USER MOD reduce.3.24.130724 H: found=0, std=0, add=827, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 827 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 151 SER OG : rot 151:sc= 1.02 USER MOD Set 1.2: A 154 THR OG1 : rot -150:sc= 0.721 USER MOD Set 2.1: A 104 LYS NZ :NH3+ 149:sc= -1.5 (180deg=-3.82!) USER MOD Set 2.2: A 107 ASN : amide:sc= -0.11 K(o=-1.6,f=-6!) USER MOD Set 3.1: A 21 LYS NZ :NH3+ -175:sc= 1.24 (180deg=-0.0793) USER MOD Set 3.2: A 95 GLN : amide:sc= -0.691 K(o=0.54,f=-7.9!) USER MOD Set 4.1: A 16 HIS : no HD1:sc= -7.16! C(o=-20!,f=-19!) USER MOD Set 4.2: A 19 HIS : no HD1:sc= -9.07! C(o=-20!,f=-32!) USER MOD Set 4.3: A 96 THR OG1 : rot -154:sc= -4.08! USER MOD Single : A 12 THR OG1 : rot 31:sc= 0.155 USER MOD Single : A 14 MET CE :methyl -175:sc= -0.0615 (180deg=-0.0697) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot -170:sc= -2.39! USER MOD Single : A 93 MET CE :methyl -157:sc= -0.0605 (180deg=-0.562) USER MOD Single : A 101 ASN : amide:sc= -2.89! C(o=-2.9!,f=-2.4!) USER MOD Single : A 102 HIS : no HD1:sc= -0.209 X(o=-0.21,f=0) USER MOD Single : A 115 ASN : amide:sc= -6.97! C(o=-7!,f=-14!) USER MOD Single : A 116 LYS NZ :NH3+ -161:sc= 1.9 (180deg=1.44) USER MOD Single : A 117 MET CE :methyl -118:sc= -2.64! (180deg=-7.28!) USER MOD Single : A 119 LYS NZ :NH3+ 175:sc= 1.27 (180deg=1.22) USER MOD Single : A 123 ASN : amide:sc= -0.959 K(o=-0.96,f=-0.098) USER MOD Single : A 128 MET CE :methyl 133:sc= -2.26! (180deg=-7.4!) USER MOD Single : A 129 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 132 MET CE :methyl -157:sc= -0.398 (180deg=-1.72!) USER MOD Single : A 134 TYR OH : rot 180:sc=-0.00906 USER MOD Single : A 135 ASN : amide:sc= -0.197 K(o=-0.2,f=-1.1) USER MOD Single : A 145 THR OG1 : rot -11:sc= 0.746 USER MOD Single : A 148 CYS SG : rot 150:sc=-0.00968 USER MOD Single : A 149 LYS NZ :NH3+ -176:sc= 0.0826 (180deg=0.0221) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 162:sc= -0.236 (180deg=-0.622) USER MOD Single : A 160 HIS : no HD1:sc= -0.306 K(o=-0.31,f=-1.2) USER MOD Single : A 164 MET CE :methyl -141:sc= -1.13 (180deg=-3.51!) USER MOD ----------------------------------------------------------------- ATOM 171 N THR A 12 -11.799 -4.137 -0.342 1.00 0.44 N ATOM 172 CA THR A 12 -11.528 -4.741 0.947 1.00 0.45 C ATOM 173 C THR A 12 -10.469 -3.951 1.692 1.00 0.41 C ATOM 174 O THR A 12 -9.396 -3.671 1.155 1.00 0.50 O ATOM 175 CB THR A 12 -11.054 -6.200 0.810 1.00 0.54 C ATOM 176 OG1 THR A 12 -11.952 -6.939 -0.035 1.00 0.61 O ATOM 177 CG2 THR A 12 -10.984 -6.870 2.178 1.00 0.64 C ATOM 0 HA THR A 12 -12.465 -4.730 1.504 1.00 0.45 H new ATOM 0 HB THR A 12 -10.060 -6.193 0.363 1.00 0.54 H new ATOM 0 HG1 THR A 12 -12.345 -6.337 -0.701 1.00 0.61 H new ATOM 0 HG21 THR A 12 -10.647 -7.900 2.062 1.00 0.64 H new ATOM 0 HG22 THR A 12 -10.283 -6.328 2.813 1.00 0.64 H new ATOM 0 HG23 THR A 12 -11.972 -6.861 2.639 1.00 0.64 H new ATOM 185 N ILE A 13 -10.782 -3.572 2.916 1.00 0.40 N ATOM 186 CA ILE A 13 -9.816 -2.902 3.751 1.00 0.40 C ATOM 187 C ILE A 13 -9.087 -3.944 4.590 1.00 0.37 C ATOM 188 O ILE A 13 -9.700 -4.829 5.191 1.00 0.52 O ATOM 189 CB ILE A 13 -10.474 -1.830 4.653 1.00 0.52 C ATOM 190 CG1 ILE A 13 -9.410 -0.908 5.253 1.00 1.15 C ATOM 191 CG2 ILE A 13 -11.283 -2.482 5.759 1.00 1.26 C ATOM 192 CD1 ILE A 13 -9.983 0.246 6.047 1.00 1.30 C ATOM 0 H ILE A 13 -11.694 -3.718 3.349 1.00 0.40 H new ATOM 0 HA ILE A 13 -9.106 -2.377 3.112 1.00 0.40 H new ATOM 0 HB ILE A 13 -11.147 -1.234 4.036 1.00 0.52 H new ATOM 0 HG12 ILE A 13 -8.757 -1.494 5.900 1.00 1.15 H new ATOM 0 HG13 ILE A 13 -8.790 -0.512 4.449 1.00 1.15 H new ATOM 0 HG21 ILE A 13 -11.737 -1.711 6.381 1.00 1.26 H new ATOM 0 HG22 ILE A 13 -12.065 -3.101 5.321 1.00 1.26 H new ATOM 0 HG23 ILE A 13 -10.629 -3.103 6.371 1.00 1.26 H new ATOM 0 HD11 ILE A 13 -9.170 0.856 6.441 1.00 1.30 H new ATOM 0 HD12 ILE A 13 -10.613 0.856 5.399 1.00 1.30 H new ATOM 0 HD13 ILE A 13 -10.580 -0.141 6.873 1.00 1.30 H new ATOM 204 N MET A 14 -7.778 -3.874 4.575 1.00 0.26 N ATOM 205 CA MET A 14 -6.948 -4.802 5.295 1.00 0.28 C ATOM 206 C MET A 14 -5.734 -4.083 5.842 1.00 0.24 C ATOM 207 O MET A 14 -5.642 -2.863 5.768 1.00 0.29 O ATOM 208 CB MET A 14 -6.510 -5.950 4.386 1.00 0.36 C ATOM 209 CG MET A 14 -7.533 -7.071 4.271 1.00 0.49 C ATOM 210 SD MET A 14 -6.831 -8.607 3.624 1.00 0.79 S ATOM 211 CE MET A 14 -6.365 -8.122 1.965 1.00 0.69 C ATOM 0 H MET A 14 -7.257 -3.165 4.058 1.00 0.26 H new ATOM 0 HA MET A 14 -7.524 -5.218 6.121 1.00 0.28 H new ATOM 0 HB2 MET A 14 -6.305 -5.555 3.391 1.00 0.36 H new ATOM 0 HB3 MET A 14 -5.574 -6.363 4.764 1.00 0.36 H new ATOM 0 HG2 MET A 14 -7.966 -7.262 5.253 1.00 0.49 H new ATOM 0 HG3 MET A 14 -8.346 -6.748 3.621 1.00 0.49 H new ATOM 0 HE1 MET A 14 -6.001 -8.993 1.420 1.00 0.69 H new ATOM 0 HE2 MET A 14 -7.232 -7.708 1.450 1.00 0.69 H new ATOM 0 HE3 MET A 14 -5.578 -7.369 2.013 1.00 0.69 H new ATOM 221 N GLY A 15 -4.802 -4.841 6.376 1.00 0.27 N ATOM 222 CA GLY A 15 -3.637 -4.265 6.970 1.00 0.27 C ATOM 223 C GLY A 15 -3.408 -4.831 8.341 1.00 0.24 C ATOM 224 O GLY A 15 -3.910 -5.912 8.650 1.00 0.31 O ATOM 0 H GLY A 15 -4.837 -5.860 6.406 1.00 0.27 H new ATOM 0 HA2 GLY A 15 -2.768 -4.459 6.341 1.00 0.27 H new ATOM 0 HA3 GLY A 15 -3.751 -3.183 7.032 1.00 0.27 H new ATOM 228 N HIS A 16 -2.671 -4.122 9.164 1.00 0.20 N ATOM 229 CA HIS A 16 -2.424 -4.592 10.514 1.00 0.17 C ATOM 230 C HIS A 16 -3.476 -4.066 11.481 1.00 0.19 C ATOM 231 O HIS A 16 -4.142 -3.058 11.233 1.00 0.22 O ATOM 232 CB HIS A 16 -1.030 -4.192 10.997 1.00 0.17 C ATOM 233 CG HIS A 16 -0.626 -4.865 12.273 1.00 0.16 C ATOM 234 ND1 HIS A 16 -0.691 -6.228 12.427 1.00 0.16 N ATOM 235 CD2 HIS A 16 -0.203 -4.315 13.428 1.00 0.19 C ATOM 236 CE1 HIS A 16 -0.311 -6.467 13.671 1.00 0.19 C ATOM 237 NE2 HIS A 16 -0.003 -5.336 14.316 1.00 0.22 N ATOM 0 H HIS A 16 -2.236 -3.229 8.931 1.00 0.20 H new ATOM 0 HA HIS A 16 -2.483 -5.680 10.490 1.00 0.17 H new ATOM 0 HB2 HIS A 16 -0.302 -4.433 10.222 1.00 0.17 H new ATOM 0 HB3 HIS A 16 -0.999 -3.112 11.139 1.00 0.17 H new ATOM 0 HD2 HIS A 16 -0.050 -3.263 13.618 1.00 0.19 H new ATOM 0 HE1 HIS A 16 -0.256 -7.452 14.111 1.00 0.19 H new ATOM 0 HE2 HIS A 16 0.318 -5.252 15.281 1.00 0.22 H new ATOM 245 N VAL A 17 -3.617 -4.785 12.573 1.00 0.20 N ATOM 246 CA VAL A 17 -4.485 -4.403 13.668 1.00 0.25 C ATOM 247 C VAL A 17 -3.865 -3.246 14.442 1.00 0.26 C ATOM 248 O VAL A 17 -2.654 -3.061 14.397 1.00 0.25 O ATOM 249 CB VAL A 17 -4.694 -5.620 14.581 1.00 0.29 C ATOM 250 CG1 VAL A 17 -3.356 -6.167 15.045 1.00 0.30 C ATOM 251 CG2 VAL A 17 -5.547 -5.309 15.777 1.00 0.36 C ATOM 0 H VAL A 17 -3.125 -5.665 12.729 1.00 0.20 H new ATOM 0 HA VAL A 17 -5.450 -4.074 13.284 1.00 0.25 H new ATOM 0 HB VAL A 17 -5.220 -6.368 13.987 1.00 0.29 H new ATOM 0 HG11 VAL A 17 -3.520 -7.029 15.691 1.00 0.30 H new ATOM 0 HG12 VAL A 17 -2.766 -6.469 14.179 1.00 0.30 H new ATOM 0 HG13 VAL A 17 -2.820 -5.396 15.598 1.00 0.30 H new ATOM 0 HG21 VAL A 17 -5.661 -6.206 16.386 1.00 0.36 H new ATOM 0 HG22 VAL A 17 -5.072 -4.526 16.369 1.00 0.36 H new ATOM 0 HG23 VAL A 17 -6.528 -4.969 15.446 1.00 0.36 H new ATOM 261 N ASP A 18 -4.703 -2.448 15.110 1.00 0.31 N ATOM 262 CA ASP A 18 -4.249 -1.267 15.853 1.00 0.36 C ATOM 263 C ASP A 18 -3.894 -0.133 14.893 1.00 0.34 C ATOM 264 O ASP A 18 -3.844 1.036 15.275 1.00 0.41 O ATOM 265 CB ASP A 18 -3.065 -1.618 16.764 1.00 0.42 C ATOM 266 CG ASP A 18 -2.469 -0.413 17.468 1.00 0.55 C ATOM 267 OD1 ASP A 18 -3.026 0.009 18.505 1.00 0.69 O ATOM 268 OD2 ASP A 18 -1.432 0.107 16.997 1.00 0.59 O ATOM 0 H ASP A 18 -5.711 -2.601 15.152 1.00 0.31 H new ATOM 0 HA ASP A 18 -5.065 -0.925 16.489 1.00 0.36 H new ATOM 0 HB2 ASP A 18 -3.393 -2.341 17.511 1.00 0.42 H new ATOM 0 HB3 ASP A 18 -2.290 -2.103 16.170 1.00 0.42 H new ATOM 273 N HIS A 19 -3.668 -0.483 13.632 1.00 0.29 N ATOM 274 CA HIS A 19 -3.501 0.515 12.592 1.00 0.32 C ATOM 275 C HIS A 19 -4.877 0.953 12.118 1.00 0.43 C ATOM 276 O HIS A 19 -5.012 1.843 11.288 1.00 0.63 O ATOM 277 CB HIS A 19 -2.680 -0.021 11.414 1.00 0.29 C ATOM 278 CG HIS A 19 -1.345 -0.570 11.789 1.00 0.22 C ATOM 279 ND1 HIS A 19 -0.428 -0.928 10.834 1.00 0.27 N ATOM 280 CD2 HIS A 19 -0.818 -0.799 13.015 1.00 0.21 C ATOM 281 CE1 HIS A 19 0.627 -1.362 11.493 1.00 0.26 C ATOM 282 NE2 HIS A 19 0.434 -1.304 12.813 1.00 0.24 N ATOM 0 H HIS A 19 -3.597 -1.448 13.310 1.00 0.29 H new ATOM 0 HA HIS A 19 -2.953 1.362 13.003 1.00 0.32 H new ATOM 0 HB2 HIS A 19 -3.253 -0.802 10.914 1.00 0.29 H new ATOM 0 HB3 HIS A 19 -2.538 0.782 10.691 1.00 0.29 H new ATOM 0 HD2 HIS A 19 -1.295 -0.618 13.967 1.00 0.21 H new ATOM 0 HE1 HIS A 19 1.533 -1.719 11.025 1.00 0.26 H new ATOM 0 HE2 HIS A 19 1.098 -1.584 13.535 1.00 0.24 H new ATOM 290 N GLY A 20 -5.903 0.297 12.644 1.00 0.42 N ATOM 291 CA GLY A 20 -7.252 0.738 12.400 1.00 0.54 C ATOM 292 C GLY A 20 -8.057 -0.196 11.527 1.00 0.57 C ATOM 293 O GLY A 20 -8.707 0.257 10.590 1.00 0.79 O ATOM 0 H GLY A 20 -5.820 -0.531 13.234 1.00 0.42 H new ATOM 0 HA2 GLY A 20 -7.763 0.856 13.356 1.00 0.54 H new ATOM 0 HA3 GLY A 20 -7.222 1.721 11.931 1.00 0.54 H new ATOM 297 N LYS A 21 -8.020 -1.493 11.822 1.00 0.61 N ATOM 298 CA LYS A 21 -8.842 -2.453 11.102 1.00 0.95 C ATOM 299 C LYS A 21 -10.309 -2.015 11.049 1.00 0.89 C ATOM 300 O LYS A 21 -10.839 -1.702 9.984 1.00 1.05 O ATOM 301 CB LYS A 21 -8.743 -3.809 11.775 1.00 1.36 C ATOM 302 CG LYS A 21 -8.671 -4.953 10.794 1.00 1.79 C ATOM 303 CD LYS A 21 -7.377 -4.900 10.008 1.00 2.30 C ATOM 304 CE LYS A 21 -7.355 -5.945 8.911 1.00 2.66 C ATOM 305 NZ LYS A 21 -7.461 -7.327 9.449 1.00 3.31 N ATOM 0 H LYS A 21 -7.432 -1.898 12.551 1.00 0.61 H new ATOM 0 HA LYS A 21 -8.472 -2.512 10.079 1.00 0.95 H new ATOM 0 HB2 LYS A 21 -7.859 -3.828 12.412 1.00 1.36 H new ATOM 0 HB3 LYS A 21 -9.607 -3.949 12.425 1.00 1.36 H new ATOM 0 HG2 LYS A 21 -8.741 -5.901 11.327 1.00 1.79 H new ATOM 0 HG3 LYS A 21 -9.520 -4.908 10.111 1.00 1.79 H new ATOM 0 HD2 LYS A 21 -7.255 -3.909 9.571 1.00 2.30 H new ATOM 0 HD3 LYS A 21 -6.534 -5.058 10.681 1.00 2.30 H new ATOM 0 HE2 LYS A 21 -8.178 -5.762 8.221 1.00 2.66 H new ATOM 0 HE3 LYS A 21 -6.432 -5.849 8.339 1.00 2.66 H new ATOM 0 HZ1 LYS A 21 -7.357 -8.011 8.672 1.00 3.31 H new ATOM 0 HZ2 LYS A 21 -6.711 -7.484 10.152 1.00 3.31 H new ATOM 0 HZ3 LYS A 21 -8.390 -7.454 9.900 1.00 3.31 H new ATOM 319 N THR A 22 -10.955 -1.992 12.206 1.00 0.84 N ATOM 320 CA THR A 22 -12.365 -1.644 12.293 1.00 0.87 C ATOM 321 C THR A 22 -12.551 -0.154 12.596 1.00 0.79 C ATOM 322 O THR A 22 -13.527 0.465 12.164 1.00 0.79 O ATOM 323 CB THR A 22 -13.055 -2.494 13.381 1.00 1.02 C ATOM 324 OG1 THR A 22 -12.717 -3.875 13.195 1.00 1.21 O ATOM 325 CG2 THR A 22 -14.565 -2.337 13.333 1.00 1.18 C ATOM 0 H THR A 22 -10.521 -2.212 13.103 1.00 0.84 H new ATOM 0 HA THR A 22 -12.824 -1.854 11.327 1.00 0.87 H new ATOM 0 HB THR A 22 -12.705 -2.147 14.353 1.00 1.02 H new ATOM 0 HG1 THR A 22 -13.154 -4.415 13.887 1.00 1.21 H new ATOM 0 HG21 THR A 22 -15.019 -2.949 14.112 1.00 1.18 H new ATOM 0 HG22 THR A 22 -14.827 -1.291 13.494 1.00 1.18 H new ATOM 0 HG23 THR A 22 -14.933 -2.658 12.359 1.00 1.18 H new ATOM 333 N THR A 23 -11.599 0.427 13.323 1.00 0.75 N ATOM 334 CA THR A 23 -11.660 1.836 13.692 1.00 0.75 C ATOM 335 C THR A 23 -11.746 2.762 12.477 1.00 0.67 C ATOM 336 O THR A 23 -12.306 3.845 12.569 1.00 0.66 O ATOM 337 CB THR A 23 -10.454 2.240 14.551 1.00 0.82 C ATOM 338 OG1 THR A 23 -9.422 1.246 14.444 1.00 1.25 O ATOM 339 CG2 THR A 23 -10.865 2.412 16.003 1.00 1.17 C ATOM 0 H THR A 23 -10.773 -0.061 13.669 1.00 0.75 H new ATOM 0 HA THR A 23 -12.576 1.952 14.271 1.00 0.75 H new ATOM 0 HB THR A 23 -10.071 3.193 14.187 1.00 0.82 H new ATOM 0 HG1 THR A 23 -8.725 1.425 15.110 1.00 1.25 H new ATOM 0 HG21 THR A 23 -9.996 2.698 16.596 1.00 1.17 H new ATOM 0 HG22 THR A 23 -11.626 3.189 16.076 1.00 1.17 H new ATOM 0 HG23 THR A 23 -11.268 1.472 16.381 1.00 1.17 H new ATOM 347 N LEU A 24 -11.214 2.330 11.335 1.00 0.65 N ATOM 348 CA LEU A 24 -11.255 3.153 10.128 1.00 0.63 C ATOM 349 C LEU A 24 -12.616 3.086 9.474 1.00 0.64 C ATOM 350 O LEU A 24 -13.023 4.010 8.783 1.00 0.65 O ATOM 351 CB LEU A 24 -10.186 2.723 9.149 1.00 0.67 C ATOM 352 CG LEU A 24 -8.922 3.592 9.128 1.00 0.84 C ATOM 353 CD1 LEU A 24 -8.206 3.542 10.468 1.00 1.49 C ATOM 354 CD2 LEU A 24 -7.993 3.151 8.008 1.00 1.30 C ATOM 0 H LEU A 24 -10.755 1.426 11.220 1.00 0.65 H new ATOM 0 HA LEU A 24 -11.064 4.185 10.422 1.00 0.63 H new ATOM 0 HB2 LEU A 24 -9.897 1.698 9.380 1.00 0.67 H new ATOM 0 HB3 LEU A 24 -10.617 2.715 8.148 1.00 0.67 H new ATOM 0 HG LEU A 24 -9.221 4.624 8.944 1.00 0.84 H new ATOM 0 HD11 LEU A 24 -7.313 4.166 10.427 1.00 1.49 H new ATOM 0 HD12 LEU A 24 -8.871 3.910 11.250 1.00 1.49 H new ATOM 0 HD13 LEU A 24 -7.920 2.514 10.690 1.00 1.49 H new ATOM 0 HD21 LEU A 24 -7.101 3.778 8.007 1.00 1.30 H new ATOM 0 HD22 LEU A 24 -7.705 2.111 8.162 1.00 1.30 H new ATOM 0 HD23 LEU A 24 -8.505 3.248 7.051 1.00 1.30 H new ATOM 366 N LEU A 25 -13.329 1.998 9.715 1.00 0.68 N ATOM 367 CA LEU A 25 -14.683 1.859 9.213 1.00 0.75 C ATOM 368 C LEU A 25 -15.615 2.734 10.051 1.00 0.74 C ATOM 369 O LEU A 25 -16.734 3.048 9.648 1.00 0.82 O ATOM 370 CB LEU A 25 -15.122 0.394 9.264 1.00 0.85 C ATOM 371 CG LEU A 25 -15.795 -0.131 7.996 1.00 0.92 C ATOM 372 CD1 LEU A 25 -17.107 0.586 7.741 1.00 1.63 C ATOM 373 CD2 LEU A 25 -14.866 0.025 6.802 1.00 1.69 C ATOM 0 H LEU A 25 -12.992 1.200 10.254 1.00 0.68 H new ATOM 0 HA LEU A 25 -14.724 2.183 8.173 1.00 0.75 H new ATOM 0 HB2 LEU A 25 -14.248 -0.223 9.474 1.00 0.85 H new ATOM 0 HB3 LEU A 25 -15.810 0.267 10.100 1.00 0.85 H new ATOM 0 HG LEU A 25 -16.010 -1.190 8.139 1.00 0.92 H new ATOM 0 HD11 LEU A 25 -17.565 0.194 6.833 1.00 1.63 H new ATOM 0 HD12 LEU A 25 -17.779 0.427 8.585 1.00 1.63 H new ATOM 0 HD13 LEU A 25 -16.921 1.653 7.622 1.00 1.63 H new ATOM 0 HD21 LEU A 25 -15.358 -0.353 5.906 1.00 1.69 H new ATOM 0 HD22 LEU A 25 -14.623 1.079 6.665 1.00 1.69 H new ATOM 0 HD23 LEU A 25 -13.950 -0.539 6.978 1.00 1.69 H new ATOM 385 N ASP A 26 -15.126 3.132 11.219 1.00 0.71 N ATOM 386 CA ASP A 26 -15.840 4.077 12.063 1.00 0.75 C ATOM 387 C ASP A 26 -15.393 5.471 11.716 1.00 0.70 C ATOM 388 O ASP A 26 -16.195 6.393 11.549 1.00 0.76 O ATOM 389 CB ASP A 26 -15.551 3.838 13.530 1.00 0.81 C ATOM 390 CG ASP A 26 -16.216 4.878 14.419 1.00 1.01 C ATOM 391 OD1 ASP A 26 -15.616 5.959 14.636 1.00 1.23 O ATOM 392 OD2 ASP A 26 -17.347 4.637 14.887 1.00 1.13 O ATOM 0 H ASP A 26 -14.236 2.813 11.602 1.00 0.71 H new ATOM 0 HA ASP A 26 -16.908 3.947 11.891 1.00 0.75 H new ATOM 0 HB2 ASP A 26 -15.900 2.844 13.811 1.00 0.81 H new ATOM 0 HB3 ASP A 26 -14.474 3.856 13.695 1.00 0.81 H new ATOM 397 N ALA A 27 -14.083 5.596 11.602 1.00 0.63 N ATOM 398 CA ALA A 27 -13.437 6.854 11.287 1.00 0.61 C ATOM 399 C ALA A 27 -13.945 7.395 9.961 1.00 0.58 C ATOM 400 O ALA A 27 -14.084 8.604 9.773 1.00 0.62 O ATOM 401 CB ALA A 27 -11.939 6.634 11.241 1.00 0.61 C ATOM 0 H ALA A 27 -13.433 4.820 11.727 1.00 0.63 H new ATOM 0 HA ALA A 27 -13.671 7.591 12.055 1.00 0.61 H new ATOM 0 HB1 ALA A 27 -11.440 7.574 11.005 1.00 0.61 H new ATOM 0 HB2 ALA A 27 -11.594 6.274 12.210 1.00 0.61 H new ATOM 0 HB3 ALA A 27 -11.703 5.895 10.475 1.00 0.61 H new ATOM 407 N ILE A 28 -14.239 6.474 9.060 1.00 0.56 N ATOM 408 CA ILE A 28 -14.695 6.797 7.724 1.00 0.57 C ATOM 409 C ILE A 28 -16.133 7.334 7.749 1.00 0.64 C ATOM 410 O ILE A 28 -16.503 8.184 6.939 1.00 0.71 O ATOM 411 CB ILE A 28 -14.572 5.541 6.828 1.00 0.61 C ATOM 412 CG1 ILE A 28 -14.309 5.917 5.380 1.00 0.84 C ATOM 413 CG2 ILE A 28 -15.800 4.644 6.927 1.00 1.02 C ATOM 414 CD1 ILE A 28 -13.613 4.805 4.634 1.00 0.85 C ATOM 0 H ILE A 28 -14.166 5.472 9.239 1.00 0.56 H new ATOM 0 HA ILE A 28 -14.069 7.587 7.309 1.00 0.57 H new ATOM 0 HB ILE A 28 -13.717 4.976 7.199 1.00 0.61 H new ATOM 0 HG12 ILE A 28 -15.253 6.151 4.887 1.00 0.84 H new ATOM 0 HG13 ILE A 28 -13.698 6.819 5.343 1.00 0.84 H new ATOM 0 HG21 ILE A 28 -15.669 3.775 6.282 1.00 1.02 H new ATOM 0 HG22 ILE A 28 -15.927 4.314 7.958 1.00 1.02 H new ATOM 0 HG23 ILE A 28 -16.683 5.200 6.612 1.00 1.02 H new ATOM 0 HD11 ILE A 28 -13.442 5.111 3.602 1.00 0.85 H new ATOM 0 HD12 ILE A 28 -12.657 4.589 5.112 1.00 0.85 H new ATOM 0 HD13 ILE A 28 -14.236 3.911 4.649 1.00 0.85 H new ATOM 1221 N ILE A 81 -10.249 -3.323 -5.808 1.00 0.63 N ATOM 1222 CA ILE A 81 -9.063 -2.721 -5.219 1.00 0.42 C ATOM 1223 C ILE A 81 -8.945 -3.146 -3.760 1.00 0.38 C ATOM 1224 O ILE A 81 -9.956 -3.380 -3.105 1.00 0.57 O ATOM 1225 CB ILE A 81 -9.156 -1.179 -5.286 1.00 0.42 C ATOM 1226 CG1 ILE A 81 -9.468 -0.721 -6.712 1.00 0.56 C ATOM 1227 CG2 ILE A 81 -7.868 -0.528 -4.801 1.00 0.50 C ATOM 1228 CD1 ILE A 81 -9.775 0.757 -6.823 1.00 0.71 C ATOM 0 HA ILE A 81 -8.188 -3.055 -5.777 1.00 0.42 H new ATOM 0 HB ILE A 81 -9.967 -0.867 -4.628 1.00 0.42 H new ATOM 0 HG12 ILE A 81 -8.619 -0.956 -7.354 1.00 0.56 H new ATOM 0 HG13 ILE A 81 -10.319 -1.289 -7.089 1.00 0.56 H new ATOM 0 HG21 ILE A 81 -7.964 0.556 -4.860 1.00 0.50 H new ATOM 0 HG22 ILE A 81 -7.679 -0.820 -3.768 1.00 0.50 H new ATOM 0 HG23 ILE A 81 -7.038 -0.853 -5.428 1.00 0.50 H new ATOM 0 HD11 ILE A 81 -9.986 1.008 -7.863 1.00 0.71 H new ATOM 0 HD12 ILE A 81 -10.643 0.995 -6.209 1.00 0.71 H new ATOM 0 HD13 ILE A 81 -8.917 1.334 -6.478 1.00 0.71 H new ATOM 1240 N VAL A 82 -7.727 -3.254 -3.244 1.00 0.27 N ATOM 1241 CA VAL A 82 -7.561 -3.548 -1.829 1.00 0.28 C ATOM 1242 C VAL A 82 -6.862 -2.402 -1.124 1.00 0.23 C ATOM 1243 O VAL A 82 -5.895 -1.834 -1.629 1.00 0.26 O ATOM 1244 CB VAL A 82 -6.774 -4.850 -1.570 1.00 0.35 C ATOM 1245 CG1 VAL A 82 -5.390 -4.748 -2.158 1.00 1.02 C ATOM 1246 CG2 VAL A 82 -6.687 -5.153 -0.074 1.00 1.17 C ATOM 0 H VAL A 82 -6.860 -3.145 -3.770 1.00 0.27 H new ATOM 0 HA VAL A 82 -8.567 -3.682 -1.430 1.00 0.28 H new ATOM 0 HB VAL A 82 -7.308 -5.669 -2.053 1.00 0.35 H new ATOM 0 HG11 VAL A 82 -4.845 -5.673 -1.968 1.00 1.02 H new ATOM 0 HG12 VAL A 82 -5.463 -4.583 -3.233 1.00 1.02 H new ATOM 0 HG13 VAL A 82 -4.860 -3.914 -1.698 1.00 1.02 H new ATOM 0 HG21 VAL A 82 -6.127 -6.076 0.078 1.00 1.17 H new ATOM 0 HG22 VAL A 82 -6.180 -4.333 0.434 1.00 1.17 H new ATOM 0 HG23 VAL A 82 -7.692 -5.267 0.333 1.00 1.17 H new ATOM 1256 N ILE A 83 -7.367 -2.061 0.034 1.00 0.22 N ATOM 1257 CA ILE A 83 -6.731 -1.083 0.875 1.00 0.19 C ATOM 1258 C ILE A 83 -5.884 -1.767 1.906 1.00 0.19 C ATOM 1259 O ILE A 83 -6.335 -2.671 2.606 1.00 0.24 O ATOM 1260 CB ILE A 83 -7.736 -0.149 1.566 1.00 0.22 C ATOM 1261 CG1 ILE A 83 -8.388 0.706 0.501 1.00 0.27 C ATOM 1262 CG2 ILE A 83 -7.043 0.715 2.622 1.00 0.24 C ATOM 1263 CD1 ILE A 83 -9.207 1.863 1.037 1.00 0.37 C ATOM 0 H ILE A 83 -8.227 -2.452 0.418 1.00 0.22 H new ATOM 0 HA ILE A 83 -6.109 -0.465 0.228 1.00 0.19 H new ATOM 0 HB ILE A 83 -8.495 -0.734 2.086 1.00 0.22 H new ATOM 0 HG12 ILE A 83 -7.612 1.100 -0.156 1.00 0.27 H new ATOM 0 HG13 ILE A 83 -9.032 0.074 -0.110 1.00 0.27 H new ATOM 0 HG21 ILE A 83 -7.776 1.367 3.097 1.00 0.24 H new ATOM 0 HG22 ILE A 83 -6.587 0.073 3.376 1.00 0.24 H new ATOM 0 HG23 ILE A 83 -6.272 1.321 2.147 1.00 0.24 H new ATOM 0 HD11 ILE A 83 -9.637 2.421 0.205 1.00 0.37 H new ATOM 0 HD12 ILE A 83 -10.008 1.480 1.669 1.00 0.37 H new ATOM 0 HD13 ILE A 83 -8.566 2.522 1.623 1.00 0.37 H new ATOM 1275 N LEU A 84 -4.660 -1.335 1.986 1.00 0.19 N ATOM 1276 CA LEU A 84 -3.738 -1.879 2.931 1.00 0.23 C ATOM 1277 C LEU A 84 -3.384 -0.781 3.928 1.00 0.24 C ATOM 1278 O LEU A 84 -2.744 0.209 3.576 1.00 0.31 O ATOM 1279 CB LEU A 84 -2.508 -2.436 2.188 1.00 0.39 C ATOM 1280 CG LEU A 84 -1.352 -2.957 3.050 1.00 0.31 C ATOM 1281 CD1 LEU A 84 -0.513 -1.797 3.535 1.00 0.91 C ATOM 1282 CD2 LEU A 84 -1.860 -3.782 4.225 1.00 1.01 C ATOM 0 H LEU A 84 -4.276 -0.596 1.397 1.00 0.19 H new ATOM 0 HA LEU A 84 -4.171 -2.713 3.483 1.00 0.23 H new ATOM 0 HB2 LEU A 84 -2.841 -3.248 1.542 1.00 0.39 H new ATOM 0 HB3 LEU A 84 -2.120 -1.651 1.539 1.00 0.39 H new ATOM 0 HG LEU A 84 -0.735 -3.612 2.435 1.00 0.31 H new ATOM 0 HD11 LEU A 84 0.307 -2.172 4.147 1.00 0.91 H new ATOM 0 HD12 LEU A 84 -0.109 -1.257 2.679 1.00 0.91 H new ATOM 0 HD13 LEU A 84 -1.131 -1.124 4.129 1.00 0.91 H new ATOM 0 HD21 LEU A 84 -1.014 -4.135 4.814 1.00 1.01 H new ATOM 0 HD22 LEU A 84 -2.506 -3.165 4.850 1.00 1.01 H new ATOM 0 HD23 LEU A 84 -2.425 -4.637 3.852 1.00 1.01 H new ATOM 1294 N VAL A 85 -3.855 -0.927 5.150 1.00 0.21 N ATOM 1295 CA VAL A 85 -3.625 0.056 6.182 1.00 0.27 C ATOM 1296 C VAL A 85 -2.373 -0.276 6.985 1.00 0.25 C ATOM 1297 O VAL A 85 -2.282 -1.340 7.603 1.00 0.29 O ATOM 1298 CB VAL A 85 -4.834 0.140 7.132 1.00 0.34 C ATOM 1299 CG1 VAL A 85 -4.594 1.182 8.201 1.00 0.43 C ATOM 1300 CG2 VAL A 85 -6.104 0.450 6.356 1.00 0.40 C ATOM 0 H VAL A 85 -4.407 -1.730 5.452 1.00 0.21 H new ATOM 0 HA VAL A 85 -3.485 1.020 5.692 1.00 0.27 H new ATOM 0 HB VAL A 85 -4.959 -0.828 7.617 1.00 0.34 H new ATOM 0 HG11 VAL A 85 -5.458 1.229 8.864 1.00 0.43 H new ATOM 0 HG12 VAL A 85 -3.708 0.915 8.777 1.00 0.43 H new ATOM 0 HG13 VAL A 85 -4.443 2.155 7.733 1.00 0.43 H new ATOM 0 HG21 VAL A 85 -6.947 0.505 7.045 1.00 0.40 H new ATOM 0 HG22 VAL A 85 -5.992 1.405 5.842 1.00 0.40 H new ATOM 0 HG23 VAL A 85 -6.285 -0.337 5.624 1.00 0.40 H new ATOM 1310 N VAL A 86 -1.407 0.628 6.942 1.00 0.22 N ATOM 1311 CA VAL A 86 -0.202 0.502 7.733 1.00 0.20 C ATOM 1312 C VAL A 86 0.047 1.775 8.519 1.00 0.17 C ATOM 1313 O VAL A 86 0.165 2.860 7.954 1.00 0.22 O ATOM 1314 CB VAL A 86 1.032 0.196 6.868 1.00 0.23 C ATOM 1315 CG1 VAL A 86 1.103 -1.286 6.547 1.00 0.49 C ATOM 1316 CG2 VAL A 86 1.019 1.018 5.589 1.00 0.64 C ATOM 0 H VAL A 86 -1.439 1.465 6.359 1.00 0.22 H new ATOM 0 HA VAL A 86 -0.356 -0.336 8.413 1.00 0.20 H new ATOM 0 HB VAL A 86 1.920 0.471 7.437 1.00 0.23 H new ATOM 0 HG11 VAL A 86 1.982 -1.484 5.934 1.00 0.49 H new ATOM 0 HG12 VAL A 86 1.171 -1.856 7.474 1.00 0.49 H new ATOM 0 HG13 VAL A 86 0.207 -1.584 6.002 1.00 0.49 H new ATOM 0 HG21 VAL A 86 1.903 0.782 4.996 1.00 0.64 H new ATOM 0 HG22 VAL A 86 0.123 0.783 5.014 1.00 0.64 H new ATOM 0 HG23 VAL A 86 1.022 2.079 5.838 1.00 0.64 H new ATOM 1326 N ALA A 87 0.092 1.639 9.826 1.00 0.17 N ATOM 1327 CA ALA A 87 0.400 2.750 10.702 1.00 0.18 C ATOM 1328 C ALA A 87 1.821 3.229 10.464 1.00 0.16 C ATOM 1329 O ALA A 87 2.746 2.427 10.429 1.00 0.24 O ATOM 1330 CB ALA A 87 0.219 2.322 12.147 1.00 0.28 C ATOM 0 H ALA A 87 -0.083 0.759 10.311 1.00 0.17 H new ATOM 0 HA ALA A 87 -0.279 3.575 10.488 1.00 0.18 H new ATOM 0 HB1 ALA A 87 0.451 3.159 12.806 1.00 0.28 H new ATOM 0 HB2 ALA A 87 -0.813 2.009 12.307 1.00 0.28 H new ATOM 0 HB3 ALA A 87 0.889 1.491 12.367 1.00 0.28 H new ATOM 1336 N ALA A 88 1.999 4.535 10.312 1.00 0.12 N ATOM 1337 CA ALA A 88 3.318 5.088 10.043 1.00 0.14 C ATOM 1338 C ALA A 88 4.222 4.918 11.237 1.00 0.16 C ATOM 1339 O ALA A 88 5.439 5.035 11.132 1.00 0.22 O ATOM 1340 CB ALA A 88 3.220 6.564 9.703 1.00 0.17 C ATOM 0 H ALA A 88 1.251 5.226 10.370 1.00 0.12 H new ATOM 0 HA ALA A 88 3.736 4.547 9.194 1.00 0.14 H new ATOM 0 HB1 ALA A 88 4.217 6.959 9.505 1.00 0.17 H new ATOM 0 HB2 ALA A 88 2.596 6.693 8.818 1.00 0.17 H new ATOM 0 HB3 ALA A 88 2.776 7.102 10.541 1.00 0.17 H new ATOM 1346 N ASP A 89 3.614 4.675 12.372 1.00 0.16 N ATOM 1347 CA ASP A 89 4.377 4.516 13.600 1.00 0.21 C ATOM 1348 C ASP A 89 4.768 3.056 13.826 1.00 0.22 C ATOM 1349 O ASP A 89 5.649 2.758 14.633 1.00 0.37 O ATOM 1350 CB ASP A 89 3.582 5.039 14.797 1.00 0.30 C ATOM 1351 CG ASP A 89 2.818 3.948 15.539 1.00 0.39 C ATOM 1352 OD1 ASP A 89 1.951 3.290 14.928 1.00 0.47 O ATOM 1353 OD2 ASP A 89 3.073 3.760 16.747 1.00 0.58 O ATOM 0 H ASP A 89 2.604 4.583 12.478 1.00 0.16 H new ATOM 0 HA ASP A 89 5.292 5.100 13.500 1.00 0.21 H new ATOM 0 HB2 ASP A 89 4.264 5.530 15.490 1.00 0.30 H new ATOM 0 HB3 ASP A 89 2.877 5.796 14.453 1.00 0.30 H new ATOM 1358 N ASP A 90 4.130 2.154 13.089 1.00 0.19 N ATOM 1359 CA ASP A 90 4.263 0.724 13.353 1.00 0.23 C ATOM 1360 C ASP A 90 4.752 -0.014 12.106 1.00 0.25 C ATOM 1361 O ASP A 90 5.686 -0.817 12.170 1.00 0.42 O ATOM 1362 CB ASP A 90 2.913 0.177 13.820 1.00 0.26 C ATOM 1363 CG ASP A 90 3.033 -0.997 14.769 1.00 0.36 C ATOM 1364 OD1 ASP A 90 3.885 -0.946 15.680 1.00 0.56 O ATOM 1365 OD2 ASP A 90 2.245 -1.956 14.634 1.00 0.46 O ATOM 0 H ASP A 90 3.518 2.385 12.307 1.00 0.19 H new ATOM 0 HA ASP A 90 5.004 0.566 14.136 1.00 0.23 H new ATOM 0 HB2 ASP A 90 2.356 0.975 14.311 1.00 0.26 H new ATOM 0 HB3 ASP A 90 2.332 -0.128 12.949 1.00 0.26 H new ATOM 1370 N GLY A 91 4.124 0.277 10.968 1.00 0.20 N ATOM 1371 CA GLY A 91 4.567 -0.269 9.695 1.00 0.21 C ATOM 1372 C GLY A 91 4.027 -1.659 9.424 1.00 0.22 C ATOM 1373 O GLY A 91 2.943 -2.012 9.876 1.00 0.37 O ATOM 0 H GLY A 91 3.309 0.887 10.906 1.00 0.20 H new ATOM 0 HA2 GLY A 91 4.255 0.399 8.892 1.00 0.21 H new ATOM 0 HA3 GLY A 91 5.656 -0.299 9.679 1.00 0.21 H new ATOM 1377 N VAL A 92 4.779 -2.436 8.669 1.00 0.26 N ATOM 1378 CA VAL A 92 4.382 -3.794 8.325 1.00 0.26 C ATOM 1379 C VAL A 92 4.630 -4.746 9.486 1.00 0.24 C ATOM 1380 O VAL A 92 5.718 -4.798 10.063 1.00 0.28 O ATOM 1381 CB VAL A 92 5.116 -4.279 7.062 1.00 0.32 C ATOM 1382 CG1 VAL A 92 5.042 -5.793 6.928 1.00 0.96 C ATOM 1383 CG2 VAL A 92 4.517 -3.616 5.836 1.00 1.03 C ATOM 0 H VAL A 92 5.676 -2.150 8.278 1.00 0.26 H new ATOM 0 HA VAL A 92 3.312 -3.785 8.116 1.00 0.26 H new ATOM 0 HB VAL A 92 6.167 -4.002 7.148 1.00 0.32 H new ATOM 0 HG11 VAL A 92 5.569 -6.105 6.026 1.00 0.96 H new ATOM 0 HG12 VAL A 92 5.505 -6.258 7.798 1.00 0.96 H new ATOM 0 HG13 VAL A 92 3.999 -6.102 6.863 1.00 0.96 H new ATOM 0 HG21 VAL A 92 5.039 -3.962 4.944 1.00 1.03 H new ATOM 0 HG22 VAL A 92 3.461 -3.875 5.762 1.00 1.03 H new ATOM 0 HG23 VAL A 92 4.620 -2.534 5.920 1.00 1.03 H new ATOM 1393 N MET A 93 3.593 -5.487 9.808 1.00 0.22 N ATOM 1394 CA MET A 93 3.580 -6.402 10.936 1.00 0.22 C ATOM 1395 C MET A 93 3.052 -7.764 10.457 1.00 0.22 C ATOM 1396 O MET A 93 2.737 -7.907 9.275 1.00 0.23 O ATOM 1397 CB MET A 93 2.689 -5.801 12.029 1.00 0.21 C ATOM 1398 CG MET A 93 3.157 -4.436 12.510 1.00 0.23 C ATOM 1399 SD MET A 93 4.551 -4.539 13.646 1.00 0.28 S ATOM 1400 CE MET A 93 3.721 -5.196 15.085 1.00 0.27 C ATOM 0 H MET A 93 2.717 -5.473 9.286 1.00 0.22 H new ATOM 0 HA MET A 93 4.579 -6.550 11.345 1.00 0.22 H new ATOM 0 HB2 MET A 93 1.671 -5.714 11.650 1.00 0.21 H new ATOM 0 HB3 MET A 93 2.656 -6.485 12.877 1.00 0.21 H new ATOM 0 HG2 MET A 93 3.439 -3.829 11.650 1.00 0.23 H new ATOM 0 HG3 MET A 93 2.329 -3.926 13.002 1.00 0.23 H new ATOM 0 HE1 MET A 93 4.294 -4.951 15.979 1.00 0.27 H new ATOM 0 HE2 MET A 93 2.725 -4.759 15.162 1.00 0.27 H new ATOM 0 HE3 MET A 93 3.636 -6.279 14.993 1.00 0.27 H new ATOM 1410 N PRO A 94 2.953 -8.780 11.340 1.00 0.25 N ATOM 1411 CA PRO A 94 2.506 -10.131 10.969 1.00 0.30 C ATOM 1412 C PRO A 94 1.268 -10.167 10.066 1.00 0.28 C ATOM 1413 O PRO A 94 1.361 -10.571 8.903 1.00 0.31 O ATOM 1414 CB PRO A 94 2.202 -10.803 12.318 1.00 0.37 C ATOM 1415 CG PRO A 94 2.386 -9.746 13.361 1.00 0.58 C ATOM 1416 CD PRO A 94 3.298 -8.723 12.765 1.00 0.30 C ATOM 0 HA PRO A 94 3.273 -10.632 10.378 1.00 0.30 H new ATOM 0 HB2 PRO A 94 1.185 -11.196 12.337 1.00 0.37 H new ATOM 0 HB3 PRO A 94 2.872 -11.644 12.494 1.00 0.37 H new ATOM 0 HG2 PRO A 94 1.430 -9.301 13.637 1.00 0.58 H new ATOM 0 HG3 PRO A 94 2.815 -10.167 14.270 1.00 0.58 H new ATOM 0 HD2 PRO A 94 3.125 -7.732 13.185 1.00 0.30 H new ATOM 0 HD3 PRO A 94 4.347 -8.964 12.938 1.00 0.30 H new ATOM 1424 N GLN A 95 0.115 -9.731 10.576 1.00 0.29 N ATOM 1425 CA GLN A 95 -1.127 -9.857 9.820 1.00 0.32 C ATOM 1426 C GLN A 95 -1.169 -8.857 8.671 1.00 0.31 C ATOM 1427 O GLN A 95 -1.965 -8.985 7.741 1.00 0.37 O ATOM 1428 CB GLN A 95 -2.356 -9.696 10.720 1.00 0.37 C ATOM 1429 CG GLN A 95 -2.760 -8.260 11.011 1.00 0.45 C ATOM 1430 CD GLN A 95 -4.206 -8.153 11.469 1.00 0.50 C ATOM 1431 OE1 GLN A 95 -5.114 -8.030 10.648 1.00 0.75 O ATOM 1432 NE2 GLN A 95 -4.439 -8.174 12.776 1.00 0.34 N ATOM 0 H GLN A 95 0.017 -9.295 11.493 1.00 0.29 H new ATOM 0 HA GLN A 95 -1.152 -10.864 9.403 1.00 0.32 H new ATOM 0 HB2 GLN A 95 -3.198 -10.206 10.253 1.00 0.37 H new ATOM 0 HB3 GLN A 95 -2.162 -10.201 11.666 1.00 0.37 H new ATOM 0 HG2 GLN A 95 -2.106 -7.849 11.780 1.00 0.45 H new ATOM 0 HG3 GLN A 95 -2.619 -7.656 10.115 1.00 0.45 H new ATOM 0 HE21 GLN A 95 -3.664 -8.277 13.431 1.00 0.34 H new ATOM 0 HE22 GLN A 95 -5.393 -8.087 13.125 1.00 0.34 H new ATOM 1441 N THR A 96 -0.286 -7.878 8.736 1.00 0.26 N ATOM 1442 CA THR A 96 -0.158 -6.889 7.683 1.00 0.25 C ATOM 1443 C THR A 96 0.340 -7.569 6.426 1.00 0.25 C ATOM 1444 O THR A 96 -0.162 -7.329 5.328 1.00 0.31 O ATOM 1445 CB THR A 96 0.830 -5.795 8.079 1.00 0.25 C ATOM 1446 OG1 THR A 96 0.896 -5.722 9.499 1.00 0.24 O ATOM 1447 CG2 THR A 96 0.398 -4.451 7.531 1.00 0.28 C ATOM 0 H THR A 96 0.359 -7.746 9.515 1.00 0.26 H new ATOM 0 HA THR A 96 -1.134 -6.434 7.513 1.00 0.25 H new ATOM 0 HB THR A 96 1.808 -6.040 7.664 1.00 0.25 H new ATOM 0 HG1 THR A 96 1.167 -4.820 9.768 1.00 0.24 H new ATOM 0 HG21 THR A 96 1.119 -3.689 7.827 1.00 0.28 H new ATOM 0 HG22 THR A 96 0.348 -4.500 6.443 1.00 0.28 H new ATOM 0 HG23 THR A 96 -0.585 -4.195 7.928 1.00 0.28 H new ATOM 1455 N VAL A 97 1.328 -8.436 6.605 1.00 0.25 N ATOM 1456 CA VAL A 97 1.871 -9.199 5.514 1.00 0.31 C ATOM 1457 C VAL A 97 0.854 -10.172 4.965 1.00 0.23 C ATOM 1458 O VAL A 97 0.742 -10.346 3.764 1.00 0.24 O ATOM 1459 CB VAL A 97 3.086 -10.021 5.916 1.00 0.48 C ATOM 1460 CG1 VAL A 97 3.664 -10.655 4.684 1.00 1.02 C ATOM 1461 CG2 VAL A 97 4.114 -9.176 6.617 1.00 1.38 C ATOM 0 H VAL A 97 1.766 -8.622 7.507 1.00 0.25 H new ATOM 0 HA VAL A 97 2.156 -8.458 4.767 1.00 0.31 H new ATOM 0 HB VAL A 97 2.779 -10.795 6.620 1.00 0.48 H new ATOM 0 HG11 VAL A 97 4.537 -11.249 4.956 1.00 1.02 H new ATOM 0 HG12 VAL A 97 2.916 -11.300 4.222 1.00 1.02 H new ATOM 0 HG13 VAL A 97 3.959 -9.878 3.979 1.00 1.02 H new ATOM 0 HG21 VAL A 97 4.969 -9.795 6.890 1.00 1.38 H new ATOM 0 HG22 VAL A 97 4.442 -8.377 5.953 1.00 1.38 H new ATOM 0 HG23 VAL A 97 3.677 -8.743 7.517 1.00 1.38 H new ATOM 1471 N GLU A 98 0.134 -10.827 5.855 1.00 0.24 N ATOM 1472 CA GLU A 98 -0.867 -11.804 5.446 1.00 0.29 C ATOM 1473 C GLU A 98 -1.931 -11.134 4.581 1.00 0.31 C ATOM 1474 O GLU A 98 -2.510 -11.759 3.695 1.00 0.37 O ATOM 1475 CB GLU A 98 -1.487 -12.466 6.676 1.00 0.39 C ATOM 1476 CG GLU A 98 -0.443 -13.077 7.596 1.00 0.92 C ATOM 1477 CD GLU A 98 -1.044 -13.833 8.761 1.00 1.64 C ATOM 1478 OE1 GLU A 98 -1.483 -13.175 9.731 1.00 2.35 O ATOM 1479 OE2 GLU A 98 -1.101 -15.074 8.705 1.00 1.97 O ATOM 0 H GLU A 98 0.220 -10.704 6.864 1.00 0.24 H new ATOM 0 HA GLU A 98 -0.389 -12.581 4.850 1.00 0.29 H new ATOM 0 HB2 GLU A 98 -2.066 -11.727 7.229 1.00 0.39 H new ATOM 0 HB3 GLU A 98 -2.183 -13.241 6.355 1.00 0.39 H new ATOM 0 HG2 GLU A 98 0.189 -13.753 7.020 1.00 0.92 H new ATOM 0 HG3 GLU A 98 0.202 -12.286 7.979 1.00 0.92 H new ATOM 1486 N ALA A 99 -2.145 -9.845 4.826 1.00 0.31 N ATOM 1487 CA ALA A 99 -3.022 -9.041 3.991 1.00 0.35 C ATOM 1488 C ALA A 99 -2.367 -8.762 2.638 1.00 0.34 C ATOM 1489 O ALA A 99 -3.049 -8.669 1.617 1.00 0.44 O ATOM 1490 CB ALA A 99 -3.369 -7.738 4.695 1.00 0.39 C ATOM 0 H ALA A 99 -1.719 -9.336 5.601 1.00 0.31 H new ATOM 0 HA ALA A 99 -3.943 -9.598 3.817 1.00 0.35 H new ATOM 0 HB1 ALA A 99 -4.026 -7.145 4.059 1.00 0.39 H new ATOM 0 HB2 ALA A 99 -3.874 -7.956 5.636 1.00 0.39 H new ATOM 0 HB3 ALA A 99 -2.455 -7.178 4.895 1.00 0.39 H new ATOM 1496 N ILE A 100 -1.040 -8.656 2.633 1.00 0.28 N ATOM 1497 CA ILE A 100 -0.295 -8.416 1.415 1.00 0.29 C ATOM 1498 C ILE A 100 -0.239 -9.695 0.607 1.00 0.29 C ATOM 1499 O ILE A 100 -0.457 -9.707 -0.600 1.00 0.34 O ATOM 1500 CB ILE A 100 1.144 -7.976 1.736 1.00 0.32 C ATOM 1501 CG1 ILE A 100 1.147 -6.627 2.459 1.00 0.35 C ATOM 1502 CG2 ILE A 100 1.968 -7.920 0.464 1.00 0.36 C ATOM 1503 CD1 ILE A 100 2.495 -6.252 3.032 1.00 0.41 C ATOM 0 H ILE A 100 -0.462 -8.734 3.469 1.00 0.28 H new ATOM 0 HA ILE A 100 -0.794 -7.627 0.853 1.00 0.29 H new ATOM 0 HB ILE A 100 1.596 -8.710 2.403 1.00 0.32 H new ATOM 0 HG12 ILE A 100 0.828 -5.851 1.764 1.00 0.35 H new ATOM 0 HG13 ILE A 100 0.413 -6.654 3.265 1.00 0.35 H new ATOM 0 HG21 ILE A 100 2.985 -7.608 0.703 1.00 0.36 H new ATOM 0 HG22 ILE A 100 1.991 -8.907 0.001 1.00 0.36 H new ATOM 0 HG23 ILE A 100 1.522 -7.205 -0.228 1.00 0.36 H new ATOM 0 HD11 ILE A 100 2.423 -5.285 3.530 1.00 0.41 H new ATOM 0 HD12 ILE A 100 2.807 -7.008 3.752 1.00 0.41 H new ATOM 0 HD13 ILE A 100 3.228 -6.192 2.228 1.00 0.41 H new ATOM 1515 N ASN A 101 0.045 -10.764 1.316 1.00 0.29 N ATOM 1516 CA ASN A 101 0.130 -12.093 0.756 1.00 0.34 C ATOM 1517 C ASN A 101 -1.171 -12.476 0.063 1.00 0.36 C ATOM 1518 O ASN A 101 -1.151 -13.107 -0.987 1.00 0.43 O ATOM 1519 CB ASN A 101 0.479 -13.074 1.882 1.00 0.44 C ATOM 1520 CG ASN A 101 1.964 -13.144 2.142 1.00 0.53 C ATOM 1521 OD1 ASN A 101 2.770 -13.115 1.211 1.00 0.67 O ATOM 1522 ND2 ASN A 101 2.343 -13.191 3.405 1.00 0.64 N ATOM 0 H ASN A 101 0.227 -10.733 2.319 1.00 0.29 H new ATOM 0 HA ASN A 101 0.911 -12.126 -0.004 1.00 0.34 H new ATOM 0 HB2 ASN A 101 -0.034 -12.772 2.795 1.00 0.44 H new ATOM 0 HB3 ASN A 101 0.111 -14.067 1.623 1.00 0.44 H new ATOM 0 HD21 ASN A 101 3.336 -13.204 3.639 1.00 0.64 H new ATOM 0 HD22 ASN A 101 1.643 -13.214 4.147 1.00 0.64 H new ATOM 1529 N HIS A 102 -2.293 -12.066 0.635 1.00 0.35 N ATOM 1530 CA HIS A 102 -3.591 -12.304 0.027 1.00 0.43 C ATOM 1531 C HIS A 102 -3.757 -11.412 -1.208 1.00 0.37 C ATOM 1532 O HIS A 102 -4.306 -11.831 -2.233 1.00 0.41 O ATOM 1533 CB HIS A 102 -4.698 -12.027 1.051 1.00 0.61 C ATOM 1534 CG HIS A 102 -6.054 -12.515 0.638 1.00 1.18 C ATOM 1535 ND1 HIS A 102 -6.780 -13.435 1.360 1.00 2.07 N ATOM 1536 CD2 HIS A 102 -6.821 -12.182 -0.419 1.00 1.10 C ATOM 1537 CE1 HIS A 102 -7.939 -13.646 0.764 1.00 2.50 C ATOM 1538 NE2 HIS A 102 -7.991 -12.897 -0.321 1.00 1.91 N ATOM 0 H HIS A 102 -2.329 -11.565 1.523 1.00 0.35 H new ATOM 0 HA HIS A 102 -3.662 -13.345 -0.288 1.00 0.43 H new ATOM 0 HB2 HIS A 102 -4.428 -12.496 1.997 1.00 0.61 H new ATOM 0 HB3 HIS A 102 -4.750 -10.953 1.231 1.00 0.61 H new ATOM 0 HD2 HIS A 102 -6.564 -11.482 -1.200 1.00 1.10 H new ATOM 0 HE1 HIS A 102 -8.713 -14.317 1.106 1.00 2.50 H new ATOM 0 HE2 HIS A 102 -8.770 -12.855 -0.978 1.00 1.91 H new ATOM 1547 N ALA A 103 -3.255 -10.190 -1.108 1.00 0.37 N ATOM 1548 CA ALA A 103 -3.380 -9.213 -2.181 1.00 0.41 C ATOM 1549 C ALA A 103 -2.515 -9.579 -3.386 1.00 0.40 C ATOM 1550 O ALA A 103 -2.974 -9.495 -4.521 1.00 0.44 O ATOM 1551 CB ALA A 103 -3.024 -7.825 -1.680 1.00 0.47 C ATOM 0 H ALA A 103 -2.753 -9.849 -0.288 1.00 0.37 H new ATOM 0 HA ALA A 103 -4.420 -9.218 -2.507 1.00 0.41 H new ATOM 0 HB1 ALA A 103 -3.123 -7.108 -2.495 1.00 0.47 H new ATOM 0 HB2 ALA A 103 -3.697 -7.547 -0.869 1.00 0.47 H new ATOM 0 HB3 ALA A 103 -1.996 -7.822 -1.317 1.00 0.47 H new ATOM 1557 N LYS A 104 -1.272 -9.986 -3.138 1.00 0.41 N ATOM 1558 CA LYS A 104 -0.349 -10.336 -4.216 1.00 0.49 C ATOM 1559 C LYS A 104 -0.686 -11.692 -4.779 1.00 0.54 C ATOM 1560 O LYS A 104 -0.414 -11.981 -5.943 1.00 0.66 O ATOM 1561 CB LYS A 104 1.078 -10.351 -3.703 1.00 0.61 C ATOM 1562 CG LYS A 104 1.458 -9.080 -2.992 1.00 0.70 C ATOM 1563 CD LYS A 104 1.437 -7.871 -3.922 1.00 0.84 C ATOM 1564 CE LYS A 104 2.613 -7.852 -4.898 1.00 0.99 C ATOM 1565 NZ LYS A 104 2.469 -8.840 -6.006 1.00 1.66 N ATOM 0 H LYS A 104 -0.881 -10.082 -2.201 1.00 0.41 H new ATOM 0 HA LYS A 104 -0.445 -9.586 -5.001 1.00 0.49 H new ATOM 0 HB2 LYS A 104 1.206 -11.194 -3.023 1.00 0.61 H new ATOM 0 HB3 LYS A 104 1.758 -10.511 -4.540 1.00 0.61 H new ATOM 0 HG2 LYS A 104 0.771 -8.910 -2.163 1.00 0.70 H new ATOM 0 HG3 LYS A 104 2.454 -9.189 -2.563 1.00 0.70 H new ATOM 0 HD2 LYS A 104 0.504 -7.868 -4.485 1.00 0.84 H new ATOM 0 HD3 LYS A 104 1.452 -6.959 -3.325 1.00 0.84 H new ATOM 0 HE2 LYS A 104 2.710 -6.852 -5.321 1.00 0.99 H new ATOM 0 HE3 LYS A 104 3.534 -8.058 -4.352 1.00 0.99 H new ATOM 0 HZ1 LYS A 104 2.936 -8.474 -6.860 1.00 1.66 H new ATOM 0 HZ2 LYS A 104 2.911 -9.740 -5.729 1.00 1.66 H new ATOM 0 HZ3 LYS A 104 1.460 -8.996 -6.203 1.00 1.66 H new ATOM 1579 N ALA A 105 -1.250 -12.529 -3.928 1.00 0.51 N ATOM 1580 CA ALA A 105 -1.759 -13.832 -4.360 1.00 0.61 C ATOM 1581 C ALA A 105 -2.677 -13.667 -5.565 1.00 0.62 C ATOM 1582 O ALA A 105 -2.594 -14.419 -6.537 1.00 0.77 O ATOM 1583 CB ALA A 105 -2.498 -14.533 -3.233 1.00 0.65 C ATOM 0 H ALA A 105 -1.370 -12.337 -2.934 1.00 0.51 H new ATOM 0 HA ALA A 105 -0.906 -14.449 -4.643 1.00 0.61 H new ATOM 0 HB1 ALA A 105 -2.865 -15.498 -3.583 1.00 0.65 H new ATOM 0 HB2 ALA A 105 -1.820 -14.685 -2.393 1.00 0.65 H new ATOM 0 HB3 ALA A 105 -3.340 -13.919 -2.913 1.00 0.65 H new ATOM 1589 N ALA A 106 -3.556 -12.679 -5.494 1.00 0.54 N ATOM 1590 CA ALA A 106 -4.396 -12.331 -6.632 1.00 0.64 C ATOM 1591 C ALA A 106 -3.658 -11.375 -7.567 1.00 0.64 C ATOM 1592 O ALA A 106 -3.840 -11.412 -8.784 1.00 0.74 O ATOM 1593 CB ALA A 106 -5.703 -11.716 -6.157 1.00 0.68 C ATOM 0 H ALA A 106 -3.707 -12.105 -4.664 1.00 0.54 H new ATOM 0 HA ALA A 106 -4.626 -13.241 -7.186 1.00 0.64 H new ATOM 0 HB1 ALA A 106 -6.320 -11.461 -7.019 1.00 0.68 H new ATOM 0 HB2 ALA A 106 -6.235 -12.431 -5.529 1.00 0.68 H new ATOM 0 HB3 ALA A 106 -5.493 -10.814 -5.582 1.00 0.68 H new ATOM 1599 N ASN A 107 -2.852 -10.505 -6.949 1.00 0.59 N ATOM 1600 CA ASN A 107 -1.942 -9.579 -7.628 1.00 0.65 C ATOM 1601 C ASN A 107 -2.702 -8.338 -8.035 1.00 0.60 C ATOM 1602 O ASN A 107 -2.522 -7.782 -9.118 1.00 0.85 O ATOM 1603 CB ASN A 107 -1.224 -10.209 -8.814 1.00 0.85 C ATOM 1604 CG ASN A 107 0.069 -9.497 -9.137 1.00 1.04 C ATOM 1605 OD1 ASN A 107 0.694 -8.887 -8.263 1.00 1.17 O ATOM 1606 ND2 ASN A 107 0.492 -9.598 -10.377 1.00 1.41 N ATOM 0 H ASN A 107 -2.814 -10.424 -5.933 1.00 0.59 H new ATOM 0 HA ASN A 107 -1.156 -9.309 -6.923 1.00 0.65 H new ATOM 0 HB2 ASN A 107 -1.016 -11.257 -8.597 1.00 0.85 H new ATOM 0 HB3 ASN A 107 -1.877 -10.188 -9.686 1.00 0.85 H new ATOM 0 HD21 ASN A 107 1.372 -9.162 -10.653 1.00 1.41 H new ATOM 0 HD22 ASN A 107 -0.059 -10.113 -11.064 1.00 1.41 H new ATOM 1613 N VAL A 108 -3.552 -7.924 -7.118 1.00 0.44 N ATOM 1614 CA VAL A 108 -4.423 -6.788 -7.296 1.00 0.42 C ATOM 1615 C VAL A 108 -3.699 -5.487 -6.964 1.00 0.37 C ATOM 1616 O VAL A 108 -2.854 -5.458 -6.065 1.00 0.38 O ATOM 1617 CB VAL A 108 -5.638 -6.952 -6.366 1.00 0.49 C ATOM 1618 CG1 VAL A 108 -6.373 -5.647 -6.207 1.00 1.06 C ATOM 1619 CG2 VAL A 108 -6.566 -8.029 -6.895 1.00 1.35 C ATOM 0 H VAL A 108 -3.656 -8.379 -6.211 1.00 0.44 H new ATOM 0 HA VAL A 108 -4.741 -6.743 -8.338 1.00 0.42 H new ATOM 0 HB VAL A 108 -5.278 -7.257 -5.383 1.00 0.49 H new ATOM 0 HG11 VAL A 108 -7.227 -5.789 -5.545 1.00 1.06 H new ATOM 0 HG12 VAL A 108 -5.703 -4.902 -5.779 1.00 1.06 H new ATOM 0 HG13 VAL A 108 -6.722 -5.305 -7.181 1.00 1.06 H new ATOM 0 HG21 VAL A 108 -7.421 -8.133 -6.227 1.00 1.35 H new ATOM 0 HG22 VAL A 108 -6.915 -7.752 -7.890 1.00 1.35 H new ATOM 0 HG23 VAL A 108 -6.030 -8.977 -6.949 1.00 1.35 H new ATOM 1629 N PRO A 109 -4.018 -4.399 -7.689 1.00 0.35 N ATOM 1630 CA PRO A 109 -3.517 -3.071 -7.360 1.00 0.33 C ATOM 1631 C PRO A 109 -3.990 -2.623 -5.984 1.00 0.28 C ATOM 1632 O PRO A 109 -5.153 -2.829 -5.603 1.00 0.29 O ATOM 1633 CB PRO A 109 -4.088 -2.159 -8.443 1.00 0.37 C ATOM 1634 CG PRO A 109 -4.551 -3.068 -9.534 1.00 0.47 C ATOM 1635 CD PRO A 109 -4.874 -4.385 -8.886 1.00 0.40 C ATOM 0 HA PRO A 109 -2.428 -3.050 -7.327 1.00 0.33 H new ATOM 0 HB2 PRO A 109 -4.912 -1.560 -8.056 1.00 0.37 H new ATOM 0 HB3 PRO A 109 -3.332 -1.463 -8.807 1.00 0.37 H new ATOM 0 HG2 PRO A 109 -5.428 -2.657 -10.035 1.00 0.47 H new ATOM 0 HG3 PRO A 109 -3.778 -3.189 -10.293 1.00 0.47 H new ATOM 0 HD2 PRO A 109 -5.930 -4.455 -8.625 1.00 0.40 H new ATOM 0 HD3 PRO A 109 -4.653 -5.223 -9.547 1.00 0.40 H new ATOM 1643 N ILE A 110 -3.098 -2.005 -5.238 1.00 0.25 N ATOM 1644 CA ILE A 110 -3.390 -1.692 -3.858 1.00 0.21 C ATOM 1645 C ILE A 110 -3.627 -0.199 -3.642 1.00 0.19 C ATOM 1646 O ILE A 110 -3.221 0.649 -4.439 1.00 0.23 O ATOM 1647 CB ILE A 110 -2.247 -2.194 -2.935 1.00 0.23 C ATOM 1648 CG1 ILE A 110 -2.168 -3.724 -2.984 1.00 0.38 C ATOM 1649 CG2 ILE A 110 -2.405 -1.708 -1.500 1.00 0.21 C ATOM 1650 CD1 ILE A 110 -1.961 -4.362 -1.629 1.00 0.60 C ATOM 0 H ILE A 110 -2.175 -1.713 -5.561 1.00 0.25 H new ATOM 0 HA ILE A 110 -4.314 -2.209 -3.599 1.00 0.21 H new ATOM 0 HB ILE A 110 -1.314 -1.773 -3.309 1.00 0.23 H new ATOM 0 HG12 ILE A 110 -3.086 -4.113 -3.423 1.00 0.38 H new ATOM 0 HG13 ILE A 110 -1.351 -4.017 -3.643 1.00 0.38 H new ATOM 0 HG21 ILE A 110 -1.581 -2.086 -0.895 1.00 0.21 H new ATOM 0 HG22 ILE A 110 -2.398 -0.618 -1.482 1.00 0.21 H new ATOM 0 HG23 ILE A 110 -3.349 -2.072 -1.095 1.00 0.21 H new ATOM 0 HD11 ILE A 110 -1.915 -5.445 -1.740 1.00 0.60 H new ATOM 0 HD12 ILE A 110 -1.028 -4.002 -1.196 1.00 0.60 H new ATOM 0 HD13 ILE A 110 -2.791 -4.100 -0.973 1.00 0.60 H new ATOM 1662 N ILE A 111 -4.302 0.072 -2.549 1.00 0.18 N ATOM 1663 CA ILE A 111 -4.519 1.407 -2.032 1.00 0.18 C ATOM 1664 C ILE A 111 -4.042 1.404 -0.592 1.00 0.16 C ATOM 1665 O ILE A 111 -4.785 1.083 0.334 1.00 0.18 O ATOM 1666 CB ILE A 111 -6.007 1.850 -2.114 1.00 0.25 C ATOM 1667 CG1 ILE A 111 -6.360 2.270 -3.538 1.00 0.32 C ATOM 1668 CG2 ILE A 111 -6.298 3.003 -1.153 1.00 0.27 C ATOM 1669 CD1 ILE A 111 -5.831 3.640 -3.894 1.00 0.37 C ATOM 0 H ILE A 111 -4.730 -0.654 -1.975 1.00 0.18 H new ATOM 0 HA ILE A 111 -3.966 2.125 -2.638 1.00 0.18 H new ATOM 0 HB ILE A 111 -6.621 0.997 -1.825 1.00 0.25 H new ATOM 0 HG12 ILE A 111 -5.958 1.537 -4.238 1.00 0.32 H new ATOM 0 HG13 ILE A 111 -7.444 2.262 -3.656 1.00 0.32 H new ATOM 0 HG21 ILE A 111 -7.347 3.289 -1.235 1.00 0.27 H new ATOM 0 HG22 ILE A 111 -6.087 2.687 -0.131 1.00 0.27 H new ATOM 0 HG23 ILE A 111 -5.668 3.856 -1.407 1.00 0.27 H new ATOM 0 HD11 ILE A 111 -6.113 3.884 -4.918 1.00 0.37 H new ATOM 0 HD12 ILE A 111 -6.253 4.381 -3.215 1.00 0.37 H new ATOM 0 HD13 ILE A 111 -4.745 3.645 -3.806 1.00 0.37 H new ATOM 1681 N VAL A 112 -2.770 1.658 -0.417 1.00 0.16 N ATOM 1682 CA VAL A 112 -2.200 1.691 0.898 1.00 0.18 C ATOM 1683 C VAL A 112 -2.538 2.990 1.571 1.00 0.20 C ATOM 1684 O VAL A 112 -2.669 4.029 0.933 1.00 0.22 O ATOM 1685 CB VAL A 112 -0.680 1.539 0.869 1.00 0.19 C ATOM 1686 CG1 VAL A 112 -0.122 1.540 2.258 1.00 0.26 C ATOM 1687 CG2 VAL A 112 -0.280 0.274 0.167 1.00 0.19 C ATOM 0 H VAL A 112 -2.111 1.845 -1.173 1.00 0.16 H new ATOM 0 HA VAL A 112 -2.621 0.851 1.450 1.00 0.18 H new ATOM 0 HB VAL A 112 -0.273 2.389 0.321 1.00 0.19 H new ATOM 0 HG11 VAL A 112 0.962 1.431 2.215 1.00 0.26 H new ATOM 0 HG12 VAL A 112 -0.373 2.480 2.750 1.00 0.26 H new ATOM 0 HG13 VAL A 112 -0.548 0.710 2.822 1.00 0.26 H new ATOM 0 HG21 VAL A 112 0.807 0.190 0.160 1.00 0.19 H new ATOM 0 HG22 VAL A 112 -0.707 -0.582 0.689 1.00 0.19 H new ATOM 0 HG23 VAL A 112 -0.649 0.295 -0.858 1.00 0.19 H new ATOM 1697 N ALA A 113 -2.664 2.913 2.859 1.00 0.21 N ATOM 1698 CA ALA A 113 -2.923 4.079 3.662 1.00 0.24 C ATOM 1699 C ALA A 113 -2.131 4.028 4.948 1.00 0.25 C ATOM 1700 O ALA A 113 -2.372 3.196 5.825 1.00 0.28 O ATOM 1701 CB ALA A 113 -4.407 4.232 3.914 1.00 0.29 C ATOM 0 H ALA A 113 -2.591 2.044 3.388 1.00 0.21 H new ATOM 0 HA ALA A 113 -2.594 4.963 3.115 1.00 0.24 H new ATOM 0 HB1 ALA A 113 -4.583 5.119 4.523 1.00 0.29 H new ATOM 0 HB2 ALA A 113 -4.929 4.335 2.963 1.00 0.29 H new ATOM 0 HB3 ALA A 113 -4.780 3.352 4.438 1.00 0.29 H new ATOM 1707 N ILE A 114 -1.157 4.911 5.016 1.00 0.24 N ATOM 1708 CA ILE A 114 -0.302 5.052 6.166 1.00 0.27 C ATOM 1709 C ILE A 114 -0.964 5.959 7.185 1.00 0.30 C ATOM 1710 O ILE A 114 -1.036 7.160 6.972 1.00 0.50 O ATOM 1711 CB ILE A 114 1.064 5.639 5.748 1.00 0.33 C ATOM 1712 CG1 ILE A 114 1.874 4.607 4.982 1.00 0.38 C ATOM 1713 CG2 ILE A 114 1.840 6.117 6.949 1.00 0.44 C ATOM 1714 CD1 ILE A 114 1.481 4.467 3.529 1.00 0.59 C ATOM 0 H ILE A 114 -0.937 5.559 4.260 1.00 0.24 H new ATOM 0 HA ILE A 114 -0.139 4.070 6.609 1.00 0.27 H new ATOM 0 HB ILE A 114 0.876 6.494 5.099 1.00 0.33 H new ATOM 0 HG12 ILE A 114 2.929 4.875 5.037 1.00 0.38 H new ATOM 0 HG13 ILE A 114 1.765 3.639 5.471 1.00 0.38 H new ATOM 0 HG21 ILE A 114 2.797 6.525 6.625 1.00 0.44 H new ATOM 0 HG22 ILE A 114 1.272 6.891 7.465 1.00 0.44 H new ATOM 0 HG23 ILE A 114 2.013 5.281 7.627 1.00 0.44 H new ATOM 0 HD11 ILE A 114 2.106 3.711 3.054 1.00 0.59 H new ATOM 0 HD12 ILE A 114 0.435 4.167 3.462 1.00 0.59 H new ATOM 0 HD13 ILE A 114 1.618 5.422 3.022 1.00 0.59 H new ATOM 1726 N ASN A 115 -1.427 5.388 8.292 1.00 0.19 N ATOM 1727 CA ASN A 115 -2.249 6.120 9.254 1.00 0.22 C ATOM 1728 C ASN A 115 -1.363 6.549 10.369 1.00 0.20 C ATOM 1729 O ASN A 115 -0.164 6.259 10.345 1.00 0.22 O ATOM 1730 CB ASN A 115 -3.421 5.257 9.762 1.00 0.33 C ATOM 1731 CG ASN A 115 -3.107 4.420 10.986 1.00 0.84 C ATOM 1732 OD1 ASN A 115 -2.014 3.924 11.151 1.00 1.85 O ATOM 1733 ND2 ASN A 115 -4.075 4.270 11.865 1.00 0.56 N ATOM 0 H ASN A 115 -1.247 4.417 8.547 1.00 0.19 H new ATOM 0 HA ASN A 115 -2.698 6.992 8.778 1.00 0.22 H new ATOM 0 HB2 ASN A 115 -4.263 5.910 9.992 1.00 0.33 H new ATOM 0 HB3 ASN A 115 -3.742 4.595 8.958 1.00 0.33 H new ATOM 0 HD21 ASN A 115 -3.915 3.724 12.712 1.00 0.56 H new ATOM 0 HD22 ASN A 115 -4.985 4.699 11.699 1.00 0.56 H new ATOM 1740 N LYS A 116 -1.929 7.263 11.318 1.00 0.19 N ATOM 1741 CA LYS A 116 -1.173 7.696 12.452 1.00 0.20 C ATOM 1742 C LYS A 116 -0.185 8.770 12.041 1.00 0.21 C ATOM 1743 O LYS A 116 0.866 8.934 12.656 1.00 0.26 O ATOM 1744 CB LYS A 116 -0.456 6.499 13.081 1.00 0.25 C ATOM 1745 CG LYS A 116 -1.375 5.589 13.864 1.00 0.32 C ATOM 1746 CD LYS A 116 -0.583 4.640 14.739 1.00 0.40 C ATOM 1747 CE LYS A 116 -1.403 3.448 15.202 1.00 0.51 C ATOM 1748 NZ LYS A 116 -0.586 2.518 16.027 1.00 0.59 N ATOM 0 H LYS A 116 -2.908 7.551 11.319 1.00 0.19 H new ATOM 0 HA LYS A 116 -1.846 8.124 13.195 1.00 0.20 H new ATOM 0 HB2 LYS A 116 0.030 5.922 12.294 1.00 0.25 H new ATOM 0 HB3 LYS A 116 0.331 6.863 13.741 1.00 0.25 H new ATOM 0 HG2 LYS A 116 -2.044 6.187 14.483 1.00 0.32 H new ATOM 0 HG3 LYS A 116 -2.000 5.019 13.177 1.00 0.32 H new ATOM 0 HD2 LYS A 116 0.288 4.285 14.188 1.00 0.40 H new ATOM 0 HD3 LYS A 116 -0.211 5.180 15.610 1.00 0.40 H new ATOM 0 HE2 LYS A 116 -2.259 3.795 15.781 1.00 0.51 H new ATOM 0 HE3 LYS A 116 -1.799 2.917 14.336 1.00 0.51 H new ATOM 0 HZ1 LYS A 116 -1.047 1.586 16.059 1.00 0.59 H new ATOM 0 HZ2 LYS A 116 0.361 2.422 15.607 1.00 0.59 H new ATOM 0 HZ3 LYS A 116 -0.500 2.895 16.992 1.00 0.59 H new ATOM 1762 N MET A 117 -0.541 9.512 11.000 1.00 0.21 N ATOM 1763 CA MET A 117 0.271 10.630 10.562 1.00 0.28 C ATOM 1764 C MET A 117 -0.048 11.821 11.436 1.00 0.29 C ATOM 1765 O MET A 117 0.591 12.868 11.369 1.00 0.37 O ATOM 1766 CB MET A 117 0.011 10.910 9.089 1.00 0.38 C ATOM 1767 CG MET A 117 0.492 9.776 8.202 1.00 0.48 C ATOM 1768 SD MET A 117 2.279 9.730 8.048 1.00 0.77 S ATOM 1769 CE MET A 117 2.556 11.237 7.131 1.00 0.92 C ATOM 0 H MET A 117 -1.384 9.357 10.448 1.00 0.21 H new ATOM 0 HA MET A 117 1.333 10.404 10.661 1.00 0.28 H new ATOM 0 HB2 MET A 117 -1.056 11.065 8.932 1.00 0.38 H new ATOM 0 HB3 MET A 117 0.513 11.834 8.801 1.00 0.38 H new ATOM 0 HG2 MET A 117 0.142 8.828 8.609 1.00 0.48 H new ATOM 0 HG3 MET A 117 0.048 9.881 7.212 1.00 0.48 H new ATOM 0 HE1 MET A 117 3.008 10.999 6.168 1.00 0.92 H new ATOM 0 HE2 MET A 117 1.605 11.745 6.970 1.00 0.92 H new ATOM 0 HE3 MET A 117 3.224 11.888 7.695 1.00 0.92 H new ATOM 1779 N ASP A 118 -1.064 11.616 12.257 1.00 0.27 N ATOM 1780 CA ASP A 118 -1.394 12.516 13.346 1.00 0.34 C ATOM 1781 C ASP A 118 -0.308 12.451 14.410 1.00 0.33 C ATOM 1782 O ASP A 118 -0.050 13.428 15.114 1.00 0.47 O ATOM 1783 CB ASP A 118 -2.744 12.120 13.950 1.00 0.39 C ATOM 1784 CG ASP A 118 -2.873 10.619 14.139 1.00 0.55 C ATOM 1785 OD1 ASP A 118 -3.296 9.933 13.178 1.00 0.67 O ATOM 1786 OD2 ASP A 118 -2.547 10.116 15.236 1.00 0.76 O ATOM 0 H ASP A 118 -1.688 10.812 12.185 1.00 0.27 H new ATOM 0 HA ASP A 118 -1.460 13.536 12.966 1.00 0.34 H new ATOM 0 HB2 ASP A 118 -2.869 12.617 14.912 1.00 0.39 H new ATOM 0 HB3 ASP A 118 -3.547 12.473 13.302 1.00 0.39 H new ATOM 1791 N LYS A 119 0.317 11.283 14.528 1.00 0.23 N ATOM 1792 CA LYS A 119 1.447 11.097 15.415 1.00 0.26 C ATOM 1793 C LYS A 119 2.669 11.807 14.859 1.00 0.28 C ATOM 1794 O LYS A 119 2.988 11.669 13.682 1.00 0.26 O ATOM 1795 CB LYS A 119 1.760 9.603 15.569 1.00 0.29 C ATOM 1796 CG LYS A 119 0.700 8.822 16.319 1.00 0.36 C ATOM 1797 CD LYS A 119 1.100 7.366 16.504 1.00 0.72 C ATOM 1798 CE LYS A 119 2.462 7.225 17.177 1.00 0.87 C ATOM 1799 NZ LYS A 119 2.473 7.755 18.565 1.00 1.17 N ATOM 0 H LYS A 119 0.051 10.445 14.011 1.00 0.23 H new ATOM 0 HA LYS A 119 1.194 11.516 16.389 1.00 0.26 H new ATOM 0 HB2 LYS A 119 1.886 9.165 14.579 1.00 0.29 H new ATOM 0 HB3 LYS A 119 2.712 9.494 16.089 1.00 0.29 H new ATOM 0 HG2 LYS A 119 0.532 9.280 17.294 1.00 0.36 H new ATOM 0 HG3 LYS A 119 -0.243 8.874 15.775 1.00 0.36 H new ATOM 0 HD2 LYS A 119 0.346 6.857 17.104 1.00 0.72 H new ATOM 0 HD3 LYS A 119 1.123 6.871 15.533 1.00 0.72 H new ATOM 0 HE2 LYS A 119 2.748 6.173 17.192 1.00 0.87 H new ATOM 0 HE3 LYS A 119 3.211 7.751 16.586 1.00 0.87 H new ATOM 0 HZ1 LYS A 119 3.395 7.558 19.004 1.00 1.17 H new ATOM 0 HZ2 LYS A 119 2.311 8.782 18.546 1.00 1.17 H new ATOM 0 HZ3 LYS A 119 1.721 7.296 19.118 1.00 1.17 H new ATOM 1813 N PRO A 120 3.366 12.588 15.695 1.00 0.38 N ATOM 1814 CA PRO A 120 4.641 13.202 15.316 1.00 0.45 C ATOM 1815 C PRO A 120 5.713 12.144 15.053 1.00 0.40 C ATOM 1816 O PRO A 120 6.760 12.428 14.471 1.00 0.45 O ATOM 1817 CB PRO A 120 5.020 14.051 16.533 1.00 0.57 C ATOM 1818 CG PRO A 120 4.210 13.517 17.663 1.00 0.58 C ATOM 1819 CD PRO A 120 2.953 12.962 17.059 1.00 0.48 C ATOM 0 HA PRO A 120 4.559 13.782 14.397 1.00 0.45 H new ATOM 0 HB2 PRO A 120 6.086 13.977 16.746 1.00 0.57 H new ATOM 0 HB3 PRO A 120 4.803 15.105 16.359 1.00 0.57 H new ATOM 0 HG2 PRO A 120 4.757 12.743 18.201 1.00 0.58 H new ATOM 0 HG3 PRO A 120 3.981 14.303 18.382 1.00 0.58 H new ATOM 0 HD2 PRO A 120 2.585 12.101 17.618 1.00 0.48 H new ATOM 0 HD3 PRO A 120 2.152 13.701 17.048 1.00 0.48 H new ATOM 1827 N GLU A 121 5.432 10.927 15.499 1.00 0.35 N ATOM 1828 CA GLU A 121 6.331 9.794 15.308 1.00 0.37 C ATOM 1829 C GLU A 121 6.011 9.068 14.001 1.00 0.30 C ATOM 1830 O GLU A 121 6.567 8.007 13.718 1.00 0.37 O ATOM 1831 CB GLU A 121 6.196 8.830 16.485 1.00 0.48 C ATOM 1832 CG GLU A 121 6.198 9.530 17.832 1.00 0.62 C ATOM 1833 CD GLU A 121 6.095 8.566 18.993 1.00 1.04 C ATOM 1834 OE1 GLU A 121 5.103 7.810 19.054 1.00 1.45 O ATOM 1835 OE2 GLU A 121 7.012 8.550 19.843 1.00 1.40 O ATOM 0 H GLU A 121 4.576 10.696 16.003 1.00 0.35 H new ATOM 0 HA GLU A 121 7.355 10.163 15.256 1.00 0.37 H new ATOM 0 HB2 GLU A 121 5.271 8.263 16.378 1.00 0.48 H new ATOM 0 HB3 GLU A 121 7.015 8.112 16.454 1.00 0.48 H new ATOM 0 HG2 GLU A 121 7.112 10.115 17.931 1.00 0.62 H new ATOM 0 HG3 GLU A 121 5.365 10.232 17.873 1.00 0.62 H new ATOM 1842 N ALA A 122 5.088 9.641 13.233 1.00 0.24 N ATOM 1843 CA ALA A 122 4.723 9.118 11.919 1.00 0.22 C ATOM 1844 C ALA A 122 5.942 8.975 11.025 1.00 0.21 C ATOM 1845 O ALA A 122 6.677 9.938 10.797 1.00 0.26 O ATOM 1846 CB ALA A 122 3.711 10.033 11.254 1.00 0.27 C ATOM 0 H ALA A 122 4.573 10.479 13.503 1.00 0.24 H new ATOM 0 HA ALA A 122 4.284 8.131 12.064 1.00 0.22 H new ATOM 0 HB1 ALA A 122 3.447 9.633 10.275 1.00 0.27 H new ATOM 0 HB2 ALA A 122 2.816 10.097 11.873 1.00 0.27 H new ATOM 0 HB3 ALA A 122 4.142 11.027 11.135 1.00 0.27 H new ATOM 1852 N ASN A 123 6.149 7.775 10.518 1.00 0.21 N ATOM 1853 CA ASN A 123 7.199 7.538 9.547 1.00 0.23 C ATOM 1854 C ASN A 123 6.581 6.897 8.325 1.00 0.23 C ATOM 1855 O ASN A 123 6.723 5.697 8.088 1.00 0.25 O ATOM 1856 CB ASN A 123 8.284 6.628 10.119 1.00 0.26 C ATOM 1857 CG ASN A 123 9.662 7.102 9.821 1.00 0.42 C ATOM 1858 OD1 ASN A 123 10.595 6.870 10.592 1.00 0.95 O ATOM 1859 ND2 ASN A 123 9.812 7.758 8.710 1.00 0.52 N ATOM 0 H ASN A 123 5.603 6.949 10.763 1.00 0.21 H new ATOM 0 HA ASN A 123 7.667 8.487 9.285 1.00 0.23 H new ATOM 0 HB2 ASN A 123 8.157 6.556 11.199 1.00 0.26 H new ATOM 0 HB3 ASN A 123 8.157 5.623 9.716 1.00 0.26 H new ATOM 0 HD21 ASN A 123 10.733 8.106 8.444 1.00 0.52 H new ATOM 0 HD22 ASN A 123 9.009 7.925 8.104 1.00 0.52 H new ATOM 1866 N PRO A 124 5.898 7.707 7.521 1.00 0.25 N ATOM 1867 CA PRO A 124 5.084 7.224 6.410 1.00 0.32 C ATOM 1868 C PRO A 124 5.887 6.540 5.337 1.00 0.33 C ATOM 1869 O PRO A 124 5.703 5.363 5.067 1.00 0.35 O ATOM 1870 CB PRO A 124 4.463 8.493 5.861 1.00 0.40 C ATOM 1871 CG PRO A 124 5.376 9.584 6.279 1.00 0.32 C ATOM 1872 CD PRO A 124 5.847 9.178 7.637 1.00 0.27 C ATOM 0 HA PRO A 124 4.367 6.473 6.741 1.00 0.32 H new ATOM 0 HB2 PRO A 124 4.372 8.449 4.776 1.00 0.40 H new ATOM 0 HB3 PRO A 124 3.460 8.645 6.259 1.00 0.40 H new ATOM 0 HG2 PRO A 124 6.210 9.691 5.585 1.00 0.32 H new ATOM 0 HG3 PRO A 124 4.860 10.544 6.308 1.00 0.32 H new ATOM 0 HD2 PRO A 124 6.823 9.602 7.873 1.00 0.27 H new ATOM 0 HD3 PRO A 124 5.161 9.501 8.420 1.00 0.27 H new ATOM 1880 N ASP A 125 6.779 7.296 4.736 1.00 0.37 N ATOM 1881 CA ASP A 125 7.617 6.798 3.658 1.00 0.44 C ATOM 1882 C ASP A 125 8.496 5.654 4.135 1.00 0.34 C ATOM 1883 O ASP A 125 9.034 4.899 3.329 1.00 0.33 O ATOM 1884 CB ASP A 125 8.481 7.924 3.113 1.00 0.61 C ATOM 1885 CG ASP A 125 7.650 9.105 2.649 1.00 0.99 C ATOM 1886 OD1 ASP A 125 7.319 9.979 3.478 1.00 1.44 O ATOM 1887 OD2 ASP A 125 7.341 9.175 1.440 1.00 1.13 O ATOM 0 H ASP A 125 6.947 8.273 4.977 1.00 0.37 H new ATOM 0 HA ASP A 125 6.969 6.423 2.866 1.00 0.44 H new ATOM 0 HB2 ASP A 125 9.178 8.252 3.884 1.00 0.61 H new ATOM 0 HB3 ASP A 125 9.079 7.552 2.281 1.00 0.61 H new ATOM 1892 N ARG A 126 8.623 5.513 5.448 1.00 0.31 N ATOM 1893 CA ARG A 126 9.393 4.413 6.009 1.00 0.31 C ATOM 1894 C ARG A 126 8.592 3.132 5.896 1.00 0.27 C ATOM 1895 O ARG A 126 9.015 2.161 5.273 1.00 0.30 O ATOM 1896 CB ARG A 126 9.741 4.687 7.470 1.00 0.35 C ATOM 1897 CG ARG A 126 10.236 3.465 8.237 1.00 0.51 C ATOM 1898 CD ARG A 126 11.467 2.840 7.599 1.00 1.24 C ATOM 1899 NE ARG A 126 11.758 1.525 8.170 1.00 1.92 N ATOM 1900 CZ ARG A 126 12.684 0.687 7.699 1.00 2.94 C ATOM 1901 NH1 ARG A 126 13.448 1.038 6.671 1.00 3.49 N ATOM 1902 NH2 ARG A 126 12.849 -0.500 8.269 1.00 3.79 N ATOM 0 H ARG A 126 8.207 6.140 6.137 1.00 0.31 H new ATOM 0 HA ARG A 126 10.324 4.312 5.451 1.00 0.31 H new ATOM 0 HB2 ARG A 126 10.507 5.461 7.510 1.00 0.35 H new ATOM 0 HB3 ARG A 126 8.859 5.085 7.973 1.00 0.35 H new ATOM 0 HG2 ARG A 126 10.468 3.752 9.263 1.00 0.51 H new ATOM 0 HG3 ARG A 126 9.439 2.723 8.286 1.00 0.51 H new ATOM 0 HD2 ARG A 126 11.312 2.745 6.524 1.00 1.24 H new ATOM 0 HD3 ARG A 126 12.325 3.497 7.741 1.00 1.24 H new ATOM 0 HE ARG A 126 11.217 1.229 8.982 1.00 1.92 H new ATOM 0 HH11 ARG A 126 13.329 1.953 6.236 1.00 3.49 H new ATOM 0 HH12 ARG A 126 14.154 0.393 6.316 1.00 3.49 H new ATOM 0 HH21 ARG A 126 12.269 -0.769 9.064 1.00 3.79 H new ATOM 0 HH22 ARG A 126 13.556 -1.143 7.912 1.00 3.79 H new ATOM 1916 N VAL A 127 7.420 3.163 6.498 1.00 0.25 N ATOM 1917 CA VAL A 127 6.522 2.019 6.494 1.00 0.28 C ATOM 1918 C VAL A 127 6.027 1.741 5.073 1.00 0.28 C ATOM 1919 O VAL A 127 5.786 0.600 4.692 1.00 0.33 O ATOM 1920 CB VAL A 127 5.355 2.239 7.484 1.00 0.36 C ATOM 1921 CG1 VAL A 127 5.928 2.594 8.840 1.00 0.59 C ATOM 1922 CG2 VAL A 127 4.379 3.319 7.028 1.00 0.44 C ATOM 0 H VAL A 127 7.062 3.975 7.001 1.00 0.25 H new ATOM 0 HA VAL A 127 7.066 1.137 6.831 1.00 0.28 H new ATOM 0 HB VAL A 127 4.784 1.312 7.535 1.00 0.36 H new ATOM 0 HG11 VAL A 127 5.115 2.752 9.549 1.00 0.59 H new ATOM 0 HG12 VAL A 127 6.562 1.780 9.191 1.00 0.59 H new ATOM 0 HG13 VAL A 127 6.520 3.506 8.758 1.00 0.59 H new ATOM 0 HG21 VAL A 127 3.583 3.425 7.765 1.00 0.44 H new ATOM 0 HG22 VAL A 127 4.907 4.267 6.925 1.00 0.44 H new ATOM 0 HG23 VAL A 127 3.948 3.038 6.067 1.00 0.44 H new ATOM 1932 N MET A 128 5.951 2.806 4.293 1.00 0.27 N ATOM 1933 CA MET A 128 5.624 2.748 2.871 1.00 0.31 C ATOM 1934 C MET A 128 6.647 1.902 2.113 1.00 0.26 C ATOM 1935 O MET A 128 6.301 1.121 1.221 1.00 0.35 O ATOM 1936 CB MET A 128 5.602 4.190 2.351 1.00 0.52 C ATOM 1937 CG MET A 128 5.373 4.366 0.867 1.00 0.81 C ATOM 1938 SD MET A 128 5.328 6.121 0.422 1.00 0.67 S ATOM 1939 CE MET A 128 4.496 6.095 -1.162 1.00 0.46 C ATOM 0 H MET A 128 6.117 3.753 4.632 1.00 0.27 H new ATOM 0 HA MET A 128 4.653 2.276 2.718 1.00 0.31 H new ATOM 0 HB2 MET A 128 4.822 4.733 2.884 1.00 0.52 H new ATOM 0 HB3 MET A 128 6.551 4.661 2.608 1.00 0.52 H new ATOM 0 HG2 MET A 128 6.166 3.866 0.311 1.00 0.81 H new ATOM 0 HG3 MET A 128 4.435 3.890 0.581 1.00 0.81 H new ATOM 0 HE1 MET A 128 3.718 6.858 -1.177 1.00 0.46 H new ATOM 0 HE2 MET A 128 5.217 6.296 -1.955 1.00 0.46 H new ATOM 0 HE3 MET A 128 4.046 5.115 -1.321 1.00 0.46 H new ATOM 1949 N GLN A 129 7.908 2.048 2.488 1.00 0.24 N ATOM 1950 CA GLN A 129 8.981 1.278 1.870 1.00 0.27 C ATOM 1951 C GLN A 129 8.905 -0.200 2.236 1.00 0.30 C ATOM 1952 O GLN A 129 9.313 -1.053 1.455 1.00 0.33 O ATOM 1953 CB GLN A 129 10.348 1.831 2.262 1.00 0.32 C ATOM 1954 CG GLN A 129 10.865 2.900 1.318 1.00 0.42 C ATOM 1955 CD GLN A 129 12.213 3.446 1.748 1.00 0.54 C ATOM 1956 OE1 GLN A 129 12.526 3.495 2.940 1.00 1.17 O ATOM 1957 NE2 GLN A 129 13.026 3.837 0.784 1.00 1.31 N ATOM 0 H GLN A 129 8.216 2.692 3.217 1.00 0.24 H new ATOM 0 HA GLN A 129 8.852 1.370 0.792 1.00 0.27 H new ATOM 0 HB2 GLN A 129 10.288 2.245 3.268 1.00 0.32 H new ATOM 0 HB3 GLN A 129 11.066 1.011 2.297 1.00 0.32 H new ATOM 0 HG2 GLN A 129 10.947 2.485 0.313 1.00 0.42 H new ATOM 0 HG3 GLN A 129 10.144 3.716 1.268 1.00 0.42 H new ATOM 0 HE21 GLN A 129 12.727 3.780 -0.190 1.00 1.31 H new ATOM 0 HE22 GLN A 129 13.953 4.196 1.013 1.00 1.31 H new ATOM 1966 N GLU A 130 8.381 -0.509 3.412 1.00 0.37 N ATOM 1967 CA GLU A 130 8.263 -1.900 3.834 1.00 0.43 C ATOM 1968 C GLU A 130 7.255 -2.616 2.949 1.00 0.36 C ATOM 1969 O GLU A 130 7.356 -3.822 2.707 1.00 0.35 O ATOM 1970 CB GLU A 130 7.842 -1.987 5.298 1.00 0.61 C ATOM 1971 CG GLU A 130 8.439 -0.884 6.143 1.00 0.63 C ATOM 1972 CD GLU A 130 8.258 -1.102 7.632 1.00 1.04 C ATOM 1973 OE1 GLU A 130 7.118 -1.377 8.059 1.00 1.63 O ATOM 1974 OE2 GLU A 130 9.243 -0.985 8.383 1.00 1.64 O ATOM 0 H GLU A 130 8.034 0.174 4.086 1.00 0.37 H new ATOM 0 HA GLU A 130 9.235 -2.383 3.734 1.00 0.43 H new ATOM 0 HB2 GLU A 130 6.755 -1.941 5.363 1.00 0.61 H new ATOM 0 HB3 GLU A 130 8.145 -2.953 5.702 1.00 0.61 H new ATOM 0 HG2 GLU A 130 9.503 -0.802 5.922 1.00 0.63 H new ATOM 0 HG3 GLU A 130 7.982 0.065 5.864 1.00 0.63 H new ATOM 1981 N LEU A 131 6.291 -1.855 2.444 1.00 0.36 N ATOM 1982 CA LEU A 131 5.338 -2.386 1.491 1.00 0.37 C ATOM 1983 C LEU A 131 6.044 -2.775 0.214 1.00 0.29 C ATOM 1984 O LEU A 131 5.808 -3.854 -0.325 1.00 0.32 O ATOM 1985 CB LEU A 131 4.227 -1.386 1.184 1.00 0.49 C ATOM 1986 CG LEU A 131 3.077 -1.380 2.184 1.00 0.71 C ATOM 1987 CD1 LEU A 131 2.498 -2.769 2.317 1.00 1.36 C ATOM 1988 CD2 LEU A 131 3.549 -0.894 3.528 1.00 1.18 C ATOM 0 H LEU A 131 6.153 -0.872 2.681 1.00 0.36 H new ATOM 0 HA LEU A 131 4.880 -3.267 1.940 1.00 0.37 H new ATOM 0 HB2 LEU A 131 4.659 -0.386 1.143 1.00 0.49 H new ATOM 0 HB3 LEU A 131 3.827 -1.602 0.193 1.00 0.49 H new ATOM 0 HG LEU A 131 2.305 -0.703 1.818 1.00 0.71 H new ATOM 0 HD11 LEU A 131 1.677 -2.754 3.034 1.00 1.36 H new ATOM 0 HD12 LEU A 131 2.127 -3.103 1.348 1.00 1.36 H new ATOM 0 HD13 LEU A 131 3.271 -3.454 2.665 1.00 1.36 H new ATOM 0 HD21 LEU A 131 2.715 -0.896 4.229 1.00 1.18 H new ATOM 0 HD22 LEU A 131 4.335 -1.552 3.897 1.00 1.18 H new ATOM 0 HD23 LEU A 131 3.939 0.119 3.432 1.00 1.18 H new ATOM 2000 N MET A 132 6.938 -1.917 -0.267 1.00 0.25 N ATOM 2001 CA MET A 132 7.642 -2.223 -1.501 1.00 0.26 C ATOM 2002 C MET A 132 8.634 -3.358 -1.291 1.00 0.30 C ATOM 2003 O MET A 132 9.179 -3.902 -2.252 1.00 0.37 O ATOM 2004 CB MET A 132 8.358 -1.009 -2.096 1.00 0.32 C ATOM 2005 CG MET A 132 9.673 -0.664 -1.414 1.00 0.88 C ATOM 2006 SD MET A 132 10.556 0.682 -2.225 1.00 1.60 S ATOM 2007 CE MET A 132 10.591 0.095 -3.915 1.00 1.61 C ATOM 0 H MET A 132 7.186 -1.028 0.167 1.00 0.25 H new ATOM 0 HA MET A 132 6.881 -2.532 -2.217 1.00 0.26 H new ATOM 0 HB2 MET A 132 8.548 -1.195 -3.153 1.00 0.32 H new ATOM 0 HB3 MET A 132 7.695 -0.146 -2.039 1.00 0.32 H new ATOM 0 HG2 MET A 132 9.477 -0.390 -0.377 1.00 0.88 H new ATOM 0 HG3 MET A 132 10.309 -1.549 -1.395 1.00 0.88 H new ATOM 0 HE1 MET A 132 11.415 0.569 -4.448 1.00 1.61 H new ATOM 0 HE2 MET A 132 10.729 -0.986 -3.922 1.00 1.61 H new ATOM 0 HE3 MET A 132 9.650 0.344 -4.406 1.00 1.61 H new ATOM 2017 N GLU A 133 8.855 -3.730 -0.040 1.00 0.32 N ATOM 2018 CA GLU A 133 9.709 -4.856 0.264 1.00 0.40 C ATOM 2019 C GLU A 133 8.937 -6.137 0.036 1.00 0.38 C ATOM 2020 O GLU A 133 9.508 -7.177 -0.289 1.00 0.45 O ATOM 2021 CB GLU A 133 10.236 -4.775 1.690 1.00 0.54 C ATOM 2022 CG GLU A 133 11.214 -3.633 1.895 1.00 0.79 C ATOM 2023 CD GLU A 133 11.981 -3.751 3.190 1.00 1.07 C ATOM 2024 OE1 GLU A 133 12.849 -4.640 3.297 1.00 1.67 O ATOM 2025 OE2 GLU A 133 11.723 -2.950 4.111 1.00 1.53 O ATOM 0 H GLU A 133 8.454 -3.267 0.776 1.00 0.32 H new ATOM 0 HA GLU A 133 10.576 -4.839 -0.397 1.00 0.40 H new ATOM 0 HB2 GLU A 133 9.397 -4.656 2.376 1.00 0.54 H new ATOM 0 HB3 GLU A 133 10.725 -5.715 1.945 1.00 0.54 H new ATOM 0 HG2 GLU A 133 11.917 -3.607 1.062 1.00 0.79 H new ATOM 0 HG3 GLU A 133 10.671 -2.688 1.883 1.00 0.79 H new ATOM 2032 N TYR A 134 7.622 -6.056 0.198 1.00 0.35 N ATOM 2033 CA TYR A 134 6.748 -7.124 -0.242 1.00 0.40 C ATOM 2034 C TYR A 134 6.263 -6.839 -1.665 1.00 0.41 C ATOM 2035 O TYR A 134 5.236 -7.349 -2.116 1.00 0.50 O ATOM 2036 CB TYR A 134 5.601 -7.304 0.738 1.00 0.46 C ATOM 2037 CG TYR A 134 6.051 -7.899 2.057 1.00 0.55 C ATOM 2038 CD1 TYR A 134 6.371 -9.249 2.167 1.00 0.98 C ATOM 2039 CD2 TYR A 134 6.130 -7.115 3.201 1.00 0.88 C ATOM 2040 CE1 TYR A 134 6.756 -9.795 3.374 1.00 1.08 C ATOM 2041 CE2 TYR A 134 6.513 -7.656 4.412 1.00 0.95 C ATOM 2042 CZ TYR A 134 6.930 -8.988 4.463 1.00 0.80 C ATOM 2043 OH TYR A 134 7.199 -9.542 5.703 1.00 0.95 O ATOM 0 H TYR A 134 7.144 -5.265 0.629 1.00 0.35 H new ATOM 0 HA TYR A 134 7.296 -8.066 -0.264 1.00 0.40 H new ATOM 0 HB2 TYR A 134 5.129 -6.339 0.921 1.00 0.46 H new ATOM 0 HB3 TYR A 134 4.844 -7.949 0.292 1.00 0.46 H new ATOM 0 HD1 TYR A 134 6.317 -9.880 1.292 1.00 0.98 H new ATOM 0 HD2 TYR A 134 5.888 -6.064 3.142 1.00 0.88 H new ATOM 0 HE1 TYR A 134 6.920 -10.859 3.458 1.00 1.08 H new ATOM 0 HE2 TYR A 134 6.490 -7.056 5.310 1.00 0.95 H new ATOM 0 HH TYR A 134 7.295 -8.827 6.367 1.00 0.95 H new ATOM 2053 N ASN A 135 7.061 -6.013 -2.354 1.00 0.36 N ATOM 2054 CA ASN A 135 6.856 -5.632 -3.749 1.00 0.43 C ATOM 2055 C ASN A 135 5.530 -4.902 -3.947 1.00 0.48 C ATOM 2056 O ASN A 135 4.761 -5.190 -4.865 1.00 0.64 O ATOM 2057 CB ASN A 135 6.961 -6.856 -4.663 1.00 0.58 C ATOM 2058 CG ASN A 135 7.022 -6.502 -6.131 1.00 0.71 C ATOM 2059 OD1 ASN A 135 7.490 -5.427 -6.510 1.00 0.89 O ATOM 2060 ND2 ASN A 135 6.572 -7.414 -6.966 1.00 1.10 N ATOM 0 H ASN A 135 7.888 -5.582 -1.941 1.00 0.36 H new ATOM 0 HA ASN A 135 7.647 -4.934 -4.023 1.00 0.43 H new ATOM 0 HB2 ASN A 135 7.852 -7.425 -4.396 1.00 0.58 H new ATOM 0 HB3 ASN A 135 6.104 -7.506 -4.488 1.00 0.58 H new ATOM 0 HD21 ASN A 135 6.603 -7.244 -7.971 1.00 1.10 H new ATOM 0 HD22 ASN A 135 6.193 -8.291 -6.608 1.00 1.10 H new ATOM 2067 N LEU A 136 5.269 -3.955 -3.069 1.00 0.44 N ATOM 2068 CA LEU A 136 4.147 -3.065 -3.219 1.00 0.54 C ATOM 2069 C LEU A 136 4.640 -1.660 -3.458 1.00 0.41 C ATOM 2070 O LEU A 136 4.921 -0.911 -2.523 1.00 0.47 O ATOM 2071 CB LEU A 136 3.279 -3.130 -1.994 1.00 0.78 C ATOM 2072 CG LEU A 136 2.538 -4.444 -1.831 1.00 0.64 C ATOM 2073 CD1 LEU A 136 1.971 -4.551 -0.436 1.00 1.36 C ATOM 2074 CD2 LEU A 136 1.443 -4.543 -2.878 1.00 1.17 C ATOM 0 H LEU A 136 5.830 -3.785 -2.235 1.00 0.44 H new ATOM 0 HA LEU A 136 3.550 -3.370 -4.078 1.00 0.54 H new ATOM 0 HB2 LEU A 136 3.899 -2.963 -1.113 1.00 0.78 H new ATOM 0 HB3 LEU A 136 2.553 -2.318 -2.032 1.00 0.78 H new ATOM 0 HG LEU A 136 3.230 -5.274 -1.975 1.00 0.64 H new ATOM 0 HD11 LEU A 136 1.441 -5.498 -0.330 1.00 1.36 H new ATOM 0 HD12 LEU A 136 2.782 -4.506 0.291 1.00 1.36 H new ATOM 0 HD13 LEU A 136 1.280 -3.727 -0.260 1.00 1.36 H new ATOM 0 HD21 LEU A 136 0.911 -5.487 -2.760 1.00 1.17 H new ATOM 0 HD22 LEU A 136 0.745 -3.715 -2.754 1.00 1.17 H new ATOM 0 HD23 LEU A 136 1.886 -4.498 -3.873 1.00 1.17 H new ATOM 2086 N VAL A 137 4.751 -1.314 -4.718 1.00 0.31 N ATOM 2087 CA VAL A 137 5.366 -0.064 -5.096 1.00 0.27 C ATOM 2088 C VAL A 137 4.315 0.954 -5.473 1.00 0.29 C ATOM 2089 O VAL A 137 3.478 0.707 -6.332 1.00 0.33 O ATOM 2090 CB VAL A 137 6.340 -0.241 -6.266 1.00 0.29 C ATOM 2091 CG1 VAL A 137 7.038 1.075 -6.574 1.00 0.43 C ATOM 2092 CG2 VAL A 137 7.344 -1.338 -5.955 1.00 0.41 C ATOM 0 H VAL A 137 4.423 -1.881 -5.500 1.00 0.31 H new ATOM 0 HA VAL A 137 5.926 0.291 -4.231 1.00 0.27 H new ATOM 0 HB VAL A 137 5.780 -0.540 -7.152 1.00 0.29 H new ATOM 0 HG11 VAL A 137 7.727 0.935 -7.407 1.00 0.43 H new ATOM 0 HG12 VAL A 137 6.295 1.827 -6.840 1.00 0.43 H new ATOM 0 HG13 VAL A 137 7.593 1.407 -5.696 1.00 0.43 H new ATOM 0 HG21 VAL A 137 8.029 -1.453 -6.795 1.00 0.41 H new ATOM 0 HG22 VAL A 137 7.907 -1.073 -5.060 1.00 0.41 H new ATOM 0 HG23 VAL A 137 6.817 -2.277 -5.786 1.00 0.41 H new ATOM 2102 N PRO A 138 4.327 2.090 -4.791 1.00 0.34 N ATOM 2103 CA PRO A 138 3.437 3.198 -5.078 1.00 0.43 C ATOM 2104 C PRO A 138 3.600 3.735 -6.481 1.00 0.43 C ATOM 2105 O PRO A 138 4.649 3.591 -7.115 1.00 0.45 O ATOM 2106 CB PRO A 138 3.834 4.272 -4.075 1.00 0.53 C ATOM 2107 CG PRO A 138 5.132 3.841 -3.509 1.00 0.54 C ATOM 2108 CD PRO A 138 5.171 2.357 -3.632 1.00 0.39 C ATOM 0 HA PRO A 138 2.396 2.884 -5.002 1.00 0.43 H new ATOM 0 HB2 PRO A 138 3.923 5.244 -4.559 1.00 0.53 H new ATOM 0 HB3 PRO A 138 3.081 4.373 -3.293 1.00 0.53 H new ATOM 0 HG2 PRO A 138 5.962 4.298 -4.048 1.00 0.54 H new ATOM 0 HG3 PRO A 138 5.222 4.147 -2.467 1.00 0.54 H new ATOM 0 HD2 PRO A 138 6.187 1.993 -3.783 1.00 0.39 H new ATOM 0 HD3 PRO A 138 4.788 1.870 -2.735 1.00 0.39 H new ATOM 2116 N GLU A 139 2.555 4.382 -6.931 1.00 0.48 N ATOM 2117 CA GLU A 139 2.508 4.944 -8.273 1.00 0.56 C ATOM 2118 C GLU A 139 3.260 6.264 -8.326 1.00 0.56 C ATOM 2119 O GLU A 139 3.529 6.801 -9.403 1.00 0.64 O ATOM 2120 CB GLU A 139 1.064 5.112 -8.747 1.00 0.71 C ATOM 2121 CG GLU A 139 0.340 3.789 -8.939 1.00 1.35 C ATOM 2122 CD GLU A 139 0.976 2.925 -10.013 1.00 2.40 C ATOM 2123 OE1 GLU A 139 2.160 2.559 -9.862 1.00 3.08 O ATOM 2124 OE2 GLU A 139 0.298 2.625 -11.015 1.00 2.78 O ATOM 0 H GLU A 139 1.709 4.538 -6.384 1.00 0.48 H new ATOM 0 HA GLU A 139 2.999 4.247 -8.952 1.00 0.56 H new ATOM 0 HB2 GLU A 139 0.518 5.716 -8.022 1.00 0.71 H new ATOM 0 HB3 GLU A 139 1.059 5.662 -9.688 1.00 0.71 H new ATOM 0 HG2 GLU A 139 0.333 3.243 -7.996 1.00 1.35 H new ATOM 0 HG3 GLU A 139 -0.700 3.983 -9.203 1.00 1.35 H new ATOM 2131 N GLU A 140 3.593 6.788 -7.155 1.00 0.54 N ATOM 2132 CA GLU A 140 4.536 7.890 -7.055 1.00 0.60 C ATOM 2133 C GLU A 140 5.941 7.405 -7.406 1.00 0.56 C ATOM 2134 O GLU A 140 6.821 8.203 -7.733 1.00 0.65 O ATOM 2135 CB GLU A 140 4.529 8.516 -5.647 1.00 0.67 C ATOM 2136 CG GLU A 140 4.318 7.530 -4.516 1.00 0.63 C ATOM 2137 CD GLU A 140 2.857 7.381 -4.135 1.00 1.12 C ATOM 2138 OE1 GLU A 140 2.130 6.644 -4.834 1.00 1.57 O ATOM 2139 OE2 GLU A 140 2.438 7.983 -3.128 1.00 1.27 O ATOM 0 H GLU A 140 3.223 6.466 -6.260 1.00 0.54 H new ATOM 0 HA GLU A 140 4.229 8.660 -7.763 1.00 0.60 H new ATOM 0 HB2 GLU A 140 5.476 9.032 -5.489 1.00 0.67 H new ATOM 0 HB3 GLU A 140 3.744 9.271 -5.604 1.00 0.67 H new ATOM 0 HG2 GLU A 140 4.714 6.558 -4.808 1.00 0.63 H new ATOM 0 HG3 GLU A 140 4.885 7.856 -3.644 1.00 0.63 H new ATOM 2146 N TRP A 141 6.149 6.087 -7.332 1.00 0.47 N ATOM 2147 CA TRP A 141 7.442 5.500 -7.619 1.00 0.49 C ATOM 2148 C TRP A 141 7.410 4.694 -8.916 1.00 0.51 C ATOM 2149 O TRP A 141 8.449 4.433 -9.519 1.00 0.66 O ATOM 2150 CB TRP A 141 7.877 4.627 -6.460 1.00 0.45 C ATOM 2151 CG TRP A 141 8.022 5.370 -5.159 1.00 0.46 C ATOM 2152 CD1 TRP A 141 7.920 6.716 -4.954 1.00 0.54 C ATOM 2153 CD2 TRP A 141 8.298 4.798 -3.883 1.00 0.44 C ATOM 2154 NE1 TRP A 141 8.101 7.011 -3.628 1.00 0.55 N ATOM 2155 CE2 TRP A 141 8.337 5.846 -2.947 1.00 0.49 C ATOM 2156 CE3 TRP A 141 8.508 3.496 -3.443 1.00 0.45 C ATOM 2157 CZ2 TRP A 141 8.580 5.630 -1.594 1.00 0.52 C ATOM 2158 CZ3 TRP A 141 8.749 3.278 -2.103 1.00 0.50 C ATOM 2159 CH2 TRP A 141 8.783 4.338 -1.191 1.00 0.52 C ATOM 0 H TRP A 141 5.429 5.412 -7.074 1.00 0.47 H new ATOM 0 HA TRP A 141 8.164 6.306 -7.751 1.00 0.49 H new ATOM 0 HB2 TRP A 141 7.151 3.824 -6.330 1.00 0.45 H new ATOM 0 HB3 TRP A 141 8.829 4.159 -6.708 1.00 0.45 H new ATOM 0 HD1 TRP A 141 7.724 7.445 -5.727 1.00 0.54 H new ATOM 0 HE1 TRP A 141 8.066 7.944 -3.216 1.00 0.55 H new ATOM 0 HE3 TRP A 141 8.483 2.670 -4.138 1.00 0.45 H new ATOM 0 HZ2 TRP A 141 8.607 6.449 -0.890 1.00 0.52 H new ATOM 0 HZ3 TRP A 141 8.915 2.270 -1.751 1.00 0.50 H new ATOM 0 HH2 TRP A 141 8.973 4.133 -0.148 1.00 0.52 H new ATOM 2170 N GLY A 142 6.211 4.299 -9.334 1.00 0.45 N ATOM 2171 CA GLY A 142 6.053 3.620 -10.609 1.00 0.50 C ATOM 2172 C GLY A 142 5.841 2.122 -10.473 1.00 0.45 C ATOM 2173 O GLY A 142 6.204 1.359 -11.371 1.00 0.53 O ATOM 0 H GLY A 142 5.345 4.437 -8.813 1.00 0.45 H new ATOM 0 HA2 GLY A 142 5.205 4.053 -11.140 1.00 0.50 H new ATOM 0 HA3 GLY A 142 6.937 3.800 -11.220 1.00 0.50 H new ATOM 2177 N GLY A 143 5.254 1.700 -9.359 1.00 0.39 N ATOM 2178 CA GLY A 143 4.984 0.281 -9.154 1.00 0.41 C ATOM 2179 C GLY A 143 3.584 -0.116 -9.582 1.00 0.45 C ATOM 2180 O GLY A 143 3.303 -0.212 -10.779 1.00 0.60 O ATOM 0 H GLY A 143 4.960 2.308 -8.595 1.00 0.39 H new ATOM 0 HA2 GLY A 143 5.711 -0.308 -9.713 1.00 0.41 H new ATOM 0 HA3 GLY A 143 5.120 0.038 -8.100 1.00 0.41 H new ATOM 2184 N ASP A 144 2.711 -0.373 -8.605 1.00 0.40 N ATOM 2185 CA ASP A 144 1.303 -0.634 -8.881 1.00 0.45 C ATOM 2186 C ASP A 144 0.480 -0.551 -7.589 1.00 0.33 C ATOM 2187 O ASP A 144 -0.179 -1.514 -7.158 1.00 0.35 O ATOM 2188 CB ASP A 144 1.134 -2.013 -9.510 1.00 0.64 C ATOM 2189 CG ASP A 144 -0.076 -2.116 -10.420 1.00 1.33 C ATOM 2190 OD1 ASP A 144 -1.198 -2.291 -9.897 1.00 1.91 O ATOM 2191 OD2 ASP A 144 0.073 -1.994 -11.648 1.00 1.91 O ATOM 0 H ASP A 144 2.958 -0.405 -7.616 1.00 0.40 H new ATOM 0 HA ASP A 144 0.944 0.123 -9.579 1.00 0.45 H new ATOM 0 HB2 ASP A 144 2.030 -2.256 -10.081 1.00 0.64 H new ATOM 0 HB3 ASP A 144 1.048 -2.757 -8.718 1.00 0.64 H new ATOM 2196 N THR A 145 0.496 0.620 -6.981 1.00 0.26 N ATOM 2197 CA THR A 145 -0.216 0.852 -5.734 1.00 0.24 C ATOM 2198 C THR A 145 -0.356 2.346 -5.467 1.00 0.27 C ATOM 2199 O THR A 145 0.603 3.095 -5.601 1.00 0.37 O ATOM 2200 CB THR A 145 0.519 0.200 -4.538 1.00 0.25 C ATOM 2201 OG1 THR A 145 0.603 -1.222 -4.701 1.00 0.30 O ATOM 2202 CG2 THR A 145 -0.194 0.510 -3.236 1.00 0.30 C ATOM 0 H THR A 145 0.999 1.434 -7.333 1.00 0.26 H new ATOM 0 HA THR A 145 -1.203 0.400 -5.836 1.00 0.24 H new ATOM 0 HB THR A 145 1.526 0.616 -4.506 1.00 0.25 H new ATOM 0 HG1 THR A 145 0.032 -1.500 -5.448 1.00 0.30 H new ATOM 0 HG21 THR A 145 0.339 0.042 -2.409 1.00 0.30 H new ATOM 0 HG22 THR A 145 -0.223 1.589 -3.085 1.00 0.30 H new ATOM 0 HG23 THR A 145 -1.212 0.122 -3.277 1.00 0.30 H new ATOM 2210 N ILE A 146 -1.543 2.783 -5.089 1.00 0.26 N ATOM 2211 CA ILE A 146 -1.739 4.154 -4.682 1.00 0.28 C ATOM 2212 C ILE A 146 -1.684 4.246 -3.163 1.00 0.23 C ATOM 2213 O ILE A 146 -2.559 3.733 -2.466 1.00 0.24 O ATOM 2214 CB ILE A 146 -3.086 4.705 -5.200 1.00 0.36 C ATOM 2215 CG1 ILE A 146 -3.051 4.871 -6.722 1.00 0.53 C ATOM 2216 CG2 ILE A 146 -3.430 6.020 -4.524 1.00 0.34 C ATOM 2217 CD1 ILE A 146 -2.021 5.873 -7.198 1.00 0.63 C ATOM 0 H ILE A 146 -2.383 2.205 -5.057 1.00 0.26 H new ATOM 0 HA ILE A 146 -0.943 4.760 -5.114 1.00 0.28 H new ATOM 0 HB ILE A 146 -3.865 3.984 -4.951 1.00 0.36 H new ATOM 0 HG12 ILE A 146 -2.844 3.904 -7.180 1.00 0.53 H new ATOM 0 HG13 ILE A 146 -4.036 5.183 -7.068 1.00 0.53 H new ATOM 0 HG21 ILE A 146 -4.383 6.387 -4.906 1.00 0.34 H new ATOM 0 HG22 ILE A 146 -3.505 5.867 -3.447 1.00 0.34 H new ATOM 0 HG23 ILE A 146 -2.649 6.752 -4.733 1.00 0.34 H new ATOM 0 HD11 ILE A 146 -2.053 5.939 -8.286 1.00 0.63 H new ATOM 0 HD12 ILE A 146 -2.239 6.851 -6.769 1.00 0.63 H new ATOM 0 HD13 ILE A 146 -1.028 5.552 -6.883 1.00 0.63 H new ATOM 2229 N PHE A 147 -0.628 4.855 -2.652 1.00 0.25 N ATOM 2230 CA PHE A 147 -0.492 5.055 -1.219 1.00 0.30 C ATOM 2231 C PHE A 147 -1.109 6.378 -0.812 1.00 0.32 C ATOM 2232 O PHE A 147 -1.148 7.339 -1.584 1.00 0.50 O ATOM 2233 CB PHE A 147 0.966 5.086 -0.792 1.00 0.41 C ATOM 2234 CG PHE A 147 1.676 3.757 -0.782 1.00 0.33 C ATOM 2235 CD1 PHE A 147 1.845 3.052 -1.963 1.00 0.32 C ATOM 2236 CD2 PHE A 147 2.161 3.205 0.388 1.00 0.37 C ATOM 2237 CE1 PHE A 147 2.484 1.828 -1.977 1.00 0.33 C ATOM 2238 CE2 PHE A 147 2.802 1.980 0.379 1.00 0.36 C ATOM 2239 CZ PHE A 147 3.007 1.316 -0.726 1.00 0.33 C ATOM 0 H PHE A 147 0.147 5.219 -3.207 1.00 0.25 H new ATOM 0 HA PHE A 147 -0.999 4.220 -0.736 1.00 0.30 H new ATOM 0 HB2 PHE A 147 1.506 5.760 -1.458 1.00 0.41 H new ATOM 0 HB3 PHE A 147 1.023 5.514 0.209 1.00 0.41 H new ATOM 0 HD1 PHE A 147 1.471 3.467 -2.887 1.00 0.32 H new ATOM 0 HD2 PHE A 147 2.038 3.736 1.320 1.00 0.37 H new ATOM 0 HE1 PHE A 147 2.591 1.268 -2.894 1.00 0.33 H new ATOM 0 HE2 PHE A 147 3.143 1.560 1.314 1.00 0.36 H new ATOM 0 HZ PHE A 147 3.563 0.390 -0.708 1.00 0.33 H new ATOM 2249 N CYS A 148 -1.584 6.406 0.400 1.00 0.26 N ATOM 2250 CA CYS A 148 -2.045 7.616 1.044 1.00 0.27 C ATOM 2251 C CYS A 148 -1.431 7.725 2.436 1.00 0.31 C ATOM 2252 O CYS A 148 -1.505 6.785 3.216 1.00 0.53 O ATOM 2253 CB CYS A 148 -3.566 7.593 1.148 1.00 0.30 C ATOM 2254 SG CYS A 148 -4.418 7.725 -0.440 1.00 0.68 S ATOM 0 H CYS A 148 -1.666 5.575 0.985 1.00 0.26 H new ATOM 0 HA CYS A 148 -1.740 8.479 0.452 1.00 0.27 H new ATOM 0 HB2 CYS A 148 -3.872 6.668 1.636 1.00 0.30 H new ATOM 0 HB3 CYS A 148 -3.888 8.413 1.790 1.00 0.30 H new ATOM 0 HG CYS A 148 -5.552 7.092 -0.378 1.00 0.68 H new ATOM 2260 N LYS A 149 -0.799 8.849 2.732 1.00 0.29 N ATOM 2261 CA LYS A 149 -0.233 9.080 4.062 1.00 0.28 C ATOM 2262 C LYS A 149 -1.238 9.858 4.902 1.00 0.28 C ATOM 2263 O LYS A 149 -1.217 11.088 4.929 1.00 0.40 O ATOM 2264 CB LYS A 149 1.085 9.862 3.978 1.00 0.36 C ATOM 2265 CG LYS A 149 2.196 9.168 3.198 1.00 0.56 C ATOM 2266 CD LYS A 149 2.113 9.454 1.706 1.00 0.89 C ATOM 2267 CE LYS A 149 3.374 9.002 0.979 1.00 1.01 C ATOM 2268 NZ LYS A 149 4.588 9.715 1.474 1.00 1.44 N ATOM 0 H LYS A 149 -0.662 9.617 2.075 1.00 0.29 H new ATOM 0 HA LYS A 149 -0.023 8.115 4.523 1.00 0.28 H new ATOM 0 HB2 LYS A 149 0.887 10.830 3.517 1.00 0.36 H new ATOM 0 HB3 LYS A 149 1.439 10.058 4.990 1.00 0.36 H new ATOM 0 HG2 LYS A 149 3.164 9.497 3.576 1.00 0.56 H new ATOM 0 HG3 LYS A 149 2.138 8.092 3.364 1.00 0.56 H new ATOM 0 HD2 LYS A 149 1.247 8.944 1.285 1.00 0.89 H new ATOM 0 HD3 LYS A 149 1.963 10.522 1.547 1.00 0.89 H new ATOM 0 HE2 LYS A 149 3.504 7.928 1.112 1.00 1.01 H new ATOM 0 HE3 LYS A 149 3.260 9.179 -0.090 1.00 1.01 H new ATOM 0 HZ1 LYS A 149 5.413 9.429 0.909 1.00 1.44 H new ATOM 0 HZ2 LYS A 149 4.447 10.742 1.387 1.00 1.44 H new ATOM 0 HZ3 LYS A 149 4.751 9.472 2.472 1.00 1.44 H new ATOM 2282 N LEU A 150 -2.126 9.145 5.577 1.00 0.21 N ATOM 2283 CA LEU A 150 -3.235 9.775 6.234 1.00 0.22 C ATOM 2284 C LEU A 150 -3.193 9.613 7.745 1.00 0.19 C ATOM 2285 O LEU A 150 -2.399 8.876 8.307 1.00 0.17 O ATOM 2286 CB LEU A 150 -4.522 9.179 5.676 1.00 0.25 C ATOM 2287 CG LEU A 150 -5.021 7.884 6.316 1.00 0.26 C ATOM 2288 CD1 LEU A 150 -6.220 7.377 5.560 1.00 0.79 C ATOM 2289 CD2 LEU A 150 -3.955 6.817 6.345 1.00 0.84 C ATOM 0 H LEU A 150 -2.091 8.131 5.678 1.00 0.21 H new ATOM 0 HA LEU A 150 -3.185 10.846 6.040 1.00 0.22 H new ATOM 0 HB2 LEU A 150 -5.309 9.927 5.767 1.00 0.25 H new ATOM 0 HB3 LEU A 150 -4.377 8.997 4.611 1.00 0.25 H new ATOM 0 HG LEU A 150 -5.292 8.109 7.348 1.00 0.26 H new ATOM 0 HD11 LEU A 150 -6.575 6.453 6.017 1.00 0.79 H new ATOM 0 HD12 LEU A 150 -7.012 8.125 5.591 1.00 0.79 H new ATOM 0 HD13 LEU A 150 -5.942 7.185 4.524 1.00 0.79 H new ATOM 0 HD21 LEU A 150 -4.355 5.915 6.808 1.00 0.84 H new ATOM 0 HD22 LEU A 150 -3.638 6.592 5.327 1.00 0.84 H new ATOM 0 HD23 LEU A 150 -3.100 7.172 6.921 1.00 0.84 H new ATOM 2301 N SER A 151 -4.057 10.330 8.393 1.00 0.26 N ATOM 2302 CA SER A 151 -4.276 10.187 9.793 1.00 0.29 C ATOM 2303 C SER A 151 -5.762 10.049 10.020 1.00 0.25 C ATOM 2304 O SER A 151 -6.509 11.019 9.893 1.00 0.29 O ATOM 2305 CB SER A 151 -3.751 11.415 10.503 1.00 0.46 C ATOM 2306 OG SER A 151 -4.049 12.580 9.752 1.00 1.77 O ATOM 0 H SER A 151 -4.639 11.043 7.953 1.00 0.26 H new ATOM 0 HA SER A 151 -3.759 9.309 10.181 1.00 0.29 H new ATOM 0 HB2 SER A 151 -4.197 11.489 11.495 1.00 0.46 H new ATOM 0 HB3 SER A 151 -2.673 11.330 10.644 1.00 0.46 H new ATOM 0 HG SER A 151 -4.144 13.344 10.358 1.00 1.77 H new ATOM 2312 N ALA A 152 -6.206 8.847 10.302 1.00 0.28 N ATOM 2313 CA ALA A 152 -7.604 8.634 10.587 1.00 0.31 C ATOM 2314 C ALA A 152 -7.930 9.157 11.970 1.00 0.33 C ATOM 2315 O ALA A 152 -9.092 9.249 12.351 1.00 0.41 O ATOM 2316 CB ALA A 152 -7.955 7.172 10.461 1.00 0.41 C ATOM 0 H ALA A 152 -5.625 8.009 10.340 1.00 0.28 H new ATOM 0 HA ALA A 152 -8.203 9.181 9.860 1.00 0.31 H new ATOM 0 HB1 ALA A 152 -9.014 7.032 10.680 1.00 0.41 H new ATOM 0 HB2 ALA A 152 -7.746 6.834 9.446 1.00 0.41 H new ATOM 0 HB3 ALA A 152 -7.359 6.593 11.166 1.00 0.41 H new ATOM 2322 N LYS A 153 -6.891 9.506 12.724 1.00 0.30 N ATOM 2323 CA LYS A 153 -7.107 10.124 14.027 1.00 0.34 C ATOM 2324 C LYS A 153 -7.364 11.623 13.916 1.00 0.36 C ATOM 2325 O LYS A 153 -8.296 12.126 14.538 1.00 0.49 O ATOM 2326 CB LYS A 153 -5.973 9.839 14.994 1.00 0.35 C ATOM 2327 CG LYS A 153 -6.244 8.640 15.889 1.00 0.60 C ATOM 2328 CD LYS A 153 -6.145 9.000 17.364 1.00 1.12 C ATOM 2329 CE LYS A 153 -4.734 9.416 17.749 1.00 1.65 C ATOM 2330 NZ LYS A 153 -4.610 9.676 19.208 1.00 2.30 N ATOM 0 H LYS A 153 -5.914 9.375 12.463 1.00 0.30 H new ATOM 0 HA LYS A 153 -8.007 9.664 14.434 1.00 0.34 H new ATOM 0 HB2 LYS A 153 -5.057 9.665 14.430 1.00 0.35 H new ATOM 0 HB3 LYS A 153 -5.803 10.718 15.615 1.00 0.35 H new ATOM 0 HG2 LYS A 153 -7.238 8.246 15.677 1.00 0.60 H new ATOM 0 HG3 LYS A 153 -5.532 7.847 15.660 1.00 0.60 H new ATOM 0 HD2 LYS A 153 -6.837 9.812 17.588 1.00 1.12 H new ATOM 0 HD3 LYS A 153 -6.450 8.146 17.968 1.00 1.12 H new ATOM 0 HE2 LYS A 153 -4.033 8.633 17.459 1.00 1.65 H new ATOM 0 HE3 LYS A 153 -4.457 10.313 17.196 1.00 1.65 H new ATOM 0 HZ1 LYS A 153 -3.633 9.957 19.429 1.00 2.30 H new ATOM 0 HZ2 LYS A 153 -5.260 10.441 19.481 1.00 2.30 H new ATOM 0 HZ3 LYS A 153 -4.850 8.813 19.736 1.00 2.30 H new ATOM 2344 N THR A 154 -6.564 12.352 13.133 1.00 0.30 N ATOM 2345 CA THR A 154 -6.837 13.780 12.966 1.00 0.39 C ATOM 2346 C THR A 154 -7.837 14.026 11.845 1.00 0.36 C ATOM 2347 O THR A 154 -8.247 15.162 11.593 1.00 0.41 O ATOM 2348 CB THR A 154 -5.565 14.625 12.738 1.00 0.47 C ATOM 2349 OG1 THR A 154 -4.675 13.975 11.833 1.00 0.50 O ATOM 2350 CG2 THR A 154 -4.848 14.898 14.051 1.00 0.70 C ATOM 0 H THR A 154 -5.755 11.996 12.624 1.00 0.30 H new ATOM 0 HA THR A 154 -7.271 14.108 13.911 1.00 0.39 H new ATOM 0 HB THR A 154 -5.878 15.575 12.304 1.00 0.47 H new ATOM 0 HG1 THR A 154 -3.752 14.223 12.047 1.00 0.50 H new ATOM 0 HG21 THR A 154 -3.956 15.495 13.861 1.00 0.70 H new ATOM 0 HG22 THR A 154 -5.513 15.442 14.722 1.00 0.70 H new ATOM 0 HG23 THR A 154 -4.561 13.953 14.512 1.00 0.70 H new ATOM 2358 N LYS A 155 -8.226 12.937 11.179 1.00 0.30 N ATOM 2359 CA LYS A 155 -9.295 12.963 10.182 1.00 0.32 C ATOM 2360 C LYS A 155 -8.900 13.812 8.998 1.00 0.34 C ATOM 2361 O LYS A 155 -9.676 14.621 8.499 1.00 0.41 O ATOM 2362 CB LYS A 155 -10.606 13.464 10.790 1.00 0.38 C ATOM 2363 CG LYS A 155 -11.225 12.472 11.747 1.00 0.40 C ATOM 2364 CD LYS A 155 -11.328 11.104 11.098 1.00 0.45 C ATOM 2365 CE LYS A 155 -12.100 10.123 11.970 1.00 0.61 C ATOM 2366 NZ LYS A 155 -13.363 10.699 12.504 1.00 1.36 N ATOM 0 H LYS A 155 -7.810 12.016 11.316 1.00 0.30 H new ATOM 0 HA LYS A 155 -9.454 11.942 9.836 1.00 0.32 H new ATOM 0 HB2 LYS A 155 -10.423 14.402 11.314 1.00 0.38 H new ATOM 0 HB3 LYS A 155 -11.314 13.679 9.989 1.00 0.38 H new ATOM 0 HG2 LYS A 155 -10.623 12.407 12.653 1.00 0.40 H new ATOM 0 HG3 LYS A 155 -12.215 12.815 12.046 1.00 0.40 H new ATOM 0 HD2 LYS A 155 -11.821 11.197 10.130 1.00 0.45 H new ATOM 0 HD3 LYS A 155 -10.328 10.714 10.910 1.00 0.45 H new ATOM 0 HE2 LYS A 155 -12.330 9.230 11.389 1.00 0.61 H new ATOM 0 HE3 LYS A 155 -11.469 9.808 12.801 1.00 0.61 H new ATOM 0 HZ1 LYS A 155 -13.987 9.931 12.823 1.00 1.36 H new ATOM 0 HZ2 LYS A 155 -13.147 11.325 13.306 1.00 1.36 H new ATOM 0 HZ3 LYS A 155 -13.839 11.244 11.757 1.00 1.36 H new ATOM 2380 N GLU A 156 -7.688 13.597 8.552 1.00 0.30 N ATOM 2381 CA GLU A 156 -7.119 14.401 7.492 1.00 0.33 C ATOM 2382 C GLU A 156 -7.045 13.588 6.199 1.00 0.28 C ATOM 2383 O GLU A 156 -7.657 13.927 5.176 1.00 0.30 O ATOM 2384 CB GLU A 156 -5.742 14.900 7.971 1.00 0.40 C ATOM 2385 CG GLU A 156 -4.611 14.791 6.965 1.00 1.30 C ATOM 2386 CD GLU A 156 -4.620 15.886 5.920 1.00 1.70 C ATOM 2387 OE1 GLU A 156 -4.112 16.987 6.207 1.00 1.52 O ATOM 2388 OE2 GLU A 156 -5.124 15.649 4.804 1.00 2.48 O ATOM 0 H GLU A 156 -7.070 12.867 8.907 1.00 0.30 H new ATOM 0 HA GLU A 156 -7.742 15.267 7.268 1.00 0.33 H new ATOM 0 HB2 GLU A 156 -5.839 15.944 8.268 1.00 0.40 H new ATOM 0 HB3 GLU A 156 -5.464 14.339 8.863 1.00 0.40 H new ATOM 0 HG2 GLU A 156 -3.660 14.816 7.497 1.00 1.30 H new ATOM 0 HG3 GLU A 156 -4.672 13.824 6.466 1.00 1.30 H new ATOM 2395 N GLY A 157 -6.343 12.480 6.272 1.00 0.29 N ATOM 2396 CA GLY A 157 -6.092 11.699 5.096 1.00 0.28 C ATOM 2397 C GLY A 157 -7.254 10.819 4.686 1.00 0.27 C ATOM 2398 O GLY A 157 -7.231 10.252 3.603 1.00 0.29 O ATOM 0 H GLY A 157 -5.940 12.106 7.131 1.00 0.29 H new ATOM 0 HA2 GLY A 157 -5.848 12.369 4.272 1.00 0.28 H new ATOM 0 HA3 GLY A 157 -5.217 11.072 5.268 1.00 0.28 H new ATOM 2402 N LEU A 158 -8.268 10.688 5.541 1.00 0.26 N ATOM 2403 CA LEU A 158 -9.442 9.909 5.182 1.00 0.28 C ATOM 2404 C LEU A 158 -10.171 10.606 4.053 1.00 0.30 C ATOM 2405 O LEU A 158 -10.704 9.973 3.141 1.00 0.33 O ATOM 2406 CB LEU A 158 -10.368 9.742 6.381 1.00 0.31 C ATOM 2407 CG LEU A 158 -9.873 8.779 7.460 1.00 0.47 C ATOM 2408 CD1 LEU A 158 -10.867 8.719 8.601 1.00 0.73 C ATOM 2409 CD2 LEU A 158 -9.645 7.392 6.874 1.00 0.80 C ATOM 0 H LEU A 158 -8.297 11.105 6.471 1.00 0.26 H new ATOM 0 HA LEU A 158 -9.127 8.917 4.860 1.00 0.28 H new ATOM 0 HB2 LEU A 158 -10.527 10.720 6.835 1.00 0.31 H new ATOM 0 HB3 LEU A 158 -11.338 9.395 6.025 1.00 0.31 H new ATOM 0 HG LEU A 158 -8.922 9.146 7.846 1.00 0.47 H new ATOM 0 HD11 LEU A 158 -10.504 8.030 9.364 1.00 0.73 H new ATOM 0 HD12 LEU A 158 -10.983 9.712 9.035 1.00 0.73 H new ATOM 0 HD13 LEU A 158 -11.830 8.372 8.227 1.00 0.73 H new ATOM 0 HD21 LEU A 158 -9.293 6.720 7.656 1.00 0.80 H new ATOM 0 HD22 LEU A 158 -10.581 7.012 6.463 1.00 0.80 H new ATOM 0 HD23 LEU A 158 -8.898 7.450 6.082 1.00 0.80 H new ATOM 2421 N ASP A 159 -10.166 11.924 4.124 1.00 0.32 N ATOM 2422 CA ASP A 159 -10.729 12.749 3.081 1.00 0.38 C ATOM 2423 C ASP A 159 -9.868 12.674 1.831 1.00 0.32 C ATOM 2424 O ASP A 159 -10.378 12.557 0.721 1.00 0.33 O ATOM 2425 CB ASP A 159 -10.863 14.193 3.565 1.00 0.50 C ATOM 2426 CG ASP A 159 -11.979 14.362 4.578 1.00 1.25 C ATOM 2427 OD1 ASP A 159 -11.846 13.834 5.707 1.00 2.20 O ATOM 2428 OD2 ASP A 159 -12.977 15.037 4.267 1.00 1.42 O ATOM 0 H ASP A 159 -9.772 12.448 4.905 1.00 0.32 H new ATOM 0 HA ASP A 159 -11.724 12.378 2.833 1.00 0.38 H new ATOM 0 HB2 ASP A 159 -9.921 14.513 4.010 1.00 0.50 H new ATOM 0 HB3 ASP A 159 -11.050 14.844 2.711 1.00 0.50 H new ATOM 2433 N HIS A 160 -8.553 12.712 2.014 1.00 0.30 N ATOM 2434 CA HIS A 160 -7.629 12.616 0.889 1.00 0.30 C ATOM 2435 C HIS A 160 -7.658 11.212 0.266 1.00 0.28 C ATOM 2436 O HIS A 160 -7.297 11.033 -0.895 1.00 0.33 O ATOM 2437 CB HIS A 160 -6.206 12.976 1.345 1.00 0.34 C ATOM 2438 CG HIS A 160 -5.178 12.952 0.252 1.00 0.41 C ATOM 2439 ND1 HIS A 160 -4.989 13.992 -0.631 1.00 0.52 N ATOM 2440 CD2 HIS A 160 -4.276 12.005 -0.090 1.00 0.46 C ATOM 2441 CE1 HIS A 160 -4.011 13.688 -1.465 1.00 0.58 C ATOM 2442 NE2 HIS A 160 -3.561 12.487 -1.156 1.00 0.54 N ATOM 0 H HIS A 160 -8.104 12.808 2.925 1.00 0.30 H new ATOM 0 HA HIS A 160 -7.945 13.325 0.124 1.00 0.30 H new ATOM 0 HB2 HIS A 160 -6.221 13.971 1.790 1.00 0.34 H new ATOM 0 HB3 HIS A 160 -5.902 12.281 2.128 1.00 0.34 H new ATOM 0 HD2 HIS A 160 -4.143 11.046 0.388 1.00 0.46 H new ATOM 0 HE1 HIS A 160 -3.643 14.315 -2.263 1.00 0.58 H new ATOM 0 HE2 HIS A 160 -2.804 11.997 -1.633 1.00 0.54 H new ATOM 2451 N LEU A 161 -8.116 10.227 1.033 1.00 0.27 N ATOM 2452 CA LEU A 161 -8.123 8.841 0.577 1.00 0.28 C ATOM 2453 C LEU A 161 -9.230 8.645 -0.448 1.00 0.29 C ATOM 2454 O LEU A 161 -8.996 8.144 -1.548 1.00 0.31 O ATOM 2455 CB LEU A 161 -8.324 7.892 1.770 1.00 0.29 C ATOM 2456 CG LEU A 161 -7.656 6.512 1.661 1.00 0.57 C ATOM 2457 CD1 LEU A 161 -7.938 5.693 2.907 1.00 1.15 C ATOM 2458 CD2 LEU A 161 -8.124 5.761 0.424 1.00 1.16 C ATOM 0 H LEU A 161 -8.487 10.363 1.973 1.00 0.27 H new ATOM 0 HA LEU A 161 -7.164 8.612 0.111 1.00 0.28 H new ATOM 0 HB2 LEU A 161 -7.948 8.385 2.667 1.00 0.29 H new ATOM 0 HB3 LEU A 161 -9.394 7.744 1.913 1.00 0.29 H new ATOM 0 HG LEU A 161 -6.581 6.669 1.570 1.00 0.57 H new ATOM 0 HD11 LEU A 161 -7.459 4.718 2.817 1.00 1.15 H new ATOM 0 HD12 LEU A 161 -7.543 6.212 3.781 1.00 1.15 H new ATOM 0 HD13 LEU A 161 -9.014 5.560 3.019 1.00 1.15 H new ATOM 0 HD21 LEU A 161 -7.631 4.790 0.380 1.00 1.16 H new ATOM 0 HD22 LEU A 161 -9.204 5.618 0.472 1.00 1.16 H new ATOM 0 HD23 LEU A 161 -7.873 6.336 -0.467 1.00 1.16 H new ATOM 2470 N LEU A 162 -10.435 9.071 -0.086 1.00 0.31 N ATOM 2471 CA LEU A 162 -11.586 8.962 -0.965 1.00 0.37 C ATOM 2472 C LEU A 162 -11.358 9.751 -2.255 1.00 0.38 C ATOM 2473 O LEU A 162 -11.899 9.407 -3.303 1.00 0.45 O ATOM 2474 CB LEU A 162 -12.849 9.423 -0.224 1.00 0.47 C ATOM 2475 CG LEU A 162 -12.818 10.833 0.383 1.00 0.85 C ATOM 2476 CD1 LEU A 162 -13.235 11.890 -0.630 1.00 1.49 C ATOM 2477 CD2 LEU A 162 -13.709 10.889 1.610 1.00 1.51 C ATOM 0 H LEU A 162 -10.637 9.498 0.818 1.00 0.31 H new ATOM 0 HA LEU A 162 -11.725 7.919 -1.251 1.00 0.37 H new ATOM 0 HB2 LEU A 162 -13.688 9.370 -0.917 1.00 0.47 H new ATOM 0 HB3 LEU A 162 -13.052 8.712 0.577 1.00 0.47 H new ATOM 0 HG LEU A 162 -11.791 11.051 0.677 1.00 0.85 H new ATOM 0 HD11 LEU A 162 -13.201 12.875 -0.164 1.00 1.49 H new ATOM 0 HD12 LEU A 162 -12.554 11.867 -1.481 1.00 1.49 H new ATOM 0 HD13 LEU A 162 -14.250 11.686 -0.972 1.00 1.49 H new ATOM 0 HD21 LEU A 162 -13.681 11.893 2.034 1.00 1.51 H new ATOM 0 HD22 LEU A 162 -14.733 10.643 1.328 1.00 1.51 H new ATOM 0 HD23 LEU A 162 -13.354 10.172 2.350 1.00 1.51 H new ATOM 2489 N GLU A 163 -10.534 10.796 -2.173 1.00 0.37 N ATOM 2490 CA GLU A 163 -10.147 11.556 -3.357 1.00 0.44 C ATOM 2491 C GLU A 163 -9.338 10.690 -4.316 1.00 0.41 C ATOM 2492 O GLU A 163 -9.610 10.653 -5.515 1.00 0.50 O ATOM 2493 CB GLU A 163 -9.345 12.795 -2.974 1.00 0.56 C ATOM 2494 CG GLU A 163 -10.130 13.794 -2.151 1.00 1.03 C ATOM 2495 CD GLU A 163 -9.370 15.077 -1.921 1.00 1.78 C ATOM 2496 OE1 GLU A 163 -9.416 15.961 -2.806 1.00 2.14 O ATOM 2497 OE2 GLU A 163 -8.739 15.221 -0.857 1.00 2.57 O ATOM 0 H GLU A 163 -10.124 11.133 -1.302 1.00 0.37 H new ATOM 0 HA GLU A 163 -11.061 11.875 -3.858 1.00 0.44 H new ATOM 0 HB2 GLU A 163 -8.463 12.487 -2.412 1.00 0.56 H new ATOM 0 HB3 GLU A 163 -8.991 13.283 -3.882 1.00 0.56 H new ATOM 0 HG2 GLU A 163 -11.070 14.018 -2.656 1.00 1.03 H new ATOM 0 HG3 GLU A 163 -10.384 13.348 -1.189 1.00 1.03 H new ATOM 2504 N MET A 164 -8.347 9.992 -3.783 1.00 0.37 N ATOM 2505 CA MET A 164 -7.552 9.078 -4.589 1.00 0.39 C ATOM 2506 C MET A 164 -8.421 7.948 -5.115 1.00 0.37 C ATOM 2507 O MET A 164 -8.242 7.485 -6.243 1.00 0.43 O ATOM 2508 CB MET A 164 -6.378 8.518 -3.779 1.00 0.43 C ATOM 2509 CG MET A 164 -5.086 9.318 -3.905 1.00 0.64 C ATOM 2510 SD MET A 164 -5.253 11.059 -3.454 1.00 0.58 S ATOM 2511 CE MET A 164 -5.821 11.785 -4.991 1.00 0.53 C ATOM 0 H MET A 164 -8.075 10.040 -2.801 1.00 0.37 H new ATOM 0 HA MET A 164 -7.147 9.631 -5.436 1.00 0.39 H new ATOM 0 HB2 MET A 164 -6.664 8.477 -2.728 1.00 0.43 H new ATOM 0 HB3 MET A 164 -6.189 7.493 -4.098 1.00 0.43 H new ATOM 0 HG2 MET A 164 -4.325 8.861 -3.273 1.00 0.64 H new ATOM 0 HG3 MET A 164 -4.729 9.252 -4.933 1.00 0.64 H new ATOM 0 HE1 MET A 164 -5.345 12.756 -5.133 1.00 0.53 H new ATOM 0 HE2 MET A 164 -5.561 11.129 -5.821 1.00 0.53 H new ATOM 0 HE3 MET A 164 -6.903 11.913 -4.955 1.00 0.53 H new ATOM 2521 N ILE A 165 -9.378 7.525 -4.300 1.00 0.34 N ATOM 2522 CA ILE A 165 -10.314 6.494 -4.705 1.00 0.38 C ATOM 2523 C ILE A 165 -11.139 6.951 -5.907 1.00 0.44 C ATOM 2524 O ILE A 165 -11.261 6.223 -6.887 1.00 0.52 O ATOM 2525 CB ILE A 165 -11.278 6.108 -3.564 1.00 0.40 C ATOM 2526 CG1 ILE A 165 -10.512 5.464 -2.407 1.00 0.42 C ATOM 2527 CG2 ILE A 165 -12.349 5.163 -4.085 1.00 0.50 C ATOM 2528 CD1 ILE A 165 -11.387 5.105 -1.224 1.00 0.50 C ATOM 0 H ILE A 165 -9.524 7.882 -3.356 1.00 0.34 H new ATOM 0 HA ILE A 165 -9.718 5.621 -4.972 1.00 0.38 H new ATOM 0 HB ILE A 165 -11.759 7.013 -3.192 1.00 0.40 H new ATOM 0 HG12 ILE A 165 -10.016 4.563 -2.768 1.00 0.42 H new ATOM 0 HG13 ILE A 165 -9.730 6.147 -2.075 1.00 0.42 H new ATOM 0 HG21 ILE A 165 -13.025 4.896 -3.273 1.00 0.50 H new ATOM 0 HG22 ILE A 165 -12.912 5.653 -4.879 1.00 0.50 H new ATOM 0 HG23 ILE A 165 -11.879 4.261 -4.477 1.00 0.50 H new ATOM 0 HD11 ILE A 165 -10.775 4.653 -0.443 1.00 0.50 H new ATOM 0 HD12 ILE A 165 -11.863 6.006 -0.837 1.00 0.50 H new ATOM 0 HD13 ILE A 165 -12.153 4.397 -1.540 1.00 0.50 H new ATOM 2540 N LEU A 166 -11.699 8.161 -5.836 1.00 0.46 N ATOM 2541 CA LEU A 166 -12.542 8.665 -6.918 1.00 0.57 C ATOM 2542 C LEU A 166 -11.729 8.898 -8.175 1.00 0.61 C ATOM 2543 O LEU A 166 -12.230 8.731 -9.285 1.00 0.70 O ATOM 2544 CB LEU A 166 -13.290 9.951 -6.520 1.00 0.66 C ATOM 2545 CG LEU A 166 -12.446 11.165 -6.105 1.00 1.07 C ATOM 2546 CD1 LEU A 166 -12.009 11.973 -7.318 1.00 1.73 C ATOM 2547 CD2 LEU A 166 -13.222 12.053 -5.147 1.00 1.38 C ATOM 0 H LEU A 166 -11.585 8.802 -5.050 1.00 0.46 H new ATOM 0 HA LEU A 166 -13.290 7.898 -7.120 1.00 0.57 H new ATOM 0 HB2 LEU A 166 -13.917 10.249 -7.361 1.00 0.66 H new ATOM 0 HB3 LEU A 166 -13.959 9.709 -5.694 1.00 0.66 H new ATOM 0 HG LEU A 166 -11.555 10.790 -5.601 1.00 1.07 H new ATOM 0 HD11 LEU A 166 -11.413 12.826 -6.992 1.00 1.73 H new ATOM 0 HD12 LEU A 166 -11.412 11.344 -7.978 1.00 1.73 H new ATOM 0 HD13 LEU A 166 -12.889 12.329 -7.854 1.00 1.73 H new ATOM 0 HD21 LEU A 166 -12.607 12.908 -4.864 1.00 1.38 H new ATOM 0 HD22 LEU A 166 -14.132 12.405 -5.633 1.00 1.38 H new ATOM 0 HD23 LEU A 166 -13.484 11.484 -4.255 1.00 1.38 H new ATOM 2559 N LEU A 167 -10.490 9.308 -7.991 1.00 0.56 N ATOM 2560 CA LEU A 167 -9.549 9.413 -9.094 1.00 0.64 C ATOM 2561 C LEU A 167 -9.482 8.069 -9.818 1.00 0.66 C ATOM 2562 O LEU A 167 -9.649 7.992 -11.038 1.00 0.75 O ATOM 2563 CB LEU A 167 -8.163 9.829 -8.574 1.00 0.64 C ATOM 2564 CG LEU A 167 -7.226 10.486 -9.597 1.00 0.81 C ATOM 2565 CD1 LEU A 167 -6.036 11.118 -8.893 1.00 1.47 C ATOM 2566 CD2 LEU A 167 -6.740 9.481 -10.633 1.00 1.51 C ATOM 0 H LEU A 167 -10.108 9.576 -7.084 1.00 0.56 H new ATOM 0 HA LEU A 167 -9.884 10.178 -9.794 1.00 0.64 H new ATOM 0 HB2 LEU A 167 -8.302 10.520 -7.743 1.00 0.64 H new ATOM 0 HB3 LEU A 167 -7.667 8.945 -8.174 1.00 0.64 H new ATOM 0 HG LEU A 167 -7.792 11.260 -10.115 1.00 0.81 H new ATOM 0 HD11 LEU A 167 -5.380 11.580 -9.631 1.00 1.47 H new ATOM 0 HD12 LEU A 167 -6.388 11.877 -8.194 1.00 1.47 H new ATOM 0 HD13 LEU A 167 -5.486 10.351 -8.348 1.00 1.47 H new ATOM 0 HD21 LEU A 167 -6.079 9.980 -11.342 1.00 1.51 H new ATOM 0 HD22 LEU A 167 -6.198 8.678 -10.134 1.00 1.51 H new ATOM 0 HD23 LEU A 167 -7.595 9.065 -11.166 1.00 1.51 H new ATOM 2578 N VAL A 168 -9.281 7.006 -9.049 1.00 0.61 N ATOM 2579 CA VAL A 168 -9.266 5.667 -9.589 1.00 0.69 C ATOM 2580 C VAL A 168 -10.645 5.286 -10.135 1.00 0.77 C ATOM 2581 O VAL A 168 -10.746 4.671 -11.188 1.00 0.89 O ATOM 2582 CB VAL A 168 -8.823 4.643 -8.528 1.00 0.68 C ATOM 2583 CG1 VAL A 168 -8.819 3.248 -9.110 1.00 0.84 C ATOM 2584 CG2 VAL A 168 -7.447 4.990 -7.978 1.00 0.66 C ATOM 0 H VAL A 168 -9.126 7.055 -8.042 1.00 0.61 H new ATOM 0 HA VAL A 168 -8.545 5.651 -10.406 1.00 0.69 H new ATOM 0 HB VAL A 168 -9.537 4.677 -7.705 1.00 0.68 H new ATOM 0 HG11 VAL A 168 -8.504 2.536 -8.347 1.00 0.84 H new ATOM 0 HG12 VAL A 168 -9.822 2.993 -9.451 1.00 0.84 H new ATOM 0 HG13 VAL A 168 -8.128 3.207 -9.952 1.00 0.84 H new ATOM 0 HG21 VAL A 168 -7.157 4.252 -7.230 1.00 0.66 H new ATOM 0 HG22 VAL A 168 -6.720 4.989 -8.790 1.00 0.66 H new ATOM 0 HG23 VAL A 168 -7.477 5.978 -7.519 1.00 0.66 H new