USER MOD reduce.3.24.130724 H: found=0, std=0, add=1146, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1154 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: C 227 LYS NZ :NH3+ 165:sc= 1.54 (180deg=-0.12) USER MOD Set 1.2: C 248 GLN : amide:sc= 1.12 K(o=2.7,f=-5!) USER MOD Set 1.3: D 312 TYR OH : rot -140:sc= 0.0143 USER MOD Set 2.1: A 16 SER OG : rot -130:sc= -1.24 USER MOD Set 2.2: A 17 HIS : no HD1:sc= 0 X(o=-1.2,f=-1.2) USER MOD Single : A 22 ASN :FLIP amide:sc= -1.18 F(o=-2,f=-1.2) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -0.0949 X(o=-0.095,f=-0.12) USER MOD Single : A 27 LYS NZ :NH3+ -113:sc= -0.075 (180deg=-1.28) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=-0.084) USER MOD Single : A 31 THR OG1 : rot 127:sc= -2.36! USER MOD Single : A 33 ASN : amide:sc= -0.315 X(o=-0.31,f=-0.49) USER MOD Single : A 37 GLN : amide:sc= -4.47! C(o=-4.5!,f=-7.2!) USER MOD Single : A 43 LYS NZ :NH3+ 169:sc=-0.00677 (180deg=-0.168) USER MOD Single : A 48 GLN : amide:sc=-0.00964 K(o=-0.0096,f=-0.94) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN :FLIP amide:sc= -3.29 F(o=-4.3!,f=-3.3) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ -166:sc= 1.09 (180deg=0.95) USER MOD Single : A 67 ASN : amide:sc= -0.0975 K(o=-0.098,f=-3.8!) USER MOD Single : B 116 MET CE :methyl -160:sc= -0.174 (180deg=-0.724) USER MOD Single : B 118 SER OG : rot 180:sc= 0 USER MOD Single : B 123 SER OG : rot -16:sc= 1.14 USER MOD Single : B 124 MET CE :methyl -164:sc= -0.0594 (180deg=-0.437) USER MOD Single : B 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 216 SER OG : rot 148:sc= -0.99! USER MOD Single : C 217 HIS : no HD1:sc= -1.25 X(o=-1.2,f=-1.4) USER MOD Single : C 222 ASN : amide:sc= -0.376 X(o=-0.38,f=-0.48) USER MOD Single : C 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 225 HIS : no HD1:sc= -0.0621 X(o=-0.062,f=-0.023) USER MOD Single : C 230 ASN : amide:sc= 0.125 K(o=0.13,f=-4.4!) USER MOD Single : C 231 THR OG1 : rot 179:sc= 1.26 USER MOD Single : C 233 ASN : amide:sc= -0.164 X(o=-0.16,f=-0.4) USER MOD Single : C 237 GLN :FLIP amide:sc= -3.5! C(o=-4.2!,f=-3.5!) USER MOD Single : C 243 LYS NZ :NH3+ 172:sc= -0.0167 (180deg=-0.11) USER MOD Single : C 254 LYS NZ :NH3+ 179:sc= 0.79! (180deg=0.751!) USER MOD Single : C 256 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 259 GLN : amide:sc= -2.96 X(o=-3,f=-2.9!) USER MOD Single : C 261 TYR OH : rot 180:sc= 0 USER MOD Single : C 264 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 267 ASN : amide:sc= -0.0254 X(o=-0.025,f=0) USER MOD Single : D 313 THR OG1 : rot 180:sc= 0.0355 USER MOD Single : D 316 MET CE :methyl -161:sc= -0.0954 (180deg=-0.585) USER MOD Single : D 318 SER OG : rot 180:sc= 0 USER MOD Single : D 323 SER OG : rot 41:sc= -0.0605 USER MOD Single : D 324 MET CE :methyl -156:sc= -0.249 (180deg=-0.933) USER MOD Single : D 325 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 115 N ARG A 8 13.338 -7.171 12.446 1.00 2.21 N ATOM 116 CA ARG A 8 12.127 -7.926 12.721 1.00 42.42 C ATOM 117 C ARG A 8 11.159 -7.655 11.588 1.00 34.45 C ATOM 118 O ARG A 8 11.354 -6.703 10.850 1.00 65.44 O ATOM 119 CB ARG A 8 11.497 -7.474 14.045 1.00 4.50 C ATOM 120 CG ARG A 8 12.359 -7.686 15.277 1.00 65.50 C ATOM 121 CD ARG A 8 12.631 -9.155 15.516 1.00 40.12 C ATOM 122 NE ARG A 8 13.511 -9.362 16.661 1.00 72.21 N ATOM 123 CZ ARG A 8 13.937 -10.553 17.083 1.00 1.13 C ATOM 124 NH1 ARG A 8 13.511 -11.669 16.490 1.00 42.22 N ATOM 125 NH2 ARG A 8 14.779 -10.623 18.098 1.00 44.23 N ATOM 0 HA ARG A 8 12.359 -8.988 12.801 1.00 42.42 H new ATOM 0 HB2 ARG A 8 11.253 -6.414 13.970 1.00 4.50 H new ATOM 0 HB3 ARG A 8 10.557 -8.008 14.183 1.00 4.50 H new ATOM 0 HG2 ARG A 8 13.303 -7.155 15.158 1.00 65.50 H new ATOM 0 HG3 ARG A 8 11.861 -7.260 16.148 1.00 65.50 H new ATOM 0 HD2 ARG A 8 11.689 -9.677 15.682 1.00 40.12 H new ATOM 0 HD3 ARG A 8 13.084 -9.591 14.625 1.00 40.12 H new ATOM 0 HE ARG A 8 13.822 -8.538 17.175 1.00 72.21 H new ATOM 0 HH11 ARG A 8 12.856 -11.614 15.710 1.00 42.22 H new ATOM 0 HH12 ARG A 8 13.840 -12.578 16.817 1.00 42.22 H new ATOM 0 HH21 ARG A 8 15.100 -9.769 18.554 1.00 44.23 H new ATOM 0 HH22 ARG A 8 15.109 -11.531 18.426 1.00 44.23 H new ATOM 139 N CYS A 9 10.152 -8.470 11.432 1.00 11.21 N ATOM 140 CA CYS A 9 9.150 -8.238 10.391 1.00 72.10 C ATOM 141 C CYS A 9 7.993 -7.435 10.985 1.00 73.32 C ATOM 142 O CYS A 9 7.748 -7.532 12.185 1.00 1.11 O ATOM 143 CB CYS A 9 8.642 -9.571 9.831 1.00 24.35 C ATOM 144 SG CYS A 9 9.924 -10.610 9.037 1.00 32.52 S ATOM 0 H CYS A 9 9.991 -9.301 12.002 1.00 11.21 H new ATOM 0 HA CYS A 9 9.600 -7.677 9.572 1.00 72.10 H new ATOM 0 HB2 CYS A 9 8.185 -10.139 10.642 1.00 24.35 H new ATOM 0 HB3 CYS A 9 7.857 -9.367 9.103 1.00 24.35 H new ATOM 149 N PRO A 10 7.272 -6.602 10.158 1.00 62.15 N ATOM 150 CA PRO A 10 6.179 -5.754 10.652 1.00 1.15 C ATOM 151 C PRO A 10 5.121 -6.582 11.350 1.00 4.03 C ATOM 152 O PRO A 10 4.751 -6.304 12.479 1.00 21.42 O ATOM 153 CB PRO A 10 5.616 -5.075 9.389 1.00 45.23 C ATOM 154 CG PRO A 10 6.176 -5.840 8.237 1.00 21.24 C ATOM 155 CD PRO A 10 7.467 -6.445 8.706 1.00 62.03 C ATOM 0 HA PRO A 10 6.519 -5.028 11.390 1.00 1.15 H new ATOM 0 HB2 PRO A 10 4.526 -5.100 9.383 1.00 45.23 H new ATOM 0 HB3 PRO A 10 5.911 -4.027 9.343 1.00 45.23 H new ATOM 0 HG2 PRO A 10 5.481 -6.615 7.913 1.00 21.24 H new ATOM 0 HG3 PRO A 10 6.344 -5.185 7.382 1.00 21.24 H new ATOM 0 HD2 PRO A 10 7.660 -7.402 8.222 1.00 62.03 H new ATOM 0 HD3 PRO A 10 8.316 -5.799 8.484 1.00 62.03 H new ATOM 163 N CYS A 11 4.658 -7.592 10.676 1.00 5.12 N ATOM 164 CA CYS A 11 3.785 -8.542 11.260 1.00 13.42 C ATOM 165 C CYS A 11 4.486 -9.872 11.271 1.00 32.13 C ATOM 166 O CYS A 11 5.236 -10.209 10.341 1.00 43.20 O ATOM 167 CB CYS A 11 2.454 -8.651 10.502 1.00 15.31 C ATOM 168 SG CYS A 11 1.429 -7.136 10.493 1.00 40.12 S ATOM 0 H CYS A 11 4.883 -7.773 9.698 1.00 5.12 H new ATOM 0 HA CYS A 11 3.542 -8.221 12.273 1.00 13.42 H new ATOM 0 HB2 CYS A 11 2.665 -8.932 9.470 1.00 15.31 H new ATOM 0 HB3 CYS A 11 1.871 -9.461 10.940 1.00 15.31 H new ATOM 173 N ARG A 12 4.287 -10.612 12.310 1.00 54.24 N ATOM 174 CA ARG A 12 4.871 -11.918 12.414 1.00 14.34 C ATOM 175 C ARG A 12 3.929 -12.919 11.789 1.00 51.42 C ATOM 176 O ARG A 12 4.318 -14.030 11.425 1.00 1.22 O ATOM 177 CB ARG A 12 5.187 -12.236 13.878 1.00 32.12 C ATOM 178 CG ARG A 12 6.217 -11.267 14.449 1.00 74.13 C ATOM 179 CD ARG A 12 6.497 -11.477 15.925 1.00 72.02 C ATOM 180 NE ARG A 12 6.959 -12.825 16.239 1.00 35.15 N ATOM 181 CZ ARG A 12 7.976 -13.118 17.063 1.00 63.42 C ATOM 182 NH1 ARG A 12 8.786 -12.165 17.510 1.00 4.42 N ATOM 183 NH2 ARG A 12 8.197 -14.370 17.410 1.00 60.43 N ATOM 0 H ARG A 12 3.719 -10.335 13.110 1.00 54.24 H new ATOM 0 HA ARG A 12 5.817 -11.964 11.875 1.00 14.34 H new ATOM 0 HB2 ARG A 12 4.272 -12.186 14.468 1.00 32.12 H new ATOM 0 HB3 ARG A 12 5.562 -13.256 13.957 1.00 32.12 H new ATOM 0 HG2 ARG A 12 7.149 -11.371 13.893 1.00 74.13 H new ATOM 0 HG3 ARG A 12 5.867 -10.246 14.296 1.00 74.13 H new ATOM 0 HD2 ARG A 12 7.248 -10.758 16.251 1.00 72.02 H new ATOM 0 HD3 ARG A 12 5.590 -11.270 16.493 1.00 72.02 H new ATOM 0 HE ARG A 12 6.471 -13.605 15.798 1.00 35.15 H new ATOM 0 HH11 ARG A 12 8.639 -11.196 17.227 1.00 4.42 H new ATOM 0 HH12 ARG A 12 9.555 -12.402 18.136 1.00 4.42 H new ATOM 0 HH21 ARG A 12 7.596 -15.112 17.052 1.00 60.43 H new ATOM 0 HH22 ARG A 12 8.969 -14.597 18.036 1.00 60.43 H new ATOM 197 N PHE A 13 2.680 -12.494 11.650 1.00 5.54 N ATOM 198 CA PHE A 13 1.652 -13.272 11.020 1.00 55.21 C ATOM 199 C PHE A 13 0.856 -12.381 10.087 1.00 53.33 C ATOM 200 O PHE A 13 0.421 -11.303 10.475 1.00 64.20 O ATOM 201 CB PHE A 13 0.711 -13.895 12.063 1.00 34.03 C ATOM 202 CG PHE A 13 1.370 -14.868 13.000 1.00 41.13 C ATOM 203 CD1 PHE A 13 2.030 -14.425 14.134 1.00 24.42 C ATOM 204 CD2 PHE A 13 1.326 -16.227 12.744 1.00 72.01 C ATOM 205 CE1 PHE A 13 2.633 -15.313 14.990 1.00 33.54 C ATOM 206 CE2 PHE A 13 1.929 -17.125 13.602 1.00 53.10 C ATOM 207 CZ PHE A 13 2.583 -16.666 14.728 1.00 31.12 C ATOM 0 H PHE A 13 2.360 -11.584 11.981 1.00 5.54 H new ATOM 0 HA PHE A 13 2.122 -14.080 10.460 1.00 55.21 H new ATOM 0 HB2 PHE A 13 0.260 -13.095 12.650 1.00 34.03 H new ATOM 0 HB3 PHE A 13 -0.100 -14.405 11.543 1.00 34.03 H new ATOM 0 HD1 PHE A 13 2.071 -13.367 14.348 1.00 24.42 H new ATOM 0 HD2 PHE A 13 0.815 -16.589 11.864 1.00 72.01 H new ATOM 0 HE1 PHE A 13 3.147 -14.952 15.869 1.00 33.54 H new ATOM 0 HE2 PHE A 13 1.889 -18.184 13.393 1.00 53.10 H new ATOM 0 HZ PHE A 13 3.055 -17.365 15.402 1.00 31.12 H new ATOM 217 N PHE A 14 0.687 -12.831 8.884 1.00 72.00 N ATOM 218 CA PHE A 14 -0.082 -12.143 7.866 1.00 10.55 C ATOM 219 C PHE A 14 -1.319 -12.953 7.553 1.00 2.21 C ATOM 220 O PHE A 14 -1.276 -14.160 7.578 1.00 44.23 O ATOM 221 CB PHE A 14 0.787 -11.843 6.628 1.00 64.13 C ATOM 222 CG PHE A 14 1.768 -12.935 6.291 1.00 43.11 C ATOM 223 CD1 PHE A 14 1.357 -14.116 5.720 1.00 35.50 C ATOM 224 CD2 PHE A 14 3.118 -12.770 6.584 1.00 14.13 C ATOM 225 CE1 PHE A 14 2.264 -15.111 5.438 1.00 35.22 C ATOM 226 CE2 PHE A 14 4.027 -13.764 6.305 1.00 23.13 C ATOM 227 CZ PHE A 14 3.601 -14.937 5.730 1.00 63.22 C ATOM 0 H PHE A 14 1.087 -13.712 8.562 1.00 72.00 H new ATOM 0 HA PHE A 14 -0.410 -11.170 8.233 1.00 10.55 H new ATOM 0 HB2 PHE A 14 0.135 -11.677 5.770 1.00 64.13 H new ATOM 0 HB3 PHE A 14 1.335 -10.916 6.797 1.00 64.13 H new ATOM 0 HD1 PHE A 14 0.312 -14.264 5.491 1.00 35.50 H new ATOM 0 HD2 PHE A 14 3.457 -11.850 7.036 1.00 14.13 H new ATOM 0 HE1 PHE A 14 1.928 -16.032 4.986 1.00 35.22 H new ATOM 0 HE2 PHE A 14 5.072 -13.623 6.537 1.00 23.13 H new ATOM 0 HZ PHE A 14 4.311 -15.720 5.507 1.00 63.22 H new ATOM 237 N GLU A 15 -2.408 -12.294 7.296 1.00 44.13 N ATOM 238 CA GLU A 15 -3.687 -12.937 7.196 1.00 21.41 C ATOM 239 C GLU A 15 -4.238 -12.907 5.786 1.00 72.30 C ATOM 240 O GLU A 15 -3.939 -12.010 4.995 1.00 73.24 O ATOM 241 CB GLU A 15 -4.619 -12.227 8.165 1.00 13.32 C ATOM 242 CG GLU A 15 -4.070 -12.258 9.578 1.00 2.13 C ATOM 243 CD GLU A 15 -4.798 -11.397 10.570 1.00 12.10 C ATOM 244 OE1 GLU A 15 -5.747 -11.893 11.216 1.00 13.24 O ATOM 245 OE2 GLU A 15 -4.374 -10.253 10.792 1.00 51.22 O ATOM 0 H GLU A 15 -2.436 -11.285 7.148 1.00 44.13 H new ATOM 0 HA GLU A 15 -3.590 -13.993 7.449 1.00 21.41 H new ATOM 0 HB2 GLU A 15 -4.757 -11.193 7.849 1.00 13.32 H new ATOM 0 HB3 GLU A 15 -5.600 -12.701 8.143 1.00 13.32 H new ATOM 0 HG2 GLU A 15 -4.088 -13.288 9.934 1.00 2.13 H new ATOM 0 HG3 GLU A 15 -3.025 -11.948 9.551 1.00 2.13 H new ATOM 252 N SER A 16 -5.039 -13.873 5.488 1.00 14.11 N ATOM 253 CA SER A 16 -5.638 -14.014 4.218 1.00 65.42 C ATOM 254 C SER A 16 -7.132 -14.309 4.407 1.00 11.25 C ATOM 255 O SER A 16 -7.595 -14.379 5.543 1.00 54.31 O ATOM 256 CB SER A 16 -4.911 -15.106 3.438 1.00 45.01 C ATOM 257 OG SER A 16 -4.870 -16.291 4.184 1.00 11.43 O ATOM 0 H SER A 16 -5.299 -14.606 6.148 1.00 14.11 H new ATOM 0 HA SER A 16 -5.555 -13.096 3.636 1.00 65.42 H new ATOM 0 HB2 SER A 16 -5.417 -15.283 2.489 1.00 45.01 H new ATOM 0 HB3 SER A 16 -3.897 -14.781 3.203 1.00 45.01 H new ATOM 0 HG SER A 16 -3.952 -16.633 4.204 1.00 11.43 H new ATOM 263 N HIS A 17 -7.888 -14.470 3.304 1.00 21.03 N ATOM 264 CA HIS A 17 -9.362 -14.678 3.379 1.00 52.01 C ATOM 265 C HIS A 17 -10.070 -13.505 4.078 1.00 51.51 C ATOM 266 O HIS A 17 -11.161 -13.657 4.637 1.00 44.23 O ATOM 267 CB HIS A 17 -9.717 -16.020 4.058 1.00 72.23 C ATOM 268 CG HIS A 17 -9.377 -17.225 3.242 1.00 71.11 C ATOM 269 ND1 HIS A 17 -10.310 -17.909 2.498 1.00 61.12 N ATOM 270 CD2 HIS A 17 -8.203 -17.876 3.054 1.00 50.51 C ATOM 271 CE1 HIS A 17 -9.730 -18.921 1.890 1.00 31.02 C ATOM 272 NE2 HIS A 17 -8.454 -18.925 2.210 1.00 73.14 N ATOM 0 H HIS A 17 -7.514 -14.462 2.355 1.00 21.03 H new ATOM 0 HA HIS A 17 -9.726 -14.719 2.352 1.00 52.01 H new ATOM 0 HB2 HIS A 17 -9.194 -16.081 5.013 1.00 72.23 H new ATOM 0 HB3 HIS A 17 -10.785 -16.033 4.278 1.00 72.23 H new ATOM 0 HD2 HIS A 17 -7.249 -17.616 3.488 1.00 50.51 H new ATOM 0 HE1 HIS A 17 -10.219 -19.629 1.238 1.00 31.02 H new ATOM 0 HE2 HIS A 17 -7.763 -19.600 1.882 1.00 73.14 H new ATOM 281 N VAL A 18 -9.478 -12.338 3.956 1.00 61.31 N ATOM 282 CA VAL A 18 -9.984 -11.104 4.553 1.00 54.34 C ATOM 283 C VAL A 18 -10.775 -10.340 3.474 1.00 70.01 C ATOM 284 O VAL A 18 -10.438 -10.425 2.307 1.00 23.42 O ATOM 285 CB VAL A 18 -8.793 -10.215 5.066 1.00 61.44 C ATOM 286 CG1 VAL A 18 -9.281 -8.905 5.668 1.00 74.34 C ATOM 287 CG2 VAL A 18 -7.932 -10.979 6.081 1.00 41.43 C ATOM 0 H VAL A 18 -8.614 -12.209 3.430 1.00 61.31 H new ATOM 0 HA VAL A 18 -10.625 -11.339 5.403 1.00 54.34 H new ATOM 0 HB VAL A 18 -8.179 -9.974 4.198 1.00 61.44 H new ATOM 0 HG11 VAL A 18 -8.426 -8.321 6.010 1.00 74.34 H new ATOM 0 HG12 VAL A 18 -9.828 -8.340 4.914 1.00 74.34 H new ATOM 0 HG13 VAL A 18 -9.938 -9.115 6.512 1.00 74.34 H new ATOM 0 HG21 VAL A 18 -7.116 -10.341 6.419 1.00 41.43 H new ATOM 0 HG22 VAL A 18 -8.545 -11.267 6.935 1.00 41.43 H new ATOM 0 HG23 VAL A 18 -7.522 -11.873 5.611 1.00 41.43 H new ATOM 297 N ALA A 19 -11.842 -9.667 3.852 1.00 50.24 N ATOM 298 CA ALA A 19 -12.669 -8.946 2.887 1.00 70.03 C ATOM 299 C ALA A 19 -12.100 -7.549 2.584 1.00 73.24 C ATOM 300 O ALA A 19 -11.785 -6.785 3.497 1.00 72.31 O ATOM 301 CB ALA A 19 -14.104 -8.844 3.387 1.00 73.53 C ATOM 0 H ALA A 19 -12.163 -9.600 4.818 1.00 50.24 H new ATOM 0 HA ALA A 19 -12.661 -9.512 1.956 1.00 70.03 H new ATOM 0 HB1 ALA A 19 -14.706 -8.304 2.656 1.00 73.53 H new ATOM 0 HB2 ALA A 19 -14.513 -9.845 3.526 1.00 73.53 H new ATOM 0 HB3 ALA A 19 -14.121 -8.310 4.337 1.00 73.53 H new ATOM 307 N ARG A 20 -12.000 -7.218 1.291 1.00 51.42 N ATOM 308 CA ARG A 20 -11.439 -5.930 0.838 1.00 42.24 C ATOM 309 C ARG A 20 -12.366 -4.776 1.207 1.00 14.13 C ATOM 310 O ARG A 20 -11.944 -3.647 1.340 1.00 2.23 O ATOM 311 CB ARG A 20 -11.152 -5.960 -0.708 1.00 62.21 C ATOM 312 CG ARG A 20 -12.371 -5.959 -1.645 1.00 64.34 C ATOM 313 CD ARG A 20 -12.900 -4.541 -1.896 1.00 4.43 C ATOM 314 NE ARG A 20 -14.217 -4.556 -2.565 1.00 50.12 N ATOM 315 CZ ARG A 20 -14.638 -3.714 -3.529 1.00 71.24 C ATOM 316 NH1 ARG A 20 -13.773 -2.976 -4.219 1.00 2.11 N ATOM 317 NH2 ARG A 20 -15.926 -3.689 -3.852 1.00 52.51 N ATOM 0 H ARG A 20 -12.302 -7.827 0.531 1.00 51.42 H new ATOM 0 HA ARG A 20 -10.490 -5.771 1.350 1.00 42.24 H new ATOM 0 HB2 ARG A 20 -10.535 -5.096 -0.955 1.00 62.21 H new ATOM 0 HB3 ARG A 20 -10.559 -6.848 -0.925 1.00 62.21 H new ATOM 0 HG2 ARG A 20 -12.098 -6.418 -2.595 1.00 64.34 H new ATOM 0 HG3 ARG A 20 -13.163 -6.570 -1.211 1.00 64.34 H new ATOM 0 HD2 ARG A 20 -12.980 -4.010 -0.947 1.00 4.43 H new ATOM 0 HD3 ARG A 20 -12.187 -3.991 -2.510 1.00 4.43 H new ATOM 0 HE ARG A 20 -14.874 -5.277 -2.267 1.00 50.12 H new ATOM 0 HH11 ARG A 20 -12.775 -3.043 -4.022 1.00 2.11 H new ATOM 0 HH12 ARG A 20 -14.108 -2.343 -4.946 1.00 2.11 H new ATOM 0 HH21 ARG A 20 -16.584 -4.303 -3.372 1.00 52.51 H new ATOM 0 HH22 ARG A 20 -16.257 -3.056 -4.580 1.00 52.51 H new ATOM 331 N ALA A 21 -13.637 -5.081 1.358 1.00 14.53 N ATOM 332 CA ALA A 21 -14.630 -4.076 1.685 1.00 71.43 C ATOM 333 C ALA A 21 -14.650 -3.794 3.173 1.00 13.23 C ATOM 334 O ALA A 21 -15.287 -2.844 3.623 1.00 4.21 O ATOM 335 CB ALA A 21 -16.003 -4.498 1.196 1.00 30.12 C ATOM 0 H ALA A 21 -14.011 -6.025 1.259 1.00 14.53 H new ATOM 0 HA ALA A 21 -14.356 -3.153 1.174 1.00 71.43 H new ATOM 0 HB1 ALA A 21 -16.732 -3.730 1.452 1.00 30.12 H new ATOM 0 HB2 ALA A 21 -15.979 -4.630 0.114 1.00 30.12 H new ATOM 0 HB3 ALA A 21 -16.285 -5.438 1.670 1.00 30.12 H new ATOM 341 N ASN A 22 -13.961 -4.630 3.933 1.00 55.11 N ATOM 342 CA ASN A 22 -13.922 -4.502 5.380 1.00 74.32 C ATOM 343 C ASN A 22 -12.674 -3.717 5.806 1.00 62.14 C ATOM 344 O ASN A 22 -12.502 -3.382 6.979 1.00 54.53 O ATOM 345 CB ASN A 22 -13.945 -5.902 6.047 1.00 60.31 C ATOM 346 CG ASN A 22 -14.024 -5.865 7.578 1.00 34.33 C ATOM 347 OD1 ASN A 22 -13.440 -6.849 8.222 1.00 1.12 O flip ATOM 348 ND2 ASN A 22 -14.609 -4.955 8.171 1.00 74.33 N flip ATOM 0 H ASN A 22 -13.417 -5.411 3.567 1.00 55.11 H new ATOM 0 HA ASN A 22 -14.805 -3.954 5.710 1.00 74.32 H new ATOM 0 HB2 ASN A 22 -14.798 -6.461 5.663 1.00 60.31 H new ATOM 0 HB3 ASN A 22 -13.048 -6.447 5.753 1.00 60.31 H new ATOM 0 HD21 ASN A 22 -15.053 -4.204 7.642 1.00 74.33 H new ATOM 0 HD22 ASN A 22 -14.649 -4.953 9.190 1.00 74.33 H new ATOM 355 N VAL A 23 -11.815 -3.400 4.853 1.00 74.11 N ATOM 356 CA VAL A 23 -10.608 -2.658 5.173 1.00 21.13 C ATOM 357 C VAL A 23 -10.755 -1.189 4.786 1.00 51.45 C ATOM 358 O VAL A 23 -11.394 -0.861 3.789 1.00 12.42 O ATOM 359 CB VAL A 23 -9.318 -3.266 4.526 1.00 62.21 C ATOM 360 CG1 VAL A 23 -9.113 -4.704 4.959 1.00 43.32 C ATOM 361 CG2 VAL A 23 -9.333 -3.165 3.011 1.00 14.45 C ATOM 0 H VAL A 23 -11.927 -3.640 3.868 1.00 74.11 H new ATOM 0 HA VAL A 23 -10.482 -2.735 6.253 1.00 21.13 H new ATOM 0 HB VAL A 23 -8.478 -2.672 4.886 1.00 62.21 H new ATOM 0 HG11 VAL A 23 -8.210 -5.099 4.494 1.00 43.32 H new ATOM 0 HG12 VAL A 23 -9.011 -4.746 6.043 1.00 43.32 H new ATOM 0 HG13 VAL A 23 -9.971 -5.302 4.652 1.00 43.32 H new ATOM 0 HG21 VAL A 23 -8.418 -3.600 2.608 1.00 14.45 H new ATOM 0 HG22 VAL A 23 -10.195 -3.705 2.619 1.00 14.45 H new ATOM 0 HG23 VAL A 23 -9.397 -2.117 2.717 1.00 14.45 H new ATOM 371 N LYS A 24 -10.207 -0.311 5.602 1.00 35.42 N ATOM 372 CA LYS A 24 -10.239 1.114 5.332 1.00 4.24 C ATOM 373 C LYS A 24 -9.170 1.479 4.359 1.00 75.14 C ATOM 374 O LYS A 24 -9.349 2.343 3.520 1.00 1.13 O ATOM 375 CB LYS A 24 -10.041 1.907 6.612 1.00 61.41 C ATOM 376 CG LYS A 24 -11.051 1.560 7.646 1.00 12.53 C ATOM 377 CD LYS A 24 -11.011 2.482 8.858 1.00 22.45 C ATOM 378 CE LYS A 24 -9.738 2.355 9.667 1.00 72.51 C ATOM 379 NZ LYS A 24 -9.717 3.323 10.796 1.00 2.54 N ATOM 0 H LYS A 24 -9.729 -0.563 6.467 1.00 35.42 H new ATOM 0 HA LYS A 24 -11.214 1.356 4.910 1.00 4.24 H new ATOM 0 HB2 LYS A 24 -9.042 1.718 7.004 1.00 61.41 H new ATOM 0 HB3 LYS A 24 -10.101 2.973 6.391 1.00 61.41 H new ATOM 0 HG2 LYS A 24 -12.045 1.599 7.201 1.00 12.53 H new ATOM 0 HG3 LYS A 24 -10.888 0.533 7.973 1.00 12.53 H new ATOM 0 HD2 LYS A 24 -11.119 3.514 8.524 1.00 22.45 H new ATOM 0 HD3 LYS A 24 -11.864 2.263 9.500 1.00 22.45 H new ATOM 0 HE2 LYS A 24 -9.650 1.340 10.054 1.00 72.51 H new ATOM 0 HE3 LYS A 24 -8.876 2.526 9.022 1.00 72.51 H new ATOM 0 HZ1 LYS A 24 -8.833 3.212 11.332 1.00 2.54 H new ATOM 0 HZ2 LYS A 24 -9.777 4.292 10.423 1.00 2.54 H new ATOM 0 HZ3 LYS A 24 -10.527 3.143 11.423 1.00 2.54 H new ATOM 393 N HIS A 25 -8.044 0.831 4.491 1.00 53.11 N ATOM 394 CA HIS A 25 -6.927 1.093 3.583 1.00 11.14 C ATOM 395 C HIS A 25 -5.871 0.026 3.645 1.00 51.22 C ATOM 396 O HIS A 25 -5.926 -0.855 4.499 1.00 71.41 O ATOM 397 CB HIS A 25 -6.280 2.473 3.838 1.00 63.31 C ATOM 398 CG HIS A 25 -5.568 2.681 5.159 1.00 21.43 C ATOM 399 ND1 HIS A 25 -6.025 3.533 6.147 1.00 43.23 N ATOM 400 CD2 HIS A 25 -4.380 2.208 5.607 1.00 15.45 C ATOM 401 CE1 HIS A 25 -5.139 3.566 7.127 1.00 64.42 C ATOM 402 NE2 HIS A 25 -4.147 2.774 6.822 1.00 62.45 N ATOM 0 H HIS A 25 -7.863 0.124 5.204 1.00 53.11 H new ATOM 0 HA HIS A 25 -7.360 1.088 2.583 1.00 11.14 H new ATOM 0 HB2 HIS A 25 -5.565 2.662 3.038 1.00 63.31 H new ATOM 0 HB3 HIS A 25 -7.060 3.230 3.754 1.00 63.31 H new ATOM 0 HD2 HIS A 25 -3.736 1.509 5.094 1.00 15.45 H new ATOM 0 HE1 HIS A 25 -5.222 4.151 8.031 1.00 64.42 H new ATOM 0 HE2 HIS A 25 -3.326 2.606 7.403 1.00 62.45 H new ATOM 411 N LEU A 26 -4.860 0.172 2.798 1.00 50.40 N ATOM 412 CA LEU A 26 -3.751 -0.754 2.753 1.00 21.31 C ATOM 413 C LEU A 26 -2.489 -0.021 3.175 1.00 11.05 C ATOM 414 O LEU A 26 -2.329 1.156 2.892 1.00 43.31 O ATOM 415 CB LEU A 26 -3.557 -1.346 1.321 1.00 35.23 C ATOM 416 CG LEU A 26 -4.693 -2.201 0.744 1.00 61.22 C ATOM 417 CD1 LEU A 26 -4.312 -2.735 -0.644 1.00 31.44 C ATOM 418 CD2 LEU A 26 -5.031 -3.348 1.681 1.00 33.10 C ATOM 0 H LEU A 26 -4.792 0.937 2.126 1.00 50.40 H new ATOM 0 HA LEU A 26 -3.960 -1.582 3.430 1.00 21.31 H new ATOM 0 HB2 LEU A 26 -3.380 -0.517 0.636 1.00 35.23 H new ATOM 0 HB3 LEU A 26 -2.651 -1.952 1.328 1.00 35.23 H new ATOM 0 HG LEU A 26 -5.577 -1.571 0.642 1.00 61.22 H new ATOM 0 HD11 LEU A 26 -5.129 -3.339 -1.038 1.00 31.44 H new ATOM 0 HD12 LEU A 26 -4.122 -1.898 -1.316 1.00 31.44 H new ATOM 0 HD13 LEU A 26 -3.414 -3.347 -0.564 1.00 31.44 H new ATOM 0 HD21 LEU A 26 -5.839 -3.942 1.253 1.00 33.10 H new ATOM 0 HD22 LEU A 26 -4.152 -3.977 1.818 1.00 33.10 H new ATOM 0 HD23 LEU A 26 -5.346 -2.949 2.645 1.00 33.10 H new ATOM 430 N LYS A 27 -1.658 -0.690 3.913 1.00 71.43 N ATOM 431 CA LYS A 27 -0.417 -0.185 4.367 1.00 2.53 C ATOM 432 C LYS A 27 0.663 -1.228 4.170 1.00 23.42 C ATOM 433 O LYS A 27 0.506 -2.348 4.587 1.00 4.33 O ATOM 434 CB LYS A 27 -0.554 0.218 5.816 1.00 72.34 C ATOM 435 CG LYS A 27 0.754 0.435 6.486 1.00 64.25 C ATOM 436 CD LYS A 27 0.633 1.227 7.743 1.00 33.41 C ATOM 437 CE LYS A 27 -0.465 0.729 8.650 1.00 30.45 C ATOM 438 NZ LYS A 27 -0.363 -0.723 9.031 1.00 15.24 N ATOM 0 H LYS A 27 -1.842 -1.644 4.224 1.00 71.43 H new ATOM 0 HA LYS A 27 -0.129 0.695 3.792 1.00 2.53 H new ATOM 0 HB2 LYS A 27 -1.144 1.133 5.878 1.00 72.34 H new ATOM 0 HB3 LYS A 27 -1.106 -0.555 6.351 1.00 72.34 H new ATOM 0 HG2 LYS A 27 1.206 -0.531 6.712 1.00 64.25 H new ATOM 0 HG3 LYS A 27 1.427 0.950 5.801 1.00 64.25 H new ATOM 0 HD2 LYS A 27 1.582 1.195 8.279 1.00 33.41 H new ATOM 0 HD3 LYS A 27 0.444 2.271 7.492 1.00 33.41 H new ATOM 0 HE2 LYS A 27 -0.465 1.329 9.560 1.00 30.45 H new ATOM 0 HE3 LYS A 27 -1.424 0.894 8.160 1.00 30.45 H new ATOM 0 HZ1 LYS A 27 -1.153 -1.250 8.607 1.00 15.24 H new ATOM 0 HZ2 LYS A 27 0.538 -1.111 8.684 1.00 15.24 H new ATOM 0 HZ3 LYS A 27 -0.403 -0.814 10.066 1.00 15.24 H new ATOM 452 N ILE A 28 1.742 -0.859 3.533 1.00 33.40 N ATOM 453 CA ILE A 28 2.789 -1.809 3.207 1.00 74.53 C ATOM 454 C ILE A 28 4.084 -1.421 3.912 1.00 11.41 C ATOM 455 O ILE A 28 4.522 -0.238 3.838 1.00 72.45 O ATOM 456 CB ILE A 28 3.081 -1.806 1.692 1.00 61.01 C ATOM 457 CG1 ILE A 28 1.782 -1.821 0.872 1.00 74.00 C ATOM 458 CG2 ILE A 28 3.948 -3.013 1.337 1.00 72.24 C ATOM 459 CD1 ILE A 28 1.992 -1.760 -0.632 1.00 23.02 C ATOM 0 H ILE A 28 1.926 0.096 3.225 1.00 33.40 H new ATOM 0 HA ILE A 28 2.447 -2.794 3.526 1.00 74.53 H new ATOM 0 HB ILE A 28 3.616 -0.889 1.445 1.00 61.01 H new ATOM 0 HG12 ILE A 28 1.224 -2.726 1.113 1.00 74.00 H new ATOM 0 HG13 ILE A 28 1.164 -0.976 1.176 1.00 74.00 H new ATOM 0 HG21 ILE A 28 4.154 -3.011 0.267 1.00 72.24 H new ATOM 0 HG22 ILE A 28 4.887 -2.961 1.888 1.00 72.24 H new ATOM 0 HG23 ILE A 28 3.422 -3.930 1.603 1.00 72.24 H new ATOM 0 HD11 ILE A 28 1.025 -1.775 -1.135 1.00 23.02 H new ATOM 0 HD12 ILE A 28 2.520 -0.842 -0.889 1.00 23.02 H new ATOM 0 HD13 ILE A 28 2.581 -2.619 -0.952 1.00 23.02 H new ATOM 471 N LEU A 29 4.693 -2.385 4.585 1.00 60.41 N ATOM 472 CA LEU A 29 5.980 -2.174 5.242 1.00 11.21 C ATOM 473 C LEU A 29 6.954 -3.281 4.993 1.00 44.24 C ATOM 474 O LEU A 29 6.693 -4.441 5.286 1.00 24.02 O ATOM 475 CB LEU A 29 5.929 -1.856 6.768 1.00 31.24 C ATOM 476 CG LEU A 29 5.289 -0.559 7.154 1.00 74.21 C ATOM 477 CD1 LEU A 29 3.797 -0.683 7.286 1.00 4.55 C ATOM 478 CD2 LEU A 29 5.941 0.036 8.372 1.00 63.14 C ATOM 0 H LEU A 29 4.317 -3.327 4.693 1.00 60.41 H new ATOM 0 HA LEU A 29 6.331 -1.263 4.758 1.00 11.21 H new ATOM 0 HB2 LEU A 29 5.394 -2.664 7.268 1.00 31.24 H new ATOM 0 HB3 LEU A 29 6.949 -1.862 7.153 1.00 31.24 H new ATOM 0 HG LEU A 29 5.457 0.146 6.339 1.00 74.21 H new ATOM 0 HD11 LEU A 29 3.375 0.282 7.567 1.00 4.55 H new ATOM 0 HD12 LEU A 29 3.373 -1.001 6.334 1.00 4.55 H new ATOM 0 HD13 LEU A 29 3.560 -1.420 8.053 1.00 4.55 H new ATOM 0 HD21 LEU A 29 5.451 0.977 8.624 1.00 63.14 H new ATOM 0 HD22 LEU A 29 5.849 -0.656 9.209 1.00 63.14 H new ATOM 0 HD23 LEU A 29 6.996 0.219 8.167 1.00 63.14 H new ATOM 490 N ASN A 30 8.054 -2.905 4.436 1.00 4.05 N ATOM 491 CA ASN A 30 9.176 -3.767 4.240 1.00 61.32 C ATOM 492 C ASN A 30 10.205 -3.465 5.297 1.00 63.44 C ATOM 493 O ASN A 30 10.759 -2.369 5.327 1.00 74.43 O ATOM 494 CB ASN A 30 9.793 -3.553 2.846 1.00 75.04 C ATOM 495 CG ASN A 30 11.160 -4.224 2.684 1.00 2.31 C ATOM 496 OD1 ASN A 30 12.204 -3.607 2.950 1.00 10.41 O ATOM 497 ND2 ASN A 30 11.177 -5.456 2.255 1.00 13.01 N ATOM 0 H ASN A 30 8.205 -1.957 4.092 1.00 4.05 H new ATOM 0 HA ASN A 30 8.848 -4.804 4.313 1.00 61.32 H new ATOM 0 HB2 ASN A 30 9.112 -3.943 2.090 1.00 75.04 H new ATOM 0 HB3 ASN A 30 9.896 -2.484 2.661 1.00 75.04 H new ATOM 0 HD21 ASN A 30 12.066 -5.940 2.129 1.00 13.01 H new ATOM 0 HD22 ASN A 30 10.301 -5.935 2.045 1.00 13.01 H new ATOM 504 N THR A 31 10.413 -4.387 6.179 1.00 20.33 N ATOM 505 CA THR A 31 11.449 -4.260 7.144 1.00 72.53 C ATOM 506 C THR A 31 12.646 -5.072 6.652 1.00 54.41 C ATOM 507 O THR A 31 12.464 -6.082 5.946 1.00 41.11 O ATOM 508 CB THR A 31 11.007 -4.777 8.532 1.00 31.40 C ATOM 509 OG1 THR A 31 10.471 -6.085 8.410 1.00 23.02 O ATOM 510 CG2 THR A 31 9.988 -3.856 9.224 1.00 40.13 C ATOM 0 H THR A 31 9.869 -5.247 6.249 1.00 20.33 H new ATOM 0 HA THR A 31 11.704 -3.206 7.258 1.00 72.53 H new ATOM 0 HB THR A 31 11.897 -4.790 9.162 1.00 31.40 H new ATOM 0 HG1 THR A 31 10.923 -6.684 9.040 1.00 23.02 H new ATOM 0 HG21 THR A 31 9.718 -4.275 10.193 1.00 40.13 H new ATOM 0 HG22 THR A 31 10.427 -2.868 9.365 1.00 40.13 H new ATOM 0 HG23 THR A 31 9.095 -3.771 8.605 1.00 40.13 H new ATOM 518 N PRO A 32 13.876 -4.638 6.963 1.00 75.10 N ATOM 519 CA PRO A 32 15.092 -5.356 6.568 1.00 12.12 C ATOM 520 C PRO A 32 15.049 -6.846 6.960 1.00 23.42 C ATOM 521 O PRO A 32 14.700 -7.185 8.101 1.00 32.03 O ATOM 522 CB PRO A 32 16.186 -4.628 7.345 1.00 54.21 C ATOM 523 CG PRO A 32 15.663 -3.249 7.520 1.00 63.34 C ATOM 524 CD PRO A 32 14.185 -3.401 7.712 1.00 32.14 C ATOM 0 HA PRO A 32 15.239 -5.356 5.488 1.00 12.12 H new ATOM 0 HB2 PRO A 32 16.375 -5.106 8.306 1.00 54.21 H new ATOM 0 HB3 PRO A 32 17.129 -4.629 6.798 1.00 54.21 H new ATOM 0 HG2 PRO A 32 16.122 -2.762 8.380 1.00 63.34 H new ATOM 0 HG3 PRO A 32 15.884 -2.632 6.649 1.00 63.34 H new ATOM 0 HD2 PRO A 32 13.922 -3.492 8.766 1.00 32.14 H new ATOM 0 HD3 PRO A 32 13.637 -2.544 7.319 1.00 32.14 H new ATOM 532 N ASN A 33 15.392 -7.717 5.990 1.00 10.14 N ATOM 533 CA ASN A 33 15.389 -9.201 6.143 1.00 54.31 C ATOM 534 C ASN A 33 13.961 -9.802 6.006 1.00 40.24 C ATOM 535 O ASN A 33 13.757 -11.020 6.097 1.00 73.24 O ATOM 536 CB ASN A 33 16.148 -9.667 7.442 1.00 22.14 C ATOM 537 CG ASN A 33 16.181 -11.186 7.659 1.00 41.45 C ATOM 538 OD1 ASN A 33 15.304 -11.757 8.315 1.00 33.42 O ATOM 539 ND2 ASN A 33 17.191 -11.845 7.129 1.00 13.40 N ATOM 0 H ASN A 33 15.685 -7.413 5.061 1.00 10.14 H new ATOM 0 HA ASN A 33 15.959 -9.612 5.310 1.00 54.31 H new ATOM 0 HB2 ASN A 33 17.173 -9.298 7.399 1.00 22.14 H new ATOM 0 HB3 ASN A 33 15.677 -9.201 8.308 1.00 22.14 H new ATOM 0 HD21 ASN A 33 17.264 -12.855 7.255 1.00 13.40 H new ATOM 0 HD22 ASN A 33 17.900 -11.346 6.592 1.00 13.40 H new ATOM 546 N CYS A 34 12.993 -8.964 5.700 1.00 4.54 N ATOM 547 CA CYS A 34 11.627 -9.429 5.518 1.00 50.13 C ATOM 548 C CYS A 34 11.133 -9.007 4.149 1.00 22.52 C ATOM 549 O CYS A 34 11.706 -8.111 3.526 1.00 32.10 O ATOM 550 CB CYS A 34 10.700 -8.892 6.619 1.00 60.24 C ATOM 551 SG CYS A 34 11.276 -9.282 8.311 1.00 22.04 S ATOM 0 H CYS A 34 13.122 -7.960 5.572 1.00 4.54 H new ATOM 0 HA CYS A 34 11.616 -10.517 5.589 1.00 50.13 H new ATOM 0 HB2 CYS A 34 10.612 -7.811 6.514 1.00 60.24 H new ATOM 0 HB3 CYS A 34 9.702 -9.308 6.478 1.00 60.24 H new ATOM 556 N ALA A 35 10.103 -9.665 3.673 1.00 53.34 N ATOM 557 CA ALA A 35 9.595 -9.429 2.343 1.00 63.15 C ATOM 558 C ALA A 35 8.519 -8.361 2.343 1.00 14.12 C ATOM 559 O ALA A 35 8.214 -7.779 3.393 1.00 32.13 O ATOM 560 CB ALA A 35 9.042 -10.727 1.777 1.00 23.32 C ATOM 0 H ALA A 35 9.594 -10.378 4.196 1.00 53.34 H new ATOM 0 HA ALA A 35 10.415 -9.073 1.719 1.00 63.15 H new ATOM 0 HB1 ALA A 35 8.658 -10.551 0.772 1.00 23.32 H new ATOM 0 HB2 ALA A 35 9.835 -11.473 1.737 1.00 23.32 H new ATOM 0 HB3 ALA A 35 8.236 -11.088 2.416 1.00 23.32 H new ATOM 566 N CYS A 36 7.964 -8.089 1.159 1.00 74.10 N ATOM 567 CA CYS A 36 6.844 -7.170 1.025 1.00 34.04 C ATOM 568 C CYS A 36 5.696 -7.723 1.851 1.00 1.22 C ATOM 569 O CYS A 36 5.511 -8.945 1.918 1.00 61.11 O ATOM 570 CB CYS A 36 6.432 -7.034 -0.450 1.00 42.20 C ATOM 571 SG CYS A 36 5.067 -5.854 -0.755 1.00 51.50 S ATOM 0 H CYS A 36 8.278 -8.497 0.279 1.00 74.10 H new ATOM 0 HA CYS A 36 7.122 -6.177 1.379 1.00 34.04 H new ATOM 0 HB2 CYS A 36 7.301 -6.721 -1.029 1.00 42.20 H new ATOM 0 HB3 CYS A 36 6.137 -8.015 -0.823 1.00 42.20 H new ATOM 576 N GLN A 37 4.949 -6.860 2.488 1.00 33.31 N ATOM 577 CA GLN A 37 3.953 -7.297 3.415 1.00 22.23 C ATOM 578 C GLN A 37 2.912 -6.206 3.621 1.00 10.40 C ATOM 579 O GLN A 37 3.251 -5.034 3.836 1.00 22.33 O ATOM 580 CB GLN A 37 4.664 -7.668 4.706 1.00 1.44 C ATOM 581 CG GLN A 37 3.813 -8.290 5.775 1.00 13.51 C ATOM 582 CD GLN A 37 4.654 -8.777 6.934 1.00 24.34 C ATOM 583 OE1 GLN A 37 4.212 -8.789 8.058 1.00 12.04 O ATOM 584 NE2 GLN A 37 5.883 -9.191 6.658 1.00 72.23 N ATOM 0 H GLN A 37 5.016 -5.848 2.378 1.00 33.31 H new ATOM 0 HA GLN A 37 3.415 -8.168 3.039 1.00 22.23 H new ATOM 0 HB2 GLN A 37 5.472 -8.359 4.466 1.00 1.44 H new ATOM 0 HB3 GLN A 37 5.124 -6.768 5.115 1.00 1.44 H new ATOM 0 HG2 GLN A 37 3.085 -7.562 6.132 1.00 13.51 H new ATOM 0 HG3 GLN A 37 3.251 -9.124 5.355 1.00 13.51 H new ATOM 0 HE21 GLN A 37 6.225 -9.168 5.697 1.00 72.23 H new ATOM 0 HE22 GLN A 37 6.486 -9.533 7.406 1.00 72.23 H new ATOM 593 N ILE A 38 1.658 -6.596 3.547 1.00 63.22 N ATOM 594 CA ILE A 38 0.543 -5.678 3.594 1.00 4.12 C ATOM 595 C ILE A 38 -0.104 -5.729 4.980 1.00 62.23 C ATOM 596 O ILE A 38 -0.190 -6.770 5.580 1.00 13.23 O ATOM 597 CB ILE A 38 -0.546 -6.089 2.558 1.00 73.04 C ATOM 598 CG1 ILE A 38 0.038 -6.315 1.152 1.00 1.31 C ATOM 599 CG2 ILE A 38 -1.682 -5.064 2.503 1.00 14.43 C ATOM 600 CD1 ILE A 38 0.692 -5.111 0.527 1.00 21.23 C ATOM 0 H ILE A 38 1.381 -7.573 3.451 1.00 63.22 H new ATOM 0 HA ILE A 38 0.918 -4.679 3.371 1.00 4.12 H new ATOM 0 HB ILE A 38 -0.953 -7.040 2.902 1.00 73.04 H new ATOM 0 HG12 ILE A 38 0.771 -7.120 1.206 1.00 1.31 H new ATOM 0 HG13 ILE A 38 -0.762 -6.656 0.495 1.00 1.31 H new ATOM 0 HG21 ILE A 38 -2.424 -5.382 1.770 1.00 14.43 H new ATOM 0 HG22 ILE A 38 -2.151 -4.987 3.484 1.00 14.43 H new ATOM 0 HG23 ILE A 38 -1.281 -4.092 2.215 1.00 14.43 H new ATOM 0 HD11 ILE A 38 1.071 -5.374 -0.461 1.00 21.23 H new ATOM 0 HD12 ILE A 38 -0.039 -4.308 0.433 1.00 21.23 H new ATOM 0 HD13 ILE A 38 1.518 -4.778 1.155 1.00 21.23 H new ATOM 612 N VAL A 39 -0.479 -4.605 5.499 1.00 13.32 N ATOM 613 CA VAL A 39 -1.237 -4.530 6.730 1.00 14.34 C ATOM 614 C VAL A 39 -2.405 -3.588 6.497 1.00 65.33 C ATOM 615 O VAL A 39 -2.214 -2.467 6.022 1.00 40.22 O ATOM 616 CB VAL A 39 -0.393 -4.020 7.921 1.00 72.14 C ATOM 617 CG1 VAL A 39 -1.211 -4.043 9.213 1.00 60.51 C ATOM 618 CG2 VAL A 39 0.873 -4.843 8.075 1.00 23.54 C ATOM 0 H VAL A 39 -0.271 -3.697 5.084 1.00 13.32 H new ATOM 0 HA VAL A 39 -1.572 -5.534 6.991 1.00 14.34 H new ATOM 0 HB VAL A 39 -0.106 -2.989 7.716 1.00 72.14 H new ATOM 0 HG11 VAL A 39 -0.598 -3.680 10.038 1.00 60.51 H new ATOM 0 HG12 VAL A 39 -2.085 -3.402 9.101 1.00 60.51 H new ATOM 0 HG13 VAL A 39 -1.533 -5.063 9.422 1.00 60.51 H new ATOM 0 HG21 VAL A 39 1.451 -4.467 8.919 1.00 23.54 H new ATOM 0 HG22 VAL A 39 0.610 -5.886 8.252 1.00 23.54 H new ATOM 0 HG23 VAL A 39 1.468 -4.768 7.165 1.00 23.54 H new ATOM 628 N ALA A 40 -3.586 -4.014 6.818 1.00 31.43 N ATOM 629 CA ALA A 40 -4.760 -3.227 6.547 1.00 61.21 C ATOM 630 C ALA A 40 -5.575 -3.004 7.799 1.00 42.23 C ATOM 631 O ALA A 40 -5.651 -3.859 8.661 1.00 12.14 O ATOM 632 CB ALA A 40 -5.598 -3.904 5.485 1.00 21.52 C ATOM 0 H ALA A 40 -3.769 -4.909 7.272 1.00 31.43 H new ATOM 0 HA ALA A 40 -4.440 -2.251 6.184 1.00 61.21 H new ATOM 0 HB1 ALA A 40 -6.485 -3.304 5.284 1.00 21.52 H new ATOM 0 HB2 ALA A 40 -5.014 -4.005 4.570 1.00 21.52 H new ATOM 0 HB3 ALA A 40 -5.900 -4.892 5.834 1.00 21.52 H new ATOM 638 N ARG A 41 -6.179 -1.855 7.906 1.00 61.24 N ATOM 639 CA ARG A 41 -7.009 -1.580 9.049 1.00 34.24 C ATOM 640 C ARG A 41 -8.433 -1.830 8.736 1.00 74.24 C ATOM 641 O ARG A 41 -8.938 -1.332 7.734 1.00 5.44 O ATOM 642 CB ARG A 41 -6.862 -0.169 9.596 1.00 40.22 C ATOM 643 CG ARG A 41 -5.548 0.128 10.255 1.00 40.22 C ATOM 644 CD ARG A 41 -5.680 1.367 11.089 1.00 44.04 C ATOM 645 NE ARG A 41 -4.540 1.573 11.960 1.00 72.22 N ATOM 646 CZ ARG A 41 -4.618 2.132 13.177 1.00 32.20 C ATOM 647 NH1 ARG A 41 -5.801 2.519 13.668 1.00 70.42 N ATOM 648 NH2 ARG A 41 -3.528 2.288 13.906 1.00 72.34 N ATOM 0 H ARG A 41 -6.115 -1.099 7.224 1.00 61.24 H new ATOM 0 HA ARG A 41 -6.662 -2.262 9.825 1.00 34.24 H new ATOM 0 HB2 ARG A 41 -7.008 0.537 8.779 1.00 40.22 H new ATOM 0 HB3 ARG A 41 -7.660 0.009 10.317 1.00 40.22 H new ATOM 0 HG2 ARG A 41 -5.243 -0.713 10.878 1.00 40.22 H new ATOM 0 HG3 ARG A 41 -4.773 0.264 9.501 1.00 40.22 H new ATOM 0 HD2 ARG A 41 -5.794 2.231 10.435 1.00 44.04 H new ATOM 0 HD3 ARG A 41 -6.586 1.301 11.691 1.00 44.04 H new ATOM 0 HE ARG A 41 -3.623 1.275 11.628 1.00 72.22 H new ATOM 0 HH11 ARG A 41 -6.649 2.389 13.116 1.00 70.42 H new ATOM 0 HH12 ARG A 41 -5.855 2.943 14.594 1.00 70.42 H new ATOM 0 HH21 ARG A 41 -2.624 1.983 13.544 1.00 72.34 H new ATOM 0 HH22 ARG A 41 -3.590 2.713 14.831 1.00 72.34 H new ATOM 662 N LEU A 42 -9.079 -2.594 9.581 1.00 30.35 N ATOM 663 CA LEU A 42 -10.479 -2.897 9.410 1.00 52.13 C ATOM 664 C LEU A 42 -11.310 -1.696 9.782 1.00 63.22 C ATOM 665 O LEU A 42 -10.892 -0.872 10.611 1.00 31.34 O ATOM 666 CB LEU A 42 -10.892 -4.131 10.224 1.00 51.20 C ATOM 667 CG LEU A 42 -10.232 -5.448 9.836 1.00 45.24 C ATOM 668 CD1 LEU A 42 -10.866 -6.565 10.603 1.00 50.53 C ATOM 669 CD2 LEU A 42 -10.328 -5.701 8.343 1.00 53.20 C ATOM 0 H LEU A 42 -8.653 -3.022 10.403 1.00 30.35 H new ATOM 0 HA LEU A 42 -10.655 -3.135 8.361 1.00 52.13 H new ATOM 0 HB2 LEU A 42 -10.675 -3.936 11.274 1.00 51.20 H new ATOM 0 HB3 LEU A 42 -11.972 -4.251 10.138 1.00 51.20 H new ATOM 0 HG LEU A 42 -9.172 -5.392 10.085 1.00 45.24 H new ATOM 0 HD11 LEU A 42 -10.395 -7.509 10.327 1.00 50.53 H new ATOM 0 HD12 LEU A 42 -10.735 -6.393 11.671 1.00 50.53 H new ATOM 0 HD13 LEU A 42 -11.930 -6.608 10.370 1.00 50.53 H new ATOM 0 HD21 LEU A 42 -9.847 -6.649 8.103 1.00 53.20 H new ATOM 0 HD22 LEU A 42 -11.376 -5.741 8.047 1.00 53.20 H new ATOM 0 HD23 LEU A 42 -9.830 -4.895 7.805 1.00 53.20 H new ATOM 681 N LYS A 43 -12.465 -1.590 9.168 1.00 70.44 N ATOM 682 CA LYS A 43 -13.347 -0.453 9.350 1.00 33.43 C ATOM 683 C LYS A 43 -13.876 -0.383 10.765 1.00 11.22 C ATOM 684 O LYS A 43 -13.438 0.448 11.565 1.00 20.40 O ATOM 685 CB LYS A 43 -14.465 -0.551 8.355 1.00 41.32 C ATOM 686 CG LYS A 43 -13.976 -0.533 6.926 1.00 30.14 C ATOM 687 CD LYS A 43 -15.071 -0.883 5.977 1.00 3.13 C ATOM 688 CE LYS A 43 -16.218 0.110 6.014 1.00 3.35 C ATOM 689 NZ LYS A 43 -15.785 1.477 5.652 1.00 34.12 N ATOM 0 H LYS A 43 -12.825 -2.293 8.523 1.00 70.44 H new ATOM 0 HA LYS A 43 -12.788 0.468 9.182 1.00 33.43 H new ATOM 0 HB2 LYS A 43 -15.024 -1.470 8.532 1.00 41.32 H new ATOM 0 HB3 LYS A 43 -15.156 0.277 8.509 1.00 41.32 H new ATOM 0 HG2 LYS A 43 -13.585 0.455 6.685 1.00 30.14 H new ATOM 0 HG3 LYS A 43 -13.153 -1.238 6.812 1.00 30.14 H new ATOM 0 HD2 LYS A 43 -14.668 -0.929 4.965 1.00 3.13 H new ATOM 0 HD3 LYS A 43 -15.449 -1.877 6.215 1.00 3.13 H new ATOM 0 HE2 LYS A 43 -17.000 -0.215 5.328 1.00 3.35 H new ATOM 0 HE3 LYS A 43 -16.654 0.121 7.013 1.00 3.35 H new ATOM 0 HZ1 LYS A 43 -16.621 2.079 5.509 1.00 34.12 H new ATOM 0 HZ2 LYS A 43 -15.202 1.871 6.418 1.00 34.12 H new ATOM 0 HZ3 LYS A 43 -15.228 1.444 4.775 1.00 34.12 H new ATOM 745 N ARG A 47 -9.921 -4.853 14.958 1.00 44.24 N ATOM 746 CA ARG A 47 -8.525 -4.434 14.873 1.00 33.43 C ATOM 747 C ARG A 47 -8.067 -4.381 13.469 1.00 35.32 C ATOM 748 O ARG A 47 -8.859 -4.480 12.548 1.00 24.43 O ATOM 749 CB ARG A 47 -7.566 -5.311 15.779 1.00 33.54 C ATOM 750 CG ARG A 47 -7.830 -6.820 15.789 1.00 65.43 C ATOM 751 CD ARG A 47 -7.580 -7.582 14.481 1.00 53.01 C ATOM 752 NE ARG A 47 -6.162 -7.718 14.134 1.00 64.01 N ATOM 753 CZ ARG A 47 -5.649 -8.722 13.377 1.00 34.42 C ATOM 754 NH1 ARG A 47 -6.356 -9.816 13.116 1.00 71.54 N ATOM 755 NH2 ARG A 47 -4.414 -8.654 12.952 1.00 14.52 N ATOM 0 HA ARG A 47 -8.474 -3.422 15.275 1.00 33.43 H new ATOM 0 HB2 ARG A 47 -6.540 -5.146 15.450 1.00 33.54 H new ATOM 0 HB3 ARG A 47 -7.635 -4.945 16.803 1.00 33.54 H new ATOM 0 HG2 ARG A 47 -7.209 -7.267 16.565 1.00 65.43 H new ATOM 0 HG3 ARG A 47 -8.868 -6.980 16.081 1.00 65.43 H new ATOM 0 HD2 ARG A 47 -8.021 -8.575 14.561 1.00 53.01 H new ATOM 0 HD3 ARG A 47 -8.095 -7.069 13.669 1.00 53.01 H new ATOM 0 HE ARG A 47 -5.517 -7.010 14.485 1.00 64.01 H new ATOM 0 HH11 ARG A 47 -7.302 -9.913 13.486 1.00 71.54 H new ATOM 0 HH12 ARG A 47 -5.953 -10.559 12.545 1.00 71.54 H new ATOM 0 HH21 ARG A 47 -3.837 -7.847 13.189 1.00 14.52 H new ATOM 0 HH22 ARG A 47 -4.028 -9.408 12.383 1.00 14.52 H new ATOM 769 N GLN A 48 -6.811 -4.243 13.316 1.00 42.34 N ATOM 770 CA GLN A 48 -6.214 -4.121 12.016 1.00 45.11 C ATOM 771 C GLN A 48 -5.549 -5.402 11.698 1.00 63.32 C ATOM 772 O GLN A 48 -4.791 -5.914 12.510 1.00 3.12 O ATOM 773 CB GLN A 48 -5.227 -2.942 11.939 1.00 74.33 C ATOM 774 CG GLN A 48 -4.053 -2.996 12.911 1.00 3.10 C ATOM 775 CD GLN A 48 -3.074 -1.849 12.714 1.00 12.44 C ATOM 776 OE1 GLN A 48 -2.889 -1.332 11.594 1.00 64.12 O ATOM 777 NE2 GLN A 48 -2.452 -1.437 13.780 1.00 64.22 N ATOM 0 H GLN A 48 -6.145 -4.209 14.088 1.00 42.34 H new ATOM 0 HA GLN A 48 -6.990 -3.907 11.281 1.00 45.11 H new ATOM 0 HB2 GLN A 48 -4.832 -2.889 10.924 1.00 74.33 H new ATOM 0 HB3 GLN A 48 -5.779 -2.019 12.116 1.00 74.33 H new ATOM 0 HG2 GLN A 48 -4.432 -2.974 13.933 1.00 3.10 H new ATOM 0 HG3 GLN A 48 -3.527 -3.943 12.787 1.00 3.10 H new ATOM 0 HE21 GLN A 48 -2.629 -1.885 14.679 1.00 64.22 H new ATOM 0 HE22 GLN A 48 -1.787 -0.666 13.717 1.00 64.22 H new ATOM 786 N VAL A 49 -5.782 -5.903 10.538 1.00 74.32 N ATOM 787 CA VAL A 49 -5.325 -7.206 10.215 1.00 63.05 C ATOM 788 C VAL A 49 -4.201 -7.123 9.220 1.00 22.13 C ATOM 789 O VAL A 49 -4.174 -6.246 8.345 1.00 70.41 O ATOM 790 CB VAL A 49 -6.483 -8.129 9.678 1.00 42.21 C ATOM 791 CG1 VAL A 49 -7.610 -8.229 10.675 1.00 72.04 C ATOM 792 CG2 VAL A 49 -7.030 -7.661 8.362 1.00 2.35 C ATOM 0 H VAL A 49 -6.290 -5.427 9.793 1.00 74.32 H new ATOM 0 HA VAL A 49 -4.958 -7.666 11.133 1.00 63.05 H new ATOM 0 HB VAL A 49 -6.037 -9.113 9.530 1.00 42.21 H new ATOM 0 HG11 VAL A 49 -8.394 -8.873 10.275 1.00 72.04 H new ATOM 0 HG12 VAL A 49 -7.235 -8.651 11.607 1.00 72.04 H new ATOM 0 HG13 VAL A 49 -8.018 -7.236 10.864 1.00 72.04 H new ATOM 0 HG21 VAL A 49 -7.825 -8.333 8.039 1.00 2.35 H new ATOM 0 HG22 VAL A 49 -7.430 -6.653 8.472 1.00 2.35 H new ATOM 0 HG23 VAL A 49 -6.234 -7.657 7.618 1.00 2.35 H new ATOM 802 N CYS A 50 -3.270 -7.985 9.366 1.00 75.21 N ATOM 803 CA CYS A 50 -2.149 -8.000 8.495 1.00 71.13 C ATOM 804 C CYS A 50 -2.565 -8.775 7.279 1.00 3.13 C ATOM 805 O CYS A 50 -3.202 -9.769 7.400 1.00 65.12 O ATOM 806 CB CYS A 50 -0.954 -8.641 9.197 1.00 25.45 C ATOM 807 SG CYS A 50 -0.482 -7.810 10.774 1.00 14.32 S ATOM 0 H CYS A 50 -3.258 -8.703 10.091 1.00 75.21 H new ATOM 0 HA CYS A 50 -1.840 -6.994 8.209 1.00 71.13 H new ATOM 0 HB2 CYS A 50 -1.184 -9.686 9.403 1.00 25.45 H new ATOM 0 HB3 CYS A 50 -0.099 -8.630 8.521 1.00 25.45 H new ATOM 812 N ILE A 51 -2.247 -8.317 6.130 1.00 34.42 N ATOM 813 CA ILE A 51 -2.702 -8.968 4.944 1.00 4.31 C ATOM 814 C ILE A 51 -1.548 -9.653 4.232 1.00 41.13 C ATOM 815 O ILE A 51 -0.447 -9.096 4.115 1.00 73.24 O ATOM 816 CB ILE A 51 -3.376 -7.964 3.968 1.00 21.44 C ATOM 817 CG1 ILE A 51 -4.460 -7.151 4.668 1.00 15.25 C ATOM 818 CG2 ILE A 51 -3.986 -8.700 2.807 1.00 35.24 C ATOM 819 CD1 ILE A 51 -5.540 -7.986 5.279 1.00 62.51 C ATOM 0 H ILE A 51 -1.671 -7.490 5.975 1.00 34.42 H new ATOM 0 HA ILE A 51 -3.438 -9.712 5.248 1.00 4.31 H new ATOM 0 HB ILE A 51 -2.604 -7.282 3.612 1.00 21.44 H new ATOM 0 HG12 ILE A 51 -3.999 -6.543 5.446 1.00 15.25 H new ATOM 0 HG13 ILE A 51 -4.907 -6.464 3.949 1.00 15.25 H new ATOM 0 HG21 ILE A 51 -4.455 -7.986 2.130 1.00 35.24 H new ATOM 0 HG22 ILE A 51 -3.209 -9.248 2.275 1.00 35.24 H new ATOM 0 HG23 ILE A 51 -4.737 -9.400 3.174 1.00 35.24 H new ATOM 0 HD11 ILE A 51 -6.274 -7.338 5.758 1.00 62.51 H new ATOM 0 HD12 ILE A 51 -6.028 -8.575 4.502 1.00 62.51 H new ATOM 0 HD13 ILE A 51 -5.106 -8.655 6.023 1.00 62.51 H new ATOM 831 N ASP A 52 -1.793 -10.861 3.789 1.00 43.23 N ATOM 832 CA ASP A 52 -0.839 -11.597 3.006 1.00 32.12 C ATOM 833 C ASP A 52 -0.749 -10.873 1.672 1.00 33.23 C ATOM 834 O ASP A 52 -1.780 -10.669 1.020 1.00 65.14 O ATOM 835 CB ASP A 52 -1.356 -13.031 2.773 1.00 42.42 C ATOM 836 CG ASP A 52 -0.311 -13.963 2.184 1.00 11.13 C ATOM 837 OD1 ASP A 52 0.104 -13.745 1.047 1.00 75.23 O ATOM 838 OD2 ASP A 52 0.084 -14.951 2.869 1.00 31.00 O ATOM 0 H ASP A 52 -2.664 -11.361 3.964 1.00 43.23 H new ATOM 0 HA ASP A 52 0.129 -11.657 3.504 1.00 32.12 H new ATOM 0 HB2 ASP A 52 -1.705 -13.442 3.721 1.00 42.42 H new ATOM 0 HB3 ASP A 52 -2.217 -12.995 2.105 1.00 42.42 H new ATOM 843 N PRO A 53 0.454 -10.443 1.252 1.00 52.13 N ATOM 844 CA PRO A 53 0.631 -9.687 -0.006 1.00 31.34 C ATOM 845 C PRO A 53 0.356 -10.514 -1.247 1.00 41.24 C ATOM 846 O PRO A 53 0.527 -10.047 -2.368 1.00 74.24 O ATOM 847 CB PRO A 53 2.095 -9.263 0.020 1.00 61.21 C ATOM 848 CG PRO A 53 2.771 -10.165 0.994 1.00 35.30 C ATOM 849 CD PRO A 53 1.726 -10.646 1.964 1.00 61.32 C ATOM 0 HA PRO A 53 -0.073 -8.856 -0.059 1.00 31.34 H new ATOM 0 HB2 PRO A 53 2.544 -9.352 -0.969 1.00 61.21 H new ATOM 0 HB3 PRO A 53 2.193 -8.220 0.322 1.00 61.21 H new ATOM 0 HG2 PRO A 53 3.234 -11.007 0.480 1.00 35.30 H new ATOM 0 HG3 PRO A 53 3.567 -9.636 1.518 1.00 35.30 H new ATOM 0 HD2 PRO A 53 1.875 -11.694 2.223 1.00 61.32 H new ATOM 0 HD3 PRO A 53 1.756 -10.080 2.895 1.00 61.32 H new ATOM 857 N LYS A 54 -0.007 -11.742 -1.030 1.00 30.02 N ATOM 858 CA LYS A 54 -0.310 -12.654 -2.070 1.00 3.24 C ATOM 859 C LYS A 54 -1.820 -13.066 -2.083 1.00 34.52 C ATOM 860 O LYS A 54 -2.251 -13.897 -2.922 1.00 73.01 O ATOM 861 CB LYS A 54 0.644 -13.823 -1.931 1.00 24.23 C ATOM 862 CG LYS A 54 2.084 -13.321 -1.909 1.00 24.23 C ATOM 863 CD LYS A 54 3.123 -14.407 -1.746 1.00 71.11 C ATOM 864 CE LYS A 54 3.008 -15.090 -0.406 1.00 43.32 C ATOM 865 NZ LYS A 54 4.079 -16.086 -0.213 1.00 22.32 N ATOM 0 H LYS A 54 -0.101 -12.140 -0.095 1.00 30.02 H new ATOM 0 HA LYS A 54 -0.166 -12.188 -3.045 1.00 3.24 H new ATOM 0 HB2 LYS A 54 0.428 -14.373 -1.015 1.00 24.23 H new ATOM 0 HB3 LYS A 54 0.505 -14.517 -2.760 1.00 24.23 H new ATOM 0 HG2 LYS A 54 2.282 -12.782 -2.836 1.00 24.23 H new ATOM 0 HG3 LYS A 54 2.194 -12.605 -1.094 1.00 24.23 H new ATOM 0 HD2 LYS A 54 3.008 -15.143 -2.541 1.00 71.11 H new ATOM 0 HD3 LYS A 54 4.119 -13.977 -1.851 1.00 71.11 H new ATOM 0 HE2 LYS A 54 3.055 -14.345 0.388 1.00 43.32 H new ATOM 0 HE3 LYS A 54 2.037 -15.579 -0.328 1.00 43.32 H new ATOM 0 HZ1 LYS A 54 3.970 -16.537 0.718 1.00 22.32 H new ATOM 0 HZ2 LYS A 54 4.018 -16.810 -0.957 1.00 22.32 H new ATOM 0 HZ3 LYS A 54 5.005 -15.615 -0.263 1.00 22.32 H new ATOM 879 N LEU A 55 -2.621 -12.489 -1.157 1.00 3.53 N ATOM 880 CA LEU A 55 -4.062 -12.647 -1.140 1.00 74.41 C ATOM 881 C LEU A 55 -4.695 -12.210 -2.494 1.00 64.03 C ATOM 882 O LEU A 55 -4.306 -11.203 -3.049 1.00 31.24 O ATOM 883 CB LEU A 55 -4.596 -11.756 -0.040 1.00 2.24 C ATOM 884 CG LEU A 55 -5.503 -12.419 0.952 1.00 13.24 C ATOM 885 CD1 LEU A 55 -5.935 -11.442 2.021 1.00 0.25 C ATOM 886 CD2 LEU A 55 -6.697 -13.053 0.291 1.00 31.14 C ATOM 0 H LEU A 55 -2.266 -11.900 -0.403 1.00 3.53 H new ATOM 0 HA LEU A 55 -4.313 -13.695 -0.975 1.00 74.41 H new ATOM 0 HB2 LEU A 55 -3.750 -11.328 0.498 1.00 2.24 H new ATOM 0 HB3 LEU A 55 -5.134 -10.927 -0.499 1.00 2.24 H new ATOM 0 HG LEU A 55 -4.934 -13.220 1.424 1.00 13.24 H new ATOM 0 HD11 LEU A 55 -6.593 -11.945 2.730 1.00 0.25 H new ATOM 0 HD12 LEU A 55 -5.057 -11.065 2.545 1.00 0.25 H new ATOM 0 HD13 LEU A 55 -6.467 -10.610 1.560 1.00 0.25 H new ATOM 0 HD21 LEU A 55 -7.326 -13.521 1.048 1.00 31.14 H new ATOM 0 HD22 LEU A 55 -7.270 -12.289 -0.235 1.00 31.14 H new ATOM 0 HD23 LEU A 55 -6.361 -13.808 -0.419 1.00 31.14 H new ATOM 898 N LYS A 56 -5.714 -12.966 -2.975 1.00 23.15 N ATOM 899 CA LYS A 56 -6.383 -12.708 -4.290 1.00 62.52 C ATOM 900 C LYS A 56 -6.682 -11.238 -4.546 1.00 60.10 C ATOM 901 O LYS A 56 -6.171 -10.657 -5.498 1.00 53.41 O ATOM 902 CB LYS A 56 -7.694 -13.494 -4.411 1.00 74.42 C ATOM 903 CG LYS A 56 -8.486 -13.165 -5.678 1.00 42.14 C ATOM 904 CD LYS A 56 -9.787 -13.939 -5.769 1.00 40.31 C ATOM 905 CE LYS A 56 -10.736 -13.666 -4.594 1.00 53.11 C ATOM 906 NZ LYS A 56 -11.992 -14.460 -4.691 1.00 52.55 N ATOM 0 H LYS A 56 -6.098 -13.767 -2.473 1.00 23.15 H new ATOM 0 HA LYS A 56 -5.665 -13.042 -5.039 1.00 62.52 H new ATOM 0 HB2 LYS A 56 -7.472 -14.561 -4.397 1.00 74.42 H new ATOM 0 HB3 LYS A 56 -8.315 -13.287 -3.539 1.00 74.42 H new ATOM 0 HG2 LYS A 56 -8.701 -12.097 -5.701 1.00 42.14 H new ATOM 0 HG3 LYS A 56 -7.874 -13.386 -6.552 1.00 42.14 H new ATOM 0 HD2 LYS A 56 -10.290 -13.683 -6.701 1.00 40.31 H new ATOM 0 HD3 LYS A 56 -9.566 -15.006 -5.809 1.00 40.31 H new ATOM 0 HE2 LYS A 56 -10.230 -13.902 -3.658 1.00 53.11 H new ATOM 0 HE3 LYS A 56 -10.980 -12.604 -4.565 1.00 53.11 H new ATOM 0 HZ1 LYS A 56 -12.603 -14.244 -3.877 1.00 52.55 H new ATOM 0 HZ2 LYS A 56 -12.489 -14.217 -5.571 1.00 52.55 H new ATOM 0 HZ3 LYS A 56 -11.762 -15.474 -4.692 1.00 52.55 H new ATOM 920 N TRP A 57 -7.517 -10.653 -3.706 1.00 51.13 N ATOM 921 CA TRP A 57 -7.915 -9.257 -3.870 1.00 74.32 C ATOM 922 C TRP A 57 -6.747 -8.290 -3.820 1.00 2.43 C ATOM 923 O TRP A 57 -6.829 -7.223 -4.403 1.00 34.13 O ATOM 924 CB TRP A 57 -9.036 -8.846 -2.920 1.00 65.30 C ATOM 925 CG TRP A 57 -8.719 -9.038 -1.485 1.00 21.33 C ATOM 926 CD1 TRP A 57 -8.825 -10.190 -0.793 1.00 53.24 C ATOM 927 CD2 TRP A 57 -8.267 -8.046 -0.551 1.00 60.15 C ATOM 928 NE1 TRP A 57 -8.463 -9.993 0.493 1.00 52.31 N ATOM 929 CE2 TRP A 57 -8.124 -8.684 0.680 1.00 41.11 C ATOM 930 CE3 TRP A 57 -7.975 -6.683 -0.641 1.00 2.51 C ATOM 931 CZ2 TRP A 57 -7.701 -8.019 1.826 1.00 10.12 C ATOM 932 CZ3 TRP A 57 -7.556 -6.020 0.495 1.00 65.14 C ATOM 933 CH2 TRP A 57 -7.424 -6.692 1.717 1.00 14.41 C ATOM 0 H TRP A 57 -7.936 -11.119 -2.901 1.00 51.13 H new ATOM 0 HA TRP A 57 -8.320 -9.193 -4.880 1.00 74.32 H new ATOM 0 HB2 TRP A 57 -9.274 -7.796 -3.090 1.00 65.30 H new ATOM 0 HB3 TRP A 57 -9.931 -9.419 -3.163 1.00 65.30 H new ATOM 0 HD1 TRP A 57 -9.152 -11.133 -1.207 1.00 53.24 H new ATOM 0 HE1 TRP A 57 -8.446 -10.713 1.215 1.00 52.31 H new ATOM 0 HE3 TRP A 57 -8.075 -6.159 -1.580 1.00 2.51 H new ATOM 0 HZ2 TRP A 57 -7.596 -8.537 2.768 1.00 10.12 H new ATOM 0 HZ3 TRP A 57 -7.326 -4.966 0.441 1.00 65.14 H new ATOM 0 HH2 TRP A 57 -7.096 -6.146 2.589 1.00 14.41 H new ATOM 944 N ILE A 58 -5.673 -8.657 -3.127 1.00 11.02 N ATOM 945 CA ILE A 58 -4.477 -7.828 -3.103 1.00 5.14 C ATOM 946 C ILE A 58 -3.840 -7.832 -4.471 1.00 2.34 C ATOM 947 O ILE A 58 -3.515 -6.781 -5.004 1.00 20.44 O ATOM 948 CB ILE A 58 -3.446 -8.294 -2.027 1.00 34.13 C ATOM 949 CG1 ILE A 58 -3.997 -8.081 -0.623 1.00 33.22 C ATOM 950 CG2 ILE A 58 -2.096 -7.583 -2.182 1.00 14.42 C ATOM 951 CD1 ILE A 58 -4.255 -6.621 -0.285 1.00 1.03 C ATOM 0 H ILE A 58 -5.608 -9.515 -2.580 1.00 11.02 H new ATOM 0 HA ILE A 58 -4.780 -6.817 -2.831 1.00 5.14 H new ATOM 0 HB ILE A 58 -3.278 -9.360 -2.182 1.00 34.13 H new ATOM 0 HG12 ILE A 58 -4.927 -8.639 -0.518 1.00 33.22 H new ATOM 0 HG13 ILE A 58 -3.294 -8.494 0.101 1.00 33.22 H new ATOM 0 HG21 ILE A 58 -1.408 -7.936 -1.414 1.00 14.42 H new ATOM 0 HG22 ILE A 58 -1.682 -7.799 -3.167 1.00 14.42 H new ATOM 0 HG23 ILE A 58 -2.237 -6.507 -2.076 1.00 14.42 H new ATOM 0 HD11 ILE A 58 -4.646 -6.546 0.730 1.00 1.03 H new ATOM 0 HD12 ILE A 58 -3.323 -6.061 -0.357 1.00 1.03 H new ATOM 0 HD13 ILE A 58 -4.981 -6.208 -0.985 1.00 1.03 H new ATOM 963 N GLN A 59 -3.696 -9.020 -5.037 1.00 25.22 N ATOM 964 CA GLN A 59 -3.113 -9.191 -6.361 1.00 10.30 C ATOM 965 C GLN A 59 -3.913 -8.398 -7.363 1.00 22.21 C ATOM 966 O GLN A 59 -3.360 -7.651 -8.160 1.00 73.23 O ATOM 967 CB GLN A 59 -3.104 -10.674 -6.787 1.00 3.23 C ATOM 968 CG GLN A 59 -2.691 -11.650 -5.704 1.00 24.43 C ATOM 969 CD GLN A 59 -1.533 -11.160 -4.892 1.00 33.32 C ATOM 970 OE1 GLN A 59 -0.371 -11.423 -5.303 1.00 35.31 O flip ATOM 971 NE2 GLN A 59 -1.717 -10.522 -3.897 1.00 24.21 N flip ATOM 0 H GLN A 59 -3.979 -9.893 -4.593 1.00 25.22 H new ATOM 0 HA GLN A 59 -2.083 -8.837 -6.326 1.00 10.30 H new ATOM 0 HB2 GLN A 59 -4.101 -10.942 -7.135 1.00 3.23 H new ATOM 0 HB3 GLN A 59 -2.429 -10.789 -7.635 1.00 3.23 H new ATOM 0 HG2 GLN A 59 -3.539 -11.834 -5.045 1.00 24.43 H new ATOM 0 HG3 GLN A 59 -2.430 -12.604 -6.162 1.00 24.43 H new ATOM 0 HE21 GLN A 59 -2.668 -10.324 -3.587 1.00 24.21 H new ATOM 0 HE22 GLN A 59 -0.923 -10.176 -3.359 1.00 24.21 H new ATOM 980 N GLU A 60 -5.219 -8.581 -7.287 1.00 45.43 N ATOM 981 CA GLU A 60 -6.188 -7.915 -8.076 1.00 44.14 C ATOM 982 C GLU A 60 -5.990 -6.382 -7.925 1.00 55.11 C ATOM 983 O GLU A 60 -5.899 -5.649 -8.909 1.00 73.34 O ATOM 984 CB GLU A 60 -7.533 -8.345 -7.469 1.00 55.22 C ATOM 985 CG GLU A 60 -8.725 -8.261 -8.355 1.00 31.02 C ATOM 986 CD GLU A 60 -9.049 -6.868 -8.839 1.00 11.22 C ATOM 987 OE1 GLU A 60 -9.598 -6.067 -8.047 1.00 1.42 O ATOM 988 OE2 GLU A 60 -8.768 -6.555 -10.003 1.00 44.34 O ATOM 0 H GLU A 60 -5.635 -9.240 -6.629 1.00 45.43 H new ATOM 0 HA GLU A 60 -6.124 -8.155 -9.137 1.00 44.14 H new ATOM 0 HB2 GLU A 60 -7.437 -9.375 -7.125 1.00 55.22 H new ATOM 0 HB3 GLU A 60 -7.720 -7.731 -6.588 1.00 55.22 H new ATOM 0 HG2 GLU A 60 -8.565 -8.904 -9.220 1.00 31.02 H new ATOM 0 HG3 GLU A 60 -9.588 -8.656 -7.820 1.00 31.02 H new ATOM 995 N TYR A 61 -5.868 -5.947 -6.674 1.00 61.31 N ATOM 996 CA TYR A 61 -5.736 -4.540 -6.309 1.00 70.21 C ATOM 997 C TYR A 61 -4.465 -3.955 -6.929 1.00 1.43 C ATOM 998 O TYR A 61 -4.518 -2.951 -7.636 1.00 33.32 O ATOM 999 CB TYR A 61 -5.651 -4.444 -4.772 1.00 14.42 C ATOM 1000 CG TYR A 61 -5.883 -3.079 -4.171 1.00 44.30 C ATOM 1001 CD1 TYR A 61 -4.971 -2.045 -4.319 1.00 15.34 C ATOM 1002 CD2 TYR A 61 -7.028 -2.843 -3.425 1.00 3.23 C ATOM 1003 CE1 TYR A 61 -5.203 -0.812 -3.749 1.00 62.35 C ATOM 1004 CE2 TYR A 61 -7.266 -1.621 -2.850 1.00 31.43 C ATOM 1005 CZ TYR A 61 -6.348 -0.602 -3.018 1.00 61.24 C ATOM 1006 OH TYR A 61 -6.576 0.636 -2.461 1.00 32.24 O ATOM 0 H TYR A 61 -5.858 -6.575 -5.870 1.00 61.31 H new ATOM 0 HA TYR A 61 -6.595 -3.979 -6.678 1.00 70.21 H new ATOM 0 HB2 TYR A 61 -6.380 -5.133 -4.346 1.00 14.42 H new ATOM 0 HB3 TYR A 61 -4.665 -4.791 -4.462 1.00 14.42 H new ATOM 0 HD1 TYR A 61 -4.068 -2.208 -4.888 1.00 15.34 H new ATOM 0 HD2 TYR A 61 -7.747 -3.638 -3.294 1.00 3.23 H new ATOM 0 HE1 TYR A 61 -4.487 -0.013 -3.876 1.00 62.35 H new ATOM 0 HE2 TYR A 61 -8.163 -1.457 -2.271 1.00 31.43 H new ATOM 0 HH TYR A 61 -7.428 0.625 -1.976 1.00 32.24 H new ATOM 1016 N LEU A 62 -3.339 -4.598 -6.657 1.00 73.32 N ATOM 1017 CA LEU A 62 -2.023 -4.179 -7.177 1.00 14.25 C ATOM 1018 C LEU A 62 -2.033 -4.134 -8.682 1.00 42.41 C ATOM 1019 O LEU A 62 -1.647 -3.130 -9.283 1.00 51.23 O ATOM 1020 CB LEU A 62 -0.930 -5.173 -6.759 1.00 2.03 C ATOM 1021 CG LEU A 62 -0.823 -5.510 -5.284 1.00 0.23 C ATOM 1022 CD1 LEU A 62 0.255 -6.569 -5.056 1.00 15.44 C ATOM 1023 CD2 LEU A 62 -0.560 -4.268 -4.442 1.00 41.13 C ATOM 0 H LEU A 62 -3.300 -5.430 -6.068 1.00 73.32 H new ATOM 0 HA LEU A 62 -1.818 -3.190 -6.766 1.00 14.25 H new ATOM 0 HB2 LEU A 62 -1.092 -6.102 -7.306 1.00 2.03 H new ATOM 0 HB3 LEU A 62 0.031 -4.774 -7.084 1.00 2.03 H new ATOM 0 HG LEU A 62 -1.781 -5.919 -4.963 1.00 0.23 H new ATOM 0 HD11 LEU A 62 0.319 -6.800 -3.993 1.00 15.44 H new ATOM 0 HD12 LEU A 62 -0.000 -7.473 -5.609 1.00 15.44 H new ATOM 0 HD13 LEU A 62 1.216 -6.191 -5.404 1.00 15.44 H new ATOM 0 HD21 LEU A 62 -0.490 -4.549 -3.391 1.00 41.13 H new ATOM 0 HD22 LEU A 62 0.375 -3.806 -4.758 1.00 41.13 H new ATOM 0 HD23 LEU A 62 -1.377 -3.559 -4.574 1.00 41.13 H new ATOM 1035 N GLU A 63 -2.470 -5.233 -9.277 1.00 12.05 N ATOM 1036 CA GLU A 63 -2.487 -5.395 -10.717 1.00 4.01 C ATOM 1037 C GLU A 63 -3.223 -4.226 -11.384 1.00 74.24 C ATOM 1038 O GLU A 63 -2.708 -3.607 -12.313 1.00 13.11 O ATOM 1039 CB GLU A 63 -3.190 -6.700 -11.085 1.00 13.24 C ATOM 1040 CG GLU A 63 -2.559 -7.453 -12.242 1.00 73.22 C ATOM 1041 CD GLU A 63 -2.344 -6.620 -13.475 1.00 32.12 C ATOM 1042 OE1 GLU A 63 -3.302 -6.391 -14.238 1.00 22.51 O ATOM 1043 OE2 GLU A 63 -1.193 -6.196 -13.707 1.00 32.21 O ATOM 0 H GLU A 63 -2.825 -6.042 -8.767 1.00 12.05 H new ATOM 0 HA GLU A 63 -1.456 -5.417 -11.070 1.00 4.01 H new ATOM 0 HB2 GLU A 63 -3.203 -7.350 -10.210 1.00 13.24 H new ATOM 0 HB3 GLU A 63 -4.228 -6.480 -11.335 1.00 13.24 H new ATOM 0 HG2 GLU A 63 -1.600 -7.857 -11.918 1.00 73.22 H new ATOM 0 HG3 GLU A 63 -3.193 -8.302 -12.497 1.00 73.22 H new ATOM 1050 N LYS A 64 -4.412 -3.917 -10.905 1.00 21.31 N ATOM 1051 CA LYS A 64 -5.184 -2.888 -11.486 1.00 20.14 C ATOM 1052 C LYS A 64 -4.639 -1.512 -11.166 1.00 44.01 C ATOM 1053 O LYS A 64 -4.582 -0.654 -12.043 1.00 54.21 O ATOM 1054 CB LYS A 64 -6.631 -3.031 -11.089 1.00 32.31 C ATOM 1055 CG LYS A 64 -7.000 -2.845 -9.625 1.00 61.22 C ATOM 1056 CD LYS A 64 -8.474 -3.160 -9.450 1.00 75.24 C ATOM 1057 CE LYS A 64 -8.976 -2.967 -8.030 1.00 22.53 C ATOM 1058 NZ LYS A 64 -10.387 -3.409 -7.909 1.00 24.22 N ATOM 0 H LYS A 64 -4.849 -4.380 -10.108 1.00 21.31 H new ATOM 0 HA LYS A 64 -5.119 -2.992 -12.569 1.00 20.14 H new ATOM 0 HB2 LYS A 64 -7.208 -2.312 -11.671 1.00 32.31 H new ATOM 0 HB3 LYS A 64 -6.962 -4.025 -11.391 1.00 32.31 H new ATOM 0 HG2 LYS A 64 -6.397 -3.501 -8.997 1.00 61.22 H new ATOM 0 HG3 LYS A 64 -6.792 -1.822 -9.310 1.00 61.22 H new ATOM 0 HD2 LYS A 64 -9.054 -2.525 -10.120 1.00 75.24 H new ATOM 0 HD3 LYS A 64 -8.654 -4.192 -9.752 1.00 75.24 H new ATOM 0 HE2 LYS A 64 -8.352 -3.532 -7.338 1.00 22.53 H new ATOM 0 HE3 LYS A 64 -8.893 -1.917 -7.749 1.00 22.53 H new ATOM 0 HZ1 LYS A 64 -10.785 -3.058 -7.015 1.00 24.22 H new ATOM 0 HZ2 LYS A 64 -10.939 -3.032 -8.706 1.00 24.22 H new ATOM 0 HZ3 LYS A 64 -10.428 -4.448 -7.921 1.00 24.22 H new ATOM 1072 N CYS A 65 -4.211 -1.330 -9.929 1.00 23.20 N ATOM 1073 CA CYS A 65 -3.666 -0.036 -9.453 1.00 64.52 C ATOM 1074 C CYS A 65 -2.440 0.376 -10.270 1.00 51.14 C ATOM 1075 O CYS A 65 -2.191 1.561 -10.471 1.00 50.54 O ATOM 1076 CB CYS A 65 -3.316 -0.108 -7.949 1.00 63.33 C ATOM 1077 SG CYS A 65 -2.678 1.445 -7.217 1.00 1.00 S ATOM 0 H CYS A 65 -4.224 -2.060 -9.217 1.00 23.20 H new ATOM 0 HA CYS A 65 -4.436 0.723 -9.590 1.00 64.52 H new ATOM 0 HB2 CYS A 65 -4.208 -0.409 -7.400 1.00 63.33 H new ATOM 0 HB3 CYS A 65 -2.572 -0.891 -7.803 1.00 63.33 H new ATOM 1082 N LEU A 66 -1.708 -0.631 -10.755 1.00 20.10 N ATOM 1083 CA LEU A 66 -0.525 -0.469 -11.579 1.00 31.20 C ATOM 1084 C LEU A 66 -0.846 0.427 -12.806 1.00 75.21 C ATOM 1085 O LEU A 66 -0.022 1.208 -13.253 1.00 1.24 O ATOM 1086 CB LEU A 66 -0.100 -1.892 -12.045 1.00 53.33 C ATOM 1087 CG LEU A 66 1.329 -2.124 -12.579 1.00 40.42 C ATOM 1088 CD1 LEU A 66 1.655 -1.301 -13.817 1.00 30.14 C ATOM 1089 CD2 LEU A 66 2.329 -1.889 -11.476 1.00 73.02 C ATOM 0 H LEU A 66 -1.936 -1.609 -10.575 1.00 20.10 H new ATOM 0 HA LEU A 66 0.278 0.012 -11.020 1.00 31.20 H new ATOM 0 HB2 LEU A 66 -0.247 -2.568 -11.203 1.00 53.33 H new ATOM 0 HB3 LEU A 66 -0.794 -2.200 -12.827 1.00 53.33 H new ATOM 0 HG LEU A 66 1.388 -3.163 -12.903 1.00 40.42 H new ATOM 0 HD11 LEU A 66 2.675 -1.514 -14.137 1.00 30.14 H new ATOM 0 HD12 LEU A 66 0.962 -1.558 -14.618 1.00 30.14 H new ATOM 0 HD13 LEU A 66 1.562 -0.240 -13.584 1.00 30.14 H new ATOM 0 HD21 LEU A 66 3.337 -2.054 -11.857 1.00 73.02 H new ATOM 0 HD22 LEU A 66 2.240 -0.864 -11.117 1.00 73.02 H new ATOM 0 HD23 LEU A 66 2.134 -2.579 -10.655 1.00 73.02 H new ATOM 1101 N ASN A 67 -2.034 0.311 -13.323 1.00 12.13 N ATOM 1102 CA ASN A 67 -2.380 1.058 -14.511 1.00 73.10 C ATOM 1103 C ASN A 67 -3.460 2.080 -14.258 1.00 43.41 C ATOM 1104 O ASN A 67 -3.298 3.271 -14.536 1.00 12.42 O ATOM 1105 CB ASN A 67 -2.826 0.126 -15.610 1.00 71.54 C ATOM 1106 CG ASN A 67 -3.006 0.867 -16.904 1.00 14.14 C ATOM 1107 OD1 ASN A 67 -2.290 1.829 -17.200 1.00 72.20 O ATOM 1108 ND2 ASN A 67 -3.952 0.471 -17.661 1.00 2.30 N ATOM 0 H ASN A 67 -2.775 -0.283 -12.952 1.00 12.13 H new ATOM 0 HA ASN A 67 -1.479 1.591 -14.815 1.00 73.10 H new ATOM 0 HB2 ASN A 67 -2.090 -0.667 -15.740 1.00 71.54 H new ATOM 0 HB3 ASN A 67 -3.764 -0.353 -15.328 1.00 71.54 H new ATOM 0 HD21 ASN A 67 -4.136 0.952 -18.541 1.00 2.30 H new ATOM 0 HD22 ASN A 67 -4.525 -0.327 -17.387 1.00 2.30 H new ATOM 1333 N GLU B 114 6.763 -1.919 14.041 1.00 63.21 N ATOM 1334 CA GLU B 114 7.651 -2.625 13.153 1.00 31.31 C ATOM 1335 C GLU B 114 8.579 -3.628 13.846 1.00 23.32 C ATOM 1336 O GLU B 114 9.774 -3.379 14.076 1.00 22.11 O ATOM 1337 CB GLU B 114 8.352 -1.623 12.220 1.00 52.25 C ATOM 1338 CG GLU B 114 9.053 -0.484 12.949 1.00 52.44 C ATOM 1339 CD GLU B 114 9.257 0.726 12.068 1.00 44.41 C ATOM 1340 OE1 GLU B 114 10.098 0.683 11.157 1.00 74.11 O ATOM 1341 OE2 GLU B 114 8.544 1.757 12.288 1.00 42.32 O ATOM 0 HA GLU B 114 7.049 -3.284 12.528 1.00 31.31 H new ATOM 0 HB2 GLU B 114 9.083 -2.157 11.614 1.00 52.25 H new ATOM 0 HB3 GLU B 114 7.615 -1.203 11.535 1.00 52.25 H new ATOM 0 HG2 GLU B 114 8.466 -0.199 13.822 1.00 52.44 H new ATOM 0 HG3 GLU B 114 10.020 -0.831 13.314 1.00 52.44 H new ATOM 1348 N GLU B 115 7.947 -4.724 14.242 1.00 22.14 N ATOM 1349 CA GLU B 115 8.524 -5.872 14.855 1.00 24.44 C ATOM 1350 C GLU B 115 7.422 -6.845 15.285 1.00 45.51 C ATOM 1351 O GLU B 115 7.623 -8.059 15.311 1.00 1.32 O ATOM 1352 CB GLU B 115 9.386 -5.550 16.065 1.00 23.53 C ATOM 1353 CG GLU B 115 8.698 -4.756 17.146 1.00 64.34 C ATOM 1354 CD GLU B 115 9.543 -4.626 18.384 1.00 11.34 C ATOM 1355 OE1 GLU B 115 10.444 -3.766 18.425 1.00 34.24 O ATOM 1356 OE2 GLU B 115 9.344 -5.414 19.333 1.00 32.51 O ATOM 0 H GLU B 115 6.939 -4.823 14.125 1.00 22.14 H new ATOM 0 HA GLU B 115 9.174 -6.318 14.102 1.00 24.44 H new ATOM 0 HB2 GLU B 115 9.745 -6.485 16.495 1.00 23.53 H new ATOM 0 HB3 GLU B 115 10.263 -4.995 15.730 1.00 23.53 H new ATOM 0 HG2 GLU B 115 8.457 -3.763 16.767 1.00 64.34 H new ATOM 0 HG3 GLU B 115 7.754 -5.237 17.402 1.00 64.34 H new ATOM 1363 N MET B 116 6.265 -6.303 15.637 1.00 30.53 N ATOM 1364 CA MET B 116 5.155 -7.107 16.110 1.00 35.24 C ATOM 1365 C MET B 116 3.874 -6.765 15.405 1.00 44.10 C ATOM 1366 O MET B 116 3.499 -5.591 15.267 1.00 3.24 O ATOM 1367 CB MET B 116 4.952 -6.992 17.626 1.00 10.21 C ATOM 1368 CG MET B 116 6.091 -7.546 18.462 1.00 61.01 C ATOM 1369 SD MET B 116 5.778 -7.429 20.236 1.00 42.30 S ATOM 1370 CE MET B 116 5.595 -5.657 20.436 1.00 45.50 C ATOM 0 H MET B 116 6.073 -5.302 15.602 1.00 30.53 H new ATOM 0 HA MET B 116 5.420 -8.139 15.878 1.00 35.24 H new ATOM 0 HB2 MET B 116 4.809 -5.942 17.881 1.00 10.21 H new ATOM 0 HB3 MET B 116 4.034 -7.513 17.897 1.00 10.21 H new ATOM 0 HG2 MET B 116 6.257 -8.590 18.195 1.00 61.01 H new ATOM 0 HG3 MET B 116 7.007 -7.006 18.223 1.00 61.01 H new ATOM 0 HE1 MET B 116 5.752 -5.391 21.481 1.00 45.50 H new ATOM 0 HE2 MET B 116 6.330 -5.143 19.816 1.00 45.50 H new ATOM 0 HE3 MET B 116 4.592 -5.358 20.132 1.00 45.50 H new ATOM 1380 N GLY B 117 3.210 -7.788 14.988 1.00 43.43 N ATOM 1381 CA GLY B 117 1.973 -7.684 14.303 1.00 72.34 C ATOM 1382 C GLY B 117 1.378 -9.044 14.226 1.00 50.42 C ATOM 1383 O GLY B 117 1.802 -9.875 13.413 1.00 73.55 O ATOM 0 H GLY B 117 3.525 -8.749 15.120 1.00 43.43 H new ATOM 0 HA2 GLY B 117 1.302 -7.003 14.827 1.00 72.34 H new ATOM 0 HA3 GLY B 117 2.123 -7.276 13.303 1.00 72.34 H new ATOM 1387 N SER B 118 0.454 -9.312 15.088 1.00 14.12 N ATOM 1388 CA SER B 118 -0.132 -10.605 15.155 1.00 14.15 C ATOM 1389 C SER B 118 -1.255 -10.739 14.139 1.00 14.10 C ATOM 1390 O SER B 118 -1.848 -9.733 13.716 1.00 31.01 O ATOM 1391 CB SER B 118 -0.605 -10.869 16.578 1.00 41.52 C ATOM 1392 OG SER B 118 0.502 -10.776 17.489 1.00 35.45 O ATOM 0 H SER B 118 0.086 -8.642 15.763 1.00 14.12 H new ATOM 0 HA SER B 118 0.611 -11.361 14.899 1.00 14.15 H new ATOM 0 HB2 SER B 118 -1.375 -10.148 16.854 1.00 41.52 H new ATOM 0 HB3 SER B 118 -1.057 -11.859 16.642 1.00 41.52 H new ATOM 0 HG SER B 118 0.189 -10.945 18.402 1.00 35.45 H new ATOM 1398 N GLY B 119 -1.520 -11.963 13.743 1.00 63.23 N ATOM 1399 CA GLY B 119 -2.526 -12.237 12.765 1.00 5.52 C ATOM 1400 C GLY B 119 -3.116 -13.606 12.976 1.00 32.23 C ATOM 1401 O GLY B 119 -2.467 -14.474 13.576 1.00 2.25 O ATOM 0 H GLY B 119 -1.039 -12.791 14.095 1.00 63.23 H new ATOM 0 HA2 GLY B 119 -3.312 -11.484 12.824 1.00 5.52 H new ATOM 0 HA3 GLY B 119 -2.096 -12.171 11.766 1.00 5.52 H new ATOM 1405 N ASP B 120 -4.322 -13.816 12.498 1.00 14.14 N ATOM 1406 CA ASP B 120 -5.028 -15.068 12.717 1.00 14.11 C ATOM 1407 C ASP B 120 -5.648 -15.618 11.456 1.00 65.04 C ATOM 1408 O ASP B 120 -5.503 -16.796 11.172 1.00 64.41 O ATOM 1409 CB ASP B 120 -6.174 -14.864 13.675 1.00 53.04 C ATOM 1410 CG ASP B 120 -5.789 -14.416 15.063 1.00 54.34 C ATOM 1411 OD1 ASP B 120 -5.308 -15.237 15.866 1.00 13.33 O ATOM 1412 OD2 ASP B 120 -5.990 -13.224 15.389 1.00 62.13 O ATOM 0 H ASP B 120 -4.842 -13.131 11.949 1.00 14.14 H new ATOM 0 HA ASP B 120 -4.278 -15.759 13.101 1.00 14.11 H new ATOM 0 HB2 ASP B 120 -6.853 -14.126 13.249 1.00 53.04 H new ATOM 0 HB3 ASP B 120 -6.729 -15.799 13.755 1.00 53.04 H new ATOM 1441 N ASP B 122 -6.593 -17.271 8.633 1.00 52.41 N ATOM 1442 CA ASP B 122 -5.922 -18.260 7.771 1.00 64.15 C ATOM 1443 C ASP B 122 -4.416 -18.250 8.069 1.00 63.14 C ATOM 1444 O ASP B 122 -3.799 -19.291 8.328 1.00 0.53 O ATOM 1445 CB ASP B 122 -6.217 -18.006 6.317 1.00 52.14 C ATOM 1446 CG ASP B 122 -5.672 -19.089 5.436 1.00 21.45 C ATOM 1447 OD1 ASP B 122 -4.479 -19.061 5.115 1.00 2.42 O ATOM 1448 OD2 ASP B 122 -6.449 -19.998 5.059 1.00 31.11 O ATOM 0 HA ASP B 122 -6.309 -19.255 7.991 1.00 64.15 H new ATOM 0 HB2 ASP B 122 -7.295 -17.930 6.174 1.00 52.14 H new ATOM 0 HB3 ASP B 122 -5.788 -17.048 6.022 1.00 52.14 H new ATOM 1453 N SER B 123 -3.872 -17.061 8.019 1.00 23.03 N ATOM 1454 CA SER B 123 -2.587 -16.665 8.529 1.00 63.21 C ATOM 1455 C SER B 123 -1.335 -17.086 7.674 1.00 52.23 C ATOM 1456 O SER B 123 -0.199 -16.999 8.181 1.00 11.13 O ATOM 1457 CB SER B 123 -2.501 -17.005 10.056 1.00 74.13 C ATOM 1458 OG SER B 123 -2.306 -18.391 10.314 1.00 12.42 O ATOM 0 H SER B 123 -4.360 -16.279 7.582 1.00 23.03 H new ATOM 0 HA SER B 123 -2.526 -15.582 8.420 1.00 63.21 H new ATOM 0 HB2 SER B 123 -1.681 -16.441 10.501 1.00 74.13 H new ATOM 0 HB3 SER B 123 -3.417 -16.677 10.546 1.00 74.13 H new ATOM 0 HG SER B 123 -2.518 -18.907 9.508 1.00 12.42 H new ATOM 1464 N MET B 124 -1.553 -17.498 6.370 1.00 71.14 N ATOM 1465 CA MET B 124 -0.426 -17.749 5.374 1.00 70.21 C ATOM 1466 C MET B 124 -0.909 -18.406 4.062 1.00 55.14 C ATOM 1467 O MET B 124 -1.380 -19.540 4.084 1.00 65.34 O ATOM 1468 CB MET B 124 0.713 -18.621 5.955 1.00 11.24 C ATOM 1469 CG MET B 124 1.819 -18.902 4.948 1.00 33.31 C ATOM 1470 SD MET B 124 3.178 -19.910 5.594 1.00 61.43 S ATOM 1471 CE MET B 124 3.809 -18.846 6.891 1.00 21.41 C ATOM 0 H MET B 124 -2.483 -17.662 5.985 1.00 71.14 H new ATOM 0 HA MET B 124 -0.044 -16.752 5.157 1.00 70.21 H new ATOM 0 HB2 MET B 124 1.139 -18.120 6.824 1.00 11.24 H new ATOM 0 HB3 MET B 124 0.298 -19.567 6.304 1.00 11.24 H new ATOM 0 HG2 MET B 124 1.387 -19.406 4.083 1.00 33.31 H new ATOM 0 HG3 MET B 124 2.222 -17.953 4.595 1.00 33.31 H new ATOM 0 HE1 MET B 124 4.802 -19.184 7.188 1.00 21.41 H new ATOM 0 HE2 MET B 124 3.870 -17.821 6.524 1.00 21.41 H new ATOM 0 HE3 MET B 124 3.140 -18.884 7.751 1.00 21.41 H new ATOM 1481 N LYS B 125 -0.765 -17.706 2.919 1.00 62.41 N ATOM 1482 CA LYS B 125 -1.124 -18.278 1.591 1.00 4.32 C ATOM 1483 C LYS B 125 -0.130 -17.894 0.484 1.00 54.31 C ATOM 1484 O LYS B 125 0.892 -17.271 0.738 1.00 11.32 O ATOM 1485 CB LYS B 125 -2.563 -17.919 1.171 1.00 70.22 C ATOM 1486 CG LYS B 125 -3.631 -18.627 1.939 1.00 52.33 C ATOM 1487 CD LYS B 125 -3.533 -20.117 1.721 1.00 1.51 C ATOM 1488 CE LYS B 125 -4.583 -20.820 2.492 1.00 30.15 C ATOM 1489 NZ LYS B 125 -4.507 -22.284 2.340 1.00 15.22 N ATOM 0 H LYS B 125 -0.407 -16.752 2.880 1.00 62.41 H new ATOM 0 HA LYS B 125 -1.067 -19.359 1.718 1.00 4.32 H new ATOM 0 HB2 LYS B 125 -2.703 -16.844 1.286 1.00 70.22 H new ATOM 0 HB3 LYS B 125 -2.685 -18.145 0.112 1.00 70.22 H new ATOM 0 HG2 LYS B 125 -3.535 -18.401 3.001 1.00 52.33 H new ATOM 0 HG3 LYS B 125 -4.612 -18.270 1.624 1.00 52.33 H new ATOM 0 HD2 LYS B 125 -3.638 -20.344 0.660 1.00 1.51 H new ATOM 0 HD3 LYS B 125 -2.549 -20.472 2.027 1.00 1.51 H new ATOM 0 HE2 LYS B 125 -4.490 -20.562 3.547 1.00 30.15 H new ATOM 0 HE3 LYS B 125 -5.563 -20.474 2.165 1.00 30.15 H new ATOM 0 HZ1 LYS B 125 -5.262 -22.731 2.898 1.00 15.22 H new ATOM 0 HZ2 LYS B 125 -4.623 -22.535 1.337 1.00 15.22 H new ATOM 0 HZ3 LYS B 125 -3.582 -22.620 2.677 1.00 15.22 H new ATOM 1503 N GLU B 126 -0.421 -18.316 -0.741 1.00 25.22 N ATOM 1504 CA GLU B 126 0.379 -18.010 -1.880 1.00 35.22 C ATOM 1505 C GLU B 126 -0.453 -17.101 -2.812 1.00 40.12 C ATOM 1506 O GLU B 126 -1.657 -16.931 -2.572 1.00 12.45 O ATOM 1507 CB GLU B 126 0.848 -19.323 -2.602 1.00 51.40 C ATOM 1508 CG GLU B 126 -0.253 -20.236 -3.176 1.00 23.31 C ATOM 1509 CD GLU B 126 -1.120 -20.908 -2.131 1.00 43.45 C ATOM 1510 OE1 GLU B 126 -0.783 -22.028 -1.688 1.00 0.22 O ATOM 1511 OE2 GLU B 126 -2.154 -20.341 -1.751 1.00 3.34 O ATOM 0 H GLU B 126 -1.237 -18.889 -0.955 1.00 25.22 H new ATOM 0 HA GLU B 126 1.287 -17.486 -1.581 1.00 35.22 H new ATOM 0 HB2 GLU B 126 1.514 -19.042 -3.417 1.00 51.40 H new ATOM 0 HB3 GLU B 126 1.438 -19.906 -1.895 1.00 51.40 H new ATOM 0 HG2 GLU B 126 -0.891 -19.645 -3.834 1.00 23.31 H new ATOM 0 HG3 GLU B 126 0.214 -21.005 -3.791 1.00 23.31 H new ATOM 1518 N PRO B 127 0.149 -16.499 -3.864 1.00 44.31 N ATOM 1519 CA PRO B 127 -0.565 -15.614 -4.778 1.00 70.42 C ATOM 1520 C PRO B 127 -1.665 -16.334 -5.491 1.00 34.11 C ATOM 1521 O PRO B 127 -1.418 -17.256 -6.278 1.00 3.12 O ATOM 1522 CB PRO B 127 0.497 -15.165 -5.785 1.00 40.43 C ATOM 1523 CG PRO B 127 1.774 -15.425 -5.100 1.00 74.31 C ATOM 1524 CD PRO B 127 1.537 -16.631 -4.247 1.00 31.41 C ATOM 0 HA PRO B 127 -1.032 -14.784 -4.248 1.00 70.42 H new ATOM 0 HB2 PRO B 127 0.424 -15.724 -6.718 1.00 40.43 H new ATOM 0 HB3 PRO B 127 0.387 -14.110 -6.037 1.00 40.43 H new ATOM 0 HG2 PRO B 127 2.574 -15.604 -5.818 1.00 74.31 H new ATOM 0 HG3 PRO B 127 2.075 -14.570 -4.495 1.00 74.31 H new ATOM 0 HD2 PRO B 127 1.717 -17.555 -4.797 1.00 31.41 H new ATOM 0 HD3 PRO B 127 2.195 -16.645 -3.378 1.00 31.41 H new ATOM 1825 N ARG C 208 -13.918 12.766 -2.552 1.00 61.41 N ATOM 1826 CA ARG C 208 -12.761 13.562 -2.836 1.00 22.55 C ATOM 1827 C ARG C 208 -11.569 12.653 -2.737 1.00 22.51 C ATOM 1828 O ARG C 208 -11.681 11.574 -2.181 1.00 13.53 O ATOM 1829 CB ARG C 208 -12.651 14.699 -1.825 1.00 14.14 C ATOM 1830 CG ARG C 208 -13.816 15.667 -1.844 1.00 23.23 C ATOM 1831 CD ARG C 208 -13.916 16.379 -3.178 1.00 72.03 C ATOM 1832 NE ARG C 208 -15.074 17.267 -3.233 1.00 3.53 N ATOM 1833 CZ ARG C 208 -15.289 18.186 -4.171 1.00 10.43 C ATOM 1834 NH1 ARG C 208 -14.373 18.416 -5.105 1.00 21.53 N ATOM 1835 NH2 ARG C 208 -16.416 18.883 -4.162 1.00 42.21 N ATOM 0 HA ARG C 208 -12.823 14.007 -3.829 1.00 22.55 H new ATOM 0 HB2 ARG C 208 -12.564 14.273 -0.825 1.00 14.14 H new ATOM 0 HB3 ARG C 208 -11.731 15.252 -2.017 1.00 14.14 H new ATOM 0 HG2 ARG C 208 -14.743 15.128 -1.646 1.00 23.23 H new ATOM 0 HG3 ARG C 208 -13.696 16.400 -1.046 1.00 23.23 H new ATOM 0 HD2 ARG C 208 -13.007 16.955 -3.351 1.00 72.03 H new ATOM 0 HD3 ARG C 208 -13.984 15.643 -3.979 1.00 72.03 H new ATOM 0 HE ARG C 208 -15.772 17.176 -2.495 1.00 3.53 H new ATOM 0 HH11 ARG C 208 -13.501 17.887 -5.105 1.00 21.53 H new ATOM 0 HH12 ARG C 208 -14.542 19.121 -5.822 1.00 21.53 H new ATOM 0 HH21 ARG C 208 -17.114 18.714 -3.438 1.00 42.21 H new ATOM 0 HH22 ARG C 208 -16.585 19.588 -4.879 1.00 42.21 H new ATOM 1849 N CYS C 209 -10.466 13.046 -3.268 1.00 51.24 N ATOM 1850 CA CYS C 209 -9.300 12.186 -3.266 1.00 45.15 C ATOM 1851 C CYS C 209 -8.438 12.501 -2.035 1.00 41.22 C ATOM 1852 O CYS C 209 -8.423 13.642 -1.584 1.00 4.51 O ATOM 1853 CB CYS C 209 -8.495 12.421 -4.548 1.00 13.44 C ATOM 1854 SG CYS C 209 -9.419 12.176 -6.117 1.00 62.15 S ATOM 0 H CYS C 209 -10.330 13.954 -3.713 1.00 51.24 H new ATOM 0 HA CYS C 209 -9.609 11.142 -3.226 1.00 45.15 H new ATOM 0 HB2 CYS C 209 -8.106 13.439 -4.531 1.00 13.44 H new ATOM 0 HB3 CYS C 209 -7.635 11.751 -4.544 1.00 13.44 H new ATOM 1859 N PRO C 210 -7.706 11.481 -1.463 1.00 62.04 N ATOM 1860 CA PRO C 210 -6.857 11.672 -0.258 1.00 24.31 C ATOM 1861 C PRO C 210 -5.860 12.808 -0.448 1.00 73.22 C ATOM 1862 O PRO C 210 -5.504 13.504 0.489 1.00 53.25 O ATOM 1863 CB PRO C 210 -6.164 10.313 -0.078 1.00 73.11 C ATOM 1864 CG PRO C 210 -6.325 9.620 -1.391 1.00 63.13 C ATOM 1865 CD PRO C 210 -7.643 10.089 -1.938 1.00 72.34 C ATOM 0 HA PRO C 210 -7.432 11.960 0.622 1.00 24.31 H new ATOM 0 HB2 PRO C 210 -5.111 10.437 0.176 1.00 73.11 H new ATOM 0 HB3 PRO C 210 -6.621 9.741 0.729 1.00 73.11 H new ATOM 0 HG2 PRO C 210 -5.508 9.870 -2.068 1.00 63.13 H new ATOM 0 HG3 PRO C 210 -6.316 8.537 -1.266 1.00 63.13 H new ATOM 0 HD2 PRO C 210 -7.676 10.029 -3.026 1.00 72.34 H new ATOM 0 HD3 PRO C 210 -8.474 9.493 -1.561 1.00 72.34 H new ATOM 1873 N CYS C 211 -5.414 12.951 -1.649 1.00 53.02 N ATOM 1874 CA CYS C 211 -4.671 14.091 -2.078 1.00 61.44 C ATOM 1875 C CYS C 211 -5.226 14.515 -3.397 1.00 24.12 C ATOM 1876 O CYS C 211 -5.669 13.671 -4.182 1.00 53.13 O ATOM 1877 CB CYS C 211 -3.172 13.815 -2.212 1.00 64.22 C ATOM 1878 SG CYS C 211 -2.275 13.509 -0.641 1.00 51.32 S ATOM 0 H CYS C 211 -5.560 12.258 -2.383 1.00 53.02 H new ATOM 0 HA CYS C 211 -4.769 14.872 -1.324 1.00 61.44 H new ATOM 0 HB2 CYS C 211 -3.037 12.949 -2.860 1.00 64.22 H new ATOM 0 HB3 CYS C 211 -2.708 14.664 -2.714 1.00 64.22 H new ATOM 1883 N ARG C 212 -5.232 15.796 -3.656 1.00 22.43 N ATOM 1884 CA ARG C 212 -5.723 16.279 -4.926 1.00 71.44 C ATOM 1885 C ARG C 212 -4.683 16.056 -5.975 1.00 20.14 C ATOM 1886 O ARG C 212 -4.987 15.911 -7.152 1.00 32.12 O ATOM 1887 CB ARG C 212 -6.071 17.760 -4.866 1.00 33.13 C ATOM 1888 CG ARG C 212 -7.277 18.104 -4.023 1.00 13.40 C ATOM 1889 CD ARG C 212 -7.511 19.604 -4.028 1.00 33.11 C ATOM 1890 NE ARG C 212 -7.578 20.142 -5.391 1.00 64.31 N ATOM 1891 CZ ARG C 212 -7.372 21.418 -5.719 1.00 72.42 C ATOM 1892 NH1 ARG C 212 -7.157 22.323 -4.774 1.00 4.20 N ATOM 1893 NH2 ARG C 212 -7.376 21.783 -6.996 1.00 64.33 N ATOM 0 H ARG C 212 -4.907 16.519 -3.015 1.00 22.43 H new ATOM 0 HA ARG C 212 -6.632 15.729 -5.169 1.00 71.44 H new ATOM 0 HB2 ARG C 212 -5.210 18.304 -4.478 1.00 33.13 H new ATOM 0 HB3 ARG C 212 -6.243 18.118 -5.881 1.00 33.13 H new ATOM 0 HG2 ARG C 212 -8.158 17.590 -4.409 1.00 13.40 H new ATOM 0 HG3 ARG C 212 -7.127 17.756 -3.001 1.00 13.40 H new ATOM 0 HD2 ARG C 212 -8.439 19.828 -3.503 1.00 33.11 H new ATOM 0 HD3 ARG C 212 -6.708 20.099 -3.481 1.00 33.11 H new ATOM 0 HE ARG C 212 -7.799 19.491 -6.145 1.00 64.31 H new ATOM 0 HH11 ARG C 212 -7.149 22.044 -3.793 1.00 4.20 H new ATOM 0 HH12 ARG C 212 -7.000 23.298 -5.028 1.00 4.20 H new ATOM 0 HH21 ARG C 212 -7.537 21.088 -7.725 1.00 64.33 H new ATOM 0 HH22 ARG C 212 -7.219 22.759 -7.248 1.00 64.33 H new ATOM 1907 N PHE C 213 -3.456 16.018 -5.542 1.00 63.21 N ATOM 1908 CA PHE C 213 -2.361 15.842 -6.425 1.00 63.05 C ATOM 1909 C PHE C 213 -1.430 14.791 -5.860 1.00 43.32 C ATOM 1910 O PHE C 213 -1.074 14.842 -4.681 1.00 33.32 O ATOM 1911 CB PHE C 213 -1.615 17.171 -6.612 1.00 31.14 C ATOM 1912 CG PHE C 213 -2.473 18.298 -7.146 1.00 21.30 C ATOM 1913 CD1 PHE C 213 -2.680 18.444 -8.507 1.00 4.44 C ATOM 1914 CD2 PHE C 213 -3.066 19.209 -6.281 1.00 23.22 C ATOM 1915 CE1 PHE C 213 -3.456 19.475 -8.998 1.00 15.20 C ATOM 1916 CE2 PHE C 213 -3.845 20.241 -6.768 1.00 24.22 C ATOM 1917 CZ PHE C 213 -4.041 20.374 -8.128 1.00 40.32 C ATOM 0 H PHE C 213 -3.195 16.110 -4.560 1.00 63.21 H new ATOM 0 HA PHE C 213 -2.727 15.513 -7.398 1.00 63.05 H new ATOM 0 HB2 PHE C 213 -1.192 17.475 -5.654 1.00 31.14 H new ATOM 0 HB3 PHE C 213 -0.779 17.012 -7.293 1.00 31.14 H new ATOM 0 HD1 PHE C 213 -2.229 17.743 -9.193 1.00 4.44 H new ATOM 0 HD2 PHE C 213 -2.916 19.109 -5.216 1.00 23.22 H new ATOM 0 HE1 PHE C 213 -3.606 19.578 -10.063 1.00 15.20 H new ATOM 0 HE2 PHE C 213 -4.300 20.943 -6.085 1.00 24.22 H new ATOM 0 HZ PHE C 213 -4.650 21.179 -8.511 1.00 40.32 H new ATOM 1927 N PHE C 214 -1.076 13.846 -6.677 1.00 42.11 N ATOM 1928 CA PHE C 214 -0.145 12.795 -6.313 1.00 41.14 C ATOM 1929 C PHE C 214 1.251 13.163 -6.796 1.00 2.44 C ATOM 1930 O PHE C 214 1.413 13.601 -7.918 1.00 24.01 O ATOM 1931 CB PHE C 214 -0.634 11.420 -6.822 1.00 42.11 C ATOM 1932 CG PHE C 214 -1.217 11.429 -8.222 1.00 13.32 C ATOM 1933 CD1 PHE C 214 -0.411 11.483 -9.340 1.00 75.52 C ATOM 1934 CD2 PHE C 214 -2.595 11.391 -8.400 1.00 41.12 C ATOM 1935 CE1 PHE C 214 -0.959 11.498 -10.608 1.00 35.41 C ATOM 1936 CE2 PHE C 214 -3.148 11.407 -9.664 1.00 45.43 C ATOM 1937 CZ PHE C 214 -2.329 11.460 -10.770 1.00 54.11 C ATOM 0 H PHE C 214 -1.425 13.773 -7.633 1.00 42.11 H new ATOM 0 HA PHE C 214 -0.095 12.702 -5.228 1.00 41.14 H new ATOM 0 HB2 PHE C 214 0.202 10.721 -6.797 1.00 42.11 H new ATOM 0 HB3 PHE C 214 -1.388 11.041 -6.132 1.00 42.11 H new ATOM 0 HD1 PHE C 214 0.662 11.514 -9.223 1.00 75.52 H new ATOM 0 HD2 PHE C 214 -3.242 11.348 -7.536 1.00 41.12 H new ATOM 0 HE1 PHE C 214 -0.315 11.540 -11.474 1.00 35.41 H new ATOM 0 HE2 PHE C 214 -4.221 11.378 -9.786 1.00 45.43 H new ATOM 0 HZ PHE C 214 -2.758 11.472 -11.761 1.00 54.11 H new ATOM 1947 N GLU C 215 2.238 13.002 -5.943 1.00 24.01 N ATOM 1948 CA GLU C 215 3.567 13.523 -6.174 1.00 11.02 C ATOM 1949 C GLU C 215 4.564 12.500 -6.681 1.00 53.13 C ATOM 1950 O GLU C 215 4.441 11.287 -6.450 1.00 42.02 O ATOM 1951 CB GLU C 215 4.073 14.190 -4.907 1.00 10.33 C ATOM 1952 CG GLU C 215 3.148 15.289 -4.444 1.00 12.10 C ATOM 1953 CD GLU C 215 3.613 16.013 -3.221 1.00 44.43 C ATOM 1954 OE1 GLU C 215 3.278 15.598 -2.109 1.00 13.34 O ATOM 1955 OE2 GLU C 215 4.287 17.069 -3.375 1.00 31.35 O ATOM 0 H GLU C 215 2.140 12.500 -5.060 1.00 24.01 H new ATOM 0 HA GLU C 215 3.479 14.251 -6.980 1.00 11.02 H new ATOM 0 HB2 GLU C 215 4.174 13.444 -4.119 1.00 10.33 H new ATOM 0 HB3 GLU C 215 5.066 14.602 -5.085 1.00 10.33 H new ATOM 0 HG2 GLU C 215 3.025 16.009 -5.253 1.00 12.10 H new ATOM 0 HG3 GLU C 215 2.165 14.861 -4.246 1.00 12.10 H new ATOM 1962 N SER C 216 5.546 13.007 -7.374 1.00 1.41 N ATOM 1963 CA SER C 216 6.598 12.237 -7.941 1.00 34.22 C ATOM 1964 C SER C 216 7.967 12.898 -7.623 1.00 20.11 C ATOM 1965 O SER C 216 8.001 13.933 -6.977 1.00 71.13 O ATOM 1966 CB SER C 216 6.333 12.050 -9.429 1.00 65.24 C ATOM 1967 OG SER C 216 5.992 13.283 -10.025 1.00 40.51 O ATOM 0 H SER C 216 5.631 14.006 -7.561 1.00 1.41 H new ATOM 0 HA SER C 216 6.636 11.241 -7.500 1.00 34.22 H new ATOM 0 HB2 SER C 216 7.217 11.636 -9.914 1.00 65.24 H new ATOM 0 HB3 SER C 216 5.525 11.333 -9.574 1.00 65.24 H new ATOM 0 HG SER C 216 6.309 13.297 -10.952 1.00 40.51 H new ATOM 1973 N HIS C 217 9.091 12.280 -8.060 1.00 74.23 N ATOM 1974 CA HIS C 217 10.480 12.737 -7.680 1.00 41.13 C ATOM 1975 C HIS C 217 10.726 12.456 -6.218 1.00 0.03 C ATOM 1976 O HIS C 217 11.684 12.935 -5.619 1.00 5.04 O ATOM 1977 CB HIS C 217 10.782 14.230 -7.990 1.00 23.43 C ATOM 1978 CG HIS C 217 10.896 14.561 -9.437 1.00 60.52 C ATOM 1979 ND1 HIS C 217 12.033 15.081 -10.010 1.00 2.22 N ATOM 1980 CD2 HIS C 217 10.001 14.494 -10.408 1.00 32.33 C ATOM 1981 CE1 HIS C 217 11.813 15.314 -11.282 1.00 30.12 C ATOM 1982 NE2 HIS C 217 10.578 14.966 -11.552 1.00 44.23 N ATOM 0 H HIS C 217 9.079 11.466 -8.674 1.00 74.23 H new ATOM 0 HA HIS C 217 11.162 12.164 -8.309 1.00 41.13 H new ATOM 0 HB2 HIS C 217 9.993 14.843 -7.553 1.00 23.43 H new ATOM 0 HB3 HIS C 217 11.712 14.507 -7.495 1.00 23.43 H new ATOM 0 HD2 HIS C 217 8.989 14.129 -10.313 1.00 32.33 H new ATOM 0 HE1 HIS C 217 12.525 15.721 -11.984 1.00 30.12 H new ATOM 0 HE2 HIS C 217 10.125 15.036 -12.463 1.00 44.23 H new ATOM 1991 N VAL C 218 9.873 11.644 -5.675 1.00 12.13 N ATOM 1992 CA VAL C 218 9.944 11.232 -4.317 1.00 2.21 C ATOM 1993 C VAL C 218 10.634 9.871 -4.328 1.00 62.41 C ATOM 1994 O VAL C 218 10.342 9.048 -5.192 1.00 41.14 O ATOM 1995 CB VAL C 218 8.511 11.098 -3.719 1.00 13.40 C ATOM 1996 CG1 VAL C 218 8.562 10.718 -2.252 1.00 1.31 C ATOM 1997 CG2 VAL C 218 7.690 12.383 -3.923 1.00 14.20 C ATOM 0 H VAL C 218 9.087 11.240 -6.184 1.00 12.13 H new ATOM 0 HA VAL C 218 10.487 11.955 -3.708 1.00 2.21 H new ATOM 0 HB VAL C 218 8.009 10.295 -4.259 1.00 13.40 H new ATOM 0 HG11 VAL C 218 7.547 10.632 -1.863 1.00 1.31 H new ATOM 0 HG12 VAL C 218 9.075 9.763 -2.141 1.00 1.31 H new ATOM 0 HG13 VAL C 218 9.100 11.486 -1.696 1.00 1.31 H new ATOM 0 HG21 VAL C 218 6.697 12.252 -3.493 1.00 14.20 H new ATOM 0 HG22 VAL C 218 8.191 13.217 -3.431 1.00 14.20 H new ATOM 0 HG23 VAL C 218 7.600 12.592 -4.989 1.00 14.20 H new ATOM 2007 N ALA C 219 11.556 9.655 -3.430 1.00 52.30 N ATOM 2008 CA ALA C 219 12.336 8.432 -3.420 1.00 63.41 C ATOM 2009 C ALA C 219 11.851 7.464 -2.356 1.00 32.24 C ATOM 2010 O ALA C 219 11.583 7.860 -1.224 1.00 3.14 O ATOM 2011 CB ALA C 219 13.803 8.758 -3.205 1.00 74.21 C ATOM 0 H ALA C 219 11.792 10.312 -2.686 1.00 52.30 H new ATOM 0 HA ALA C 219 12.210 7.946 -4.387 1.00 63.41 H new ATOM 0 HB1 ALA C 219 14.384 7.835 -3.198 1.00 74.21 H new ATOM 0 HB2 ALA C 219 14.154 9.402 -4.011 1.00 74.21 H new ATOM 0 HB3 ALA C 219 13.926 9.271 -2.251 1.00 74.21 H new ATOM 2017 N ARG C 220 11.766 6.184 -2.717 1.00 51.20 N ATOM 2018 CA ARG C 220 11.326 5.137 -1.787 1.00 10.54 C ATOM 2019 C ARG C 220 12.331 4.889 -0.683 1.00 44.00 C ATOM 2020 O ARG C 220 12.028 4.266 0.316 1.00 63.30 O ATOM 2021 CB ARG C 220 10.900 3.834 -2.509 1.00 22.45 C ATOM 2022 CG ARG C 220 11.926 3.172 -3.439 1.00 73.05 C ATOM 2023 CD ARG C 220 13.066 2.523 -2.689 1.00 22.44 C ATOM 2024 NE ARG C 220 14.053 1.947 -3.607 1.00 71.55 N ATOM 2025 CZ ARG C 220 15.157 1.276 -3.245 1.00 55.22 C ATOM 2026 NH1 ARG C 220 15.462 1.117 -1.952 1.00 11.43 N ATOM 2027 NH2 ARG C 220 15.966 0.785 -4.179 1.00 41.14 N ATOM 0 H ARG C 220 11.997 5.843 -3.650 1.00 51.20 H new ATOM 0 HA ARG C 220 10.426 5.518 -1.304 1.00 10.54 H new ATOM 0 HB2 ARG C 220 10.616 3.106 -1.749 1.00 22.45 H new ATOM 0 HB3 ARG C 220 10.006 4.050 -3.094 1.00 22.45 H new ATOM 0 HG2 ARG C 220 11.424 2.421 -4.049 1.00 73.05 H new ATOM 0 HG3 ARG C 220 12.327 3.921 -4.122 1.00 73.05 H new ATOM 0 HD2 ARG C 220 13.550 3.261 -2.050 1.00 22.44 H new ATOM 0 HD3 ARG C 220 12.676 1.742 -2.036 1.00 22.44 H new ATOM 0 HE ARG C 220 13.886 2.066 -4.606 1.00 71.55 H new ATOM 0 HH11 ARG C 220 14.853 1.507 -1.233 1.00 11.43 H new ATOM 0 HH12 ARG C 220 16.303 0.605 -1.686 1.00 11.43 H new ATOM 0 HH21 ARG C 220 15.746 0.919 -5.166 1.00 41.14 H new ATOM 0 HH22 ARG C 220 16.806 0.274 -3.909 1.00 41.14 H new ATOM 2041 N ALA C 221 13.531 5.358 -0.890 1.00 5.51 N ATOM 2042 CA ALA C 221 14.572 5.258 0.111 1.00 51.13 C ATOM 2043 C ALA C 221 14.301 6.234 1.246 1.00 2.31 C ATOM 2044 O ALA C 221 14.818 6.083 2.349 1.00 62.34 O ATOM 2045 CB ALA C 221 15.918 5.549 -0.512 1.00 15.21 C ATOM 0 H ALA C 221 13.820 5.820 -1.752 1.00 5.51 H new ATOM 0 HA ALA C 221 14.580 4.245 0.512 1.00 51.13 H new ATOM 0 HB1 ALA C 221 16.695 5.472 0.248 1.00 15.21 H new ATOM 0 HB2 ALA C 221 16.114 4.829 -1.306 1.00 15.21 H new ATOM 0 HB3 ALA C 221 15.916 6.557 -0.928 1.00 15.21 H new ATOM 2051 N ASN C 222 13.485 7.226 0.964 1.00 52.42 N ATOM 2052 CA ASN C 222 13.162 8.260 1.924 1.00 34.24 C ATOM 2053 C ASN C 222 11.763 8.022 2.503 1.00 51.12 C ATOM 2054 O ASN C 222 11.287 8.779 3.350 1.00 22.05 O ATOM 2055 CB ASN C 222 13.241 9.640 1.241 1.00 22.21 C ATOM 2056 CG ASN C 222 13.007 10.832 2.175 1.00 41.11 C ATOM 2057 OD1 ASN C 222 13.329 10.795 3.374 1.00 3.21 O ATOM 2058 ND2 ASN C 222 12.465 11.893 1.635 1.00 70.12 N ATOM 0 H ASN C 222 13.025 7.339 0.060 1.00 52.42 H new ATOM 0 HA ASN C 222 13.880 8.231 2.743 1.00 34.24 H new ATOM 0 HB2 ASN C 222 14.222 9.746 0.779 1.00 22.21 H new ATOM 0 HB3 ASN C 222 12.505 9.675 0.438 1.00 22.21 H new ATOM 0 HD21 ASN C 222 12.295 12.724 2.202 1.00 70.12 H new ATOM 0 HD22 ASN C 222 12.212 11.890 0.647 1.00 70.12 H new ATOM 2065 N VAL C 223 11.104 6.966 2.068 1.00 41.44 N ATOM 2066 CA VAL C 223 9.782 6.705 2.579 1.00 51.32 C ATOM 2067 C VAL C 223 9.849 5.686 3.708 1.00 73.30 C ATOM 2068 O VAL C 223 10.644 4.768 3.679 1.00 23.14 O ATOM 2069 CB VAL C 223 8.744 6.260 1.487 1.00 53.41 C ATOM 2070 CG1 VAL C 223 8.694 7.245 0.329 1.00 64.03 C ATOM 2071 CG2 VAL C 223 8.968 4.838 0.994 1.00 13.50 C ATOM 0 H VAL C 223 11.452 6.296 1.383 1.00 41.44 H new ATOM 0 HA VAL C 223 9.411 7.657 2.959 1.00 51.32 H new ATOM 0 HB VAL C 223 7.770 6.265 1.977 1.00 53.41 H new ATOM 0 HG11 VAL C 223 7.965 6.905 -0.407 1.00 64.03 H new ATOM 0 HG12 VAL C 223 8.403 8.228 0.700 1.00 64.03 H new ATOM 0 HG13 VAL C 223 9.677 7.309 -0.137 1.00 64.03 H new ATOM 0 HG21 VAL C 223 8.219 4.591 0.242 1.00 13.50 H new ATOM 0 HG22 VAL C 223 9.963 4.757 0.556 1.00 13.50 H new ATOM 0 HG23 VAL C 223 8.883 4.145 1.831 1.00 13.50 H new ATOM 2081 N LYS C 224 9.046 5.900 4.709 1.00 62.31 N ATOM 2082 CA LYS C 224 8.954 5.027 5.853 1.00 21.34 C ATOM 2083 C LYS C 224 8.124 3.842 5.526 1.00 65.42 C ATOM 2084 O LYS C 224 8.370 2.745 6.005 1.00 42.41 O ATOM 2085 CB LYS C 224 8.364 5.798 7.028 1.00 22.30 C ATOM 2086 CG LYS C 224 9.244 6.942 7.373 1.00 64.32 C ATOM 2087 CD LYS C 224 8.853 7.724 8.624 1.00 40.33 C ATOM 2088 CE LYS C 224 7.574 8.511 8.478 1.00 20.54 C ATOM 2089 NZ LYS C 224 7.360 9.406 9.641 1.00 23.11 N ATOM 0 H LYS C 224 8.420 6.704 4.758 1.00 62.31 H new ATOM 0 HA LYS C 224 9.949 4.675 6.127 1.00 21.34 H new ATOM 0 HB2 LYS C 224 7.367 6.158 6.774 1.00 22.30 H new ATOM 0 HB3 LYS C 224 8.255 5.139 7.889 1.00 22.30 H new ATOM 0 HG2 LYS C 224 10.260 6.569 7.503 1.00 64.32 H new ATOM 0 HG3 LYS C 224 9.263 7.630 6.528 1.00 64.32 H new ATOM 0 HD2 LYS C 224 8.747 7.029 9.457 1.00 40.33 H new ATOM 0 HD3 LYS C 224 9.662 8.408 8.881 1.00 40.33 H new ATOM 0 HE2 LYS C 224 7.610 9.102 7.563 1.00 20.54 H new ATOM 0 HE3 LYS C 224 6.731 7.826 8.383 1.00 20.54 H new ATOM 0 HZ1 LYS C 224 6.474 9.935 9.514 1.00 23.11 H new ATOM 0 HZ2 LYS C 224 7.303 8.838 10.510 1.00 23.11 H new ATOM 0 HZ3 LYS C 224 8.154 10.074 9.716 1.00 23.11 H new ATOM 2103 N HIS C 225 7.130 4.073 4.715 1.00 53.02 N ATOM 2104 CA HIS C 225 6.241 3.001 4.246 1.00 31.12 C ATOM 2105 C HIS C 225 5.244 3.512 3.241 1.00 52.11 C ATOM 2106 O HIS C 225 5.189 4.718 2.975 1.00 14.02 O ATOM 2107 CB HIS C 225 5.495 2.291 5.408 1.00 5.24 C ATOM 2108 CG HIS C 225 4.514 3.119 6.209 1.00 70.02 C ATOM 2109 ND1 HIS C 225 4.730 3.485 7.522 1.00 13.43 N ATOM 2110 CD2 HIS C 225 3.274 3.584 5.896 1.00 43.44 C ATOM 2111 CE1 HIS C 225 3.660 4.135 7.970 1.00 14.34 C ATOM 2112 NE2 HIS C 225 2.777 4.206 7.009 1.00 15.30 N ATOM 0 H HIS C 225 6.898 4.998 4.352 1.00 53.02 H new ATOM 0 HA HIS C 225 6.887 2.266 3.766 1.00 31.12 H new ATOM 0 HB2 HIS C 225 4.957 1.438 4.993 1.00 5.24 H new ATOM 0 HB3 HIS C 225 6.242 1.893 6.095 1.00 5.24 H new ATOM 0 HD2 HIS C 225 2.774 3.481 4.944 1.00 43.44 H new ATOM 0 HE1 HIS C 225 3.540 4.538 8.965 1.00 14.34 H new ATOM 0 HE2 HIS C 225 1.863 4.654 7.078 1.00 15.30 H new ATOM 2121 N LEU C 226 4.406 2.607 2.753 1.00 23.40 N ATOM 2122 CA LEU C 226 3.388 2.947 1.785 1.00 43.42 C ATOM 2123 C LEU C 226 2.016 2.733 2.421 1.00 25.25 C ATOM 2124 O LEU C 226 1.828 1.823 3.224 1.00 72.14 O ATOM 2125 CB LEU C 226 3.510 2.068 0.495 1.00 62.51 C ATOM 2126 CG LEU C 226 4.825 2.159 -0.317 1.00 24.24 C ATOM 2127 CD1 LEU C 226 4.763 1.246 -1.558 1.00 23.14 C ATOM 2128 CD2 LEU C 226 5.112 3.594 -0.732 1.00 5.24 C ATOM 0 H LEU C 226 4.418 1.623 3.020 1.00 23.40 H new ATOM 0 HA LEU C 226 3.517 3.989 1.493 1.00 43.42 H new ATOM 0 HB2 LEU C 226 3.366 1.027 0.784 1.00 62.51 H new ATOM 0 HB3 LEU C 226 2.687 2.331 -0.169 1.00 62.51 H new ATOM 0 HG LEU C 226 5.638 1.820 0.325 1.00 24.24 H new ATOM 0 HD11 LEU C 226 5.697 1.325 -2.115 1.00 23.14 H new ATOM 0 HD12 LEU C 226 4.614 0.213 -1.243 1.00 23.14 H new ATOM 0 HD13 LEU C 226 3.934 1.554 -2.195 1.00 23.14 H new ATOM 0 HD21 LEU C 226 6.041 3.629 -1.301 1.00 5.24 H new ATOM 0 HD22 LEU C 226 4.294 3.965 -1.350 1.00 5.24 H new ATOM 0 HD23 LEU C 226 5.207 4.218 0.157 1.00 5.24 H new ATOM 2140 N LYS C 227 1.114 3.613 2.126 1.00 12.32 N ATOM 2141 CA LYS C 227 -0.230 3.578 2.562 1.00 35.40 C ATOM 2142 C LYS C 227 -1.130 3.914 1.381 1.00 60.41 C ATOM 2143 O LYS C 227 -1.039 4.975 0.832 1.00 71.24 O ATOM 2144 CB LYS C 227 -0.401 4.567 3.715 1.00 45.10 C ATOM 2145 CG LYS C 227 -1.831 4.861 4.038 1.00 32.32 C ATOM 2146 CD LYS C 227 -2.019 5.452 5.424 1.00 41.42 C ATOM 2147 CE LYS C 227 -1.051 6.573 5.737 1.00 21.30 C ATOM 2148 NZ LYS C 227 -1.241 7.795 4.889 1.00 52.42 N ATOM 0 H LYS C 227 1.317 4.421 1.538 1.00 12.32 H new ATOM 0 HA LYS C 227 -0.505 2.589 2.928 1.00 35.40 H new ATOM 0 HB2 LYS C 227 0.089 4.167 4.603 1.00 45.10 H new ATOM 0 HB3 LYS C 227 0.106 5.499 3.463 1.00 45.10 H new ATOM 0 HG2 LYS C 227 -2.230 5.554 3.297 1.00 32.32 H new ATOM 0 HG3 LYS C 227 -2.411 3.942 3.960 1.00 32.32 H new ATOM 0 HD2 LYS C 227 -3.039 5.826 5.516 1.00 41.42 H new ATOM 0 HD3 LYS C 227 -1.901 4.663 6.166 1.00 41.42 H new ATOM 0 HE2 LYS C 227 -1.158 6.850 6.786 1.00 21.30 H new ATOM 0 HE3 LYS C 227 -0.033 6.207 5.607 1.00 21.30 H new ATOM 0 HZ1 LYS C 227 -0.732 8.596 5.315 1.00 52.42 H new ATOM 0 HZ2 LYS C 227 -0.868 7.617 3.935 1.00 52.42 H new ATOM 0 HZ3 LYS C 227 -2.254 8.021 4.828 1.00 52.42 H new ATOM 2162 N ILE C 228 -1.977 3.004 0.999 1.00 4.31 N ATOM 2163 CA ILE C 228 -2.794 3.175 -0.196 1.00 12.24 C ATOM 2164 C ILE C 228 -4.242 3.413 0.194 1.00 54.24 C ATOM 2165 O ILE C 228 -4.789 2.698 1.083 1.00 2.10 O ATOM 2166 CB ILE C 228 -2.742 1.907 -1.078 1.00 34.53 C ATOM 2167 CG1 ILE C 228 -1.291 1.451 -1.298 1.00 23.34 C ATOM 2168 CG2 ILE C 228 -3.425 2.172 -2.417 1.00 74.22 C ATOM 2169 CD1 ILE C 228 -1.160 0.170 -2.103 1.00 24.24 C ATOM 0 H ILE C 228 -2.130 2.125 1.493 1.00 4.31 H new ATOM 0 HA ILE C 228 -2.401 4.028 -0.749 1.00 12.24 H new ATOM 0 HB ILE C 228 -3.273 1.107 -0.562 1.00 34.53 H new ATOM 0 HG12 ILE C 228 -0.745 2.245 -1.807 1.00 23.34 H new ATOM 0 HG13 ILE C 228 -0.815 1.308 -0.328 1.00 23.34 H new ATOM 0 HG21 ILE C 228 -3.383 1.272 -3.031 1.00 74.22 H new ATOM 0 HG22 ILE C 228 -4.466 2.447 -2.246 1.00 74.22 H new ATOM 0 HG23 ILE C 228 -2.914 2.986 -2.931 1.00 74.22 H new ATOM 0 HD11 ILE C 228 -0.106 -0.084 -2.214 1.00 24.24 H new ATOM 0 HD12 ILE C 228 -1.676 -0.639 -1.586 1.00 24.24 H new ATOM 0 HD13 ILE C 228 -1.604 0.312 -3.088 1.00 24.24 H new ATOM 2181 N LEU C 229 -4.870 4.401 -0.446 1.00 1.44 N ATOM 2182 CA LEU C 229 -6.273 4.730 -0.199 1.00 31.34 C ATOM 2183 C LEU C 229 -6.933 5.237 -1.423 1.00 62.40 C ATOM 2184 O LEU C 229 -6.452 6.178 -2.055 1.00 51.41 O ATOM 2185 CB LEU C 229 -6.521 5.755 0.944 1.00 12.51 C ATOM 2186 CG LEU C 229 -6.039 5.372 2.302 1.00 72.31 C ATOM 2187 CD1 LEU C 229 -4.621 5.817 2.535 1.00 5.40 C ATOM 2188 CD2 LEU C 229 -6.982 5.831 3.367 1.00 51.04 C ATOM 0 H LEU C 229 -4.422 4.992 -1.146 1.00 1.44 H new ATOM 0 HA LEU C 229 -6.706 3.782 0.120 1.00 31.34 H new ATOM 0 HB2 LEU C 229 -6.045 6.696 0.667 1.00 12.51 H new ATOM 0 HB3 LEU C 229 -7.593 5.945 1.004 1.00 12.51 H new ATOM 0 HG LEU C 229 -6.024 4.283 2.357 1.00 72.31 H new ATOM 0 HD11 LEU C 229 -4.306 5.520 3.535 1.00 5.40 H new ATOM 0 HD12 LEU C 229 -3.968 5.353 1.796 1.00 5.40 H new ATOM 0 HD13 LEU C 229 -4.560 6.901 2.443 1.00 5.40 H new ATOM 0 HD21 LEU C 229 -6.600 5.535 4.344 1.00 51.04 H new ATOM 0 HD22 LEU C 229 -7.075 6.916 3.327 1.00 51.04 H new ATOM 0 HD23 LEU C 229 -7.960 5.377 3.207 1.00 51.04 H new ATOM 2200 N ASN C 230 -8.010 4.620 -1.775 1.00 4.21 N ATOM 2201 CA ASN C 230 -8.801 5.094 -2.852 1.00 1.43 C ATOM 2202 C ASN C 230 -10.214 5.330 -2.378 1.00 31.40 C ATOM 2203 O ASN C 230 -10.837 4.427 -1.810 1.00 12.12 O ATOM 2204 CB ASN C 230 -8.810 4.144 -4.026 1.00 21.01 C ATOM 2205 CG ASN C 230 -9.578 4.759 -5.157 1.00 52.12 C ATOM 2206 OD1 ASN C 230 -9.586 5.968 -5.299 1.00 43.24 O ATOM 2207 ND2 ASN C 230 -10.232 3.958 -5.950 1.00 14.43 N ATOM 0 H ASN C 230 -8.363 3.776 -1.324 1.00 4.21 H new ATOM 0 HA ASN C 230 -8.356 6.028 -3.195 1.00 1.43 H new ATOM 0 HB2 ASN C 230 -7.789 3.927 -4.340 1.00 21.01 H new ATOM 0 HB3 ASN C 230 -9.263 3.196 -3.737 1.00 21.01 H new ATOM 0 HD21 ASN C 230 -10.776 4.339 -6.724 1.00 14.43 H new ATOM 0 HD22 ASN C 230 -10.199 2.950 -5.797 1.00 14.43 H new ATOM 2214 N THR C 231 -10.702 6.509 -2.613 1.00 51.52 N ATOM 2215 CA THR C 231 -12.028 6.891 -2.253 1.00 54.13 C ATOM 2216 C THR C 231 -12.999 6.540 -3.426 1.00 23.42 C ATOM 2217 O THR C 231 -12.564 6.418 -4.582 1.00 61.15 O ATOM 2218 CB THR C 231 -12.041 8.405 -1.951 1.00 31.35 C ATOM 2219 OG1 THR C 231 -11.436 9.096 -3.044 1.00 52.31 O ATOM 2220 CG2 THR C 231 -11.265 8.734 -0.661 1.00 42.23 C ATOM 0 H THR C 231 -10.173 7.250 -3.073 1.00 51.52 H new ATOM 0 HA THR C 231 -12.358 6.354 -1.364 1.00 54.13 H new ATOM 0 HB THR C 231 -13.076 8.718 -1.814 1.00 31.35 H new ATOM 0 HG1 THR C 231 -11.451 10.060 -2.870 1.00 52.31 H new ATOM 0 HG21 THR C 231 -11.296 9.809 -0.482 1.00 42.23 H new ATOM 0 HG22 THR C 231 -11.720 8.212 0.181 1.00 42.23 H new ATOM 0 HG23 THR C 231 -10.228 8.414 -0.768 1.00 42.23 H new ATOM 2228 N PRO C 232 -14.321 6.375 -3.150 1.00 44.34 N ATOM 2229 CA PRO C 232 -15.345 5.952 -4.169 1.00 53.45 C ATOM 2230 C PRO C 232 -15.625 6.978 -5.320 1.00 63.54 C ATOM 2231 O PRO C 232 -16.749 7.041 -5.849 1.00 45.45 O ATOM 2232 CB PRO C 232 -16.608 5.775 -3.308 1.00 51.33 C ATOM 2233 CG PRO C 232 -16.394 6.675 -2.143 1.00 70.24 C ATOM 2234 CD PRO C 232 -14.938 6.570 -1.820 1.00 3.31 C ATOM 0 HA PRO C 232 -15.002 5.069 -4.709 1.00 53.45 H new ATOM 0 HB2 PRO C 232 -17.507 6.048 -3.861 1.00 51.33 H new ATOM 0 HB3 PRO C 232 -16.731 4.739 -2.992 1.00 51.33 H new ATOM 0 HG2 PRO C 232 -16.670 7.702 -2.384 1.00 70.24 H new ATOM 0 HG3 PRO C 232 -17.007 6.371 -1.295 1.00 70.24 H new ATOM 0 HD2 PRO C 232 -14.566 7.470 -1.330 1.00 3.31 H new ATOM 0 HD3 PRO C 232 -14.731 5.734 -1.152 1.00 3.31 H new ATOM 2242 N ASN C 233 -14.620 7.734 -5.721 1.00 32.53 N ATOM 2243 CA ASN C 233 -14.758 8.695 -6.822 1.00 72.31 C ATOM 2244 C ASN C 233 -13.373 9.032 -7.401 1.00 10.22 C ATOM 2245 O ASN C 233 -13.226 9.883 -8.279 1.00 23.21 O ATOM 2246 CB ASN C 233 -15.494 9.967 -6.331 1.00 71.21 C ATOM 2247 CG ASN C 233 -15.825 10.980 -7.431 1.00 53.50 C ATOM 2248 OD1 ASN C 233 -15.054 11.905 -7.718 1.00 64.31 O ATOM 2249 ND2 ASN C 233 -16.967 10.820 -8.044 1.00 14.32 N ATOM 0 H ASN C 233 -13.690 7.707 -5.303 1.00 32.53 H new ATOM 0 HA ASN C 233 -15.356 8.251 -7.618 1.00 72.31 H new ATOM 0 HB2 ASN C 233 -16.420 9.668 -5.841 1.00 71.21 H new ATOM 0 HB3 ASN C 233 -14.879 10.458 -5.577 1.00 71.21 H new ATOM 0 HD21 ASN C 233 -17.245 11.467 -8.782 1.00 14.32 H new ATOM 0 HD22 ASN C 233 -17.581 10.048 -7.785 1.00 14.32 H new ATOM 2256 N CYS C 234 -12.369 8.313 -6.952 1.00 15.44 N ATOM 2257 CA CYS C 234 -11.007 8.563 -7.370 1.00 71.30 C ATOM 2258 C CYS C 234 -10.343 7.289 -7.873 1.00 3.22 C ATOM 2259 O CYS C 234 -10.881 6.182 -7.707 1.00 4.42 O ATOM 2260 CB CYS C 234 -10.181 9.218 -6.244 1.00 12.11 C ATOM 2261 SG CYS C 234 -10.863 10.817 -5.665 1.00 11.35 S ATOM 0 H CYS C 234 -12.472 7.543 -6.291 1.00 15.44 H new ATOM 0 HA CYS C 234 -11.043 9.268 -8.200 1.00 71.30 H new ATOM 0 HB2 CYS C 234 -10.124 8.530 -5.400 1.00 12.11 H new ATOM 0 HB3 CYS C 234 -9.162 9.374 -6.597 1.00 12.11 H new ATOM 2266 N ALA C 235 -9.253 7.455 -8.578 1.00 24.41 N ATOM 2267 CA ALA C 235 -8.447 6.346 -9.009 1.00 33.44 C ATOM 2268 C ALA C 235 -7.503 5.968 -7.874 1.00 13.25 C ATOM 2269 O ALA C 235 -7.338 6.753 -6.931 1.00 32.45 O ATOM 2270 CB ALA C 235 -7.648 6.743 -10.232 1.00 1.44 C ATOM 0 H ALA C 235 -8.900 8.367 -8.869 1.00 24.41 H new ATOM 0 HA ALA C 235 -9.081 5.497 -9.265 1.00 33.44 H new ATOM 0 HB1 ALA C 235 -7.038 5.901 -10.557 1.00 1.44 H new ATOM 0 HB2 ALA C 235 -8.328 7.029 -11.034 1.00 1.44 H new ATOM 0 HB3 ALA C 235 -7.002 7.586 -9.987 1.00 1.44 H new ATOM 2276 N CYS C 236 -6.882 4.785 -7.970 1.00 14.11 N ATOM 2277 CA CYS C 236 -5.943 4.298 -6.941 1.00 31.43 C ATOM 2278 C CYS C 236 -4.859 5.354 -6.686 1.00 21.33 C ATOM 2279 O CYS C 236 -4.491 6.101 -7.602 1.00 14.44 O ATOM 2280 CB CYS C 236 -5.313 2.968 -7.386 1.00 40.43 C ATOM 2281 SG CYS C 236 -4.239 2.173 -6.139 1.00 11.11 S ATOM 0 H CYS C 236 -7.011 4.143 -8.752 1.00 14.11 H new ATOM 0 HA CYS C 236 -6.486 4.125 -6.012 1.00 31.43 H new ATOM 0 HB2 CYS C 236 -6.111 2.275 -7.652 1.00 40.43 H new ATOM 0 HB3 CYS C 236 -4.729 3.143 -8.289 1.00 40.43 H new ATOM 2286 N GLN C 237 -4.365 5.431 -5.459 1.00 31.52 N ATOM 2287 CA GLN C 237 -3.445 6.468 -5.092 1.00 21.10 C ATOM 2288 C GLN C 237 -2.612 6.015 -3.900 1.00 12.13 C ATOM 2289 O GLN C 237 -3.142 5.449 -2.936 1.00 71.24 O ATOM 2290 CB GLN C 237 -4.261 7.716 -4.778 1.00 63.44 C ATOM 2291 CG GLN C 237 -3.470 8.979 -4.527 1.00 52.44 C ATOM 2292 CD GLN C 237 -4.376 10.196 -4.432 1.00 4.31 C ATOM 2293 OE1 GLN C 237 -5.501 10.167 -5.148 1.00 52.00 O flip ATOM 2294 NE2 GLN C 237 -4.077 11.150 -3.732 1.00 15.24 N flip ATOM 0 H GLN C 237 -4.594 4.780 -4.707 1.00 31.52 H new ATOM 0 HA GLN C 237 -2.749 6.691 -5.901 1.00 21.10 H new ATOM 0 HB2 GLN C 237 -4.944 7.898 -5.608 1.00 63.44 H new ATOM 0 HB3 GLN C 237 -4.874 7.514 -3.899 1.00 63.44 H new ATOM 0 HG2 GLN C 237 -2.901 8.875 -3.603 1.00 52.44 H new ATOM 0 HG3 GLN C 237 -2.749 9.123 -5.331 1.00 52.44 H new ATOM 0 HE21 GLN C 237 -3.208 11.138 -3.198 1.00 15.24 H new ATOM 0 HE22 GLN C 237 -4.696 11.959 -3.681 1.00 15.24 H new ATOM 2303 N ILE C 238 -1.320 6.250 -3.972 1.00 22.44 N ATOM 2304 CA ILE C 238 -0.396 5.802 -2.951 1.00 21.11 C ATOM 2305 C ILE C 238 -0.034 6.981 -2.065 1.00 64.35 C ATOM 2306 O ILE C 238 0.141 8.075 -2.549 1.00 74.11 O ATOM 2307 CB ILE C 238 0.930 5.279 -3.585 1.00 14.34 C ATOM 2308 CG1 ILE C 238 0.675 4.253 -4.704 1.00 2.21 C ATOM 2309 CG2 ILE C 238 1.855 4.687 -2.520 1.00 31.51 C ATOM 2310 CD1 ILE C 238 -0.059 3.004 -4.277 1.00 13.13 C ATOM 0 H ILE C 238 -0.880 6.757 -4.740 1.00 22.44 H new ATOM 0 HA ILE C 238 -0.876 5.002 -2.388 1.00 21.11 H new ATOM 0 HB ILE C 238 1.423 6.140 -4.036 1.00 14.34 H new ATOM 0 HG12 ILE C 238 0.104 4.738 -5.496 1.00 2.21 H new ATOM 0 HG13 ILE C 238 1.634 3.963 -5.134 1.00 2.21 H new ATOM 0 HG21 ILE C 238 2.771 4.331 -2.991 1.00 31.51 H new ATOM 0 HG22 ILE C 238 2.100 5.453 -1.784 1.00 31.51 H new ATOM 0 HG23 ILE C 238 1.354 3.855 -2.025 1.00 31.51 H new ATOM 0 HD11 ILE C 238 -0.189 2.346 -5.137 1.00 13.13 H new ATOM 0 HD12 ILE C 238 0.517 2.488 -3.509 1.00 13.13 H new ATOM 0 HD13 ILE C 238 -1.036 3.275 -3.877 1.00 13.13 H new ATOM 2322 N VAL C 239 0.033 6.764 -0.797 1.00 31.52 N ATOM 2323 CA VAL C 239 0.472 7.773 0.137 1.00 62.21 C ATOM 2324 C VAL C 239 1.691 7.236 0.862 1.00 74.11 C ATOM 2325 O VAL C 239 1.673 6.116 1.360 1.00 12.45 O ATOM 2326 CB VAL C 239 -0.622 8.129 1.178 1.00 52.42 C ATOM 2327 CG1 VAL C 239 -0.170 9.278 2.073 1.00 72.34 C ATOM 2328 CG2 VAL C 239 -1.933 8.464 0.493 1.00 40.54 C ATOM 0 H VAL C 239 -0.216 5.875 -0.363 1.00 31.52 H new ATOM 0 HA VAL C 239 0.699 8.683 -0.418 1.00 62.21 H new ATOM 0 HB VAL C 239 -0.783 7.254 1.807 1.00 52.42 H new ATOM 0 HG11 VAL C 239 -0.955 9.508 2.794 1.00 72.34 H new ATOM 0 HG12 VAL C 239 0.737 8.990 2.604 1.00 72.34 H new ATOM 0 HG13 VAL C 239 0.031 10.158 1.462 1.00 72.34 H new ATOM 0 HG21 VAL C 239 -2.684 8.710 1.244 1.00 40.54 H new ATOM 0 HG22 VAL C 239 -1.790 9.317 -0.170 1.00 40.54 H new ATOM 0 HG23 VAL C 239 -2.269 7.606 -0.089 1.00 40.54 H new ATOM 2338 N ALA C 240 2.730 7.998 0.925 1.00 3.43 N ATOM 2339 CA ALA C 240 3.939 7.542 1.557 1.00 34.44 C ATOM 2340 C ALA C 240 4.370 8.496 2.633 1.00 54.01 C ATOM 2341 O ALA C 240 4.222 9.705 2.503 1.00 24.34 O ATOM 2342 CB ALA C 240 5.040 7.371 0.537 1.00 53.22 C ATOM 0 H ALA C 240 2.775 8.945 0.547 1.00 3.43 H new ATOM 0 HA ALA C 240 3.737 6.574 2.016 1.00 34.44 H new ATOM 0 HB1 ALA C 240 5.946 7.026 1.034 1.00 53.22 H new ATOM 0 HB2 ALA C 240 4.734 6.638 -0.209 1.00 53.22 H new ATOM 0 HB3 ALA C 240 5.235 8.326 0.049 1.00 53.22 H new ATOM 2348 N ARG C 241 4.888 7.965 3.702 1.00 21.44 N ATOM 2349 CA ARG C 241 5.371 8.800 4.767 1.00 24.54 C ATOM 2350 C ARG C 241 6.849 8.970 4.651 1.00 62.11 C ATOM 2351 O ARG C 241 7.551 8.007 4.527 1.00 22.02 O ATOM 2352 CB ARG C 241 4.988 8.285 6.158 1.00 61.10 C ATOM 2353 CG ARG C 241 3.513 8.292 6.426 1.00 20.24 C ATOM 2354 CD ARG C 241 3.241 8.214 7.899 1.00 2.42 C ATOM 2355 NE ARG C 241 1.823 8.408 8.185 1.00 44.14 N ATOM 2356 CZ ARG C 241 1.261 8.370 9.403 1.00 2.23 C ATOM 2357 NH1 ARG C 241 1.990 8.122 10.480 1.00 34.44 N ATOM 2358 NH2 ARG C 241 -0.022 8.595 9.528 1.00 23.31 N ATOM 0 H ARG C 241 4.987 6.962 3.861 1.00 21.44 H new ATOM 0 HA ARG C 241 4.883 9.769 4.660 1.00 24.54 H new ATOM 0 HB2 ARG C 241 5.363 7.268 6.274 1.00 61.10 H new ATOM 0 HB3 ARG C 241 5.487 8.896 6.910 1.00 61.10 H new ATOM 0 HG2 ARG C 241 3.068 9.199 6.017 1.00 20.24 H new ATOM 0 HG3 ARG C 241 3.042 7.450 5.919 1.00 20.24 H new ATOM 0 HD2 ARG C 241 3.562 7.245 8.280 1.00 2.42 H new ATOM 0 HD3 ARG C 241 3.827 8.971 8.420 1.00 2.42 H new ATOM 0 HE ARG C 241 1.207 8.588 7.392 1.00 44.14 H new ATOM 0 HH11 ARG C 241 2.993 7.957 10.390 1.00 34.44 H new ATOM 0 HH12 ARG C 241 1.549 8.096 11.399 1.00 34.44 H new ATOM 0 HH21 ARG C 241 -0.587 8.797 8.703 1.00 23.31 H new ATOM 0 HH22 ARG C 241 -0.457 8.568 10.450 1.00 23.31 H new ATOM 2372 N LEU C 242 7.306 10.188 4.683 1.00 21.52 N ATOM 2373 CA LEU C 242 8.730 10.479 4.522 1.00 43.32 C ATOM 2374 C LEU C 242 9.473 10.427 5.834 1.00 73.44 C ATOM 2375 O LEU C 242 8.935 10.817 6.880 1.00 34.04 O ATOM 2376 CB LEU C 242 8.946 11.816 3.832 1.00 52.12 C ATOM 2377 CG LEU C 242 8.492 11.911 2.382 1.00 74.02 C ATOM 2378 CD1 LEU C 242 8.932 13.223 1.815 1.00 0.02 C ATOM 2379 CD2 LEU C 242 9.047 10.763 1.556 1.00 35.31 C ATOM 0 H LEU C 242 6.721 11.012 4.819 1.00 21.52 H new ATOM 0 HA LEU C 242 9.141 9.696 3.885 1.00 43.32 H new ATOM 0 HB2 LEU C 242 8.425 12.584 4.404 1.00 52.12 H new ATOM 0 HB3 LEU C 242 10.009 12.054 3.873 1.00 52.12 H new ATOM 0 HG LEU C 242 7.405 11.844 2.348 1.00 74.02 H new ATOM 0 HD11 LEU C 242 8.610 13.297 0.776 1.00 0.02 H new ATOM 0 HD12 LEU C 242 8.489 14.035 2.391 1.00 0.02 H new ATOM 0 HD13 LEU C 242 10.019 13.294 1.864 1.00 0.02 H new ATOM 0 HD21 LEU C 242 8.706 10.858 0.525 1.00 35.31 H new ATOM 0 HD22 LEU C 242 10.136 10.790 1.581 1.00 35.31 H new ATOM 0 HD23 LEU C 242 8.698 9.816 1.968 1.00 35.31 H new ATOM 2391 N LYS C 243 10.715 9.962 5.773 1.00 12.44 N ATOM 2392 CA LYS C 243 11.554 9.783 6.952 1.00 10.32 C ATOM 2393 C LYS C 243 11.970 11.107 7.563 1.00 45.34 C ATOM 2394 O LYS C 243 11.398 11.543 8.567 1.00 72.22 O ATOM 2395 CB LYS C 243 12.764 8.957 6.586 1.00 2.13 C ATOM 2396 CG LYS C 243 12.425 7.542 6.160 1.00 72.03 C ATOM 2397 CD LYS C 243 13.613 6.857 5.560 1.00 74.21 C ATOM 2398 CE LYS C 243 14.781 6.776 6.536 1.00 44.23 C ATOM 2399 NZ LYS C 243 14.440 6.025 7.774 1.00 24.22 N ATOM 0 H LYS C 243 11.171 9.697 4.900 1.00 12.44 H new ATOM 0 HA LYS C 243 10.970 9.259 7.709 1.00 10.32 H new ATOM 0 HB2 LYS C 243 13.301 9.453 5.777 1.00 2.13 H new ATOM 0 HB3 LYS C 243 13.440 8.919 7.441 1.00 2.13 H new ATOM 0 HG2 LYS C 243 12.072 6.975 7.021 1.00 72.03 H new ATOM 0 HG3 LYS C 243 11.610 7.563 5.436 1.00 72.03 H new ATOM 0 HD2 LYS C 243 13.332 5.851 5.248 1.00 74.21 H new ATOM 0 HD3 LYS C 243 13.926 7.393 4.664 1.00 74.21 H new ATOM 0 HE2 LYS C 243 15.627 6.295 6.045 1.00 44.23 H new ATOM 0 HE3 LYS C 243 15.098 7.784 6.803 1.00 44.23 H new ATOM 0 HZ1 LYS C 243 15.300 5.882 8.341 1.00 24.22 H new ATOM 0 HZ2 LYS C 243 13.746 6.566 8.328 1.00 24.22 H new ATOM 0 HZ3 LYS C 243 14.035 5.101 7.519 1.00 24.22 H new ATOM 2455 N ARG C 247 7.050 15.643 5.782 1.00 74.44 N ATOM 2456 CA ARG C 247 5.823 14.971 6.153 1.00 24.12 C ATOM 2457 C ARG C 247 5.492 13.878 5.172 1.00 21.51 C ATOM 2458 O ARG C 247 6.346 13.455 4.411 1.00 35.04 O ATOM 2459 CB ARG C 247 4.649 15.989 6.355 1.00 74.44 C ATOM 2460 CG ARG C 247 4.369 17.006 5.238 1.00 24.11 C ATOM 2461 CD ARG C 247 3.885 16.399 3.937 1.00 33.44 C ATOM 2462 NE ARG C 247 3.417 17.429 3.003 1.00 21.31 N ATOM 2463 CZ ARG C 247 2.543 17.245 1.992 1.00 10.34 C ATOM 2464 NH1 ARG C 247 2.008 16.060 1.761 1.00 41.12 N ATOM 2465 NH2 ARG C 247 2.203 18.260 1.230 1.00 22.20 N ATOM 0 HA ARG C 247 5.973 14.490 7.119 1.00 24.12 H new ATOM 0 HB2 ARG C 247 3.736 15.416 6.520 1.00 74.44 H new ATOM 0 HB3 ARG C 247 4.846 16.546 7.271 1.00 74.44 H new ATOM 0 HG2 ARG C 247 3.622 17.717 5.591 1.00 24.11 H new ATOM 0 HG3 ARG C 247 5.280 17.571 5.043 1.00 24.11 H new ATOM 0 HD2 ARG C 247 4.693 15.830 3.477 1.00 33.44 H new ATOM 0 HD3 ARG C 247 3.076 15.697 4.141 1.00 33.44 H new ATOM 0 HE ARG C 247 3.787 18.371 3.130 1.00 21.31 H new ATOM 0 HH11 ARG C 247 2.254 15.266 2.352 1.00 41.12 H new ATOM 0 HH12 ARG C 247 1.349 15.939 0.992 1.00 41.12 H new ATOM 0 HH21 ARG C 247 2.600 19.184 1.404 1.00 22.20 H new ATOM 0 HH22 ARG C 247 1.542 18.124 0.465 1.00 22.20 H new ATOM 2479 N GLN C 248 4.264 13.445 5.176 1.00 42.53 N ATOM 2480 CA GLN C 248 3.857 12.358 4.320 1.00 44.33 C ATOM 2481 C GLN C 248 3.219 12.914 3.076 1.00 3.10 C ATOM 2482 O GLN C 248 2.371 13.802 3.147 1.00 54.14 O ATOM 2483 CB GLN C 248 2.897 11.396 5.048 1.00 54.33 C ATOM 2484 CG GLN C 248 1.582 12.007 5.527 1.00 25.31 C ATOM 2485 CD GLN C 248 0.650 10.993 6.191 1.00 31.11 C ATOM 2486 OE1 GLN C 248 0.646 9.782 5.861 1.00 4.31 O ATOM 2487 NE2 GLN C 248 -0.133 11.456 7.126 1.00 63.33 N ATOM 0 H GLN C 248 3.522 13.827 5.763 1.00 42.53 H new ATOM 0 HA GLN C 248 4.740 11.781 4.044 1.00 44.33 H new ATOM 0 HB2 GLN C 248 2.668 10.566 4.379 1.00 54.33 H new ATOM 0 HB3 GLN C 248 3.417 10.977 5.910 1.00 54.33 H new ATOM 0 HG2 GLN C 248 1.798 12.808 6.233 1.00 25.31 H new ATOM 0 HG3 GLN C 248 1.069 12.460 4.678 1.00 25.31 H new ATOM 0 HE21 GLN C 248 -0.105 12.446 7.371 1.00 63.33 H new ATOM 0 HE22 GLN C 248 -0.773 10.828 7.613 1.00 63.33 H new ATOM 2496 N VAL C 249 3.633 12.417 1.957 1.00 61.04 N ATOM 2497 CA VAL C 249 3.180 12.923 0.693 1.00 10.22 C ATOM 2498 C VAL C 249 2.515 11.820 -0.098 1.00 12.34 C ATOM 2499 O VAL C 249 2.776 10.633 0.134 1.00 13.44 O ATOM 2500 CB VAL C 249 4.348 13.561 -0.142 1.00 61.41 C ATOM 2501 CG1 VAL C 249 5.006 14.703 0.617 1.00 22.45 C ATOM 2502 CG2 VAL C 249 5.398 12.536 -0.557 1.00 52.22 C ATOM 0 H VAL C 249 4.297 11.646 1.888 1.00 61.04 H new ATOM 0 HA VAL C 249 2.457 13.713 0.896 1.00 10.22 H new ATOM 0 HB VAL C 249 3.895 13.954 -1.052 1.00 61.41 H new ATOM 0 HG11 VAL C 249 5.810 15.125 0.014 1.00 22.45 H new ATOM 0 HG12 VAL C 249 4.266 15.475 0.826 1.00 22.45 H new ATOM 0 HG13 VAL C 249 5.414 14.328 1.556 1.00 22.45 H new ATOM 0 HG21 VAL C 249 6.182 13.030 -1.131 1.00 52.22 H new ATOM 0 HG22 VAL C 249 5.833 12.080 0.332 1.00 52.22 H new ATOM 0 HG23 VAL C 249 4.931 11.764 -1.169 1.00 52.22 H new ATOM 2512 N CYS C 250 1.656 12.183 -0.990 1.00 21.33 N ATOM 2513 CA CYS C 250 1.033 11.209 -1.821 1.00 63.13 C ATOM 2514 C CYS C 250 1.891 10.958 -3.014 1.00 72.40 C ATOM 2515 O CYS C 250 2.481 11.865 -3.544 1.00 52.00 O ATOM 2516 CB CYS C 250 -0.384 11.607 -2.206 1.00 4.45 C ATOM 2517 SG CYS C 250 -1.565 11.611 -0.793 1.00 63.23 S ATOM 0 H CYS C 250 1.369 13.147 -1.162 1.00 21.33 H new ATOM 0 HA CYS C 250 0.935 10.280 -1.260 1.00 63.13 H new ATOM 0 HB2 CYS C 250 -0.363 12.601 -2.653 1.00 4.45 H new ATOM 0 HB3 CYS C 250 -0.749 10.921 -2.971 1.00 4.45 H new ATOM 2522 N ILE C 251 1.977 9.739 -3.412 1.00 61.01 N ATOM 2523 CA ILE C 251 2.834 9.345 -4.479 1.00 63.44 C ATOM 2524 C ILE C 251 1.986 8.971 -5.668 1.00 11.53 C ATOM 2525 O ILE C 251 0.834 8.526 -5.509 1.00 12.15 O ATOM 2526 CB ILE C 251 3.688 8.106 -4.073 1.00 44.14 C ATOM 2527 CG1 ILE C 251 4.366 8.328 -2.723 1.00 34.41 C ATOM 2528 CG2 ILE C 251 4.734 7.801 -5.131 1.00 40.43 C ATOM 2529 CD1 ILE C 251 5.249 9.544 -2.669 1.00 22.11 C ATOM 0 H ILE C 251 1.446 8.972 -3.000 1.00 61.01 H new ATOM 0 HA ILE C 251 3.500 10.174 -4.718 1.00 63.44 H new ATOM 0 HB ILE C 251 3.014 7.254 -3.989 1.00 44.14 H new ATOM 0 HG12 ILE C 251 3.599 8.416 -1.954 1.00 34.41 H new ATOM 0 HG13 ILE C 251 4.962 7.449 -2.480 1.00 34.41 H new ATOM 0 HG21 ILE C 251 5.318 6.933 -4.826 1.00 40.43 H new ATOM 0 HG22 ILE C 251 4.241 7.591 -6.080 1.00 40.43 H new ATOM 0 HG23 ILE C 251 5.395 8.660 -5.247 1.00 40.43 H new ATOM 0 HD11 ILE C 251 5.692 9.628 -1.676 1.00 22.11 H new ATOM 0 HD12 ILE C 251 6.041 9.452 -3.413 1.00 22.11 H new ATOM 0 HD13 ILE C 251 4.656 10.434 -2.879 1.00 22.11 H new ATOM 2541 N ASP C 252 2.531 9.164 -6.838 1.00 32.41 N ATOM 2542 CA ASP C 252 1.870 8.801 -8.053 1.00 44.32 C ATOM 2543 C ASP C 252 1.854 7.268 -8.119 1.00 54.01 C ATOM 2544 O ASP C 252 2.915 6.646 -8.093 1.00 65.23 O ATOM 2545 CB ASP C 252 2.661 9.364 -9.249 1.00 21.50 C ATOM 2546 CG ASP C 252 1.923 9.242 -10.562 1.00 2.22 C ATOM 2547 OD1 ASP C 252 1.352 8.200 -10.822 1.00 44.31 O ATOM 2548 OD2 ASP C 252 1.869 10.217 -11.329 1.00 14.43 O ATOM 0 H ASP C 252 3.452 9.581 -6.972 1.00 32.41 H new ATOM 0 HA ASP C 252 0.856 9.200 -8.085 1.00 44.32 H new ATOM 0 HB2 ASP C 252 2.889 10.414 -9.064 1.00 21.50 H new ATOM 0 HB3 ASP C 252 3.614 8.840 -9.325 1.00 21.50 H new ATOM 2553 N PRO C 253 0.661 6.636 -8.191 1.00 53.21 N ATOM 2554 CA PRO C 253 0.536 5.158 -8.246 1.00 31.45 C ATOM 2555 C PRO C 253 0.958 4.595 -9.591 1.00 14.13 C ATOM 2556 O PRO C 253 0.815 3.409 -9.860 1.00 63.53 O ATOM 2557 CB PRO C 253 -0.950 4.922 -8.034 1.00 54.13 C ATOM 2558 CG PRO C 253 -1.612 6.167 -8.501 1.00 62.11 C ATOM 2559 CD PRO C 253 -0.658 7.295 -8.221 1.00 12.20 C ATOM 0 HA PRO C 253 1.175 4.671 -7.510 1.00 31.45 H new ATOM 0 HB2 PRO C 253 -1.296 4.056 -8.599 1.00 54.13 H new ATOM 0 HB3 PRO C 253 -1.172 4.727 -6.985 1.00 54.13 H new ATOM 0 HG2 PRO C 253 -1.840 6.108 -9.565 1.00 62.11 H new ATOM 0 HG3 PRO C 253 -2.557 6.321 -7.981 1.00 62.11 H new ATOM 0 HD2 PRO C 253 -0.706 8.061 -8.995 1.00 12.20 H new ATOM 0 HD3 PRO C 253 -0.883 7.784 -7.273 1.00 12.20 H new ATOM 2567 N LYS C 254 1.396 5.477 -10.434 1.00 61.03 N ATOM 2568 CA LYS C 254 1.887 5.167 -11.721 1.00 55.41 C ATOM 2569 C LYS C 254 3.418 5.423 -11.811 1.00 21.03 C ATOM 2570 O LYS C 254 4.033 5.191 -12.863 1.00 23.41 O ATOM 2571 CB LYS C 254 1.102 6.009 -12.720 1.00 1.11 C ATOM 2572 CG LYS C 254 -0.397 5.771 -12.579 1.00 41.31 C ATOM 2573 CD LYS C 254 -1.271 6.657 -13.478 1.00 53.52 C ATOM 2574 CE LYS C 254 -1.519 8.067 -12.901 1.00 21.45 C ATOM 2575 NZ LYS C 254 -0.309 8.883 -12.735 1.00 5.43 N ATOM 0 H LYS C 254 1.418 6.475 -10.225 1.00 61.03 H new ATOM 0 HA LYS C 254 1.749 4.109 -11.945 1.00 55.41 H new ATOM 0 HB2 LYS C 254 1.322 7.065 -12.563 1.00 1.11 H new ATOM 0 HB3 LYS C 254 1.418 5.765 -13.734 1.00 1.11 H new ATOM 0 HG2 LYS C 254 -0.609 4.726 -12.805 1.00 41.31 H new ATOM 0 HG3 LYS C 254 -0.682 5.937 -11.540 1.00 41.31 H new ATOM 0 HD2 LYS C 254 -0.795 6.751 -14.454 1.00 53.52 H new ATOM 0 HD3 LYS C 254 -2.230 6.165 -13.637 1.00 53.52 H new ATOM 0 HE2 LYS C 254 -2.211 8.596 -13.556 1.00 21.45 H new ATOM 0 HE3 LYS C 254 -2.010 7.968 -11.933 1.00 21.45 H new ATOM 0 HZ1 LYS C 254 -0.569 9.817 -12.359 1.00 5.43 H new ATOM 0 HZ2 LYS C 254 0.339 8.412 -12.072 1.00 5.43 H new ATOM 0 HZ3 LYS C 254 0.161 8.999 -13.656 1.00 5.43 H new ATOM 2589 N LEU C 255 4.040 5.908 -10.702 1.00 55.13 N ATOM 2590 CA LEU C 255 5.465 6.106 -10.648 1.00 73.34 C ATOM 2591 C LEU C 255 6.248 4.806 -10.797 1.00 33.44 C ATOM 2592 O LEU C 255 5.892 3.795 -10.222 1.00 75.41 O ATOM 2593 CB LEU C 255 5.834 6.754 -9.348 1.00 44.45 C ATOM 2594 CG LEU C 255 6.323 8.180 -9.417 1.00 0.11 C ATOM 2595 CD1 LEU C 255 6.661 8.676 -8.035 1.00 71.03 C ATOM 2596 CD2 LEU C 255 7.532 8.317 -10.342 1.00 14.35 C ATOM 0 H LEU C 255 3.550 6.162 -9.844 1.00 55.13 H new ATOM 0 HA LEU C 255 5.729 6.747 -11.489 1.00 73.34 H new ATOM 0 HB2 LEU C 255 4.963 6.724 -8.693 1.00 44.45 H new ATOM 0 HB3 LEU C 255 6.609 6.151 -8.875 1.00 44.45 H new ATOM 0 HG LEU C 255 5.521 8.790 -9.832 1.00 0.11 H new ATOM 0 HD11 LEU C 255 7.013 9.706 -8.094 1.00 71.03 H new ATOM 0 HD12 LEU C 255 5.772 8.632 -7.405 1.00 71.03 H new ATOM 0 HD13 LEU C 255 7.442 8.050 -7.605 1.00 71.03 H new ATOM 0 HD21 LEU C 255 7.856 9.358 -10.366 1.00 14.35 H new ATOM 0 HD22 LEU C 255 8.345 7.692 -9.973 1.00 14.35 H new ATOM 0 HD23 LEU C 255 7.258 7.999 -11.348 1.00 14.35 H new ATOM 2608 N LYS C 256 7.363 4.890 -11.528 1.00 62.42 N ATOM 2609 CA LYS C 256 8.240 3.747 -11.847 1.00 63.03 C ATOM 2610 C LYS C 256 8.502 2.834 -10.645 1.00 64.13 C ATOM 2611 O LYS C 256 8.198 1.644 -10.687 1.00 30.35 O ATOM 2612 CB LYS C 256 9.588 4.242 -12.356 1.00 25.24 C ATOM 2613 CG LYS C 256 10.541 3.110 -12.724 1.00 41.43 C ATOM 2614 CD LYS C 256 11.938 3.607 -13.023 1.00 62.51 C ATOM 2615 CE LYS C 256 12.605 4.210 -11.787 1.00 52.34 C ATOM 2616 NZ LYS C 256 13.984 4.655 -12.065 1.00 0.53 N ATOM 0 H LYS C 256 7.693 5.770 -11.925 1.00 62.42 H new ATOM 0 HA LYS C 256 7.713 3.172 -12.608 1.00 63.03 H new ATOM 0 HB2 LYS C 256 9.430 4.874 -13.230 1.00 25.24 H new ATOM 0 HB3 LYS C 256 10.052 4.865 -11.591 1.00 25.24 H new ATOM 0 HG2 LYS C 256 10.581 2.392 -11.905 1.00 41.43 H new ATOM 0 HG3 LYS C 256 10.153 2.580 -13.594 1.00 41.43 H new ATOM 0 HD2 LYS C 256 12.545 2.782 -13.397 1.00 62.51 H new ATOM 0 HD3 LYS C 256 11.895 4.356 -13.814 1.00 62.51 H new ATOM 0 HE2 LYS C 256 12.015 5.056 -11.433 1.00 52.34 H new ATOM 0 HE3 LYS C 256 12.617 3.472 -10.985 1.00 52.34 H new ATOM 0 HZ1 LYS C 256 14.400 5.057 -11.201 1.00 0.53 H new ATOM 0 HZ2 LYS C 256 14.554 3.844 -12.378 1.00 0.53 H new ATOM 0 HZ3 LYS C 256 13.971 5.378 -12.812 1.00 0.53 H new ATOM 2630 N TRP C 257 9.085 3.394 -9.584 1.00 2.22 N ATOM 2631 CA TRP C 257 9.423 2.597 -8.403 1.00 44.33 C ATOM 2632 C TRP C 257 8.212 1.997 -7.714 1.00 64.55 C ATOM 2633 O TRP C 257 8.333 0.954 -7.073 1.00 11.21 O ATOM 2634 CB TRP C 257 10.320 3.342 -7.418 1.00 32.14 C ATOM 2635 CG TRP C 257 9.775 4.638 -6.939 1.00 54.40 C ATOM 2636 CD1 TRP C 257 9.912 5.843 -7.542 1.00 1.43 C ATOM 2637 CD2 TRP C 257 9.027 4.866 -5.742 1.00 72.54 C ATOM 2638 NE1 TRP C 257 9.296 6.799 -6.805 1.00 13.43 N ATOM 2639 CE2 TRP C 257 8.748 6.233 -5.688 1.00 63.15 C ATOM 2640 CE3 TRP C 257 8.567 4.046 -4.715 1.00 64.44 C ATOM 2641 CZ2 TRP C 257 8.029 6.809 -4.638 1.00 22.44 C ATOM 2642 CZ3 TRP C 257 7.857 4.616 -3.676 1.00 63.13 C ATOM 2643 CH2 TRP C 257 7.596 5.984 -3.644 1.00 34.23 C ATOM 0 H TRP C 257 9.330 4.382 -9.517 1.00 2.22 H new ATOM 0 HA TRP C 257 10.004 1.759 -8.788 1.00 44.33 H new ATOM 0 HB2 TRP C 257 10.502 2.700 -6.557 1.00 32.14 H new ATOM 0 HB3 TRP C 257 11.285 3.522 -7.891 1.00 32.14 H new ATOM 0 HD1 TRP C 257 10.434 6.016 -8.471 1.00 1.43 H new ATOM 0 HE1 TRP C 257 9.249 7.789 -7.047 1.00 13.43 H new ATOM 0 HE3 TRP C 257 8.762 2.984 -4.730 1.00 64.44 H new ATOM 0 HZ2 TRP C 257 7.824 7.869 -4.615 1.00 22.44 H new ATOM 0 HZ3 TRP C 257 7.497 3.989 -2.873 1.00 63.13 H new ATOM 0 HH2 TRP C 257 7.040 6.398 -2.816 1.00 34.23 H new ATOM 2654 N ILE C 258 7.057 2.647 -7.842 1.00 5.42 N ATOM 2655 CA ILE C 258 5.823 2.109 -7.288 1.00 30.20 C ATOM 2656 C ILE C 258 5.455 0.856 -8.049 1.00 20.20 C ATOM 2657 O ILE C 258 5.226 -0.192 -7.451 1.00 4.14 O ATOM 2658 CB ILE C 258 4.641 3.138 -7.352 1.00 71.22 C ATOM 2659 CG1 ILE C 258 4.875 4.313 -6.404 1.00 72.11 C ATOM 2660 CG2 ILE C 258 3.298 2.467 -7.037 1.00 13.24 C ATOM 2661 CD1 ILE C 258 4.860 3.926 -4.936 1.00 10.11 C ATOM 0 H ILE C 258 6.953 3.541 -8.322 1.00 5.42 H new ATOM 0 HA ILE C 258 5.993 1.885 -6.235 1.00 30.20 H new ATOM 0 HB ILE C 258 4.604 3.520 -8.372 1.00 71.22 H new ATOM 0 HG12 ILE C 258 5.835 4.773 -6.640 1.00 72.11 H new ATOM 0 HG13 ILE C 258 4.109 5.068 -6.579 1.00 72.11 H new ATOM 0 HG21 ILE C 258 2.500 3.208 -7.090 1.00 13.24 H new ATOM 0 HG22 ILE C 258 3.108 1.676 -7.762 1.00 13.24 H new ATOM 0 HG23 ILE C 258 3.331 2.040 -6.035 1.00 13.24 H new ATOM 0 HD11 ILE C 258 5.033 4.812 -4.324 1.00 10.11 H new ATOM 0 HD12 ILE C 258 3.892 3.494 -4.683 1.00 10.11 H new ATOM 0 HD13 ILE C 258 5.645 3.194 -4.745 1.00 10.11 H new ATOM 2673 N GLN C 259 5.442 0.972 -9.372 1.00 23.42 N ATOM 2674 CA GLN C 259 5.088 -0.129 -10.253 1.00 62.11 C ATOM 2675 C GLN C 259 6.019 -1.297 -10.013 1.00 35.53 C ATOM 2676 O GLN C 259 5.582 -2.436 -9.883 1.00 24.42 O ATOM 2677 CB GLN C 259 5.179 0.278 -11.736 1.00 3.03 C ATOM 2678 CG GLN C 259 4.648 1.664 -12.067 1.00 63.42 C ATOM 2679 CD GLN C 259 3.367 1.989 -11.360 1.00 42.42 C ATOM 2680 OE1 GLN C 259 3.384 2.530 -10.285 1.00 71.45 O ATOM 2681 NE2 GLN C 259 2.283 1.674 -11.922 1.00 72.51 N ATOM 0 H GLN C 259 5.677 1.835 -9.863 1.00 23.42 H new ATOM 0 HA GLN C 259 4.058 -0.409 -10.031 1.00 62.11 H new ATOM 0 HB2 GLN C 259 6.222 0.224 -12.046 1.00 3.03 H new ATOM 0 HB3 GLN C 259 4.631 -0.454 -12.330 1.00 3.03 H new ATOM 0 HG2 GLN C 259 5.400 2.407 -11.802 1.00 63.42 H new ATOM 0 HG3 GLN C 259 4.491 1.739 -13.143 1.00 63.42 H new ATOM 0 HE21 GLN C 259 2.295 1.216 -12.833 1.00 72.51 H new ATOM 0 HE22 GLN C 259 1.394 1.877 -11.465 1.00 72.51 H new ATOM 2690 N GLU C 260 7.305 -0.980 -9.949 1.00 32.20 N ATOM 2691 CA GLU C 260 8.365 -1.898 -9.693 1.00 63.40 C ATOM 2692 C GLU C 260 8.066 -2.649 -8.375 1.00 74.01 C ATOM 2693 O GLU C 260 8.096 -3.887 -8.321 1.00 54.24 O ATOM 2694 CB GLU C 260 9.608 -1.017 -9.523 1.00 75.44 C ATOM 2695 CG GLU C 260 10.924 -1.646 -9.825 1.00 31.31 C ATOM 2696 CD GLU C 260 11.251 -2.856 -8.981 1.00 32.54 C ATOM 2697 OE1 GLU C 260 11.365 -2.707 -7.740 1.00 60.11 O ATOM 2698 OE2 GLU C 260 11.393 -3.967 -9.546 1.00 52.35 O ATOM 0 H GLU C 260 7.635 -0.024 -10.083 1.00 32.20 H new ATOM 0 HA GLU C 260 8.492 -2.637 -10.484 1.00 63.40 H new ATOM 0 HB2 GLU C 260 9.495 -0.142 -10.164 1.00 75.44 H new ATOM 0 HB3 GLU C 260 9.631 -0.658 -8.494 1.00 75.44 H new ATOM 0 HG2 GLU C 260 10.940 -1.937 -10.875 1.00 31.31 H new ATOM 0 HG3 GLU C 260 11.708 -0.901 -9.688 1.00 31.31 H new ATOM 2705 N TYR C 261 7.731 -1.872 -7.352 1.00 73.04 N ATOM 2706 CA TYR C 261 7.476 -2.363 -6.008 1.00 30.40 C ATOM 2707 C TYR C 261 6.252 -3.299 -6.003 1.00 3.33 C ATOM 2708 O TYR C 261 6.333 -4.436 -5.540 1.00 34.14 O ATOM 2709 CB TYR C 261 7.236 -1.149 -5.089 1.00 4.35 C ATOM 2710 CG TYR C 261 7.232 -1.425 -3.604 1.00 53.03 C ATOM 2711 CD1 TYR C 261 6.120 -1.951 -2.968 1.00 65.41 C ATOM 2712 CD2 TYR C 261 8.350 -1.126 -2.832 1.00 44.33 C ATOM 2713 CE1 TYR C 261 6.119 -2.178 -1.611 1.00 64.13 C ATOM 2714 CE2 TYR C 261 8.362 -1.349 -1.472 1.00 72.40 C ATOM 2715 CZ TYR C 261 7.239 -1.879 -0.864 1.00 64.41 C ATOM 2716 OH TYR C 261 7.229 -2.114 0.492 1.00 2.11 O ATOM 0 H TYR C 261 7.627 -0.861 -7.438 1.00 73.04 H new ATOM 0 HA TYR C 261 8.331 -2.935 -5.649 1.00 30.40 H new ATOM 0 HB2 TYR C 261 8.005 -0.405 -5.297 1.00 4.35 H new ATOM 0 HB3 TYR C 261 6.279 -0.701 -5.356 1.00 4.35 H new ATOM 0 HD1 TYR C 261 5.239 -2.187 -3.547 1.00 65.41 H new ATOM 0 HD2 TYR C 261 9.226 -0.711 -3.308 1.00 44.33 H new ATOM 0 HE1 TYR C 261 5.243 -2.589 -1.132 1.00 64.13 H new ATOM 0 HE2 TYR C 261 9.239 -1.112 -0.888 1.00 72.40 H new ATOM 0 HH TYR C 261 8.092 -1.852 0.876 1.00 2.11 H new ATOM 2726 N LEU C 262 5.131 -2.803 -6.523 1.00 23.14 N ATOM 2727 CA LEU C 262 3.872 -3.583 -6.606 1.00 52.12 C ATOM 2728 C LEU C 262 4.074 -4.875 -7.375 1.00 44.44 C ATOM 2729 O LEU C 262 3.726 -5.949 -6.895 1.00 43.41 O ATOM 2730 CB LEU C 262 2.792 -2.789 -7.346 1.00 1.12 C ATOM 2731 CG LEU C 262 2.512 -1.382 -6.864 1.00 31.20 C ATOM 2732 CD1 LEU C 262 1.463 -0.717 -7.753 1.00 1.12 C ATOM 2733 CD2 LEU C 262 2.080 -1.361 -5.407 1.00 40.55 C ATOM 0 H LEU C 262 5.057 -1.858 -6.899 1.00 23.14 H new ATOM 0 HA LEU C 262 3.568 -3.795 -5.581 1.00 52.12 H new ATOM 0 HB2 LEU C 262 3.074 -2.735 -8.398 1.00 1.12 H new ATOM 0 HB3 LEU C 262 1.862 -3.355 -7.294 1.00 1.12 H new ATOM 0 HG LEU C 262 3.440 -0.815 -6.933 1.00 31.20 H new ATOM 0 HD11 LEU C 262 1.271 0.294 -7.395 1.00 1.12 H new ATOM 0 HD12 LEU C 262 1.829 -0.676 -8.779 1.00 1.12 H new ATOM 0 HD13 LEU C 262 0.539 -1.295 -7.720 1.00 1.12 H new ATOM 0 HD21 LEU C 262 1.889 -0.333 -5.099 1.00 40.55 H new ATOM 0 HD22 LEU C 262 1.171 -1.951 -5.288 1.00 40.55 H new ATOM 0 HD23 LEU C 262 2.870 -1.784 -4.787 1.00 40.55 H new ATOM 2745 N GLU C 263 4.633 -4.747 -8.566 1.00 12.13 N ATOM 2746 CA GLU C 263 4.826 -5.867 -9.477 1.00 52.44 C ATOM 2747 C GLU C 263 5.594 -7.013 -8.801 1.00 70.41 C ATOM 2748 O GLU C 263 5.169 -8.161 -8.859 1.00 72.33 O ATOM 2749 CB GLU C 263 5.563 -5.386 -10.725 1.00 25.40 C ATOM 2750 CG GLU C 263 5.152 -6.075 -12.015 1.00 74.31 C ATOM 2751 CD GLU C 263 5.417 -7.565 -12.062 1.00 15.44 C ATOM 2752 OE1 GLU C 263 6.543 -7.970 -12.436 1.00 21.44 O ATOM 2753 OE2 GLU C 263 4.495 -8.358 -11.757 1.00 34.12 O ATOM 0 H GLU C 263 4.969 -3.857 -8.933 1.00 12.13 H new ATOM 0 HA GLU C 263 3.848 -6.256 -9.762 1.00 52.44 H new ATOM 0 HB2 GLU C 263 5.400 -4.314 -10.835 1.00 25.40 H new ATOM 0 HB3 GLU C 263 6.633 -5.532 -10.577 1.00 25.40 H new ATOM 0 HG2 GLU C 263 4.087 -5.906 -12.175 1.00 74.31 H new ATOM 0 HG3 GLU C 263 5.678 -5.602 -12.844 1.00 74.31 H new ATOM 2760 N LYS C 264 6.699 -6.710 -8.133 1.00 15.21 N ATOM 2761 CA LYS C 264 7.463 -7.732 -7.500 1.00 53.30 C ATOM 2762 C LYS C 264 6.761 -8.288 -6.282 1.00 20.02 C ATOM 2763 O LYS C 264 6.877 -9.460 -5.976 1.00 30.54 O ATOM 2764 CB LYS C 264 8.825 -7.231 -7.125 1.00 53.53 C ATOM 2765 CG LYS C 264 8.883 -6.074 -6.150 1.00 74.51 C ATOM 2766 CD LYS C 264 10.312 -5.813 -5.737 1.00 54.22 C ATOM 2767 CE LYS C 264 10.425 -4.654 -4.773 1.00 53.11 C ATOM 2768 NZ LYS C 264 11.797 -4.536 -4.253 1.00 1.51 N ATOM 0 H LYS C 264 7.070 -5.766 -8.026 1.00 15.21 H new ATOM 0 HA LYS C 264 7.572 -8.541 -8.223 1.00 53.30 H new ATOM 0 HB2 LYS C 264 9.387 -8.062 -6.699 1.00 53.53 H new ATOM 0 HB3 LYS C 264 9.340 -6.932 -8.038 1.00 53.53 H new ATOM 0 HG2 LYS C 264 8.460 -5.180 -6.609 1.00 74.51 H new ATOM 0 HG3 LYS C 264 8.278 -6.298 -5.272 1.00 74.51 H new ATOM 0 HD2 LYS C 264 10.724 -6.710 -5.274 1.00 54.22 H new ATOM 0 HD3 LYS C 264 10.913 -5.606 -6.623 1.00 54.22 H new ATOM 0 HE2 LYS C 264 10.141 -3.729 -5.275 1.00 53.11 H new ATOM 0 HE3 LYS C 264 9.729 -4.794 -3.946 1.00 53.11 H new ATOM 0 HZ1 LYS C 264 11.850 -3.734 -3.593 1.00 1.51 H new ATOM 0 HZ2 LYS C 264 12.056 -5.412 -3.755 1.00 1.51 H new ATOM 0 HZ3 LYS C 264 12.455 -4.379 -5.043 1.00 1.51 H new ATOM 2782 N CYS C 265 6.040 -7.440 -5.614 1.00 13.31 N ATOM 2783 CA CYS C 265 5.306 -7.802 -4.392 1.00 41.33 C ATOM 2784 C CYS C 265 4.166 -8.798 -4.686 1.00 22.14 C ATOM 2785 O CYS C 265 3.724 -9.515 -3.800 1.00 61.52 O ATOM 2786 CB CYS C 265 4.753 -6.530 -3.713 1.00 34.44 C ATOM 2787 SG CYS C 265 3.891 -6.794 -2.119 1.00 43.21 S ATOM 0 H CYS C 265 5.929 -6.463 -5.886 1.00 13.31 H new ATOM 0 HA CYS C 265 6.003 -8.296 -3.714 1.00 41.33 H new ATOM 0 HB2 CYS C 265 5.580 -5.839 -3.548 1.00 34.44 H new ATOM 0 HB3 CYS C 265 4.063 -6.043 -4.402 1.00 34.44 H new ATOM 2792 N LEU C 266 3.726 -8.837 -5.943 1.00 53.01 N ATOM 2793 CA LEU C 266 2.641 -9.687 -6.385 1.00 24.42 C ATOM 2794 C LEU C 266 2.966 -11.181 -6.140 1.00 54.23 C ATOM 2795 O LEU C 266 2.371 -11.836 -5.289 1.00 22.03 O ATOM 2796 CB LEU C 266 2.409 -9.423 -7.904 1.00 24.24 C ATOM 2797 CG LEU C 266 1.079 -9.876 -8.549 1.00 70.11 C ATOM 2798 CD1 LEU C 266 0.837 -11.383 -8.466 1.00 21.23 C ATOM 2799 CD2 LEU C 266 -0.057 -9.105 -7.943 1.00 51.02 C ATOM 0 H LEU C 266 4.125 -8.267 -6.688 1.00 53.01 H new ATOM 0 HA LEU C 266 1.740 -9.455 -5.817 1.00 24.42 H new ATOM 0 HB2 LEU C 266 2.507 -8.350 -8.070 1.00 24.24 H new ATOM 0 HB3 LEU C 266 3.220 -9.905 -8.449 1.00 24.24 H new ATOM 0 HG LEU C 266 1.146 -9.658 -9.615 1.00 70.11 H new ATOM 0 HD11 LEU C 266 -0.115 -11.625 -8.939 1.00 21.23 H new ATOM 0 HD12 LEU C 266 1.642 -11.910 -8.979 1.00 21.23 H new ATOM 0 HD13 LEU C 266 0.811 -11.690 -7.421 1.00 21.23 H new ATOM 0 HD21 LEU C 266 -0.996 -9.423 -8.397 1.00 51.02 H new ATOM 0 HD22 LEU C 266 -0.091 -9.291 -6.870 1.00 51.02 H new ATOM 0 HD23 LEU C 266 0.090 -8.040 -8.122 1.00 51.02 H new ATOM 2811 N ASN C 267 3.906 -11.697 -6.878 1.00 10.25 N ATOM 2812 CA ASN C 267 4.202 -13.117 -6.830 1.00 21.54 C ATOM 2813 C ASN C 267 5.357 -13.408 -5.925 1.00 21.24 C ATOM 2814 O ASN C 267 5.287 -14.281 -5.051 1.00 35.32 O ATOM 2815 CB ASN C 267 4.470 -13.656 -8.248 1.00 4.51 C ATOM 2816 CG ASN C 267 4.740 -15.137 -8.272 1.00 34.01 C ATOM 2817 OD1 ASN C 267 3.819 -15.944 -8.386 1.00 44.12 O ATOM 2818 ND2 ASN C 267 5.984 -15.511 -8.199 1.00 33.53 N ATOM 0 H ASN C 267 4.487 -11.163 -7.524 1.00 10.25 H new ATOM 0 HA ASN C 267 3.330 -13.627 -6.420 1.00 21.54 H new ATOM 0 HB2 ASN C 267 3.611 -13.438 -8.882 1.00 4.51 H new ATOM 0 HB3 ASN C 267 5.323 -13.130 -8.676 1.00 4.51 H new ATOM 0 HD21 ASN C 267 6.222 -16.502 -8.236 1.00 33.53 H new ATOM 0 HD22 ASN C 267 6.722 -14.813 -8.105 1.00 33.53 H new ATOM 3008 N TYR D 312 -9.787 8.870 7.936 1.00 63.21 N ATOM 3009 CA TYR D 312 -8.609 9.268 7.164 1.00 50.11 C ATOM 3010 C TYR D 312 -8.846 10.645 6.590 1.00 13.45 C ATOM 3011 O TYR D 312 -9.995 11.073 6.447 1.00 51.03 O ATOM 3012 CB TYR D 312 -8.297 8.269 6.008 1.00 34.11 C ATOM 3013 CG TYR D 312 -6.955 8.518 5.308 1.00 42.54 C ATOM 3014 CD1 TYR D 312 -5.771 8.231 5.974 1.00 30.31 C ATOM 3015 CD2 TYR D 312 -6.860 9.038 3.987 1.00 15.22 C ATOM 3016 CE1 TYR D 312 -4.559 8.445 5.391 1.00 72.43 C ATOM 3017 CE2 TYR D 312 -5.623 9.245 3.406 1.00 3.40 C ATOM 3018 CZ TYR D 312 -4.478 8.947 4.122 1.00 13.23 C ATOM 3019 OH TYR D 312 -3.240 9.140 3.568 1.00 60.44 O ATOM 0 HA TYR D 312 -7.749 9.269 7.834 1.00 50.11 H new ATOM 0 HB2 TYR D 312 -8.303 7.255 6.407 1.00 34.11 H new ATOM 0 HB3 TYR D 312 -9.096 8.325 5.269 1.00 34.11 H new ATOM 0 HD1 TYR D 312 -5.812 7.829 6.976 1.00 30.31 H new ATOM 0 HD2 TYR D 312 -7.759 9.272 3.436 1.00 15.22 H new ATOM 0 HE1 TYR D 312 -3.655 8.216 5.935 1.00 72.43 H new ATOM 0 HE2 TYR D 312 -5.551 9.636 2.402 1.00 3.40 H new ATOM 0 HH TYR D 312 -3.235 9.979 3.062 1.00 60.44 H new ATOM 3029 N THR D 313 -7.782 11.323 6.256 1.00 23.45 N ATOM 3030 CA THR D 313 -7.824 12.616 5.621 1.00 60.45 C ATOM 3031 C THR D 313 -8.083 12.453 4.112 1.00 40.12 C ATOM 3032 O THR D 313 -7.534 13.177 3.292 1.00 73.32 O ATOM 3033 CB THR D 313 -6.477 13.302 5.849 1.00 61.13 C ATOM 3034 OG1 THR D 313 -5.406 12.418 5.433 1.00 24.41 O ATOM 3035 CG2 THR D 313 -6.302 13.654 7.318 1.00 41.33 C ATOM 0 H THR D 313 -6.835 10.983 6.422 1.00 23.45 H new ATOM 0 HA THR D 313 -8.629 13.217 6.044 1.00 60.45 H new ATOM 0 HB THR D 313 -6.447 14.219 5.261 1.00 61.13 H new ATOM 0 HG1 THR D 313 -4.543 12.859 5.578 1.00 24.41 H new ATOM 0 HG21 THR D 313 -5.338 14.142 7.463 1.00 41.33 H new ATOM 0 HG22 THR D 313 -7.100 14.329 7.628 1.00 41.33 H new ATOM 0 HG23 THR D 313 -6.342 12.744 7.917 1.00 41.33 H new ATOM 3043 N GLU D 314 -9.006 11.547 3.779 1.00 44.51 N ATOM 3044 CA GLU D 314 -9.328 11.172 2.402 1.00 31.50 C ATOM 3045 C GLU D 314 -10.106 12.255 1.646 1.00 62.31 C ATOM 3046 O GLU D 314 -10.747 11.976 0.643 1.00 4.24 O ATOM 3047 CB GLU D 314 -10.123 9.863 2.379 1.00 50.24 C ATOM 3048 CG GLU D 314 -11.378 9.864 3.226 1.00 65.42 C ATOM 3049 CD GLU D 314 -12.237 8.647 2.963 1.00 34.14 C ATOM 3050 OE1 GLU D 314 -11.746 7.512 3.135 1.00 41.35 O ATOM 3051 OE2 GLU D 314 -13.403 8.832 2.543 1.00 53.22 O ATOM 0 H GLU D 314 -9.560 11.045 4.473 1.00 44.51 H new ATOM 0 HA GLU D 314 -8.374 11.044 1.890 1.00 31.50 H new ATOM 0 HB2 GLU D 314 -10.398 9.640 1.348 1.00 50.24 H new ATOM 0 HB3 GLU D 314 -9.474 9.055 2.718 1.00 50.24 H new ATOM 0 HG2 GLU D 314 -11.104 9.894 4.281 1.00 65.42 H new ATOM 0 HG3 GLU D 314 -11.954 10.766 3.020 1.00 65.42 H new ATOM 3058 N GLU D 315 -10.018 13.470 2.092 1.00 44.15 N ATOM 3059 CA GLU D 315 -10.749 14.519 1.463 1.00 13.43 C ATOM 3060 C GLU D 315 -9.841 15.470 0.673 1.00 4.34 C ATOM 3061 O GLU D 315 -10.166 15.856 -0.442 1.00 41.32 O ATOM 3062 CB GLU D 315 -11.633 15.256 2.464 1.00 70.51 C ATOM 3063 CG GLU D 315 -10.871 15.832 3.631 1.00 21.12 C ATOM 3064 CD GLU D 315 -11.749 16.550 4.617 1.00 2.41 C ATOM 3065 OE1 GLU D 315 -12.106 17.727 4.369 1.00 54.33 O ATOM 3066 OE2 GLU D 315 -12.075 15.969 5.673 1.00 14.01 O ATOM 0 H GLU D 315 -9.448 13.757 2.888 1.00 44.15 H new ATOM 0 HA GLU D 315 -11.410 14.057 0.730 1.00 13.43 H new ATOM 0 HB2 GLU D 315 -12.157 16.062 1.950 1.00 70.51 H new ATOM 0 HB3 GLU D 315 -12.393 14.570 2.839 1.00 70.51 H new ATOM 0 HG2 GLU D 315 -10.343 15.028 4.143 1.00 21.12 H new ATOM 0 HG3 GLU D 315 -10.115 16.523 3.257 1.00 21.12 H new ATOM 3073 N MET D 316 -8.716 15.841 1.246 1.00 34.12 N ATOM 3074 CA MET D 316 -7.772 16.747 0.587 1.00 14.01 C ATOM 3075 C MET D 316 -6.361 16.473 1.033 1.00 23.50 C ATOM 3076 O MET D 316 -6.130 16.033 2.161 1.00 73.52 O ATOM 3077 CB MET D 316 -8.094 18.244 0.829 1.00 51.43 C ATOM 3078 CG MET D 316 -9.415 18.729 0.247 1.00 12.43 C ATOM 3079 SD MET D 316 -9.681 20.504 0.462 1.00 3.41 S ATOM 3080 CE MET D 316 -9.606 20.646 2.245 1.00 14.02 C ATOM 0 H MET D 316 -8.423 15.532 2.173 1.00 34.12 H new ATOM 0 HA MET D 316 -7.873 16.552 -0.481 1.00 14.01 H new ATOM 0 HB2 MET D 316 -8.100 18.428 1.903 1.00 51.43 H new ATOM 0 HB3 MET D 316 -7.288 18.845 0.407 1.00 51.43 H new ATOM 0 HG2 MET D 316 -9.445 18.490 -0.816 1.00 12.43 H new ATOM 0 HG3 MET D 316 -10.234 18.186 0.719 1.00 12.43 H new ATOM 0 HE1 MET D 316 -10.074 21.580 2.556 1.00 14.02 H new ATOM 0 HE2 MET D 316 -10.133 19.807 2.699 1.00 14.02 H new ATOM 0 HE3 MET D 316 -8.565 20.638 2.567 1.00 14.02 H new ATOM 3090 N GLY D 317 -5.430 16.747 0.154 1.00 14.24 N ATOM 3091 CA GLY D 317 -4.035 16.553 0.426 1.00 34.41 C ATOM 3092 C GLY D 317 -3.224 17.328 -0.570 1.00 73.30 C ATOM 3093 O GLY D 317 -3.434 17.186 -1.793 1.00 52.13 O ATOM 0 H GLY D 317 -5.625 17.114 -0.778 1.00 14.24 H new ATOM 0 HA2 GLY D 317 -3.801 16.882 1.438 1.00 34.41 H new ATOM 0 HA3 GLY D 317 -3.786 15.493 0.370 1.00 34.41 H new ATOM 3097 N SER D 318 -2.320 18.138 -0.084 1.00 64.40 N ATOM 3098 CA SER D 318 -1.549 19.016 -0.925 1.00 62.23 C ATOM 3099 C SER D 318 -0.363 18.288 -1.564 1.00 24.24 C ATOM 3100 O SER D 318 0.490 17.731 -0.864 1.00 41.33 O ATOM 3101 CB SER D 318 -1.081 20.222 -0.107 1.00 61.21 C ATOM 3102 OG SER D 318 -2.203 20.902 0.461 1.00 23.30 O ATOM 0 H SER D 318 -2.097 18.208 0.909 1.00 64.40 H new ATOM 0 HA SER D 318 -2.183 19.362 -1.741 1.00 62.23 H new ATOM 0 HB2 SER D 318 -0.407 19.894 0.684 1.00 61.21 H new ATOM 0 HB3 SER D 318 -0.517 20.905 -0.743 1.00 61.21 H new ATOM 0 HG SER D 318 -1.890 21.670 0.983 1.00 23.30 H new ATOM 3108 N GLY D 319 -0.336 18.290 -2.885 1.00 15.35 N ATOM 3109 CA GLY D 319 0.732 17.668 -3.626 1.00 0.41 C ATOM 3110 C GLY D 319 1.315 18.629 -4.642 1.00 62.23 C ATOM 3111 O GLY D 319 0.565 19.375 -5.288 1.00 72.21 O ATOM 0 H GLY D 319 -1.054 18.723 -3.467 1.00 15.35 H new ATOM 0 HA2 GLY D 319 1.513 17.340 -2.940 1.00 0.41 H new ATOM 0 HA3 GLY D 319 0.358 16.778 -4.133 1.00 0.41 H new ATOM 3115 N ASP D 320 2.628 18.625 -4.788 1.00 55.31 N ATOM 3116 CA ASP D 320 3.325 19.565 -5.673 1.00 73.43 C ATOM 3117 C ASP D 320 4.448 18.934 -6.458 1.00 73.45 C ATOM 3118 O ASP D 320 4.597 19.231 -7.639 1.00 24.33 O ATOM 3119 CB ASP D 320 3.964 20.668 -4.864 1.00 3.10 C ATOM 3120 CG ASP D 320 3.003 21.638 -4.225 1.00 33.14 C ATOM 3121 OD1 ASP D 320 2.557 22.586 -4.893 1.00 52.31 O ATOM 3122 OD2 ASP D 320 2.710 21.497 -3.024 1.00 43.02 O ATOM 0 H ASP D 320 3.247 17.976 -4.302 1.00 55.31 H new ATOM 0 HA ASP D 320 2.559 19.928 -6.358 1.00 73.43 H new ATOM 0 HB2 ASP D 320 4.573 20.216 -4.081 1.00 3.10 H new ATOM 0 HB3 ASP D 320 4.641 21.226 -5.511 1.00 3.10 H new ATOM 3151 N ASP D 322 6.505 17.649 -8.765 1.00 30.44 N ATOM 3152 CA ASP D 322 6.293 17.204 -10.155 1.00 21.21 C ATOM 3153 C ASP D 322 4.817 16.859 -10.319 1.00 61.40 C ATOM 3154 O ASP D 322 4.058 17.603 -10.941 1.00 64.24 O ATOM 3155 CB ASP D 322 7.192 16.034 -10.453 1.00 12.41 C ATOM 3156 CG ASP D 322 7.192 15.593 -11.903 1.00 53.14 C ATOM 3157 OD1 ASP D 322 6.288 14.850 -12.323 1.00 74.11 O ATOM 3158 OD2 ASP D 322 8.150 15.944 -12.630 1.00 52.11 O ATOM 0 HA ASP D 322 6.547 17.989 -10.867 1.00 21.21 H new ATOM 0 HB2 ASP D 322 8.211 16.293 -10.165 1.00 12.41 H new ATOM 0 HB3 ASP D 322 6.889 15.192 -9.831 1.00 12.41 H new ATOM 3163 N SER D 323 4.438 15.742 -9.747 1.00 24.12 N ATOM 3164 CA SER D 323 3.085 15.399 -9.490 1.00 43.40 C ATOM 3165 C SER D 323 2.264 14.982 -10.744 1.00 12.30 C ATOM 3166 O SER D 323 1.030 15.146 -10.780 1.00 32.43 O ATOM 3167 CB SER D 323 2.438 16.525 -8.557 1.00 72.41 C ATOM 3168 OG SER D 323 1.068 16.300 -8.268 1.00 50.23 O ATOM 0 H SER D 323 5.099 15.028 -9.441 1.00 24.12 H new ATOM 0 HA SER D 323 3.056 14.463 -8.932 1.00 43.40 H new ATOM 0 HB2 SER D 323 2.995 16.575 -7.622 1.00 72.41 H new ATOM 0 HB3 SER D 323 2.544 17.494 -9.044 1.00 72.41 H new ATOM 0 HG SER D 323 0.922 15.346 -8.096 1.00 50.23 H new ATOM 3174 N MET D 324 2.937 14.377 -11.742 1.00 52.14 N ATOM 3175 CA MET D 324 2.222 13.817 -12.900 1.00 74.22 C ATOM 3176 C MET D 324 3.087 12.871 -13.748 1.00 44.33 C ATOM 3177 O MET D 324 3.996 13.308 -14.471 1.00 43.12 O ATOM 3178 CB MET D 324 1.593 14.906 -13.777 1.00 32.32 C ATOM 3179 CG MET D 324 0.746 14.366 -14.917 1.00 14.51 C ATOM 3180 SD MET D 324 -0.080 15.672 -15.857 1.00 13.53 S ATOM 3181 CE MET D 324 -1.078 16.436 -14.568 1.00 72.35 C ATOM 0 H MET D 324 3.951 14.266 -11.769 1.00 52.14 H new ATOM 0 HA MET D 324 1.417 13.218 -12.475 1.00 74.22 H new ATOM 0 HB2 MET D 324 0.975 15.550 -13.152 1.00 32.32 H new ATOM 0 HB3 MET D 324 2.386 15.529 -14.190 1.00 32.32 H new ATOM 0 HG2 MET D 324 1.378 13.785 -15.589 1.00 14.51 H new ATOM 0 HG3 MET D 324 -0.004 13.684 -14.515 1.00 14.51 H new ATOM 0 HE1 MET D 324 -1.931 16.943 -15.020 1.00 72.35 H new ATOM 0 HE2 MET D 324 -1.434 15.669 -13.881 1.00 72.35 H new ATOM 0 HE3 MET D 324 -0.474 17.160 -14.021 1.00 72.35 H new ATOM 3191 N LYS D 325 2.818 11.584 -13.622 1.00 74.33 N ATOM 3192 CA LYS D 325 3.443 10.535 -14.434 1.00 73.23 C ATOM 3193 C LYS D 325 2.402 9.547 -14.950 1.00 15.42 C ATOM 3194 O LYS D 325 1.222 9.686 -14.689 1.00 21.05 O ATOM 3195 CB LYS D 325 4.538 9.776 -13.649 1.00 32.23 C ATOM 3196 CG LYS D 325 5.866 10.459 -13.581 1.00 22.40 C ATOM 3197 CD LYS D 325 6.470 10.521 -14.962 1.00 14.21 C ATOM 3198 CE LYS D 325 7.850 11.075 -14.925 1.00 52.41 C ATOM 3199 NZ LYS D 325 8.460 11.157 -16.272 1.00 22.15 N ATOM 0 H LYS D 325 2.148 11.224 -12.942 1.00 74.33 H new ATOM 0 HA LYS D 325 3.913 11.032 -15.283 1.00 73.23 H new ATOM 0 HB2 LYS D 325 4.182 9.608 -12.633 1.00 32.23 H new ATOM 0 HB3 LYS D 325 4.675 8.796 -14.105 1.00 32.23 H new ATOM 0 HG2 LYS D 325 5.749 11.465 -13.178 1.00 22.40 H new ATOM 0 HG3 LYS D 325 6.530 9.920 -12.906 1.00 22.40 H new ATOM 0 HD2 LYS D 325 6.489 9.522 -15.398 1.00 14.21 H new ATOM 0 HD3 LYS D 325 5.845 11.139 -15.607 1.00 14.21 H new ATOM 0 HE2 LYS D 325 7.828 12.069 -14.478 1.00 52.41 H new ATOM 0 HE3 LYS D 325 8.473 10.451 -14.284 1.00 52.41 H new ATOM 0 HZ1 LYS D 325 9.420 11.549 -16.195 1.00 22.15 H new ATOM 0 HZ2 LYS D 325 8.506 10.206 -16.691 1.00 22.15 H new ATOM 0 HZ3 LYS D 325 7.882 11.774 -16.878 1.00 22.15 H new ATOM 3213 N GLU D 326 2.852 8.571 -15.686 1.00 11.11 N ATOM 3214 CA GLU D 326 2.044 7.509 -16.178 1.00 32.34 C ATOM 3215 C GLU D 326 2.827 6.228 -15.916 1.00 55.43 C ATOM 3216 O GLU D 326 4.043 6.317 -15.744 1.00 5.44 O ATOM 3217 CB GLU D 326 1.683 7.700 -17.688 1.00 74.22 C ATOM 3218 CG GLU D 326 2.846 7.801 -18.686 1.00 3.43 C ATOM 3219 CD GLU D 326 3.726 9.014 -18.480 1.00 74.14 C ATOM 3220 OE1 GLU D 326 3.308 10.131 -18.823 1.00 54.25 O ATOM 3221 OE2 GLU D 326 4.850 8.865 -17.964 1.00 1.22 O ATOM 0 H GLU D 326 3.830 8.497 -15.966 1.00 11.11 H new ATOM 0 HA GLU D 326 1.080 7.477 -15.671 1.00 32.34 H new ATOM 0 HB2 GLU D 326 1.051 6.866 -17.991 1.00 74.22 H new ATOM 0 HB3 GLU D 326 1.082 8.605 -17.779 1.00 74.22 H new ATOM 0 HG2 GLU D 326 3.458 6.903 -18.608 1.00 3.43 H new ATOM 0 HG3 GLU D 326 2.442 7.825 -19.698 1.00 3.43 H new ATOM 3228 N PRO D 327 2.157 5.040 -15.855 1.00 64.44 N ATOM 3229 CA PRO D 327 2.790 3.760 -15.481 1.00 65.54 C ATOM 3230 C PRO D 327 4.062 3.464 -16.230 1.00 51.13 C ATOM 3231 O PRO D 327 4.049 2.961 -17.362 1.00 64.22 O ATOM 3232 CB PRO D 327 1.728 2.716 -15.791 1.00 61.05 C ATOM 3233 CG PRO D 327 0.460 3.460 -15.670 1.00 65.41 C ATOM 3234 CD PRO D 327 0.746 4.850 -16.163 1.00 61.33 C ATOM 0 HA PRO D 327 3.099 3.777 -14.436 1.00 65.54 H new ATOM 0 HB2 PRO D 327 1.855 2.301 -16.791 1.00 61.05 H new ATOM 0 HB3 PRO D 327 1.771 1.881 -15.091 1.00 61.05 H new ATOM 0 HG2 PRO D 327 -0.326 2.990 -16.262 1.00 65.41 H new ATOM 0 HG3 PRO D 327 0.114 3.476 -14.636 1.00 65.41 H new ATOM 0 HD2 PRO D 327 0.553 4.944 -17.232 1.00 61.33 H new ATOM 0 HD3 PRO D 327 0.123 5.590 -15.660 1.00 61.33 H new