOM 2970 C SER D 309 -3.082 -3.683 -14.645 1.00 3.30 C ATOM 2971 O SER D 309 -2.636 -3.273 -13.577 1.00 54.01 O ATOM 2972 CB SER D 309 -4.569 -5.422 -13.609 1.00 14.14 C ATOM 2973 OG SER D 309 -5.747 -4.635 -13.703 1.00 43.11 O ATOM 0 H SER D 309 -1.540 -5.407 -14.613 1.00 65.44 H new ATOM 0 HA SER D 309 -4.095 -5.289 -15.702 1.00 10.33 H new ATOM 0 HB2 SER D 309 -4.836 -6.479 -13.632 1.00 14.14 H new ATOM 0 HB3 SER D 309 -4.084 -5.237 -12.651 1.00 14.14 H new ATOM 0 HG SER D 309 -6.349 -4.858 -12.963 1.00 43.11 H new ATOM 2979 N ASP D 310 -3.108 -2.958 -15.735 1.00 22.51 N ATOM 2980 CA ASP D 310 -2.622 -1.584 -15.751 1.00 53.01 C ATOM 2981 C ASP D 310 -3.609 -0.711 -15.018 1.00 13.25 C ATOM 2982 O ASP D 310 -3.242 0.056 -14.127 1.00 73.44 O ATOM 2983 CB ASP D 310 -2.443 -1.097 -17.192 1.00 53.23 C ATOM 2984 CG ASP D 310 -1.499 -1.973 -17.983 1.00 5.13 C ATOM 2985 OD1 ASP D 310 -0.276 -1.753 -17.946 1.00 61.31 O ATOM 2986 OD2 ASP D 310 -1.975 -2.918 -18.663 1.00 63.42 O ATOM 0 H ASP D 310 -3.461 -3.291 -16.632 1.00 22.51 H new ATOM 0 HA ASP D 310 -1.652 -1.533 -15.257 1.00 53.01 H new ATOM 0 HB2 ASP D 310 -3.413 -1.073 -17.688 1.00 53.23 H new ATOM 0 HB3 ASP D 310 -2.064 -0.075 -17.183 1.00 53.23 H new ATOM 2991 N ASN D 311 -4.867 -0.852 -15.410 1.00 61.20 N ATOM 2992 CA ASN D 311 -6.022 -0.209 -14.773 1.00 14.23 C ATOM 2993 C ASN D 311 -6.021 1.334 -14.878 1.00 5.31 C ATOM 2994 O ASN D 311 -6.819 1.904 -15.624 1.00 11.44 O ATOM 2995 CB ASN D 311 -6.177 -0.687 -13.314 1.00 71.42 C ATOM 2996 CG ASN D 311 -7.449 -0.200 -12.662 1.00 25.31 C ATOM 2997 OD1 ASN D 311 -8.463 0.014 -13.326 1.00 32.14 O ATOM 2998 ND2 ASN D 311 -7.427 -0.048 -11.368 1.00 3.11 N ATOM 0 H ASN D 311 -5.127 -1.435 -16.206 1.00 61.20 H new ATOM 0 HA ASN D 311 -6.898 -0.527 -15.338 1.00 14.23 H new ATOM 0 HB2 ASN D 311 -6.158 -1.777 -13.291 1.00 71.42 H new ATOM 0 HB3 ASN D 311 -5.322 -0.341 -12.732 1.00 71.42 H new ATOM 0 HD21 ASN D 311 -8.267 0.257 -10.876 1.00 3.11 H new ATOM 0 HD22 ASN D 311 -6.570 -0.234 -10.847 1.00 3.11 H new ATOM 3124 N TYR D 321 1.451 17.928 -2.249 1.00 73.44 N ATOM 3125 CA TYR D 321 0.850 18.595 -1.086 1.00 72.10 C ATOM 3126 C TYR D 321 1.763 19.738 -0.671 1.00 73.44 C ATOM 3127 O TYR D 321 1.307 20.857 -0.425 1.00 74.41 O ATOM 3128 CB TYR D 321 0.713 17.563 0.073 1.00 62.31 C ATOM 3129 CG TYR D 321 -0.158 17.941 1.260 1.00 0.24 C ATOM 3130 CD1 TYR D 321 0.212 18.891 2.198 1.00 73.42 C ATOM 3131 CD2 TYR D 321 -1.352 17.283 1.440 1.00 51.22 C ATOM 3132 CE1 TYR D 321 -0.613 19.168 3.288 1.00 51.25 C ATOM 3133 CE2 TYR D 321 -2.181 17.533 2.496 1.00 41.02 C ATOM 3134 CZ TYR D 321 -1.815 18.479 3.430 1.00 23.32 C ATOM 3135 OH TYR D 321 -2.647 18.746 4.497 1.00 13.33 O ATOM 0 HA TYR D 321 -0.138 18.986 -1.328 1.00 72.10 H new ATOM 0 HB2 TYR D 321 0.322 16.637 -0.348 1.00 62.31 H new ATOM 0 HB3 TYR D 321 1.713 17.345 0.448 1.00 62.31 H new ATOM 0 HD1 TYR D 321 1.146 19.421 2.084 1.00 73.42 H new ATOM 0 HD2 TYR D 321 -1.646 16.538 0.716 1.00 51.22 H new ATOM 0 HE1 TYR D 321 -0.322 19.911 4.016 1.00 51.25 H new ATOM 0 HE2 TYR D 321 -3.112 16.996 2.598 1.00 41.02 H new ATOM 0 HH TYR D 321 -3.443 18.177 4.442 1.00 13.33 H new ATOM 3145 N ASP D 322 3.063 19.434 -0.647 1.00 53.22 N ATOM 3146 CA ASP D 322 4.121 20.377 -0.304 1.00 53.05 C ATOM 3147 C ASP D 322 5.455 19.666 -0.248 1.00 44.35 C ATOM 3148 O ASP D 322 5.607 18.731 0.519 1.00 54.40 O ATOM 3149 CB ASP D 322 3.877 21.053 1.052 1.00 54.15 C ATOM 3150 CG ASP D 322 4.993 22.001 1.426 1.00 43.41 C ATOM 3151 OD1 ASP D 322 4.924 23.184 1.062 1.00 21.32 O ATOM 3152 OD2 ASP D 322 5.960 21.569 2.092 1.00 13.00 O ATOM 0 H ASP D 322 3.413 18.503 -0.871 1.00 53.22 H new ATOM 0 HA ASP D 322 4.124 21.143 -1.080 1.00 53.05 H new ATOM 0 HB2 ASP D 322 2.934 21.599 1.019 1.00 54.15 H new ATOM 0 HB3 ASP D 322 3.777 20.290 1.824 1.00 54.15 H new ATOM 3157 N SER D 323 6.373 20.083 -1.098 1.00 1.04 N ATOM 3158 CA SER D 323 7.789 19.660 -1.078 1.00 1.25 C ATOM 3159 C SER D 323 7.988 18.134 -1.257 1.00 10.15 C ATOM 3160 O SER D 323 7.964 17.370 -0.280 1.00 73.11 O ATOM 3161 CB SER D 323 8.455 20.130 0.220 1.00 23.14 C ATOM 3162 OG SER D 323 8.214 21.521 0.453 1.00 14.53 O ATOM 0 H SER D 323 6.165 20.743 -1.847 1.00 1.04 H new ATOM 0 HA SER D 323 8.263 20.131 -1.939 1.00 1.25 H new ATOM 0 HB2 SER D 323 8.074 19.547 1.059 1.00 23.14 H new ATOM 0 HB3 SER D 323 9.528 19.948 0.167 1.00 23.14 H new ATOM 0 HG SER D 323 7.436 21.624 1.040 1.00 14.53 H new ATOM 3168 N MET D 324 8.177 17.708 -2.500 1.00 11.52 N ATOM 3169 CA MET D 324 8.364 16.287 -2.840 1.00 42.32 C ATOM 3170 C MET D 324 9.593 15.700 -2.138 1.00 70.05 C ATOM 3171 O MET D 324 10.645 16.347 -2.052 1.00 61.03 O ATOM 3172 CB MET D 324 8.458 16.082 -4.365 1.00 53.14 C ATOM 3173 CG MET D 324 9.622 16.802 -5.041 1.00 13.25 C ATOM 3174 SD MET D 324 9.691 16.515 -6.830 1.00 64.15 S ATOM 3175 CE MET D 324 8.097 17.166 -7.348 1.00 75.02 C ATOM 0 H MET D 324 8.206 18.331 -3.307 1.00 11.52 H new ATOM 0 HA MET D 324 7.485 15.751 -2.481 1.00 42.32 H new ATOM 0 HB2 MET D 324 8.543 15.015 -4.569 1.00 53.14 H new ATOM 0 HB3 MET D 324 7.527 16.420 -4.820 1.00 53.14 H new ATOM 0 HG2 MET D 324 9.538 17.872 -4.853 1.00 13.25 H new ATOM 0 HG3 MET D 324 10.558 16.472 -4.589 1.00 13.25 H new ATOM 0 HE1 MET D 324 8.210 17.696 -8.294 1.00 75.02 H new ATOM 0 HE2 MET D 324 7.392 16.344 -7.474 1.00 75.02 H new ATOM 0 HE3 MET D 324 7.721 17.853 -6.590 1.00 75.02 H new ATOM 3185 N LYS D 325 9.466 14.489 -1.639 1.00 41.22 N ATOM 3186 CA LYS D 325 10.536 13.867 -0.880 1.00 24.31 C ATOM 3187 C LYS D 325 11.144 12.691 -1.646 1.00 11.45 C ATOM 3188 O LYS D 325 10.727 12.402 -2.781 1.00 1.24 O ATOM 3189 CB LYS D 325 10.019 13.432 0.504 1.00 5.41 C ATOM 3190 CG LYS D 325 9.415 14.535 1.378 1.00 74.23 C ATOM 3191 CD LYS D 325 10.461 15.361 2.092 1.00 41.34 C ATOM 3192 CE LYS D 325 11.276 16.274 1.177 1.00 44.42 C ATOM 3193 NZ LYS D 325 12.240 17.099 1.915 1.00 65.20 N ATOM 0 H LYS D 325 8.631 13.912 -1.744 1.00 41.22 H new ATOM 0 HA LYS D 325 11.330 14.599 -0.733 1.00 24.31 H new ATOM 0 HB2 LYS D 325 9.265 12.658 0.360 1.00 5.41 H new ATOM 0 HB3 LYS D 325 10.845 12.976 1.050 1.00 5.41 H new ATOM 0 HG2 LYS D 325 8.804 15.190 0.757 1.00 74.23 H new ATOM 0 HG3 LYS D 325 8.750 14.084 2.115 1.00 74.23 H new ATOM 0 HD2 LYS D 325 9.970 15.971 2.850 1.00 41.34 H new ATOM 0 HD3 LYS D 325 11.142 14.690 2.615 1.00 41.34 H new ATOM 0 HE2 LYS D 325 11.809 15.667 0.445 1.00 44.42 H new ATOM 0 HE3 LYS D 325 10.599 16.923 0.621 1.00 44.42 H new ATOM 0 HZ1 LYS D 325 12.766 17.699 1.248 1.00 65.20 H new ATOM 0 HZ2 LYS D 325 11.733 17.700 2.596 1.00 65.20 H new ATOM 0 HZ3 LYS D 325 12.905 16.483 2.425 1.00 65.20 H new ATOM 3207 N GLU D 326 12.143 12.038 -1.042 1.00 12.23 N ATOM 3208 CA GLU D 326 12.839 10.920 -1.648 1.00 50.14 C ATOM 3209 C GLU D 326 13.813 10.267 -0.674 1.00 54.35 C ATOM 3210 O GLU D 326 14.585 10.953 0.003 1.00 41.10 O ATOM 3211 CB GLU D 326 13.541 11.325 -2.958 1.00 3.14 C ATOM 3212 CG GLU D 326 14.510 12.484 -2.850 1.00 1.50 C ATOM 3213 CD GLU D 326 15.058 12.876 -4.192 1.00 22.45 C ATOM 3214 OE1 GLU D 326 14.398 13.659 -4.905 1.00 1.43 O ATOM 3215 OE2 GLU D 326 16.147 12.390 -4.573 1.00 64.01 O ATOM 0 H GLU D 326 12.486 12.280 -0.112 1.00 12.23 H new ATOM 0 HA GLU D 326 12.084 10.176 -1.902 1.00 50.14 H new ATOM 0 HB2 GLU D 326 14.080 10.459 -3.343 1.00 3.14 H new ATOM 0 HB3 GLU D 326 12.779 11.580 -3.694 1.00 3.14 H new ATOM 0 HG2 GLU D 326 14.006 13.339 -2.399 1.00 1.50 H new ATOM 0 HG3 GLU D 326 15.331 12.211 -2.187 1.00 1.50 H new ATOM 3222 N PRO D 327 13.789 8.937 -0.576 1.00 12.13 N ATOM 3223 CA PRO D 327 14.672 8.200 0.299 1.00 30.22 C ATOM 3224 C PRO D 327 16.109 8.200 -0.202 1.00 54.24 C ATOM 3225 O PRO D 327 16.458 7.561 -1.207 1.00 75.41 O ATOM 3226 CB PRO D 327 14.114 6.795 0.255 1.00 63.24 C ATOM 3227 CG PRO D 327 13.563 6.720 -1.104 1.00 1.32 C ATOM 3228 CD PRO D 327 12.888 8.027 -1.296 1.00 71.45 C ATOM 0 HA PRO D 327 14.709 8.634 1.298 1.00 30.22 H new ATOM 0 HB2 PRO D 327 14.887 6.045 0.422 1.00 63.24 H new ATOM 0 HB3 PRO D 327 13.348 6.638 1.014 1.00 63.24 H new ATOM 0 HG2 PRO D 327 14.348 6.565 -1.844 1.00 1.32 H new ATOM 0 HG3 PRO D 327 12.862 5.891 -1.204 1.00 1.32 H new ATOM 0 HD2 PRO D 327 12.798 8.290 -2.350 1.00 71.45 H new ATOM 0 HD3 PRO D 327 11.881 8.033 -0.878 1.00 71.45 H new