USER MOD reduce.3.24.130724 H: found=0, std=0, add=616, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 486 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 230 THR OG1 : rot 180:sc= 0.211 USER MOD Set 1.2: A 233 GLN : amide:sc= 0.264 X(o=0.48,f=0.83) USER MOD Single : A 158 HIS : no HD1:sc= -1.75! C(o=-1.8!,f=-3.1!) USER MOD Single : A 175 TYR OH : rot 180:sc= 0 USER MOD Single : A 180 THR OG1 : rot 180:sc= 0 USER MOD Single : A 181 SER OG : rot 168:sc= 1.34 USER MOD Single : A 191 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 192 GLN : amide:sc= -0.963 K(o=-0.96,f=-3.7!) USER MOD Single : A 198 SER OG : rot -132:sc= -0.346 USER MOD Single : A 208 SER OG : rot 70:sc= 0.9 USER MOD Single : A 209 THR OG1 : rot 180:sc= -0.352 USER MOD Single : A 215 ASN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 222 ASN : amide:sc= -0.0316 X(o=-0.032,f=-0.28) USER MOD Single : A 229 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 235 THR OG1 : rot 55:sc= 0.758 USER MOD Single : A 237 MET CE :methyl -169:sc= 0 (180deg=-0.206) USER MOD Single : A 238 MET CE :methyl -122:sc= -1.21 (180deg=-3.72!) USER MOD Single : A 241 ASN : amide:sc= -1.95 K(o=-2,f=-1) USER MOD Single : A 242 SER OG : rot -98:sc= 0.642 USER MOD Single : A 243 SER OG : rot 180:sc= 0 USER MOD Single : A 244 ASN : amide:sc= -0.0412 X(o=-0.041,f=0.028) USER MOD Single : A 248 THR OG1 : rot -15:sc= -3.05! USER MOD Single : A 250 LYS NZ :NH3+ 153:sc= 1.18 (180deg=0.858) USER MOD ----------------------------------------------------------------- ATOM 28 N HIS A 158 -9.635 -7.215 -2.840 1.00 20.24 N ATOM 29 CA HIS A 158 -8.662 -6.252 -3.329 1.00 33.52 C ATOM 30 C HIS A 158 -8.959 -5.635 -4.669 1.00 53.41 C ATOM 31 O HIS A 158 -9.426 -6.293 -5.601 1.00 42.11 O ATOM 32 CB HIS A 158 -7.180 -6.688 -3.202 1.00 52.21 C ATOM 33 CG HIS A 158 -6.725 -7.926 -3.908 1.00 75.24 C ATOM 34 ND1 HIS A 158 -6.066 -8.935 -3.256 1.00 31.32 N ATOM 35 CD2 HIS A 158 -6.693 -8.249 -5.215 1.00 15.42 C ATOM 36 CE1 HIS A 158 -5.643 -9.808 -4.120 1.00 71.14 C ATOM 37 NE2 HIS A 158 -6.011 -9.427 -5.322 1.00 64.24 N ATOM 0 HA HIS A 158 -8.798 -5.442 -2.612 1.00 33.52 H new ATOM 0 HB2 HIS A 158 -6.563 -5.862 -3.555 1.00 52.21 H new ATOM 0 HB3 HIS A 158 -6.964 -6.816 -2.141 1.00 52.21 H new ATOM 0 HD2 HIS A 158 -7.126 -7.682 -6.026 1.00 15.42 H new ATOM 0 HE1 HIS A 158 -5.081 -10.701 -3.888 1.00 71.14 H new ATOM 0 HE2 HIS A 158 -5.819 -9.927 -6.190 1.00 64.24 H new ATOM 46 N ARG A 159 -8.677 -4.356 -4.745 1.00 12.01 N ATOM 47 CA ARG A 159 -8.819 -3.573 -5.949 1.00 62.25 C ATOM 48 C ARG A 159 -7.509 -2.861 -6.242 1.00 71.10 C ATOM 49 O ARG A 159 -6.781 -2.482 -5.321 1.00 32.34 O ATOM 50 CB ARG A 159 -9.974 -2.556 -5.843 1.00 35.41 C ATOM 51 CG ARG A 159 -10.076 -1.635 -7.054 1.00 13.12 C ATOM 52 CD ARG A 159 -11.217 -0.648 -6.963 1.00 3.42 C ATOM 53 NE ARG A 159 -11.155 0.314 -8.072 1.00 75.14 N ATOM 54 CZ ARG A 159 -12.174 1.026 -8.556 1.00 73.22 C ATOM 55 NH1 ARG A 159 -13.403 0.849 -8.098 1.00 43.03 N ATOM 56 NH2 ARG A 159 -11.952 1.915 -9.514 1.00 41.45 N ATOM 0 H ARG A 159 -8.333 -3.817 -3.950 1.00 12.01 H new ATOM 0 HA ARG A 159 -9.063 -4.249 -6.769 1.00 62.25 H new ATOM 0 HB2 ARG A 159 -10.914 -3.095 -5.724 1.00 35.41 H new ATOM 0 HB3 ARG A 159 -9.837 -1.952 -4.946 1.00 35.41 H new ATOM 0 HG2 ARG A 159 -9.140 -1.088 -7.165 1.00 13.12 H new ATOM 0 HG3 ARG A 159 -10.200 -2.240 -7.952 1.00 13.12 H new ATOM 0 HD2 ARG A 159 -12.168 -1.180 -6.988 1.00 3.42 H new ATOM 0 HD3 ARG A 159 -11.172 -0.118 -6.011 1.00 3.42 H new ATOM 0 HE ARG A 159 -10.246 0.450 -8.514 1.00 75.14 H new ATOM 0 HH11 ARG A 159 -13.580 0.161 -7.366 1.00 43.03 H new ATOM 0 HH12 ARG A 159 -14.173 1.400 -8.477 1.00 43.03 H new ATOM 0 HH21 ARG A 159 -11.008 2.050 -9.875 1.00 41.45 H new ATOM 0 HH22 ARG A 159 -12.725 2.464 -9.890 1.00 41.45 H new ATOM 68 N ARG A 160 -7.195 -2.731 -7.503 1.00 1.12 N ATOM 69 CA ARG A 160 -5.988 -2.063 -7.934 1.00 62.52 C ATOM 70 C ARG A 160 -6.305 -0.588 -8.129 1.00 11.13 C ATOM 71 O ARG A 160 -7.119 -0.235 -8.990 1.00 4.41 O ATOM 72 CB ARG A 160 -5.446 -2.646 -9.270 1.00 23.40 C ATOM 73 CG ARG A 160 -5.040 -4.133 -9.272 1.00 13.12 C ATOM 74 CD ARG A 160 -6.211 -5.086 -9.060 1.00 51.32 C ATOM 75 NE ARG A 160 -7.229 -4.935 -10.096 1.00 62.43 N ATOM 76 CZ ARG A 160 -8.390 -5.593 -10.149 1.00 63.11 C ATOM 77 NH1 ARG A 160 -8.714 -6.474 -9.204 1.00 1.30 N ATOM 78 NH2 ARG A 160 -9.219 -5.360 -11.150 1.00 55.33 N ATOM 0 H ARG A 160 -7.770 -3.086 -8.267 1.00 1.12 H new ATOM 0 HA ARG A 160 -5.221 -2.209 -7.174 1.00 62.52 H new ATOM 0 HB2 ARG A 160 -6.208 -2.502 -10.036 1.00 23.40 H new ATOM 0 HB3 ARG A 160 -4.578 -2.058 -9.569 1.00 23.40 H new ATOM 0 HG2 ARG A 160 -4.558 -4.368 -10.221 1.00 13.12 H new ATOM 0 HG3 ARG A 160 -4.300 -4.300 -8.489 1.00 13.12 H new ATOM 0 HD2 ARG A 160 -5.847 -6.113 -9.055 1.00 51.32 H new ATOM 0 HD3 ARG A 160 -6.657 -4.902 -8.083 1.00 51.32 H new ATOM 0 HE ARG A 160 -7.037 -4.269 -10.844 1.00 62.43 H new ATOM 0 HH11 ARG A 160 -8.073 -6.651 -8.431 1.00 1.30 H new ATOM 0 HH12 ARG A 160 -9.603 -6.971 -9.254 1.00 1.30 H new ATOM 0 HH21 ARG A 160 -8.970 -4.684 -11.872 1.00 55.33 H new ATOM 0 HH22 ARG A 160 -10.109 -5.856 -11.201 1.00 55.33 H new ATOM 90 N VAL A 161 -5.719 0.251 -7.325 1.00 42.43 N ATOM 91 CA VAL A 161 -5.937 1.673 -7.437 1.00 22.01 C ATOM 92 C VAL A 161 -4.714 2.371 -7.962 1.00 62.10 C ATOM 93 O VAL A 161 -3.593 2.061 -7.562 1.00 70.43 O ATOM 94 CB VAL A 161 -6.404 2.330 -6.104 1.00 74.43 C ATOM 95 CG1 VAL A 161 -7.757 1.804 -5.714 1.00 54.40 C ATOM 96 CG2 VAL A 161 -5.402 2.101 -4.974 1.00 11.42 C ATOM 0 H VAL A 161 -5.081 -0.023 -6.578 1.00 42.43 H new ATOM 0 HA VAL A 161 -6.751 1.794 -8.152 1.00 22.01 H new ATOM 0 HB VAL A 161 -6.469 3.405 -6.271 1.00 74.43 H new ATOM 0 HG11 VAL A 161 -8.073 2.270 -4.781 1.00 54.40 H new ATOM 0 HG12 VAL A 161 -8.478 2.036 -6.498 1.00 54.40 H new ATOM 0 HG13 VAL A 161 -7.703 0.724 -5.580 1.00 54.40 H new ATOM 0 HG21 VAL A 161 -5.766 2.576 -4.063 1.00 11.42 H new ATOM 0 HG22 VAL A 161 -5.284 1.031 -4.804 1.00 11.42 H new ATOM 0 HG23 VAL A 161 -4.440 2.533 -5.248 1.00 11.42 H new ATOM 102 N ARG A 162 -4.914 3.276 -8.869 1.00 4.04 N ATOM 103 CA ARG A 162 -3.812 4.018 -9.397 1.00 74.44 C ATOM 104 C ARG A 162 -3.723 5.363 -8.722 1.00 41.01 C ATOM 105 O ARG A 162 -4.672 6.169 -8.749 1.00 12.11 O ATOM 106 CB ARG A 162 -3.882 4.214 -10.909 1.00 0.02 C ATOM 107 CG ARG A 162 -2.652 4.949 -11.439 1.00 41.13 C ATOM 108 CD ARG A 162 -2.780 5.325 -12.900 1.00 34.02 C ATOM 109 NE ARG A 162 -1.657 6.178 -13.342 1.00 11.54 N ATOM 110 CZ ARG A 162 -1.489 6.650 -14.586 1.00 72.20 C ATOM 111 NH1 ARG A 162 -2.372 6.367 -15.533 1.00 62.34 N ATOM 112 NH2 ARG A 162 -0.441 7.420 -14.868 1.00 54.33 N ATOM 0 H ARG A 162 -5.825 3.518 -9.258 1.00 4.04 H new ATOM 0 HA ARG A 162 -2.919 3.427 -9.192 1.00 74.44 H new ATOM 0 HB2 ARG A 162 -3.966 3.244 -11.399 1.00 0.02 H new ATOM 0 HB3 ARG A 162 -4.780 4.777 -11.162 1.00 0.02 H new ATOM 0 HG2 ARG A 162 -2.491 5.851 -10.849 1.00 41.13 H new ATOM 0 HG3 ARG A 162 -1.772 4.319 -11.306 1.00 41.13 H new ATOM 0 HD2 ARG A 162 -2.812 4.421 -13.508 1.00 34.02 H new ATOM 0 HD3 ARG A 162 -3.722 5.850 -13.060 1.00 34.02 H new ATOM 0 HE ARG A 162 -0.954 6.427 -12.646 1.00 11.54 H new ATOM 0 HH11 ARG A 162 -3.184 5.788 -15.317 1.00 62.34 H new ATOM 0 HH12 ARG A 162 -2.240 6.728 -16.478 1.00 62.34 H new ATOM 0 HH21 ARG A 162 0.233 7.651 -14.138 1.00 54.33 H new ATOM 0 HH22 ARG A 162 -0.312 7.780 -15.814 1.00 54.33 H new ATOM 124 N LEU A 163 -2.617 5.597 -8.131 1.00 30.22 N ATOM 125 CA LEU A 163 -2.330 6.813 -7.493 1.00 14.33 C ATOM 126 C LEU A 163 -1.396 7.559 -8.393 1.00 51.15 C ATOM 127 O LEU A 163 -0.486 6.958 -8.977 1.00 61.43 O ATOM 128 CB LEU A 163 -1.651 6.563 -6.140 1.00 63.21 C ATOM 129 CG LEU A 163 -2.303 5.491 -5.275 1.00 54.30 C ATOM 130 CD1 LEU A 163 -1.639 5.419 -3.944 1.00 70.14 C ATOM 131 CD2 LEU A 163 -3.802 5.691 -5.125 1.00 14.04 C ATOM 0 H LEU A 163 -1.858 4.917 -8.078 1.00 30.22 H new ATOM 0 HA LEU A 163 -3.245 7.376 -7.308 1.00 14.33 H new ATOM 0 HB2 LEU A 163 -0.613 6.281 -6.319 1.00 63.21 H new ATOM 0 HB3 LEU A 163 -1.636 7.499 -5.581 1.00 63.21 H new ATOM 0 HG LEU A 163 -2.167 4.539 -5.789 1.00 54.30 H new ATOM 0 HD11 LEU A 163 -2.118 4.648 -3.340 1.00 70.14 H new ATOM 0 HD12 LEU A 163 -0.585 5.174 -4.076 1.00 70.14 H new ATOM 0 HD13 LEU A 163 -1.728 6.382 -3.441 1.00 70.14 H new ATOM 0 HD21 LEU A 163 -4.214 4.899 -4.499 1.00 14.04 H new ATOM 0 HD22 LEU A 163 -3.995 6.658 -4.661 1.00 14.04 H new ATOM 0 HD23 LEU A 163 -4.273 5.660 -6.107 1.00 14.04 H new ATOM 139 N LEU A 164 -1.642 8.815 -8.535 1.00 31.21 N ATOM 140 CA LEU A 164 -0.830 9.717 -9.316 1.00 44.42 C ATOM 141 C LEU A 164 -0.905 9.482 -10.831 1.00 71.43 C ATOM 142 O LEU A 164 -0.298 8.560 -11.388 1.00 71.54 O ATOM 143 CB LEU A 164 0.621 9.749 -8.837 1.00 51.21 C ATOM 144 CG LEU A 164 1.463 10.911 -9.375 1.00 1.35 C ATOM 145 CD1 LEU A 164 0.727 12.223 -9.169 1.00 22.45 C ATOM 146 CD2 LEU A 164 2.790 10.965 -8.658 1.00 3.11 C ATOM 0 H LEU A 164 -2.443 9.271 -8.098 1.00 31.21 H new ATOM 0 HA LEU A 164 -1.269 10.700 -9.144 1.00 44.42 H new ATOM 0 HB2 LEU A 164 0.626 9.792 -7.748 1.00 51.21 H new ATOM 0 HB3 LEU A 164 1.101 8.812 -9.121 1.00 51.21 H new ATOM 0 HG LEU A 164 1.635 10.754 -10.440 1.00 1.35 H new ATOM 0 HD11 LEU A 164 1.332 13.044 -9.554 1.00 22.45 H new ATOM 0 HD12 LEU A 164 -0.225 12.194 -9.700 1.00 22.45 H new ATOM 0 HD13 LEU A 164 0.544 12.375 -8.105 1.00 22.45 H new ATOM 0 HD21 LEU A 164 3.381 11.794 -9.048 1.00 3.11 H new ATOM 0 HD22 LEU A 164 2.621 11.110 -7.591 1.00 3.11 H new ATOM 0 HD23 LEU A 164 3.328 10.030 -8.817 1.00 3.11 H new ATOM 260 N LEU A 172 1.865 12.069 -2.479 1.00 14.42 N ATOM 261 CA LEU A 172 0.987 10.951 -2.843 1.00 35.33 C ATOM 262 C LEU A 172 -0.188 10.820 -1.888 1.00 4.34 C ATOM 263 O LEU A 172 -1.271 10.383 -2.278 1.00 13.44 O ATOM 264 CB LEU A 172 1.767 9.662 -2.888 1.00 15.34 C ATOM 265 CG LEU A 172 2.804 9.555 -3.996 1.00 52.25 C ATOM 266 CD1 LEU A 172 3.689 8.349 -3.778 1.00 15.10 C ATOM 267 CD2 LEU A 172 2.107 9.456 -5.355 1.00 75.35 C ATOM 0 HA LEU A 172 0.586 11.161 -3.834 1.00 35.33 H new ATOM 0 HB2 LEU A 172 2.271 9.530 -1.930 1.00 15.34 H new ATOM 0 HB3 LEU A 172 1.063 8.837 -2.994 1.00 15.34 H new ATOM 0 HG LEU A 172 3.427 10.449 -3.979 1.00 52.25 H new ATOM 0 HD11 LEU A 172 4.425 8.288 -4.580 1.00 15.10 H new ATOM 0 HD12 LEU A 172 4.202 8.443 -2.821 1.00 15.10 H new ATOM 0 HD13 LEU A 172 3.079 7.446 -3.776 1.00 15.10 H new ATOM 0 HD21 LEU A 172 2.856 9.380 -6.143 1.00 75.35 H new ATOM 0 HD22 LEU A 172 1.469 8.572 -5.373 1.00 75.35 H new ATOM 0 HD23 LEU A 172 1.499 10.346 -5.518 1.00 75.35 H new ATOM 275 N GLY A 173 0.029 11.175 -0.645 1.00 22.25 N ATOM 276 CA GLY A 173 -1.052 11.213 0.289 1.00 41.22 C ATOM 277 C GLY A 173 -1.217 9.963 1.082 1.00 61.14 C ATOM 278 O GLY A 173 -2.301 9.704 1.588 1.00 2.22 O ATOM 0 H GLY A 173 0.939 11.438 -0.266 1.00 22.25 H new ATOM 0 HA2 GLY A 173 -0.897 12.047 0.974 1.00 41.22 H new ATOM 0 HA3 GLY A 173 -1.978 11.412 -0.251 1.00 41.22 H new ATOM 282 N PHE A 174 -0.185 9.182 1.202 1.00 23.52 N ATOM 283 CA PHE A 174 -0.275 7.991 2.004 1.00 72.12 C ATOM 284 C PHE A 174 1.112 7.542 2.379 1.00 64.35 C ATOM 285 O PHE A 174 2.079 7.841 1.680 1.00 55.43 O ATOM 286 CB PHE A 174 -1.039 6.848 1.265 1.00 75.25 C ATOM 287 CG PHE A 174 -0.273 6.174 0.148 1.00 42.11 C ATOM 288 CD1 PHE A 174 0.109 6.864 -0.995 1.00 61.11 C ATOM 289 CD2 PHE A 174 0.091 4.847 0.274 1.00 52.32 C ATOM 290 CE1 PHE A 174 0.833 6.232 -1.986 1.00 11.44 C ATOM 291 CE2 PHE A 174 0.817 4.218 -0.708 1.00 22.24 C ATOM 292 CZ PHE A 174 1.186 4.909 -1.840 1.00 63.04 C ATOM 0 H PHE A 174 0.721 9.342 0.762 1.00 23.52 H new ATOM 0 HA PHE A 174 -0.844 8.224 2.904 1.00 72.12 H new ATOM 0 HB2 PHE A 174 -1.323 6.091 1.996 1.00 75.25 H new ATOM 0 HB3 PHE A 174 -1.962 7.257 0.855 1.00 75.25 H new ATOM 0 HD1 PHE A 174 -0.162 7.903 -1.109 1.00 61.11 H new ATOM 0 HD2 PHE A 174 -0.199 4.297 1.157 1.00 52.32 H new ATOM 0 HE1 PHE A 174 1.122 6.774 -2.874 1.00 11.44 H new ATOM 0 HE2 PHE A 174 1.098 3.182 -0.592 1.00 22.24 H new ATOM 0 HZ PHE A 174 1.753 4.413 -2.614 1.00 63.04 H new ATOM 302 N TYR A 175 1.200 6.853 3.463 1.00 2.35 N ATOM 303 CA TYR A 175 2.434 6.298 3.935 1.00 55.32 C ATOM 304 C TYR A 175 2.228 4.817 4.098 1.00 24.24 C ATOM 305 O TYR A 175 1.085 4.369 4.305 1.00 45.13 O ATOM 306 CB TYR A 175 2.847 6.904 5.288 1.00 23.22 C ATOM 307 CG TYR A 175 3.178 8.382 5.290 1.00 71.24 C ATOM 308 CD1 TYR A 175 2.180 9.342 5.286 1.00 71.13 C ATOM 309 CD2 TYR A 175 4.499 8.809 5.329 1.00 45.32 C ATOM 310 CE1 TYR A 175 2.486 10.682 5.315 1.00 23.01 C ATOM 311 CE2 TYR A 175 4.812 10.153 5.355 1.00 33.42 C ATOM 312 CZ TYR A 175 3.802 11.083 5.349 1.00 72.31 C ATOM 313 OH TYR A 175 4.106 12.430 5.386 1.00 3.42 O ATOM 0 H TYR A 175 0.401 6.651 4.065 1.00 2.35 H new ATOM 0 HA TYR A 175 3.227 6.519 3.220 1.00 55.32 H new ATOM 0 HB2 TYR A 175 2.039 6.734 6.000 1.00 23.22 H new ATOM 0 HB3 TYR A 175 3.716 6.359 5.656 1.00 23.22 H new ATOM 0 HD1 TYR A 175 1.145 9.033 5.260 1.00 71.13 H new ATOM 0 HD2 TYR A 175 5.294 8.078 5.339 1.00 45.32 H new ATOM 0 HE1 TYR A 175 1.696 11.418 5.311 1.00 23.01 H new ATOM 0 HE2 TYR A 175 5.844 10.471 5.380 1.00 33.42 H new ATOM 0 HH TYR A 175 5.079 12.545 5.408 1.00 3.42 H new ATOM 323 N ILE A 176 3.275 4.057 3.999 1.00 40.45 N ATOM 324 CA ILE A 176 3.165 2.630 4.154 1.00 34.24 C ATOM 325 C ILE A 176 3.895 2.159 5.402 1.00 43.43 C ATOM 326 O ILE A 176 4.678 2.896 6.004 1.00 2.32 O ATOM 327 CB ILE A 176 3.706 1.862 2.928 1.00 72.53 C ATOM 328 CG1 ILE A 176 5.211 2.132 2.738 1.00 14.24 C ATOM 329 CG2 ILE A 176 2.909 2.239 1.682 1.00 54.43 C ATOM 330 CD1 ILE A 176 5.843 1.358 1.616 1.00 34.42 C ATOM 0 H ILE A 176 4.218 4.396 3.812 1.00 40.45 H new ATOM 0 HA ILE A 176 2.101 2.414 4.249 1.00 34.24 H new ATOM 0 HB ILE A 176 3.585 0.792 3.098 1.00 72.53 H new ATOM 0 HG12 ILE A 176 5.357 3.197 2.556 1.00 14.24 H new ATOM 0 HG13 ILE A 176 5.731 1.893 3.666 1.00 14.24 H new ATOM 0 HG21 ILE A 176 3.297 1.693 0.822 1.00 54.43 H new ATOM 0 HG22 ILE A 176 1.860 1.984 1.830 1.00 54.43 H new ATOM 0 HG23 ILE A 176 3.000 3.310 1.502 1.00 54.43 H new ATOM 0 HD11 ILE A 176 6.902 1.608 1.553 1.00 34.42 H new ATOM 0 HD12 ILE A 176 5.733 0.290 1.804 1.00 34.42 H new ATOM 0 HD13 ILE A 176 5.353 1.614 0.676 1.00 34.42 H new ATOM 337 N ARG A 177 3.630 0.944 5.774 1.00 43.35 N ATOM 338 CA ARG A 177 4.228 0.312 6.927 1.00 62.45 C ATOM 339 C ARG A 177 4.394 -1.159 6.673 1.00 25.04 C ATOM 340 O ARG A 177 3.670 -1.736 5.872 1.00 33.11 O ATOM 341 CB ARG A 177 3.390 0.524 8.197 1.00 2.53 C ATOM 342 CG ARG A 177 1.922 0.197 8.014 1.00 1.11 C ATOM 343 CD ARG A 177 1.166 0.159 9.312 1.00 33.32 C ATOM 344 NE ARG A 177 -0.280 0.007 9.066 1.00 3.31 N ATOM 345 CZ ARG A 177 -1.143 -0.688 9.807 1.00 2.12 C ATOM 346 NH1 ARG A 177 -0.724 -1.368 10.874 1.00 13.10 N ATOM 347 NH2 ARG A 177 -2.437 -0.703 9.464 1.00 31.41 N ATOM 0 H ARG A 177 2.975 0.342 5.275 1.00 43.35 H new ATOM 0 HA ARG A 177 5.201 0.775 7.088 1.00 62.45 H new ATOM 0 HB2 ARG A 177 3.795 -0.095 8.997 1.00 2.53 H new ATOM 0 HB3 ARG A 177 3.486 1.562 8.517 1.00 2.53 H new ATOM 0 HG2 ARG A 177 1.469 0.939 7.357 1.00 1.11 H new ATOM 0 HG3 ARG A 177 1.829 -0.768 7.517 1.00 1.11 H new ATOM 0 HD2 ARG A 177 1.525 -0.668 9.924 1.00 33.32 H new ATOM 0 HD3 ARG A 177 1.351 1.075 9.874 1.00 33.32 H new ATOM 0 HE ARG A 177 -0.658 0.482 8.246 1.00 3.31 H new ATOM 0 HH11 ARG A 177 0.264 -1.359 11.129 1.00 13.10 H new ATOM 0 HH12 ARG A 177 -1.391 -1.897 11.436 1.00 13.10 H new ATOM 0 HH21 ARG A 177 -2.753 -0.186 8.643 1.00 31.41 H new ATOM 0 HH22 ARG A 177 -3.107 -1.231 10.023 1.00 31.41 H new ATOM 359 N ASP A 178 5.328 -1.740 7.347 1.00 63.12 N ATOM 360 CA ASP A 178 5.626 -3.159 7.237 1.00 33.13 C ATOM 361 C ASP A 178 5.225 -3.862 8.508 1.00 31.34 C ATOM 362 O ASP A 178 5.351 -3.306 9.605 1.00 13.11 O ATOM 363 CB ASP A 178 7.130 -3.362 6.987 1.00 1.40 C ATOM 364 CG ASP A 178 7.574 -4.820 7.033 1.00 13.51 C ATOM 365 OD1 ASP A 178 7.462 -5.518 6.028 1.00 34.23 O ATOM 366 OD2 ASP A 178 8.083 -5.267 8.103 1.00 44.34 O ATOM 0 H ASP A 178 5.928 -1.246 8.008 1.00 63.12 H new ATOM 0 HA ASP A 178 5.066 -3.576 6.400 1.00 33.13 H new ATOM 0 HB2 ASP A 178 7.386 -2.945 6.013 1.00 1.40 H new ATOM 0 HB3 ASP A 178 7.691 -2.798 7.732 1.00 1.40 H new ATOM 371 N GLY A 179 4.725 -5.041 8.364 1.00 70.02 N ATOM 372 CA GLY A 179 4.354 -5.861 9.478 1.00 44.21 C ATOM 373 C GLY A 179 4.294 -7.284 9.032 1.00 55.32 C ATOM 374 O GLY A 179 4.221 -7.534 7.836 1.00 51.34 O ATOM 0 H GLY A 179 4.558 -5.474 7.456 1.00 70.02 H new ATOM 0 HA2 GLY A 179 5.077 -5.749 10.286 1.00 44.21 H new ATOM 0 HA3 GLY A 179 3.387 -5.548 9.871 1.00 44.21 H new ATOM 378 N THR A 180 4.349 -8.222 9.931 1.00 22.24 N ATOM 379 CA THR A 180 4.266 -9.583 9.502 1.00 14.02 C ATOM 380 C THR A 180 2.786 -9.974 9.523 1.00 2.31 C ATOM 381 O THR A 180 2.108 -9.845 10.557 1.00 22.13 O ATOM 382 CB THR A 180 5.055 -10.507 10.419 1.00 74.41 C ATOM 383 OG1 THR A 180 6.172 -9.779 10.962 1.00 4.24 O ATOM 384 CG2 THR A 180 5.646 -11.645 9.610 1.00 30.43 C ATOM 0 H THR A 180 4.448 -8.076 10.936 1.00 22.24 H new ATOM 0 HA THR A 180 4.692 -9.681 8.503 1.00 14.02 H new ATOM 0 HB THR A 180 4.390 -10.879 11.198 1.00 74.41 H new ATOM 0 HG1 THR A 180 6.687 -10.365 11.556 1.00 4.24 H new ATOM 0 HG21 THR A 180 6.210 -12.305 10.269 1.00 30.43 H new ATOM 0 HG22 THR A 180 4.843 -12.208 9.133 1.00 30.43 H new ATOM 0 HG23 THR A 180 6.310 -11.241 8.845 1.00 30.43 H new ATOM 390 N SER A 181 2.302 -10.411 8.418 1.00 62.24 N ATOM 391 CA SER A 181 0.931 -10.734 8.241 1.00 14.33 C ATOM 392 C SER A 181 0.755 -12.232 8.275 1.00 3.53 C ATOM 393 O SER A 181 1.434 -12.939 7.551 1.00 72.12 O ATOM 394 CB SER A 181 0.515 -10.237 6.865 1.00 4.11 C ATOM 395 OG SER A 181 -0.891 -10.356 6.658 1.00 62.14 O ATOM 0 H SER A 181 2.868 -10.559 7.582 1.00 62.24 H new ATOM 0 HA SER A 181 0.332 -10.278 9.029 1.00 14.33 H new ATOM 0 HB2 SER A 181 0.812 -9.194 6.751 1.00 4.11 H new ATOM 0 HB3 SER A 181 1.044 -10.804 6.099 1.00 4.11 H new ATOM 0 HG SER A 181 -1.147 -9.855 5.856 1.00 62.14 H new ATOM 517 N LYS A 191 2.740 -16.491 8.541 1.00 44.33 N ATOM 518 CA LYS A 191 3.029 -15.138 8.888 1.00 3.41 C ATOM 519 C LYS A 191 4.205 -14.705 8.025 1.00 22.50 C ATOM 520 O LYS A 191 5.233 -15.392 7.987 1.00 25.03 O ATOM 521 CB LYS A 191 3.363 -15.045 10.365 1.00 73.22 C ATOM 522 CG LYS A 191 3.189 -13.665 10.956 1.00 35.11 C ATOM 523 CD LYS A 191 3.661 -13.604 12.396 1.00 64.23 C ATOM 524 CE LYS A 191 2.863 -14.533 13.292 1.00 3.52 C ATOM 525 NZ LYS A 191 3.358 -14.504 14.682 1.00 34.53 N ATOM 0 HA LYS A 191 2.174 -14.486 8.712 1.00 3.41 H new ATOM 0 HB2 LYS A 191 2.732 -15.744 10.913 1.00 73.22 H new ATOM 0 HB3 LYS A 191 4.395 -15.363 10.513 1.00 73.22 H new ATOM 0 HG2 LYS A 191 3.746 -12.942 10.360 1.00 35.11 H new ATOM 0 HG3 LYS A 191 2.139 -13.378 10.906 1.00 35.11 H new ATOM 0 HD2 LYS A 191 4.717 -13.871 12.444 1.00 64.23 H new ATOM 0 HD3 LYS A 191 3.574 -12.582 12.764 1.00 64.23 H new ATOM 0 HE2 LYS A 191 1.812 -14.244 13.273 1.00 3.52 H new ATOM 0 HE3 LYS A 191 2.921 -15.551 12.906 1.00 3.52 H new ATOM 0 HZ1 LYS A 191 2.790 -15.150 15.266 1.00 34.53 H new ATOM 0 HZ2 LYS A 191 4.354 -14.804 14.702 1.00 34.53 H new ATOM 0 HZ3 LYS A 191 3.280 -13.538 15.058 1.00 34.53 H new ATOM 539 N GLN A 192 4.072 -13.585 7.365 1.00 54.24 N ATOM 540 CA GLN A 192 5.023 -13.182 6.343 1.00 51.22 C ATOM 541 C GLN A 192 5.115 -11.678 6.283 1.00 62.53 C ATOM 542 O GLN A 192 4.227 -11.019 6.769 1.00 31.02 O ATOM 543 CB GLN A 192 4.628 -13.831 4.971 1.00 31.43 C ATOM 544 CG GLN A 192 3.263 -13.460 4.310 1.00 50.42 C ATOM 545 CD GLN A 192 3.170 -12.036 3.783 1.00 42.31 C ATOM 546 OE1 GLN A 192 2.717 -11.133 4.466 1.00 43.34 O ATOM 547 NE2 GLN A 192 3.627 -11.833 2.566 1.00 12.52 N ATOM 0 H GLN A 192 3.309 -12.925 7.513 1.00 54.24 H new ATOM 0 HA GLN A 192 6.021 -13.543 6.592 1.00 51.22 H new ATOM 0 HB2 GLN A 192 5.414 -13.588 4.256 1.00 31.43 H new ATOM 0 HB3 GLN A 192 4.643 -14.913 5.105 1.00 31.43 H new ATOM 0 HG2 GLN A 192 3.076 -14.149 3.486 1.00 50.42 H new ATOM 0 HG3 GLN A 192 2.469 -13.614 5.041 1.00 50.42 H new ATOM 0 HE21 GLN A 192 3.999 -12.613 2.024 1.00 12.52 H new ATOM 0 HE22 GLN A 192 3.610 -10.896 2.164 1.00 12.52 H new ATOM 555 N PRO A 193 6.193 -11.097 5.751 1.00 14.41 N ATOM 556 CA PRO A 193 6.289 -9.646 5.681 1.00 14.34 C ATOM 557 C PRO A 193 5.262 -9.058 4.708 1.00 41.12 C ATOM 558 O PRO A 193 5.164 -9.473 3.533 1.00 22.35 O ATOM 559 CB PRO A 193 7.711 -9.407 5.174 1.00 14.11 C ATOM 560 CG PRO A 193 8.109 -10.678 4.498 1.00 53.22 C ATOM 561 CD PRO A 193 7.381 -11.775 5.210 1.00 35.45 C ATOM 0 HA PRO A 193 6.086 -9.169 6.640 1.00 14.34 H new ATOM 0 HB2 PRO A 193 7.745 -8.566 4.481 1.00 14.11 H new ATOM 0 HB3 PRO A 193 8.387 -9.171 5.996 1.00 14.11 H new ATOM 0 HG2 PRO A 193 7.843 -10.657 3.441 1.00 53.22 H new ATOM 0 HG3 PRO A 193 9.187 -10.827 4.553 1.00 53.22 H new ATOM 0 HD2 PRO A 193 7.109 -12.584 4.532 1.00 35.45 H new ATOM 0 HD3 PRO A 193 7.989 -12.214 6.001 1.00 35.45 H new ATOM 569 N GLY A 194 4.553 -8.071 5.174 1.00 4.32 N ATOM 570 CA GLY A 194 3.538 -7.463 4.404 1.00 32.12 C ATOM 571 C GLY A 194 3.487 -5.998 4.637 1.00 22.41 C ATOM 572 O GLY A 194 3.846 -5.515 5.712 1.00 34.34 O ATOM 0 H GLY A 194 4.673 -7.672 6.105 1.00 4.32 H new ATOM 0 HA2 GLY A 194 3.715 -7.659 3.346 1.00 32.12 H new ATOM 0 HA3 GLY A 194 2.574 -7.907 4.654 1.00 32.12 H new ATOM 576 N ILE A 195 3.062 -5.295 3.648 1.00 43.01 N ATOM 577 CA ILE A 195 2.962 -3.887 3.718 1.00 12.31 C ATOM 578 C ILE A 195 1.524 -3.494 3.889 1.00 31.24 C ATOM 579 O ILE A 195 0.636 -4.052 3.256 1.00 40.13 O ATOM 580 CB ILE A 195 3.589 -3.167 2.476 1.00 62.01 C ATOM 581 CG1 ILE A 195 5.106 -3.347 2.413 1.00 63.22 C ATOM 582 CG2 ILE A 195 3.260 -1.680 2.451 1.00 14.22 C ATOM 583 CD1 ILE A 195 5.605 -4.736 2.067 1.00 34.41 C ATOM 0 H ILE A 195 2.770 -5.692 2.755 1.00 43.01 H new ATOM 0 HA ILE A 195 3.540 -3.561 4.582 1.00 12.31 H new ATOM 0 HB ILE A 195 3.142 -3.641 1.602 1.00 62.01 H new ATOM 0 HG12 ILE A 195 5.503 -2.648 1.677 1.00 63.22 H new ATOM 0 HG13 ILE A 195 5.524 -3.064 3.379 1.00 63.22 H new ATOM 0 HG21 ILE A 195 3.715 -1.221 1.573 1.00 14.22 H new ATOM 0 HG22 ILE A 195 2.179 -1.547 2.411 1.00 14.22 H new ATOM 0 HG23 ILE A 195 3.650 -1.206 3.351 1.00 14.22 H new ATOM 0 HD11 ILE A 195 6.695 -4.738 2.053 1.00 34.41 H new ATOM 0 HD12 ILE A 195 5.250 -5.446 2.814 1.00 34.41 H new ATOM 0 HD13 ILE A 195 5.229 -5.024 1.085 1.00 34.41 H new ATOM 590 N PHE A 196 1.308 -2.569 4.747 1.00 74.04 N ATOM 591 CA PHE A 196 0.001 -2.074 5.048 1.00 12.15 C ATOM 592 C PHE A 196 0.041 -0.573 4.896 1.00 44.43 C ATOM 593 O PHE A 196 1.131 0.016 4.830 1.00 74.33 O ATOM 594 CB PHE A 196 -0.384 -2.435 6.504 1.00 42.00 C ATOM 595 CG PHE A 196 -0.377 -3.912 6.834 1.00 51.54 C ATOM 596 CD1 PHE A 196 0.819 -4.588 7.068 1.00 21.20 C ATOM 597 CD2 PHE A 196 -1.557 -4.621 6.912 1.00 13.42 C ATOM 598 CE1 PHE A 196 0.828 -5.936 7.369 1.00 3.25 C ATOM 599 CE2 PHE A 196 -1.556 -5.969 7.216 1.00 44.13 C ATOM 600 CZ PHE A 196 -0.361 -6.626 7.443 1.00 43.13 C ATOM 0 H PHE A 196 2.051 -2.116 5.279 1.00 74.04 H new ATOM 0 HA PHE A 196 -0.736 -2.516 4.378 1.00 12.15 H new ATOM 0 HB2 PHE A 196 0.304 -1.927 7.180 1.00 42.00 H new ATOM 0 HB3 PHE A 196 -1.380 -2.040 6.706 1.00 42.00 H new ATOM 0 HD1 PHE A 196 1.754 -4.049 7.013 1.00 21.20 H new ATOM 0 HD2 PHE A 196 -2.495 -4.116 6.733 1.00 13.42 H new ATOM 0 HE1 PHE A 196 1.763 -6.446 7.545 1.00 3.25 H new ATOM 0 HE2 PHE A 196 -2.489 -6.509 7.276 1.00 44.13 H new ATOM 0 HZ PHE A 196 -0.360 -7.680 7.678 1.00 43.13 H new ATOM 610 N ILE A 197 -1.100 0.036 4.826 1.00 14.23 N ATOM 611 CA ILE A 197 -1.189 1.483 4.771 1.00 30.15 C ATOM 612 C ILE A 197 -0.937 1.994 6.177 1.00 15.25 C ATOM 613 O ILE A 197 -1.480 1.456 7.127 1.00 52.04 O ATOM 614 CB ILE A 197 -2.586 1.952 4.300 1.00 53.10 C ATOM 615 CG1 ILE A 197 -2.958 1.318 2.955 1.00 42.21 C ATOM 616 CG2 ILE A 197 -2.651 3.483 4.208 1.00 3.31 C ATOM 617 CD1 ILE A 197 -2.058 1.693 1.801 1.00 41.12 C ATOM 0 H ILE A 197 -2.000 -0.443 4.805 1.00 14.23 H new ATOM 0 HA ILE A 197 -0.460 1.869 4.058 1.00 30.15 H new ATOM 0 HB ILE A 197 -3.312 1.623 5.043 1.00 53.10 H new ATOM 0 HG12 ILE A 197 -2.948 0.234 3.066 1.00 42.21 H new ATOM 0 HG13 ILE A 197 -3.980 1.603 2.706 1.00 42.21 H new ATOM 0 HG21 ILE A 197 -3.644 3.786 3.875 1.00 3.31 H new ATOM 0 HG22 ILE A 197 -2.450 3.915 5.188 1.00 3.31 H new ATOM 0 HG23 ILE A 197 -1.906 3.837 3.496 1.00 3.31 H new ATOM 0 HD11 ILE A 197 -2.402 1.195 0.894 1.00 41.12 H new ATOM 0 HD12 ILE A 197 -2.085 2.773 1.655 1.00 41.12 H new ATOM 0 HD13 ILE A 197 -1.037 1.382 2.020 1.00 41.12 H new ATOM 624 N SER A 198 -0.090 2.949 6.339 1.00 33.44 N ATOM 625 CA SER A 198 0.193 3.397 7.671 1.00 13.12 C ATOM 626 C SER A 198 -0.561 4.685 7.989 1.00 22.53 C ATOM 627 O SER A 198 -1.110 4.849 9.086 1.00 24.45 O ATOM 628 CB SER A 198 1.688 3.557 7.870 1.00 51.20 C ATOM 629 OG SER A 198 2.198 4.645 7.158 1.00 70.30 O ATOM 0 H SER A 198 0.412 3.429 5.592 1.00 33.44 H new ATOM 0 HA SER A 198 -0.157 2.639 8.372 1.00 13.12 H new ATOM 0 HB2 SER A 198 1.900 3.687 8.931 1.00 51.20 H new ATOM 0 HB3 SER A 198 2.195 2.646 7.552 1.00 51.20 H new ATOM 0 HG SER A 198 3.002 4.369 6.670 1.00 70.30 H new ATOM 635 N ARG A 199 -0.605 5.574 7.033 1.00 44.11 N ATOM 636 CA ARG A 199 -1.276 6.841 7.180 1.00 12.10 C ATOM 637 C ARG A 199 -1.819 7.249 5.832 1.00 40.52 C ATOM 638 O ARG A 199 -1.181 7.005 4.816 1.00 2.44 O ATOM 639 CB ARG A 199 -0.286 7.908 7.689 1.00 42.11 C ATOM 640 CG ARG A 199 -0.894 9.293 7.901 1.00 33.13 C ATOM 641 CD ARG A 199 -1.935 9.286 9.007 1.00 51.34 C ATOM 642 NE ARG A 199 -2.554 10.602 9.185 1.00 10.41 N ATOM 643 CZ ARG A 199 -3.555 10.872 10.033 1.00 41.53 C ATOM 644 NH1 ARG A 199 -4.079 9.915 10.785 1.00 64.41 N ATOM 645 NH2 ARG A 199 -4.023 12.102 10.122 1.00 23.44 N ATOM 0 H ARG A 199 -0.172 5.439 6.120 1.00 44.11 H new ATOM 0 HA ARG A 199 -2.088 6.751 7.902 1.00 12.10 H new ATOM 0 HB2 ARG A 199 0.143 7.566 8.631 1.00 42.11 H new ATOM 0 HB3 ARG A 199 0.535 7.992 6.977 1.00 42.11 H new ATOM 0 HG2 ARG A 199 -0.105 10.003 8.149 1.00 33.13 H new ATOM 0 HG3 ARG A 199 -1.351 9.636 6.973 1.00 33.13 H new ATOM 0 HD2 ARG A 199 -2.706 8.551 8.775 1.00 51.34 H new ATOM 0 HD3 ARG A 199 -1.469 8.975 9.942 1.00 51.34 H new ATOM 0 HE ARG A 199 -2.195 11.372 8.620 1.00 10.41 H new ATOM 0 HH11 ARG A 199 -3.720 8.962 10.721 1.00 64.41 H new ATOM 0 HH12 ARG A 199 -4.841 10.131 11.428 1.00 64.41 H new ATOM 0 HH21 ARG A 199 -3.623 12.843 9.546 1.00 23.44 H new ATOM 0 HH22 ARG A 199 -4.785 12.312 10.766 1.00 23.44 H new ATOM 657 N LEU A 200 -2.989 7.821 5.815 1.00 30.54 N ATOM 658 CA LEU A 200 -3.587 8.272 4.607 1.00 51.24 C ATOM 659 C LEU A 200 -3.857 9.777 4.783 1.00 11.21 C ATOM 660 O LEU A 200 -4.546 10.184 5.725 1.00 54.22 O ATOM 661 CB LEU A 200 -4.878 7.473 4.399 1.00 71.11 C ATOM 662 CG LEU A 200 -5.344 7.286 2.970 1.00 74.34 C ATOM 663 CD1 LEU A 200 -6.550 6.367 2.915 1.00 2.34 C ATOM 664 CD2 LEU A 200 -5.636 8.596 2.275 1.00 64.21 C ATOM 0 H LEU A 200 -3.553 7.985 6.649 1.00 30.54 H new ATOM 0 HA LEU A 200 -2.956 8.125 3.731 1.00 51.24 H new ATOM 0 HB2 LEU A 200 -4.742 6.487 4.844 1.00 71.11 H new ATOM 0 HB3 LEU A 200 -5.676 7.966 4.954 1.00 71.11 H new ATOM 0 HG LEU A 200 -4.520 6.821 2.428 1.00 74.34 H new ATOM 0 HD11 LEU A 200 -6.868 6.246 1.880 1.00 2.34 H new ATOM 0 HD12 LEU A 200 -6.285 5.394 3.329 1.00 2.34 H new ATOM 0 HD13 LEU A 200 -7.364 6.800 3.497 1.00 2.34 H new ATOM 0 HD21 LEU A 200 -5.966 8.401 1.255 1.00 64.21 H new ATOM 0 HD22 LEU A 200 -6.420 9.127 2.815 1.00 64.21 H new ATOM 0 HD23 LEU A 200 -4.733 9.206 2.254 1.00 64.21 H new ATOM 672 N VAL A 201 -3.329 10.576 3.894 1.00 14.02 N ATOM 673 CA VAL A 201 -3.369 12.030 4.022 1.00 44.21 C ATOM 674 C VAL A 201 -4.381 12.647 3.052 1.00 5.54 C ATOM 675 O VAL A 201 -4.327 12.390 1.839 1.00 55.51 O ATOM 676 CB VAL A 201 -1.977 12.644 3.709 1.00 54.42 C ATOM 677 CG1 VAL A 201 -1.946 14.143 3.966 1.00 34.33 C ATOM 678 CG2 VAL A 201 -0.872 11.934 4.466 1.00 4.20 C ATOM 0 H VAL A 201 -2.855 10.247 3.053 1.00 14.02 H new ATOM 0 HA VAL A 201 -3.662 12.250 5.049 1.00 44.21 H new ATOM 0 HB VAL A 201 -1.797 12.495 2.644 1.00 54.42 H new ATOM 0 HG11 VAL A 201 -0.954 14.531 3.734 1.00 34.33 H new ATOM 0 HG12 VAL A 201 -2.685 14.636 3.335 1.00 34.33 H new ATOM 0 HG13 VAL A 201 -2.176 14.337 5.014 1.00 34.33 H new ATOM 0 HG21 VAL A 201 0.087 12.390 4.222 1.00 4.20 H new ATOM 0 HG22 VAL A 201 -1.052 12.019 5.538 1.00 4.20 H new ATOM 0 HG23 VAL A 201 -0.855 10.881 4.183 1.00 4.20 H new ATOM 684 N PRO A 202 -5.309 13.469 3.566 1.00 31.31 N ATOM 685 CA PRO A 202 -6.269 14.176 2.735 1.00 13.25 C ATOM 686 C PRO A 202 -5.587 15.280 1.932 1.00 71.14 C ATOM 687 O PRO A 202 -4.848 16.105 2.481 1.00 52.24 O ATOM 688 CB PRO A 202 -7.274 14.749 3.734 1.00 13.43 C ATOM 689 CG PRO A 202 -6.523 14.858 5.017 1.00 73.40 C ATOM 690 CD PRO A 202 -5.489 13.770 5.003 1.00 10.30 C ATOM 0 HA PRO A 202 -6.744 13.530 1.997 1.00 13.25 H new ATOM 0 HB2 PRO A 202 -7.643 15.722 3.409 1.00 13.43 H new ATOM 0 HB3 PRO A 202 -8.142 14.098 3.839 1.00 13.43 H new ATOM 0 HG2 PRO A 202 -6.054 15.837 5.109 1.00 73.40 H new ATOM 0 HG3 PRO A 202 -7.193 14.744 5.869 1.00 73.40 H new ATOM 0 HD2 PRO A 202 -4.557 14.099 5.462 1.00 10.30 H new ATOM 0 HD3 PRO A 202 -5.825 12.893 5.556 1.00 10.30 H new ATOM 698 N GLY A 203 -5.815 15.284 0.644 1.00 1.51 N ATOM 699 CA GLY A 203 -5.177 16.246 -0.216 1.00 14.52 C ATOM 700 C GLY A 203 -4.235 15.559 -1.166 1.00 63.11 C ATOM 701 O GLY A 203 -3.839 16.120 -2.185 1.00 30.31 O ATOM 0 H GLY A 203 -6.438 14.632 0.168 1.00 1.51 H new ATOM 0 HA2 GLY A 203 -5.931 16.797 -0.777 1.00 14.52 H new ATOM 0 HA3 GLY A 203 -4.631 16.974 0.384 1.00 14.52 H new ATOM 705 N GLY A 204 -3.878 14.341 -0.827 1.00 5.45 N ATOM 706 CA GLY A 204 -3.013 13.561 -1.662 1.00 70.14 C ATOM 707 C GLY A 204 -3.821 12.643 -2.551 1.00 4.44 C ATOM 708 O GLY A 204 -5.033 12.487 -2.339 1.00 2.42 O ATOM 0 H GLY A 204 -4.179 13.873 0.028 1.00 5.45 H new ATOM 0 HA2 GLY A 204 -2.397 14.220 -2.274 1.00 70.14 H new ATOM 0 HA3 GLY A 204 -2.334 12.973 -1.044 1.00 70.14 H new ATOM 712 N LEU A 205 -3.168 11.987 -3.500 1.00 65.13 N ATOM 713 CA LEU A 205 -3.837 11.180 -4.492 1.00 11.20 C ATOM 714 C LEU A 205 -4.534 9.973 -3.874 1.00 74.43 C ATOM 715 O LEU A 205 -5.555 9.500 -4.388 1.00 74.34 O ATOM 716 CB LEU A 205 -2.867 10.733 -5.593 1.00 43.22 C ATOM 717 CG LEU A 205 -2.202 11.828 -6.457 1.00 63.22 C ATOM 718 CD1 LEU A 205 -3.220 12.827 -6.989 1.00 32.41 C ATOM 719 CD2 LEU A 205 -1.052 12.517 -5.738 1.00 65.42 C ATOM 0 H LEU A 205 -2.153 12.004 -3.598 1.00 65.13 H new ATOM 0 HA LEU A 205 -4.604 11.809 -4.942 1.00 11.20 H new ATOM 0 HB2 LEU A 205 -2.075 10.149 -5.124 1.00 43.22 H new ATOM 0 HB3 LEU A 205 -3.406 10.061 -6.261 1.00 43.22 H new ATOM 0 HG LEU A 205 -1.768 11.322 -7.319 1.00 63.22 H new ATOM 0 HD11 LEU A 205 -2.711 13.580 -7.591 1.00 32.41 H new ATOM 0 HD12 LEU A 205 -3.954 12.306 -7.604 1.00 32.41 H new ATOM 0 HD13 LEU A 205 -3.725 13.312 -6.153 1.00 32.41 H new ATOM 0 HD21 LEU A 205 -0.620 13.277 -6.388 1.00 65.42 H new ATOM 0 HD22 LEU A 205 -1.422 12.987 -4.827 1.00 65.42 H new ATOM 0 HD23 LEU A 205 -0.289 11.781 -5.483 1.00 65.42 H new ATOM 727 N ALA A 206 -3.985 9.487 -2.779 1.00 62.43 N ATOM 728 CA ALA A 206 -4.563 8.367 -2.069 1.00 42.41 C ATOM 729 C ALA A 206 -5.957 8.715 -1.538 1.00 41.43 C ATOM 730 O ALA A 206 -6.891 7.936 -1.673 1.00 12.43 O ATOM 731 CB ALA A 206 -3.652 7.930 -0.943 1.00 55.32 C ATOM 0 H ALA A 206 -3.131 9.855 -2.359 1.00 62.43 H new ATOM 0 HA ALA A 206 -4.670 7.537 -2.768 1.00 42.41 H new ATOM 0 HB1 ALA A 206 -4.101 7.087 -0.418 1.00 55.32 H new ATOM 0 HB2 ALA A 206 -2.686 7.631 -1.351 1.00 55.32 H new ATOM 0 HB3 ALA A 206 -3.511 8.757 -0.247 1.00 55.32 H new ATOM 737 N GLU A 207 -6.098 9.886 -0.963 1.00 1.35 N ATOM 738 CA GLU A 207 -7.384 10.298 -0.445 1.00 24.44 C ATOM 739 C GLU A 207 -8.272 10.702 -1.624 1.00 53.44 C ATOM 740 O GLU A 207 -9.476 10.479 -1.611 1.00 44.25 O ATOM 741 CB GLU A 207 -7.213 11.419 0.601 1.00 73.24 C ATOM 742 CG GLU A 207 -8.439 11.708 1.496 1.00 4.33 C ATOM 743 CD GLU A 207 -9.616 12.294 0.777 1.00 25.11 C ATOM 744 OE1 GLU A 207 -9.516 13.438 0.305 1.00 65.41 O ATOM 745 OE2 GLU A 207 -10.670 11.643 0.718 1.00 51.21 O ATOM 0 H GLU A 207 -5.347 10.566 -0.842 1.00 1.35 H new ATOM 0 HA GLU A 207 -7.872 9.477 0.079 1.00 24.44 H new ATOM 0 HB2 GLU A 207 -6.372 11.162 1.245 1.00 73.24 H new ATOM 0 HB3 GLU A 207 -6.946 12.338 0.079 1.00 73.24 H new ATOM 0 HG2 GLU A 207 -8.749 10.779 1.975 1.00 4.33 H new ATOM 0 HG3 GLU A 207 -8.139 12.391 2.290 1.00 4.33 H new ATOM 752 N SER A 208 -7.656 11.271 -2.659 1.00 73.32 N ATOM 753 CA SER A 208 -8.381 11.641 -3.857 1.00 71.33 C ATOM 754 C SER A 208 -9.103 10.421 -4.458 1.00 61.20 C ATOM 755 O SER A 208 -10.266 10.528 -4.861 1.00 54.41 O ATOM 756 CB SER A 208 -7.451 12.291 -4.872 1.00 44.34 C ATOM 757 OG SER A 208 -6.839 13.451 -4.317 1.00 31.14 O ATOM 0 H SER A 208 -6.658 11.482 -2.685 1.00 73.32 H new ATOM 0 HA SER A 208 -9.140 12.374 -3.585 1.00 71.33 H new ATOM 0 HB2 SER A 208 -6.684 11.580 -5.179 1.00 44.34 H new ATOM 0 HB3 SER A 208 -8.012 12.561 -5.767 1.00 44.34 H new ATOM 0 HG SER A 208 -6.202 13.184 -3.622 1.00 31.14 H new ATOM 763 N THR A 209 -8.434 9.255 -4.500 1.00 22.11 N ATOM 764 CA THR A 209 -9.120 8.067 -4.956 1.00 25.34 C ATOM 765 C THR A 209 -10.094 7.617 -3.858 1.00 40.02 C ATOM 766 O THR A 209 -11.238 7.266 -4.142 1.00 73.32 O ATOM 767 CB THR A 209 -8.145 6.885 -5.399 1.00 20.13 C ATOM 768 OG1 THR A 209 -8.879 5.816 -5.976 1.00 20.42 O ATOM 769 CG2 THR A 209 -7.309 6.333 -4.250 1.00 42.14 C ATOM 0 H THR A 209 -7.458 9.126 -4.232 1.00 22.11 H new ATOM 0 HA THR A 209 -9.665 8.323 -5.865 1.00 25.34 H new ATOM 0 HB THR A 209 -7.466 7.323 -6.131 1.00 20.13 H new ATOM 0 HG1 THR A 209 -8.263 5.102 -6.242 1.00 20.42 H new ATOM 0 HG21 THR A 209 -6.668 5.532 -4.619 1.00 42.14 H new ATOM 0 HG22 THR A 209 -6.692 7.129 -3.834 1.00 42.14 H new ATOM 0 HG23 THR A 209 -7.969 5.942 -3.475 1.00 42.14 H new ATOM 775 N GLY A 210 -9.634 7.697 -2.594 1.00 61.11 N ATOM 776 CA GLY A 210 -10.455 7.366 -1.438 1.00 72.23 C ATOM 777 C GLY A 210 -11.025 5.972 -1.493 1.00 24.11 C ATOM 778 O GLY A 210 -12.104 5.715 -0.972 1.00 43.30 O ATOM 0 H GLY A 210 -8.687 7.992 -2.358 1.00 61.11 H new ATOM 0 HA2 GLY A 210 -9.856 7.471 -0.533 1.00 72.23 H new ATOM 0 HA3 GLY A 210 -11.273 8.083 -1.364 1.00 72.23 H new ATOM 782 N LEU A 211 -10.320 5.077 -2.135 1.00 3.23 N ATOM 783 CA LEU A 211 -10.792 3.719 -2.274 1.00 71.31 C ATOM 784 C LEU A 211 -10.058 2.810 -1.321 1.00 45.24 C ATOM 785 O LEU A 211 -10.460 1.672 -1.108 1.00 43.24 O ATOM 786 CB LEU A 211 -10.611 3.238 -3.709 1.00 3.14 C ATOM 787 CG LEU A 211 -11.265 4.104 -4.786 1.00 55.55 C ATOM 788 CD1 LEU A 211 -11.060 3.497 -6.163 1.00 34.24 C ATOM 789 CD2 LEU A 211 -12.749 4.319 -4.510 1.00 43.12 C ATOM 0 H LEU A 211 -9.416 5.261 -2.571 1.00 3.23 H new ATOM 0 HA LEU A 211 -11.854 3.694 -2.031 1.00 71.31 H new ATOM 0 HB2 LEU A 211 -9.543 3.174 -3.919 1.00 3.14 H new ATOM 0 HB3 LEU A 211 -11.013 2.228 -3.788 1.00 3.14 H new ATOM 0 HG LEU A 211 -10.780 5.080 -4.761 1.00 55.55 H new ATOM 0 HD11 LEU A 211 -11.534 4.130 -6.914 1.00 34.24 H new ATOM 0 HD12 LEU A 211 -9.993 3.422 -6.372 1.00 34.24 H new ATOM 0 HD13 LEU A 211 -11.506 2.503 -6.193 1.00 34.24 H new ATOM 0 HD21 LEU A 211 -13.179 4.939 -5.297 1.00 43.12 H new ATOM 0 HD22 LEU A 211 -13.258 3.356 -4.488 1.00 43.12 H new ATOM 0 HD23 LEU A 211 -12.872 4.816 -3.548 1.00 43.12 H new ATOM 797 N LEU A 212 -8.994 3.325 -0.758 1.00 43.31 N ATOM 798 CA LEU A 212 -8.175 2.567 0.182 1.00 34.15 C ATOM 799 C LEU A 212 -8.277 3.193 1.567 1.00 3.14 C ATOM 800 O LEU A 212 -8.650 4.371 1.689 1.00 1.42 O ATOM 801 CB LEU A 212 -6.678 2.474 -0.266 1.00 23.21 C ATOM 802 CG LEU A 212 -5.775 3.722 -0.137 1.00 3.53 C ATOM 803 CD1 LEU A 212 -4.336 3.386 -0.539 1.00 15.22 C ATOM 804 CD2 LEU A 212 -6.286 4.888 -0.956 1.00 15.34 C ATOM 0 H LEU A 212 -8.664 4.275 -0.930 1.00 43.31 H new ATOM 0 HA LEU A 212 -8.559 1.547 0.207 1.00 34.15 H new ATOM 0 HB2 LEU A 212 -6.213 1.672 0.307 1.00 23.21 H new ATOM 0 HB3 LEU A 212 -6.667 2.167 -1.312 1.00 23.21 H new ATOM 0 HG LEU A 212 -5.796 4.025 0.910 1.00 3.53 H new ATOM 0 HD11 LEU A 212 -3.714 4.276 -0.442 1.00 15.22 H new ATOM 0 HD12 LEU A 212 -3.950 2.601 0.112 1.00 15.22 H new ATOM 0 HD13 LEU A 212 -4.318 3.041 -1.573 1.00 15.22 H new ATOM 0 HD21 LEU A 212 -5.618 5.740 -0.832 1.00 15.34 H new ATOM 0 HD22 LEU A 212 -6.322 4.605 -2.008 1.00 15.34 H new ATOM 0 HD23 LEU A 212 -7.286 5.159 -0.618 1.00 15.34 H new ATOM 812 N ALA A 213 -7.986 2.421 2.581 1.00 43.45 N ATOM 813 CA ALA A 213 -8.018 2.879 3.962 1.00 15.01 C ATOM 814 C ALA A 213 -6.720 2.495 4.675 1.00 60.43 C ATOM 815 O ALA A 213 -5.961 1.679 4.180 1.00 24.43 O ATOM 816 CB ALA A 213 -9.225 2.298 4.691 1.00 55.24 C ATOM 0 H ALA A 213 -7.716 1.443 2.479 1.00 43.45 H new ATOM 0 HA ALA A 213 -8.109 3.965 3.968 1.00 15.01 H new ATOM 0 HB1 ALA A 213 -9.232 2.651 5.722 1.00 55.24 H new ATOM 0 HB2 ALA A 213 -10.140 2.617 4.192 1.00 55.24 H new ATOM 0 HB3 ALA A 213 -9.167 1.210 4.681 1.00 55.24 H new ATOM 822 N VAL A 214 -6.472 3.090 5.837 1.00 4.04 N ATOM 823 CA VAL A 214 -5.262 2.831 6.614 1.00 10.43 C ATOM 824 C VAL A 214 -5.149 1.383 7.111 1.00 61.23 C ATOM 825 O VAL A 214 -4.063 0.858 7.314 1.00 24.41 O ATOM 826 CB VAL A 214 -5.067 3.834 7.762 1.00 23.41 C ATOM 827 CG1 VAL A 214 -4.929 5.238 7.210 1.00 30.20 C ATOM 828 CG2 VAL A 214 -6.196 3.751 8.788 1.00 2.31 C ATOM 0 H VAL A 214 -7.103 3.766 6.268 1.00 4.04 H new ATOM 0 HA VAL A 214 -4.443 2.979 5.910 1.00 10.43 H new ATOM 0 HB VAL A 214 -4.147 3.573 8.284 1.00 23.41 H new ATOM 0 HG11 VAL A 214 -4.791 5.940 8.032 1.00 30.20 H new ATOM 0 HG12 VAL A 214 -4.067 5.284 6.545 1.00 30.20 H new ATOM 0 HG13 VAL A 214 -5.830 5.501 6.655 1.00 30.20 H new ATOM 0 HG21 VAL A 214 -6.020 4.476 9.582 1.00 2.31 H new ATOM 0 HG22 VAL A 214 -7.147 3.970 8.301 1.00 2.31 H new ATOM 0 HG23 VAL A 214 -6.228 2.748 9.213 1.00 2.31 H new ATOM 834 N ASN A 215 -6.266 0.769 7.343 1.00 53.11 N ATOM 835 CA ASN A 215 -6.295 -0.615 7.824 1.00 41.44 C ATOM 836 C ASN A 215 -6.006 -1.601 6.711 1.00 21.52 C ATOM 837 O ASN A 215 -5.711 -2.773 6.971 1.00 32.31 O ATOM 838 CB ASN A 215 -7.627 -0.954 8.486 1.00 33.24 C ATOM 839 CG ASN A 215 -7.874 -0.155 9.737 1.00 32.33 C ATOM 840 OD1 ASN A 215 -6.939 0.228 10.438 1.00 43.44 O ATOM 841 ND2 ASN A 215 -9.116 0.100 10.030 1.00 13.51 N ATOM 0 H ASN A 215 -7.186 1.190 7.212 1.00 53.11 H new ATOM 0 HA ASN A 215 -5.507 -0.700 8.572 1.00 41.44 H new ATOM 0 HB2 ASN A 215 -8.436 -0.773 7.778 1.00 33.24 H new ATOM 0 HB3 ASN A 215 -7.648 -2.016 8.728 1.00 33.24 H new ATOM 0 HD21 ASN A 215 -9.343 0.636 10.868 1.00 13.51 H new ATOM 0 HD22 ASN A 215 -9.863 -0.236 9.422 1.00 13.51 H new ATOM 847 N ASP A 216 -6.085 -1.129 5.495 1.00 20.41 N ATOM 848 CA ASP A 216 -5.942 -1.961 4.318 1.00 21.43 C ATOM 849 C ASP A 216 -4.523 -2.499 4.147 1.00 2.50 C ATOM 850 O ASP A 216 -3.523 -1.841 4.512 1.00 14.52 O ATOM 851 CB ASP A 216 -6.399 -1.221 3.053 1.00 50.51 C ATOM 852 CG ASP A 216 -7.870 -0.804 3.082 1.00 21.32 C ATOM 853 OD1 ASP A 216 -8.550 -0.981 4.140 1.00 44.45 O ATOM 854 OD2 ASP A 216 -8.354 -0.282 2.058 1.00 23.32 O ATOM 0 H ASP A 216 -6.252 -0.145 5.286 1.00 20.41 H new ATOM 0 HA ASP A 216 -6.593 -2.822 4.469 1.00 21.43 H new ATOM 0 HB2 ASP A 216 -5.781 -0.333 2.919 1.00 50.51 H new ATOM 0 HB3 ASP A 216 -6.229 -1.861 2.187 1.00 50.51 H new ATOM 859 N GLU A 217 -4.451 -3.688 3.591 1.00 2.52 N ATOM 860 CA GLU A 217 -3.212 -4.407 3.388 1.00 64.41 C ATOM 861 C GLU A 217 -2.833 -4.450 1.912 1.00 64.41 C ATOM 862 O GLU A 217 -3.667 -4.767 1.056 1.00 54.54 O ATOM 863 CB GLU A 217 -3.320 -5.816 3.981 1.00 63.21 C ATOM 864 CG GLU A 217 -2.135 -6.714 3.691 1.00 12.53 C ATOM 865 CD GLU A 217 -2.238 -8.066 4.347 1.00 31.55 C ATOM 866 OE1 GLU A 217 -3.296 -8.716 4.251 1.00 43.02 O ATOM 867 OE2 GLU A 217 -1.236 -8.528 4.900 1.00 43.53 O ATOM 0 H GLU A 217 -5.272 -4.194 3.259 1.00 2.52 H new ATOM 0 HA GLU A 217 -2.414 -3.877 3.907 1.00 64.41 H new ATOM 0 HB2 GLU A 217 -3.441 -5.733 5.061 1.00 63.21 H new ATOM 0 HB3 GLU A 217 -4.222 -6.291 3.595 1.00 63.21 H new ATOM 0 HG2 GLU A 217 -2.044 -6.847 2.613 1.00 12.53 H new ATOM 0 HG3 GLU A 217 -1.223 -6.222 4.030 1.00 12.53 H new ATOM 874 N VAL A 218 -1.568 -4.166 1.634 1.00 24.52 N ATOM 875 CA VAL A 218 -1.052 -4.074 0.283 1.00 4.55 C ATOM 876 C VAL A 218 -0.681 -5.461 -0.266 1.00 23.41 C ATOM 877 O VAL A 218 -0.035 -6.275 0.403 1.00 41.21 O ATOM 878 CB VAL A 218 0.177 -3.114 0.201 1.00 20.22 C ATOM 879 CG1 VAL A 218 0.635 -2.928 -1.235 1.00 30.24 C ATOM 880 CG2 VAL A 218 -0.133 -1.762 0.836 1.00 22.33 C ATOM 0 H VAL A 218 -0.865 -3.991 2.353 1.00 24.52 H new ATOM 0 HA VAL A 218 -1.848 -3.659 -0.335 1.00 4.55 H new ATOM 0 HB VAL A 218 0.988 -3.578 0.762 1.00 20.22 H new ATOM 0 HG11 VAL A 218 1.492 -2.255 -1.259 1.00 30.24 H new ATOM 0 HG12 VAL A 218 0.920 -3.893 -1.654 1.00 30.24 H new ATOM 0 HG13 VAL A 218 -0.178 -2.503 -1.824 1.00 30.24 H new ATOM 0 HG21 VAL A 218 0.742 -1.116 0.763 1.00 22.33 H new ATOM 0 HG22 VAL A 218 -0.970 -1.298 0.314 1.00 22.33 H new ATOM 0 HG23 VAL A 218 -0.393 -1.904 1.885 1.00 22.33 H new ATOM 886 N ILE A 219 -1.104 -5.698 -1.480 1.00 4.44 N ATOM 887 CA ILE A 219 -0.906 -6.941 -2.187 1.00 63.23 C ATOM 888 C ILE A 219 0.222 -6.810 -3.229 1.00 63.41 C ATOM 889 O ILE A 219 1.223 -7.550 -3.191 1.00 65.02 O ATOM 890 CB ILE A 219 -2.240 -7.350 -2.905 1.00 31.41 C ATOM 891 CG1 ILE A 219 -3.362 -7.571 -1.870 1.00 72.41 C ATOM 892 CG2 ILE A 219 -2.062 -8.599 -3.772 1.00 74.55 C ATOM 893 CD1 ILE A 219 -3.068 -8.668 -0.877 1.00 21.34 C ATOM 0 H ILE A 219 -1.616 -5.005 -2.026 1.00 4.44 H new ATOM 0 HA ILE A 219 -0.620 -7.708 -1.467 1.00 63.23 H new ATOM 0 HB ILE A 219 -2.521 -6.530 -3.565 1.00 31.41 H new ATOM 0 HG12 ILE A 219 -3.533 -6.640 -1.329 1.00 72.41 H new ATOM 0 HG13 ILE A 219 -4.287 -7.808 -2.396 1.00 72.41 H new ATOM 0 HG21 ILE A 219 -3.009 -8.848 -4.251 1.00 74.55 H new ATOM 0 HG22 ILE A 219 -1.308 -8.407 -4.536 1.00 74.55 H new ATOM 0 HG23 ILE A 219 -1.741 -9.433 -3.147 1.00 74.55 H new ATOM 0 HD11 ILE A 219 -3.903 -8.763 -0.183 1.00 21.34 H new ATOM 0 HD12 ILE A 219 -2.927 -9.610 -1.407 1.00 21.34 H new ATOM 0 HD13 ILE A 219 -2.161 -8.424 -0.323 1.00 21.34 H new ATOM 900 N GLU A 220 0.073 -5.858 -4.122 1.00 4.41 N ATOM 901 CA GLU A 220 0.998 -5.668 -5.214 1.00 2.51 C ATOM 902 C GLU A 220 1.004 -4.213 -5.639 1.00 43.11 C ATOM 903 O GLU A 220 0.105 -3.439 -5.256 1.00 25.31 O ATOM 904 CB GLU A 220 0.594 -6.558 -6.401 1.00 54.42 C ATOM 905 CG GLU A 220 -0.816 -6.333 -6.878 1.00 44.35 C ATOM 906 CD GLU A 220 -1.173 -7.136 -8.094 1.00 61.32 C ATOM 907 OE1 GLU A 220 -1.634 -8.281 -7.949 1.00 54.22 O ATOM 908 OE2 GLU A 220 -1.019 -6.627 -9.216 1.00 23.32 O ATOM 0 H GLU A 220 -0.698 -5.190 -4.110 1.00 4.41 H new ATOM 0 HA GLU A 220 1.999 -5.946 -4.885 1.00 2.51 H new ATOM 0 HB2 GLU A 220 1.280 -6.378 -7.228 1.00 54.42 H new ATOM 0 HB3 GLU A 220 0.708 -7.603 -6.114 1.00 54.42 H new ATOM 0 HG2 GLU A 220 -1.507 -6.581 -6.073 1.00 44.35 H new ATOM 0 HG3 GLU A 220 -0.952 -5.274 -7.099 1.00 44.35 H new ATOM 915 N VAL A 221 2.004 -3.843 -6.405 1.00 13.52 N ATOM 916 CA VAL A 221 2.135 -2.519 -6.928 1.00 65.45 C ATOM 917 C VAL A 221 2.516 -2.576 -8.431 1.00 1.41 C ATOM 918 O VAL A 221 3.492 -3.237 -8.823 1.00 34.44 O ATOM 919 CB VAL A 221 3.176 -1.675 -6.118 1.00 41.45 C ATOM 920 CG1 VAL A 221 4.520 -2.300 -6.160 1.00 0.11 C ATOM 921 CG2 VAL A 221 3.235 -0.243 -6.610 1.00 63.15 C ATOM 0 H VAL A 221 2.758 -4.471 -6.682 1.00 13.52 H new ATOM 0 HA VAL A 221 1.171 -2.020 -6.827 1.00 65.45 H new ATOM 0 HB VAL A 221 2.842 -1.657 -5.081 1.00 41.45 H new ATOM 0 HG11 VAL A 221 5.222 -1.692 -5.589 1.00 0.11 H new ATOM 0 HG12 VAL A 221 4.470 -3.299 -5.727 1.00 0.11 H new ATOM 0 HG13 VAL A 221 4.857 -2.369 -7.194 1.00 0.11 H new ATOM 0 HG21 VAL A 221 3.968 0.313 -6.025 1.00 63.15 H new ATOM 0 HG22 VAL A 221 3.525 -0.231 -7.661 1.00 63.15 H new ATOM 0 HG23 VAL A 221 2.255 0.221 -6.499 1.00 63.15 H new ATOM 927 N ASN A 222 1.698 -1.931 -9.254 1.00 40.44 N ATOM 928 CA ASN A 222 1.882 -1.808 -10.726 1.00 3.54 C ATOM 929 C ASN A 222 1.764 -3.192 -11.410 1.00 42.13 C ATOM 930 O ASN A 222 2.075 -3.366 -12.582 1.00 10.31 O ATOM 931 CB ASN A 222 3.246 -1.137 -11.030 1.00 43.52 C ATOM 932 CG ASN A 222 3.404 -0.631 -12.462 1.00 61.31 C ATOM 933 OD1 ASN A 222 3.843 -1.353 -13.351 1.00 75.42 O ATOM 934 ND2 ASN A 222 3.095 0.637 -12.674 1.00 12.41 N ATOM 0 H ASN A 222 0.857 -1.459 -8.922 1.00 40.44 H new ATOM 0 HA ASN A 222 1.092 -1.177 -11.134 1.00 3.54 H new ATOM 0 HB2 ASN A 222 3.384 -0.300 -10.346 1.00 43.52 H new ATOM 0 HB3 ASN A 222 4.042 -1.852 -10.822 1.00 43.52 H new ATOM 0 HD21 ASN A 222 3.219 1.044 -13.601 1.00 12.41 H new ATOM 0 HD22 ASN A 222 2.732 1.208 -11.911 1.00 12.41 H new ATOM 940 N GLY A 223 1.264 -4.152 -10.670 1.00 72.22 N ATOM 941 CA GLY A 223 1.138 -5.493 -11.185 1.00 44.22 C ATOM 942 C GLY A 223 2.156 -6.434 -10.577 1.00 74.30 C ATOM 943 O GLY A 223 2.081 -7.649 -10.765 1.00 43.03 O ATOM 0 H GLY A 223 0.938 -4.030 -9.711 1.00 72.22 H new ATOM 0 HA2 GLY A 223 0.134 -5.866 -10.983 1.00 44.22 H new ATOM 0 HA3 GLY A 223 1.260 -5.478 -12.268 1.00 44.22 H new ATOM 947 N ILE A 224 3.104 -5.884 -9.843 1.00 14.31 N ATOM 948 CA ILE A 224 4.137 -6.676 -9.219 1.00 3.10 C ATOM 949 C ILE A 224 3.874 -6.797 -7.728 1.00 72.22 C ATOM 950 O ILE A 224 3.728 -5.791 -7.033 1.00 24.11 O ATOM 951 CB ILE A 224 5.544 -6.077 -9.440 1.00 42.20 C ATOM 952 CG1 ILE A 224 5.859 -5.985 -10.941 1.00 43.44 C ATOM 953 CG2 ILE A 224 6.580 -6.932 -8.723 1.00 64.42 C ATOM 954 CD1 ILE A 224 7.216 -5.391 -11.256 1.00 41.53 C ATOM 0 H ILE A 224 3.177 -4.882 -9.665 1.00 14.31 H new ATOM 0 HA ILE A 224 4.112 -7.661 -9.686 1.00 3.10 H new ATOM 0 HB ILE A 224 5.573 -5.068 -9.028 1.00 42.20 H new ATOM 0 HG12 ILE A 224 5.803 -6.984 -11.374 1.00 43.44 H new ATOM 0 HG13 ILE A 224 5.090 -5.383 -11.426 1.00 43.44 H new ATOM 0 HG21 ILE A 224 7.572 -6.509 -8.879 1.00 64.42 H new ATOM 0 HG22 ILE A 224 6.359 -6.953 -7.656 1.00 64.42 H new ATOM 0 HG23 ILE A 224 6.552 -7.947 -9.120 1.00 64.42 H new ATOM 0 HD11 ILE A 224 7.359 -5.362 -12.336 1.00 41.53 H new ATOM 0 HD12 ILE A 224 7.272 -4.379 -10.855 1.00 41.53 H new ATOM 0 HD13 ILE A 224 7.995 -6.004 -10.803 1.00 41.53 H new ATOM 961 N GLU A 225 3.801 -8.020 -7.264 1.00 13.35 N ATOM 962 CA GLU A 225 3.533 -8.360 -5.872 1.00 53.22 C ATOM 963 C GLU A 225 4.545 -7.736 -4.909 1.00 42.11 C ATOM 964 O GLU A 225 5.742 -7.628 -5.207 1.00 5.35 O ATOM 965 CB GLU A 225 3.555 -9.879 -5.716 1.00 65.11 C ATOM 966 CG GLU A 225 4.907 -10.490 -6.037 1.00 2.05 C ATOM 967 CD GLU A 225 4.880 -11.994 -6.074 1.00 12.52 C ATOM 968 OE1 GLU A 225 4.611 -12.562 -7.154 1.00 20.43 O ATOM 969 OE2 GLU A 225 5.126 -12.630 -5.038 1.00 24.02 O ATOM 0 H GLU A 225 3.929 -8.839 -7.858 1.00 13.35 H new ATOM 0 HA GLU A 225 2.553 -7.957 -5.617 1.00 53.22 H new ATOM 0 HB2 GLU A 225 3.279 -10.137 -4.694 1.00 65.11 H new ATOM 0 HB3 GLU A 225 2.801 -10.317 -6.370 1.00 65.11 H new ATOM 0 HG2 GLU A 225 5.249 -10.115 -7.001 1.00 2.05 H new ATOM 0 HG3 GLU A 225 5.633 -10.164 -5.292 1.00 2.05 H new ATOM 976 N VAL A 226 4.057 -7.322 -3.770 1.00 73.23 N ATOM 977 CA VAL A 226 4.911 -6.800 -2.716 1.00 32.14 C ATOM 978 C VAL A 226 4.783 -7.650 -1.493 1.00 54.01 C ATOM 979 O VAL A 226 5.462 -7.432 -0.491 1.00 34.50 O ATOM 980 CB VAL A 226 4.608 -5.334 -2.361 1.00 4.41 C ATOM 981 CG1 VAL A 226 4.874 -4.447 -3.539 1.00 72.44 C ATOM 982 CG2 VAL A 226 3.182 -5.165 -1.879 1.00 1.51 C ATOM 0 H VAL A 226 3.063 -7.333 -3.539 1.00 73.23 H new ATOM 0 HA VAL A 226 5.932 -6.829 -3.096 1.00 32.14 H new ATOM 0 HB VAL A 226 5.270 -5.043 -1.545 1.00 4.41 H new ATOM 0 HG11 VAL A 226 4.655 -3.413 -3.273 1.00 72.44 H new ATOM 0 HG12 VAL A 226 5.921 -4.533 -3.830 1.00 72.44 H new ATOM 0 HG13 VAL A 226 4.240 -4.749 -4.372 1.00 72.44 H new ATOM 0 HG21 VAL A 226 3.002 -4.118 -1.637 1.00 1.51 H new ATOM 0 HG22 VAL A 226 2.493 -5.480 -2.663 1.00 1.51 H new ATOM 0 HG23 VAL A 226 3.024 -5.775 -0.990 1.00 1.51 H new ATOM 988 N ALA A 227 3.936 -8.640 -1.586 1.00 51.21 N ATOM 989 CA ALA A 227 3.684 -9.505 -0.478 1.00 45.12 C ATOM 990 C ALA A 227 4.826 -10.482 -0.324 1.00 61.42 C ATOM 991 O ALA A 227 4.926 -11.451 -1.056 1.00 60.10 O ATOM 992 CB ALA A 227 2.352 -10.221 -0.644 1.00 74.23 C ATOM 0 H ALA A 227 3.407 -8.864 -2.429 1.00 51.21 H new ATOM 0 HA ALA A 227 3.618 -8.910 0.433 1.00 45.12 H new ATOM 0 HB1 ALA A 227 2.181 -10.874 0.212 1.00 74.23 H new ATOM 0 HB2 ALA A 227 1.549 -9.486 -0.706 1.00 74.23 H new ATOM 0 HB3 ALA A 227 2.370 -10.816 -1.557 1.00 74.23 H new ATOM 998 N GLY A 228 5.711 -10.180 0.583 1.00 40.31 N ATOM 999 CA GLY A 228 6.837 -11.036 0.826 1.00 63.53 C ATOM 1000 C GLY A 228 8.145 -10.328 0.562 1.00 3.33 C ATOM 1001 O GLY A 228 9.212 -10.818 0.947 1.00 54.54 O ATOM 0 H GLY A 228 5.674 -9.345 1.168 1.00 40.31 H new ATOM 0 HA2 GLY A 228 6.813 -11.384 1.859 1.00 63.53 H new ATOM 0 HA3 GLY A 228 6.767 -11.919 0.191 1.00 63.53 H new ATOM 1005 N LYS A 229 8.066 -9.180 -0.108 1.00 43.43 N ATOM 1006 CA LYS A 229 9.265 -8.385 -0.431 1.00 34.30 C ATOM 1007 C LYS A 229 9.753 -7.622 0.799 1.00 75.30 C ATOM 1008 O LYS A 229 9.156 -7.707 1.880 1.00 51.23 O ATOM 1009 CB LYS A 229 8.962 -7.363 -1.532 1.00 15.51 C ATOM 1010 CG LYS A 229 8.344 -7.936 -2.781 1.00 54.24 C ATOM 1011 CD LYS A 229 9.211 -8.982 -3.427 1.00 62.34 C ATOM 1012 CE LYS A 229 8.476 -9.606 -4.586 1.00 74.41 C ATOM 1013 NZ LYS A 229 9.283 -10.633 -5.285 1.00 42.31 N ATOM 0 H LYS A 229 7.191 -8.775 -0.440 1.00 43.43 H new ATOM 0 HA LYS A 229 10.032 -9.081 -0.770 1.00 34.30 H new ATOM 0 HB2 LYS A 229 8.291 -6.605 -1.128 1.00 15.51 H new ATOM 0 HB3 LYS A 229 9.889 -6.857 -1.803 1.00 15.51 H new ATOM 0 HG2 LYS A 229 7.376 -8.373 -2.536 1.00 54.24 H new ATOM 0 HG3 LYS A 229 8.160 -7.131 -3.493 1.00 54.24 H new ATOM 0 HD2 LYS A 229 10.142 -8.533 -3.773 1.00 62.34 H new ATOM 0 HD3 LYS A 229 9.478 -9.748 -2.698 1.00 62.34 H new ATOM 0 HE2 LYS A 229 7.553 -10.059 -4.225 1.00 74.41 H new ATOM 0 HE3 LYS A 229 8.193 -8.827 -5.294 1.00 74.41 H new ATOM 0 HZ1 LYS A 229 8.732 -11.030 -6.073 1.00 42.31 H new ATOM 0 HZ2 LYS A 229 10.153 -10.199 -5.655 1.00 42.31 H new ATOM 0 HZ3 LYS A 229 9.532 -11.392 -4.619 1.00 42.31 H new ATOM 1027 N THR A 230 10.821 -6.872 0.635 1.00 20.41 N ATOM 1028 CA THR A 230 11.334 -6.062 1.704 1.00 40.13 C ATOM 1029 C THR A 230 10.776 -4.664 1.547 1.00 25.15 C ATOM 1030 O THR A 230 10.298 -4.311 0.454 1.00 2.34 O ATOM 1031 CB THR A 230 12.879 -6.025 1.702 1.00 20.33 C ATOM 1032 OG1 THR A 230 13.347 -5.575 0.430 1.00 45.12 O ATOM 1033 CG2 THR A 230 13.460 -7.402 1.999 1.00 0.11 C ATOM 0 H THR A 230 11.349 -6.810 -0.235 1.00 20.41 H new ATOM 0 HA THR A 230 11.027 -6.492 2.657 1.00 40.13 H new ATOM 0 HB THR A 230 13.205 -5.337 2.482 1.00 20.33 H new ATOM 0 HG1 THR A 230 14.327 -5.551 0.432 1.00 45.12 H new ATOM 0 HG21 THR A 230 14.549 -7.347 1.991 1.00 0.11 H new ATOM 0 HG22 THR A 230 13.120 -7.736 2.979 1.00 0.11 H new ATOM 0 HG23 THR A 230 13.127 -8.109 1.239 1.00 0.11 H new ATOM 1039 N LEU A 231 10.835 -3.869 2.591 1.00 3.42 N ATOM 1040 CA LEU A 231 10.298 -2.541 2.557 1.00 75.21 C ATOM 1041 C LEU A 231 11.078 -1.708 1.517 1.00 75.22 C ATOM 1042 O LEU A 231 10.509 -0.859 0.831 1.00 55.52 O ATOM 1043 CB LEU A 231 10.343 -1.955 3.994 1.00 53.20 C ATOM 1044 CG LEU A 231 9.569 -0.651 4.313 1.00 21.20 C ATOM 1045 CD1 LEU A 231 10.151 0.566 3.626 1.00 33.34 C ATOM 1046 CD2 LEU A 231 8.085 -0.795 3.993 1.00 11.44 C ATOM 0 H LEU A 231 11.257 -4.130 3.482 1.00 3.42 H new ATOM 0 HA LEU A 231 9.255 -2.530 2.241 1.00 75.21 H new ATOM 0 HB2 LEU A 231 9.977 -2.726 4.672 1.00 53.20 H new ATOM 0 HB3 LEU A 231 11.390 -1.782 4.243 1.00 53.20 H new ATOM 0 HG LEU A 231 9.679 -0.488 5.385 1.00 21.20 H new ATOM 0 HD11 LEU A 231 9.565 1.447 3.889 1.00 33.34 H new ATOM 0 HD12 LEU A 231 11.183 0.707 3.948 1.00 33.34 H new ATOM 0 HD13 LEU A 231 10.124 0.422 2.546 1.00 33.34 H new ATOM 0 HD21 LEU A 231 7.570 0.137 4.228 1.00 11.44 H new ATOM 0 HD22 LEU A 231 7.961 -1.021 2.934 1.00 11.44 H new ATOM 0 HD23 LEU A 231 7.661 -1.604 4.588 1.00 11.44 H new ATOM 1054 N ASP A 232 12.363 -1.994 1.374 1.00 33.02 N ATOM 1055 CA ASP A 232 13.182 -1.326 0.363 1.00 3.21 C ATOM 1056 C ASP A 232 12.676 -1.656 -1.024 1.00 61.44 C ATOM 1057 O ASP A 232 12.440 -0.763 -1.828 1.00 21.15 O ATOM 1058 CB ASP A 232 14.643 -1.725 0.473 1.00 15.24 C ATOM 1059 CG ASP A 232 15.521 -1.004 -0.538 1.00 54.41 C ATOM 1060 OD1 ASP A 232 15.853 0.183 -0.301 1.00 43.34 O ATOM 1061 OD2 ASP A 232 15.894 -1.600 -1.574 1.00 34.30 O ATOM 0 H ASP A 232 12.863 -2.680 1.940 1.00 33.02 H new ATOM 0 HA ASP A 232 13.105 -0.253 0.538 1.00 3.21 H new ATOM 0 HB2 ASP A 232 15.001 -1.509 1.480 1.00 15.24 H new ATOM 0 HB3 ASP A 232 14.734 -2.801 0.327 1.00 15.24 H new ATOM 1066 N GLN A 233 12.476 -2.952 -1.283 1.00 73.22 N ATOM 1067 CA GLN A 233 11.982 -3.422 -2.573 1.00 33.31 C ATOM 1068 C GLN A 233 10.656 -2.804 -2.942 1.00 63.22 C ATOM 1069 O GLN A 233 10.455 -2.404 -4.090 1.00 23.32 O ATOM 1070 CB GLN A 233 11.873 -4.942 -2.619 1.00 22.42 C ATOM 1071 CG GLN A 233 13.200 -5.656 -2.658 1.00 1.33 C ATOM 1072 CD GLN A 233 13.048 -7.154 -2.618 1.00 1.10 C ATOM 1073 OE1 GLN A 233 12.925 -7.808 -3.648 1.00 75.50 O ATOM 1074 NE2 GLN A 233 13.088 -7.707 -1.441 1.00 20.11 N ATOM 0 H GLN A 233 12.651 -3.696 -0.608 1.00 73.22 H new ATOM 0 HA GLN A 233 12.720 -3.102 -3.308 1.00 33.31 H new ATOM 0 HB2 GLN A 233 11.316 -5.282 -1.746 1.00 22.42 H new ATOM 0 HB3 GLN A 233 11.294 -5.227 -3.497 1.00 22.42 H new ATOM 0 HG2 GLN A 233 13.736 -5.372 -3.564 1.00 1.33 H new ATOM 0 HG3 GLN A 233 13.808 -5.333 -1.813 1.00 1.33 H new ATOM 0 HE21 GLN A 233 13.191 -7.127 -0.608 1.00 20.11 H new ATOM 0 HE22 GLN A 233 13.016 -8.720 -1.351 1.00 20.11 H new ATOM 1082 N VAL A 234 9.761 -2.694 -1.976 1.00 23.22 N ATOM 1083 CA VAL A 234 8.437 -2.170 -2.248 1.00 43.23 C ATOM 1084 C VAL A 234 8.468 -0.656 -2.454 1.00 52.34 C ATOM 1085 O VAL A 234 7.722 -0.126 -3.277 1.00 75.32 O ATOM 1086 CB VAL A 234 7.421 -2.552 -1.159 1.00 51.45 C ATOM 1087 CG1 VAL A 234 7.454 -4.045 -0.912 1.00 15.52 C ATOM 1088 CG2 VAL A 234 7.654 -1.772 0.113 1.00 50.13 C ATOM 0 H VAL A 234 9.926 -2.958 -1.005 1.00 23.22 H new ATOM 0 HA VAL A 234 8.104 -2.634 -3.176 1.00 43.23 H new ATOM 0 HB VAL A 234 6.424 -2.288 -1.513 1.00 51.45 H new ATOM 0 HG11 VAL A 234 6.730 -4.302 -0.139 1.00 15.52 H new ATOM 0 HG12 VAL A 234 7.204 -4.572 -1.833 1.00 15.52 H new ATOM 0 HG13 VAL A 234 8.452 -4.338 -0.586 1.00 15.52 H new ATOM 0 HG21 VAL A 234 6.918 -2.067 0.861 1.00 50.13 H new ATOM 0 HG22 VAL A 234 8.656 -1.979 0.488 1.00 50.13 H new ATOM 0 HG23 VAL A 234 7.556 -0.706 -0.091 1.00 50.13 H new ATOM 1094 N THR A 235 9.345 0.036 -1.733 1.00 2.01 N ATOM 1095 CA THR A 235 9.454 1.466 -1.884 1.00 62.44 C ATOM 1096 C THR A 235 10.093 1.758 -3.232 1.00 73.25 C ATOM 1097 O THR A 235 9.688 2.674 -3.942 1.00 21.12 O ATOM 1098 CB THR A 235 10.292 2.111 -0.758 1.00 14.25 C ATOM 1099 OG1 THR A 235 9.796 1.684 0.522 1.00 74.02 O ATOM 1100 CG2 THR A 235 10.173 3.625 -0.829 1.00 15.24 C ATOM 0 H THR A 235 9.980 -0.373 -1.048 1.00 2.01 H new ATOM 0 HA THR A 235 8.454 1.896 -1.824 1.00 62.44 H new ATOM 0 HB THR A 235 11.332 1.808 -0.882 1.00 14.25 H new ATOM 0 HG1 THR A 235 9.778 0.705 0.556 1.00 74.02 H new ATOM 0 HG21 THR A 235 10.766 4.074 -0.032 1.00 15.24 H new ATOM 0 HG22 THR A 235 10.539 3.974 -1.795 1.00 15.24 H new ATOM 0 HG23 THR A 235 9.129 3.914 -0.711 1.00 15.24 H new ATOM 1106 N ASP A 236 11.060 0.921 -3.598 1.00 65.11 N ATOM 1107 CA ASP A 236 11.740 1.025 -4.883 1.00 70.25 C ATOM 1108 C ASP A 236 10.743 0.880 -6.014 1.00 44.03 C ATOM 1109 O ASP A 236 10.863 1.552 -7.053 1.00 74.51 O ATOM 1110 CB ASP A 236 12.834 -0.027 -4.999 1.00 32.15 C ATOM 1111 CG ASP A 236 13.593 0.053 -6.297 1.00 33.02 C ATOM 1112 OD1 ASP A 236 14.381 1.001 -6.484 1.00 25.25 O ATOM 1113 OD2 ASP A 236 13.410 -0.833 -7.157 1.00 1.42 O ATOM 0 H ASP A 236 11.393 0.154 -3.013 1.00 65.11 H new ATOM 0 HA ASP A 236 12.205 2.008 -4.950 1.00 70.25 H new ATOM 0 HB2 ASP A 236 13.531 0.089 -4.169 1.00 32.15 H new ATOM 0 HB3 ASP A 236 12.389 -1.018 -4.905 1.00 32.15 H new ATOM 1118 N MET A 237 9.729 0.014 -5.799 1.00 32.25 N ATOM 1119 CA MET A 237 8.646 -0.146 -6.761 1.00 33.24 C ATOM 1120 C MET A 237 7.965 1.188 -6.924 1.00 10.22 C ATOM 1121 O MET A 237 7.832 1.698 -8.001 1.00 65.52 O ATOM 1122 CB MET A 237 7.560 -1.093 -6.254 1.00 22.13 C ATOM 1123 CG MET A 237 7.950 -2.478 -5.885 1.00 73.43 C ATOM 1124 SD MET A 237 8.340 -3.538 -7.253 1.00 21.23 S ATOM 1125 CE MET A 237 8.349 -5.079 -6.353 1.00 61.15 C ATOM 0 H MET A 237 9.648 -0.576 -4.971 1.00 32.25 H new ATOM 0 HA MET A 237 9.083 -0.536 -7.680 1.00 33.24 H new ATOM 0 HB2 MET A 237 7.099 -0.633 -5.380 1.00 22.13 H new ATOM 0 HB3 MET A 237 6.790 -1.158 -7.023 1.00 22.13 H new ATOM 0 HG2 MET A 237 8.815 -2.432 -5.223 1.00 73.43 H new ATOM 0 HG3 MET A 237 7.137 -2.929 -5.316 1.00 73.43 H new ATOM 0 HE1 MET A 237 8.765 -5.866 -6.983 1.00 61.15 H new ATOM 0 HE2 MET A 237 8.958 -4.972 -5.455 1.00 61.15 H new ATOM 0 HE3 MET A 237 7.329 -5.341 -6.071 1.00 61.15 H new ATOM 1135 N MET A 238 7.582 1.756 -5.793 1.00 71.02 N ATOM 1136 CA MET A 238 6.814 2.997 -5.718 1.00 73.41 C ATOM 1137 C MET A 238 7.559 4.180 -6.328 1.00 71.43 C ATOM 1138 O MET A 238 6.957 5.027 -6.970 1.00 21.21 O ATOM 1139 CB MET A 238 6.413 3.266 -4.261 1.00 53.44 C ATOM 1140 CG MET A 238 5.568 2.171 -3.683 1.00 15.12 C ATOM 1141 SD MET A 238 5.153 2.424 -1.964 1.00 3.33 S ATOM 1142 CE MET A 238 4.454 0.823 -1.618 1.00 71.31 C ATOM 0 H MET A 238 7.799 1.362 -4.878 1.00 71.02 H new ATOM 0 HA MET A 238 5.911 2.875 -6.316 1.00 73.41 H new ATOM 0 HB2 MET A 238 7.312 3.383 -3.656 1.00 53.44 H new ATOM 0 HB3 MET A 238 5.867 4.208 -4.206 1.00 53.44 H new ATOM 0 HG2 MET A 238 4.648 2.088 -4.262 1.00 15.12 H new ATOM 0 HG3 MET A 238 6.096 1.223 -3.786 1.00 15.12 H new ATOM 0 HE1 MET A 238 3.429 0.942 -1.267 1.00 71.31 H new ATOM 0 HE2 MET A 238 4.459 0.220 -2.526 1.00 71.31 H new ATOM 0 HE3 MET A 238 5.046 0.326 -0.849 1.00 71.31 H new ATOM 1152 N VAL A 239 8.862 4.215 -6.141 1.00 14.44 N ATOM 1153 CA VAL A 239 9.691 5.251 -6.725 1.00 51.32 C ATOM 1154 C VAL A 239 9.745 5.092 -8.256 1.00 40.32 C ATOM 1155 O VAL A 239 9.734 6.078 -9.009 1.00 64.21 O ATOM 1156 CB VAL A 239 11.124 5.216 -6.131 1.00 74.43 C ATOM 1157 CG1 VAL A 239 12.007 6.254 -6.781 1.00 33.44 C ATOM 1158 CG2 VAL A 239 11.080 5.442 -4.630 1.00 60.32 C ATOM 0 H VAL A 239 9.374 3.531 -5.584 1.00 14.44 H new ATOM 0 HA VAL A 239 9.246 6.217 -6.486 1.00 51.32 H new ATOM 0 HB VAL A 239 11.546 4.231 -6.332 1.00 74.43 H new ATOM 0 HG11 VAL A 239 13.005 6.207 -6.345 1.00 33.44 H new ATOM 0 HG12 VAL A 239 12.069 6.060 -7.852 1.00 33.44 H new ATOM 0 HG13 VAL A 239 11.585 7.245 -6.616 1.00 33.44 H new ATOM 0 HG21 VAL A 239 12.093 5.415 -4.228 1.00 60.32 H new ATOM 0 HG22 VAL A 239 10.633 6.414 -4.421 1.00 60.32 H new ATOM 0 HG23 VAL A 239 10.483 4.660 -4.162 1.00 60.32 H new ATOM 1164 N ALA A 240 9.768 3.854 -8.704 1.00 72.54 N ATOM 1165 CA ALA A 240 9.802 3.540 -10.128 1.00 43.53 C ATOM 1166 C ALA A 240 8.435 3.786 -10.751 1.00 33.33 C ATOM 1167 O ALA A 240 8.311 4.260 -11.874 1.00 41.51 O ATOM 1168 CB ALA A 240 10.229 2.093 -10.319 1.00 43.31 C ATOM 0 H ALA A 240 9.764 3.034 -8.097 1.00 72.54 H new ATOM 0 HA ALA A 240 10.524 4.188 -10.626 1.00 43.53 H new ATOM 0 HB1 ALA A 240 10.254 1.859 -11.383 1.00 43.31 H new ATOM 0 HB2 ALA A 240 11.221 1.947 -9.892 1.00 43.31 H new ATOM 0 HB3 ALA A 240 9.518 1.435 -9.819 1.00 43.31 H new ATOM 1174 N ASN A 241 7.424 3.488 -9.990 1.00 1.24 N ATOM 1175 CA ASN A 241 6.034 3.641 -10.392 1.00 75.11 C ATOM 1176 C ASN A 241 5.537 5.040 -10.075 1.00 62.50 C ATOM 1177 O ASN A 241 4.360 5.263 -9.981 1.00 11.14 O ATOM 1178 CB ASN A 241 5.173 2.604 -9.663 1.00 12.23 C ATOM 1179 CG ASN A 241 5.592 1.184 -9.974 1.00 51.53 C ATOM 1180 OD1 ASN A 241 6.052 0.873 -11.075 1.00 33.34 O ATOM 1181 ND2 ASN A 241 5.474 0.318 -9.003 1.00 44.22 N ATOM 0 H ASN A 241 7.533 3.121 -9.045 1.00 1.24 H new ATOM 0 HA ASN A 241 5.960 3.485 -11.468 1.00 75.11 H new ATOM 0 HB2 ASN A 241 5.239 2.772 -8.588 1.00 12.23 H new ATOM 0 HB3 ASN A 241 4.129 2.741 -9.943 1.00 12.23 H new ATOM 0 HD21 ASN A 241 5.767 -0.649 -9.144 1.00 44.22 H new ATOM 0 HD22 ASN A 241 5.089 0.609 -8.104 1.00 44.22 H new ATOM 1187 N SER A 242 6.445 5.979 -9.944 1.00 2.13 N ATOM 1188 CA SER A 242 6.089 7.349 -9.593 1.00 43.22 C ATOM 1189 C SER A 242 5.133 8.027 -10.614 1.00 24.32 C ATOM 1190 O SER A 242 4.376 8.904 -10.257 1.00 52.45 O ATOM 1191 CB SER A 242 7.350 8.178 -9.354 1.00 33.15 C ATOM 1192 OG SER A 242 8.260 8.053 -10.446 1.00 13.54 O ATOM 0 H SER A 242 7.445 5.825 -10.075 1.00 2.13 H new ATOM 0 HA SER A 242 5.520 7.300 -8.665 1.00 43.22 H new ATOM 0 HB2 SER A 242 7.080 9.225 -9.219 1.00 33.15 H new ATOM 0 HB3 SER A 242 7.834 7.852 -8.433 1.00 33.15 H new ATOM 0 HG SER A 242 8.944 7.386 -10.227 1.00 13.54 H new ATOM 1198 N SER A 243 5.184 7.625 -11.868 1.00 73.33 N ATOM 1199 CA SER A 243 4.282 8.181 -12.869 1.00 42.50 C ATOM 1200 C SER A 243 2.932 7.447 -12.900 1.00 13.13 C ATOM 1201 O SER A 243 1.979 7.890 -13.553 1.00 62.21 O ATOM 1202 CB SER A 243 4.948 8.164 -14.229 1.00 34.03 C ATOM 1203 OG SER A 243 6.148 8.933 -14.193 1.00 33.21 O ATOM 0 H SER A 243 5.833 6.922 -12.221 1.00 73.33 H new ATOM 0 HA SER A 243 4.068 9.214 -12.594 1.00 42.50 H new ATOM 0 HB2 SER A 243 5.172 7.138 -14.521 1.00 34.03 H new ATOM 0 HB3 SER A 243 4.270 8.568 -14.981 1.00 34.03 H new ATOM 0 HG SER A 243 6.574 8.916 -15.075 1.00 33.21 H new ATOM 1209 N ASN A 244 2.859 6.347 -12.188 1.00 64.10 N ATOM 1210 CA ASN A 244 1.685 5.500 -12.166 1.00 30.34 C ATOM 1211 C ASN A 244 1.725 4.533 -11.005 1.00 10.14 C ATOM 1212 O ASN A 244 2.075 3.346 -11.157 1.00 11.15 O ATOM 1213 CB ASN A 244 1.458 4.772 -13.527 1.00 71.02 C ATOM 1214 CG ASN A 244 2.711 4.080 -14.114 1.00 43.41 C ATOM 1215 OD1 ASN A 244 3.616 3.630 -13.401 1.00 32.33 O ATOM 1216 ND2 ASN A 244 2.765 4.005 -15.421 1.00 33.24 N ATOM 0 H ASN A 244 3.621 6.009 -11.600 1.00 64.10 H new ATOM 0 HA ASN A 244 0.823 6.150 -12.017 1.00 30.34 H new ATOM 0 HB2 ASN A 244 0.676 4.024 -13.396 1.00 71.02 H new ATOM 0 HB3 ASN A 244 1.088 5.497 -14.252 1.00 71.02 H new ATOM 0 HD21 ASN A 244 3.567 3.567 -15.874 1.00 33.24 H new ATOM 0 HD22 ASN A 244 2.005 4.384 -15.985 1.00 33.24 H new ATOM 1222 N LEU A 245 1.408 5.019 -9.825 1.00 11.23 N ATOM 1223 CA LEU A 245 1.541 4.182 -8.683 1.00 75.21 C ATOM 1224 C LEU A 245 0.271 3.368 -8.547 1.00 24.40 C ATOM 1225 O LEU A 245 -0.724 3.852 -8.098 1.00 40.43 O ATOM 1226 CB LEU A 245 1.737 5.046 -7.434 1.00 53.41 C ATOM 1227 CG LEU A 245 2.561 4.448 -6.296 1.00 54.44 C ATOM 1228 CD1 LEU A 245 2.592 5.371 -5.123 1.00 24.43 C ATOM 1229 CD2 LEU A 245 2.060 3.110 -5.898 1.00 51.23 C ATOM 0 H LEU A 245 1.067 5.964 -9.646 1.00 11.23 H new ATOM 0 HA LEU A 245 2.402 3.523 -8.793 1.00 75.21 H new ATOM 0 HB2 LEU A 245 2.210 5.980 -7.739 1.00 53.41 H new ATOM 0 HB3 LEU A 245 0.753 5.301 -7.041 1.00 53.41 H new ATOM 0 HG LEU A 245 3.579 4.320 -6.663 1.00 54.44 H new ATOM 0 HD11 LEU A 245 3.184 4.925 -4.324 1.00 24.43 H new ATOM 0 HD12 LEU A 245 3.038 6.320 -5.419 1.00 24.43 H new ATOM 0 HD13 LEU A 245 1.576 5.543 -4.768 1.00 24.43 H new ATOM 0 HD21 LEU A 245 2.673 2.719 -5.086 1.00 51.23 H new ATOM 0 HD22 LEU A 245 1.026 3.193 -5.564 1.00 51.23 H new ATOM 0 HD23 LEU A 245 2.113 2.433 -6.751 1.00 51.23 H new ATOM 1237 N ILE A 246 0.311 2.148 -8.941 1.00 12.20 N ATOM 1238 CA ILE A 246 -0.860 1.328 -8.834 1.00 44.23 C ATOM 1239 C ILE A 246 -0.687 0.376 -7.680 1.00 51.22 C ATOM 1240 O ILE A 246 0.186 -0.447 -7.695 1.00 13.44 O ATOM 1241 CB ILE A 246 -1.124 0.548 -10.147 1.00 31.14 C ATOM 1242 CG1 ILE A 246 -1.286 1.521 -11.322 1.00 43.14 C ATOM 1243 CG2 ILE A 246 -2.363 -0.335 -10.013 1.00 53.13 C ATOM 1244 CD1 ILE A 246 -1.480 0.846 -12.664 1.00 12.32 C ATOM 0 H ILE A 246 1.130 1.689 -9.339 1.00 12.20 H new ATOM 0 HA ILE A 246 -1.725 1.968 -8.657 1.00 44.23 H new ATOM 0 HB ILE A 246 -0.266 -0.095 -10.341 1.00 31.14 H new ATOM 0 HG12 ILE A 246 -2.140 2.170 -11.127 1.00 43.14 H new ATOM 0 HG13 ILE A 246 -0.405 2.161 -11.374 1.00 43.14 H new ATOM 0 HG21 ILE A 246 -2.529 -0.873 -10.946 1.00 53.13 H new ATOM 0 HG22 ILE A 246 -2.215 -1.050 -9.204 1.00 53.13 H new ATOM 0 HG23 ILE A 246 -3.231 0.287 -9.793 1.00 53.13 H new ATOM 0 HD11 ILE A 246 -1.586 1.604 -13.440 1.00 12.32 H new ATOM 0 HD12 ILE A 246 -0.616 0.219 -12.884 1.00 12.32 H new ATOM 0 HD13 ILE A 246 -2.378 0.228 -12.634 1.00 12.32 H new ATOM 1251 N ILE A 247 -1.502 0.504 -6.696 1.00 60.24 N ATOM 1252 CA ILE A 247 -1.431 -0.337 -5.535 1.00 43.23 C ATOM 1253 C ILE A 247 -2.690 -1.134 -5.356 1.00 13.44 C ATOM 1254 O ILE A 247 -3.790 -0.647 -5.560 1.00 52.52 O ATOM 1255 CB ILE A 247 -1.048 0.461 -4.242 1.00 12.33 C ATOM 1256 CG1 ILE A 247 0.447 0.746 -4.232 1.00 3.43 C ATOM 1257 CG2 ILE A 247 -1.477 -0.240 -2.971 1.00 52.44 C ATOM 1258 CD1 ILE A 247 0.928 1.553 -3.049 1.00 2.53 C ATOM 0 H ILE A 247 -2.248 1.199 -6.664 1.00 60.24 H new ATOM 0 HA ILE A 247 -0.621 -1.046 -5.705 1.00 43.23 H new ATOM 0 HB ILE A 247 -1.594 1.404 -4.267 1.00 12.33 H new ATOM 0 HG12 ILE A 247 0.984 -0.202 -4.250 1.00 3.43 H new ATOM 0 HG13 ILE A 247 0.708 1.277 -5.147 1.00 3.43 H new ATOM 0 HG21 ILE A 247 -1.185 0.359 -2.109 1.00 52.44 H new ATOM 0 HG22 ILE A 247 -2.559 -0.369 -2.974 1.00 52.44 H new ATOM 0 HG23 ILE A 247 -0.996 -1.216 -2.914 1.00 52.44 H new ATOM 0 HD11 ILE A 247 2.004 1.707 -3.127 1.00 2.53 H new ATOM 0 HD12 ILE A 247 0.423 2.519 -3.038 1.00 2.53 H new ATOM 0 HD13 ILE A 247 0.704 1.016 -2.127 1.00 2.53 H new ATOM 1265 N THR A 248 -2.514 -2.364 -5.035 1.00 55.02 N ATOM 1266 CA THR A 248 -3.586 -3.237 -4.786 1.00 31.13 C ATOM 1267 C THR A 248 -3.648 -3.512 -3.301 1.00 20.41 C ATOM 1268 O THR A 248 -2.695 -4.010 -2.731 1.00 23.51 O ATOM 1269 CB THR A 248 -3.333 -4.523 -5.540 1.00 25.33 C ATOM 1270 OG1 THR A 248 -3.112 -4.182 -6.906 1.00 61.34 O ATOM 1271 CG2 THR A 248 -4.511 -5.471 -5.432 1.00 52.43 C ATOM 0 H THR A 248 -1.595 -2.796 -4.938 1.00 55.02 H new ATOM 0 HA THR A 248 -4.530 -2.801 -5.111 1.00 31.13 H new ATOM 0 HB THR A 248 -2.468 -5.032 -5.114 1.00 25.33 H new ATOM 0 HG1 THR A 248 -3.410 -3.262 -7.066 1.00 61.34 H new ATOM 0 HG21 THR A 248 -4.295 -6.385 -5.986 1.00 52.43 H new ATOM 0 HG22 THR A 248 -4.687 -5.715 -4.384 1.00 52.43 H new ATOM 0 HG23 THR A 248 -5.399 -4.996 -5.848 1.00 52.43 H new ATOM 1277 N VAL A 249 -4.739 -3.163 -2.692 1.00 63.35 N ATOM 1278 CA VAL A 249 -4.936 -3.382 -1.272 1.00 5.22 C ATOM 1279 C VAL A 249 -6.244 -4.069 -1.029 1.00 50.24 C ATOM 1280 O VAL A 249 -7.147 -4.022 -1.870 1.00 64.44 O ATOM 1281 CB VAL A 249 -4.893 -2.063 -0.404 1.00 2.33 C ATOM 1282 CG1 VAL A 249 -3.527 -1.432 -0.410 1.00 5.23 C ATOM 1283 CG2 VAL A 249 -5.953 -1.053 -0.851 1.00 0.14 C ATOM 0 H VAL A 249 -5.528 -2.715 -3.158 1.00 63.35 H new ATOM 0 HA VAL A 249 -4.098 -4.004 -0.957 1.00 5.22 H new ATOM 0 HB VAL A 249 -5.121 -2.359 0.620 1.00 2.33 H new ATOM 0 HG11 VAL A 249 -3.541 -0.528 0.199 1.00 5.23 H new ATOM 0 HG12 VAL A 249 -2.800 -2.134 -0.001 1.00 5.23 H new ATOM 0 HG13 VAL A 249 -3.249 -1.177 -1.432 1.00 5.23 H new ATOM 0 HG21 VAL A 249 -5.890 -0.160 -0.229 1.00 0.14 H new ATOM 0 HG22 VAL A 249 -5.781 -0.782 -1.893 1.00 0.14 H new ATOM 0 HG23 VAL A 249 -6.944 -1.496 -0.750 1.00 0.14 H new ATOM 1289 N LYS A 250 -6.341 -4.680 0.110 1.00 50.43 N ATOM 1290 CA LYS A 250 -7.549 -5.318 0.566 1.00 0.04 C ATOM 1291 C LYS A 250 -7.827 -4.689 1.871 1.00 54.21 C ATOM 1292 O LYS A 250 -6.887 -4.442 2.626 1.00 75.41 O ATOM 1293 CB LYS A 250 -7.307 -6.729 1.004 1.00 45.32 C ATOM 1294 CG LYS A 250 -6.616 -7.681 0.097 1.00 35.33 C ATOM 1295 CD LYS A 250 -6.344 -8.958 0.882 1.00 61.02 C ATOM 1296 CE LYS A 250 -5.630 -8.630 2.208 1.00 1.42 C ATOM 1297 NZ LYS A 250 -5.252 -9.830 2.966 1.00 54.14 N ATOM 0 H LYS A 250 -5.566 -4.754 0.769 1.00 50.43 H new ATOM 0 HA LYS A 250 -8.296 -5.251 -0.225 1.00 0.04 H new ATOM 0 HB2 LYS A 250 -6.732 -6.687 1.929 1.00 45.32 H new ATOM 0 HB3 LYS A 250 -8.276 -7.162 1.251 1.00 45.32 H new ATOM 0 HG2 LYS A 250 -7.233 -7.893 -0.776 1.00 35.33 H new ATOM 0 HG3 LYS A 250 -5.683 -7.252 -0.269 1.00 35.33 H new ATOM 0 HD2 LYS A 250 -7.282 -9.475 1.085 1.00 61.02 H new ATOM 0 HD3 LYS A 250 -5.729 -9.634 0.288 1.00 61.02 H new ATOM 0 HE2 LYS A 250 -4.736 -8.043 1.998 1.00 1.42 H new ATOM 0 HE3 LYS A 250 -6.282 -8.009 2.822 1.00 1.42 H new ATOM 0 HZ1 LYS A 250 -4.426 -9.619 3.561 1.00 54.14 H new ATOM 0 HZ2 LYS A 250 -6.047 -10.124 3.569 1.00 54.14 H new ATOM 0 HZ3 LYS A 250 -5.016 -10.598 2.305 1.00 54.14 H new ATOM 1311 N PRO A 251 -9.044 -4.440 2.203 1.00 21.53 N ATOM 1312 CA PRO A 251 -9.356 -3.902 3.482 1.00 63.11 C ATOM 1313 C PRO A 251 -9.342 -4.980 4.555 1.00 14.03 C ATOM 1314 O PRO A 251 -9.779 -6.120 4.319 1.00 33.31 O ATOM 1315 CB PRO A 251 -10.746 -3.283 3.310 1.00 23.22 C ATOM 1316 CG PRO A 251 -11.101 -3.501 1.873 1.00 34.14 C ATOM 1317 CD PRO A 251 -10.228 -4.608 1.384 1.00 4.21 C ATOM 0 HA PRO A 251 -8.623 -3.166 3.812 1.00 63.11 H new ATOM 0 HB2 PRO A 251 -11.472 -3.757 3.971 1.00 23.22 H new ATOM 0 HB3 PRO A 251 -10.737 -2.221 3.556 1.00 23.22 H new ATOM 0 HG2 PRO A 251 -12.154 -3.763 1.769 1.00 34.14 H new ATOM 0 HG3 PRO A 251 -10.939 -2.593 1.291 1.00 34.14 H new ATOM 0 HD2 PRO A 251 -10.689 -5.585 1.528 1.00 4.21 H new ATOM 0 HD3 PRO A 251 -10.006 -4.514 0.321 1.00 4.21 H new