USER MOD reduce.3.24.130724 H: found=0, std=0, add=1173, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1175 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: B 132 ASN : amide:sc= 1.99 K(o=2.9,f=0.2) USER MOD Set 1.2: B 157 GLN : amide:sc= 0.903 K(o=2.9,f=1.2) USER MOD Set 2.1: B 146 THR OG1 : rot -48:sc= 1.22 USER MOD Set 2.2: B 148 SER OG : rot 160:sc= 1.21 USER MOD Set 3.1: A 28 ASN : amide:sc= 1.47 K(o=2.4,f=-0.012) USER MOD Set 3.2: A 53 GLN : amide:sc= 0.969 K(o=2.4,f=0.62) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 91:sc= 1.28 USER MOD Single : A 27 LYS NZ :NH3+ 159:sc= 1.21 (180deg=0.853) USER MOD Single : A 30 HIS : no HD1:sc= -0.384 X(o=-0.38,f=0) USER MOD Single : A 31 GLN : amide:sc=-0.000254 X(o=-0.00025,f=-0.00025) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 147:sc= 0.694 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot -19:sc= 0.107 USER MOD Single : A 42 THR OG1 : rot -178:sc= -0.151 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 GLN : amide:sc= -0.058 X(o=-0.058,f=-0.38) USER MOD Single : A 56 HIS : no HE2:sc= 0.906 K(o=0.91,f=-3.2!) USER MOD Single : A 58 MET CE :methyl -167:sc= -0.0051 (180deg=-0.203) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ -172:sc= 1.21 (180deg=1.09) USER MOD Single : A 70 ASN : amide:sc= 0.893 K(o=0.89,f=0) USER MOD Single : A 83 SER OG : rot -170:sc= 0.0934 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 120 SER OG : rot -152:sc= 1.42 USER MOD Single : B 128 THR OG1 : rot 68:sc= 1.23 USER MOD Single : B 131 LYS NZ :NH3+ -121:sc= 0.78 (180deg=-0.105) USER MOD Single : B 134 HIS : no HD1:sc= -0.283 X(o=-0.28,f=-0.012) USER MOD Single : B 135 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 136 TYR OH : rot 180:sc= 0 USER MOD Single : B 137 SER OG : rot 156:sc= 1.26 USER MOD Single : B 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 144 THR OG1 : rot 180:sc= 0 USER MOD Single : B 155 THR OG1 : rot 180:sc= 0 USER MOD Single : B 156 GLN : amide:sc= -0.0495 K(o=-0.049,f=-0.71) USER MOD Single : B 160 HIS : no HE2:sc= 0.539 K(o=0.54,f=-5.6!) USER MOD Single : B 162 MET CE :methyl -147:sc= -0.0539 (180deg=-0.398) USER MOD Single : B 171 LYS NZ :NH3+ -172:sc= 1.25 (180deg=1.18) USER MOD Single : B 174 ASN : amide:sc= 0.716 K(o=0.72,f=0) USER MOD Single : B 187 SER OG : rot 180:sc= 0 USER MOD Single : B 197 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 198 SER OG : rot 180:sc= 0 USER MOD Single : B 200 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 178 N GLU A 14 -12.533 13.390 -3.929 1.00 1.94 N ATOM 179 CA GLU A 14 -13.679 12.763 -4.628 1.00 1.56 C ATOM 180 C GLU A 14 -13.555 11.242 -4.859 1.00 1.25 C ATOM 181 O GLU A 14 -14.480 10.604 -5.365 1.00 1.15 O ATOM 182 CB GLU A 14 -13.937 13.478 -5.969 1.00 1.78 C ATOM 183 CG GLU A 14 -12.948 13.121 -7.097 1.00 3.04 C ATOM 184 CD GLU A 14 -13.254 13.843 -8.418 1.00 3.50 C ATOM 185 OE1 GLU A 14 -14.440 14.083 -8.755 1.00 4.03 O ATOM 186 OE2 GLU A 14 -12.313 14.191 -9.166 1.00 4.11 O ATOM 0 HA GLU A 14 -14.526 12.884 -3.952 1.00 1.56 H new ATOM 0 HB2 GLU A 14 -14.947 13.240 -6.302 1.00 1.78 H new ATOM 0 HB3 GLU A 14 -13.902 14.555 -5.802 1.00 1.78 H new ATOM 0 HG2 GLU A 14 -11.936 13.373 -6.778 1.00 3.04 H new ATOM 0 HG3 GLU A 14 -12.971 12.044 -7.265 1.00 3.04 H new ATOM 193 N PHE A 15 -12.394 10.678 -4.539 1.00 1.31 N ATOM 194 CA PHE A 15 -12.032 9.280 -4.769 1.00 1.16 C ATOM 195 C PHE A 15 -12.923 8.288 -3.996 1.00 1.14 C ATOM 196 O PHE A 15 -13.559 8.637 -2.996 1.00 1.19 O ATOM 197 CB PHE A 15 -10.541 9.093 -4.440 1.00 1.07 C ATOM 198 CG PHE A 15 -9.492 9.779 -5.313 1.00 1.30 C ATOM 199 CD1 PHE A 15 -9.824 10.618 -6.399 1.00 2.18 C ATOM 200 CD2 PHE A 15 -8.132 9.542 -5.028 1.00 2.39 C ATOM 201 CE1 PHE A 15 -8.814 11.202 -7.184 1.00 2.32 C ATOM 202 CE2 PHE A 15 -7.121 10.112 -5.823 1.00 2.69 C ATOM 203 CZ PHE A 15 -7.462 10.942 -6.904 1.00 1.96 C ATOM 0 H PHE A 15 -11.645 11.206 -4.092 1.00 1.31 H new ATOM 0 HA PHE A 15 -12.205 9.050 -5.820 1.00 1.16 H new ATOM 0 HB2 PHE A 15 -10.387 9.431 -3.415 1.00 1.07 H new ATOM 0 HB3 PHE A 15 -10.333 8.023 -4.457 1.00 1.07 H new ATOM 0 HD1 PHE A 15 -10.861 10.813 -6.628 1.00 2.18 H new ATOM 0 HD2 PHE A 15 -7.863 8.916 -4.190 1.00 2.39 H new ATOM 0 HE1 PHE A 15 -9.078 11.852 -8.005 1.00 2.32 H new ATOM 0 HE2 PHE A 15 -6.083 9.912 -5.602 1.00 2.69 H new ATOM 0 HZ PHE A 15 -6.688 11.379 -7.517 1.00 1.96 H new ATOM 213 N SER A 16 -12.975 7.033 -4.453 1.00 1.12 N ATOM 214 CA SER A 16 -13.615 5.936 -3.708 1.00 1.12 C ATOM 215 C SER A 16 -12.913 5.711 -2.360 1.00 0.92 C ATOM 216 O SER A 16 -11.728 6.010 -2.238 1.00 0.81 O ATOM 217 CB SER A 16 -13.578 4.652 -4.540 1.00 1.21 C ATOM 218 OG SER A 16 -14.549 3.752 -4.048 1.00 1.78 O ATOM 0 H SER A 16 -12.577 6.746 -5.347 1.00 1.12 H new ATOM 0 HA SER A 16 -14.652 6.208 -3.513 1.00 1.12 H new ATOM 0 HB2 SER A 16 -13.772 4.878 -5.588 1.00 1.21 H new ATOM 0 HB3 SER A 16 -12.587 4.200 -4.490 1.00 1.21 H new ATOM 0 HG SER A 16 -14.530 2.928 -4.579 1.00 1.78 H new ATOM 224 N ASP A 17 -13.583 5.161 -1.344 1.00 1.00 N ATOM 225 CA ASP A 17 -13.007 5.017 0.010 1.00 1.00 C ATOM 226 C ASP A 17 -11.688 4.212 0.057 1.00 0.76 C ATOM 227 O ASP A 17 -10.807 4.538 0.855 1.00 0.73 O ATOM 228 CB ASP A 17 -14.041 4.407 0.968 1.00 1.27 C ATOM 229 CG ASP A 17 -15.230 5.333 1.218 1.00 1.85 C ATOM 230 OD1 ASP A 17 -15.047 6.388 1.871 1.00 2.67 O ATOM 231 OD2 ASP A 17 -16.353 5.023 0.750 1.00 2.78 O ATOM 0 H ASP A 17 -14.534 4.803 -1.428 1.00 1.00 H new ATOM 0 HA ASP A 17 -12.749 6.026 0.332 1.00 1.00 H new ATOM 0 HB2 ASP A 17 -14.400 3.464 0.556 1.00 1.27 H new ATOM 0 HB3 ASP A 17 -13.559 4.177 1.918 1.00 1.27 H new ATOM 236 N VAL A 18 -11.507 3.224 -0.831 1.00 0.66 N ATOM 237 CA VAL A 18 -10.240 2.476 -1.016 1.00 0.56 C ATOM 238 C VAL A 18 -9.186 3.285 -1.794 1.00 0.43 C ATOM 239 O VAL A 18 -7.986 3.149 -1.580 1.00 0.46 O ATOM 240 CB VAL A 18 -10.532 1.131 -1.709 1.00 0.66 C ATOM 241 CG1 VAL A 18 -10.922 1.274 -3.182 1.00 0.63 C ATOM 242 CG2 VAL A 18 -9.354 0.155 -1.656 1.00 0.81 C ATOM 0 H VAL A 18 -12.249 2.911 -1.457 1.00 0.66 H new ATOM 0 HA VAL A 18 -9.813 2.290 -0.030 1.00 0.56 H new ATOM 0 HB VAL A 18 -11.373 0.738 -1.138 1.00 0.66 H new ATOM 0 HG11 VAL A 18 -11.113 0.288 -3.605 1.00 0.63 H new ATOM 0 HG12 VAL A 18 -11.822 1.884 -3.263 1.00 0.63 H new ATOM 0 HG13 VAL A 18 -10.109 1.752 -3.729 1.00 0.63 H new ATOM 0 HG21 VAL A 18 -9.626 -0.771 -2.162 1.00 0.81 H new ATOM 0 HG22 VAL A 18 -8.491 0.599 -2.152 1.00 0.81 H new ATOM 0 HG23 VAL A 18 -9.105 -0.059 -0.617 1.00 0.81 H new ATOM 252 N GLU A 19 -9.633 4.163 -2.686 1.00 0.45 N ATOM 253 CA GLU A 19 -8.812 4.965 -3.597 1.00 0.49 C ATOM 254 C GLU A 19 -8.231 6.192 -2.864 1.00 0.52 C ATOM 255 O GLU A 19 -7.035 6.468 -2.978 1.00 0.67 O ATOM 256 CB GLU A 19 -9.700 5.267 -4.819 1.00 0.58 C ATOM 257 CG GLU A 19 -9.053 5.974 -6.016 1.00 0.73 C ATOM 258 CD GLU A 19 -10.094 6.318 -7.105 1.00 0.79 C ATOM 259 OE1 GLU A 19 -11.176 6.858 -6.758 1.00 1.39 O ATOM 260 OE2 GLU A 19 -9.820 6.083 -8.307 1.00 2.03 O ATOM 0 H GLU A 19 -10.630 4.347 -2.802 1.00 0.45 H new ATOM 0 HA GLU A 19 -7.922 4.445 -3.952 1.00 0.49 H new ATOM 0 HB2 GLU A 19 -10.116 4.323 -5.172 1.00 0.58 H new ATOM 0 HB3 GLU A 19 -10.537 5.878 -4.482 1.00 0.58 H new ATOM 0 HG2 GLU A 19 -8.563 6.888 -5.678 1.00 0.73 H new ATOM 0 HG3 GLU A 19 -8.278 5.336 -6.441 1.00 0.73 H new ATOM 267 N ARG A 20 -9.014 6.839 -1.981 1.00 0.56 N ATOM 268 CA ARG A 20 -8.488 7.808 -0.997 1.00 0.61 C ATOM 269 C ARG A 20 -7.755 7.174 0.186 1.00 0.55 C ATOM 270 O ARG A 20 -6.941 7.854 0.804 1.00 0.61 O ATOM 271 CB ARG A 20 -9.512 8.869 -0.562 1.00 0.99 C ATOM 272 CG ARG A 20 -10.823 8.396 0.080 1.00 1.29 C ATOM 273 CD ARG A 20 -11.904 9.485 -0.048 1.00 2.18 C ATOM 274 NE ARG A 20 -13.192 9.034 0.502 1.00 2.92 N ATOM 275 CZ ARG A 20 -14.391 9.534 0.258 1.00 4.46 C ATOM 276 NH1 ARG A 20 -14.588 10.590 -0.485 1.00 5.68 N ATOM 277 NH2 ARG A 20 -15.432 8.953 0.780 1.00 5.12 N ATOM 0 H ARG A 20 -10.024 6.707 -1.928 1.00 0.56 H new ATOM 0 HA ARG A 20 -7.719 8.347 -1.551 1.00 0.61 H new ATOM 0 HB2 ARG A 20 -9.019 9.537 0.144 1.00 0.99 H new ATOM 0 HB3 ARG A 20 -9.767 9.464 -1.439 1.00 0.99 H new ATOM 0 HG2 ARG A 20 -11.162 7.479 -0.402 1.00 1.29 H new ATOM 0 HG3 ARG A 20 -10.657 8.161 1.131 1.00 1.29 H new ATOM 0 HD2 ARG A 20 -11.579 10.385 0.475 1.00 2.18 H new ATOM 0 HD3 ARG A 20 -12.029 9.753 -1.097 1.00 2.18 H new ATOM 0 HE ARG A 20 -13.155 8.244 1.146 1.00 2.92 H new ATOM 0 HH11 ARG A 20 -13.794 11.070 -0.909 1.00 5.68 H new ATOM 0 HH12 ARG A 20 -15.535 10.934 -0.641 1.00 5.68 H new ATOM 0 HH21 ARG A 20 -15.314 8.126 1.366 1.00 5.12 H new ATOM 0 HH22 ARG A 20 -16.365 9.324 0.603 1.00 5.12 H new ATOM 291 N ALA A 21 -7.941 5.884 0.460 1.00 0.54 N ATOM 292 CA ALA A 21 -7.065 5.164 1.394 1.00 0.55 C ATOM 293 C ALA A 21 -5.611 5.075 0.878 1.00 0.50 C ATOM 294 O ALA A 21 -4.685 5.352 1.643 1.00 0.46 O ATOM 295 CB ALA A 21 -7.643 3.789 1.743 1.00 0.61 C ATOM 0 H ALA A 21 -8.684 5.316 0.054 1.00 0.54 H new ATOM 0 HA ALA A 21 -7.024 5.743 2.317 1.00 0.55 H new ATOM 0 HB1 ALA A 21 -6.974 3.278 2.436 1.00 0.61 H new ATOM 0 HB2 ALA A 21 -8.621 3.913 2.208 1.00 0.61 H new ATOM 0 HB3 ALA A 21 -7.746 3.196 0.834 1.00 0.61 H new ATOM 301 N ILE A 22 -5.392 4.787 -0.418 1.00 0.52 N ATOM 302 CA ILE A 22 -4.040 4.739 -1.018 1.00 0.51 C ATOM 303 C ILE A 22 -3.399 6.134 -0.944 1.00 0.51 C ATOM 304 O ILE A 22 -2.262 6.278 -0.496 1.00 0.55 O ATOM 305 CB ILE A 22 -4.046 4.179 -2.472 1.00 0.49 C ATOM 306 CG1 ILE A 22 -4.689 2.779 -2.569 1.00 0.54 C ATOM 307 CG2 ILE A 22 -2.608 4.113 -3.024 1.00 0.52 C ATOM 308 CD1 ILE A 22 -5.254 2.471 -3.963 1.00 0.60 C ATOM 0 H ILE A 22 -6.141 4.581 -1.079 1.00 0.52 H new ATOM 0 HA ILE A 22 -3.437 4.039 -0.440 1.00 0.51 H new ATOM 0 HB ILE A 22 -4.650 4.864 -3.067 1.00 0.49 H new ATOM 0 HG12 ILE A 22 -3.945 2.025 -2.310 1.00 0.54 H new ATOM 0 HG13 ILE A 22 -5.490 2.702 -1.834 1.00 0.54 H new ATOM 0 HG21 ILE A 22 -2.626 3.720 -4.041 1.00 0.52 H new ATOM 0 HG22 ILE A 22 -2.174 5.113 -3.029 1.00 0.52 H new ATOM 0 HG23 ILE A 22 -2.006 3.459 -2.393 1.00 0.52 H new ATOM 0 HD11 ILE A 22 -5.692 1.473 -3.966 1.00 0.60 H new ATOM 0 HD12 ILE A 22 -6.020 3.204 -4.215 1.00 0.60 H new ATOM 0 HD13 ILE A 22 -4.452 2.517 -4.699 1.00 0.60 H new ATOM 320 N GLU A 23 -4.156 7.181 -1.282 1.00 0.52 N ATOM 321 CA GLU A 23 -3.772 8.575 -1.188 1.00 0.59 C ATOM 322 C GLU A 23 -3.417 9.014 0.237 1.00 0.58 C ATOM 323 O GLU A 23 -2.415 9.686 0.460 1.00 0.60 O ATOM 324 CB GLU A 23 -5.017 9.287 -1.694 1.00 0.77 C ATOM 325 CG GLU A 23 -4.861 10.721 -2.130 1.00 1.50 C ATOM 326 CD GLU A 23 -4.979 11.777 -1.017 1.00 2.53 C ATOM 327 OE1 GLU A 23 -5.781 11.607 -0.069 1.00 3.73 O ATOM 328 OE2 GLU A 23 -4.340 12.853 -1.127 1.00 3.12 O ATOM 0 H GLU A 23 -5.101 7.063 -1.647 1.00 0.52 H new ATOM 0 HA GLU A 23 -2.867 8.795 -1.753 1.00 0.59 H new ATOM 0 HB2 GLU A 23 -5.412 8.719 -2.536 1.00 0.77 H new ATOM 0 HB3 GLU A 23 -5.769 9.253 -0.906 1.00 0.77 H new ATOM 0 HG2 GLU A 23 -3.888 10.832 -2.608 1.00 1.50 H new ATOM 0 HG3 GLU A 23 -5.614 10.934 -2.888 1.00 1.50 H new ATOM 335 N THR A 24 -4.198 8.566 1.219 1.00 0.57 N ATOM 336 CA THR A 24 -4.040 8.930 2.635 1.00 0.67 C ATOM 337 C THR A 24 -2.755 8.339 3.199 1.00 0.69 C ATOM 338 O THR A 24 -2.071 8.991 3.996 1.00 0.73 O ATOM 339 CB THR A 24 -5.259 8.436 3.439 1.00 0.75 C ATOM 340 OG1 THR A 24 -6.397 9.180 3.056 1.00 0.84 O ATOM 341 CG2 THR A 24 -5.148 8.552 4.959 1.00 0.79 C ATOM 0 H THR A 24 -4.975 7.927 1.054 1.00 0.57 H new ATOM 0 HA THR A 24 -3.978 10.015 2.716 1.00 0.67 H new ATOM 0 HB THR A 24 -5.325 7.373 3.207 1.00 0.75 H new ATOM 0 HG1 THR A 24 -6.852 8.725 2.317 1.00 0.84 H new ATOM 0 HG21 THR A 24 -6.061 8.176 5.420 1.00 0.79 H new ATOM 0 HG22 THR A 24 -4.297 7.966 5.307 1.00 0.79 H new ATOM 0 HG23 THR A 24 -5.006 9.597 5.235 1.00 0.79 H new ATOM 349 N LEU A 25 -2.404 7.115 2.792 1.00 0.70 N ATOM 350 CA LEU A 25 -1.189 6.463 3.279 1.00 0.81 C ATOM 351 C LEU A 25 0.077 6.846 2.501 1.00 0.68 C ATOM 352 O LEU A 25 1.132 6.980 3.115 1.00 0.75 O ATOM 353 CB LEU A 25 -1.435 4.985 3.532 1.00 1.29 C ATOM 354 CG LEU A 25 -1.321 4.044 2.334 1.00 0.49 C ATOM 355 CD1 LEU A 25 0.064 3.406 2.310 1.00 0.97 C ATOM 356 CD2 LEU A 25 -2.318 2.926 2.569 1.00 0.94 C ATOM 0 H LEU A 25 -2.944 6.559 2.129 1.00 0.70 H new ATOM 0 HA LEU A 25 -0.944 6.867 4.261 1.00 0.81 H new ATOM 0 HB2 LEU A 25 -0.730 4.650 4.293 1.00 1.29 H new ATOM 0 HB3 LEU A 25 -2.434 4.876 3.954 1.00 1.29 H new ATOM 0 HG LEU A 25 -1.498 4.587 1.405 1.00 0.49 H new ATOM 0 HD11 LEU A 25 0.141 2.736 1.454 1.00 0.97 H new ATOM 0 HD12 LEU A 25 0.822 4.185 2.230 1.00 0.97 H new ATOM 0 HD13 LEU A 25 0.220 2.841 3.229 1.00 0.97 H new ATOM 0 HD21 LEU A 25 -2.278 2.222 1.738 1.00 0.94 H new ATOM 0 HD22 LEU A 25 -2.072 2.408 3.496 1.00 0.94 H new ATOM 0 HD23 LEU A 25 -3.322 3.343 2.642 1.00 0.94 H new ATOM 368 N ILE A 26 -0.013 7.138 1.195 1.00 0.62 N ATOM 369 CA ILE A 26 1.136 7.676 0.447 1.00 0.74 C ATOM 370 C ILE A 26 1.451 9.125 0.861 1.00 0.60 C ATOM 371 O ILE A 26 2.622 9.470 1.035 1.00 0.59 O ATOM 372 CB ILE A 26 0.959 7.458 -1.075 1.00 1.04 C ATOM 373 CG1 ILE A 26 2.306 7.361 -1.819 1.00 1.50 C ATOM 374 CG2 ILE A 26 0.108 8.548 -1.741 1.00 1.36 C ATOM 375 CD1 ILE A 26 3.108 6.095 -1.488 1.00 1.91 C ATOM 0 H ILE A 26 -0.859 7.013 0.639 1.00 0.62 H new ATOM 0 HA ILE A 26 2.030 7.112 0.715 1.00 0.74 H new ATOM 0 HB ILE A 26 0.435 6.506 -1.156 1.00 1.04 H new ATOM 0 HG12 ILE A 26 2.120 7.392 -2.893 1.00 1.50 H new ATOM 0 HG13 ILE A 26 2.909 8.236 -1.575 1.00 1.50 H new ATOM 0 HG21 ILE A 26 0.020 8.340 -2.807 1.00 1.36 H new ATOM 0 HG22 ILE A 26 -0.885 8.561 -1.291 1.00 1.36 H new ATOM 0 HG23 ILE A 26 0.583 9.518 -1.599 1.00 1.36 H new ATOM 0 HD11 ILE A 26 4.042 6.099 -2.050 1.00 1.91 H new ATOM 0 HD12 ILE A 26 3.327 6.071 -0.420 1.00 1.91 H new ATOM 0 HD13 ILE A 26 2.526 5.214 -1.759 1.00 1.91 H new ATOM 387 N LYS A 27 0.431 9.936 1.199 1.00 0.55 N ATOM 388 CA LYS A 27 0.604 11.243 1.867 1.00 0.55 C ATOM 389 C LYS A 27 1.375 11.153 3.187 1.00 0.51 C ATOM 390 O LYS A 27 1.980 12.141 3.590 1.00 0.57 O ATOM 391 CB LYS A 27 -0.766 11.910 2.111 1.00 0.63 C ATOM 392 CG LYS A 27 -1.354 12.628 0.884 1.00 0.76 C ATOM 393 CD LYS A 27 -0.627 13.951 0.583 1.00 1.00 C ATOM 394 CE LYS A 27 -1.194 14.715 -0.622 1.00 1.59 C ATOM 395 NZ LYS A 27 -2.639 15.019 -0.486 1.00 2.34 N ATOM 0 H LYS A 27 -0.545 9.702 1.015 1.00 0.55 H new ATOM 0 HA LYS A 27 1.202 11.852 1.189 1.00 0.55 H new ATOM 0 HB2 LYS A 27 -1.472 11.149 2.444 1.00 0.63 H new ATOM 0 HB3 LYS A 27 -0.666 12.629 2.924 1.00 0.63 H new ATOM 0 HG2 LYS A 27 -1.288 11.973 0.015 1.00 0.76 H new ATOM 0 HG3 LYS A 27 -2.412 12.827 1.054 1.00 0.76 H new ATOM 0 HD2 LYS A 27 -0.680 14.591 1.464 1.00 1.00 H new ATOM 0 HD3 LYS A 27 0.428 13.742 0.404 1.00 1.00 H new ATOM 0 HE2 LYS A 27 -0.642 15.647 -0.747 1.00 1.59 H new ATOM 0 HE3 LYS A 27 -1.035 14.127 -1.526 1.00 1.59 H new ATOM 0 HZ1 LYS A 27 -2.888 15.810 -1.114 1.00 2.34 H new ATOM 0 HZ2 LYS A 27 -3.196 14.181 -0.748 1.00 2.34 H new ATOM 0 HZ3 LYS A 27 -2.848 15.280 0.499 1.00 2.34 H new ATOM 409 N ASN A 28 1.448 9.991 3.842 1.00 0.52 N ATOM 410 CA ASN A 28 2.277 9.831 5.039 1.00 0.51 C ATOM 411 C ASN A 28 3.793 9.799 4.758 1.00 0.45 C ATOM 412 O ASN A 28 4.553 10.093 5.674 1.00 0.52 O ATOM 413 CB ASN A 28 1.737 8.718 5.957 1.00 0.57 C ATOM 414 CG ASN A 28 0.644 9.250 6.864 1.00 0.64 C ATOM 415 OD1 ASN A 28 0.899 9.685 7.978 1.00 0.75 O ATOM 416 ND2 ASN A 28 -0.587 9.266 6.422 1.00 0.68 N ATOM 0 H ASN A 28 0.944 9.149 3.564 1.00 0.52 H new ATOM 0 HA ASN A 28 2.181 10.747 5.622 1.00 0.51 H new ATOM 0 HB2 ASN A 28 1.347 7.899 5.352 1.00 0.57 H new ATOM 0 HB3 ASN A 28 2.549 8.311 6.559 1.00 0.57 H new ATOM 0 HD21 ASN A 28 -1.334 9.641 7.007 1.00 0.68 H new ATOM 0 HD22 ASN A 28 -0.800 8.903 5.493 1.00 0.68 H new ATOM 423 N PHE A 29 4.250 9.556 3.520 1.00 0.43 N ATOM 424 CA PHE A 29 5.610 9.953 3.105 1.00 0.53 C ATOM 425 C PHE A 29 5.738 11.486 3.086 1.00 0.61 C ATOM 426 O PHE A 29 6.656 12.053 3.683 1.00 0.77 O ATOM 427 CB PHE A 29 5.936 9.359 1.719 1.00 0.69 C ATOM 428 CG PHE A 29 7.355 9.597 1.207 1.00 0.77 C ATOM 429 CD1 PHE A 29 7.775 10.864 0.750 1.00 2.30 C ATOM 430 CD2 PHE A 29 8.257 8.520 1.148 1.00 1.47 C ATOM 431 CE1 PHE A 29 9.093 11.052 0.287 1.00 2.41 C ATOM 432 CE2 PHE A 29 9.566 8.699 0.670 1.00 1.47 C ATOM 433 CZ PHE A 29 9.989 9.970 0.249 1.00 1.06 C ATOM 0 H PHE A 29 3.706 9.091 2.793 1.00 0.43 H new ATOM 0 HA PHE A 29 6.327 9.561 3.826 1.00 0.53 H new ATOM 0 HB2 PHE A 29 5.759 8.284 1.755 1.00 0.69 H new ATOM 0 HB3 PHE A 29 5.235 9.773 0.994 1.00 0.69 H new ATOM 0 HD1 PHE A 29 7.084 11.694 0.755 1.00 2.30 H new ATOM 0 HD2 PHE A 29 7.939 7.541 1.475 1.00 1.47 H new ATOM 0 HE1 PHE A 29 9.415 12.030 -0.039 1.00 2.41 H new ATOM 0 HE2 PHE A 29 10.246 7.861 0.626 1.00 1.47 H new ATOM 0 HZ PHE A 29 11.000 10.116 -0.103 1.00 1.06 H new ATOM 443 N HIS A 30 4.785 12.165 2.431 1.00 0.68 N ATOM 444 CA HIS A 30 4.808 13.616 2.196 1.00 0.98 C ATOM 445 C HIS A 30 4.853 14.394 3.522 1.00 0.85 C ATOM 446 O HIS A 30 5.657 15.311 3.677 1.00 0.94 O ATOM 447 CB HIS A 30 3.582 14.062 1.369 1.00 1.32 C ATOM 448 CG HIS A 30 3.411 13.489 -0.025 1.00 1.58 C ATOM 449 ND1 HIS A 30 2.922 14.189 -1.106 1.00 2.90 N ATOM 450 CD2 HIS A 30 3.639 12.207 -0.462 1.00 0.75 C ATOM 451 CE1 HIS A 30 2.877 13.364 -2.163 1.00 2.75 C ATOM 452 NE2 HIS A 30 3.319 12.144 -1.822 1.00 1.41 N ATOM 0 H HIS A 30 3.959 11.711 2.041 1.00 0.68 H new ATOM 0 HA HIS A 30 5.713 13.839 1.631 1.00 0.98 H new ATOM 0 HB2 HIS A 30 2.687 13.817 1.942 1.00 1.32 H new ATOM 0 HB3 HIS A 30 3.617 15.148 1.281 1.00 1.32 H new ATOM 0 HD2 HIS A 30 4.003 11.388 0.141 1.00 0.75 H new ATOM 0 HE1 HIS A 30 2.534 13.642 -3.148 1.00 2.75 H new ATOM 0 HE2 HIS A 30 3.405 11.332 -2.433 1.00 1.41 H new ATOM 460 N GLN A 31 4.049 13.973 4.505 1.00 0.73 N ATOM 461 CA GLN A 31 3.979 14.571 5.840 1.00 0.77 C ATOM 462 C GLN A 31 5.254 14.390 6.687 1.00 0.69 C ATOM 463 O GLN A 31 5.423 15.131 7.663 1.00 0.96 O ATOM 464 CB GLN A 31 2.780 13.966 6.597 1.00 0.87 C ATOM 465 CG GLN A 31 1.408 14.378 6.039 1.00 1.44 C ATOM 466 CD GLN A 31 1.082 15.846 6.286 1.00 2.05 C ATOM 467 OE1 GLN A 31 1.139 16.683 5.394 1.00 3.29 O ATOM 468 NE2 GLN A 31 0.727 16.217 7.492 1.00 2.77 N ATOM 0 H GLN A 31 3.412 13.185 4.389 1.00 0.73 H new ATOM 0 HA GLN A 31 3.865 15.645 5.689 1.00 0.77 H new ATOM 0 HB2 GLN A 31 2.859 12.879 6.570 1.00 0.87 H new ATOM 0 HB3 GLN A 31 2.838 14.264 7.644 1.00 0.87 H new ATOM 0 HG2 GLN A 31 1.384 14.181 4.967 1.00 1.44 H new ATOM 0 HG3 GLN A 31 0.636 13.758 6.494 1.00 1.44 H new ATOM 0 HE21 GLN A 31 0.676 15.529 8.243 1.00 2.77 H new ATOM 0 HE22 GLN A 31 0.502 17.194 7.679 1.00 2.77 H new ATOM 477 N TYR A 32 6.131 13.430 6.358 1.00 0.57 N ATOM 478 CA TYR A 32 7.216 13.006 7.252 1.00 0.60 C ATOM 479 C TYR A 32 8.650 13.260 6.790 1.00 0.67 C ATOM 480 O TYR A 32 9.481 13.344 7.686 1.00 0.96 O ATOM 481 CB TYR A 32 7.031 11.544 7.693 1.00 0.59 C ATOM 482 CG TYR A 32 6.310 11.436 9.023 1.00 0.58 C ATOM 483 CD1 TYR A 32 7.051 11.547 10.218 1.00 1.71 C ATOM 484 CD2 TYR A 32 4.911 11.292 9.075 1.00 1.99 C ATOM 485 CE1 TYR A 32 6.398 11.506 11.463 1.00 1.78 C ATOM 486 CE2 TYR A 32 4.252 11.274 10.320 1.00 1.99 C ATOM 487 CZ TYR A 32 4.992 11.387 11.518 1.00 0.74 C ATOM 488 OH TYR A 32 4.347 11.393 12.716 1.00 0.87 O ATOM 0 H TYR A 32 6.108 12.929 5.470 1.00 0.57 H new ATOM 0 HA TYR A 32 7.108 13.680 8.102 1.00 0.60 H new ATOM 0 HB2 TYR A 32 6.468 11.005 6.931 1.00 0.59 H new ATOM 0 HB3 TYR A 32 8.006 11.063 7.770 1.00 0.59 H new ATOM 0 HD1 TYR A 32 8.124 11.664 10.177 1.00 1.71 H new ATOM 0 HD2 TYR A 32 4.343 11.195 8.161 1.00 1.99 H new ATOM 0 HE1 TYR A 32 6.971 11.565 12.376 1.00 1.78 H new ATOM 0 HE2 TYR A 32 3.177 11.173 10.359 1.00 1.99 H new ATOM 0 HH TYR A 32 3.382 11.303 12.569 1.00 0.87 H new ATOM 498 N SER A 33 8.984 13.422 5.502 1.00 0.60 N ATOM 499 CA SER A 33 10.395 13.455 5.032 1.00 0.67 C ATOM 500 C SER A 33 11.202 14.745 5.343 1.00 0.95 C ATOM 501 O SER A 33 12.139 15.101 4.623 1.00 1.69 O ATOM 502 CB SER A 33 10.450 13.103 3.533 1.00 0.77 C ATOM 503 OG SER A 33 9.751 14.036 2.721 1.00 1.70 O ATOM 0 H SER A 33 8.298 13.534 4.755 1.00 0.60 H new ATOM 0 HA SER A 33 10.907 12.699 5.627 1.00 0.67 H new ATOM 0 HB2 SER A 33 11.491 13.059 3.213 1.00 0.77 H new ATOM 0 HB3 SER A 33 10.028 12.110 3.382 1.00 0.77 H new ATOM 0 HG SER A 33 10.203 14.119 1.855 1.00 1.70 H new ATOM 509 N VAL A 34 10.885 15.446 6.437 1.00 0.98 N ATOM 510 CA VAL A 34 11.327 16.823 6.732 1.00 1.17 C ATOM 511 C VAL A 34 12.613 16.947 7.576 1.00 1.83 C ATOM 512 O VAL A 34 13.154 18.052 7.679 1.00 2.35 O ATOM 513 CB VAL A 34 10.126 17.643 7.260 1.00 1.62 C ATOM 514 CG1 VAL A 34 9.737 17.288 8.697 1.00 2.34 C ATOM 515 CG2 VAL A 34 10.317 19.159 7.151 1.00 2.95 C ATOM 0 H VAL A 34 10.292 15.060 7.172 1.00 0.98 H new ATOM 0 HA VAL A 34 11.658 17.264 5.792 1.00 1.17 H new ATOM 0 HB VAL A 34 9.311 17.356 6.596 1.00 1.62 H new ATOM 0 HG11 VAL A 34 8.889 17.899 9.006 1.00 2.34 H new ATOM 0 HG12 VAL A 34 9.464 16.234 8.750 1.00 2.34 H new ATOM 0 HG13 VAL A 34 10.581 17.478 9.360 1.00 2.34 H new ATOM 0 HG21 VAL A 34 9.434 19.666 7.541 1.00 2.95 H new ATOM 0 HG22 VAL A 34 11.192 19.458 7.729 1.00 2.95 H new ATOM 0 HG23 VAL A 34 10.461 19.433 6.106 1.00 2.95 H new ATOM 525 N GLU A 35 13.174 15.863 8.133 1.00 2.02 N ATOM 526 CA GLU A 35 14.500 15.874 8.800 1.00 2.79 C ATOM 527 C GLU A 35 15.626 16.203 7.811 1.00 3.17 C ATOM 528 O GLU A 35 16.641 16.780 8.206 1.00 4.10 O ATOM 529 CB GLU A 35 14.859 14.499 9.408 1.00 2.56 C ATOM 530 CG GLU A 35 14.122 14.103 10.693 1.00 4.50 C ATOM 531 CD GLU A 35 14.817 14.626 11.951 1.00 4.99 C ATOM 532 OE1 GLU A 35 15.718 13.939 12.494 1.00 5.23 O ATOM 533 OE2 GLU A 35 14.436 15.713 12.452 1.00 5.76 O ATOM 0 H GLU A 35 12.725 14.947 8.137 1.00 2.02 H new ATOM 0 HA GLU A 35 14.419 16.633 9.579 1.00 2.79 H new ATOM 0 HB2 GLU A 35 14.668 13.734 8.656 1.00 2.56 H new ATOM 0 HB3 GLU A 35 15.930 14.486 9.611 1.00 2.56 H new ATOM 0 HG2 GLU A 35 13.103 14.489 10.657 1.00 4.50 H new ATOM 0 HG3 GLU A 35 14.050 13.017 10.747 1.00 4.50 H new ATOM 540 N GLY A 36 15.464 15.823 6.540 1.00 2.86 N ATOM 541 CA GLY A 36 16.480 15.995 5.497 1.00 3.71 C ATOM 542 C GLY A 36 16.332 15.085 4.274 1.00 3.15 C ATOM 543 O GLY A 36 17.094 15.248 3.319 1.00 3.78 O ATOM 0 H GLY A 36 14.610 15.380 6.201 1.00 2.86 H new ATOM 0 HA2 GLY A 36 16.459 17.032 5.161 1.00 3.71 H new ATOM 0 HA3 GLY A 36 17.462 15.823 5.939 1.00 3.71 H new ATOM 547 N GLY A 37 15.382 14.141 4.260 1.00 3.41 N ATOM 548 CA GLY A 37 15.139 13.266 3.107 1.00 4.30 C ATOM 549 C GLY A 37 14.540 14.020 1.915 1.00 3.55 C ATOM 550 O GLY A 37 15.086 13.977 0.810 1.00 4.13 O ATOM 0 H GLY A 37 14.760 13.963 5.049 1.00 3.41 H new ATOM 0 HA2 GLY A 37 16.077 12.800 2.804 1.00 4.30 H new ATOM 0 HA3 GLY A 37 14.464 12.462 3.401 1.00 4.30 H new ATOM 554 N LYS A 38 13.465 14.778 2.158 1.00 2.87 N ATOM 555 CA LYS A 38 12.705 15.601 1.199 1.00 2.79 C ATOM 556 C LYS A 38 12.148 14.784 0.026 1.00 2.43 C ATOM 557 O LYS A 38 11.026 14.285 0.104 1.00 2.59 O ATOM 558 CB LYS A 38 13.484 16.867 0.806 1.00 4.20 C ATOM 559 CG LYS A 38 13.873 17.654 2.066 1.00 5.17 C ATOM 560 CD LYS A 38 14.492 18.998 1.703 1.00 6.30 C ATOM 561 CE LYS A 38 15.053 19.614 2.982 1.00 7.02 C ATOM 562 NZ LYS A 38 15.489 21.011 2.780 1.00 7.91 N ATOM 0 H LYS A 38 13.071 14.840 3.097 1.00 2.87 H new ATOM 0 HA LYS A 38 11.809 15.964 1.702 1.00 2.79 H new ATOM 0 HB2 LYS A 38 14.379 16.595 0.246 1.00 4.20 H new ATOM 0 HB3 LYS A 38 12.875 17.490 0.151 1.00 4.20 H new ATOM 0 HG2 LYS A 38 12.991 17.812 2.687 1.00 5.17 H new ATOM 0 HG3 LYS A 38 14.580 17.073 2.658 1.00 5.17 H new ATOM 0 HD2 LYS A 38 15.282 18.867 0.963 1.00 6.30 H new ATOM 0 HD3 LYS A 38 13.745 19.655 1.258 1.00 6.30 H new ATOM 0 HE2 LYS A 38 14.294 19.581 3.763 1.00 7.02 H new ATOM 0 HE3 LYS A 38 15.896 19.018 3.331 1.00 7.02 H new ATOM 0 HZ1 LYS A 38 15.863 21.391 3.673 1.00 7.91 H new ATOM 0 HZ2 LYS A 38 16.232 21.041 2.053 1.00 7.91 H new ATOM 0 HZ3 LYS A 38 14.679 21.586 2.472 1.00 7.91 H new ATOM 576 N GLU A 39 12.957 14.611 -1.021 1.00 2.22 N ATOM 577 CA GLU A 39 12.708 13.756 -2.196 1.00 2.11 C ATOM 578 C GLU A 39 12.998 12.260 -1.937 1.00 1.70 C ATOM 579 O GLU A 39 12.610 11.409 -2.744 1.00 1.73 O ATOM 580 CB GLU A 39 13.584 14.257 -3.362 1.00 2.45 C ATOM 581 CG GLU A 39 13.176 15.645 -3.875 1.00 3.25 C ATOM 582 CD GLU A 39 14.226 16.224 -4.827 1.00 3.89 C ATOM 583 OE1 GLU A 39 15.341 16.556 -4.364 1.00 4.82 O ATOM 584 OE2 GLU A 39 13.951 16.401 -6.040 1.00 4.15 O ATOM 0 H GLU A 39 13.856 15.089 -1.080 1.00 2.22 H new ATOM 0 HA GLU A 39 11.647 13.828 -2.435 1.00 2.11 H new ATOM 0 HB2 GLU A 39 14.624 14.288 -3.038 1.00 2.45 H new ATOM 0 HB3 GLU A 39 13.527 13.543 -4.183 1.00 2.45 H new ATOM 0 HG2 GLU A 39 12.217 15.577 -4.388 1.00 3.25 H new ATOM 0 HG3 GLU A 39 13.038 16.320 -3.030 1.00 3.25 H new ATOM 591 N THR A 40 13.674 11.962 -0.821 1.00 1.50 N ATOM 592 CA THR A 40 13.948 10.640 -0.223 1.00 1.14 C ATOM 593 C THR A 40 13.566 10.681 1.275 1.00 1.05 C ATOM 594 O THR A 40 12.754 11.518 1.671 1.00 1.10 O ATOM 595 CB THR A 40 15.414 10.209 -0.457 1.00 1.15 C ATOM 596 OG1 THR A 40 16.290 11.109 0.181 1.00 1.38 O ATOM 597 CG2 THR A 40 15.774 10.246 -1.945 1.00 1.31 C ATOM 0 H THR A 40 14.083 12.707 -0.257 1.00 1.50 H new ATOM 0 HA THR A 40 13.338 9.880 -0.711 1.00 1.14 H new ATOM 0 HB THR A 40 15.512 9.198 -0.062 1.00 1.15 H new ATOM 0 HG1 THR A 40 15.821 11.951 0.360 1.00 1.38 H new ATOM 0 HG21 THR A 40 16.811 9.938 -2.076 1.00 1.31 H new ATOM 0 HG22 THR A 40 15.121 9.567 -2.494 1.00 1.31 H new ATOM 0 HG23 THR A 40 15.646 11.259 -2.325 1.00 1.31 H new ATOM 605 N LEU A 41 14.065 9.772 2.122 1.00 1.06 N ATOM 606 CA LEU A 41 13.567 9.546 3.491 1.00 0.88 C ATOM 607 C LEU A 41 14.739 9.164 4.425 1.00 0.80 C ATOM 608 O LEU A 41 15.570 8.340 4.043 1.00 1.09 O ATOM 609 CB LEU A 41 12.502 8.435 3.345 1.00 1.03 C ATOM 610 CG LEU A 41 11.458 8.199 4.446 1.00 0.80 C ATOM 611 CD1 LEU A 41 12.040 7.773 5.788 1.00 0.94 C ATOM 612 CD2 LEU A 41 10.559 9.419 4.666 1.00 0.82 C ATOM 0 H LEU A 41 14.842 9.159 1.873 1.00 1.06 H new ATOM 0 HA LEU A 41 13.124 10.431 3.948 1.00 0.88 H new ATOM 0 HB2 LEU A 41 11.956 8.634 2.423 1.00 1.03 H new ATOM 0 HB3 LEU A 41 13.036 7.496 3.203 1.00 1.03 H new ATOM 0 HG LEU A 41 10.868 7.366 4.064 1.00 0.80 H new ATOM 0 HD11 LEU A 41 11.232 7.629 6.506 1.00 0.94 H new ATOM 0 HD12 LEU A 41 12.589 6.839 5.667 1.00 0.94 H new ATOM 0 HD13 LEU A 41 12.716 8.546 6.153 1.00 0.94 H new ATOM 0 HD21 LEU A 41 9.838 9.202 5.454 1.00 0.82 H new ATOM 0 HD22 LEU A 41 11.170 10.273 4.958 1.00 0.82 H new ATOM 0 HD23 LEU A 41 10.028 9.651 3.743 1.00 0.82 H new ATOM 624 N THR A 42 14.861 9.748 5.622 1.00 0.76 N ATOM 625 CA THR A 42 15.965 9.431 6.559 1.00 0.79 C ATOM 626 C THR A 42 15.656 8.243 7.487 1.00 0.65 C ATOM 627 O THR A 42 14.512 8.074 7.918 1.00 0.62 O ATOM 628 CB THR A 42 16.380 10.627 7.435 1.00 1.06 C ATOM 629 OG1 THR A 42 15.323 11.025 8.269 1.00 1.36 O ATOM 630 CG2 THR A 42 16.814 11.855 6.641 1.00 1.34 C ATOM 0 H THR A 42 14.208 10.448 5.974 1.00 0.76 H new ATOM 0 HA THR A 42 16.791 9.164 5.899 1.00 0.79 H new ATOM 0 HB THR A 42 17.234 10.266 8.008 1.00 1.06 H new ATOM 0 HG1 THR A 42 15.597 11.805 8.795 1.00 1.36 H new ATOM 0 HG21 THR A 42 17.091 12.654 7.329 1.00 1.34 H new ATOM 0 HG22 THR A 42 17.671 11.601 6.017 1.00 1.34 H new ATOM 0 HG23 THR A 42 15.991 12.189 6.009 1.00 1.34 H new ATOM 638 N PRO A 43 16.673 7.467 7.924 1.00 0.75 N ATOM 639 CA PRO A 43 16.545 6.542 9.055 1.00 0.78 C ATOM 640 C PRO A 43 16.034 7.203 10.346 1.00 0.74 C ATOM 641 O PRO A 43 15.389 6.540 11.156 1.00 0.77 O ATOM 642 CB PRO A 43 17.953 5.976 9.261 1.00 0.95 C ATOM 643 CG PRO A 43 18.570 6.043 7.868 1.00 1.02 C ATOM 644 CD PRO A 43 18.012 7.367 7.360 1.00 0.92 C ATOM 0 HA PRO A 43 15.800 5.779 8.831 1.00 0.78 H new ATOM 0 HB2 PRO A 43 18.521 6.565 9.981 1.00 0.95 H new ATOM 0 HB3 PRO A 43 17.924 4.954 9.638 1.00 0.95 H new ATOM 0 HG2 PRO A 43 19.660 6.041 7.900 1.00 1.02 H new ATOM 0 HG3 PRO A 43 18.268 5.202 7.243 1.00 1.02 H new ATOM 0 HD2 PRO A 43 18.635 8.203 7.678 1.00 0.92 H new ATOM 0 HD3 PRO A 43 17.982 7.388 6.271 1.00 0.92 H new ATOM 652 N SER A 44 16.270 8.508 10.523 1.00 0.77 N ATOM 653 CA SER A 44 15.808 9.284 11.678 1.00 0.81 C ATOM 654 C SER A 44 14.279 9.373 11.752 1.00 0.72 C ATOM 655 O SER A 44 13.698 9.047 12.790 1.00 0.81 O ATOM 656 CB SER A 44 16.400 10.699 11.635 1.00 1.03 C ATOM 657 OG SER A 44 17.806 10.668 11.469 1.00 1.39 O ATOM 0 H SER A 44 16.799 9.065 9.852 1.00 0.77 H new ATOM 0 HA SER A 44 16.152 8.760 12.570 1.00 0.81 H new ATOM 0 HB2 SER A 44 15.948 11.259 10.816 1.00 1.03 H new ATOM 0 HB3 SER A 44 16.153 11.226 12.556 1.00 1.03 H new ATOM 0 HG SER A 44 18.153 11.584 11.444 1.00 1.39 H new ATOM 663 N GLU A 45 13.604 9.776 10.672 1.00 0.67 N ATOM 664 CA GLU A 45 12.133 9.897 10.659 1.00 0.64 C ATOM 665 C GLU A 45 11.406 8.570 10.403 1.00 0.58 C ATOM 666 O GLU A 45 10.276 8.400 10.863 1.00 0.64 O ATOM 667 CB GLU A 45 11.682 11.036 9.736 1.00 0.75 C ATOM 668 CG GLU A 45 11.975 10.847 8.238 1.00 0.78 C ATOM 669 CD GLU A 45 12.574 12.102 7.585 1.00 0.97 C ATOM 670 OE1 GLU A 45 12.280 13.235 8.025 1.00 1.70 O ATOM 671 OE2 GLU A 45 13.404 11.936 6.659 1.00 1.69 O ATOM 0 H GLU A 45 14.050 10.026 9.789 1.00 0.67 H new ATOM 0 HA GLU A 45 11.829 10.169 11.670 1.00 0.64 H new ATOM 0 HB2 GLU A 45 10.608 11.175 9.861 1.00 0.75 H new ATOM 0 HB3 GLU A 45 12.163 11.957 10.066 1.00 0.75 H new ATOM 0 HG2 GLU A 45 12.664 10.012 8.110 1.00 0.78 H new ATOM 0 HG3 GLU A 45 11.052 10.580 7.723 1.00 0.78 H new ATOM 678 N LEU A 46 12.089 7.592 9.790 1.00 0.54 N ATOM 679 CA LEU A 46 11.665 6.189 9.706 1.00 0.57 C ATOM 680 C LEU A 46 11.286 5.627 11.087 1.00 0.65 C ATOM 681 O LEU A 46 10.231 5.016 11.220 1.00 0.89 O ATOM 682 CB LEU A 46 12.821 5.415 9.039 1.00 0.60 C ATOM 683 CG LEU A 46 12.748 3.886 8.872 1.00 0.93 C ATOM 684 CD1 LEU A 46 12.691 3.089 10.171 1.00 2.03 C ATOM 685 CD2 LEU A 46 11.578 3.411 8.034 1.00 1.72 C ATOM 0 H LEU A 46 12.980 7.763 9.324 1.00 0.54 H new ATOM 0 HA LEU A 46 10.759 6.088 9.108 1.00 0.57 H new ATOM 0 HB2 LEU A 46 12.961 5.840 8.045 1.00 0.60 H new ATOM 0 HB3 LEU A 46 13.724 5.633 9.609 1.00 0.60 H new ATOM 0 HG LEU A 46 13.694 3.691 8.366 1.00 0.93 H new ATOM 0 HD11 LEU A 46 12.642 2.024 9.943 1.00 2.03 H new ATOM 0 HD12 LEU A 46 13.584 3.292 10.762 1.00 2.03 H new ATOM 0 HD13 LEU A 46 11.807 3.380 10.738 1.00 2.03 H new ATOM 0 HD21 LEU A 46 11.598 2.323 7.964 1.00 1.72 H new ATOM 0 HD22 LEU A 46 10.645 3.728 8.500 1.00 1.72 H new ATOM 0 HD23 LEU A 46 11.649 3.840 7.034 1.00 1.72 H new ATOM 697 N ARG A 47 12.096 5.845 12.136 1.00 0.61 N ATOM 698 CA ARG A 47 11.729 5.397 13.498 1.00 0.76 C ATOM 699 C ARG A 47 10.682 6.285 14.175 1.00 0.80 C ATOM 700 O ARG A 47 9.875 5.769 14.947 1.00 0.97 O ATOM 701 CB ARG A 47 12.942 5.055 14.374 1.00 1.06 C ATOM 702 CG ARG A 47 14.116 6.040 14.374 1.00 1.23 C ATOM 703 CD ARG A 47 15.364 5.336 14.915 1.00 1.00 C ATOM 704 NE ARG A 47 15.348 5.206 16.384 1.00 1.81 N ATOM 705 CZ ARG A 47 16.300 4.660 17.118 1.00 2.52 C ATOM 706 NH1 ARG A 47 17.386 4.169 16.604 1.00 2.66 N ATOM 707 NH2 ARG A 47 16.197 4.572 18.409 1.00 3.49 N ATOM 0 H ARG A 47 12.996 6.321 12.074 1.00 0.61 H new ATOM 0 HA ARG A 47 11.217 4.444 13.364 1.00 0.76 H new ATOM 0 HB2 ARG A 47 12.595 4.946 15.401 1.00 1.06 H new ATOM 0 HB3 ARG A 47 13.320 4.082 14.060 1.00 1.06 H new ATOM 0 HG2 ARG A 47 14.299 6.406 13.364 1.00 1.23 H new ATOM 0 HG3 ARG A 47 13.878 6.908 14.989 1.00 1.23 H new ATOM 0 HD2 ARG A 47 15.441 4.345 14.467 1.00 1.00 H new ATOM 0 HD3 ARG A 47 16.251 5.893 14.613 1.00 1.00 H new ATOM 0 HE ARG A 47 14.531 5.569 16.875 1.00 1.81 H new ATOM 0 HH11 ARG A 47 17.530 4.196 15.595 1.00 2.66 H new ATOM 0 HH12 ARG A 47 18.096 3.756 17.210 1.00 2.66 H new ATOM 0 HH21 ARG A 47 15.366 4.929 18.880 1.00 3.49 H new ATOM 0 HH22 ARG A 47 16.947 4.145 18.953 1.00 3.49 H new ATOM 721 N ASP A 48 10.625 7.575 13.832 1.00 0.74 N ATOM 722 CA ASP A 48 9.673 8.537 14.408 1.00 0.76 C ATOM 723 C ASP A 48 8.218 8.211 14.043 1.00 0.76 C ATOM 724 O ASP A 48 7.402 7.984 14.939 1.00 0.94 O ATOM 725 CB ASP A 48 10.046 9.971 13.999 1.00 0.83 C ATOM 726 CG ASP A 48 9.619 10.998 15.051 1.00 0.88 C ATOM 727 OD1 ASP A 48 10.433 11.245 15.976 1.00 1.78 O ATOM 728 OD2 ASP A 48 8.531 11.609 14.961 1.00 1.65 O ATOM 0 H ASP A 48 11.246 7.989 13.137 1.00 0.74 H new ATOM 0 HA ASP A 48 9.743 8.456 15.493 1.00 0.76 H new ATOM 0 HB2 ASP A 48 11.123 10.036 13.846 1.00 0.83 H new ATOM 0 HB3 ASP A 48 9.574 10.210 13.046 1.00 0.83 H new ATOM 733 N LEU A 49 7.883 8.081 12.749 1.00 0.68 N ATOM 734 CA LEU A 49 6.502 7.750 12.371 1.00 0.70 C ATOM 735 C LEU A 49 6.096 6.327 12.777 1.00 0.68 C ATOM 736 O LEU A 49 4.910 6.060 12.946 1.00 0.79 O ATOM 737 CB LEU A 49 6.177 8.091 10.903 1.00 0.75 C ATOM 738 CG LEU A 49 6.315 6.988 9.842 1.00 0.67 C ATOM 739 CD1 LEU A 49 5.704 7.454 8.519 1.00 0.76 C ATOM 740 CD2 LEU A 49 7.770 6.619 9.581 1.00 0.77 C ATOM 0 H LEU A 49 8.529 8.196 11.968 1.00 0.68 H new ATOM 0 HA LEU A 49 5.865 8.409 12.961 1.00 0.70 H new ATOM 0 HB2 LEU A 49 5.151 8.457 10.868 1.00 0.75 H new ATOM 0 HB3 LEU A 49 6.821 8.919 10.605 1.00 0.75 H new ATOM 0 HG LEU A 49 5.793 6.113 10.229 1.00 0.67 H new ATOM 0 HD11 LEU A 49 5.807 6.666 7.773 1.00 0.76 H new ATOM 0 HD12 LEU A 49 4.648 7.680 8.666 1.00 0.76 H new ATOM 0 HD13 LEU A 49 6.222 8.349 8.174 1.00 0.76 H new ATOM 0 HD21 LEU A 49 7.817 5.836 8.824 1.00 0.77 H new ATOM 0 HD22 LEU A 49 8.310 7.497 9.228 1.00 0.77 H new ATOM 0 HD23 LEU A 49 8.225 6.259 10.504 1.00 0.77 H new ATOM 752 N VAL A 50 7.054 5.416 12.976 1.00 0.60 N ATOM 753 CA VAL A 50 6.758 4.052 13.430 1.00 0.60 C ATOM 754 C VAL A 50 6.396 4.023 14.922 1.00 0.62 C ATOM 755 O VAL A 50 5.403 3.387 15.280 1.00 0.73 O ATOM 756 CB VAL A 50 7.907 3.092 13.067 1.00 0.59 C ATOM 757 CG1 VAL A 50 7.707 1.693 13.662 1.00 0.63 C ATOM 758 CG2 VAL A 50 7.986 2.907 11.546 1.00 0.64 C ATOM 0 H VAL A 50 8.047 5.599 12.829 1.00 0.60 H new ATOM 0 HA VAL A 50 5.875 3.695 12.900 1.00 0.60 H new ATOM 0 HB VAL A 50 8.814 3.542 13.471 1.00 0.59 H new ATOM 0 HG11 VAL A 50 8.543 1.054 13.378 1.00 0.63 H new ATOM 0 HG12 VAL A 50 7.657 1.763 14.749 1.00 0.63 H new ATOM 0 HG13 VAL A 50 6.778 1.266 13.283 1.00 0.63 H new ATOM 0 HG21 VAL A 50 8.802 2.226 11.304 1.00 0.64 H new ATOM 0 HG22 VAL A 50 7.047 2.492 11.181 1.00 0.64 H new ATOM 0 HG23 VAL A 50 8.165 3.872 11.071 1.00 0.64 H new ATOM 768 N THR A 51 7.113 4.751 15.793 1.00 0.59 N ATOM 769 CA THR A 51 6.737 4.863 17.223 1.00 0.65 C ATOM 770 C THR A 51 5.527 5.780 17.457 1.00 0.65 C ATOM 771 O THR A 51 4.778 5.569 18.411 1.00 0.75 O ATOM 772 CB THR A 51 7.938 5.232 18.119 1.00 0.76 C ATOM 773 OG1 THR A 51 7.614 5.061 19.487 1.00 0.93 O ATOM 774 CG2 THR A 51 8.436 6.663 17.947 1.00 0.73 C ATOM 0 H THR A 51 7.953 5.271 15.540 1.00 0.59 H new ATOM 0 HA THR A 51 6.417 3.866 17.526 1.00 0.65 H new ATOM 0 HB THR A 51 8.732 4.557 17.801 1.00 0.76 H new ATOM 0 HG1 THR A 51 8.388 5.298 20.039 1.00 0.93 H new ATOM 0 HG21 THR A 51 9.281 6.837 18.614 1.00 0.73 H new ATOM 0 HG22 THR A 51 8.751 6.817 16.915 1.00 0.73 H new ATOM 0 HG23 THR A 51 7.633 7.359 18.189 1.00 0.73 H new ATOM 782 N GLN A 52 5.273 6.760 16.580 1.00 0.59 N ATOM 783 CA GLN A 52 4.119 7.665 16.702 1.00 0.63 C ATOM 784 C GLN A 52 2.842 7.171 15.999 1.00 0.65 C ATOM 785 O GLN A 52 1.749 7.536 16.444 1.00 0.87 O ATOM 786 CB GLN A 52 4.496 9.076 16.213 1.00 0.63 C ATOM 787 CG GLN A 52 5.579 9.748 17.076 1.00 0.98 C ATOM 788 CD GLN A 52 5.178 9.984 18.531 1.00 1.75 C ATOM 789 OE1 GLN A 52 4.014 10.030 18.911 1.00 2.05 O ATOM 790 NE2 GLN A 52 6.144 10.150 19.402 1.00 2.92 N ATOM 0 H GLN A 52 5.859 6.949 15.767 1.00 0.59 H new ATOM 0 HA GLN A 52 3.872 7.690 17.763 1.00 0.63 H new ATOM 0 HB2 GLN A 52 4.848 9.015 15.183 1.00 0.63 H new ATOM 0 HB3 GLN A 52 3.604 9.702 16.208 1.00 0.63 H new ATOM 0 HG2 GLN A 52 6.476 9.129 17.056 1.00 0.98 H new ATOM 0 HG3 GLN A 52 5.842 10.705 16.626 1.00 0.98 H new ATOM 0 HE21 GLN A 52 7.117 10.114 19.098 1.00 2.92 H new ATOM 0 HE22 GLN A 52 5.923 10.315 20.384 1.00 2.92 H new ATOM 799 N GLN A 53 2.941 6.364 14.930 1.00 0.59 N ATOM 800 CA GLN A 53 1.784 5.958 14.110 1.00 0.67 C ATOM 801 C GLN A 53 1.576 4.443 13.907 1.00 0.69 C ATOM 802 O GLN A 53 0.473 4.086 13.499 1.00 0.82 O ATOM 803 CB GLN A 53 1.774 6.652 12.733 1.00 0.75 C ATOM 804 CG GLN A 53 2.132 8.146 12.687 1.00 0.86 C ATOM 805 CD GLN A 53 1.581 8.816 11.430 1.00 1.20 C ATOM 806 OE1 GLN A 53 0.544 9.465 11.429 1.00 1.56 O ATOM 807 NE2 GLN A 53 2.225 8.659 10.297 1.00 2.07 N ATOM 0 H GLN A 53 3.826 5.973 14.608 1.00 0.59 H new ATOM 0 HA GLN A 53 0.946 6.293 14.721 1.00 0.67 H new ATOM 0 HB2 GLN A 53 2.469 6.120 12.083 1.00 0.75 H new ATOM 0 HB3 GLN A 53 0.780 6.531 12.303 1.00 0.75 H new ATOM 0 HG2 GLN A 53 1.733 8.644 13.571 1.00 0.86 H new ATOM 0 HG3 GLN A 53 3.215 8.263 12.717 1.00 0.86 H new ATOM 0 HE21 GLN A 53 3.092 8.122 10.273 1.00 2.07 H new ATOM 0 HE22 GLN A 53 1.859 9.074 9.440 1.00 2.07 H new ATOM 816 N LEU A 54 2.543 3.552 14.193 1.00 0.64 N ATOM 817 CA LEU A 54 2.338 2.085 14.129 1.00 0.67 C ATOM 818 C LEU A 54 2.511 1.362 15.496 1.00 0.76 C ATOM 819 O LEU A 54 3.202 0.339 15.556 1.00 0.79 O ATOM 820 CB LEU A 54 3.271 1.455 13.064 1.00 0.63 C ATOM 821 CG LEU A 54 3.171 1.949 11.612 1.00 0.61 C ATOM 822 CD1 LEU A 54 4.195 1.196 10.760 1.00 0.66 C ATOM 823 CD2 LEU A 54 1.804 1.688 10.977 1.00 0.64 C ATOM 0 H LEU A 54 3.486 3.822 14.474 1.00 0.64 H new ATOM 0 HA LEU A 54 1.296 1.940 13.842 1.00 0.67 H new ATOM 0 HB2 LEU A 54 4.299 1.605 13.394 1.00 0.63 H new ATOM 0 HB3 LEU A 54 3.091 0.380 13.061 1.00 0.63 H new ATOM 0 HG LEU A 54 3.345 3.025 11.642 1.00 0.61 H new ATOM 0 HD11 LEU A 54 4.132 1.539 9.727 1.00 0.66 H new ATOM 0 HD12 LEU A 54 5.197 1.384 11.145 1.00 0.66 H new ATOM 0 HD13 LEU A 54 3.986 0.127 10.800 1.00 0.66 H new ATOM 0 HD21 LEU A 54 1.801 2.061 9.953 1.00 0.64 H new ATOM 0 HD22 LEU A 54 1.603 0.617 10.974 1.00 0.64 H new ATOM 0 HD23 LEU A 54 1.032 2.200 11.552 1.00 0.64 H new ATOM 835 N PRO A 55 1.899 1.815 16.611 1.00 0.86 N ATOM 836 CA PRO A 55 2.114 1.192 17.919 1.00 0.99 C ATOM 837 C PRO A 55 1.392 -0.157 18.085 1.00 1.01 C ATOM 838 O PRO A 55 1.758 -0.926 18.978 1.00 1.10 O ATOM 839 CB PRO A 55 1.622 2.230 18.930 1.00 1.10 C ATOM 840 CG PRO A 55 0.476 2.908 18.183 1.00 1.06 C ATOM 841 CD PRO A 55 1.003 2.956 16.749 1.00 0.91 C ATOM 0 HA PRO A 55 3.165 0.937 18.059 1.00 0.99 H new ATOM 0 HB2 PRO A 55 1.283 1.765 19.856 1.00 1.10 H new ATOM 0 HB3 PRO A 55 2.406 2.938 19.198 1.00 1.10 H new ATOM 0 HG2 PRO A 55 -0.450 2.338 18.257 1.00 1.06 H new ATOM 0 HG3 PRO A 55 0.269 3.904 18.574 1.00 1.06 H new ATOM 0 HD2 PRO A 55 0.185 2.899 16.031 1.00 0.91 H new ATOM 0 HD3 PRO A 55 1.530 3.891 16.558 1.00 0.91 H new ATOM 849 N HIS A 56 0.377 -0.461 17.265 1.00 0.98 N ATOM 850 CA HIS A 56 -0.271 -1.778 17.204 1.00 1.08 C ATOM 851 C HIS A 56 0.444 -2.711 16.216 1.00 1.08 C ATOM 852 O HIS A 56 0.745 -3.864 16.546 1.00 1.21 O ATOM 853 CB HIS A 56 -1.766 -1.625 16.867 1.00 1.14 C ATOM 854 CG HIS A 56 -2.467 -0.577 17.681 1.00 1.20 C ATOM 855 ND1 HIS A 56 -2.644 0.731 17.312 1.00 1.14 N ATOM 856 CD2 HIS A 56 -3.000 -0.727 18.931 1.00 1.39 C ATOM 857 CE1 HIS A 56 -3.252 1.360 18.324 1.00 1.27 C ATOM 858 NE2 HIS A 56 -3.491 0.518 19.348 1.00 1.42 N ATOM 0 H HIS A 56 -0.024 0.214 16.614 1.00 0.98 H new ATOM 0 HA HIS A 56 -0.194 -2.243 18.187 1.00 1.08 H new ATOM 0 HB2 HIS A 56 -1.867 -1.378 15.810 1.00 1.14 H new ATOM 0 HB3 HIS A 56 -2.263 -2.583 17.020 1.00 1.14 H new ATOM 0 HD1 HIS A 56 -2.363 1.150 16.425 1.00 1.14 H new ATOM 0 HD2 HIS A 56 -3.036 -1.645 19.499 1.00 1.39 H new ATOM 0 HE1 HIS A 56 -3.517 2.407 18.321 1.00 1.27 H new ATOM 866 N LEU A 57 0.720 -2.202 15.008 1.00 1.06 N ATOM 867 CA LEU A 57 1.161 -2.989 13.848 1.00 1.15 C ATOM 868 C LEU A 57 2.690 -3.169 13.734 1.00 1.36 C ATOM 869 O LEU A 57 3.145 -4.088 13.055 1.00 1.76 O ATOM 870 CB LEU A 57 0.528 -2.344 12.598 1.00 1.36 C ATOM 871 CG LEU A 57 0.721 -3.092 11.263 1.00 1.20 C ATOM 872 CD1 LEU A 57 0.263 -4.552 11.322 1.00 2.21 C ATOM 873 CD2 LEU A 57 -0.091 -2.392 10.170 1.00 2.00 C ATOM 0 H LEU A 57 0.641 -1.206 14.805 1.00 1.06 H new ATOM 0 HA LEU A 57 0.817 -4.017 13.964 1.00 1.15 H new ATOM 0 HB2 LEU A 57 -0.542 -2.234 12.776 1.00 1.36 H new ATOM 0 HB3 LEU A 57 0.937 -1.340 12.488 1.00 1.36 H new ATOM 0 HG LEU A 57 1.790 -3.079 11.050 1.00 1.20 H new ATOM 0 HD11 LEU A 57 0.425 -5.023 10.353 1.00 2.21 H new ATOM 0 HD12 LEU A 57 0.835 -5.082 12.083 1.00 2.21 H new ATOM 0 HD13 LEU A 57 -0.797 -4.591 11.572 1.00 2.21 H new ATOM 0 HD21 LEU A 57 0.043 -2.918 9.224 1.00 2.00 H new ATOM 0 HD22 LEU A 57 -1.147 -2.397 10.442 1.00 2.00 H new ATOM 0 HD23 LEU A 57 0.252 -1.363 10.065 1.00 2.00 H new ATOM 885 N MET A 58 3.493 -2.336 14.401 1.00 1.25 N ATOM 886 CA MET A 58 4.956 -2.480 14.489 1.00 1.41 C ATOM 887 C MET A 58 5.473 -2.005 15.867 1.00 1.45 C ATOM 888 O MET A 58 6.097 -0.944 15.967 1.00 1.61 O ATOM 889 CB MET A 58 5.605 -1.740 13.303 1.00 1.57 C ATOM 890 CG MET A 58 7.127 -1.919 13.183 1.00 1.54 C ATOM 891 SD MET A 58 7.724 -3.625 12.987 1.00 2.23 S ATOM 892 CE MET A 58 8.186 -4.036 14.693 1.00 3.73 C ATOM 0 H MET A 58 3.141 -1.524 14.907 1.00 1.25 H new ATOM 0 HA MET A 58 5.238 -3.530 14.416 1.00 1.41 H new ATOM 0 HB2 MET A 58 5.139 -2.085 12.380 1.00 1.57 H new ATOM 0 HB3 MET A 58 5.385 -0.676 13.393 1.00 1.57 H new ATOM 0 HG2 MET A 58 7.474 -1.335 12.331 1.00 1.54 H new ATOM 0 HG3 MET A 58 7.593 -1.493 14.072 1.00 1.54 H new ATOM 0 HE1 MET A 58 8.777 -4.952 14.699 1.00 3.73 H new ATOM 0 HE2 MET A 58 8.774 -3.222 15.117 1.00 3.73 H new ATOM 0 HE3 MET A 58 7.285 -4.181 15.289 1.00 3.73 H new ATOM 902 N PRO A 59 5.193 -2.749 16.956 1.00 1.64 N ATOM 903 CA PRO A 59 5.502 -2.320 18.318 1.00 1.75 C ATOM 904 C PRO A 59 6.993 -2.376 18.673 1.00 1.57 C ATOM 905 O PRO A 59 7.763 -3.207 18.185 1.00 1.72 O ATOM 906 CB PRO A 59 4.695 -3.237 19.241 1.00 2.30 C ATOM 907 CG PRO A 59 4.582 -4.522 18.426 1.00 2.40 C ATOM 908 CD PRO A 59 4.475 -4.018 16.987 1.00 2.04 C ATOM 0 HA PRO A 59 5.238 -1.268 18.429 1.00 1.75 H new ATOM 0 HB2 PRO A 59 5.203 -3.404 20.191 1.00 2.30 H new ATOM 0 HB3 PRO A 59 3.716 -2.818 19.473 1.00 2.30 H new ATOM 0 HG2 PRO A 59 5.452 -5.163 18.564 1.00 2.40 H new ATOM 0 HG3 PRO A 59 3.707 -5.105 18.714 1.00 2.40 H new ATOM 0 HD2 PRO A 59 4.912 -4.732 16.289 1.00 2.04 H new ATOM 0 HD3 PRO A 59 3.433 -3.885 16.696 1.00 2.04 H new ATOM 916 N SER A 60 7.366 -1.537 19.637 1.00 1.63 N ATOM 917 CA SER A 60 8.707 -1.455 20.235 1.00 1.68 C ATOM 918 C SER A 60 9.184 -2.760 20.887 1.00 1.97 C ATOM 919 O SER A 60 10.391 -2.990 20.969 1.00 1.63 O ATOM 920 CB SER A 60 8.676 -0.356 21.293 1.00 1.84 C ATOM 921 OG SER A 60 8.662 0.908 20.654 1.00 2.12 O ATOM 0 H SER A 60 6.717 -0.864 20.044 1.00 1.63 H new ATOM 0 HA SER A 60 9.411 -1.245 19.429 1.00 1.68 H new ATOM 0 HB2 SER A 60 7.794 -0.467 21.924 1.00 1.84 H new ATOM 0 HB3 SER A 60 9.546 -0.438 21.944 1.00 1.84 H new ATOM 0 HG SER A 60 8.640 1.616 21.331 1.00 2.12 H new ATOM 959 N LEU A 64 12.252 -1.530 16.965 1.00 1.71 N ATOM 960 CA LEU A 64 11.920 -0.791 15.736 1.00 1.46 C ATOM 961 C LEU A 64 13.153 -0.198 15.039 1.00 1.21 C ATOM 962 O LEU A 64 13.125 -0.025 13.823 1.00 1.26 O ATOM 963 CB LEU A 64 10.746 0.182 15.982 1.00 1.46 C ATOM 964 CG LEU A 64 10.876 1.206 17.128 1.00 1.04 C ATOM 965 CD1 LEU A 64 11.833 2.350 16.797 1.00 1.10 C ATOM 966 CD2 LEU A 64 9.508 1.825 17.408 1.00 1.37 C ATOM 0 HA LEU A 64 11.551 -1.498 14.993 1.00 1.46 H new ATOM 0 HB2 LEU A 64 10.573 0.735 15.059 1.00 1.46 H new ATOM 0 HB3 LEU A 64 9.853 -0.414 16.168 1.00 1.46 H new ATOM 0 HG LEU A 64 11.268 0.663 17.988 1.00 1.04 H new ATOM 0 HD11 LEU A 64 11.883 3.038 17.641 1.00 1.10 H new ATOM 0 HD12 LEU A 64 12.826 1.947 16.598 1.00 1.10 H new ATOM 0 HD13 LEU A 64 11.473 2.882 15.916 1.00 1.10 H new ATOM 0 HD21 LEU A 64 9.595 2.550 18.218 1.00 1.37 H new ATOM 0 HD22 LEU A 64 9.145 2.326 16.511 1.00 1.37 H new ATOM 0 HD23 LEU A 64 8.806 1.042 17.696 1.00 1.37 H new ATOM 978 N GLU A 65 14.294 -0.064 15.728 1.00 1.15 N ATOM 979 CA GLU A 65 15.583 0.106 15.035 1.00 1.08 C ATOM 980 C GLU A 65 15.984 -1.112 14.182 1.00 1.16 C ATOM 981 O GLU A 65 16.844 -1.010 13.307 1.00 1.18 O ATOM 982 CB GLU A 65 16.727 0.538 15.960 1.00 1.16 C ATOM 983 CG GLU A 65 17.060 -0.468 17.062 1.00 1.38 C ATOM 984 CD GLU A 65 18.513 -0.299 17.519 1.00 1.67 C ATOM 985 OE1 GLU A 65 19.413 -0.884 16.866 1.00 2.63 O ATOM 986 OE2 GLU A 65 18.754 0.429 18.514 1.00 2.25 O ATOM 0 H GLU A 65 14.354 -0.069 16.746 1.00 1.15 H new ATOM 0 HA GLU A 65 15.409 0.933 14.347 1.00 1.08 H new ATOM 0 HB2 GLU A 65 17.620 0.709 15.359 1.00 1.16 H new ATOM 0 HB3 GLU A 65 16.466 1.491 16.421 1.00 1.16 H new ATOM 0 HG2 GLU A 65 16.387 -0.326 17.908 1.00 1.38 H new ATOM 0 HG3 GLU A 65 16.903 -1.483 16.696 1.00 1.38 H new ATOM 993 N GLU A 66 15.351 -2.270 14.396 1.00 1.26 N ATOM 994 CA GLU A 66 15.527 -3.475 13.585 1.00 1.36 C ATOM 995 C GLU A 66 15.064 -3.265 12.129 1.00 1.30 C ATOM 996 O GLU A 66 15.544 -3.929 11.208 1.00 1.38 O ATOM 997 CB GLU A 66 14.779 -4.621 14.283 1.00 1.53 C ATOM 998 CG GLU A 66 15.109 -5.985 13.682 1.00 2.48 C ATOM 999 CD GLU A 66 14.568 -7.089 14.587 1.00 2.91 C ATOM 1000 OE1 GLU A 66 13.369 -7.434 14.473 1.00 2.75 O ATOM 1001 OE2 GLU A 66 15.313 -7.572 15.475 1.00 4.09 O ATOM 0 H GLU A 66 14.685 -2.396 15.158 1.00 1.26 H new ATOM 0 HA GLU A 66 16.585 -3.724 13.510 1.00 1.36 H new ATOM 0 HB2 GLU A 66 15.032 -4.624 15.343 1.00 1.53 H new ATOM 0 HB3 GLU A 66 13.705 -4.446 14.212 1.00 1.53 H new ATOM 0 HG2 GLU A 66 14.672 -6.070 12.687 1.00 2.48 H new ATOM 0 HG3 GLU A 66 16.188 -6.091 13.567 1.00 2.48 H new ATOM 1008 N LYS A 67 14.198 -2.271 11.885 1.00 1.20 N ATOM 1009 CA LYS A 67 13.811 -1.849 10.535 1.00 1.20 C ATOM 1010 C LYS A 67 14.944 -1.134 9.793 1.00 1.22 C ATOM 1011 O LYS A 67 15.219 -1.467 8.642 1.00 1.51 O ATOM 1012 CB LYS A 67 12.514 -1.029 10.614 1.00 1.13 C ATOM 1013 CG LYS A 67 11.276 -1.858 10.979 1.00 1.06 C ATOM 1014 CD LYS A 67 11.050 -3.022 10.001 1.00 1.22 C ATOM 1015 CE LYS A 67 9.555 -3.292 9.881 1.00 1.24 C ATOM 1016 NZ LYS A 67 9.261 -4.516 9.106 1.00 1.85 N ATOM 0 H LYS A 67 13.745 -1.735 12.625 1.00 1.20 H new ATOM 0 HA LYS A 67 13.613 -2.734 9.930 1.00 1.20 H new ATOM 0 HB2 LYS A 67 12.640 -0.238 11.353 1.00 1.13 H new ATOM 0 HB3 LYS A 67 12.344 -0.543 9.653 1.00 1.13 H new ATOM 0 HG2 LYS A 67 11.389 -2.251 11.989 1.00 1.06 H new ATOM 0 HG3 LYS A 67 10.397 -1.213 10.984 1.00 1.06 H new ATOM 0 HD2 LYS A 67 11.467 -2.778 9.024 1.00 1.22 H new ATOM 0 HD3 LYS A 67 11.566 -3.915 10.354 1.00 1.22 H new ATOM 0 HE2 LYS A 67 9.125 -3.385 10.878 1.00 1.24 H new ATOM 0 HE3 LYS A 67 9.072 -2.439 9.404 1.00 1.24 H new ATOM 0 HZ1 LYS A 67 8.237 -4.583 8.937 1.00 1.85 H new ATOM 0 HZ2 LYS A 67 9.760 -4.478 8.194 1.00 1.85 H new ATOM 0 HZ3 LYS A 67 9.579 -5.350 9.640 1.00 1.85 H new ATOM 1030 N ILE A 68 15.687 -0.260 10.472 1.00 1.04 N ATOM 1031 CA ILE A 68 16.915 0.364 9.943 1.00 1.06 C ATOM 1032 C ILE A 68 18.056 -0.668 9.843 1.00 1.28 C ATOM 1033 O ILE A 68 18.914 -0.577 8.965 1.00 1.55 O ATOM 1034 CB ILE A 68 17.295 1.597 10.791 1.00 0.92 C ATOM 1035 CG1 ILE A 68 16.133 2.624 10.879 1.00 0.79 C ATOM 1036 CG2 ILE A 68 18.538 2.313 10.253 1.00 1.00 C ATOM 1037 CD1 ILE A 68 15.377 2.436 12.198 1.00 0.99 C ATOM 0 H ILE A 68 15.456 0.043 11.418 1.00 1.04 H new ATOM 0 HA ILE A 68 16.730 0.717 8.929 1.00 1.06 H new ATOM 0 HB ILE A 68 17.511 1.208 11.786 1.00 0.92 H new ATOM 0 HG12 ILE A 68 16.526 3.639 10.815 1.00 0.79 H new ATOM 0 HG13 ILE A 68 15.453 2.492 10.037 1.00 0.79 H new ATOM 0 HG21 ILE A 68 18.764 3.173 10.884 1.00 1.00 H new ATOM 0 HG22 ILE A 68 19.384 1.626 10.259 1.00 1.00 H new ATOM 0 HG23 ILE A 68 18.351 2.650 9.233 1.00 1.00 H new ATOM 0 HD11 ILE A 68 14.563 3.158 12.257 1.00 0.99 H new ATOM 0 HD12 ILE A 68 14.970 1.426 12.244 1.00 0.99 H new ATOM 0 HD13 ILE A 68 16.059 2.590 13.034 1.00 0.99 H new ATOM 1049 N ALA A 69 18.036 -1.714 10.674 1.00 1.24 N ATOM 1050 CA ALA A 69 18.934 -2.863 10.549 1.00 1.40 C ATOM 1051 C ALA A 69 18.626 -3.749 9.315 1.00 1.49 C ATOM 1052 O ALA A 69 19.535 -4.395 8.785 1.00 1.68 O ATOM 1053 CB ALA A 69 18.886 -3.643 11.870 1.00 1.45 C ATOM 0 H ALA A 69 17.389 -1.787 11.460 1.00 1.24 H new ATOM 0 HA ALA A 69 19.949 -2.508 10.369 1.00 1.40 H new ATOM 0 HB1 ALA A 69 19.547 -4.507 11.806 1.00 1.45 H new ATOM 0 HB2 ALA A 69 19.210 -2.997 12.686 1.00 1.45 H new ATOM 0 HB3 ALA A 69 17.866 -3.979 12.057 1.00 1.45 H new ATOM 1059 N ASN A 70 17.381 -3.758 8.816 1.00 1.39 N ATOM 1060 CA ASN A 70 16.991 -4.450 7.576 1.00 1.48 C ATOM 1061 C ASN A 70 17.398 -3.660 6.319 1.00 1.52 C ATOM 1062 O ASN A 70 18.108 -4.207 5.470 1.00 1.87 O ATOM 1063 CB ASN A 70 15.482 -4.765 7.579 1.00 1.45 C ATOM 1064 CG ASN A 70 15.161 -6.119 8.182 1.00 1.68 C ATOM 1065 OD1 ASN A 70 14.920 -7.092 7.474 1.00 2.30 O ATOM 1066 ND2 ASN A 70 15.152 -6.222 9.488 1.00 1.90 N ATOM 0 H ASN A 70 16.604 -3.277 9.269 1.00 1.39 H new ATOM 0 HA ASN A 70 17.536 -5.393 7.543 1.00 1.48 H new ATOM 0 HB2 ASN A 70 14.956 -3.991 8.137 1.00 1.45 H new ATOM 0 HB3 ASN A 70 15.107 -4.731 6.556 1.00 1.45 H new ATOM 0 HD21 ASN A 70 14.943 -7.118 9.927 1.00 1.90 H new ATOM 0 HD22 ASN A 70 15.354 -5.406 10.065 1.00 1.90 H new ATOM 1073 N LEU A 71 17.007 -2.379 6.215 1.00 1.29 N ATOM 1074 CA LEU A 71 17.343 -1.542 5.048 1.00 1.35 C ATOM 1075 C LEU A 71 18.826 -1.128 4.990 1.00 1.66 C ATOM 1076 O LEU A 71 19.354 -0.865 3.910 1.00 1.95 O ATOM 1077 CB LEU A 71 16.342 -0.391 4.876 1.00 1.20 C ATOM 1078 CG LEU A 71 16.229 0.680 5.973 1.00 1.34 C ATOM 1079 CD1 LEU A 71 17.413 1.646 6.068 1.00 1.47 C ATOM 1080 CD2 LEU A 71 14.981 1.495 5.655 1.00 1.57 C ATOM 0 H LEU A 71 16.456 -1.898 6.926 1.00 1.29 H new ATOM 0 HA LEU A 71 17.229 -2.165 4.161 1.00 1.35 H new ATOM 0 HB2 LEU A 71 16.587 0.119 3.944 1.00 1.20 H new ATOM 0 HB3 LEU A 71 15.354 -0.833 4.747 1.00 1.20 H new ATOM 0 HG LEU A 71 16.198 0.158 6.930 1.00 1.34 H new ATOM 0 HD11 LEU A 71 17.236 2.361 6.871 1.00 1.47 H new ATOM 0 HD12 LEU A 71 18.324 1.085 6.276 1.00 1.47 H new ATOM 0 HD13 LEU A 71 17.523 2.180 5.124 1.00 1.47 H new ATOM 0 HD21 LEU A 71 14.853 2.273 6.407 1.00 1.57 H new ATOM 0 HD22 LEU A 71 15.087 1.954 4.672 1.00 1.57 H new ATOM 0 HD23 LEU A 71 14.109 0.841 5.658 1.00 1.57 H new ATOM 1180 N LEU A 79 17.844 6.527 0.453 1.00 1.66 N ATOM 1181 CA LEU A 79 16.517 5.925 0.195 1.00 1.32 C ATOM 1182 C LEU A 79 15.866 6.376 -1.121 1.00 1.48 C ATOM 1183 O LEU A 79 16.332 7.298 -1.781 1.00 2.20 O ATOM 1184 CB LEU A 79 15.570 6.181 1.394 1.00 1.17 C ATOM 1185 CG LEU A 79 15.669 5.078 2.455 1.00 1.35 C ATOM 1186 CD1 LEU A 79 16.970 5.084 3.259 1.00 2.03 C ATOM 1187 CD2 LEU A 79 14.499 5.115 3.438 1.00 1.99 C ATOM 0 HA LEU A 79 16.688 4.854 0.082 1.00 1.32 H new ATOM 0 HB2 LEU A 79 15.812 7.142 1.848 1.00 1.17 H new ATOM 0 HB3 LEU A 79 14.543 6.247 1.036 1.00 1.17 H new ATOM 0 HG LEU A 79 15.644 4.159 1.869 1.00 1.35 H new ATOM 0 HD11 LEU A 79 16.953 4.271 3.985 1.00 2.03 H new ATOM 0 HD12 LEU A 79 17.815 4.950 2.584 1.00 2.03 H new ATOM 0 HD13 LEU A 79 17.070 6.035 3.782 1.00 2.03 H new ATOM 0 HD21 LEU A 79 14.613 4.315 4.170 1.00 1.99 H new ATOM 0 HD22 LEU A 79 14.485 6.077 3.951 1.00 1.99 H new ATOM 0 HD23 LEU A 79 13.563 4.979 2.895 1.00 1.99 H new ATOM 1199 N GLU A 80 14.750 5.750 -1.488 1.00 1.13 N ATOM 1200 CA GLU A 80 13.832 6.188 -2.545 1.00 1.23 C ATOM 1201 C GLU A 80 12.364 6.105 -2.082 1.00 1.02 C ATOM 1202 O GLU A 80 12.047 5.496 -1.058 1.00 0.87 O ATOM 1203 CB GLU A 80 14.078 5.349 -3.816 1.00 1.50 C ATOM 1204 CG GLU A 80 14.866 6.121 -4.886 1.00 1.71 C ATOM 1205 CD GLU A 80 14.106 7.309 -5.501 1.00 2.51 C ATOM 1206 OE1 GLU A 80 12.862 7.397 -5.363 1.00 3.37 O ATOM 1207 OE2 GLU A 80 14.761 8.164 -6.149 1.00 3.65 O ATOM 0 H GLU A 80 14.445 4.886 -1.040 1.00 1.13 H new ATOM 0 HA GLU A 80 14.027 7.235 -2.775 1.00 1.23 H new ATOM 0 HB2 GLU A 80 14.623 4.444 -3.550 1.00 1.50 H new ATOM 0 HB3 GLU A 80 13.120 5.034 -4.231 1.00 1.50 H new ATOM 0 HG2 GLU A 80 15.792 6.488 -4.444 1.00 1.71 H new ATOM 0 HG3 GLU A 80 15.144 5.432 -5.683 1.00 1.71 H new ATOM 1214 N PHE A 81 11.448 6.708 -2.846 1.00 1.15 N ATOM 1215 CA PHE A 81 10.001 6.676 -2.576 1.00 1.09 C ATOM 1216 C PHE A 81 9.453 5.230 -2.570 1.00 0.89 C ATOM 1217 O PHE A 81 8.731 4.838 -1.650 1.00 0.90 O ATOM 1218 CB PHE A 81 9.336 7.595 -3.613 1.00 1.35 C ATOM 1219 CG PHE A 81 7.822 7.708 -3.589 1.00 1.54 C ATOM 1220 CD1 PHE A 81 7.184 8.708 -2.824 1.00 2.62 C ATOM 1221 CD2 PHE A 81 7.054 6.879 -4.432 1.00 2.25 C ATOM 1222 CE1 PHE A 81 5.795 8.906 -2.938 1.00 2.99 C ATOM 1223 CE2 PHE A 81 5.665 7.072 -4.537 1.00 2.50 C ATOM 1224 CZ PHE A 81 5.043 8.099 -3.810 1.00 2.38 C ATOM 0 H PHE A 81 11.691 7.240 -3.682 1.00 1.15 H new ATOM 0 HA PHE A 81 9.772 7.045 -1.576 1.00 1.09 H new ATOM 0 HB2 PHE A 81 9.749 8.596 -3.488 1.00 1.35 H new ATOM 0 HB3 PHE A 81 9.631 7.250 -4.604 1.00 1.35 H new ATOM 0 HD1 PHE A 81 7.763 9.322 -2.150 1.00 2.62 H new ATOM 0 HD2 PHE A 81 7.533 6.094 -4.998 1.00 2.25 H new ATOM 0 HE1 PHE A 81 5.308 9.676 -2.357 1.00 2.99 H new ATOM 0 HE2 PHE A 81 5.077 6.430 -5.177 1.00 2.50 H new ATOM 0 HZ PHE A 81 3.982 8.270 -3.921 1.00 2.38 H new ATOM 1234 N ARG A 82 9.908 4.387 -3.510 1.00 0.84 N ATOM 1235 CA ARG A 82 9.660 2.932 -3.535 1.00 0.85 C ATOM 1236 C ARG A 82 10.161 2.211 -2.274 1.00 0.84 C ATOM 1237 O ARG A 82 9.533 1.248 -1.846 1.00 0.94 O ATOM 1238 CB ARG A 82 10.275 2.373 -4.836 1.00 1.01 C ATOM 1239 CG ARG A 82 10.085 0.865 -5.094 1.00 1.65 C ATOM 1240 CD ARG A 82 11.249 0.016 -4.558 1.00 2.65 C ATOM 1241 NE ARG A 82 11.111 -1.404 -4.931 1.00 3.32 N ATOM 1242 CZ ARG A 82 11.910 -2.380 -4.534 1.00 4.45 C ATOM 1243 NH1 ARG A 82 12.974 -2.174 -3.809 1.00 5.37 N ATOM 1244 NH2 ARG A 82 11.647 -3.615 -4.834 1.00 5.37 N ATOM 0 H ARG A 82 10.474 4.705 -4.297 1.00 0.84 H new ATOM 0 HA ARG A 82 8.586 2.746 -3.529 1.00 0.85 H new ATOM 0 HB2 ARG A 82 9.849 2.919 -5.677 1.00 1.01 H new ATOM 0 HB3 ARG A 82 11.344 2.586 -4.827 1.00 1.01 H new ATOM 0 HG2 ARG A 82 9.157 0.536 -4.627 1.00 1.65 H new ATOM 0 HG3 ARG A 82 9.981 0.695 -6.166 1.00 1.65 H new ATOM 0 HD2 ARG A 82 12.190 0.404 -4.947 1.00 2.65 H new ATOM 0 HD3 ARG A 82 11.293 0.104 -3.472 1.00 2.65 H new ATOM 0 HE ARG A 82 10.336 -1.654 -5.545 1.00 3.32 H new ATOM 0 HH11 ARG A 82 13.221 -1.226 -3.523 1.00 5.37 H new ATOM 0 HH12 ARG A 82 13.559 -2.960 -3.527 1.00 5.37 H new ATOM 0 HH21 ARG A 82 10.817 -3.841 -5.382 1.00 5.37 H new ATOM 0 HH22 ARG A 82 12.271 -4.359 -4.522 1.00 5.37 H new ATOM 1258 N SER A 83 11.238 2.678 -1.639 1.00 0.82 N ATOM 1259 CA SER A 83 11.809 2.050 -0.433 1.00 0.86 C ATOM 1260 C SER A 83 10.930 2.240 0.811 1.00 0.77 C ATOM 1261 O SER A 83 10.871 1.351 1.658 1.00 0.83 O ATOM 1262 CB SER A 83 13.215 2.593 -0.148 1.00 0.99 C ATOM 1263 OG SER A 83 13.974 2.724 -1.338 1.00 1.77 O ATOM 0 H SER A 83 11.746 3.508 -1.945 1.00 0.82 H new ATOM 0 HA SER A 83 11.860 0.982 -0.644 1.00 0.86 H new ATOM 0 HB2 SER A 83 13.139 3.563 0.344 1.00 0.99 H new ATOM 0 HB3 SER A 83 13.731 1.925 0.542 1.00 0.99 H new ATOM 0 HG SER A 83 14.907 2.919 -1.111 1.00 1.77 H new ATOM 1269 N PHE A 84 10.202 3.361 0.911 1.00 0.70 N ATOM 1270 CA PHE A 84 9.160 3.555 1.932 1.00 0.69 C ATOM 1271 C PHE A 84 7.987 2.591 1.693 1.00 0.65 C ATOM 1272 O PHE A 84 7.569 1.871 2.598 1.00 0.63 O ATOM 1273 CB PHE A 84 8.681 5.010 1.892 1.00 0.74 C ATOM 1274 CG PHE A 84 7.638 5.402 2.931 1.00 0.78 C ATOM 1275 CD1 PHE A 84 6.258 5.286 2.655 1.00 1.97 C ATOM 1276 CD2 PHE A 84 8.050 5.995 4.139 1.00 2.19 C ATOM 1277 CE1 PHE A 84 5.310 5.806 3.559 1.00 2.03 C ATOM 1278 CE2 PHE A 84 7.104 6.509 5.042 1.00 2.22 C ATOM 1279 CZ PHE A 84 5.734 6.426 4.746 1.00 0.99 C ATOM 0 H PHE A 84 10.318 4.159 0.287 1.00 0.70 H new ATOM 0 HA PHE A 84 9.574 3.341 2.917 1.00 0.69 H new ATOM 0 HB2 PHE A 84 9.548 5.660 2.014 1.00 0.74 H new ATOM 0 HB3 PHE A 84 8.270 5.209 0.902 1.00 0.74 H new ATOM 0 HD1 PHE A 84 5.928 4.798 1.750 1.00 1.97 H new ATOM 0 HD2 PHE A 84 9.102 6.056 4.374 1.00 2.19 H new ATOM 0 HE1 PHE A 84 4.256 5.728 3.339 1.00 2.03 H new ATOM 0 HE2 PHE A 84 7.431 6.968 5.964 1.00 2.22 H new ATOM 0 HZ PHE A 84 5.007 6.838 5.430 1.00 0.99 H new ATOM 1289 N TRP A 85 7.495 2.543 0.449 1.00 0.68 N ATOM 1290 CA TRP A 85 6.378 1.686 0.039 1.00 0.69 C ATOM 1291 C TRP A 85 6.651 0.192 0.286 1.00 0.71 C ATOM 1292 O TRP A 85 5.789 -0.512 0.812 1.00 0.76 O ATOM 1293 CB TRP A 85 6.061 1.961 -1.436 1.00 0.72 C ATOM 1294 CG TRP A 85 4.970 1.099 -1.977 1.00 0.71 C ATOM 1295 CD1 TRP A 85 5.159 -0.064 -2.640 1.00 0.82 C ATOM 1296 CD2 TRP A 85 3.526 1.242 -1.812 1.00 0.66 C ATOM 1297 NE1 TRP A 85 3.943 -0.665 -2.876 1.00 0.85 N ATOM 1298 CE2 TRP A 85 2.903 0.092 -2.384 1.00 0.76 C ATOM 1299 CE3 TRP A 85 2.679 2.196 -1.197 1.00 0.61 C ATOM 1300 CZ2 TRP A 85 1.521 -0.115 -2.326 1.00 0.83 C ATOM 1301 CZ3 TRP A 85 1.288 2.000 -1.147 1.00 0.66 C ATOM 1302 CH2 TRP A 85 0.713 0.839 -1.686 1.00 0.77 C ATOM 0 H TRP A 85 7.869 3.109 -0.313 1.00 0.68 H new ATOM 0 HA TRP A 85 5.513 1.931 0.655 1.00 0.69 H new ATOM 0 HB2 TRP A 85 5.778 3.007 -1.550 1.00 0.72 H new ATOM 0 HB3 TRP A 85 6.963 1.808 -2.029 1.00 0.72 H new ATOM 0 HD1 TRP A 85 6.118 -0.461 -2.939 1.00 0.82 H new ATOM 0 HE1 TRP A 85 3.827 -1.558 -3.355 1.00 0.85 H new ATOM 0 HE3 TRP A 85 3.108 3.086 -0.761 1.00 0.61 H new ATOM 0 HZ2 TRP A 85 1.081 -0.997 -2.768 1.00 0.83 H new ATOM 0 HZ3 TRP A 85 0.657 2.748 -0.690 1.00 0.66 H new ATOM 0 HH2 TRP A 85 -0.352 0.679 -1.609 1.00 0.77 H new ATOM 1313 N GLU A 86 7.866 -0.290 0.007 1.00 0.72 N ATOM 1314 CA GLU A 86 8.258 -1.679 0.276 1.00 0.75 C ATOM 1315 C GLU A 86 8.143 -2.076 1.757 1.00 0.69 C ATOM 1316 O GLU A 86 7.804 -3.227 2.042 1.00 0.77 O ATOM 1317 CB GLU A 86 9.696 -1.929 -0.213 1.00 0.80 C ATOM 1318 CG GLU A 86 9.788 -2.242 -1.711 1.00 0.95 C ATOM 1319 CD GLU A 86 8.990 -3.490 -2.110 1.00 1.61 C ATOM 1320 OE1 GLU A 86 9.172 -4.571 -1.496 1.00 2.42 O ATOM 1321 OE2 GLU A 86 8.141 -3.390 -3.029 1.00 2.73 O ATOM 0 H GLU A 86 8.607 0.272 -0.412 1.00 0.72 H new ATOM 0 HA GLU A 86 7.554 -2.304 -0.274 1.00 0.75 H new ATOM 0 HB2 GLU A 86 10.303 -1.050 0.004 1.00 0.80 H new ATOM 0 HB3 GLU A 86 10.124 -2.759 0.350 1.00 0.80 H new ATOM 0 HG2 GLU A 86 9.423 -1.386 -2.279 1.00 0.95 H new ATOM 0 HG3 GLU A 86 10.834 -2.383 -1.984 1.00 0.95 H new ATOM 1328 N LEU A 87 8.362 -1.157 2.705 1.00 0.60 N ATOM 1329 CA LEU A 87 8.134 -1.442 4.125 1.00 0.54 C ATOM 1330 C LEU A 87 6.653 -1.406 4.525 1.00 0.52 C ATOM 1331 O LEU A 87 6.280 -2.082 5.484 1.00 0.58 O ATOM 1332 CB LEU A 87 8.987 -0.536 5.027 1.00 0.61 C ATOM 1333 CG LEU A 87 10.275 -1.241 5.500 1.00 1.02 C ATOM 1334 CD1 LEU A 87 11.440 -1.022 4.533 1.00 1.38 C ATOM 1335 CD2 LEU A 87 10.646 -0.730 6.886 1.00 1.48 C ATOM 0 H LEU A 87 8.696 -0.212 2.514 1.00 0.60 H new ATOM 0 HA LEU A 87 8.459 -2.471 4.279 1.00 0.54 H new ATOM 0 HB2 LEU A 87 9.249 0.373 4.485 1.00 0.61 H new ATOM 0 HB3 LEU A 87 8.401 -0.232 5.894 1.00 0.61 H new ATOM 0 HG LEU A 87 10.080 -2.313 5.533 1.00 1.02 H new ATOM 0 HD11 LEU A 87 12.325 -1.537 4.907 1.00 1.38 H new ATOM 0 HD12 LEU A 87 11.178 -1.418 3.552 1.00 1.38 H new ATOM 0 HD13 LEU A 87 11.648 0.045 4.450 1.00 1.38 H new ATOM 0 HD21 LEU A 87 11.556 -1.225 7.225 1.00 1.48 H new ATOM 0 HD22 LEU A 87 10.813 0.346 6.844 1.00 1.48 H new ATOM 0 HD23 LEU A 87 9.835 -0.945 7.582 1.00 1.48 H new ATOM 1347 N ILE A 88 5.790 -0.707 3.781 1.00 0.52 N ATOM 1348 CA ILE A 88 4.337 -0.889 3.911 1.00 0.54 C ATOM 1349 C ILE A 88 3.935 -2.283 3.395 1.00 0.63 C ATOM 1350 O ILE A 88 3.124 -2.959 4.024 1.00 0.64 O ATOM 1351 CB ILE A 88 3.543 0.222 3.194 1.00 0.60 C ATOM 1352 CG1 ILE A 88 4.007 1.652 3.528 1.00 0.58 C ATOM 1353 CG2 ILE A 88 2.072 0.108 3.612 1.00 0.65 C ATOM 1354 CD1 ILE A 88 3.259 2.717 2.733 1.00 0.71 C ATOM 0 H ILE A 88 6.068 -0.014 3.086 1.00 0.52 H new ATOM 0 HA ILE A 88 4.084 -0.816 4.969 1.00 0.54 H new ATOM 0 HB ILE A 88 3.703 0.072 2.126 1.00 0.60 H new ATOM 0 HG12 ILE A 88 3.867 1.835 4.593 1.00 0.58 H new ATOM 0 HG13 ILE A 88 5.075 1.739 3.328 1.00 0.58 H new ATOM 0 HG21 ILE A 88 1.491 0.886 3.116 1.00 0.65 H new ATOM 0 HG22 ILE A 88 1.687 -0.871 3.326 1.00 0.65 H new ATOM 0 HG23 ILE A 88 1.990 0.228 4.692 1.00 0.65 H new ATOM 0 HD11 ILE A 88 3.628 3.704 3.010 1.00 0.71 H new ATOM 0 HD12 ILE A 88 3.420 2.556 1.667 1.00 0.71 H new ATOM 0 HD13 ILE A 88 2.193 2.653 2.953 1.00 0.71 H new ATOM 1366 N GLY A 89 4.578 -2.771 2.330 1.00 0.71 N ATOM 1367 CA GLY A 89 4.472 -4.170 1.894 1.00 0.82 C ATOM 1368 C GLY A 89 4.897 -5.169 2.981 1.00 0.82 C ATOM 1369 O GLY A 89 4.228 -6.177 3.207 1.00 0.90 O ATOM 0 H GLY A 89 5.190 -2.205 1.742 1.00 0.71 H new ATOM 0 HA2 GLY A 89 3.443 -4.377 1.600 1.00 0.82 H new ATOM 0 HA3 GLY A 89 5.092 -4.318 1.010 1.00 0.82 H new ATOM 1373 N GLU A 90 5.953 -4.865 3.741 1.00 0.82 N ATOM 1374 CA GLU A 90 6.363 -5.667 4.889 1.00 0.87 C ATOM 1375 C GLU A 90 5.429 -5.513 6.110 1.00 0.78 C ATOM 1376 O GLU A 90 5.278 -6.470 6.880 1.00 0.86 O ATOM 1377 CB GLU A 90 7.831 -5.357 5.204 1.00 0.98 C ATOM 1378 CG GLU A 90 8.390 -6.407 6.159 1.00 1.19 C ATOM 1379 CD GLU A 90 9.913 -6.309 6.291 1.00 1.55 C ATOM 1380 OE1 GLU A 90 10.409 -5.242 6.715 1.00 2.39 O ATOM 1381 OE2 GLU A 90 10.626 -7.298 5.989 1.00 2.30 O ATOM 0 H GLU A 90 6.547 -4.053 3.574 1.00 0.82 H new ATOM 0 HA GLU A 90 6.274 -6.722 4.630 1.00 0.87 H new ATOM 0 HB2 GLU A 90 8.414 -5.343 4.283 1.00 0.98 H new ATOM 0 HB3 GLU A 90 7.915 -4.366 5.650 1.00 0.98 H new ATOM 0 HG2 GLU A 90 7.932 -6.285 7.141 1.00 1.19 H new ATOM 0 HG3 GLU A 90 8.120 -7.401 5.803 1.00 1.19 H new ATOM 1388 N ALA A 91 4.745 -4.371 6.283 1.00 0.67 N ATOM 1389 CA ALA A 91 3.596 -4.273 7.199 1.00 0.64 C ATOM 1390 C ALA A 91 2.443 -5.200 6.755 1.00 0.72 C ATOM 1391 O ALA A 91 1.896 -5.933 7.577 1.00 0.82 O ATOM 1392 CB ALA A 91 3.118 -2.810 7.354 1.00 0.51 C ATOM 0 H ALA A 91 4.968 -3.501 5.800 1.00 0.67 H new ATOM 0 HA ALA A 91 3.930 -4.611 8.180 1.00 0.64 H new ATOM 0 HB1 ALA A 91 2.269 -2.775 8.037 1.00 0.51 H new ATOM 0 HB2 ALA A 91 3.930 -2.202 7.753 1.00 0.51 H new ATOM 0 HB3 ALA A 91 2.818 -2.420 6.381 1.00 0.51 H new ATOM 1398 N ALA A 92 2.122 -5.248 5.457 1.00 0.73 N ATOM 1399 CA ALA A 92 1.086 -6.122 4.896 1.00 0.87 C ATOM 1400 C ALA A 92 1.432 -7.625 4.995 1.00 1.08 C ATOM 1401 O ALA A 92 0.540 -8.452 5.172 1.00 1.10 O ATOM 1402 CB ALA A 92 0.813 -5.683 3.451 1.00 0.94 C ATOM 0 H ALA A 92 2.583 -4.670 4.755 1.00 0.73 H new ATOM 0 HA ALA A 92 0.180 -6.013 5.492 1.00 0.87 H new ATOM 0 HB1 ALA A 92 0.044 -6.322 3.016 1.00 0.94 H new ATOM 0 HB2 ALA A 92 0.472 -4.648 3.444 1.00 0.94 H new ATOM 0 HB3 ALA A 92 1.729 -5.767 2.866 1.00 0.94 H new ATOM 1408 N LYS A 93 2.716 -8.009 4.990 1.00 1.40 N ATOM 1409 CA LYS A 93 3.140 -9.379 5.357 1.00 1.61 C ATOM 1410 C LYS A 93 2.763 -9.757 6.804 1.00 1.65 C ATOM 1411 O LYS A 93 2.544 -10.937 7.073 1.00 1.85 O ATOM 1412 CB LYS A 93 4.648 -9.563 5.105 1.00 1.75 C ATOM 1413 CG LYS A 93 5.001 -9.757 3.621 1.00 1.79 C ATOM 1414 CD LYS A 93 6.521 -9.896 3.447 1.00 2.12 C ATOM 1415 CE LYS A 93 6.885 -10.293 2.010 1.00 2.12 C ATOM 1416 NZ LYS A 93 8.355 -10.391 1.841 1.00 2.69 N ATOM 0 H LYS A 93 3.487 -7.391 4.735 1.00 1.40 H new ATOM 0 HA LYS A 93 2.591 -10.066 4.712 1.00 1.61 H new ATOM 0 HB2 LYS A 93 5.181 -8.692 5.487 1.00 1.75 H new ATOM 0 HB3 LYS A 93 5.000 -10.426 5.670 1.00 1.75 H new ATOM 0 HG2 LYS A 93 4.501 -10.645 3.235 1.00 1.79 H new ATOM 0 HG3 LYS A 93 4.638 -8.909 3.040 1.00 1.79 H new ATOM 0 HD2 LYS A 93 7.006 -8.953 3.700 1.00 2.12 H new ATOM 0 HD3 LYS A 93 6.901 -10.646 4.141 1.00 2.12 H new ATOM 0 HE2 LYS A 93 6.423 -11.249 1.765 1.00 2.12 H new ATOM 0 HE3 LYS A 93 6.484 -9.557 1.313 1.00 2.12 H new ATOM 0 HZ1 LYS A 93 8.575 -10.661 0.861 1.00 2.69 H new ATOM 0 HZ2 LYS A 93 8.791 -9.471 2.053 1.00 2.69 H new ATOM 0 HZ3 LYS A 93 8.732 -11.110 2.491 1.00 2.69 H new ATOM 1430 N SER A 94 2.619 -8.778 7.706 1.00 1.53 N ATOM 1431 CA SER A 94 2.180 -8.958 9.104 1.00 1.64 C ATOM 1432 C SER A 94 0.660 -8.798 9.326 1.00 1.53 C ATOM 1433 O SER A 94 0.207 -8.928 10.468 1.00 1.61 O ATOM 1434 CB SER A 94 2.941 -8.006 10.040 1.00 1.72 C ATOM 1435 OG SER A 94 4.335 -8.262 10.040 1.00 2.08 O ATOM 0 H SER A 94 2.811 -7.802 7.479 1.00 1.53 H new ATOM 0 HA SER A 94 2.415 -9.995 9.342 1.00 1.64 H new ATOM 0 HB2 SER A 94 2.762 -6.976 9.733 1.00 1.72 H new ATOM 0 HB3 SER A 94 2.554 -8.108 11.054 1.00 1.72 H new ATOM 0 HG SER A 94 4.783 -7.635 10.646 1.00 2.08 H new ATOM 1441 N VAL A 95 -0.136 -8.520 8.279 1.00 1.51 N ATOM 1442 CA VAL A 95 -1.614 -8.546 8.315 1.00 1.57 C ATOM 1443 C VAL A 95 -2.194 -8.905 6.934 1.00 1.55 C ATOM 1444 O VAL A 95 -2.285 -8.075 6.032 1.00 1.35 O ATOM 1445 CB VAL A 95 -2.190 -7.234 8.907 1.00 1.58 C ATOM 1446 CG1 VAL A 95 -1.774 -5.934 8.201 1.00 1.45 C ATOM 1447 CG2 VAL A 95 -3.720 -7.287 8.999 1.00 1.85 C ATOM 0 H VAL A 95 0.235 -8.265 7.364 1.00 1.51 H new ATOM 0 HA VAL A 95 -1.930 -9.339 8.993 1.00 1.57 H new ATOM 0 HB VAL A 95 -1.739 -7.190 9.898 1.00 1.58 H new ATOM 0 HG11 VAL A 95 -2.237 -5.084 8.702 1.00 1.45 H new ATOM 0 HG12 VAL A 95 -0.690 -5.831 8.238 1.00 1.45 H new ATOM 0 HG13 VAL A 95 -2.100 -5.964 7.161 1.00 1.45 H new ATOM 0 HG21 VAL A 95 -4.092 -6.352 9.418 1.00 1.85 H new ATOM 0 HG22 VAL A 95 -4.140 -7.431 8.003 1.00 1.85 H new ATOM 0 HG23 VAL A 95 -4.017 -8.116 9.641 1.00 1.85 H new ATOM 1457 N LYS A 96 -2.590 -10.172 6.768 1.00 1.92 N ATOM 1458 CA LYS A 96 -2.913 -10.807 5.476 1.00 2.27 C ATOM 1459 C LYS A 96 -4.304 -11.460 5.464 1.00 2.69 C ATOM 1460 O LYS A 96 -5.054 -11.369 6.437 1.00 2.73 O ATOM 1461 CB LYS A 96 -1.773 -11.813 5.173 1.00 2.33 C ATOM 1462 CG LYS A 96 -1.099 -11.545 3.823 1.00 2.39 C ATOM 1463 CD LYS A 96 0.108 -12.470 3.605 1.00 2.82 C ATOM 1464 CE LYS A 96 0.855 -12.051 2.333 1.00 3.25 C ATOM 1465 NZ LYS A 96 1.989 -12.951 2.025 1.00 4.12 N ATOM 0 H LYS A 96 -2.700 -10.810 7.556 1.00 1.92 H new ATOM 0 HA LYS A 96 -2.970 -10.054 4.690 1.00 2.27 H new ATOM 0 HB2 LYS A 96 -1.026 -11.761 5.965 1.00 2.33 H new ATOM 0 HB3 LYS A 96 -2.175 -12.826 5.180 1.00 2.33 H new ATOM 0 HG2 LYS A 96 -1.821 -11.691 3.019 1.00 2.39 H new ATOM 0 HG3 LYS A 96 -0.775 -10.505 3.776 1.00 2.39 H new ATOM 0 HD2 LYS A 96 0.777 -12.420 4.464 1.00 2.82 H new ATOM 0 HD3 LYS A 96 -0.225 -13.504 3.519 1.00 2.82 H new ATOM 0 HE2 LYS A 96 0.161 -12.044 1.492 1.00 3.25 H new ATOM 0 HE3 LYS A 96 1.224 -11.032 2.450 1.00 3.25 H new ATOM 0 HZ1 LYS A 96 2.463 -12.628 1.157 1.00 4.12 H new ATOM 0 HZ2 LYS A 96 2.666 -12.939 2.814 1.00 4.12 H new ATOM 0 HZ3 LYS A 96 1.636 -13.919 1.886 1.00 4.12 H new ATOM 1794 N GLU B 118 -9.105 1.723 16.961 1.00 1.97 N ATOM 1795 CA GLU B 118 -8.040 2.166 17.866 1.00 1.77 C ATOM 1796 C GLU B 118 -6.733 2.556 17.152 1.00 1.41 C ATOM 1797 O GLU B 118 -5.837 3.130 17.774 1.00 1.47 O ATOM 1798 CB GLU B 118 -7.805 1.077 18.931 1.00 2.10 C ATOM 1799 CG GLU B 118 -7.038 -0.167 18.433 1.00 2.80 C ATOM 1800 CD GLU B 118 -6.996 -1.305 19.468 1.00 3.27 C ATOM 1801 OE1 GLU B 118 -7.049 -1.019 20.690 1.00 3.97 O ATOM 1802 OE2 GLU B 118 -6.882 -2.499 19.093 1.00 3.70 O ATOM 0 HA GLU B 118 -8.375 3.087 18.342 1.00 1.77 H new ATOM 0 HB2 GLU B 118 -7.254 1.516 19.763 1.00 2.10 H new ATOM 0 HB3 GLU B 118 -8.771 0.757 19.322 1.00 2.10 H new ATOM 0 HG2 GLU B 118 -7.505 -0.533 17.519 1.00 2.80 H new ATOM 0 HG3 GLU B 118 -6.018 0.121 18.177 1.00 2.80 H new ATOM 1809 N PHE B 119 -6.625 2.238 15.859 1.00 1.22 N ATOM 1810 CA PHE B 119 -5.443 2.487 15.017 1.00 1.00 C ATOM 1811 C PHE B 119 -5.326 3.955 14.553 1.00 0.92 C ATOM 1812 O PHE B 119 -6.316 4.693 14.500 1.00 1.01 O ATOM 1813 CB PHE B 119 -5.429 1.541 13.799 1.00 0.94 C ATOM 1814 CG PHE B 119 -5.467 0.032 14.019 1.00 1.04 C ATOM 1815 CD1 PHE B 119 -5.256 -0.556 15.282 1.00 1.99 C ATOM 1816 CD2 PHE B 119 -5.669 -0.802 12.902 1.00 1.99 C ATOM 1817 CE1 PHE B 119 -5.292 -1.954 15.433 1.00 2.05 C ATOM 1818 CE2 PHE B 119 -5.684 -2.202 13.047 1.00 2.14 C ATOM 1819 CZ PHE B 119 -5.509 -2.778 14.316 1.00 1.40 C ATOM 0 H PHE B 119 -7.382 1.784 15.348 1.00 1.22 H new ATOM 0 HA PHE B 119 -4.575 2.284 15.644 1.00 1.00 H new ATOM 0 HB2 PHE B 119 -6.283 1.801 13.173 1.00 0.94 H new ATOM 0 HB3 PHE B 119 -4.531 1.764 13.222 1.00 0.94 H new ATOM 0 HD1 PHE B 119 -5.065 0.071 16.140 1.00 1.99 H new ATOM 0 HD2 PHE B 119 -5.814 -0.363 11.926 1.00 1.99 H new ATOM 0 HE1 PHE B 119 -5.153 -2.395 16.409 1.00 2.05 H new ATOM 0 HE2 PHE B 119 -5.830 -2.833 12.183 1.00 2.14 H new ATOM 0 HZ PHE B 119 -5.541 -3.851 14.433 1.00 1.40 H new ATOM 1829 N SER B 120 -4.118 4.389 14.180 1.00 0.81 N ATOM 1830 CA SER B 120 -3.860 5.705 13.565 1.00 0.75 C ATOM 1831 C SER B 120 -4.486 5.820 12.164 1.00 0.67 C ATOM 1832 O SER B 120 -4.914 4.815 11.591 1.00 0.71 O ATOM 1833 CB SER B 120 -2.353 5.983 13.537 1.00 0.75 C ATOM 1834 OG SER B 120 -1.729 5.232 12.526 1.00 1.88 O ATOM 0 H SER B 120 -3.273 3.829 14.297 1.00 0.81 H new ATOM 0 HA SER B 120 -4.341 6.467 14.178 1.00 0.75 H new ATOM 0 HB2 SER B 120 -2.177 7.046 13.369 1.00 0.75 H new ATOM 0 HB3 SER B 120 -1.914 5.736 14.504 1.00 0.75 H new ATOM 0 HG SER B 120 -0.799 5.053 12.778 1.00 1.88 H new ATOM 1840 N ASP B 121 -4.573 7.027 11.590 1.00 0.68 N ATOM 1841 CA ASP B 121 -5.155 7.201 10.245 1.00 0.67 C ATOM 1842 C ASP B 121 -4.376 6.427 9.162 1.00 0.56 C ATOM 1843 O ASP B 121 -5.001 5.799 8.302 1.00 0.61 O ATOM 1844 CB ASP B 121 -5.303 8.694 9.886 1.00 0.83 C ATOM 1845 CG ASP B 121 -6.541 9.332 10.513 1.00 1.48 C ATOM 1846 OD1 ASP B 121 -7.664 9.053 10.031 1.00 2.50 O ATOM 1847 OD2 ASP B 121 -6.423 10.101 11.499 1.00 2.26 O ATOM 0 H ASP B 121 -4.253 7.891 12.027 1.00 0.68 H new ATOM 0 HA ASP B 121 -6.155 6.768 10.274 1.00 0.67 H new ATOM 0 HB2 ASP B 121 -4.415 9.233 10.217 1.00 0.83 H new ATOM 0 HB3 ASP B 121 -5.355 8.799 8.802 1.00 0.83 H new ATOM 1852 N VAL B 122 -3.041 6.386 9.254 1.00 0.51 N ATOM 1853 CA VAL B 122 -2.152 5.585 8.388 1.00 0.47 C ATOM 1854 C VAL B 122 -2.252 4.075 8.676 1.00 0.48 C ATOM 1855 O VAL B 122 -2.278 3.269 7.748 1.00 0.50 O ATOM 1856 CB VAL B 122 -0.703 6.109 8.494 1.00 0.52 C ATOM 1857 CG1 VAL B 122 -0.085 5.945 9.880 1.00 0.59 C ATOM 1858 CG2 VAL B 122 0.260 5.475 7.488 1.00 0.61 C ATOM 0 H VAL B 122 -2.529 6.924 9.953 1.00 0.51 H new ATOM 0 HA VAL B 122 -2.484 5.706 7.357 1.00 0.47 H new ATOM 0 HB VAL B 122 -0.821 7.169 8.270 1.00 0.52 H new ATOM 0 HG11 VAL B 122 0.932 6.336 9.873 1.00 0.59 H new ATOM 0 HG12 VAL B 122 -0.680 6.493 10.611 1.00 0.59 H new ATOM 0 HG13 VAL B 122 -0.066 4.888 10.147 1.00 0.59 H new ATOM 0 HG21 VAL B 122 1.257 5.894 7.625 1.00 0.61 H new ATOM 0 HG22 VAL B 122 0.294 4.397 7.647 1.00 0.61 H new ATOM 0 HG23 VAL B 122 -0.084 5.682 6.475 1.00 0.61 H new ATOM 1868 N GLU B 123 -2.369 3.679 9.947 1.00 0.53 N ATOM 1869 CA GLU B 123 -2.419 2.277 10.395 1.00 0.58 C ATOM 1870 C GLU B 123 -3.763 1.615 10.035 1.00 0.55 C ATOM 1871 O GLU B 123 -3.785 0.448 9.644 1.00 0.64 O ATOM 1872 CB GLU B 123 -2.054 2.269 11.891 1.00 0.72 C ATOM 1873 CG GLU B 123 -1.863 0.926 12.616 1.00 0.86 C ATOM 1874 CD GLU B 123 -1.458 1.130 14.098 1.00 1.25 C ATOM 1875 OE1 GLU B 123 -2.083 1.967 14.800 1.00 2.09 O ATOM 1876 OE2 GLU B 123 -0.528 0.439 14.583 1.00 2.05 O ATOM 0 H GLU B 123 -2.434 4.343 10.719 1.00 0.53 H new ATOM 0 HA GLU B 123 -1.694 1.653 9.872 1.00 0.58 H new ATOM 0 HB2 GLU B 123 -1.130 2.836 12.005 1.00 0.72 H new ATOM 0 HB3 GLU B 123 -2.833 2.818 12.420 1.00 0.72 H new ATOM 0 HG2 GLU B 123 -2.787 0.351 12.567 1.00 0.86 H new ATOM 0 HG3 GLU B 123 -1.097 0.342 12.106 1.00 0.86 H new ATOM 1883 N ARG B 124 -4.871 2.373 10.014 1.00 0.49 N ATOM 1884 CA ARG B 124 -6.153 1.966 9.468 1.00 0.48 C ATOM 1885 C ARG B 124 -6.211 2.082 7.935 1.00 0.44 C ATOM 1886 O ARG B 124 -6.962 1.329 7.315 1.00 0.47 O ATOM 1887 CB ARG B 124 -7.199 2.818 10.206 1.00 0.58 C ATOM 1888 CG ARG B 124 -8.593 2.481 9.716 1.00 2.14 C ATOM 1889 CD ARG B 124 -9.697 3.133 10.557 1.00 2.31 C ATOM 1890 NE ARG B 124 -11.043 2.780 10.062 1.00 4.18 N ATOM 1891 CZ ARG B 124 -11.714 1.669 10.313 1.00 5.90 C ATOM 1892 NH1 ARG B 124 -11.254 0.722 11.068 1.00 6.47 N ATOM 1893 NH2 ARG B 124 -12.892 1.464 9.809 1.00 7.53 N ATOM 0 H ARG B 124 -4.887 3.320 10.394 1.00 0.49 H new ATOM 0 HA ARG B 124 -6.346 0.906 9.632 1.00 0.48 H new ATOM 0 HB2 ARG B 124 -7.131 2.641 11.279 1.00 0.58 H new ATOM 0 HB3 ARG B 124 -6.995 3.877 10.044 1.00 0.58 H new ATOM 0 HG2 ARG B 124 -8.696 2.802 8.680 1.00 2.14 H new ATOM 0 HG3 ARG B 124 -8.725 1.399 9.729 1.00 2.14 H new ATOM 0 HD2 ARG B 124 -9.597 2.818 11.596 1.00 2.31 H new ATOM 0 HD3 ARG B 124 -9.576 4.216 10.540 1.00 2.31 H new ATOM 0 HE ARG B 124 -11.503 3.466 9.463 1.00 4.18 H new ATOM 0 HH11 ARG B 124 -10.335 0.815 11.500 1.00 6.47 H new ATOM 0 HH12 ARG B 124 -11.811 -0.117 11.231 1.00 6.47 H new ATOM 0 HH21 ARG B 124 -13.318 2.168 9.206 1.00 7.53 H new ATOM 0 HH22 ARG B 124 -13.392 0.599 10.016 1.00 7.53 H new ATOM 1907 N ALA B 125 -5.422 2.950 7.294 1.00 0.42 N ATOM 1908 CA ALA B 125 -5.412 3.074 5.829 1.00 0.41 C ATOM 1909 C ALA B 125 -4.926 1.780 5.149 1.00 0.38 C ATOM 1910 O ALA B 125 -5.617 1.228 4.305 1.00 0.40 O ATOM 1911 CB ALA B 125 -4.560 4.271 5.400 1.00 0.45 C ATOM 0 H ALA B 125 -4.777 3.582 7.769 1.00 0.42 H new ATOM 0 HA ALA B 125 -6.438 3.243 5.503 1.00 0.41 H new ATOM 0 HB1 ALA B 125 -4.563 4.349 4.313 1.00 0.45 H new ATOM 0 HB2 ALA B 125 -4.972 5.184 5.830 1.00 0.45 H new ATOM 0 HB3 ALA B 125 -3.537 4.134 5.751 1.00 0.45 H new ATOM 1917 N ILE B 126 -3.779 1.240 5.567 1.00 0.40 N ATOM 1918 CA ILE B 126 -3.184 -0.006 5.056 1.00 0.42 C ATOM 1919 C ILE B 126 -4.173 -1.161 5.272 1.00 0.42 C ATOM 1920 O ILE B 126 -4.441 -1.922 4.345 1.00 0.45 O ATOM 1921 CB ILE B 126 -1.770 -0.283 5.653 1.00 0.47 C ATOM 1922 CG1 ILE B 126 -0.827 0.944 5.610 1.00 0.49 C ATOM 1923 CG2 ILE B 126 -1.119 -1.455 4.894 1.00 0.60 C ATOM 1924 CD1 ILE B 126 0.250 0.891 6.704 1.00 0.60 C ATOM 0 H ILE B 126 -3.214 1.672 6.299 1.00 0.40 H new ATOM 0 HA ILE B 126 -3.010 0.097 3.985 1.00 0.42 H new ATOM 0 HB ILE B 126 -1.916 -0.527 6.705 1.00 0.47 H new ATOM 0 HG12 ILE B 126 -0.347 0.996 4.633 1.00 0.49 H new ATOM 0 HG13 ILE B 126 -1.414 1.855 5.725 1.00 0.49 H new ATOM 0 HG21 ILE B 126 -0.130 -1.652 5.308 1.00 0.60 H new ATOM 0 HG22 ILE B 126 -1.740 -2.345 4.997 1.00 0.60 H new ATOM 0 HG23 ILE B 126 -1.026 -1.198 3.839 1.00 0.60 H new ATOM 0 HD11 ILE B 126 0.886 1.773 6.632 1.00 0.60 H new ATOM 0 HD12 ILE B 126 -0.227 0.867 7.684 1.00 0.60 H new ATOM 0 HD13 ILE B 126 0.857 -0.005 6.574 1.00 0.60 H new ATOM 1936 N GLU B 127 -4.837 -1.221 6.433 1.00 0.41 N ATOM 1937 CA GLU B 127 -5.934 -2.135 6.704 1.00 0.46 C ATOM 1938 C GLU B 127 -7.157 -1.992 5.788 1.00 0.47 C ATOM 1939 O GLU B 127 -7.851 -2.952 5.466 1.00 0.61 O ATOM 1940 CB GLU B 127 -6.398 -1.824 8.118 1.00 0.66 C ATOM 1941 CG GLU B 127 -6.529 -3.073 8.948 1.00 1.20 C ATOM 1942 CD GLU B 127 -7.734 -3.963 8.599 1.00 2.16 C ATOM 1943 OE1 GLU B 127 -8.906 -3.524 8.711 1.00 3.03 O ATOM 1944 OE2 GLU B 127 -7.523 -5.140 8.229 1.00 3.21 O ATOM 0 H GLU B 127 -4.614 -0.617 7.224 1.00 0.41 H new ATOM 0 HA GLU B 127 -5.556 -3.145 6.544 1.00 0.46 H new ATOM 0 HB2 GLU B 127 -5.690 -1.144 8.592 1.00 0.66 H new ATOM 0 HB3 GLU B 127 -7.358 -1.309 8.081 1.00 0.66 H new ATOM 0 HG2 GLU B 127 -5.618 -3.661 8.838 1.00 1.20 H new ATOM 0 HG3 GLU B 127 -6.599 -2.788 9.998 1.00 1.20 H new ATOM 1951 N THR B 128 -7.447 -0.761 5.394 1.00 0.45 N ATOM 1952 CA THR B 128 -8.527 -0.433 4.446 1.00 0.54 C ATOM 1953 C THR B 128 -8.187 -0.947 3.047 1.00 0.58 C ATOM 1954 O THR B 128 -9.070 -1.450 2.355 1.00 0.68 O ATOM 1955 CB THR B 128 -8.856 1.070 4.453 1.00 0.59 C ATOM 1956 OG1 THR B 128 -9.194 1.459 5.769 1.00 0.63 O ATOM 1957 CG2 THR B 128 -10.058 1.422 3.579 1.00 0.70 C ATOM 0 H THR B 128 -6.936 0.058 5.723 1.00 0.45 H new ATOM 0 HA THR B 128 -9.433 -0.944 4.773 1.00 0.54 H new ATOM 0 HB THR B 128 -7.974 1.582 4.068 1.00 0.59 H new ATOM 0 HG1 THR B 128 -8.401 1.400 6.342 1.00 0.63 H new ATOM 0 HG21 THR B 128 -10.240 2.496 3.626 1.00 0.70 H new ATOM 0 HG22 THR B 128 -9.855 1.133 2.548 1.00 0.70 H new ATOM 0 HG23 THR B 128 -10.938 0.889 3.939 1.00 0.70 H new ATOM 1965 N LEU B 129 -6.907 -0.950 2.655 1.00 0.56 N ATOM 1966 CA LEU B 129 -6.474 -1.607 1.417 1.00 0.69 C ATOM 1967 C LEU B 129 -6.626 -3.130 1.553 1.00 0.67 C ATOM 1968 O LEU B 129 -7.169 -3.786 0.665 1.00 0.79 O ATOM 1969 CB LEU B 129 -5.015 -1.284 1.043 1.00 1.10 C ATOM 1970 CG LEU B 129 -4.466 0.159 1.101 1.00 0.55 C ATOM 1971 CD1 LEU B 129 -3.571 0.379 -0.123 1.00 1.06 C ATOM 1972 CD2 LEU B 129 -5.435 1.333 1.111 1.00 1.03 C ATOM 0 H LEU B 129 -6.153 -0.504 3.178 1.00 0.56 H new ATOM 0 HA LEU B 129 -7.112 -1.222 0.621 1.00 0.69 H new ATOM 0 HB2 LEU B 129 -4.381 -1.890 1.690 1.00 1.10 H new ATOM 0 HB3 LEU B 129 -4.863 -1.640 0.024 1.00 1.10 H new ATOM 0 HG LEU B 129 -3.985 0.182 2.079 1.00 0.55 H new ATOM 0 HD11 LEU B 129 -3.171 1.393 -0.104 1.00 1.06 H new ATOM 0 HD12 LEU B 129 -2.748 -0.336 -0.105 1.00 1.06 H new ATOM 0 HD13 LEU B 129 -4.156 0.237 -1.032 1.00 1.06 H new ATOM 0 HD21 LEU B 129 -4.875 2.267 1.154 1.00 1.03 H new ATOM 0 HD22 LEU B 129 -6.039 1.314 0.204 1.00 1.03 H new ATOM 0 HD23 LEU B 129 -6.086 1.260 1.982 1.00 1.03 H new ATOM 1984 N ILE B 130 -6.189 -3.674 2.696 1.00 0.65 N ATOM 1985 CA ILE B 130 -6.247 -5.100 3.038 1.00 0.87 C ATOM 1986 C ILE B 130 -7.683 -5.615 2.954 1.00 0.76 C ATOM 1987 O ILE B 130 -7.953 -6.489 2.131 1.00 0.77 O ATOM 1988 CB ILE B 130 -5.567 -5.333 4.414 1.00 1.18 C ATOM 1989 CG1 ILE B 130 -4.015 -5.232 4.403 1.00 1.68 C ATOM 1990 CG2 ILE B 130 -5.985 -6.632 5.124 1.00 1.25 C ATOM 1991 CD1 ILE B 130 -3.314 -5.176 3.038 1.00 1.98 C ATOM 0 H ILE B 130 -5.769 -3.111 3.436 1.00 0.65 H new ATOM 0 HA ILE B 130 -5.686 -5.688 2.312 1.00 0.87 H new ATOM 0 HB ILE B 130 -5.952 -4.492 4.991 1.00 1.18 H new ATOM 0 HG12 ILE B 130 -3.733 -4.340 4.962 1.00 1.68 H new ATOM 0 HG13 ILE B 130 -3.619 -6.089 4.949 1.00 1.68 H new ATOM 0 HG21 ILE B 130 -5.461 -6.711 6.076 1.00 1.25 H new ATOM 0 HG22 ILE B 130 -7.060 -6.620 5.302 1.00 1.25 H new ATOM 0 HG23 ILE B 130 -5.731 -7.487 4.498 1.00 1.25 H new ATOM 0 HD11 ILE B 130 -2.236 -5.107 3.185 1.00 1.98 H new ATOM 0 HD12 ILE B 130 -3.546 -6.078 2.473 1.00 1.98 H new ATOM 0 HD13 ILE B 130 -3.661 -4.303 2.486 1.00 1.98 H new ATOM 2003 N LYS B 131 -8.641 -5.030 3.683 1.00 0.72 N ATOM 2004 CA LYS B 131 -10.053 -5.454 3.626 1.00 0.72 C ATOM 2005 C LYS B 131 -10.659 -5.385 2.225 1.00 0.68 C ATOM 2006 O LYS B 131 -11.584 -6.143 1.940 1.00 0.87 O ATOM 2007 CB LYS B 131 -10.904 -4.646 4.619 1.00 0.80 C ATOM 2008 CG LYS B 131 -10.663 -5.019 6.089 1.00 0.88 C ATOM 2009 CD LYS B 131 -10.906 -6.508 6.388 1.00 1.04 C ATOM 2010 CE LYS B 131 -11.127 -6.750 7.880 1.00 1.57 C ATOM 2011 NZ LYS B 131 -9.950 -6.377 8.695 1.00 2.21 N ATOM 0 H LYS B 131 -8.466 -4.256 4.324 1.00 0.72 H new ATOM 0 HA LYS B 131 -10.061 -6.506 3.911 1.00 0.72 H new ATOM 0 HB2 LYS B 131 -10.694 -3.585 4.484 1.00 0.80 H new ATOM 0 HB3 LYS B 131 -11.958 -4.794 4.384 1.00 0.80 H new ATOM 0 HG2 LYS B 131 -9.638 -4.765 6.358 1.00 0.88 H new ATOM 0 HG3 LYS B 131 -11.317 -4.418 6.721 1.00 0.88 H new ATOM 0 HD2 LYS B 131 -11.775 -6.855 5.829 1.00 1.04 H new ATOM 0 HD3 LYS B 131 -10.052 -7.093 6.046 1.00 1.04 H new ATOM 0 HE2 LYS B 131 -11.992 -6.177 8.213 1.00 1.57 H new ATOM 0 HE3 LYS B 131 -11.359 -7.802 8.044 1.00 1.57 H new ATOM 0 HZ1 LYS B 131 -9.616 -7.208 9.223 1.00 2.21 H new ATOM 0 HZ2 LYS B 131 -9.191 -6.035 8.072 1.00 2.21 H new ATOM 0 HZ3 LYS B 131 -10.215 -5.625 9.363 1.00 2.21 H new ATOM 2025 N ASN B 132 -10.108 -4.576 1.322 1.00 0.53 N ATOM 2026 CA ASN B 132 -10.536 -4.543 -0.073 1.00 0.51 C ATOM 2027 C ASN B 132 -10.008 -5.692 -0.950 1.00 0.52 C ATOM 2028 O ASN B 132 -10.627 -5.970 -1.973 1.00 0.58 O ATOM 2029 CB ASN B 132 -10.361 -3.124 -0.644 1.00 0.56 C ATOM 2030 CG ASN B 132 -11.524 -2.233 -0.250 1.00 0.62 C ATOM 2031 OD1 ASN B 132 -12.571 -2.245 -0.883 1.00 0.96 O ATOM 2032 ND2 ASN B 132 -11.394 -1.469 0.803 1.00 0.57 N ATOM 0 H ASN B 132 -9.353 -3.926 1.538 1.00 0.53 H new ATOM 0 HA ASN B 132 -11.604 -4.760 -0.094 1.00 0.51 H new ATOM 0 HB2 ASN B 132 -9.428 -2.694 -0.279 1.00 0.56 H new ATOM 0 HB3 ASN B 132 -10.286 -3.172 -1.730 1.00 0.56 H new ATOM 0 HD21 ASN B 132 -12.169 -0.877 1.102 1.00 0.57 H new ATOM 0 HD22 ASN B 132 -10.518 -1.465 1.325 1.00 0.57 H new ATOM 2039 N PHE B 133 -8.964 -6.423 -0.543 1.00 0.59 N ATOM 2040 CA PHE B 133 -8.746 -7.793 -1.039 1.00 0.77 C ATOM 2041 C PHE B 133 -9.810 -8.753 -0.469 1.00 0.90 C ATOM 2042 O PHE B 133 -10.443 -9.498 -1.216 1.00 1.03 O ATOM 2043 CB PHE B 133 -7.320 -8.267 -0.690 1.00 0.89 C ATOM 2044 CG PHE B 133 -6.820 -9.474 -1.478 1.00 0.73 C ATOM 2045 CD1 PHE B 133 -7.349 -10.767 -1.269 1.00 2.03 C ATOM 2046 CD2 PHE B 133 -5.789 -9.304 -2.421 1.00 1.65 C ATOM 2047 CE1 PHE B 133 -6.869 -11.864 -2.012 1.00 1.96 C ATOM 2048 CE2 PHE B 133 -5.308 -10.400 -3.161 1.00 1.75 C ATOM 2049 CZ PHE B 133 -5.850 -11.676 -2.964 1.00 0.76 C ATOM 0 H PHE B 133 -8.262 -6.096 0.121 1.00 0.59 H new ATOM 0 HA PHE B 133 -8.847 -7.793 -2.124 1.00 0.77 H new ATOM 0 HB2 PHE B 133 -6.630 -7.438 -0.851 1.00 0.89 H new ATOM 0 HB3 PHE B 133 -7.286 -8.508 0.372 1.00 0.89 H new ATOM 0 HD1 PHE B 133 -8.127 -10.916 -0.535 1.00 2.03 H new ATOM 0 HD2 PHE B 133 -5.363 -8.324 -2.578 1.00 1.65 H new ATOM 0 HE1 PHE B 133 -7.283 -12.848 -1.851 1.00 1.96 H new ATOM 0 HE2 PHE B 133 -4.518 -10.257 -3.883 1.00 1.75 H new ATOM 0 HZ PHE B 133 -5.487 -12.514 -3.541 1.00 0.76 H new ATOM 2059 N HIS B 134 -10.044 -8.707 0.852 1.00 0.97 N ATOM 2060 CA HIS B 134 -10.925 -9.651 1.564 1.00 1.24 C ATOM 2061 C HIS B 134 -12.363 -9.635 1.017 1.00 1.00 C ATOM 2062 O HIS B 134 -12.927 -10.688 0.727 1.00 1.01 O ATOM 2063 CB HIS B 134 -10.960 -9.345 3.076 1.00 1.61 C ATOM 2064 CG HIS B 134 -9.687 -9.586 3.856 1.00 1.92 C ATOM 2065 ND1 HIS B 134 -9.614 -10.203 5.085 1.00 3.22 N ATOM 2066 CD2 HIS B 134 -8.414 -9.197 3.541 1.00 1.14 C ATOM 2067 CE1 HIS B 134 -8.332 -10.206 5.486 1.00 3.14 C ATOM 2068 NE2 HIS B 134 -7.558 -9.609 4.567 1.00 1.86 N ATOM 0 H HIS B 134 -9.624 -8.007 1.463 1.00 0.97 H new ATOM 0 HA HIS B 134 -10.505 -10.643 1.399 1.00 1.24 H new ATOM 0 HB2 HIS B 134 -11.242 -8.300 3.203 1.00 1.61 H new ATOM 0 HB3 HIS B 134 -11.751 -9.946 3.525 1.00 1.61 H new ATOM 0 HD2 HIS B 134 -8.120 -8.662 2.650 1.00 1.14 H new ATOM 0 HE1 HIS B 134 -7.976 -10.628 6.414 1.00 3.14 H new ATOM 0 HE2 HIS B 134 -6.547 -9.481 4.608 1.00 1.86 H new ATOM 2076 N GLN B 135 -12.940 -8.448 0.827 1.00 0.88 N ATOM 2077 CA GLN B 135 -14.324 -8.263 0.377 1.00 0.87 C ATOM 2078 C GLN B 135 -14.530 -8.542 -1.132 1.00 0.81 C ATOM 2079 O GLN B 135 -15.677 -8.600 -1.581 1.00 1.01 O ATOM 2080 CB GLN B 135 -14.770 -6.838 0.764 1.00 1.06 C ATOM 2081 CG GLN B 135 -14.844 -6.576 2.288 1.00 1.63 C ATOM 2082 CD GLN B 135 -16.076 -7.186 2.952 1.00 2.50 C ATOM 2083 OE1 GLN B 135 -15.998 -8.112 3.756 1.00 3.89 O ATOM 2084 NE2 GLN B 135 -17.251 -6.687 2.649 1.00 2.71 N ATOM 0 H GLN B 135 -12.449 -7.568 0.985 1.00 0.88 H new ATOM 0 HA GLN B 135 -14.949 -9.003 0.877 1.00 0.87 H new ATOM 0 HB2 GLN B 135 -14.079 -6.122 0.319 1.00 1.06 H new ATOM 0 HB3 GLN B 135 -15.751 -6.648 0.328 1.00 1.06 H new ATOM 0 HG2 GLN B 135 -13.949 -6.979 2.762 1.00 1.63 H new ATOM 0 HG3 GLN B 135 -14.841 -5.500 2.464 1.00 1.63 H new ATOM 0 HE21 GLN B 135 -17.322 -5.918 1.982 1.00 2.71 H new ATOM 0 HE22 GLN B 135 -18.093 -7.068 3.080 1.00 2.71 H new ATOM 2093 N TYR B 136 -13.456 -8.726 -1.919 1.00 0.73 N ATOM 2094 CA TYR B 136 -13.527 -8.917 -3.378 1.00 0.71 C ATOM 2095 C TYR B 136 -13.041 -10.259 -3.933 1.00 0.74 C ATOM 2096 O TYR B 136 -13.308 -10.516 -5.104 1.00 0.85 O ATOM 2097 CB TYR B 136 -12.891 -7.728 -4.116 1.00 0.73 C ATOM 2098 CG TYR B 136 -13.932 -6.752 -4.625 1.00 0.60 C ATOM 2099 CD1 TYR B 136 -14.649 -7.055 -5.800 1.00 1.85 C ATOM 2100 CD2 TYR B 136 -14.219 -5.580 -3.904 1.00 1.95 C ATOM 2101 CE1 TYR B 136 -15.646 -6.177 -6.267 1.00 2.03 C ATOM 2102 CE2 TYR B 136 -15.222 -4.702 -4.363 1.00 1.81 C ATOM 2103 CZ TYR B 136 -15.937 -5.000 -5.545 1.00 0.74 C ATOM 2104 OH TYR B 136 -16.915 -4.161 -5.976 1.00 0.91 O ATOM 0 H TYR B 136 -12.503 -8.747 -1.556 1.00 0.73 H new ATOM 0 HA TYR B 136 -14.597 -8.954 -3.581 1.00 0.71 H new ATOM 0 HB2 TYR B 136 -12.206 -7.210 -3.445 1.00 0.73 H new ATOM 0 HB3 TYR B 136 -12.299 -8.096 -4.954 1.00 0.73 H new ATOM 0 HD1 TYR B 136 -14.433 -7.963 -6.344 1.00 1.85 H new ATOM 0 HD2 TYR B 136 -13.673 -5.353 -3.001 1.00 1.95 H new ATOM 0 HE1 TYR B 136 -16.186 -6.404 -7.174 1.00 2.03 H new ATOM 0 HE2 TYR B 136 -15.444 -3.801 -3.811 1.00 1.81 H new ATOM 0 HH TYR B 136 -16.986 -3.400 -5.363 1.00 0.91 H new ATOM 2114 N SER B 137 -12.427 -11.152 -3.148 1.00 0.83 N ATOM 2115 CA SER B 137 -11.998 -12.495 -3.601 1.00 0.92 C ATOM 2116 C SER B 137 -13.140 -13.540 -3.667 1.00 0.98 C ATOM 2117 O SER B 137 -12.970 -14.724 -3.350 1.00 1.22 O ATOM 2118 CB SER B 137 -10.812 -12.961 -2.751 1.00 1.09 C ATOM 2119 OG SER B 137 -11.163 -13.088 -1.380 1.00 2.23 O ATOM 0 H SER B 137 -12.208 -10.968 -2.169 1.00 0.83 H new ATOM 0 HA SER B 137 -11.678 -12.404 -4.639 1.00 0.92 H new ATOM 0 HB2 SER B 137 -10.452 -13.920 -3.124 1.00 1.09 H new ATOM 0 HB3 SER B 137 -9.991 -12.251 -2.852 1.00 1.09 H new ATOM 0 HG SER B 137 -10.559 -13.726 -0.945 1.00 2.23 H new ATOM 2125 N VAL B 138 -14.349 -13.105 -4.026 1.00 1.26 N ATOM 2126 CA VAL B 138 -15.614 -13.827 -3.806 1.00 1.59 C ATOM 2127 C VAL B 138 -15.856 -14.976 -4.797 1.00 1.84 C ATOM 2128 O VAL B 138 -16.531 -15.936 -4.421 1.00 2.17 O ATOM 2129 CB VAL B 138 -16.795 -12.832 -3.734 1.00 1.94 C ATOM 2130 CG1 VAL B 138 -18.146 -13.518 -3.507 1.00 2.63 C ATOM 2131 CG2 VAL B 138 -16.582 -11.839 -2.581 1.00 3.39 C ATOM 0 H VAL B 138 -14.485 -12.209 -4.495 1.00 1.26 H new ATOM 0 HA VAL B 138 -15.533 -14.326 -2.840 1.00 1.59 H new ATOM 0 HB VAL B 138 -16.819 -12.327 -4.700 1.00 1.94 H new ATOM 0 HG11 VAL B 138 -18.934 -12.766 -3.466 1.00 2.63 H new ATOM 0 HG12 VAL B 138 -18.346 -14.208 -4.327 1.00 2.63 H new ATOM 0 HG13 VAL B 138 -18.121 -14.069 -2.567 1.00 2.63 H new ATOM 0 HG21 VAL B 138 -17.420 -11.143 -2.540 1.00 3.39 H new ATOM 0 HG22 VAL B 138 -16.517 -12.384 -1.639 1.00 3.39 H new ATOM 0 HG23 VAL B 138 -15.658 -11.285 -2.744 1.00 3.39 H new ATOM 2141 N GLU B 139 -15.223 -14.999 -5.978 1.00 1.73 N ATOM 2142 CA GLU B 139 -15.461 -15.994 -7.055 1.00 2.20 C ATOM 2143 C GLU B 139 -15.184 -17.469 -6.675 1.00 3.14 C ATOM 2144 O GLU B 139 -15.547 -18.392 -7.411 1.00 3.70 O ATOM 2145 CB GLU B 139 -14.550 -15.656 -8.247 1.00 1.60 C ATOM 2146 CG GLU B 139 -14.906 -14.360 -8.990 1.00 3.27 C ATOM 2147 CD GLU B 139 -15.731 -14.622 -10.246 1.00 3.50 C ATOM 2148 OE1 GLU B 139 -15.150 -15.140 -11.232 1.00 3.34 O ATOM 2149 OE2 GLU B 139 -16.931 -14.253 -10.286 1.00 4.72 O ATOM 0 H GLU B 139 -14.511 -14.312 -6.226 1.00 1.73 H new ATOM 0 HA GLU B 139 -16.525 -15.922 -7.278 1.00 2.20 H new ATOM 0 HB2 GLU B 139 -13.523 -15.582 -7.890 1.00 1.60 H new ATOM 0 HB3 GLU B 139 -14.582 -16.484 -8.956 1.00 1.60 H new ATOM 0 HG2 GLU B 139 -15.463 -13.702 -8.323 1.00 3.27 H new ATOM 0 HG3 GLU B 139 -13.990 -13.836 -9.262 1.00 3.27 H new ATOM 2156 N GLY B 140 -14.518 -17.694 -5.542 1.00 3.75 N ATOM 2157 CA GLY B 140 -14.066 -18.992 -5.034 1.00 4.83 C ATOM 2158 C GLY B 140 -12.547 -19.060 -4.876 1.00 3.16 C ATOM 2159 O GLY B 140 -12.051 -19.914 -4.143 1.00 3.67 O ATOM 0 H GLY B 140 -14.264 -16.930 -4.916 1.00 3.75 H new ATOM 0 HA2 GLY B 140 -14.538 -19.186 -4.071 1.00 4.83 H new ATOM 0 HA3 GLY B 140 -14.393 -19.779 -5.714 1.00 4.83 H new ATOM 2163 N GLY B 141 -11.808 -18.129 -5.487 1.00 2.37 N ATOM 2164 CA GLY B 141 -10.371 -17.953 -5.275 1.00 2.70 C ATOM 2165 C GLY B 141 -10.012 -17.703 -3.810 1.00 2.33 C ATOM 2166 O GLY B 141 -9.104 -18.355 -3.292 1.00 2.83 O ATOM 0 H GLY B 141 -12.200 -17.465 -6.155 1.00 2.37 H new ATOM 0 HA2 GLY B 141 -9.846 -18.841 -5.626 1.00 2.70 H new ATOM 0 HA3 GLY B 141 -10.020 -17.116 -5.878 1.00 2.70 H new ATOM 2170 N LYS B 142 -10.789 -16.834 -3.141 1.00 2.08 N ATOM 2171 CA LYS B 142 -10.831 -16.510 -1.697 1.00 2.01 C ATOM 2172 C LYS B 142 -9.505 -16.079 -1.061 1.00 1.81 C ATOM 2173 O LYS B 142 -9.364 -14.938 -0.628 1.00 2.05 O ATOM 2174 CB LYS B 142 -11.560 -17.624 -0.923 1.00 2.83 C ATOM 2175 CG LYS B 142 -12.259 -17.038 0.317 1.00 2.36 C ATOM 2176 CD LYS B 142 -12.946 -18.103 1.180 1.00 3.39 C ATOM 2177 CE LYS B 142 -13.990 -18.969 0.454 1.00 4.12 C ATOM 2178 NZ LYS B 142 -15.105 -18.166 -0.097 1.00 4.27 N ATOM 0 H LYS B 142 -11.478 -16.280 -3.649 1.00 2.08 H new ATOM 0 HA LYS B 142 -11.414 -15.593 -1.617 1.00 2.01 H new ATOM 0 HB2 LYS B 142 -12.293 -18.106 -1.569 1.00 2.83 H new ATOM 0 HB3 LYS B 142 -10.848 -18.392 -0.620 1.00 2.83 H new ATOM 0 HG2 LYS B 142 -11.525 -16.506 0.923 1.00 2.36 H new ATOM 0 HG3 LYS B 142 -13.000 -16.305 -0.003 1.00 2.36 H new ATOM 0 HD2 LYS B 142 -12.181 -18.759 1.595 1.00 3.39 H new ATOM 0 HD3 LYS B 142 -13.431 -17.607 2.021 1.00 3.39 H new ATOM 0 HE2 LYS B 142 -13.505 -19.516 -0.355 1.00 4.12 H new ATOM 0 HE3 LYS B 142 -14.388 -19.711 1.147 1.00 4.12 H new ATOM 0 HZ1 LYS B 142 -15.781 -18.794 -0.576 1.00 4.27 H new ATOM 0 HZ2 LYS B 142 -15.586 -17.664 0.676 1.00 4.27 H new ATOM 0 HZ3 LYS B 142 -14.731 -17.475 -0.779 1.00 4.27 H new ATOM 2192 N GLU B 143 -8.528 -16.973 -1.042 1.00 1.72 N ATOM 2193 CA GLU B 143 -7.170 -16.751 -0.546 1.00 1.82 C ATOM 2194 C GLU B 143 -6.255 -16.092 -1.600 1.00 1.54 C ATOM 2195 O GLU B 143 -5.196 -15.580 -1.236 1.00 1.72 O ATOM 2196 CB GLU B 143 -6.602 -18.091 -0.038 1.00 2.14 C ATOM 2197 CG GLU B 143 -7.457 -18.685 1.097 1.00 3.48 C ATOM 2198 CD GLU B 143 -6.925 -20.035 1.585 1.00 3.92 C ATOM 2199 OE1 GLU B 143 -7.159 -21.062 0.900 1.00 4.44 O ATOM 2200 OE2 GLU B 143 -6.305 -20.071 2.678 1.00 4.51 O ATOM 0 H GLU B 143 -8.664 -17.923 -1.389 1.00 1.72 H new ATOM 0 HA GLU B 143 -7.209 -16.042 0.281 1.00 1.82 H new ATOM 0 HB2 GLU B 143 -6.552 -18.800 -0.864 1.00 2.14 H new ATOM 0 HB3 GLU B 143 -5.582 -17.942 0.316 1.00 2.14 H new ATOM 0 HG2 GLU B 143 -7.484 -17.985 1.932 1.00 3.48 H new ATOM 0 HG3 GLU B 143 -8.483 -18.806 0.750 1.00 3.48 H new ATOM 2207 N THR B 144 -6.665 -16.074 -2.877 1.00 1.25 N ATOM 2208 CA THR B 144 -5.988 -15.420 -4.022 1.00 1.08 C ATOM 2209 C THR B 144 -6.998 -14.790 -5.006 1.00 0.99 C ATOM 2210 O THR B 144 -8.164 -15.188 -5.039 1.00 1.50 O ATOM 2211 CB THR B 144 -5.072 -16.393 -4.785 1.00 1.22 C ATOM 2212 OG1 THR B 144 -5.769 -17.574 -5.110 1.00 1.64 O ATOM 2213 CG2 THR B 144 -3.847 -16.816 -3.979 1.00 1.67 C ATOM 0 H THR B 144 -7.526 -16.540 -3.161 1.00 1.25 H new ATOM 0 HA THR B 144 -5.375 -14.628 -3.593 1.00 1.08 H new ATOM 0 HB THR B 144 -4.750 -15.852 -5.675 1.00 1.22 H new ATOM 0 HG1 THR B 144 -5.174 -18.182 -5.596 1.00 1.64 H new ATOM 0 HG21 THR B 144 -3.241 -17.502 -4.571 1.00 1.67 H new ATOM 0 HG22 THR B 144 -3.256 -15.936 -3.726 1.00 1.67 H new ATOM 0 HG23 THR B 144 -4.168 -17.313 -3.064 1.00 1.67 H new ATOM 2221 N LEU B 145 -6.553 -13.827 -5.823 1.00 0.97 N ATOM 2222 CA LEU B 145 -7.369 -12.966 -6.714 1.00 0.84 C ATOM 2223 C LEU B 145 -7.433 -13.536 -8.158 1.00 0.87 C ATOM 2224 O LEU B 145 -6.458 -14.133 -8.622 1.00 1.15 O ATOM 2225 CB LEU B 145 -6.716 -11.553 -6.697 1.00 0.99 C ATOM 2226 CG LEU B 145 -7.530 -10.253 -6.595 1.00 0.68 C ATOM 2227 CD1 LEU B 145 -8.321 -9.986 -7.872 1.00 1.00 C ATOM 2228 CD2 LEU B 145 -8.500 -10.228 -5.410 1.00 0.79 C ATOM 0 H LEU B 145 -5.559 -13.609 -5.890 1.00 0.97 H new ATOM 0 HA LEU B 145 -8.399 -12.922 -6.361 1.00 0.84 H new ATOM 0 HB2 LEU B 145 -6.017 -11.546 -5.861 1.00 0.99 H new ATOM 0 HB3 LEU B 145 -6.123 -11.476 -7.609 1.00 0.99 H new ATOM 0 HG LEU B 145 -6.787 -9.471 -6.440 1.00 0.68 H new ATOM 0 HD11 LEU B 145 -8.884 -9.059 -7.764 1.00 1.00 H new ATOM 0 HD12 LEU B 145 -7.634 -9.897 -8.714 1.00 1.00 H new ATOM 0 HD13 LEU B 145 -9.010 -10.811 -8.052 1.00 1.00 H new ATOM 0 HD21 LEU B 145 -9.040 -9.281 -5.402 1.00 0.79 H new ATOM 0 HD22 LEU B 145 -9.210 -11.050 -5.504 1.00 0.79 H new ATOM 0 HD23 LEU B 145 -7.941 -10.335 -4.480 1.00 0.79 H new ATOM 2240 N THR B 146 -8.524 -13.309 -8.904 1.00 0.77 N ATOM 2241 CA THR B 146 -8.669 -13.723 -10.324 1.00 0.77 C ATOM 2242 C THR B 146 -9.017 -12.578 -11.299 1.00 0.71 C ATOM 2243 O THR B 146 -9.596 -11.576 -10.880 1.00 0.67 O ATOM 2244 CB THR B 146 -9.691 -14.860 -10.486 1.00 0.91 C ATOM 2245 OG1 THR B 146 -10.995 -14.481 -10.104 1.00 1.24 O ATOM 2246 CG2 THR B 146 -9.313 -16.096 -9.684 1.00 1.21 C ATOM 0 H THR B 146 -9.346 -12.827 -8.541 1.00 0.77 H new ATOM 0 HA THR B 146 -7.675 -14.075 -10.598 1.00 0.77 H new ATOM 0 HB THR B 146 -9.678 -15.091 -11.551 1.00 0.91 H new ATOM 0 HG1 THR B 146 -10.965 -14.041 -9.229 1.00 1.24 H new ATOM 0 HG21 THR B 146 -10.066 -16.870 -9.832 1.00 1.21 H new ATOM 0 HG22 THR B 146 -8.343 -16.464 -10.019 1.00 1.21 H new ATOM 0 HG23 THR B 146 -9.258 -15.840 -8.626 1.00 1.21 H new ATOM 2254 N PRO B 147 -8.701 -12.683 -12.612 1.00 0.78 N ATOM 2255 CA PRO B 147 -9.001 -11.657 -13.626 1.00 0.85 C ATOM 2256 C PRO B 147 -10.456 -11.173 -13.695 1.00 0.89 C ATOM 2257 O PRO B 147 -10.689 -9.984 -13.907 1.00 0.92 O ATOM 2258 CB PRO B 147 -8.612 -12.302 -14.957 1.00 1.04 C ATOM 2259 CG PRO B 147 -7.426 -13.176 -14.571 1.00 1.00 C ATOM 2260 CD PRO B 147 -7.906 -13.738 -13.236 1.00 0.87 C ATOM 0 HA PRO B 147 -8.449 -10.753 -13.370 1.00 0.85 H new ATOM 0 HB2 PRO B 147 -9.429 -12.890 -15.376 1.00 1.04 H new ATOM 0 HB3 PRO B 147 -8.340 -11.556 -15.704 1.00 1.04 H new ATOM 0 HG2 PRO B 147 -7.234 -13.960 -15.304 1.00 1.00 H new ATOM 0 HG3 PRO B 147 -6.505 -12.602 -14.470 1.00 1.00 H new ATOM 0 HD2 PRO B 147 -8.502 -14.638 -13.384 1.00 0.87 H new ATOM 0 HD3 PRO B 147 -7.062 -14.015 -12.604 1.00 0.87 H new ATOM 2268 N SER B 148 -11.432 -12.059 -13.491 1.00 0.97 N ATOM 2269 CA SER B 148 -12.861 -11.725 -13.527 1.00 1.12 C ATOM 2270 C SER B 148 -13.269 -10.757 -12.414 1.00 1.00 C ATOM 2271 O SER B 148 -13.993 -9.799 -12.687 1.00 1.06 O ATOM 2272 CB SER B 148 -13.707 -13.003 -13.455 1.00 1.36 C ATOM 2273 OG SER B 148 -13.244 -13.856 -12.422 1.00 2.77 O ATOM 0 H SER B 148 -11.252 -13.043 -13.293 1.00 0.97 H new ATOM 0 HA SER B 148 -13.045 -11.218 -14.474 1.00 1.12 H new ATOM 0 HB2 SER B 148 -14.751 -12.744 -13.278 1.00 1.36 H new ATOM 0 HB3 SER B 148 -13.666 -13.526 -14.410 1.00 1.36 H new ATOM 0 HG SER B 148 -13.955 -14.482 -12.172 1.00 2.77 H new ATOM 2279 N GLU B 149 -12.788 -10.952 -11.182 1.00 0.88 N ATOM 2280 CA GLU B 149 -13.056 -10.029 -10.067 1.00 0.80 C ATOM 2281 C GLU B 149 -12.079 -8.841 -10.015 1.00 0.69 C ATOM 2282 O GLU B 149 -12.445 -7.765 -9.548 1.00 0.69 O ATOM 2283 CB GLU B 149 -13.194 -10.793 -8.742 1.00 0.84 C ATOM 2284 CG GLU B 149 -11.893 -11.369 -8.165 1.00 0.70 C ATOM 2285 CD GLU B 149 -12.056 -12.741 -7.490 1.00 0.91 C ATOM 2286 OE1 GLU B 149 -13.102 -13.009 -6.847 1.00 1.91 O ATOM 2287 OE2 GLU B 149 -11.108 -13.547 -7.648 1.00 2.21 O ATOM 0 H GLU B 149 -12.205 -11.749 -10.927 1.00 0.88 H new ATOM 0 HA GLU B 149 -14.023 -9.560 -10.252 1.00 0.80 H new ATOM 0 HB2 GLU B 149 -13.632 -10.123 -8.002 1.00 0.84 H new ATOM 0 HB3 GLU B 149 -13.899 -11.612 -8.888 1.00 0.84 H new ATOM 0 HG2 GLU B 149 -11.160 -11.456 -8.967 1.00 0.70 H new ATOM 0 HG3 GLU B 149 -11.488 -10.665 -7.438 1.00 0.70 H new ATOM 2294 N LEU B 150 -10.888 -8.981 -10.610 1.00 0.67 N ATOM 2295 CA LEU B 150 -9.965 -7.885 -10.926 1.00 0.63 C ATOM 2296 C LEU B 150 -10.651 -6.859 -11.854 1.00 0.68 C ATOM 2297 O LEU B 150 -10.710 -5.675 -11.519 1.00 0.68 O ATOM 2298 CB LEU B 150 -8.698 -8.535 -11.528 1.00 0.74 C ATOM 2299 CG LEU B 150 -7.446 -7.714 -11.871 1.00 0.84 C ATOM 2300 CD1 LEU B 150 -7.727 -6.506 -12.745 1.00 2.05 C ATOM 2301 CD2 LEU B 150 -6.661 -7.241 -10.661 1.00 2.11 C ATOM 0 H LEU B 150 -10.528 -9.892 -10.894 1.00 0.67 H new ATOM 0 HA LEU B 150 -9.676 -7.313 -10.044 1.00 0.63 H new ATOM 0 HB2 LEU B 150 -8.383 -9.313 -10.832 1.00 0.74 H new ATOM 0 HB3 LEU B 150 -9.007 -9.035 -12.446 1.00 0.74 H new ATOM 0 HG LEU B 150 -6.842 -8.431 -12.427 1.00 0.84 H new ATOM 0 HD11 LEU B 150 -6.795 -5.977 -12.944 1.00 2.05 H new ATOM 0 HD12 LEU B 150 -8.167 -6.833 -13.687 1.00 2.05 H new ATOM 0 HD13 LEU B 150 -8.420 -5.839 -12.232 1.00 2.05 H new ATOM 0 HD21 LEU B 150 -5.793 -6.669 -10.991 1.00 2.11 H new ATOM 0 HD22 LEU B 150 -7.296 -6.610 -10.039 1.00 2.11 H new ATOM 0 HD23 LEU B 150 -6.329 -8.103 -10.083 1.00 2.11 H new ATOM 2313 N ARG B 151 -11.237 -7.278 -12.991 1.00 0.78 N ATOM 2314 CA ARG B 151 -11.969 -6.341 -13.871 1.00 0.86 C ATOM 2315 C ARG B 151 -13.325 -5.889 -13.331 1.00 0.99 C ATOM 2316 O ARG B 151 -13.849 -4.885 -13.807 1.00 1.33 O ATOM 2317 CB ARG B 151 -11.981 -6.746 -15.343 1.00 0.87 C ATOM 2318 CG ARG B 151 -12.832 -7.934 -15.796 1.00 1.98 C ATOM 2319 CD ARG B 151 -12.643 -8.025 -17.319 1.00 1.59 C ATOM 2320 NE ARG B 151 -13.447 -7.027 -18.061 1.00 1.96 N ATOM 2321 CZ ARG B 151 -13.217 -6.623 -19.303 1.00 2.47 C ATOM 2322 NH1 ARG B 151 -12.295 -7.163 -20.048 1.00 2.69 N ATOM 2323 NH2 ARG B 151 -13.894 -5.643 -19.830 1.00 3.30 N ATOM 0 H ARG B 151 -11.221 -8.243 -13.320 1.00 0.78 H new ATOM 0 HA ARG B 151 -11.366 -5.433 -13.847 1.00 0.86 H new ATOM 0 HB2 ARG B 151 -12.303 -5.877 -15.917 1.00 0.87 H new ATOM 0 HB3 ARG B 151 -10.951 -6.955 -15.632 1.00 0.87 H new ATOM 0 HG2 ARG B 151 -12.512 -8.854 -15.306 1.00 1.98 H new ATOM 0 HG3 ARG B 151 -13.881 -7.784 -15.540 1.00 1.98 H new ATOM 0 HD2 ARG B 151 -11.589 -7.885 -17.558 1.00 1.59 H new ATOM 0 HD3 ARG B 151 -12.916 -9.026 -17.655 1.00 1.59 H new ATOM 0 HE ARG B 151 -14.245 -6.616 -17.576 1.00 1.96 H new ATOM 0 HH11 ARG B 151 -11.722 -7.922 -19.680 1.00 2.69 H new ATOM 0 HH12 ARG B 151 -12.146 -6.826 -20.999 1.00 2.69 H new ATOM 0 HH21 ARG B 151 -14.616 -5.171 -19.286 1.00 3.30 H new ATOM 0 HH22 ARG B 151 -13.702 -5.347 -20.787 1.00 3.30 H new ATOM 2337 N ASP B 152 -13.876 -6.581 -12.335 1.00 0.86 N ATOM 2338 CA ASP B 152 -15.059 -6.138 -11.587 1.00 0.88 C ATOM 2339 C ASP B 152 -14.715 -4.998 -10.607 1.00 0.81 C ATOM 2340 O ASP B 152 -15.278 -3.903 -10.730 1.00 0.94 O ATOM 2341 CB ASP B 152 -15.708 -7.349 -10.892 1.00 0.93 C ATOM 2342 CG ASP B 152 -17.113 -7.115 -10.328 1.00 1.19 C ATOM 2343 OD1 ASP B 152 -17.707 -6.025 -10.499 1.00 1.71 O ATOM 2344 OD2 ASP B 152 -17.648 -8.054 -9.700 1.00 2.47 O ATOM 0 H ASP B 152 -13.510 -7.479 -12.018 1.00 0.86 H new ATOM 0 HA ASP B 152 -15.788 -5.719 -12.280 1.00 0.88 H new ATOM 0 HB2 ASP B 152 -15.755 -8.172 -11.605 1.00 0.93 H new ATOM 0 HB3 ASP B 152 -15.058 -7.669 -10.078 1.00 0.93 H new ATOM 2349 N LEU B 153 -13.751 -5.201 -9.689 1.00 0.72 N ATOM 2350 CA LEU B 153 -13.426 -4.204 -8.658 1.00 0.71 C ATOM 2351 C LEU B 153 -12.725 -2.962 -9.211 1.00 0.72 C ATOM 2352 O LEU B 153 -12.970 -1.870 -8.705 1.00 0.81 O ATOM 2353 CB LEU B 153 -12.705 -4.808 -7.421 1.00 0.72 C ATOM 2354 CG LEU B 153 -11.209 -4.519 -7.187 1.00 0.82 C ATOM 2355 CD1 LEU B 153 -10.831 -4.817 -5.736 1.00 1.07 C ATOM 2356 CD2 LEU B 153 -10.323 -5.392 -8.069 1.00 0.90 C ATOM 0 H LEU B 153 -13.185 -6.048 -9.643 1.00 0.72 H new ATOM 0 HA LEU B 153 -14.391 -3.854 -8.291 1.00 0.71 H new ATOM 0 HB2 LEU B 153 -13.243 -4.471 -6.535 1.00 0.72 H new ATOM 0 HB3 LEU B 153 -12.822 -5.890 -7.473 1.00 0.72 H new ATOM 0 HG LEU B 153 -11.052 -3.468 -7.428 1.00 0.82 H new ATOM 0 HD11 LEU B 153 -9.772 -4.608 -5.586 1.00 1.07 H new ATOM 0 HD12 LEU B 153 -11.423 -4.189 -5.070 1.00 1.07 H new ATOM 0 HD13 LEU B 153 -11.029 -5.866 -5.517 1.00 1.07 H new ATOM 0 HD21 LEU B 153 -9.276 -5.160 -7.876 1.00 0.90 H new ATOM 0 HD22 LEU B 153 -10.509 -6.442 -7.845 1.00 0.90 H new ATOM 0 HD23 LEU B 153 -10.550 -5.199 -9.117 1.00 0.90 H new ATOM 2368 N VAL B 154 -11.875 -3.085 -10.238 1.00 0.69 N ATOM 2369 CA VAL B 154 -11.087 -1.937 -10.724 1.00 0.73 C ATOM 2370 C VAL B 154 -11.985 -0.846 -11.310 1.00 0.72 C ATOM 2371 O VAL B 154 -11.821 0.320 -10.961 1.00 0.78 O ATOM 2372 CB VAL B 154 -9.989 -2.387 -11.710 1.00 0.83 C ATOM 2373 CG1 VAL B 154 -9.364 -1.236 -12.507 1.00 0.94 C ATOM 2374 CG2 VAL B 154 -8.848 -3.060 -10.941 1.00 0.82 C ATOM 0 H VAL B 154 -11.714 -3.955 -10.746 1.00 0.69 H new ATOM 0 HA VAL B 154 -10.580 -1.495 -9.866 1.00 0.73 H new ATOM 0 HB VAL B 154 -10.484 -3.064 -12.407 1.00 0.83 H new ATOM 0 HG11 VAL B 154 -8.601 -1.630 -13.178 1.00 0.94 H new ATOM 0 HG12 VAL B 154 -10.137 -0.735 -13.090 1.00 0.94 H new ATOM 0 HG13 VAL B 154 -8.909 -0.523 -11.820 1.00 0.94 H new ATOM 0 HG21 VAL B 154 -8.075 -3.376 -11.641 1.00 0.82 H new ATOM 0 HG22 VAL B 154 -8.424 -2.354 -10.227 1.00 0.82 H new ATOM 0 HG23 VAL B 154 -9.232 -3.929 -10.407 1.00 0.82 H new ATOM 2384 N THR B 155 -12.979 -1.207 -12.128 1.00 0.72 N ATOM 2385 CA THR B 155 -13.910 -0.216 -12.706 1.00 0.84 C ATOM 2386 C THR B 155 -14.898 0.357 -11.681 1.00 0.81 C ATOM 2387 O THR B 155 -15.331 1.502 -11.815 1.00 0.94 O ATOM 2388 CB THR B 155 -14.624 -0.774 -13.950 1.00 0.98 C ATOM 2389 OG1 THR B 155 -15.384 0.229 -14.593 1.00 1.20 O ATOM 2390 CG2 THR B 155 -15.582 -1.923 -13.645 1.00 0.93 C ATOM 0 H THR B 155 -13.164 -2.170 -12.407 1.00 0.72 H new ATOM 0 HA THR B 155 -13.299 0.628 -13.027 1.00 0.84 H new ATOM 0 HB THR B 155 -13.818 -1.141 -14.585 1.00 0.98 H new ATOM 0 HG1 THR B 155 -15.826 -0.150 -15.381 1.00 1.20 H new ATOM 0 HG21 THR B 155 -16.048 -2.264 -14.570 1.00 0.93 H new ATOM 0 HG22 THR B 155 -15.030 -2.746 -13.192 1.00 0.93 H new ATOM 0 HG23 THR B 155 -16.353 -1.580 -12.955 1.00 0.93 H new ATOM 2398 N GLN B 156 -15.217 -0.395 -10.621 1.00 0.72 N ATOM 2399 CA GLN B 156 -16.055 0.091 -9.520 1.00 0.78 C ATOM 2400 C GLN B 156 -15.296 1.011 -8.556 1.00 0.78 C ATOM 2401 O GLN B 156 -15.860 2.020 -8.127 1.00 1.03 O ATOM 2402 CB GLN B 156 -16.659 -1.108 -8.766 1.00 0.83 C ATOM 2403 CG GLN B 156 -17.893 -1.669 -9.491 1.00 1.10 C ATOM 2404 CD GLN B 156 -19.134 -0.781 -9.386 1.00 1.52 C ATOM 2405 OE1 GLN B 156 -19.246 0.115 -8.556 1.00 1.98 O ATOM 2406 NE2 GLN B 156 -20.115 -0.979 -10.230 1.00 2.27 N ATOM 0 H GLN B 156 -14.901 -1.358 -10.503 1.00 0.72 H new ATOM 0 HA GLN B 156 -16.852 0.694 -9.955 1.00 0.78 H new ATOM 0 HB2 GLN B 156 -15.908 -1.891 -8.666 1.00 0.83 H new ATOM 0 HB3 GLN B 156 -16.937 -0.802 -7.757 1.00 0.83 H new ATOM 0 HG2 GLN B 156 -17.649 -1.812 -10.544 1.00 1.10 H new ATOM 0 HG3 GLN B 156 -18.127 -2.652 -9.082 1.00 1.10 H new ATOM 0 HE21 GLN B 156 -20.045 -1.718 -10.929 1.00 2.27 H new ATOM 0 HE22 GLN B 156 -20.950 -0.394 -10.188 1.00 2.27 H new ATOM 2415 N GLN B 157 -14.046 0.682 -8.211 1.00 0.61 N ATOM 2416 CA GLN B 157 -13.327 1.287 -7.084 1.00 0.63 C ATOM 2417 C GLN B 157 -12.118 2.163 -7.451 1.00 0.62 C ATOM 2418 O GLN B 157 -11.687 2.937 -6.602 1.00 0.73 O ATOM 2419 CB GLN B 157 -12.882 0.210 -6.085 1.00 0.71 C ATOM 2420 CG GLN B 157 -13.970 -0.745 -5.570 1.00 0.89 C ATOM 2421 CD GLN B 157 -13.792 -1.012 -4.082 1.00 0.92 C ATOM 2422 OE1 GLN B 157 -14.197 -0.229 -3.239 1.00 1.27 O ATOM 2423 NE2 GLN B 157 -13.132 -2.079 -3.697 1.00 1.75 N ATOM 0 H GLN B 157 -13.500 -0.019 -8.711 1.00 0.61 H new ATOM 0 HA GLN B 157 -14.057 1.965 -6.641 1.00 0.63 H new ATOM 0 HB2 GLN B 157 -12.100 -0.387 -6.554 1.00 0.71 H new ATOM 0 HB3 GLN B 157 -12.432 0.708 -5.226 1.00 0.71 H new ATOM 0 HG2 GLN B 157 -14.955 -0.314 -5.752 1.00 0.89 H new ATOM 0 HG3 GLN B 157 -13.926 -1.685 -6.121 1.00 0.89 H new ATOM 0 HE21 GLN B 157 -12.787 -2.743 -4.390 1.00 1.75 H new ATOM 0 HE22 GLN B 157 -12.964 -2.244 -2.705 1.00 1.75 H new ATOM 2432 N LEU B 158 -11.575 2.084 -8.675 1.00 0.60 N ATOM 2433 CA LEU B 158 -10.480 2.952 -9.150 1.00 0.63 C ATOM 2434 C LEU B 158 -10.884 3.811 -10.376 1.00 0.68 C ATOM 2435 O LEU B 158 -10.196 3.769 -11.405 1.00 0.75 O ATOM 2436 CB LEU B 158 -9.215 2.106 -9.421 1.00 0.65 C ATOM 2437 CG LEU B 158 -8.657 1.305 -8.229 1.00 0.60 C ATOM 2438 CD1 LEU B 158 -7.447 0.492 -8.693 1.00 0.68 C ATOM 2439 CD2 LEU B 158 -8.196 2.196 -7.072 1.00 0.61 C ATOM 0 H LEU B 158 -11.886 1.408 -9.373 1.00 0.60 H new ATOM 0 HA LEU B 158 -10.254 3.666 -8.358 1.00 0.63 H new ATOM 0 HB2 LEU B 158 -9.438 1.407 -10.227 1.00 0.65 H new ATOM 0 HB3 LEU B 158 -8.431 2.771 -9.783 1.00 0.65 H new ATOM 0 HG LEU B 158 -9.468 0.671 -7.872 1.00 0.60 H new ATOM 0 HD11 LEU B 158 -7.048 -0.077 -7.854 1.00 0.68 H new ATOM 0 HD12 LEU B 158 -7.751 -0.193 -9.484 1.00 0.68 H new ATOM 0 HD13 LEU B 158 -6.679 1.166 -9.072 1.00 0.68 H new ATOM 0 HD21 LEU B 158 -7.814 1.573 -6.263 1.00 0.61 H new ATOM 0 HD22 LEU B 158 -7.408 2.864 -7.419 1.00 0.61 H new ATOM 0 HD23 LEU B 158 -9.038 2.786 -6.709 1.00 0.61 H new ATOM 2451 N PRO B 159 -11.998 4.575 -10.338 1.00 0.72 N ATOM 2452 CA PRO B 159 -12.442 5.374 -11.482 1.00 0.82 C ATOM 2453 C PRO B 159 -11.532 6.576 -11.787 1.00 0.86 C ATOM 2454 O PRO B 159 -11.482 7.023 -12.937 1.00 0.95 O ATOM 2455 CB PRO B 159 -13.853 5.837 -11.114 1.00 0.96 C ATOM 2456 CG PRO B 159 -13.829 5.908 -9.590 1.00 0.92 C ATOM 2457 CD PRO B 159 -12.916 4.745 -9.219 1.00 0.75 C ATOM 0 HA PRO B 159 -12.412 4.778 -12.394 1.00 0.82 H new ATOM 0 HB2 PRO B 159 -14.083 6.806 -11.556 1.00 0.96 H new ATOM 0 HB3 PRO B 159 -14.609 5.137 -11.470 1.00 0.96 H new ATOM 0 HG2 PRO B 159 -13.437 6.861 -9.234 1.00 0.92 H new ATOM 0 HG3 PRO B 159 -14.825 5.794 -9.163 1.00 0.92 H new ATOM 0 HD2 PRO B 159 -12.372 4.956 -8.298 1.00 0.75 H new ATOM 0 HD3 PRO B 159 -13.493 3.836 -9.048 1.00 0.75 H new ATOM 2465 N HIS B 160 -10.843 7.127 -10.785 1.00 0.85 N ATOM 2466 CA HIS B 160 -9.868 8.211 -10.943 1.00 0.97 C ATOM 2467 C HIS B 160 -8.439 7.691 -11.177 1.00 1.00 C ATOM 2468 O HIS B 160 -7.666 8.317 -11.905 1.00 1.13 O ATOM 2469 CB HIS B 160 -9.976 9.170 -9.749 1.00 0.99 C ATOM 2470 CG HIS B 160 -11.397 9.509 -9.382 1.00 1.04 C ATOM 2471 ND1 HIS B 160 -12.091 8.944 -8.348 1.00 0.98 N ATOM 2472 CD2 HIS B 160 -12.252 10.367 -10.023 1.00 1.26 C ATOM 2473 CE1 HIS B 160 -13.324 9.464 -8.339 1.00 1.13 C ATOM 2474 NE2 HIS B 160 -13.490 10.325 -9.360 1.00 1.33 N ATOM 0 H HIS B 160 -10.950 6.825 -9.817 1.00 0.85 H new ATOM 0 HA HIS B 160 -10.107 8.769 -11.848 1.00 0.97 H new ATOM 0 HB2 HIS B 160 -9.483 8.722 -8.887 1.00 0.99 H new ATOM 0 HB3 HIS B 160 -9.439 10.090 -9.981 1.00 0.99 H new ATOM 0 HD1 HIS B 160 -11.731 8.247 -7.696 1.00 0.98 H new ATOM 0 HD2 HIS B 160 -12.015 10.970 -10.887 1.00 1.26 H new ATOM 0 HE1 HIS B 160 -14.084 9.225 -7.610 1.00 1.13 H new ATOM 2482 N LEU B 161 -8.079 6.544 -10.584 1.00 0.94 N ATOM 2483 CA LEU B 161 -6.731 5.960 -10.679 1.00 1.06 C ATOM 2484 C LEU B 161 -6.477 5.107 -11.938 1.00 1.13 C ATOM 2485 O LEU B 161 -5.315 4.935 -12.320 1.00 1.50 O ATOM 2486 CB LEU B 161 -6.420 5.166 -9.387 1.00 1.09 C ATOM 2487 CG LEU B 161 -5.312 5.757 -8.494 1.00 0.89 C ATOM 2488 CD1 LEU B 161 -3.967 5.867 -9.217 1.00 1.54 C ATOM 2489 CD2 LEU B 161 -5.676 7.132 -7.938 1.00 1.41 C ATOM 0 H LEU B 161 -8.721 5.989 -10.019 1.00 0.94 H new ATOM 0 HA LEU B 161 -6.042 6.798 -10.782 1.00 1.06 H new ATOM 0 HB2 LEU B 161 -7.335 5.091 -8.799 1.00 1.09 H new ATOM 0 HB3 LEU B 161 -6.135 4.151 -9.665 1.00 1.09 H new ATOM 0 HG LEU B 161 -5.217 5.051 -7.669 1.00 0.89 H new ATOM 0 HD11 LEU B 161 -3.224 6.289 -8.541 1.00 1.54 H new ATOM 0 HD12 LEU B 161 -3.644 4.877 -9.538 1.00 1.54 H new ATOM 0 HD13 LEU B 161 -4.074 6.514 -10.088 1.00 1.54 H new ATOM 0 HD21 LEU B 161 -4.860 7.501 -7.316 1.00 1.41 H new ATOM 0 HD22 LEU B 161 -5.846 7.825 -8.762 1.00 1.41 H new ATOM 0 HD23 LEU B 161 -6.582 7.053 -7.338 1.00 1.41 H new ATOM 2501 N MET B 162 -7.527 4.586 -12.586 1.00 0.95 N ATOM 2502 CA MET B 162 -7.446 3.760 -13.805 1.00 1.08 C ATOM 2503 C MET B 162 -8.475 4.222 -14.869 1.00 1.31 C ATOM 2504 O MET B 162 -9.485 3.544 -15.096 1.00 1.65 O ATOM 2505 CB MET B 162 -7.592 2.280 -13.403 1.00 1.23 C ATOM 2506 CG MET B 162 -7.435 1.275 -14.555 1.00 2.58 C ATOM 2507 SD MET B 162 -5.814 1.189 -15.364 1.00 3.01 S ATOM 2508 CE MET B 162 -6.016 2.360 -16.733 1.00 4.84 C ATOM 0 H MET B 162 -8.486 4.730 -12.270 1.00 0.95 H new ATOM 0 HA MET B 162 -6.475 3.883 -14.284 1.00 1.08 H new ATOM 0 HB2 MET B 162 -6.849 2.052 -12.638 1.00 1.23 H new ATOM 0 HB3 MET B 162 -8.572 2.138 -12.948 1.00 1.23 H new ATOM 0 HG2 MET B 162 -7.675 0.283 -14.173 1.00 2.58 H new ATOM 0 HG3 MET B 162 -8.180 1.513 -15.315 1.00 2.58 H new ATOM 0 HE1 MET B 162 -5.434 2.021 -17.590 1.00 4.84 H new ATOM 0 HE2 MET B 162 -7.069 2.419 -17.009 1.00 4.84 H new ATOM 0 HE3 MET B 162 -5.666 3.345 -16.424 1.00 4.84 H new ATOM 2518 N PRO B 163 -8.270 5.392 -15.505 1.00 1.66 N ATOM 2519 CA PRO B 163 -9.270 6.026 -16.368 1.00 2.16 C ATOM 2520 C PRO B 163 -9.512 5.327 -17.716 1.00 2.32 C ATOM 2521 O PRO B 163 -8.636 4.665 -18.287 1.00 2.34 O ATOM 2522 CB PRO B 163 -8.780 7.463 -16.576 1.00 2.76 C ATOM 2523 CG PRO B 163 -7.268 7.357 -16.399 1.00 2.71 C ATOM 2524 CD PRO B 163 -7.126 6.278 -15.329 1.00 2.00 C ATOM 0 HA PRO B 163 -10.243 5.968 -15.880 1.00 2.16 H new ATOM 0 HB2 PRO B 163 -9.042 7.837 -17.566 1.00 2.76 H new ATOM 0 HB3 PRO B 163 -9.222 8.146 -15.850 1.00 2.76 H new ATOM 0 HG2 PRO B 163 -6.771 7.074 -17.327 1.00 2.71 H new ATOM 0 HG3 PRO B 163 -6.831 8.303 -16.079 1.00 2.71 H new ATOM 0 HD2 PRO B 163 -6.189 5.734 -15.444 1.00 2.00 H new ATOM 0 HD3 PRO B 163 -7.120 6.716 -14.331 1.00 2.00 H new ATOM 2575 N LEU B 168 -8.784 -0.735 -18.783 1.00 1.79 N ATOM 2576 CA LEU B 168 -8.365 -1.539 -17.624 1.00 1.49 C ATOM 2577 C LEU B 168 -8.108 -3.026 -17.890 1.00 1.32 C ATOM 2578 O LEU B 168 -7.396 -3.646 -17.108 1.00 1.30 O ATOM 2579 CB LEU B 168 -9.295 -1.255 -16.425 1.00 1.36 C ATOM 2580 CG LEU B 168 -10.737 -1.801 -16.388 1.00 1.20 C ATOM 2581 CD1 LEU B 168 -11.544 -1.506 -17.651 1.00 1.69 C ATOM 2582 CD2 LEU B 168 -10.820 -3.297 -16.086 1.00 2.87 C ATOM 0 HA LEU B 168 -7.360 -1.204 -17.366 1.00 1.49 H new ATOM 0 HB2 LEU B 168 -8.790 -1.629 -15.534 1.00 1.36 H new ATOM 0 HB3 LEU B 168 -9.362 -0.172 -16.323 1.00 1.36 H new ATOM 0 HG LEU B 168 -11.184 -1.253 -15.559 1.00 1.20 H new ATOM 0 HD11 LEU B 168 -12.546 -1.922 -17.548 1.00 1.69 H new ATOM 0 HD12 LEU B 168 -11.612 -0.428 -17.796 1.00 1.69 H new ATOM 0 HD13 LEU B 168 -11.051 -1.958 -18.512 1.00 1.69 H new ATOM 0 HD21 LEU B 168 -11.864 -3.609 -16.076 1.00 2.87 H new ATOM 0 HD22 LEU B 168 -10.282 -3.854 -16.854 1.00 2.87 H new ATOM 0 HD23 LEU B 168 -10.373 -3.497 -15.112 1.00 2.87 H new ATOM 2594 N GLU B 169 -8.569 -3.617 -18.998 1.00 1.36 N ATOM 2595 CA GLU B 169 -8.187 -5.009 -19.329 1.00 1.29 C ATOM 2596 C GLU B 169 -6.701 -5.168 -19.687 1.00 1.33 C ATOM 2597 O GLU B 169 -6.149 -6.268 -19.613 1.00 1.30 O ATOM 2598 CB GLU B 169 -9.104 -5.659 -20.368 1.00 1.49 C ATOM 2599 CG GLU B 169 -9.248 -4.842 -21.647 1.00 1.81 C ATOM 2600 CD GLU B 169 -10.121 -5.541 -22.692 1.00 2.32 C ATOM 2601 OE1 GLU B 169 -11.266 -5.955 -22.379 1.00 3.52 O ATOM 2602 OE2 GLU B 169 -9.672 -5.651 -23.855 1.00 2.52 O ATOM 0 H GLU B 169 -9.193 -3.172 -19.671 1.00 1.36 H new ATOM 0 HA GLU B 169 -8.335 -5.564 -18.402 1.00 1.29 H new ATOM 0 HB2 GLU B 169 -8.714 -6.646 -20.618 1.00 1.49 H new ATOM 0 HB3 GLU B 169 -10.090 -5.808 -19.928 1.00 1.49 H new ATOM 0 HG2 GLU B 169 -9.681 -3.871 -21.407 1.00 1.81 H new ATOM 0 HG3 GLU B 169 -8.260 -4.656 -22.069 1.00 1.81 H new ATOM 2609 N GLU B 170 -6.026 -4.059 -19.991 1.00 1.47 N ATOM 2610 CA GLU B 170 -4.579 -3.988 -20.177 1.00 1.53 C ATOM 2611 C GLU B 170 -3.816 -4.300 -18.875 1.00 1.38 C ATOM 2612 O GLU B 170 -2.680 -4.773 -18.925 1.00 1.40 O ATOM 2613 CB GLU B 170 -4.257 -2.607 -20.772 1.00 1.79 C ATOM 2614 CG GLU B 170 -2.765 -2.414 -21.055 1.00 2.58 C ATOM 2615 CD GLU B 170 -2.494 -1.202 -21.953 1.00 3.18 C ATOM 2616 OE1 GLU B 170 -3.283 -0.224 -21.932 1.00 3.34 O ATOM 2617 OE2 GLU B 170 -1.471 -1.225 -22.681 1.00 4.24 O ATOM 0 H GLU B 170 -6.487 -3.158 -20.118 1.00 1.47 H new ATOM 0 HA GLU B 170 -4.239 -4.756 -20.872 1.00 1.53 H new ATOM 0 HB2 GLU B 170 -4.817 -2.476 -21.698 1.00 1.79 H new ATOM 0 HB3 GLU B 170 -4.594 -1.832 -20.083 1.00 1.79 H new ATOM 0 HG2 GLU B 170 -2.232 -2.291 -20.112 1.00 2.58 H new ATOM 0 HG3 GLU B 170 -2.369 -3.311 -21.531 1.00 2.58 H new ATOM 2624 N LYS B 171 -4.457 -4.152 -17.706 1.00 1.25 N ATOM 2625 CA LYS B 171 -3.928 -4.641 -16.425 1.00 1.18 C ATOM 2626 C LYS B 171 -3.842 -6.169 -16.397 1.00 1.09 C ATOM 2627 O LYS B 171 -2.784 -6.717 -16.107 1.00 1.29 O ATOM 2628 CB LYS B 171 -4.775 -4.094 -15.263 1.00 1.13 C ATOM 2629 CG LYS B 171 -4.700 -2.582 -15.048 1.00 1.17 C ATOM 2630 CD LYS B 171 -3.261 -2.106 -14.825 1.00 1.37 C ATOM 2631 CE LYS B 171 -3.285 -0.878 -13.923 1.00 1.40 C ATOM 2632 NZ LYS B 171 -2.052 -0.081 -14.055 1.00 1.68 N ATOM 0 H LYS B 171 -5.361 -3.687 -17.623 1.00 1.25 H new ATOM 0 HA LYS B 171 -2.909 -4.271 -16.308 1.00 1.18 H new ATOM 0 HB2 LYS B 171 -5.816 -4.368 -15.435 1.00 1.13 H new ATOM 0 HB3 LYS B 171 -4.463 -4.590 -14.344 1.00 1.13 H new ATOM 0 HG2 LYS B 171 -5.121 -2.071 -15.914 1.00 1.17 H new ATOM 0 HG3 LYS B 171 -5.310 -2.307 -14.188 1.00 1.17 H new ATOM 0 HD2 LYS B 171 -2.668 -2.898 -14.368 1.00 1.37 H new ATOM 0 HD3 LYS B 171 -2.791 -1.865 -15.778 1.00 1.37 H new ATOM 0 HE2 LYS B 171 -4.147 -0.259 -14.173 1.00 1.40 H new ATOM 0 HE3 LYS B 171 -3.407 -1.190 -12.886 1.00 1.40 H new ATOM 0 HZ1 LYS B 171 -2.043 0.667 -13.333 1.00 1.68 H new ATOM 0 HZ2 LYS B 171 -1.225 -0.697 -13.925 1.00 1.68 H new ATOM 0 HZ3 LYS B 171 -2.017 0.350 -15.001 1.00 1.68 H new ATOM 2646 N ILE B 172 -4.918 -6.861 -16.776 1.00 0.93 N ATOM 2647 CA ILE B 172 -4.986 -8.333 -16.848 1.00 0.89 C ATOM 2648 C ILE B 172 -4.040 -8.883 -17.923 1.00 1.10 C ATOM 2649 O ILE B 172 -3.407 -9.922 -17.725 1.00 1.19 O ATOM 2650 CB ILE B 172 -6.445 -8.784 -17.076 1.00 0.91 C ATOM 2651 CG1 ILE B 172 -7.356 -8.370 -15.890 1.00 0.82 C ATOM 2652 CG2 ILE B 172 -6.567 -10.293 -17.317 1.00 1.09 C ATOM 2653 CD1 ILE B 172 -8.114 -7.095 -16.278 1.00 0.90 C ATOM 0 H ILE B 172 -5.790 -6.408 -17.049 1.00 0.93 H new ATOM 0 HA ILE B 172 -4.650 -8.746 -15.897 1.00 0.89 H new ATOM 0 HB ILE B 172 -6.778 -8.274 -17.980 1.00 0.91 H new ATOM 0 HG12 ILE B 172 -8.057 -9.170 -15.654 1.00 0.82 H new ATOM 0 HG13 ILE B 172 -6.758 -8.197 -14.996 1.00 0.82 H new ATOM 0 HG21 ILE B 172 -7.614 -10.553 -17.471 1.00 1.09 H new ATOM 0 HG22 ILE B 172 -5.991 -10.568 -18.200 1.00 1.09 H new ATOM 0 HG23 ILE B 172 -6.183 -10.832 -16.451 1.00 1.09 H new ATOM 0 HD11 ILE B 172 -8.760 -6.791 -15.454 1.00 0.90 H new ATOM 0 HD12 ILE B 172 -7.401 -6.299 -16.494 1.00 0.90 H new ATOM 0 HD13 ILE B 172 -8.721 -7.288 -17.163 1.00 0.90 H new ATOM 2665 N ALA B 173 -3.873 -8.159 -19.031 1.00 1.25 N ATOM 2666 CA ALA B 173 -2.890 -8.485 -20.058 1.00 1.46 C ATOM 2667 C ALA B 173 -1.445 -8.447 -19.494 1.00 1.52 C ATOM 2668 O ALA B 173 -0.644 -9.355 -19.742 1.00 1.73 O ATOM 2669 CB ALA B 173 -3.124 -7.514 -21.227 1.00 1.58 C ATOM 0 H ALA B 173 -4.421 -7.325 -19.240 1.00 1.25 H new ATOM 0 HA ALA B 173 -3.012 -9.507 -20.415 1.00 1.46 H new ATOM 0 HB1 ALA B 173 -2.408 -7.722 -22.022 1.00 1.58 H new ATOM 0 HB2 ALA B 173 -4.137 -7.642 -21.609 1.00 1.58 H new ATOM 0 HB3 ALA B 173 -2.993 -6.489 -20.880 1.00 1.58 H new ATOM 2675 N ASN B 174 -1.140 -7.451 -18.649 1.00 1.46 N ATOM 2676 CA ASN B 174 0.177 -7.254 -18.037 1.00 1.56 C ATOM 2677 C ASN B 174 0.450 -8.081 -16.761 1.00 1.42 C ATOM 2678 O ASN B 174 1.625 -8.270 -16.443 1.00 1.59 O ATOM 2679 CB ASN B 174 0.416 -5.749 -17.820 1.00 1.85 C ATOM 2680 CG ASN B 174 0.851 -5.054 -19.098 1.00 2.30 C ATOM 2681 OD1 ASN B 174 1.953 -5.256 -19.590 1.00 2.65 O ATOM 2682 ND2 ASN B 174 0.009 -4.250 -19.693 1.00 2.73 N ATOM 0 H ASN B 174 -1.820 -6.745 -18.367 1.00 1.46 H new ATOM 0 HA ASN B 174 0.906 -7.650 -18.744 1.00 1.56 H new ATOM 0 HB2 ASN B 174 -0.498 -5.286 -17.448 1.00 1.85 H new ATOM 0 HB3 ASN B 174 1.178 -5.609 -17.053 1.00 1.85 H new ATOM 0 HD21 ASN B 174 0.271 -3.792 -20.566 1.00 2.73 H new ATOM 0 HD22 ASN B 174 -0.910 -4.081 -19.284 1.00 2.73 H new ATOM 2689 N LEU B 175 -0.552 -8.607 -16.043 1.00 1.26 N ATOM 2690 CA LEU B 175 -0.329 -9.614 -14.978 1.00 1.19 C ATOM 2691 C LEU B 175 -0.399 -11.075 -15.467 1.00 1.36 C ATOM 2692 O LEU B 175 0.112 -11.978 -14.803 1.00 1.48 O ATOM 2693 CB LEU B 175 -1.151 -9.313 -13.719 1.00 1.10 C ATOM 2694 CG LEU B 175 -2.683 -9.322 -13.815 1.00 1.28 C ATOM 2695 CD1 LEU B 175 -3.312 -10.670 -14.163 1.00 1.41 C ATOM 2696 CD2 LEU B 175 -3.208 -8.891 -12.453 1.00 1.63 C ATOM 0 H LEU B 175 -1.531 -8.355 -16.176 1.00 1.26 H new ATOM 0 HA LEU B 175 0.712 -9.512 -14.673 1.00 1.19 H new ATOM 0 HB2 LEU B 175 -0.864 -10.037 -12.957 1.00 1.10 H new ATOM 0 HB3 LEU B 175 -0.849 -8.331 -13.355 1.00 1.10 H new ATOM 0 HG LEU B 175 -2.954 -8.656 -14.634 1.00 1.28 H new ATOM 0 HD11 LEU B 175 -4.396 -10.566 -14.205 1.00 1.41 H new ATOM 0 HD12 LEU B 175 -2.942 -11.005 -15.132 1.00 1.41 H new ATOM 0 HD13 LEU B 175 -3.048 -11.403 -13.400 1.00 1.41 H new ATOM 0 HD21 LEU B 175 -4.298 -8.881 -12.470 1.00 1.63 H new ATOM 0 HD22 LEU B 175 -2.863 -9.591 -11.692 1.00 1.63 H new ATOM 0 HD23 LEU B 175 -2.840 -7.892 -12.221 1.00 1.63 H new ATOM 2796 N LEU B 183 -3.615 -15.206 -8.260 1.00 2.07 N ATOM 2797 CA LEU B 183 -2.870 -14.018 -7.832 1.00 1.58 C ATOM 2798 C LEU B 183 -2.639 -13.939 -6.314 1.00 1.68 C ATOM 2799 O LEU B 183 -3.586 -13.798 -5.534 1.00 2.83 O ATOM 2800 CB LEU B 183 -3.627 -12.772 -8.314 1.00 1.62 C ATOM 2801 CG LEU B 183 -2.793 -11.485 -8.290 1.00 2.68 C ATOM 2802 CD1 LEU B 183 -1.749 -11.478 -9.411 1.00 3.64 C ATOM 2803 CD2 LEU B 183 -3.665 -10.240 -8.469 1.00 3.10 C ATOM 0 HA LEU B 183 -1.877 -14.079 -8.277 1.00 1.58 H new ATOM 0 HB2 LEU B 183 -3.980 -12.945 -9.331 1.00 1.62 H new ATOM 0 HB3 LEU B 183 -4.510 -12.632 -7.690 1.00 1.62 H new ATOM 0 HG LEU B 183 -2.306 -11.461 -7.315 1.00 2.68 H new ATOM 0 HD11 LEU B 183 -1.174 -10.553 -9.367 1.00 3.64 H new ATOM 0 HD12 LEU B 183 -1.078 -12.328 -9.289 1.00 3.64 H new ATOM 0 HD13 LEU B 183 -2.251 -11.548 -10.376 1.00 3.64 H new ATOM 0 HD21 LEU B 183 -3.037 -9.349 -8.446 1.00 3.10 H new ATOM 0 HD22 LEU B 183 -4.184 -10.294 -9.426 1.00 3.10 H new ATOM 0 HD23 LEU B 183 -4.396 -10.189 -7.662 1.00 3.10 H new ATOM 2815 N GLU B 184 -1.372 -13.959 -5.907 1.00 0.89 N ATOM 2816 CA GLU B 184 -0.975 -13.758 -4.514 1.00 1.04 C ATOM 2817 C GLU B 184 -1.334 -12.356 -3.992 1.00 0.94 C ATOM 2818 O GLU B 184 -1.436 -11.371 -4.728 1.00 0.91 O ATOM 2819 CB GLU B 184 0.523 -14.085 -4.314 1.00 1.26 C ATOM 2820 CG GLU B 184 0.761 -15.493 -3.734 1.00 1.50 C ATOM 2821 CD GLU B 184 0.369 -15.617 -2.252 1.00 2.25 C ATOM 2822 OE1 GLU B 184 -0.373 -14.754 -1.725 1.00 3.52 O ATOM 2823 OE2 GLU B 184 0.762 -16.591 -1.565 1.00 2.87 O ATOM 0 H GLU B 184 -0.586 -14.116 -6.538 1.00 0.89 H new ATOM 0 HA GLU B 184 -1.553 -14.458 -3.911 1.00 1.04 H new ATOM 0 HB2 GLU B 184 1.038 -14.001 -5.271 1.00 1.26 H new ATOM 0 HB3 GLU B 184 0.965 -13.344 -3.648 1.00 1.26 H new ATOM 0 HG2 GLU B 184 0.191 -16.218 -4.315 1.00 1.50 H new ATOM 0 HG3 GLU B 184 1.814 -15.751 -3.847 1.00 1.50 H new ATOM 2830 N PHE B 185 -1.498 -12.262 -2.675 1.00 0.99 N ATOM 2831 CA PHE B 185 -1.863 -11.036 -1.959 1.00 0.94 C ATOM 2832 C PHE B 185 -0.814 -9.923 -2.170 1.00 0.98 C ATOM 2833 O PHE B 185 -1.162 -8.779 -2.469 1.00 1.01 O ATOM 2834 CB PHE B 185 -2.059 -11.448 -0.496 1.00 1.13 C ATOM 2835 CG PHE B 185 -2.608 -10.410 0.456 1.00 1.32 C ATOM 2836 CD1 PHE B 185 -1.729 -9.526 1.110 1.00 2.03 C ATOM 2837 CD2 PHE B 185 -3.977 -10.418 0.794 1.00 2.72 C ATOM 2838 CE1 PHE B 185 -2.208 -8.689 2.130 1.00 2.30 C ATOM 2839 CE2 PHE B 185 -4.455 -9.581 1.818 1.00 3.31 C ATOM 2840 CZ PHE B 185 -3.565 -8.732 2.496 1.00 2.55 C ATOM 0 H PHE B 185 -1.377 -13.062 -2.054 1.00 0.99 H new ATOM 0 HA PHE B 185 -2.784 -10.594 -2.338 1.00 0.94 H new ATOM 0 HB2 PHE B 185 -2.727 -12.309 -0.476 1.00 1.13 H new ATOM 0 HB3 PHE B 185 -1.096 -11.783 -0.109 1.00 1.13 H new ATOM 0 HD1 PHE B 185 -0.687 -9.492 0.827 1.00 2.03 H new ATOM 0 HD2 PHE B 185 -4.659 -11.068 0.266 1.00 2.72 H new ATOM 0 HE1 PHE B 185 -1.534 -8.012 2.634 1.00 2.30 H new ATOM 0 HE2 PHE B 185 -5.502 -9.591 2.082 1.00 3.31 H new ATOM 0 HZ PHE B 185 -3.924 -8.109 3.302 1.00 2.55 H new ATOM 2850 N ARG B 186 0.480 -10.283 -2.154 1.00 1.03 N ATOM 2851 CA ARG B 186 1.607 -9.412 -2.536 1.00 1.16 C ATOM 2852 C ARG B 186 1.530 -8.938 -3.999 1.00 1.12 C ATOM 2853 O ARG B 186 2.004 -7.851 -4.302 1.00 1.21 O ATOM 2854 CB ARG B 186 2.926 -10.150 -2.215 1.00 1.33 C ATOM 2855 CG ARG B 186 4.213 -9.318 -2.402 1.00 1.97 C ATOM 2856 CD ARG B 186 4.887 -9.544 -3.765 1.00 2.27 C ATOM 2857 NE ARG B 186 6.038 -8.643 -3.963 1.00 3.34 N ATOM 2858 CZ ARG B 186 7.325 -8.907 -3.820 1.00 4.04 C ATOM 2859 NH1 ARG B 186 7.788 -10.042 -3.377 1.00 4.18 N ATOM 2860 NH2 ARG B 186 8.170 -7.980 -4.149 1.00 5.37 N ATOM 0 H ARG B 186 0.781 -11.214 -1.867 1.00 1.03 H new ATOM 0 HA ARG B 186 1.559 -8.493 -1.952 1.00 1.16 H new ATOM 0 HB2 ARG B 186 2.886 -10.498 -1.183 1.00 1.33 H new ATOM 0 HB3 ARG B 186 2.991 -11.035 -2.848 1.00 1.33 H new ATOM 0 HG2 ARG B 186 3.973 -8.260 -2.293 1.00 1.97 H new ATOM 0 HG3 ARG B 186 4.918 -9.568 -1.609 1.00 1.97 H new ATOM 0 HD2 ARG B 186 5.219 -10.580 -3.839 1.00 2.27 H new ATOM 0 HD3 ARG B 186 4.160 -9.385 -4.561 1.00 2.27 H new ATOM 0 HE ARG B 186 5.811 -7.690 -4.248 1.00 3.34 H new ATOM 0 HH11 ARG B 186 7.144 -10.789 -3.118 1.00 4.18 H new ATOM 0 HH12 ARG B 186 8.794 -10.183 -3.290 1.00 4.18 H new ATOM 0 HH21 ARG B 186 7.833 -7.085 -4.504 1.00 5.37 H new ATOM 0 HH22 ARG B 186 9.172 -8.146 -4.053 1.00 5.37 H new ATOM 2874 N SER B 187 0.900 -9.691 -4.900 1.00 1.06 N ATOM 2875 CA SER B 187 0.798 -9.349 -6.329 1.00 1.09 C ATOM 2876 C SER B 187 -0.368 -8.390 -6.647 1.00 0.85 C ATOM 2877 O SER B 187 -0.219 -7.551 -7.538 1.00 0.88 O ATOM 2878 CB SER B 187 0.702 -10.626 -7.168 1.00 1.31 C ATOM 2879 OG SER B 187 1.662 -11.598 -6.785 1.00 2.16 O ATOM 0 H SER B 187 0.438 -10.568 -4.661 1.00 1.06 H new ATOM 0 HA SER B 187 1.708 -8.809 -6.591 1.00 1.09 H new ATOM 0 HB2 SER B 187 -0.298 -11.048 -7.069 1.00 1.31 H new ATOM 0 HB3 SER B 187 0.840 -10.377 -8.220 1.00 1.31 H new ATOM 0 HG SER B 187 1.562 -12.395 -7.346 1.00 2.16 H new ATOM 2885 N PHE B 188 -1.479 -8.437 -5.887 1.00 0.71 N ATOM 2886 CA PHE B 188 -2.480 -7.343 -5.808 1.00 0.65 C ATOM 2887 C PHE B 188 -1.806 -6.057 -5.289 1.00 0.60 C ATOM 2888 O PHE B 188 -1.896 -4.999 -5.908 1.00 0.57 O ATOM 2889 CB PHE B 188 -3.635 -7.748 -4.887 1.00 0.67 C ATOM 2890 CG PHE B 188 -4.767 -6.731 -4.749 1.00 0.67 C ATOM 2891 CD1 PHE B 188 -4.744 -5.757 -3.728 1.00 1.91 C ATOM 2892 CD2 PHE B 188 -5.895 -6.814 -5.592 1.00 1.95 C ATOM 2893 CE1 PHE B 188 -5.865 -4.931 -3.517 1.00 1.90 C ATOM 2894 CE2 PHE B 188 -7.022 -5.997 -5.376 1.00 2.02 C ATOM 2895 CZ PHE B 188 -7.006 -5.061 -4.326 1.00 0.83 C ATOM 0 H PHE B 188 -1.714 -9.240 -5.304 1.00 0.71 H new ATOM 0 HA PHE B 188 -2.882 -7.155 -6.804 1.00 0.65 H new ATOM 0 HB2 PHE B 188 -4.056 -8.684 -5.255 1.00 0.67 H new ATOM 0 HB3 PHE B 188 -3.230 -7.949 -3.895 1.00 0.67 H new ATOM 0 HD1 PHE B 188 -3.867 -5.645 -3.108 1.00 1.91 H new ATOM 0 HD2 PHE B 188 -5.895 -7.514 -6.415 1.00 1.95 H new ATOM 0 HE1 PHE B 188 -5.847 -4.193 -2.728 1.00 1.90 H new ATOM 0 HE2 PHE B 188 -7.891 -6.088 -6.011 1.00 2.02 H new ATOM 0 HZ PHE B 188 -7.872 -4.442 -4.142 1.00 0.83 H new ATOM 2905 N TRP B 189 -1.065 -6.173 -4.179 1.00 0.63 N ATOM 2906 CA TRP B 189 -0.334 -5.073 -3.538 1.00 0.63 C ATOM 2907 C TRP B 189 0.695 -4.396 -4.466 1.00 0.66 C ATOM 2908 O TRP B 189 0.744 -3.171 -4.551 1.00 0.66 O ATOM 2909 CB TRP B 189 0.325 -5.621 -2.267 1.00 0.68 C ATOM 2910 CG TRP B 189 1.195 -4.638 -1.566 1.00 0.68 C ATOM 2911 CD1 TRP B 189 2.527 -4.505 -1.742 1.00 0.78 C ATOM 2912 CD2 TRP B 189 0.796 -3.570 -0.660 1.00 0.67 C ATOM 2913 NE1 TRP B 189 2.977 -3.406 -1.042 1.00 0.83 N ATOM 2914 CE2 TRP B 189 1.945 -2.773 -0.380 1.00 0.78 C ATOM 2915 CE3 TRP B 189 -0.432 -3.169 -0.091 1.00 0.67 C ATOM 2916 CZ2 TRP B 189 1.865 -1.598 0.372 1.00 0.89 C ATOM 2917 CZ3 TRP B 189 -0.517 -1.996 0.679 1.00 0.77 C ATOM 2918 CH2 TRP B 189 0.616 -1.194 0.879 1.00 0.88 C ATOM 0 H TRP B 189 -0.955 -7.061 -3.689 1.00 0.63 H new ATOM 0 HA TRP B 189 -1.043 -4.283 -3.290 1.00 0.63 H new ATOM 0 HB2 TRP B 189 -0.454 -5.956 -1.581 1.00 0.68 H new ATOM 0 HB3 TRP B 189 0.919 -6.497 -2.527 1.00 0.68 H new ATOM 0 HD1 TRP B 189 3.145 -5.159 -2.339 1.00 0.78 H new ATOM 0 HE1 TRP B 189 3.950 -3.100 -1.017 1.00 0.83 H new ATOM 0 HE3 TRP B 189 -1.316 -3.770 -0.249 1.00 0.67 H new ATOM 0 HZ2 TRP B 189 2.750 -1.008 0.562 1.00 0.89 H new ATOM 0 HZ3 TRP B 189 -1.461 -1.711 1.119 1.00 0.77 H new ATOM 0 HH2 TRP B 189 0.530 -0.265 1.423 1.00 0.88 H new ATOM 2929 N GLU B 190 1.457 -5.165 -5.248 1.00 0.73 N ATOM 2930 CA GLU B 190 2.386 -4.639 -6.263 1.00 0.78 C ATOM 2931 C GLU B 190 1.694 -3.833 -7.383 1.00 0.69 C ATOM 2932 O GLU B 190 2.368 -3.047 -8.056 1.00 0.69 O ATOM 2933 CB GLU B 190 3.206 -5.793 -6.864 1.00 0.96 C ATOM 2934 CG GLU B 190 4.327 -6.314 -5.953 1.00 1.22 C ATOM 2935 CD GLU B 190 5.627 -5.495 -5.994 1.00 1.72 C ATOM 2936 OE1 GLU B 190 5.628 -4.312 -6.415 1.00 2.61 O ATOM 2937 OE2 GLU B 190 6.692 -6.044 -5.620 1.00 2.32 O ATOM 0 H GLU B 190 1.449 -6.184 -5.197 1.00 0.73 H new ATOM 0 HA GLU B 190 3.042 -3.936 -5.750 1.00 0.78 H new ATOM 0 HB2 GLU B 190 2.533 -6.617 -7.099 1.00 0.96 H new ATOM 0 HB3 GLU B 190 3.644 -5.460 -7.805 1.00 0.96 H new ATOM 0 HG2 GLU B 190 3.961 -6.336 -4.927 1.00 1.22 H new ATOM 0 HG3 GLU B 190 4.554 -7.343 -6.232 1.00 1.22 H new ATOM 2944 N LEU B 191 0.378 -3.984 -7.598 1.00 0.67 N ATOM 2945 CA LEU B 191 -0.411 -3.108 -8.482 1.00 0.68 C ATOM 2946 C LEU B 191 -0.904 -1.827 -7.791 1.00 0.64 C ATOM 2947 O LEU B 191 -1.097 -0.806 -8.455 1.00 0.67 O ATOM 2948 CB LEU B 191 -1.604 -3.869 -9.091 1.00 0.76 C ATOM 2949 CG LEU B 191 -1.499 -3.937 -10.624 1.00 1.19 C ATOM 2950 CD1 LEU B 191 -0.613 -5.115 -11.024 1.00 1.71 C ATOM 2951 CD2 LEU B 191 -2.882 -4.073 -11.250 1.00 1.47 C ATOM 0 H LEU B 191 -0.174 -4.722 -7.161 1.00 0.67 H new ATOM 0 HA LEU B 191 0.268 -2.799 -9.276 1.00 0.68 H new ATOM 0 HB2 LEU B 191 -1.641 -4.879 -8.682 1.00 0.76 H new ATOM 0 HB3 LEU B 191 -2.535 -3.376 -8.809 1.00 0.76 H new ATOM 0 HG LEU B 191 -1.051 -3.013 -10.991 1.00 1.19 H new ATOM 0 HD11 LEU B 191 -0.539 -5.162 -12.110 1.00 1.71 H new ATOM 0 HD12 LEU B 191 0.382 -4.983 -10.598 1.00 1.71 H new ATOM 0 HD13 LEU B 191 -1.048 -6.041 -10.649 1.00 1.71 H new ATOM 0 HD21 LEU B 191 -2.787 -4.120 -12.335 1.00 1.47 H new ATOM 0 HD22 LEU B 191 -3.357 -4.985 -10.888 1.00 1.47 H new ATOM 0 HD23 LEU B 191 -3.492 -3.212 -10.976 1.00 1.47 H new ATOM 2963 N ILE B 192 -1.049 -1.836 -6.464 1.00 0.59 N ATOM 2964 CA ILE B 192 -1.214 -0.603 -5.683 1.00 0.56 C ATOM 2965 C ILE B 192 0.101 0.203 -5.711 1.00 0.62 C ATOM 2966 O ILE B 192 0.083 1.420 -5.887 1.00 0.62 O ATOM 2967 CB ILE B 192 -1.669 -0.901 -4.238 1.00 0.50 C ATOM 2968 CG1 ILE B 192 -2.865 -1.873 -4.111 1.00 0.47 C ATOM 2969 CG2 ILE B 192 -2.086 0.429 -3.600 1.00 0.53 C ATOM 2970 CD1 ILE B 192 -3.149 -2.269 -2.661 1.00 0.50 C ATOM 0 H ILE B 192 -1.056 -2.688 -5.903 1.00 0.59 H new ATOM 0 HA ILE B 192 -2.002 -0.003 -6.137 1.00 0.56 H new ATOM 0 HB ILE B 192 -0.826 -1.386 -3.747 1.00 0.50 H new ATOM 0 HG12 ILE B 192 -3.754 -1.408 -4.537 1.00 0.47 H new ATOM 0 HG13 ILE B 192 -2.663 -2.770 -4.696 1.00 0.47 H new ATOM 0 HG21 ILE B 192 -2.414 0.254 -2.575 1.00 0.53 H new ATOM 0 HG22 ILE B 192 -1.237 1.113 -3.598 1.00 0.53 H new ATOM 0 HG23 ILE B 192 -2.903 0.867 -4.173 1.00 0.53 H new ATOM 0 HD11 ILE B 192 -3.998 -2.952 -2.630 1.00 0.50 H new ATOM 0 HD12 ILE B 192 -2.272 -2.761 -2.240 1.00 0.50 H new ATOM 0 HD13 ILE B 192 -3.380 -1.377 -2.079 1.00 0.50 H new ATOM 2982 N GLY B 193 1.249 -0.482 -5.681 1.00 0.69 N ATOM 2983 CA GLY B 193 2.564 0.119 -5.950 1.00 0.76 C ATOM 2984 C GLY B 193 2.697 0.730 -7.356 1.00 0.73 C ATOM 2985 O GLY B 193 3.496 1.643 -7.557 1.00 0.82 O ATOM 0 H GLY B 193 1.294 -1.478 -5.468 1.00 0.69 H new ATOM 0 HA2 GLY B 193 2.756 0.894 -5.208 1.00 0.76 H new ATOM 0 HA3 GLY B 193 3.333 -0.643 -5.822 1.00 0.76 H new ATOM 2989 N GLU B 194 1.887 0.281 -8.321 1.00 0.71 N ATOM 2990 CA GLU B 194 1.756 0.871 -9.651 1.00 0.72 C ATOM 2991 C GLU B 194 0.739 2.033 -9.693 1.00 0.65 C ATOM 2992 O GLU B 194 0.981 3.026 -10.386 1.00 0.70 O ATOM 2993 CB GLU B 194 1.427 -0.263 -10.630 1.00 0.84 C ATOM 2994 CG GLU B 194 1.547 0.215 -12.068 1.00 0.95 C ATOM 2995 CD GLU B 194 1.443 -0.960 -13.042 1.00 1.19 C ATOM 2996 OE1 GLU B 194 2.477 -1.601 -13.358 1.00 2.29 O ATOM 2997 OE2 GLU B 194 0.324 -1.287 -13.493 1.00 2.14 O ATOM 0 H GLU B 194 1.285 -0.532 -8.189 1.00 0.71 H new ATOM 0 HA GLU B 194 2.695 1.340 -9.945 1.00 0.72 H new ATOM 0 HB2 GLU B 194 2.103 -1.102 -10.463 1.00 0.84 H new ATOM 0 HB3 GLU B 194 0.416 -0.627 -10.446 1.00 0.84 H new ATOM 0 HG2 GLU B 194 0.762 0.941 -12.281 1.00 0.95 H new ATOM 0 HG3 GLU B 194 2.500 0.726 -12.208 1.00 0.95 H new ATOM 3004 N ALA B 195 -0.339 1.994 -8.893 1.00 0.59 N ATOM 3005 CA ALA B 195 -1.163 3.185 -8.620 1.00 0.62 C ATOM 3006 C ALA B 195 -0.311 4.340 -8.043 1.00 0.67 C ATOM 3007 O ALA B 195 -0.428 5.481 -8.497 1.00 0.75 O ATOM 3008 CB ALA B 195 -2.343 2.835 -7.689 1.00 0.61 C ATOM 0 H ALA B 195 -0.662 1.149 -8.422 1.00 0.59 H new ATOM 0 HA ALA B 195 -1.577 3.530 -9.568 1.00 0.62 H new ATOM 0 HB1 ALA B 195 -2.937 3.730 -7.502 1.00 0.61 H new ATOM 0 HB2 ALA B 195 -2.968 2.077 -8.162 1.00 0.61 H new ATOM 0 HB3 ALA B 195 -1.959 2.450 -6.744 1.00 0.61 H new ATOM 3014 N ALA B 196 0.629 4.041 -7.137 1.00 0.66 N ATOM 3015 CA ALA B 196 1.596 5.006 -6.595 1.00 0.74 C ATOM 3016 C ALA B 196 2.625 5.542 -7.618 1.00 0.80 C ATOM 3017 O ALA B 196 3.405 6.432 -7.286 1.00 0.99 O ATOM 3018 CB ALA B 196 2.295 4.403 -5.372 1.00 0.76 C ATOM 0 H ALA B 196 0.741 3.103 -6.752 1.00 0.66 H new ATOM 0 HA ALA B 196 1.018 5.884 -6.306 1.00 0.74 H new ATOM 0 HB1 ALA B 196 3.012 5.120 -4.972 1.00 0.76 H new ATOM 0 HB2 ALA B 196 1.553 4.167 -4.609 1.00 0.76 H new ATOM 0 HB3 ALA B 196 2.818 3.492 -5.664 1.00 0.76 H new ATOM 3024 N LYS B 197 2.641 5.056 -8.868 1.00 0.75 N ATOM 3025 CA LYS B 197 3.378 5.718 -9.961 1.00 0.85 C ATOM 3026 C LYS B 197 2.577 6.849 -10.615 1.00 0.94 C ATOM 3027 O LYS B 197 3.181 7.783 -11.140 1.00 1.19 O ATOM 3028 CB LYS B 197 3.913 4.690 -10.975 1.00 0.90 C ATOM 3029 CG LYS B 197 5.008 3.824 -10.332 1.00 1.07 C ATOM 3030 CD LYS B 197 5.716 2.935 -11.358 1.00 1.42 C ATOM 3031 CE LYS B 197 6.887 2.212 -10.681 1.00 1.32 C ATOM 3032 NZ LYS B 197 7.731 1.474 -11.651 1.00 2.30 N ATOM 0 H LYS B 197 2.152 4.206 -9.150 1.00 0.75 H new ATOM 0 HA LYS B 197 4.247 6.205 -9.518 1.00 0.85 H new ATOM 0 HB2 LYS B 197 3.098 4.056 -11.325 1.00 0.90 H new ATOM 0 HB3 LYS B 197 4.314 5.205 -11.848 1.00 0.90 H new ATOM 0 HG2 LYS B 197 5.740 4.468 -9.845 1.00 1.07 H new ATOM 0 HG3 LYS B 197 4.566 3.200 -9.555 1.00 1.07 H new ATOM 0 HD2 LYS B 197 5.016 2.209 -11.772 1.00 1.42 H new ATOM 0 HD3 LYS B 197 6.079 3.538 -12.190 1.00 1.42 H new ATOM 0 HE2 LYS B 197 7.501 2.939 -10.149 1.00 1.32 H new ATOM 0 HE3 LYS B 197 6.500 1.516 -9.937 1.00 1.32 H new ATOM 0 HZ1 LYS B 197 8.508 1.002 -11.146 1.00 2.30 H new ATOM 0 HZ2 LYS B 197 7.154 0.761 -12.142 1.00 2.30 H new ATOM 0 HZ3 LYS B 197 8.124 2.140 -12.347 1.00 2.30 H new ATOM 3046 N SER B 198 1.245 6.842 -10.523 1.00 0.85 N ATOM 3047 CA SER B 198 0.394 7.907 -11.079 1.00 1.01 C ATOM 3048 C SER B 198 0.318 9.169 -10.208 1.00 1.33 C ATOM 3049 O SER B 198 -0.019 10.229 -10.738 1.00 1.60 O ATOM 3050 CB SER B 198 -1.016 7.376 -11.361 1.00 1.08 C ATOM 3051 OG SER B 198 -1.037 6.638 -12.575 1.00 1.26 O ATOM 0 H SER B 198 0.722 6.098 -10.061 1.00 0.85 H new ATOM 0 HA SER B 198 0.873 8.210 -12.010 1.00 1.01 H new ATOM 0 HB2 SER B 198 -1.343 6.742 -10.537 1.00 1.08 H new ATOM 0 HB3 SER B 198 -1.718 8.207 -11.422 1.00 1.08 H new ATOM 0 HG SER B 198 -1.944 6.305 -12.740 1.00 1.26 H new ATOM 3057 N VAL B 199 0.633 9.091 -8.908 1.00 1.44 N ATOM 3058 CA VAL B 199 0.602 10.218 -7.954 1.00 1.73 C ATOM 3059 C VAL B 199 1.785 10.133 -6.979 1.00 1.74 C ATOM 3060 O VAL B 199 1.977 9.107 -6.329 1.00 1.65 O ATOM 3061 CB VAL B 199 -0.770 10.283 -7.239 1.00 1.90 C ATOM 3062 CG1 VAL B 199 -1.135 9.033 -6.423 1.00 1.76 C ATOM 3063 CG2 VAL B 199 -0.888 11.515 -6.337 1.00 2.38 C ATOM 0 H VAL B 199 0.926 8.216 -8.473 1.00 1.44 H new ATOM 0 HA VAL B 199 0.716 11.155 -8.498 1.00 1.73 H new ATOM 0 HB VAL B 199 -1.483 10.347 -8.061 1.00 1.90 H new ATOM 0 HG11 VAL B 199 -2.112 9.173 -5.960 1.00 1.76 H new ATOM 0 HG12 VAL B 199 -1.167 8.165 -7.082 1.00 1.76 H new ATOM 0 HG13 VAL B 199 -0.386 8.873 -5.648 1.00 1.76 H new ATOM 0 HG21 VAL B 199 -1.866 11.521 -5.855 1.00 2.38 H new ATOM 0 HG22 VAL B 199 -0.108 11.485 -5.576 1.00 2.38 H new ATOM 0 HG23 VAL B 199 -0.774 12.418 -6.937 1.00 2.38 H new ATOM 3073 N LYS B 200 2.606 11.191 -6.911 1.00 1.93 N ATOM 3074 CA LYS B 200 3.913 11.209 -6.220 1.00 2.19 C ATOM 3075 C LYS B 200 4.227 12.559 -5.551 1.00 2.62 C ATOM 3076 O LYS B 200 3.450 13.513 -5.638 1.00 2.76 O ATOM 3077 CB LYS B 200 4.988 10.809 -7.261 1.00 2.18 C ATOM 3078 CG LYS B 200 5.436 9.352 -7.078 1.00 1.98 C ATOM 3079 CD LYS B 200 6.251 8.874 -8.284 1.00 2.44 C ATOM 3080 CE LYS B 200 6.685 7.418 -8.083 1.00 2.79 C ATOM 3081 NZ LYS B 200 7.522 6.937 -9.208 1.00 3.49 N ATOM 0 H LYS B 200 2.377 12.085 -7.346 1.00 1.93 H new ATOM 0 HA LYS B 200 3.897 10.498 -5.394 1.00 2.19 H new ATOM 0 HB2 LYS B 200 4.590 10.944 -8.267 1.00 2.18 H new ATOM 0 HB3 LYS B 200 5.850 11.470 -7.168 1.00 2.18 H new ATOM 0 HG2 LYS B 200 6.034 9.263 -6.171 1.00 1.98 H new ATOM 0 HG3 LYS B 200 4.563 8.713 -6.948 1.00 1.98 H new ATOM 0 HD2 LYS B 200 5.656 8.962 -9.193 1.00 2.44 H new ATOM 0 HD3 LYS B 200 7.128 9.508 -8.415 1.00 2.44 H new ATOM 0 HE2 LYS B 200 7.242 7.329 -7.150 1.00 2.79 H new ATOM 0 HE3 LYS B 200 5.803 6.785 -7.988 1.00 2.79 H new ATOM 0 HZ1 LYS B 200 7.797 5.949 -9.038 1.00 3.49 H new ATOM 0 HZ2 LYS B 200 6.981 6.998 -10.094 1.00 3.49 H new ATOM 0 HZ3 LYS B 200 8.376 7.526 -9.282 1.00 3.49 H new