USER MOD reduce.3.24.130724 H: found=0, std=0, add=1029, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1029 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 131 HIS : no HE2:sc= -0.864 K(o=0.024,f=-3.8) USER MOD Set 1.2: A 141 GLN : amide:sc= 1.16 K(o=0.024,f=-11!) USER MOD Set 1.3: A 142 CYS SG : rot 17:sc= -0.157 USER MOD Set 1.4: A 143 CYS SG : rot 143:sc= 0.0131 USER MOD Set 1.5: A 145 GLN :FLIP amide:sc= 0.385 F(o=-1.9,f=0.024) USER MOD Set 1.6: A 153 CYS SG : rot -78:sc= -0.516 USER MOD Set 2.1: A 91 GLN : amide:sc= 0.745 K(o=0.98,f=0.37) USER MOD Set 2.2: A 100 TYR OH : rot 47:sc= 0.235 USER MOD Set 3.1: A 94 HIS : no HD1:sc= -1.41 K(o=-1.4,f=-2) USER MOD Set 3.2: A 97 ASN : amide:sc= -0.0246 K(o=-1.4,f=-3.6!) USER MOD Set 4.1: A 71 CYS SG : rot 0:sc= -2.27! USER MOD Set 4.2: A 127 MET CE :methyl -169:sc= -0.115 (180deg=-0.365) USER MOD Set 5.1: A 23 LYS NZ :NH3+ -161:sc= 0.123 (180deg=-0.643) USER MOD Set 5.2: A 25 SER OG : rot 180:sc= 0.321 USER MOD Single : A 15 THR OG1 : rot 30:sc= 0.85 USER MOD Single : A 35 ASN : amide:sc= -2.11! C(o=-2.1!,f=-3.4!) USER MOD Single : A 36 TYR OH : rot 180:sc= 0.107 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot -15:sc= 0.978 USER MOD Single : A 45 LYS NZ :NH3+ -167:sc= 0.607 (180deg=0.498) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 MET CE :methyl -135:sc= -0.0944 (180deg=-0.508) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot -108:sc= -0.175 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 173:sc= 0.52 (180deg=0.49) USER MOD Single : A 76 LYS NZ :NH3+ 156:sc= 0.721 (180deg=0.459) USER MOD Single : A 84 CYS SG : rot 180:sc= -1.49 USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 86 ASN : amide:sc= -0.0783 K(o=-0.078,f=-2.9) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 145:sc= 0.159 USER MOD Single : A 105 SER OG : rot 180:sc= -0.757 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 SER OG : rot 110:sc= -0.418 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 163:sc= 1.6 (180deg=1.35) USER MOD Single : A 121 LYS NZ :NH3+ -127:sc= 0.214 (180deg=-0.0241) USER MOD Single : A 122 ASN : amide:sc= -0.579 K(o=-0.58,f=-4.6!) USER MOD Single : A 123 ASN : amide:sc= -0.405 X(o=-0.41,f=-0.36) USER MOD Single : A 124 ASN : amide:sc= -0.127 X(o=-0.13,f=-0.49) USER MOD Single : A 125 ASN : amide:sc= 0.0245 K(o=0.025,f=-2.6!) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 TYR OH : rot 180:sc= -0.0053 USER MOD Single : A 133 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00324) USER MOD Single : A 136 THR OG1 : rot 180:sc= 0.444 USER MOD Single : A 139 SER OG : rot -170:sc= -0.106 USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 THR OG1 : rot -68:sc= 0.0611 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 TYR OH : rot 164:sc= 0.217 USER MOD Single : A 157 ASN :FLIP amide:sc= -0.13 F(o=-1.8!,f=-0.13) USER MOD ----------------------------------------------------------------- ATOM 229 N THR A 15 -9.431 -1.604 15.004 1.00 33.23 N ATOM 230 CA THR A 15 -9.234 -1.528 13.553 1.00 53.12 C ATOM 231 C THR A 15 -9.879 -0.255 12.975 1.00 33.22 C ATOM 232 O THR A 15 -10.959 0.162 13.408 1.00 74.42 O ATOM 233 CB THR A 15 -9.800 -2.799 12.813 1.00 41.30 C ATOM 234 OG1 THR A 15 -9.464 -2.751 11.415 1.00 30.14 O ATOM 235 CG2 THR A 15 -11.331 -2.952 12.959 1.00 44.24 C ATOM 0 HA THR A 15 -8.158 -1.491 13.382 1.00 53.12 H new ATOM 0 HB THR A 15 -9.336 -3.663 13.289 1.00 41.30 H new ATOM 0 HG1 THR A 15 -8.624 -2.261 11.297 1.00 30.14 H new ATOM 0 HG21 THR A 15 -11.660 -3.845 12.428 1.00 44.24 H new ATOM 0 HG22 THR A 15 -11.589 -3.042 14.014 1.00 44.24 H new ATOM 0 HG23 THR A 15 -11.826 -2.077 12.538 1.00 44.24 H new ATOM 243 N ILE A 16 -9.170 0.378 12.035 1.00 55.22 N ATOM 244 CA ILE A 16 -9.696 1.467 11.208 1.00 64.12 C ATOM 245 C ILE A 16 -10.469 0.861 10.018 1.00 73.02 C ATOM 246 O ILE A 16 -11.562 1.317 9.676 1.00 61.22 O ATOM 247 CB ILE A 16 -8.527 2.387 10.680 1.00 11.00 C ATOM 248 CG1 ILE A 16 -7.667 2.916 11.883 1.00 30.41 C ATOM 249 CG2 ILE A 16 -9.074 3.559 9.814 1.00 11.11 C ATOM 250 CD1 ILE A 16 -6.441 3.718 11.494 1.00 62.51 C ATOM 0 H ILE A 16 -8.200 0.144 11.825 1.00 55.22 H new ATOM 0 HA ILE A 16 -10.363 2.083 11.811 1.00 64.12 H new ATOM 0 HB ILE A 16 -7.883 1.787 10.037 1.00 11.00 H new ATOM 0 HG12 ILE A 16 -8.301 3.535 12.518 1.00 30.41 H new ATOM 0 HG13 ILE A 16 -7.349 2.064 12.484 1.00 30.41 H new ATOM 0 HG21 ILE A 16 -8.243 4.173 9.466 1.00 11.11 H new ATOM 0 HG22 ILE A 16 -9.612 3.157 8.956 1.00 11.11 H new ATOM 0 HG23 ILE A 16 -9.750 4.169 10.413 1.00 11.11 H new ATOM 0 HD11 ILE A 16 -5.915 4.038 12.394 1.00 62.51 H new ATOM 0 HD12 ILE A 16 -5.779 3.100 10.887 1.00 62.51 H new ATOM 0 HD13 ILE A 16 -6.746 4.594 10.921 1.00 62.51 H new ATOM 262 N LEU A 17 -9.896 -0.199 9.428 1.00 73.44 N ATOM 263 CA LEU A 17 -10.434 -0.858 8.219 1.00 33.24 C ATOM 264 C LEU A 17 -9.791 -2.253 8.054 1.00 51.12 C ATOM 265 O LEU A 17 -8.619 -2.418 8.371 1.00 35.51 O ATOM 266 CB LEU A 17 -10.155 0.016 6.957 1.00 1.11 C ATOM 267 CG LEU A 17 -10.689 -0.535 5.595 1.00 55.14 C ATOM 268 CD1 LEU A 17 -12.229 -0.708 5.616 1.00 63.15 C ATOM 269 CD2 LEU A 17 -10.229 0.366 4.422 1.00 34.20 C ATOM 0 H LEU A 17 -9.039 -0.629 9.776 1.00 73.44 H new ATOM 0 HA LEU A 17 -11.512 -0.974 8.329 1.00 33.24 H new ATOM 0 HB2 LEU A 17 -10.591 1.001 7.121 1.00 1.11 H new ATOM 0 HB3 LEU A 17 -9.077 0.155 6.870 1.00 1.11 H new ATOM 0 HG LEU A 17 -10.261 -1.526 5.441 1.00 55.14 H new ATOM 0 HD11 LEU A 17 -12.565 -1.093 4.653 1.00 63.15 H new ATOM 0 HD12 LEU A 17 -12.506 -1.409 6.403 1.00 63.15 H new ATOM 0 HD13 LEU A 17 -12.701 0.256 5.806 1.00 63.15 H new ATOM 0 HD21 LEU A 17 -10.611 -0.035 3.483 1.00 34.20 H new ATOM 0 HD22 LEU A 17 -10.612 1.376 4.567 1.00 34.20 H new ATOM 0 HD23 LEU A 17 -9.140 0.392 4.389 1.00 34.20 H new ATOM 281 N GLU A 18 -10.567 -3.241 7.556 1.00 30.21 N ATOM 282 CA GLU A 18 -10.063 -4.600 7.246 1.00 52.45 C ATOM 283 C GLU A 18 -10.647 -5.081 5.901 1.00 41.45 C ATOM 284 O GLU A 18 -11.786 -4.740 5.567 1.00 12.33 O ATOM 285 CB GLU A 18 -10.401 -5.607 8.391 1.00 0.22 C ATOM 286 CG GLU A 18 -11.894 -5.986 8.576 1.00 5.14 C ATOM 287 CD GLU A 18 -12.791 -4.795 8.960 1.00 74.42 C ATOM 288 OE1 GLU A 18 -12.854 -4.441 10.160 1.00 64.24 O ATOM 289 OE2 GLU A 18 -13.434 -4.192 8.063 1.00 24.21 O ATOM 0 H GLU A 18 -11.560 -3.120 7.357 1.00 30.21 H new ATOM 0 HA GLU A 18 -8.977 -4.554 7.164 1.00 52.45 H new ATOM 0 HB2 GLU A 18 -9.838 -6.523 8.214 1.00 0.22 H new ATOM 0 HB3 GLU A 18 -10.039 -5.187 9.330 1.00 0.22 H new ATOM 0 HG2 GLU A 18 -12.266 -6.426 7.651 1.00 5.14 H new ATOM 0 HG3 GLU A 18 -11.972 -6.752 9.347 1.00 5.14 H new ATOM 296 N GLU A 19 -9.862 -5.868 5.141 1.00 20.44 N ATOM 297 CA GLU A 19 -10.278 -6.375 3.813 1.00 3.54 C ATOM 298 C GLU A 19 -9.414 -7.575 3.384 1.00 32.30 C ATOM 299 O GLU A 19 -8.263 -7.723 3.830 1.00 33.44 O ATOM 300 CB GLU A 19 -10.189 -5.229 2.759 1.00 5.33 C ATOM 301 CG GLU A 19 -10.613 -5.578 1.313 1.00 71.02 C ATOM 302 CD GLU A 19 -12.070 -6.039 1.182 1.00 23.04 C ATOM 303 OE1 GLU A 19 -12.983 -5.191 1.300 1.00 42.50 O ATOM 304 OE2 GLU A 19 -12.320 -7.241 0.952 1.00 30.34 O ATOM 0 H GLU A 19 -8.930 -6.170 5.424 1.00 20.44 H new ATOM 0 HA GLU A 19 -11.311 -6.717 3.879 1.00 3.54 H new ATOM 0 HB2 GLU A 19 -10.808 -4.401 3.104 1.00 5.33 H new ATOM 0 HB3 GLU A 19 -9.160 -4.869 2.734 1.00 5.33 H new ATOM 0 HG2 GLU A 19 -10.462 -4.703 0.680 1.00 71.02 H new ATOM 0 HG3 GLU A 19 -9.959 -6.363 0.933 1.00 71.02 H new ATOM 311 N ILE A 20 -9.995 -8.422 2.517 1.00 11.14 N ATOM 312 CA ILE A 20 -9.314 -9.543 1.872 1.00 32.21 C ATOM 313 C ILE A 20 -8.578 -9.014 0.621 1.00 43.12 C ATOM 314 O ILE A 20 -9.179 -8.802 -0.436 1.00 42.53 O ATOM 315 CB ILE A 20 -10.367 -10.657 1.489 1.00 42.12 C ATOM 316 CG1 ILE A 20 -11.050 -11.249 2.768 1.00 14.52 C ATOM 317 CG2 ILE A 20 -9.744 -11.780 0.638 1.00 0.24 C ATOM 318 CD1 ILE A 20 -10.113 -12.020 3.708 1.00 34.24 C ATOM 0 H ILE A 20 -10.974 -8.339 2.243 1.00 11.14 H new ATOM 0 HA ILE A 20 -8.587 -9.991 2.549 1.00 32.21 H new ATOM 0 HB ILE A 20 -11.131 -10.174 0.880 1.00 42.12 H new ATOM 0 HG12 ILE A 20 -11.509 -10.433 3.326 1.00 14.52 H new ATOM 0 HG13 ILE A 20 -11.855 -11.915 2.456 1.00 14.52 H new ATOM 0 HG21 ILE A 20 -10.506 -12.522 0.400 1.00 0.24 H new ATOM 0 HG22 ILE A 20 -9.347 -11.359 -0.285 1.00 0.24 H new ATOM 0 HG23 ILE A 20 -8.938 -12.255 1.197 1.00 0.24 H new ATOM 0 HD11 ILE A 20 -10.679 -12.390 4.563 1.00 34.24 H new ATOM 0 HD12 ILE A 20 -9.672 -12.861 3.173 1.00 34.24 H new ATOM 0 HD13 ILE A 20 -9.321 -11.357 4.057 1.00 34.24 H new ATOM 330 N LEU A 21 -7.283 -8.744 0.784 1.00 23.04 N ATOM 331 CA LEU A 21 -6.417 -8.194 -0.271 1.00 2.11 C ATOM 332 C LEU A 21 -5.333 -9.222 -0.626 1.00 21.24 C ATOM 333 O LEU A 21 -4.894 -9.979 0.238 1.00 41.01 O ATOM 334 CB LEU A 21 -5.752 -6.894 0.245 1.00 12.10 C ATOM 335 CG LEU A 21 -6.712 -5.765 0.741 1.00 24.34 C ATOM 336 CD1 LEU A 21 -5.962 -4.701 1.578 1.00 13.53 C ATOM 337 CD2 LEU A 21 -7.445 -5.103 -0.435 1.00 72.32 C ATOM 0 H LEU A 21 -6.794 -8.902 1.665 1.00 23.04 H new ATOM 0 HA LEU A 21 -7.010 -7.973 -1.159 1.00 2.11 H new ATOM 0 HB2 LEU A 21 -5.083 -7.156 1.064 1.00 12.10 H new ATOM 0 HB3 LEU A 21 -5.133 -6.488 -0.555 1.00 12.10 H new ATOM 0 HG LEU A 21 -7.452 -6.237 1.387 1.00 24.34 H new ATOM 0 HD11 LEU A 21 -6.664 -3.934 1.904 1.00 13.53 H new ATOM 0 HD12 LEU A 21 -5.512 -5.175 2.450 1.00 13.53 H new ATOM 0 HD13 LEU A 21 -5.181 -4.244 0.970 1.00 13.53 H new ATOM 0 HD21 LEU A 21 -8.105 -4.322 -0.059 1.00 72.32 H new ATOM 0 HD22 LEU A 21 -6.717 -4.665 -1.117 1.00 72.32 H new ATOM 0 HD23 LEU A 21 -8.034 -5.852 -0.965 1.00 72.32 H new ATOM 349 N ILE A 22 -4.868 -9.213 -1.881 1.00 75.35 N ATOM 350 CA ILE A 22 -3.805 -10.126 -2.343 1.00 45.10 C ATOM 351 C ILE A 22 -2.444 -9.424 -2.252 1.00 30.14 C ATOM 352 O ILE A 22 -2.247 -8.345 -2.792 1.00 64.05 O ATOM 353 CB ILE A 22 -4.078 -10.676 -3.805 1.00 74.22 C ATOM 354 CG1 ILE A 22 -5.240 -11.730 -3.751 1.00 53.32 C ATOM 355 CG2 ILE A 22 -2.796 -11.271 -4.459 1.00 41.44 C ATOM 356 CD1 ILE A 22 -5.484 -12.496 -5.030 1.00 73.34 C ATOM 0 H ILE A 22 -5.212 -8.580 -2.603 1.00 75.35 H new ATOM 0 HA ILE A 22 -3.799 -10.997 -1.687 1.00 45.10 H new ATOM 0 HB ILE A 22 -4.379 -9.842 -4.438 1.00 74.22 H new ATOM 0 HG12 ILE A 22 -5.023 -12.444 -2.956 1.00 53.32 H new ATOM 0 HG13 ILE A 22 -6.161 -11.216 -3.475 1.00 53.32 H new ATOM 0 HG21 ILE A 22 -3.033 -11.635 -5.459 1.00 41.44 H new ATOM 0 HG22 ILE A 22 -2.030 -10.499 -4.526 1.00 41.44 H new ATOM 0 HG23 ILE A 22 -2.427 -12.097 -3.851 1.00 41.44 H new ATOM 0 HD11 ILE A 22 -6.306 -13.196 -4.883 1.00 73.34 H new ATOM 0 HD12 ILE A 22 -5.739 -11.799 -5.829 1.00 73.34 H new ATOM 0 HD13 ILE A 22 -4.583 -13.046 -5.302 1.00 73.34 H new ATOM 368 N LYS A 23 -1.516 -10.070 -1.545 1.00 34.22 N ATOM 369 CA LYS A 23 -0.203 -9.520 -1.225 1.00 13.24 C ATOM 370 C LYS A 23 0.860 -10.011 -2.222 1.00 42.21 C ATOM 371 O LYS A 23 0.929 -11.207 -2.531 1.00 15.01 O ATOM 372 CB LYS A 23 0.171 -9.975 0.207 1.00 71.35 C ATOM 373 CG LYS A 23 1.527 -9.453 0.705 1.00 5.11 C ATOM 374 CD LYS A 23 1.930 -10.026 2.085 1.00 34.04 C ATOM 375 CE LYS A 23 3.360 -9.625 2.463 1.00 15.24 C ATOM 376 NZ LYS A 23 4.342 -10.055 1.431 1.00 3.12 N ATOM 0 H LYS A 23 -1.661 -11.008 -1.173 1.00 34.22 H new ATOM 0 HA LYS A 23 -0.239 -8.432 -1.288 1.00 13.24 H new ATOM 0 HB2 LYS A 23 -0.607 -9.644 0.895 1.00 71.35 H new ATOM 0 HB3 LYS A 23 0.181 -11.065 0.238 1.00 71.35 H new ATOM 0 HG2 LYS A 23 2.296 -9.705 -0.025 1.00 5.11 H new ATOM 0 HG3 LYS A 23 1.490 -8.365 0.767 1.00 5.11 H new ATOM 0 HD2 LYS A 23 1.237 -9.667 2.846 1.00 34.04 H new ATOM 0 HD3 LYS A 23 1.848 -11.113 2.067 1.00 34.04 H new ATOM 0 HE2 LYS A 23 3.414 -8.544 2.589 1.00 15.24 H new ATOM 0 HE3 LYS A 23 3.622 -10.071 3.423 1.00 15.24 H new ATOM 0 HZ1 LYS A 23 5.297 -10.066 1.843 1.00 3.12 H new ATOM 0 HZ2 LYS A 23 4.098 -11.009 1.096 1.00 3.12 H new ATOM 0 HZ3 LYS A 23 4.318 -9.391 0.631 1.00 3.12 H new ATOM 390 N ARG A 24 1.675 -9.068 -2.718 1.00 64.34 N ATOM 391 CA ARG A 24 2.941 -9.370 -3.401 1.00 53.15 C ATOM 392 C ARG A 24 4.046 -9.521 -2.338 1.00 30.13 C ATOM 393 O ARG A 24 4.177 -8.668 -1.445 1.00 42.05 O ATOM 394 CB ARG A 24 3.299 -8.225 -4.392 1.00 41.50 C ATOM 395 CG ARG A 24 4.731 -8.286 -4.969 1.00 24.44 C ATOM 396 CD ARG A 24 5.068 -7.099 -5.895 1.00 43.32 C ATOM 397 NE ARG A 24 4.417 -7.202 -7.215 1.00 60.44 N ATOM 398 CZ ARG A 24 4.841 -6.583 -8.331 1.00 61.53 C ATOM 399 NH1 ARG A 24 5.923 -5.801 -8.304 1.00 41.14 N ATOM 400 NH2 ARG A 24 4.207 -6.784 -9.472 1.00 13.54 N ATOM 0 H ARG A 24 1.473 -8.070 -2.656 1.00 64.34 H new ATOM 0 HA ARG A 24 2.847 -10.295 -3.969 1.00 53.15 H new ATOM 0 HB2 ARG A 24 2.589 -8.245 -5.219 1.00 41.50 H new ATOM 0 HB3 ARG A 24 3.169 -7.270 -3.883 1.00 41.50 H new ATOM 0 HG2 ARG A 24 5.446 -8.310 -4.146 1.00 24.44 H new ATOM 0 HG3 ARG A 24 4.852 -9.216 -5.524 1.00 24.44 H new ATOM 0 HD2 ARG A 24 4.760 -6.170 -5.415 1.00 43.32 H new ATOM 0 HD3 ARG A 24 6.148 -7.045 -6.031 1.00 43.32 H new ATOM 0 HE ARG A 24 3.584 -7.786 -7.286 1.00 60.44 H new ATOM 0 HH11 ARG A 24 6.435 -5.669 -7.432 1.00 41.14 H new ATOM 0 HH12 ARG A 24 6.237 -5.336 -9.155 1.00 41.14 H new ATOM 0 HH21 ARG A 24 3.400 -7.406 -9.504 1.00 13.54 H new ATOM 0 HH22 ARG A 24 4.525 -6.317 -10.321 1.00 13.54 H new ATOM 414 N SER A 25 4.807 -10.621 -2.411 1.00 35.34 N ATOM 415 CA SER A 25 5.927 -10.877 -1.485 1.00 45.53 C ATOM 416 C SER A 25 7.286 -10.595 -2.146 1.00 23.14 C ATOM 417 O SER A 25 7.452 -10.751 -3.366 1.00 45.21 O ATOM 418 CB SER A 25 5.845 -12.316 -0.952 1.00 51.13 C ATOM 419 OG SER A 25 4.630 -12.502 -0.249 1.00 72.10 O ATOM 0 H SER A 25 4.669 -11.355 -3.106 1.00 35.34 H new ATOM 0 HA SER A 25 5.842 -10.190 -0.643 1.00 45.53 H new ATOM 0 HB2 SER A 25 5.909 -13.023 -1.779 1.00 51.13 H new ATOM 0 HB3 SER A 25 6.690 -12.518 -0.294 1.00 51.13 H new ATOM 0 HG SER A 25 4.584 -13.422 0.086 1.00 72.10 H new ATOM 583 N ASN A 35 5.320 -13.678 -5.749 1.00 55.21 N ATOM 584 CA ASN A 35 4.111 -14.508 -5.623 1.00 32.13 C ATOM 585 C ASN A 35 2.930 -13.700 -5.045 1.00 15.23 C ATOM 586 O ASN A 35 3.111 -12.821 -4.188 1.00 11.41 O ATOM 587 CB ASN A 35 4.392 -15.776 -4.787 1.00 63.41 C ATOM 588 CG ASN A 35 4.891 -15.507 -3.365 1.00 12.13 C ATOM 589 OD1 ASN A 35 5.682 -14.602 -3.131 1.00 10.10 O ATOM 590 ND2 ASN A 35 4.424 -16.286 -2.405 1.00 41.12 N ATOM 0 HA ASN A 35 3.824 -14.829 -6.624 1.00 32.13 H new ATOM 0 HB2 ASN A 35 3.478 -16.368 -4.731 1.00 63.41 H new ATOM 0 HB3 ASN A 35 5.133 -16.382 -5.309 1.00 63.41 H new ATOM 0 HD21 ASN A 35 4.722 -16.141 -1.440 1.00 41.12 H new ATOM 0 HD22 ASN A 35 3.766 -17.032 -2.629 1.00 41.12 H new ATOM 597 N TYR A 36 1.725 -14.003 -5.556 1.00 73.43 N ATOM 598 CA TYR A 36 0.484 -13.281 -5.237 1.00 33.24 C ATOM 599 C TYR A 36 -0.480 -14.230 -4.513 1.00 31.04 C ATOM 600 O TYR A 36 -0.941 -15.212 -5.099 1.00 23.41 O ATOM 601 CB TYR A 36 -0.142 -12.748 -6.553 1.00 53.10 C ATOM 602 CG TYR A 36 0.817 -11.854 -7.361 1.00 62.33 C ATOM 603 CD1 TYR A 36 1.082 -10.544 -6.961 1.00 35.44 C ATOM 604 CD2 TYR A 36 1.480 -12.328 -8.499 1.00 44.43 C ATOM 605 CE1 TYR A 36 1.964 -9.749 -7.664 1.00 41.13 C ATOM 606 CE2 TYR A 36 2.366 -11.528 -9.198 1.00 4.41 C ATOM 607 CZ TYR A 36 2.599 -10.238 -8.774 1.00 13.41 C ATOM 608 OH TYR A 36 3.479 -9.433 -9.460 1.00 72.11 O ATOM 0 H TYR A 36 1.585 -14.770 -6.214 1.00 73.43 H new ATOM 0 HA TYR A 36 0.692 -12.435 -4.582 1.00 33.24 H new ATOM 0 HB2 TYR A 36 -0.448 -13.592 -7.170 1.00 53.10 H new ATOM 0 HB3 TYR A 36 -1.043 -12.183 -6.316 1.00 53.10 H new ATOM 0 HD1 TYR A 36 0.589 -10.146 -6.087 1.00 35.44 H new ATOM 0 HD2 TYR A 36 1.296 -13.337 -8.838 1.00 44.43 H new ATOM 0 HE1 TYR A 36 2.154 -8.737 -7.337 1.00 41.13 H new ATOM 0 HE2 TYR A 36 2.872 -11.912 -10.071 1.00 4.41 H new ATOM 0 HH TYR A 36 3.847 -9.926 -10.222 1.00 72.11 H new ATOM 618 N LYS A 37 -0.759 -13.940 -3.233 1.00 1.22 N ATOM 619 CA LYS A 37 -1.593 -14.805 -2.371 1.00 75.33 C ATOM 620 C LYS A 37 -2.664 -13.980 -1.639 1.00 5.21 C ATOM 621 O LYS A 37 -2.438 -12.820 -1.322 1.00 13.25 O ATOM 622 CB LYS A 37 -0.717 -15.565 -1.337 1.00 54.45 C ATOM 623 CG LYS A 37 0.229 -16.639 -1.921 1.00 44.30 C ATOM 624 CD LYS A 37 -0.538 -17.820 -2.558 1.00 33.12 C ATOM 625 CE LYS A 37 -1.322 -18.659 -1.533 1.00 20.40 C ATOM 626 NZ LYS A 37 -2.198 -19.646 -2.216 1.00 0.31 N ATOM 0 H LYS A 37 -0.416 -13.102 -2.763 1.00 1.22 H new ATOM 0 HA LYS A 37 -2.089 -15.532 -3.014 1.00 75.33 H new ATOM 0 HB2 LYS A 37 -0.117 -14.837 -0.791 1.00 54.45 H new ATOM 0 HB3 LYS A 37 -1.376 -16.043 -0.612 1.00 54.45 H new ATOM 0 HG2 LYS A 37 0.874 -16.181 -2.672 1.00 44.30 H new ATOM 0 HG3 LYS A 37 0.878 -17.016 -1.130 1.00 44.30 H new ATOM 0 HD2 LYS A 37 -1.230 -17.434 -3.306 1.00 33.12 H new ATOM 0 HD3 LYS A 37 0.169 -18.464 -3.080 1.00 33.12 H new ATOM 0 HE2 LYS A 37 -0.626 -19.179 -0.874 1.00 20.40 H new ATOM 0 HE3 LYS A 37 -1.926 -18.003 -0.906 1.00 20.40 H new ATOM 0 HZ1 LYS A 37 -2.717 -20.200 -1.505 1.00 0.31 H new ATOM 0 HZ2 LYS A 37 -2.875 -19.145 -2.826 1.00 0.31 H new ATOM 0 HZ3 LYS A 37 -1.616 -20.284 -2.795 1.00 0.31 H new ATOM 640 N GLU A 38 -3.791 -14.638 -1.319 1.00 24.43 N ATOM 641 CA GLU A 38 -4.991 -13.998 -0.748 1.00 72.24 C ATOM 642 C GLU A 38 -4.851 -13.894 0.787 1.00 65.12 C ATOM 643 O GLU A 38 -4.774 -14.918 1.474 1.00 61.33 O ATOM 644 CB GLU A 38 -6.239 -14.828 -1.136 1.00 44.13 C ATOM 645 CG GLU A 38 -7.565 -14.231 -0.645 1.00 25.44 C ATOM 646 CD GLU A 38 -8.767 -15.167 -0.852 1.00 3.33 C ATOM 647 OE1 GLU A 38 -9.379 -15.152 -1.943 1.00 12.40 O ATOM 648 OE2 GLU A 38 -9.094 -15.944 0.077 1.00 72.40 O ATOM 0 H GLU A 38 -3.897 -15.644 -1.451 1.00 24.43 H new ATOM 0 HA GLU A 38 -5.101 -12.989 -1.146 1.00 72.24 H new ATOM 0 HB2 GLU A 38 -6.276 -14.924 -2.221 1.00 44.13 H new ATOM 0 HB3 GLU A 38 -6.134 -15.834 -0.731 1.00 44.13 H new ATOM 0 HG2 GLU A 38 -7.478 -13.992 0.415 1.00 25.44 H new ATOM 0 HG3 GLU A 38 -7.749 -13.293 -1.169 1.00 25.44 H new ATOM 655 N ARG A 39 -4.827 -12.659 1.310 1.00 31.01 N ATOM 656 CA ARG A 39 -4.472 -12.356 2.716 1.00 53.12 C ATOM 657 C ARG A 39 -5.529 -11.422 3.341 1.00 64.01 C ATOM 658 O ARG A 39 -6.195 -10.654 2.643 1.00 72.51 O ATOM 659 CB ARG A 39 -3.037 -11.703 2.803 1.00 43.11 C ATOM 660 CG ARG A 39 -1.856 -12.699 3.010 1.00 5.11 C ATOM 661 CD ARG A 39 -1.624 -13.684 1.843 1.00 30.53 C ATOM 662 NE ARG A 39 -0.791 -14.856 2.197 1.00 54.35 N ATOM 663 CZ ARG A 39 -1.162 -16.149 2.063 1.00 64.01 C ATOM 664 NH1 ARG A 39 -2.363 -16.483 1.584 1.00 25.40 N ATOM 665 NH2 ARG A 39 -0.319 -17.096 2.412 1.00 30.24 N ATOM 0 H ARG A 39 -5.056 -11.827 0.766 1.00 31.01 H new ATOM 0 HA ARG A 39 -4.454 -13.290 3.277 1.00 53.12 H new ATOM 0 HB2 ARG A 39 -2.858 -11.140 1.887 1.00 43.11 H new ATOM 0 HB3 ARG A 39 -3.033 -10.986 3.624 1.00 43.11 H new ATOM 0 HG2 ARG A 39 -0.942 -12.128 3.171 1.00 5.11 H new ATOM 0 HG3 ARG A 39 -2.038 -13.272 3.919 1.00 5.11 H new ATOM 0 HD2 ARG A 39 -2.590 -14.035 1.480 1.00 30.53 H new ATOM 0 HD3 ARG A 39 -1.149 -13.150 1.020 1.00 30.53 H new ATOM 0 HE ARG A 39 0.139 -14.673 2.573 1.00 54.35 H new ATOM 0 HH11 ARG A 39 -3.023 -15.755 1.310 1.00 25.40 H new ATOM 0 HH12 ARG A 39 -2.620 -17.466 1.492 1.00 25.40 H new ATOM 0 HH21 ARG A 39 0.601 -16.850 2.778 1.00 30.24 H new ATOM 0 HH22 ARG A 39 -0.585 -18.076 2.317 1.00 30.24 H new ATOM 679 N LEU A 40 -5.670 -11.505 4.670 1.00 34.32 N ATOM 680 CA LEU A 40 -6.572 -10.636 5.439 1.00 41.05 C ATOM 681 C LEU A 40 -5.760 -9.502 6.089 1.00 65.15 C ATOM 682 O LEU A 40 -5.095 -9.712 7.106 1.00 62.24 O ATOM 683 CB LEU A 40 -7.341 -11.467 6.509 1.00 5.44 C ATOM 684 CG LEU A 40 -8.242 -10.654 7.498 1.00 14.33 C ATOM 685 CD1 LEU A 40 -9.275 -9.754 6.754 1.00 14.54 C ATOM 686 CD2 LEU A 40 -8.942 -11.598 8.510 1.00 31.24 C ATOM 0 H LEU A 40 -5.161 -12.177 5.244 1.00 34.32 H new ATOM 0 HA LEU A 40 -7.311 -10.194 4.771 1.00 41.05 H new ATOM 0 HB2 LEU A 40 -7.968 -12.194 5.993 1.00 5.44 H new ATOM 0 HB3 LEU A 40 -6.614 -12.031 7.093 1.00 5.44 H new ATOM 0 HG LEU A 40 -7.586 -9.983 8.054 1.00 14.33 H new ATOM 0 HD11 LEU A 40 -9.876 -9.211 7.483 1.00 14.54 H new ATOM 0 HD12 LEU A 40 -8.747 -9.044 6.118 1.00 14.54 H new ATOM 0 HD13 LEU A 40 -9.925 -10.377 6.140 1.00 14.54 H new ATOM 0 HD21 LEU A 40 -9.562 -11.010 9.187 1.00 31.24 H new ATOM 0 HD22 LEU A 40 -9.567 -12.310 7.971 1.00 31.24 H new ATOM 0 HD23 LEU A 40 -8.189 -12.138 9.085 1.00 31.24 H new ATOM 698 N PHE A 41 -5.793 -8.315 5.467 1.00 60.45 N ATOM 699 CA PHE A 41 -5.146 -7.108 6.006 1.00 71.41 C ATOM 700 C PHE A 41 -6.109 -6.389 6.957 1.00 13.41 C ATOM 701 O PHE A 41 -7.191 -5.963 6.549 1.00 15.42 O ATOM 702 CB PHE A 41 -4.721 -6.155 4.861 1.00 75.23 C ATOM 703 CG PHE A 41 -3.525 -6.655 4.036 1.00 71.12 C ATOM 704 CD1 PHE A 41 -3.672 -7.680 3.100 1.00 53.22 C ATOM 705 CD2 PHE A 41 -2.252 -6.104 4.205 1.00 53.11 C ATOM 706 CE1 PHE A 41 -2.592 -8.129 2.358 1.00 22.14 C ATOM 707 CE2 PHE A 41 -1.174 -6.558 3.465 1.00 22.32 C ATOM 708 CZ PHE A 41 -1.345 -7.567 2.542 1.00 61.13 C ATOM 0 H PHE A 41 -6.268 -8.164 4.577 1.00 60.45 H new ATOM 0 HA PHE A 41 -4.251 -7.406 6.553 1.00 71.41 H new ATOM 0 HB2 PHE A 41 -5.570 -6.005 4.194 1.00 75.23 H new ATOM 0 HB3 PHE A 41 -4.473 -5.182 5.286 1.00 75.23 H new ATOM 0 HD1 PHE A 41 -4.643 -8.130 2.952 1.00 53.22 H new ATOM 0 HD2 PHE A 41 -2.107 -5.312 4.924 1.00 53.11 H new ATOM 0 HE1 PHE A 41 -2.726 -8.920 1.635 1.00 22.14 H new ATOM 0 HE2 PHE A 41 -0.197 -6.121 3.611 1.00 22.32 H new ATOM 0 HZ PHE A 41 -0.504 -7.918 1.963 1.00 61.13 H new ATOM 718 N VAL A 42 -5.710 -6.295 8.229 1.00 2.23 N ATOM 719 CA VAL A 42 -6.427 -5.538 9.262 1.00 72.25 C ATOM 720 C VAL A 42 -5.548 -4.336 9.654 1.00 14.34 C ATOM 721 O VAL A 42 -4.432 -4.519 10.128 1.00 13.13 O ATOM 722 CB VAL A 42 -6.724 -6.438 10.533 1.00 11.21 C ATOM 723 CG1 VAL A 42 -7.471 -5.646 11.638 1.00 65.14 C ATOM 724 CG2 VAL A 42 -7.506 -7.719 10.138 1.00 73.11 C ATOM 0 H VAL A 42 -4.866 -6.750 8.576 1.00 2.23 H new ATOM 0 HA VAL A 42 -7.389 -5.204 8.873 1.00 72.25 H new ATOM 0 HB VAL A 42 -5.763 -6.742 10.947 1.00 11.21 H new ATOM 0 HG11 VAL A 42 -7.656 -6.298 12.492 1.00 65.14 H new ATOM 0 HG12 VAL A 42 -6.862 -4.799 11.954 1.00 65.14 H new ATOM 0 HG13 VAL A 42 -8.421 -5.283 11.246 1.00 65.14 H new ATOM 0 HG21 VAL A 42 -7.696 -8.318 11.028 1.00 73.11 H new ATOM 0 HG22 VAL A 42 -8.454 -7.439 9.679 1.00 73.11 H new ATOM 0 HG23 VAL A 42 -6.917 -8.300 9.429 1.00 73.11 H new ATOM 734 N LEU A 43 -6.062 -3.122 9.476 1.00 73.11 N ATOM 735 CA LEU A 43 -5.328 -1.884 9.791 1.00 61.41 C ATOM 736 C LEU A 43 -5.786 -1.409 11.158 1.00 2.32 C ATOM 737 O LEU A 43 -6.981 -1.329 11.400 1.00 62.31 O ATOM 738 CB LEU A 43 -5.636 -0.784 8.737 1.00 22.51 C ATOM 739 CG LEU A 43 -5.096 0.645 9.048 1.00 73.40 C ATOM 740 CD1 LEU A 43 -3.546 0.666 9.148 1.00 13.52 C ATOM 741 CD2 LEU A 43 -5.622 1.680 8.015 1.00 42.24 C ATOM 0 H LEU A 43 -7.000 -2.961 9.109 1.00 73.11 H new ATOM 0 HA LEU A 43 -4.255 -2.078 9.782 1.00 61.41 H new ATOM 0 HB2 LEU A 43 -5.225 -1.104 7.780 1.00 22.51 H new ATOM 0 HB3 LEU A 43 -6.717 -0.721 8.615 1.00 22.51 H new ATOM 0 HG LEU A 43 -5.479 0.935 10.026 1.00 73.40 H new ATOM 0 HD11 LEU A 43 -3.209 1.680 9.366 1.00 13.52 H new ATOM 0 HD12 LEU A 43 -3.224 -0.003 9.946 1.00 13.52 H new ATOM 0 HD13 LEU A 43 -3.116 0.336 8.202 1.00 13.52 H new ATOM 0 HD21 LEU A 43 -5.229 2.668 8.257 1.00 42.24 H new ATOM 0 HD22 LEU A 43 -5.295 1.394 7.015 1.00 42.24 H new ATOM 0 HD23 LEU A 43 -6.711 1.705 8.047 1.00 42.24 H new ATOM 753 N THR A 44 -4.834 -1.120 12.042 1.00 52.01 N ATOM 754 CA THR A 44 -5.093 -0.576 13.375 1.00 40.30 C ATOM 755 C THR A 44 -4.326 0.752 13.516 1.00 52.13 C ATOM 756 O THR A 44 -3.629 1.180 12.579 1.00 23.41 O ATOM 757 CB THR A 44 -4.658 -1.609 14.470 1.00 30.22 C ATOM 758 OG1 THR A 44 -3.258 -1.901 14.334 1.00 71.21 O ATOM 759 CG2 THR A 44 -5.459 -2.925 14.365 1.00 21.33 C ATOM 0 H THR A 44 -3.842 -1.260 11.849 1.00 52.01 H new ATOM 0 HA THR A 44 -6.158 -0.387 13.510 1.00 40.30 H new ATOM 0 HB THR A 44 -4.859 -1.161 15.443 1.00 30.22 H new ATOM 0 HG1 THR A 44 -2.943 -1.591 13.460 1.00 71.21 H new ATOM 0 HG21 THR A 44 -5.128 -3.615 15.141 1.00 21.33 H new ATOM 0 HG22 THR A 44 -6.521 -2.716 14.494 1.00 21.33 H new ATOM 0 HG23 THR A 44 -5.294 -3.374 13.386 1.00 21.33 H new ATOM 767 N LYS A 45 -4.458 1.388 14.685 1.00 23.20 N ATOM 768 CA LYS A 45 -3.896 2.729 14.951 1.00 23.23 C ATOM 769 C LYS A 45 -2.357 2.770 14.881 1.00 25.21 C ATOM 770 O LYS A 45 -1.788 3.731 14.347 1.00 73.31 O ATOM 771 CB LYS A 45 -4.395 3.252 16.337 1.00 72.24 C ATOM 772 CG LYS A 45 -5.894 3.674 16.385 1.00 72.25 C ATOM 773 CD LYS A 45 -6.131 5.199 16.186 1.00 63.24 C ATOM 774 CE LYS A 45 -5.546 5.756 14.882 1.00 70.21 C ATOM 775 NZ LYS A 45 -5.882 7.193 14.671 1.00 21.10 N ATOM 0 H LYS A 45 -4.958 0.991 15.480 1.00 23.20 H new ATOM 0 HA LYS A 45 -4.255 3.384 14.157 1.00 23.23 H new ATOM 0 HB2 LYS A 45 -4.229 2.474 17.082 1.00 72.24 H new ATOM 0 HB3 LYS A 45 -3.784 4.107 16.627 1.00 72.24 H new ATOM 0 HG2 LYS A 45 -6.439 3.129 15.614 1.00 72.25 H new ATOM 0 HG3 LYS A 45 -6.314 3.374 17.345 1.00 72.25 H new ATOM 0 HD2 LYS A 45 -7.203 5.395 16.204 1.00 63.24 H new ATOM 0 HD3 LYS A 45 -5.694 5.737 17.027 1.00 63.24 H new ATOM 0 HE2 LYS A 45 -4.462 5.638 14.895 1.00 70.21 H new ATOM 0 HE3 LYS A 45 -5.920 5.172 14.041 1.00 70.21 H new ATOM 0 HZ1 LYS A 45 -5.660 7.461 13.691 1.00 21.10 H new ATOM 0 HZ2 LYS A 45 -6.896 7.342 14.849 1.00 21.10 H new ATOM 0 HZ3 LYS A 45 -5.325 7.779 15.325 1.00 21.10 H new ATOM 789 N SER A 46 -1.700 1.739 15.422 1.00 35.32 N ATOM 790 CA SER A 46 -0.230 1.706 15.529 1.00 35.03 C ATOM 791 C SER A 46 0.418 1.054 14.288 1.00 71.11 C ATOM 792 O SER A 46 1.475 1.509 13.825 1.00 40.13 O ATOM 793 CB SER A 46 0.175 0.943 16.810 1.00 0.53 C ATOM 794 OG SER A 46 -0.505 1.455 17.948 1.00 51.21 O ATOM 0 H SER A 46 -2.162 0.910 15.796 1.00 35.32 H new ATOM 0 HA SER A 46 0.132 2.733 15.583 1.00 35.03 H new ATOM 0 HB2 SER A 46 -0.053 -0.117 16.693 1.00 0.53 H new ATOM 0 HB3 SER A 46 1.252 1.023 16.960 1.00 0.53 H new ATOM 0 HG SER A 46 -0.232 0.954 18.745 1.00 51.21 H new ATOM 800 N MET A 47 -0.232 0.004 13.727 1.00 44.42 N ATOM 801 CA MET A 47 0.390 -0.874 12.699 1.00 64.33 C ATOM 802 C MET A 47 -0.665 -1.417 11.714 1.00 22.13 C ATOM 803 O MET A 47 -1.856 -1.488 12.024 1.00 24.52 O ATOM 804 CB MET A 47 1.168 -2.067 13.360 1.00 65.21 C ATOM 805 CG MET A 47 2.415 -1.666 14.171 1.00 4.12 C ATOM 806 SD MET A 47 3.228 -3.052 14.992 1.00 52.30 S ATOM 807 CE MET A 47 1.951 -3.632 16.106 1.00 22.51 C ATOM 0 H MET A 47 -1.188 -0.257 13.968 1.00 44.42 H new ATOM 0 HA MET A 47 1.101 -0.262 12.144 1.00 64.33 H new ATOM 0 HB2 MET A 47 0.485 -2.606 14.016 1.00 65.21 H new ATOM 0 HB3 MET A 47 1.471 -2.761 12.576 1.00 65.21 H new ATOM 0 HG2 MET A 47 3.129 -1.181 13.505 1.00 4.12 H new ATOM 0 HG3 MET A 47 2.127 -0.930 14.921 1.00 4.12 H new ATOM 0 HE1 MET A 47 2.383 -3.821 17.089 1.00 22.51 H new ATOM 0 HE2 MET A 47 1.172 -2.875 16.192 1.00 22.51 H new ATOM 0 HE3 MET A 47 1.520 -4.554 15.716 1.00 22.51 H new ATOM 817 N LEU A 48 -0.195 -1.792 10.517 1.00 65.40 N ATOM 818 CA LEU A 48 -0.982 -2.500 9.507 1.00 12.53 C ATOM 819 C LEU A 48 -0.687 -3.997 9.659 1.00 75.13 C ATOM 820 O LEU A 48 0.379 -4.475 9.265 1.00 45.12 O ATOM 821 CB LEU A 48 -0.604 -2.001 8.082 1.00 21.43 C ATOM 822 CG LEU A 48 -1.238 -2.769 6.869 1.00 20.21 C ATOM 823 CD1 LEU A 48 -2.787 -2.701 6.889 1.00 52.24 C ATOM 824 CD2 LEU A 48 -0.664 -2.246 5.518 1.00 21.44 C ATOM 0 H LEU A 48 0.763 -1.606 10.221 1.00 65.40 H new ATOM 0 HA LEU A 48 -2.047 -2.312 9.645 1.00 12.53 H new ATOM 0 HB2 LEU A 48 -0.887 -0.951 8.004 1.00 21.43 H new ATOM 0 HB3 LEU A 48 0.481 -2.047 7.983 1.00 21.43 H new ATOM 0 HG LEU A 48 -0.964 -3.819 6.967 1.00 20.21 H new ATOM 0 HD11 LEU A 48 -3.186 -3.245 6.033 1.00 52.24 H new ATOM 0 HD12 LEU A 48 -3.159 -3.150 7.810 1.00 52.24 H new ATOM 0 HD13 LEU A 48 -3.106 -1.660 6.839 1.00 52.24 H new ATOM 0 HD21 LEU A 48 -1.119 -2.794 4.693 1.00 21.44 H new ATOM 0 HD22 LEU A 48 -0.887 -1.184 5.415 1.00 21.44 H new ATOM 0 HD23 LEU A 48 0.416 -2.394 5.500 1.00 21.44 H new ATOM 836 N THR A 49 -1.625 -4.697 10.294 1.00 24.43 N ATOM 837 CA THR A 49 -1.538 -6.137 10.563 1.00 24.45 C ATOM 838 C THR A 49 -2.070 -6.929 9.348 1.00 1.01 C ATOM 839 O THR A 49 -2.883 -6.411 8.582 1.00 33.22 O ATOM 840 CB THR A 49 -2.365 -6.477 11.851 1.00 15.55 C ATOM 841 OG1 THR A 49 -2.006 -5.556 12.900 1.00 62.02 O ATOM 842 CG2 THR A 49 -2.148 -7.933 12.343 1.00 31.00 C ATOM 0 H THR A 49 -2.485 -4.274 10.644 1.00 24.43 H new ATOM 0 HA THR A 49 -0.498 -6.418 10.729 1.00 24.45 H new ATOM 0 HB THR A 49 -3.420 -6.382 11.594 1.00 15.55 H new ATOM 0 HG1 THR A 49 -2.521 -5.763 13.707 1.00 62.02 H new ATOM 0 HG21 THR A 49 -2.747 -8.108 13.237 1.00 31.00 H new ATOM 0 HG22 THR A 49 -2.451 -8.630 11.562 1.00 31.00 H new ATOM 0 HG23 THR A 49 -1.094 -8.085 12.576 1.00 31.00 H new ATOM 850 N TYR A 50 -1.570 -8.160 9.153 1.00 75.45 N ATOM 851 CA TYR A 50 -2.045 -9.064 8.097 1.00 31.04 C ATOM 852 C TYR A 50 -1.874 -10.528 8.543 1.00 32.32 C ATOM 853 O TYR A 50 -0.793 -10.946 8.987 1.00 63.10 O ATOM 854 CB TYR A 50 -1.341 -8.779 6.727 1.00 34.33 C ATOM 855 CG TYR A 50 0.133 -8.341 6.832 1.00 22.22 C ATOM 856 CD1 TYR A 50 1.168 -9.274 6.915 1.00 74.25 C ATOM 857 CD2 TYR A 50 0.481 -6.984 6.871 1.00 72.03 C ATOM 858 CE1 TYR A 50 2.481 -8.872 7.031 1.00 71.15 C ATOM 859 CE2 TYR A 50 1.796 -6.584 6.980 1.00 54.44 C ATOM 860 CZ TYR A 50 2.790 -7.534 7.065 1.00 23.12 C ATOM 861 OH TYR A 50 4.100 -7.144 7.185 1.00 50.35 O ATOM 0 H TYR A 50 -0.824 -8.555 9.725 1.00 75.45 H new ATOM 0 HA TYR A 50 -3.107 -8.880 7.936 1.00 31.04 H new ATOM 0 HB2 TYR A 50 -1.394 -9.679 6.114 1.00 34.33 H new ATOM 0 HB3 TYR A 50 -1.899 -8.003 6.203 1.00 34.33 H new ATOM 0 HD1 TYR A 50 0.936 -10.328 6.888 1.00 74.25 H new ATOM 0 HD2 TYR A 50 -0.296 -6.237 6.815 1.00 72.03 H new ATOM 0 HE1 TYR A 50 3.268 -9.609 7.095 1.00 71.15 H new ATOM 0 HE2 TYR A 50 2.045 -5.533 6.999 1.00 54.44 H new ATOM 0 HH TYR A 50 4.252 -6.780 8.082 1.00 50.35 H new ATOM 871 N TYR A 51 -2.985 -11.267 8.422 1.00 73.31 N ATOM 872 CA TYR A 51 -3.082 -12.688 8.756 1.00 63.30 C ATOM 873 C TYR A 51 -3.150 -13.521 7.467 1.00 4.11 C ATOM 874 O TYR A 51 -3.899 -13.183 6.538 1.00 31.41 O ATOM 875 CB TYR A 51 -4.362 -12.934 9.592 1.00 65.13 C ATOM 876 CG TYR A 51 -4.454 -12.135 10.905 1.00 41.13 C ATOM 877 CD1 TYR A 51 -3.756 -12.544 12.044 1.00 1.04 C ATOM 878 CD2 TYR A 51 -5.233 -10.974 11.003 1.00 11.43 C ATOM 879 CE1 TYR A 51 -3.838 -11.833 13.225 1.00 31.10 C ATOM 880 CE2 TYR A 51 -5.311 -10.267 12.184 1.00 30.54 C ATOM 881 CZ TYR A 51 -4.613 -10.700 13.287 1.00 13.03 C ATOM 882 OH TYR A 51 -4.699 -9.994 14.458 1.00 13.53 O ATOM 0 H TYR A 51 -3.864 -10.879 8.079 1.00 73.31 H new ATOM 0 HA TYR A 51 -2.204 -12.983 9.331 1.00 63.30 H new ATOM 0 HB2 TYR A 51 -5.229 -12.693 8.978 1.00 65.13 H new ATOM 0 HB3 TYR A 51 -4.424 -13.996 9.827 1.00 65.13 H new ATOM 0 HD1 TYR A 51 -3.142 -13.431 12.000 1.00 1.04 H new ATOM 0 HD2 TYR A 51 -5.781 -10.628 10.139 1.00 11.43 H new ATOM 0 HE1 TYR A 51 -3.295 -12.166 14.097 1.00 31.10 H new ATOM 0 HE2 TYR A 51 -5.918 -9.376 12.243 1.00 30.54 H new ATOM 0 HH TYR A 51 -5.286 -9.220 14.331 1.00 13.53 H new ATOM 1081 N PHE A 63 3.015 -7.503 10.866 1.00 4.23 N ATOM 1082 CA PHE A 63 2.652 -6.080 10.890 1.00 23.40 C ATOM 1083 C PHE A 63 3.723 -5.212 10.209 1.00 34.44 C ATOM 1084 O PHE A 63 4.853 -5.658 9.976 1.00 42.44 O ATOM 1085 CB PHE A 63 2.421 -5.613 12.361 1.00 51.43 C ATOM 1086 CG PHE A 63 3.541 -5.997 13.357 1.00 33.14 C ATOM 1087 CD1 PHE A 63 4.754 -5.299 13.393 1.00 14.34 C ATOM 1088 CD2 PHE A 63 3.372 -7.052 14.258 1.00 30.43 C ATOM 1089 CE1 PHE A 63 5.751 -5.646 14.289 1.00 74.44 C ATOM 1090 CE2 PHE A 63 4.372 -7.395 15.153 1.00 2.35 C ATOM 1091 CZ PHE A 63 5.559 -6.692 15.170 1.00 2.43 C ATOM 0 HA PHE A 63 1.726 -5.958 10.328 1.00 23.40 H new ATOM 0 HB2 PHE A 63 2.307 -4.529 12.368 1.00 51.43 H new ATOM 0 HB3 PHE A 63 1.481 -6.035 12.716 1.00 51.43 H new ATOM 0 HD1 PHE A 63 4.915 -4.477 12.711 1.00 14.34 H new ATOM 0 HD2 PHE A 63 2.447 -7.609 14.256 1.00 30.43 H new ATOM 0 HE1 PHE A 63 6.681 -5.097 14.299 1.00 74.44 H new ATOM 0 HE2 PHE A 63 4.222 -8.215 15.840 1.00 2.35 H new ATOM 0 HZ PHE A 63 6.336 -6.959 15.871 1.00 2.43 H new ATOM 1101 N ILE A 64 3.310 -3.982 9.849 1.00 12.21 N ATOM 1102 CA ILE A 64 4.203 -2.883 9.420 1.00 3.32 C ATOM 1103 C ILE A 64 3.781 -1.617 10.183 1.00 15.04 C ATOM 1104 O ILE A 64 2.593 -1.327 10.255 1.00 62.34 O ATOM 1105 CB ILE A 64 4.139 -2.622 7.858 1.00 63.44 C ATOM 1106 CG1 ILE A 64 4.621 -3.886 7.076 1.00 12.11 C ATOM 1107 CG2 ILE A 64 4.976 -1.368 7.457 1.00 70.00 C ATOM 1108 CD1 ILE A 64 4.536 -3.781 5.570 1.00 31.41 C ATOM 0 H ILE A 64 2.325 -3.716 9.847 1.00 12.21 H new ATOM 0 HA ILE A 64 5.234 -3.158 9.644 1.00 3.32 H new ATOM 0 HB ILE A 64 3.101 -2.423 7.591 1.00 63.44 H new ATOM 0 HG12 ILE A 64 5.655 -4.092 7.352 1.00 12.11 H new ATOM 0 HG13 ILE A 64 4.028 -4.742 7.399 1.00 12.11 H new ATOM 0 HG21 ILE A 64 4.911 -1.217 6.379 1.00 70.00 H new ATOM 0 HG22 ILE A 64 4.585 -0.490 7.971 1.00 70.00 H new ATOM 0 HG23 ILE A 64 6.018 -1.520 7.740 1.00 70.00 H new ATOM 0 HD11 ILE A 64 4.893 -4.707 5.120 1.00 31.41 H new ATOM 0 HD12 ILE A 64 3.501 -3.610 5.275 1.00 31.41 H new ATOM 0 HD13 ILE A 64 5.153 -2.950 5.228 1.00 31.41 H new ATOM 1120 N ASP A 65 4.753 -0.865 10.725 1.00 44.44 N ATOM 1121 CA ASP A 65 4.474 0.347 11.526 1.00 53.33 C ATOM 1122 C ASP A 65 3.938 1.467 10.623 1.00 40.24 C ATOM 1123 O ASP A 65 4.582 1.806 9.622 1.00 42.42 O ATOM 1124 CB ASP A 65 5.753 0.826 12.259 1.00 52.11 C ATOM 1125 CG ASP A 65 6.240 -0.169 13.324 1.00 15.33 C ATOM 1126 OD1 ASP A 65 5.786 -0.076 14.486 1.00 63.51 O ATOM 1127 OD2 ASP A 65 7.069 -1.053 13.010 1.00 72.41 O ATOM 0 H ASP A 65 5.746 -1.074 10.624 1.00 44.44 H new ATOM 0 HA ASP A 65 3.719 0.098 12.272 1.00 53.33 H new ATOM 0 HB2 ASP A 65 6.546 0.986 11.528 1.00 52.11 H new ATOM 0 HB3 ASP A 65 5.556 1.788 12.731 1.00 52.11 H new ATOM 1132 N VAL A 66 2.759 2.024 10.995 1.00 30.25 N ATOM 1133 CA VAL A 66 2.115 3.145 10.264 1.00 64.24 C ATOM 1134 C VAL A 66 2.995 4.413 10.330 1.00 2.32 C ATOM 1135 O VAL A 66 3.064 5.189 9.370 1.00 21.21 O ATOM 1136 CB VAL A 66 0.648 3.425 10.809 1.00 22.14 C ATOM 1137 CG1 VAL A 66 -0.012 4.640 10.113 1.00 51.13 C ATOM 1138 CG2 VAL A 66 -0.245 2.165 10.660 1.00 12.34 C ATOM 0 H VAL A 66 2.229 1.710 11.808 1.00 30.25 H new ATOM 0 HA VAL A 66 2.019 2.856 9.217 1.00 64.24 H new ATOM 0 HB VAL A 66 0.742 3.667 11.868 1.00 22.14 H new ATOM 0 HG11 VAL A 66 -1.012 4.792 10.518 1.00 51.13 H new ATOM 0 HG12 VAL A 66 0.590 5.531 10.289 1.00 51.13 H new ATOM 0 HG13 VAL A 66 -0.079 4.453 9.041 1.00 51.13 H new ATOM 0 HG21 VAL A 66 -1.244 2.380 11.039 1.00 12.34 H new ATOM 0 HG22 VAL A 66 -0.308 1.886 9.608 1.00 12.34 H new ATOM 0 HG23 VAL A 66 0.189 1.342 11.228 1.00 12.34 H new ATOM 1148 N SER A 67 3.717 4.560 11.450 1.00 1.23 N ATOM 1149 CA SER A 67 4.655 5.679 11.665 1.00 1.32 C ATOM 1150 C SER A 67 5.829 5.642 10.665 1.00 60.11 C ATOM 1151 O SER A 67 6.350 6.692 10.287 1.00 13.01 O ATOM 1152 CB SER A 67 5.179 5.660 13.117 1.00 2.41 C ATOM 1153 OG SER A 67 4.102 5.707 14.043 1.00 72.34 O ATOM 0 H SER A 67 3.670 3.909 12.234 1.00 1.23 H new ATOM 0 HA SER A 67 4.111 6.608 11.494 1.00 1.32 H new ATOM 0 HB2 SER A 67 5.769 4.759 13.284 1.00 2.41 H new ATOM 0 HB3 SER A 67 5.842 6.510 13.280 1.00 2.41 H new ATOM 0 HG SER A 67 4.455 5.692 14.957 1.00 72.34 H new ATOM 1159 N LYS A 68 6.211 4.430 10.212 1.00 25.25 N ATOM 1160 CA LYS A 68 7.359 4.232 9.291 1.00 53.42 C ATOM 1161 C LYS A 68 6.945 4.353 7.817 1.00 4.15 C ATOM 1162 O LYS A 68 7.809 4.381 6.928 1.00 20.21 O ATOM 1163 CB LYS A 68 8.040 2.858 9.548 1.00 33.41 C ATOM 1164 CG LYS A 68 8.718 2.723 10.932 1.00 64.34 C ATOM 1165 CD LYS A 68 9.791 3.805 11.194 1.00 63.01 C ATOM 1166 CE LYS A 68 10.949 3.773 10.183 1.00 44.42 C ATOM 1167 NZ LYS A 68 11.932 4.860 10.437 1.00 12.40 N ATOM 0 H LYS A 68 5.738 3.564 10.470 1.00 25.25 H new ATOM 0 HA LYS A 68 8.075 5.027 9.497 1.00 53.42 H new ATOM 0 HB2 LYS A 68 7.292 2.072 9.447 1.00 33.41 H new ATOM 0 HB3 LYS A 68 8.788 2.688 8.774 1.00 33.41 H new ATOM 0 HG2 LYS A 68 7.956 2.781 11.709 1.00 64.34 H new ATOM 0 HG3 LYS A 68 9.178 1.738 11.009 1.00 64.34 H new ATOM 0 HD2 LYS A 68 9.320 4.788 11.165 1.00 63.01 H new ATOM 0 HD3 LYS A 68 10.192 3.673 12.199 1.00 63.01 H new ATOM 0 HE2 LYS A 68 11.452 2.808 10.237 1.00 44.42 H new ATOM 0 HE3 LYS A 68 10.552 3.870 9.172 1.00 44.42 H new ATOM 0 HZ1 LYS A 68 12.698 4.806 9.736 1.00 12.40 H new ATOM 0 HZ2 LYS A 68 11.457 5.782 10.361 1.00 12.40 H new ATOM 0 HZ3 LYS A 68 12.329 4.753 11.392 1.00 12.40 H new ATOM 1181 N ILE A 69 5.629 4.409 7.568 1.00 53.13 N ATOM 1182 CA ILE A 69 5.090 4.587 6.218 1.00 70.35 C ATOM 1183 C ILE A 69 5.237 6.066 5.801 1.00 5.31 C ATOM 1184 O ILE A 69 4.709 6.962 6.466 1.00 72.24 O ATOM 1185 CB ILE A 69 3.587 4.147 6.121 1.00 23.13 C ATOM 1186 CG1 ILE A 69 3.394 2.678 6.623 1.00 52.23 C ATOM 1187 CG2 ILE A 69 3.086 4.296 4.670 1.00 42.11 C ATOM 1188 CD1 ILE A 69 1.946 2.212 6.681 1.00 42.52 C ATOM 0 H ILE A 69 4.915 4.333 8.293 1.00 53.13 H new ATOM 0 HA ILE A 69 5.658 3.949 5.541 1.00 70.35 H new ATOM 0 HB ILE A 69 2.997 4.797 6.767 1.00 23.13 H new ATOM 0 HG12 ILE A 69 3.951 2.008 5.968 1.00 52.23 H new ATOM 0 HG13 ILE A 69 3.831 2.588 7.618 1.00 52.23 H new ATOM 0 HG21 ILE A 69 2.042 3.988 4.612 1.00 42.11 H new ATOM 0 HG22 ILE A 69 3.175 5.337 4.359 1.00 42.11 H new ATOM 0 HG23 ILE A 69 3.686 3.668 4.012 1.00 42.11 H new ATOM 0 HD11 ILE A 69 1.909 1.183 7.040 1.00 42.52 H new ATOM 0 HD12 ILE A 69 1.384 2.854 7.360 1.00 42.52 H new ATOM 0 HD13 ILE A 69 1.507 2.265 5.685 1.00 42.52 H new ATOM 1200 N LYS A 70 5.978 6.292 4.704 1.00 11.50 N ATOM 1201 CA LYS A 70 6.332 7.634 4.205 1.00 0.22 C ATOM 1202 C LYS A 70 5.395 8.078 3.068 1.00 21.01 C ATOM 1203 O LYS A 70 5.283 9.273 2.778 1.00 31.23 O ATOM 1204 CB LYS A 70 7.799 7.606 3.702 1.00 41.42 C ATOM 1205 CG LYS A 70 8.815 7.097 4.750 1.00 3.11 C ATOM 1206 CD LYS A 70 10.261 7.029 4.208 1.00 0.43 C ATOM 1207 CE LYS A 70 10.416 6.052 3.027 1.00 21.40 C ATOM 1208 NZ LYS A 70 11.832 5.942 2.569 1.00 31.31 N ATOM 0 H LYS A 70 6.354 5.538 4.129 1.00 11.50 H new ATOM 0 HA LYS A 70 6.223 8.351 5.018 1.00 0.22 H new ATOM 0 HB2 LYS A 70 7.857 6.972 2.818 1.00 41.42 H new ATOM 0 HB3 LYS A 70 8.085 8.611 3.392 1.00 41.42 H new ATOM 0 HG2 LYS A 70 8.790 7.753 5.620 1.00 3.11 H new ATOM 0 HG3 LYS A 70 8.513 6.106 5.089 1.00 3.11 H new ATOM 0 HD2 LYS A 70 10.572 8.025 3.892 1.00 0.43 H new ATOM 0 HD3 LYS A 70 10.931 6.727 5.013 1.00 0.43 H new ATOM 0 HE2 LYS A 70 10.054 5.067 3.322 1.00 21.40 H new ATOM 0 HE3 LYS A 70 9.792 6.385 2.198 1.00 21.40 H new ATOM 0 HZ1 LYS A 70 11.909 5.189 1.855 1.00 31.31 H new ATOM 0 HZ2 LYS A 70 12.133 6.846 2.153 1.00 31.31 H new ATOM 0 HZ3 LYS A 70 12.442 5.714 3.380 1.00 31.31 H new ATOM 1222 N CYS A 71 4.732 7.095 2.430 1.00 23.23 N ATOM 1223 CA CYS A 71 3.858 7.317 1.262 1.00 15.45 C ATOM 1224 C CYS A 71 2.904 6.122 1.094 1.00 30.55 C ATOM 1225 O CYS A 71 3.327 4.977 1.243 1.00 40.13 O ATOM 1226 CB CYS A 71 4.689 7.493 -0.044 1.00 50.20 C ATOM 1227 SG CYS A 71 5.862 8.865 -0.029 1.00 5.15 S ATOM 0 H CYS A 71 4.788 6.117 2.713 1.00 23.23 H new ATOM 0 HA CYS A 71 3.291 8.231 1.437 1.00 15.45 H new ATOM 0 HB2 CYS A 71 5.236 6.570 -0.235 1.00 50.20 H new ATOM 0 HB3 CYS A 71 4.001 7.633 -0.878 1.00 50.20 H new ATOM 0 HG CYS A 71 5.801 9.475 1.117 1.00 5.15 H new ATOM 1233 N VAL A 72 1.612 6.396 0.827 1.00 32.05 N ATOM 1234 CA VAL A 72 0.643 5.380 0.354 1.00 42.42 C ATOM 1235 C VAL A 72 -0.116 5.974 -0.827 1.00 23.32 C ATOM 1236 O VAL A 72 -0.839 6.959 -0.671 1.00 70.51 O ATOM 1237 CB VAL A 72 -0.392 4.907 1.442 1.00 30.21 C ATOM 1238 CG1 VAL A 72 -1.422 3.912 0.842 1.00 20.10 C ATOM 1239 CG2 VAL A 72 0.335 4.271 2.633 1.00 1.20 C ATOM 0 H VAL A 72 1.208 7.327 0.932 1.00 32.05 H new ATOM 0 HA VAL A 72 1.217 4.493 0.084 1.00 42.42 H new ATOM 0 HB VAL A 72 -0.936 5.784 1.792 1.00 30.21 H new ATOM 0 HG11 VAL A 72 -2.123 3.603 1.617 1.00 20.10 H new ATOM 0 HG12 VAL A 72 -1.967 4.397 0.032 1.00 20.10 H new ATOM 0 HG13 VAL A 72 -0.900 3.037 0.455 1.00 20.10 H new ATOM 0 HG21 VAL A 72 -0.395 3.950 3.376 1.00 1.20 H new ATOM 0 HG22 VAL A 72 0.908 3.409 2.291 1.00 1.20 H new ATOM 0 HG23 VAL A 72 1.009 5.001 3.080 1.00 1.20 H new ATOM 1249 N GLU A 73 0.040 5.351 -1.995 1.00 1.20 N ATOM 1250 CA GLU A 73 -0.508 5.868 -3.244 1.00 54.35 C ATOM 1251 C GLU A 73 -0.946 4.698 -4.128 1.00 44.42 C ATOM 1252 O GLU A 73 -0.524 3.563 -3.906 1.00 52.10 O ATOM 1253 CB GLU A 73 0.566 6.749 -3.944 1.00 42.42 C ATOM 1254 CG GLU A 73 0.030 7.644 -5.074 1.00 75.35 C ATOM 1255 CD GLU A 73 -1.110 8.571 -4.620 1.00 34.32 C ATOM 1256 OE1 GLU A 73 -0.854 9.476 -3.798 1.00 54.44 O ATOM 1257 OE2 GLU A 73 -2.260 8.396 -5.084 1.00 11.24 O ATOM 0 H GLU A 73 0.550 4.474 -2.100 1.00 1.20 H new ATOM 0 HA GLU A 73 -1.383 6.488 -3.052 1.00 54.35 H new ATOM 0 HB2 GLU A 73 1.042 7.381 -3.194 1.00 42.42 H new ATOM 0 HB3 GLU A 73 1.340 6.099 -4.351 1.00 42.42 H new ATOM 0 HG2 GLU A 73 0.847 8.249 -5.469 1.00 75.35 H new ATOM 0 HG3 GLU A 73 -0.325 7.015 -5.890 1.00 75.35 H new ATOM 1264 N ILE A 74 -1.815 4.984 -5.106 1.00 31.35 N ATOM 1265 CA ILE A 74 -2.184 4.015 -6.153 1.00 64.41 C ATOM 1266 C ILE A 74 -0.980 3.770 -7.095 1.00 65.25 C ATOM 1267 O ILE A 74 -0.072 4.611 -7.180 1.00 24.54 O ATOM 1268 CB ILE A 74 -3.487 4.485 -6.934 1.00 62.21 C ATOM 1269 CG1 ILE A 74 -3.413 5.976 -7.440 1.00 60.21 C ATOM 1270 CG2 ILE A 74 -4.733 4.287 -6.044 1.00 51.40 C ATOM 1271 CD1 ILE A 74 -2.610 6.212 -8.710 1.00 75.22 C ATOM 0 H ILE A 74 -2.281 5.887 -5.196 1.00 31.35 H new ATOM 0 HA ILE A 74 -2.434 3.062 -5.687 1.00 64.41 H new ATOM 0 HB ILE A 74 -3.558 3.862 -7.825 1.00 62.21 H new ATOM 0 HG12 ILE A 74 -4.429 6.333 -7.605 1.00 60.21 H new ATOM 0 HG13 ILE A 74 -2.986 6.587 -6.645 1.00 60.21 H new ATOM 0 HG21 ILE A 74 -5.622 4.611 -6.585 1.00 51.40 H new ATOM 0 HG22 ILE A 74 -4.831 3.233 -5.784 1.00 51.40 H new ATOM 0 HG23 ILE A 74 -4.627 4.877 -5.134 1.00 51.40 H new ATOM 0 HD11 ILE A 74 -2.630 7.272 -8.961 1.00 75.22 H new ATOM 0 HD12 ILE A 74 -1.579 5.895 -8.553 1.00 75.22 H new ATOM 0 HD13 ILE A 74 -3.045 5.637 -9.528 1.00 75.22 H new ATOM 1283 N VAL A 75 -0.962 2.615 -7.783 1.00 22.12 N ATOM 1284 CA VAL A 75 0.141 2.259 -8.701 1.00 63.02 C ATOM 1285 C VAL A 75 -0.253 2.648 -10.141 1.00 61.13 C ATOM 1286 O VAL A 75 -1.171 2.049 -10.716 1.00 14.20 O ATOM 1287 CB VAL A 75 0.495 0.718 -8.633 1.00 53.02 C ATOM 1288 CG1 VAL A 75 1.684 0.366 -9.565 1.00 4.34 C ATOM 1289 CG2 VAL A 75 0.783 0.285 -7.175 1.00 15.35 C ATOM 0 H VAL A 75 -1.697 1.911 -7.723 1.00 22.12 H new ATOM 0 HA VAL A 75 1.030 2.809 -8.393 1.00 63.02 H new ATOM 0 HB VAL A 75 -0.373 0.162 -8.988 1.00 53.02 H new ATOM 0 HG11 VAL A 75 1.900 -0.700 -9.493 1.00 4.34 H new ATOM 0 HG12 VAL A 75 1.426 0.615 -10.594 1.00 4.34 H new ATOM 0 HG13 VAL A 75 2.563 0.935 -9.264 1.00 4.34 H new ATOM 0 HG21 VAL A 75 1.024 -0.778 -7.152 1.00 15.35 H new ATOM 0 HG22 VAL A 75 1.625 0.857 -6.785 1.00 15.35 H new ATOM 0 HG23 VAL A 75 -0.097 0.471 -6.560 1.00 15.35 H new ATOM 1299 N LYS A 76 0.420 3.672 -10.696 1.00 3.42 N ATOM 1300 CA LYS A 76 0.220 4.106 -12.089 1.00 40.44 C ATOM 1301 C LYS A 76 1.142 3.283 -12.997 1.00 34.01 C ATOM 1302 O LYS A 76 2.336 3.570 -13.099 1.00 31.33 O ATOM 1303 CB LYS A 76 0.556 5.615 -12.244 1.00 42.44 C ATOM 1304 CG LYS A 76 -0.292 6.572 -11.385 1.00 45.15 C ATOM 1305 CD LYS A 76 0.167 8.047 -11.510 1.00 71.15 C ATOM 1306 CE LYS A 76 -0.001 8.612 -12.928 1.00 21.11 C ATOM 1307 NZ LYS A 76 0.664 9.933 -13.080 1.00 61.41 N ATOM 0 H LYS A 76 1.117 4.221 -10.192 1.00 3.42 H new ATOM 0 HA LYS A 76 -0.823 3.953 -12.367 1.00 40.44 H new ATOM 0 HB2 LYS A 76 1.606 5.764 -11.994 1.00 42.44 H new ATOM 0 HB3 LYS A 76 0.436 5.891 -13.292 1.00 42.44 H new ATOM 0 HG2 LYS A 76 -1.337 6.494 -11.684 1.00 45.15 H new ATOM 0 HG3 LYS A 76 -0.235 6.265 -10.341 1.00 45.15 H new ATOM 0 HD2 LYS A 76 -0.403 8.659 -10.811 1.00 71.15 H new ATOM 0 HD3 LYS A 76 1.214 8.121 -11.217 1.00 71.15 H new ATOM 0 HE2 LYS A 76 0.416 7.910 -13.650 1.00 21.11 H new ATOM 0 HE3 LYS A 76 -1.062 8.711 -13.156 1.00 21.11 H new ATOM 0 HZ1 LYS A 76 0.889 10.095 -14.082 1.00 61.41 H new ATOM 0 HZ2 LYS A 76 0.027 10.683 -12.743 1.00 61.41 H new ATOM 0 HZ3 LYS A 76 1.541 9.946 -12.521 1.00 61.41 H new ATOM 1382 N ILE A 82 -2.272 -6.155 -15.200 1.00 11.03 N ATOM 1383 CA ILE A 82 -1.709 -6.400 -13.864 1.00 34.05 C ATOM 1384 C ILE A 82 -1.621 -7.920 -13.642 1.00 1.30 C ATOM 1385 O ILE A 82 -2.610 -8.607 -13.894 1.00 22.50 O ATOM 1386 CB ILE A 82 -2.606 -5.702 -12.762 1.00 1.13 C ATOM 1387 CG1 ILE A 82 -2.633 -4.148 -12.976 1.00 13.33 C ATOM 1388 CG2 ILE A 82 -2.157 -6.058 -11.330 1.00 71.22 C ATOM 1389 CD1 ILE A 82 -1.266 -3.441 -12.944 1.00 54.14 C ATOM 0 HA ILE A 82 -0.709 -5.974 -13.787 1.00 34.05 H new ATOM 0 HB ILE A 82 -3.619 -6.086 -12.878 1.00 1.13 H new ATOM 0 HG12 ILE A 82 -3.105 -3.941 -13.937 1.00 13.33 H new ATOM 0 HG13 ILE A 82 -3.267 -3.706 -12.208 1.00 13.33 H new ATOM 0 HG21 ILE A 82 -2.803 -5.555 -10.610 1.00 71.22 H new ATOM 0 HG22 ILE A 82 -2.223 -7.136 -11.185 1.00 71.22 H new ATOM 0 HG23 ILE A 82 -1.127 -5.735 -11.181 1.00 71.22 H new ATOM 0 HD11 ILE A 82 -1.406 -2.372 -13.103 1.00 54.14 H new ATOM 0 HD12 ILE A 82 -0.794 -3.606 -11.975 1.00 54.14 H new ATOM 0 HD13 ILE A 82 -0.629 -3.844 -13.731 1.00 54.14 H new ATOM 1401 N PRO A 83 -0.438 -8.469 -13.187 1.00 11.43 N ATOM 1402 CA PRO A 83 -0.235 -9.932 -13.000 1.00 73.30 C ATOM 1403 C PRO A 83 -0.901 -10.471 -11.704 1.00 15.23 C ATOM 1404 O PRO A 83 -0.235 -11.043 -10.835 1.00 14.00 O ATOM 1405 CB PRO A 83 1.314 -10.049 -12.964 1.00 53.11 C ATOM 1406 CG PRO A 83 1.785 -8.760 -12.369 1.00 41.40 C ATOM 1407 CD PRO A 83 0.799 -7.704 -12.831 1.00 74.40 C ATOM 0 HA PRO A 83 -0.697 -10.532 -13.784 1.00 73.30 H new ATOM 0 HB2 PRO A 83 1.632 -10.901 -12.363 1.00 53.11 H new ATOM 0 HB3 PRO A 83 1.722 -10.195 -13.964 1.00 53.11 H new ATOM 0 HG2 PRO A 83 1.813 -8.819 -11.281 1.00 41.40 H new ATOM 0 HG3 PRO A 83 2.796 -8.523 -12.701 1.00 41.40 H new ATOM 0 HD2 PRO A 83 0.602 -6.976 -12.045 1.00 74.40 H new ATOM 0 HD3 PRO A 83 1.183 -7.151 -13.688 1.00 74.40 H new ATOM 1415 N CYS A 84 -2.227 -10.322 -11.619 1.00 33.24 N ATOM 1416 CA CYS A 84 -3.035 -10.764 -10.477 1.00 21.14 C ATOM 1417 C CYS A 84 -4.519 -10.671 -10.856 1.00 35.11 C ATOM 1418 O CYS A 84 -4.901 -9.810 -11.658 1.00 45.25 O ATOM 1419 CB CYS A 84 -2.749 -9.903 -9.227 1.00 0.34 C ATOM 1420 SG CYS A 84 -3.664 -10.417 -7.760 1.00 13.45 S ATOM 0 H CYS A 84 -2.779 -9.883 -12.356 1.00 33.24 H new ATOM 0 HA CYS A 84 -2.776 -11.795 -10.235 1.00 21.14 H new ATOM 0 HB2 CYS A 84 -1.682 -9.940 -9.009 1.00 0.34 H new ATOM 0 HB3 CYS A 84 -2.993 -8.864 -9.450 1.00 0.34 H new ATOM 0 HG CYS A 84 -3.359 -9.640 -6.764 1.00 13.45 H new ATOM 1426 N GLN A 85 -5.342 -11.573 -10.287 1.00 14.33 N ATOM 1427 CA GLN A 85 -6.821 -11.528 -10.414 1.00 54.55 C ATOM 1428 C GLN A 85 -7.368 -10.239 -9.764 1.00 0.02 C ATOM 1429 O GLN A 85 -8.346 -9.650 -10.234 1.00 22.33 O ATOM 1430 CB GLN A 85 -7.461 -12.798 -9.774 1.00 4.11 C ATOM 1431 CG GLN A 85 -7.034 -13.075 -8.317 1.00 21.30 C ATOM 1432 CD GLN A 85 -7.681 -14.319 -7.694 1.00 14.45 C ATOM 1433 OE1 GLN A 85 -8.814 -14.672 -8.011 1.00 2.54 O ATOM 1434 NE2 GLN A 85 -6.965 -15.000 -6.818 1.00 2.34 N ATOM 0 H GLN A 85 -5.005 -12.355 -9.725 1.00 14.33 H new ATOM 0 HA GLN A 85 -7.087 -11.517 -11.471 1.00 54.55 H new ATOM 0 HB2 GLN A 85 -8.546 -12.696 -9.807 1.00 4.11 H new ATOM 0 HB3 GLN A 85 -7.203 -13.664 -10.384 1.00 4.11 H new ATOM 0 HG2 GLN A 85 -5.950 -13.188 -8.284 1.00 21.30 H new ATOM 0 HG3 GLN A 85 -7.282 -12.207 -7.707 1.00 21.30 H new ATOM 0 HE21 GLN A 85 -6.026 -14.686 -6.572 1.00 2.34 H new ATOM 0 HE22 GLN A 85 -7.351 -15.841 -6.388 1.00 2.34 H new ATOM 1443 N ASN A 86 -6.703 -9.820 -8.682 1.00 25.30 N ATOM 1444 CA ASN A 86 -6.949 -8.537 -8.022 1.00 12.42 C ATOM 1445 C ASN A 86 -6.205 -7.426 -8.783 1.00 61.33 C ATOM 1446 O ASN A 86 -4.982 -7.285 -8.649 1.00 31.15 O ATOM 1447 CB ASN A 86 -6.474 -8.592 -6.548 1.00 71.44 C ATOM 1448 CG ASN A 86 -7.334 -9.473 -5.642 1.00 33.31 C ATOM 1449 OD1 ASN A 86 -7.941 -10.445 -6.084 1.00 55.24 O ATOM 1450 ND2 ASN A 86 -7.374 -9.149 -4.354 1.00 61.34 N ATOM 0 H ASN A 86 -5.970 -10.371 -8.236 1.00 25.30 H new ATOM 0 HA ASN A 86 -8.018 -8.325 -8.028 1.00 12.42 H new ATOM 0 HB2 ASN A 86 -5.448 -8.958 -6.523 1.00 71.44 H new ATOM 0 HB3 ASN A 86 -6.461 -7.579 -6.145 1.00 71.44 H new ATOM 0 HD21 ASN A 86 -7.919 -9.714 -3.703 1.00 61.34 H new ATOM 0 HD22 ASN A 86 -6.859 -8.336 -4.016 1.00 61.34 H new ATOM 1457 N LYS A 87 -6.946 -6.680 -9.614 1.00 74.44 N ATOM 1458 CA LYS A 87 -6.405 -5.525 -10.353 1.00 54.34 C ATOM 1459 C LYS A 87 -6.679 -4.224 -9.588 1.00 31.32 C ATOM 1460 O LYS A 87 -7.453 -4.214 -8.621 1.00 4.41 O ATOM 1461 CB LYS A 87 -6.996 -5.458 -11.784 1.00 72.32 C ATOM 1462 CG LYS A 87 -6.620 -6.662 -12.675 1.00 25.42 C ATOM 1463 CD LYS A 87 -7.036 -6.452 -14.145 1.00 2.54 C ATOM 1464 CE LYS A 87 -6.298 -5.271 -14.804 1.00 75.24 C ATOM 1465 NZ LYS A 87 -6.845 -4.954 -16.145 1.00 4.15 N ATOM 0 H LYS A 87 -7.934 -6.857 -9.794 1.00 74.44 H new ATOM 0 HA LYS A 87 -5.326 -5.651 -10.442 1.00 54.34 H new ATOM 0 HB2 LYS A 87 -8.082 -5.395 -11.715 1.00 72.32 H new ATOM 0 HB3 LYS A 87 -6.653 -4.542 -12.265 1.00 72.32 H new ATOM 0 HG2 LYS A 87 -5.544 -6.827 -12.624 1.00 25.42 H new ATOM 0 HG3 LYS A 87 -7.099 -7.561 -12.289 1.00 25.42 H new ATOM 0 HD2 LYS A 87 -6.835 -7.362 -14.710 1.00 2.54 H new ATOM 0 HD3 LYS A 87 -8.111 -6.277 -14.194 1.00 2.54 H new ATOM 0 HE2 LYS A 87 -6.375 -4.392 -14.164 1.00 75.24 H new ATOM 0 HE3 LYS A 87 -5.238 -5.509 -14.892 1.00 75.24 H new ATOM 0 HZ1 LYS A 87 -6.321 -4.154 -16.553 1.00 4.15 H new ATOM 0 HZ2 LYS A 87 -6.748 -5.784 -16.764 1.00 4.15 H new ATOM 0 HZ3 LYS A 87 -7.850 -4.701 -16.059 1.00 4.15 H new ATOM 1479 N TYR A 88 -6.061 -3.136 -10.077 1.00 61.02 N ATOM 1480 CA TYR A 88 -6.003 -1.835 -9.391 1.00 73.34 C ATOM 1481 C TYR A 88 -5.292 -1.994 -8.022 1.00 31.31 C ATOM 1482 O TYR A 88 -5.943 -2.038 -6.961 1.00 2.31 O ATOM 1483 CB TYR A 88 -7.407 -1.164 -9.264 1.00 43.32 C ATOM 1484 CG TYR A 88 -8.089 -0.858 -10.618 1.00 53.11 C ATOM 1485 CD1 TYR A 88 -7.840 0.337 -11.305 1.00 13.21 C ATOM 1486 CD2 TYR A 88 -8.986 -1.761 -11.205 1.00 33.21 C ATOM 1487 CE1 TYR A 88 -8.454 0.617 -12.514 1.00 10.13 C ATOM 1488 CE2 TYR A 88 -9.600 -1.478 -12.415 1.00 42.03 C ATOM 1489 CZ TYR A 88 -9.331 -0.289 -13.064 1.00 4.24 C ATOM 1490 OH TYR A 88 -9.941 -0.004 -14.273 1.00 40.25 O ATOM 0 H TYR A 88 -5.579 -3.136 -10.976 1.00 61.02 H new ATOM 0 HA TYR A 88 -5.414 -1.152 -10.002 1.00 73.34 H new ATOM 0 HB2 TYR A 88 -8.058 -1.816 -8.682 1.00 43.32 H new ATOM 0 HB3 TYR A 88 -7.304 -0.235 -8.704 1.00 43.32 H new ATOM 0 HD1 TYR A 88 -7.154 1.056 -10.882 1.00 13.21 H new ATOM 0 HD2 TYR A 88 -9.203 -2.694 -10.706 1.00 33.21 H new ATOM 0 HE1 TYR A 88 -8.245 1.545 -13.025 1.00 10.13 H new ATOM 0 HE2 TYR A 88 -10.289 -2.187 -12.850 1.00 42.03 H new ATOM 0 HH TYR A 88 -10.530 -0.745 -14.525 1.00 40.25 H new ATOM 1500 N PRO A 89 -3.930 -2.172 -8.031 1.00 54.03 N ATOM 1501 CA PRO A 89 -3.148 -2.275 -6.798 1.00 25.10 C ATOM 1502 C PRO A 89 -2.747 -0.899 -6.236 1.00 12.14 C ATOM 1503 O PRO A 89 -2.620 0.094 -6.969 1.00 21.11 O ATOM 1504 CB PRO A 89 -1.910 -3.078 -7.244 1.00 73.35 C ATOM 1505 CG PRO A 89 -1.689 -2.689 -8.672 1.00 51.12 C ATOM 1506 CD PRO A 89 -3.055 -2.335 -9.238 1.00 33.31 C ATOM 0 HA PRO A 89 -3.707 -2.743 -5.988 1.00 25.10 H new ATOM 0 HB2 PRO A 89 -1.042 -2.837 -6.631 1.00 73.35 H new ATOM 0 HB3 PRO A 89 -2.080 -4.150 -7.149 1.00 73.35 H new ATOM 0 HG2 PRO A 89 -1.008 -1.841 -8.742 1.00 51.12 H new ATOM 0 HG3 PRO A 89 -1.237 -3.508 -9.232 1.00 51.12 H new ATOM 0 HD2 PRO A 89 -3.016 -1.418 -9.826 1.00 33.31 H new ATOM 0 HD3 PRO A 89 -3.428 -3.120 -9.896 1.00 33.31 H new ATOM 1514 N PHE A 90 -2.553 -0.854 -4.925 1.00 64.12 N ATOM 1515 CA PHE A 90 -1.965 0.296 -4.241 1.00 21.11 C ATOM 1516 C PHE A 90 -0.673 -0.152 -3.559 1.00 61.13 C ATOM 1517 O PHE A 90 -0.509 -1.331 -3.233 1.00 25.14 O ATOM 1518 CB PHE A 90 -2.954 0.920 -3.227 1.00 75.12 C ATOM 1519 CG PHE A 90 -3.419 0.002 -2.078 1.00 30.03 C ATOM 1520 CD1 PHE A 90 -4.419 -0.954 -2.280 1.00 1.31 C ATOM 1521 CD2 PHE A 90 -2.873 0.116 -0.793 1.00 42.14 C ATOM 1522 CE1 PHE A 90 -4.857 -1.762 -1.245 1.00 53.51 C ATOM 1523 CE2 PHE A 90 -3.311 -0.698 0.239 1.00 30.21 C ATOM 1524 CZ PHE A 90 -4.302 -1.634 0.012 1.00 21.22 C ATOM 0 H PHE A 90 -2.801 -1.620 -4.298 1.00 64.12 H new ATOM 0 HA PHE A 90 -1.740 1.075 -4.970 1.00 21.11 H new ATOM 0 HB2 PHE A 90 -2.487 1.804 -2.792 1.00 75.12 H new ATOM 0 HB3 PHE A 90 -3.835 1.260 -3.772 1.00 75.12 H new ATOM 0 HD1 PHE A 90 -4.857 -1.064 -3.261 1.00 1.31 H new ATOM 0 HD2 PHE A 90 -2.101 0.847 -0.604 1.00 42.14 H new ATOM 0 HE1 PHE A 90 -5.633 -2.492 -1.421 1.00 53.51 H new ATOM 0 HE2 PHE A 90 -2.877 -0.601 1.223 1.00 30.21 H new ATOM 0 HZ PHE A 90 -4.642 -2.266 0.819 1.00 21.22 H new ATOM 1534 N GLN A 91 0.230 0.797 -3.354 1.00 1.43 N ATOM 1535 CA GLN A 91 1.548 0.554 -2.771 1.00 42.33 C ATOM 1536 C GLN A 91 1.674 1.279 -1.432 1.00 10.41 C ATOM 1537 O GLN A 91 1.225 2.425 -1.278 1.00 3.21 O ATOM 1538 CB GLN A 91 2.649 0.998 -3.763 1.00 64.30 C ATOM 1539 CG GLN A 91 2.499 2.426 -4.332 1.00 4.23 C ATOM 1540 CD GLN A 91 3.519 2.760 -5.422 1.00 0.11 C ATOM 1541 OE1 GLN A 91 4.664 2.301 -5.392 1.00 34.33 O ATOM 1542 NE2 GLN A 91 3.095 3.529 -6.418 1.00 0.21 N ATOM 0 H GLN A 91 0.067 1.776 -3.591 1.00 1.43 H new ATOM 0 HA GLN A 91 1.672 -0.512 -2.583 1.00 42.33 H new ATOM 0 HB2 GLN A 91 3.615 0.925 -3.262 1.00 64.30 H new ATOM 0 HB3 GLN A 91 2.668 0.295 -4.596 1.00 64.30 H new ATOM 0 HG2 GLN A 91 1.494 2.543 -4.738 1.00 4.23 H new ATOM 0 HG3 GLN A 91 2.600 3.145 -3.519 1.00 4.23 H new ATOM 0 HE21 GLN A 91 2.142 3.892 -6.412 1.00 0.21 H new ATOM 0 HE22 GLN A 91 3.722 3.757 -7.189 1.00 0.21 H new ATOM 1551 N VAL A 92 2.279 0.584 -0.470 1.00 75.24 N ATOM 1552 CA VAL A 92 2.575 1.113 0.849 1.00 43.11 C ATOM 1553 C VAL A 92 4.096 1.248 0.923 1.00 51.10 C ATOM 1554 O VAL A 92 4.818 0.261 1.134 1.00 4.12 O ATOM 1555 CB VAL A 92 2.027 0.166 1.980 1.00 25.33 C ATOM 1556 CG1 VAL A 92 2.406 0.684 3.384 1.00 73.12 C ATOM 1557 CG2 VAL A 92 0.494 -0.020 1.845 1.00 42.15 C ATOM 0 H VAL A 92 2.581 -0.382 -0.594 1.00 75.24 H new ATOM 0 HA VAL A 92 2.089 2.076 1.004 1.00 43.11 H new ATOM 0 HB VAL A 92 2.498 -0.809 1.856 1.00 25.33 H new ATOM 0 HG11 VAL A 92 2.011 0.006 4.141 1.00 73.12 H new ATOM 0 HG12 VAL A 92 3.491 0.735 3.472 1.00 73.12 H new ATOM 0 HG13 VAL A 92 1.983 1.678 3.532 1.00 73.12 H new ATOM 0 HG21 VAL A 92 0.136 -0.678 2.637 1.00 42.15 H new ATOM 0 HG22 VAL A 92 0.001 0.949 1.928 1.00 42.15 H new ATOM 0 HG23 VAL A 92 0.265 -0.462 0.875 1.00 42.15 H new ATOM 1567 N VAL A 93 4.577 2.474 0.710 1.00 50.54 N ATOM 1568 CA VAL A 93 6.006 2.770 0.667 1.00 41.14 C ATOM 1569 C VAL A 93 6.454 3.118 2.087 1.00 54.41 C ATOM 1570 O VAL A 93 6.216 4.236 2.562 1.00 13.13 O ATOM 1571 CB VAL A 93 6.328 3.963 -0.315 1.00 62.44 C ATOM 1572 CG1 VAL A 93 7.855 4.121 -0.517 1.00 31.04 C ATOM 1573 CG2 VAL A 93 5.589 3.802 -1.666 1.00 12.10 C ATOM 0 H VAL A 93 3.983 3.290 0.562 1.00 50.54 H new ATOM 0 HA VAL A 93 6.544 1.899 0.292 1.00 41.14 H new ATOM 0 HB VAL A 93 5.959 4.879 0.146 1.00 62.44 H new ATOM 0 HG11 VAL A 93 8.048 4.950 -1.198 1.00 31.04 H new ATOM 0 HG12 VAL A 93 8.330 4.322 0.443 1.00 31.04 H new ATOM 0 HG13 VAL A 93 8.263 3.203 -0.939 1.00 31.04 H new ATOM 0 HG21 VAL A 93 5.834 4.641 -2.317 1.00 12.10 H new ATOM 0 HG22 VAL A 93 5.899 2.871 -2.141 1.00 12.10 H new ATOM 0 HG23 VAL A 93 4.513 3.780 -1.492 1.00 12.10 H new ATOM 1583 N HIS A 94 7.044 2.136 2.774 1.00 54.31 N ATOM 1584 CA HIS A 94 7.616 2.310 4.118 1.00 73.52 C ATOM 1585 C HIS A 94 9.143 2.218 4.014 1.00 31.24 C ATOM 1586 O HIS A 94 9.676 1.713 3.016 1.00 60.14 O ATOM 1587 CB HIS A 94 7.032 1.276 5.122 1.00 45.21 C ATOM 1588 CG HIS A 94 7.204 -0.179 4.744 1.00 22.51 C ATOM 1589 ND1 HIS A 94 8.102 -1.017 5.367 1.00 65.34 N ATOM 1590 CD2 HIS A 94 6.578 -0.939 3.807 1.00 14.12 C ATOM 1591 CE1 HIS A 94 8.015 -2.222 4.841 1.00 10.22 C ATOM 1592 NE2 HIS A 94 7.103 -2.208 3.892 1.00 41.33 N ATOM 0 H HIS A 94 7.140 1.187 2.412 1.00 54.31 H new ATOM 0 HA HIS A 94 7.347 3.291 4.509 1.00 73.52 H new ATOM 0 HB2 HIS A 94 7.500 1.437 6.093 1.00 45.21 H new ATOM 0 HB3 HIS A 94 5.968 1.477 5.243 1.00 45.21 H new ATOM 0 HD2 HIS A 94 5.811 -0.608 3.123 1.00 14.12 H new ATOM 0 HE1 HIS A 94 8.597 -3.081 5.140 1.00 10.22 H new ATOM 0 HE2 HIS A 94 6.831 -3.005 3.316 1.00 41.33 H new ATOM 1601 N ASP A 95 9.838 2.679 5.057 1.00 22.24 N ATOM 1602 CA ASP A 95 11.289 2.960 5.001 1.00 51.21 C ATOM 1603 C ASP A 95 12.158 1.684 4.867 1.00 71.02 C ATOM 1604 O ASP A 95 13.332 1.771 4.514 1.00 44.35 O ATOM 1605 CB ASP A 95 11.688 3.810 6.237 1.00 52.51 C ATOM 1606 CG ASP A 95 13.066 4.479 6.097 1.00 24.23 C ATOM 1607 OD1 ASP A 95 13.231 5.316 5.177 1.00 71.31 O ATOM 1608 OD2 ASP A 95 13.979 4.177 6.893 1.00 42.12 O ATOM 0 H ASP A 95 9.418 2.870 5.967 1.00 22.24 H new ATOM 0 HA ASP A 95 11.488 3.527 4.091 1.00 51.21 H new ATOM 0 HB2 ASP A 95 10.933 4.579 6.399 1.00 52.51 H new ATOM 0 HB3 ASP A 95 11.689 3.173 7.122 1.00 52.51 H new ATOM 1613 N ALA A 96 11.575 0.503 5.127 1.00 50.20 N ATOM 1614 CA ALA A 96 12.269 -0.783 4.922 1.00 24.31 C ATOM 1615 C ALA A 96 12.302 -1.149 3.422 1.00 33.41 C ATOM 1616 O ALA A 96 13.363 -1.464 2.870 1.00 73.11 O ATOM 1617 CB ALA A 96 11.597 -1.884 5.753 1.00 20.13 C ATOM 0 H ALA A 96 10.623 0.410 5.480 1.00 50.20 H new ATOM 0 HA ALA A 96 13.301 -0.686 5.260 1.00 24.31 H new ATOM 0 HB1 ALA A 96 12.117 -2.829 5.594 1.00 20.13 H new ATOM 0 HB2 ALA A 96 11.640 -1.620 6.810 1.00 20.13 H new ATOM 0 HB3 ALA A 96 10.556 -1.987 5.446 1.00 20.13 H new ATOM 1623 N ASN A 97 11.126 -1.084 2.779 1.00 33.22 N ATOM 1624 CA ASN A 97 10.952 -1.387 1.334 1.00 42.03 C ATOM 1625 C ASN A 97 9.535 -0.989 0.893 1.00 53.12 C ATOM 1626 O ASN A 97 8.702 -0.620 1.725 1.00 24.31 O ATOM 1627 CB ASN A 97 11.223 -2.901 1.008 1.00 51.22 C ATOM 1628 CG ASN A 97 10.238 -3.896 1.656 1.00 42.13 C ATOM 1629 OD1 ASN A 97 9.706 -3.657 2.738 1.00 54.44 O ATOM 1630 ND2 ASN A 97 9.997 -5.028 1.003 1.00 52.41 N ATOM 0 H ASN A 97 10.257 -0.819 3.243 1.00 33.22 H new ATOM 0 HA ASN A 97 11.688 -0.805 0.779 1.00 42.03 H new ATOM 0 HB2 ASN A 97 11.192 -3.035 -0.073 1.00 51.22 H new ATOM 0 HB3 ASN A 97 12.233 -3.151 1.331 1.00 51.22 H new ATOM 0 HD21 ASN A 97 9.360 -5.719 1.398 1.00 52.41 H new ATOM 0 HD22 ASN A 97 10.449 -5.206 0.106 1.00 52.41 H new ATOM 1637 N THR A 98 9.265 -1.067 -0.415 1.00 43.52 N ATOM 1638 CA THR A 98 7.945 -0.741 -0.978 1.00 55.04 C ATOM 1639 C THR A 98 7.090 -2.022 -1.102 1.00 21.32 C ATOM 1640 O THR A 98 7.439 -2.947 -1.849 1.00 70.31 O ATOM 1641 CB THR A 98 8.090 -0.047 -2.374 1.00 20.04 C ATOM 1642 OG1 THR A 98 8.984 1.079 -2.265 1.00 23.01 O ATOM 1643 CG2 THR A 98 6.731 0.434 -2.928 1.00 52.32 C ATOM 0 H THR A 98 9.951 -1.356 -1.113 1.00 43.52 H new ATOM 0 HA THR A 98 7.446 -0.046 -0.303 1.00 55.04 H new ATOM 0 HB THR A 98 8.492 -0.786 -3.067 1.00 20.04 H new ATOM 0 HG1 THR A 98 9.505 1.164 -3.090 1.00 23.01 H new ATOM 0 HG21 THR A 98 6.881 0.909 -3.898 1.00 52.32 H new ATOM 0 HG22 THR A 98 6.062 -0.419 -3.041 1.00 52.32 H new ATOM 0 HG23 THR A 98 6.290 1.152 -2.237 1.00 52.32 H new ATOM 1651 N LEU A 99 5.982 -2.071 -0.338 1.00 32.30 N ATOM 1652 CA LEU A 99 5.017 -3.188 -0.382 1.00 73.30 C ATOM 1653 C LEU A 99 3.957 -2.905 -1.465 1.00 61.45 C ATOM 1654 O LEU A 99 3.600 -1.749 -1.690 1.00 0.14 O ATOM 1655 CB LEU A 99 4.340 -3.373 1.011 1.00 25.31 C ATOM 1656 CG LEU A 99 3.298 -4.537 1.126 1.00 4.32 C ATOM 1657 CD1 LEU A 99 3.949 -5.925 0.877 1.00 14.00 C ATOM 1658 CD2 LEU A 99 2.557 -4.493 2.489 1.00 41.41 C ATOM 0 H LEU A 99 5.730 -1.339 0.326 1.00 32.30 H new ATOM 0 HA LEU A 99 5.543 -4.110 -0.629 1.00 73.30 H new ATOM 0 HB2 LEU A 99 5.122 -3.539 1.752 1.00 25.31 H new ATOM 0 HB3 LEU A 99 3.842 -2.440 1.276 1.00 25.31 H new ATOM 0 HG LEU A 99 2.558 -4.388 0.340 1.00 4.32 H new ATOM 0 HD11 LEU A 99 3.191 -6.704 0.966 1.00 14.00 H new ATOM 0 HD12 LEU A 99 4.379 -5.951 -0.124 1.00 14.00 H new ATOM 0 HD13 LEU A 99 4.734 -6.096 1.614 1.00 14.00 H new ATOM 0 HD21 LEU A 99 1.840 -5.313 2.540 1.00 41.41 H new ATOM 0 HD22 LEU A 99 3.279 -4.592 3.299 1.00 41.41 H new ATOM 0 HD23 LEU A 99 2.030 -3.544 2.586 1.00 41.41 H new ATOM 1670 N TYR A 100 3.470 -3.961 -2.135 1.00 40.24 N ATOM 1671 CA TYR A 100 2.407 -3.857 -3.153 1.00 72.32 C ATOM 1672 C TYR A 100 1.236 -4.758 -2.769 1.00 72.21 C ATOM 1673 O TYR A 100 1.376 -5.983 -2.673 1.00 43.05 O ATOM 1674 CB TYR A 100 2.945 -4.214 -4.557 1.00 43.40 C ATOM 1675 CG TYR A 100 3.865 -3.122 -5.105 1.00 33.02 C ATOM 1676 CD1 TYR A 100 3.338 -2.025 -5.783 1.00 72.01 C ATOM 1677 CD2 TYR A 100 5.249 -3.160 -4.907 1.00 64.35 C ATOM 1678 CE1 TYR A 100 4.142 -1.003 -6.225 1.00 33.14 C ATOM 1679 CE2 TYR A 100 6.053 -2.139 -5.357 1.00 11.53 C ATOM 1680 CZ TYR A 100 5.492 -1.068 -6.020 1.00 34.51 C ATOM 1681 OH TYR A 100 6.290 -0.043 -6.458 1.00 72.43 O ATOM 0 H TYR A 100 3.802 -4.914 -1.987 1.00 40.24 H new ATOM 0 HA TYR A 100 2.058 -2.825 -3.191 1.00 72.32 H new ATOM 0 HB2 TYR A 100 3.489 -5.158 -4.509 1.00 43.40 H new ATOM 0 HB3 TYR A 100 2.109 -4.362 -5.240 1.00 43.40 H new ATOM 0 HD1 TYR A 100 2.275 -1.977 -5.965 1.00 72.01 H new ATOM 0 HD2 TYR A 100 5.692 -4.001 -4.395 1.00 64.35 H new ATOM 0 HE1 TYR A 100 3.710 -0.153 -6.732 1.00 33.14 H new ATOM 0 HE2 TYR A 100 7.120 -2.176 -5.192 1.00 11.53 H new ATOM 0 HH TYR A 100 5.898 0.814 -6.190 1.00 72.43 H new ATOM 1691 N ILE A 101 0.094 -4.113 -2.523 1.00 10.34 N ATOM 1692 CA ILE A 101 -1.145 -4.771 -2.109 1.00 1.15 C ATOM 1693 C ILE A 101 -2.200 -4.605 -3.228 1.00 63.40 C ATOM 1694 O ILE A 101 -2.610 -3.486 -3.548 1.00 63.50 O ATOM 1695 CB ILE A 101 -1.683 -4.157 -0.767 1.00 54.13 C ATOM 1696 CG1 ILE A 101 -0.563 -4.074 0.320 1.00 34.34 C ATOM 1697 CG2 ILE A 101 -2.879 -4.980 -0.247 1.00 13.01 C ATOM 1698 CD1 ILE A 101 -0.992 -3.417 1.623 1.00 23.30 C ATOM 0 H ILE A 101 0.004 -3.101 -2.608 1.00 10.34 H new ATOM 0 HA ILE A 101 -0.947 -5.829 -1.939 1.00 1.15 H new ATOM 0 HB ILE A 101 -2.014 -3.140 -0.975 1.00 54.13 H new ATOM 0 HG12 ILE A 101 -0.209 -5.082 0.536 1.00 34.34 H new ATOM 0 HG13 ILE A 101 0.282 -3.521 -0.090 1.00 34.34 H new ATOM 0 HG21 ILE A 101 -3.243 -4.545 0.684 1.00 13.01 H new ATOM 0 HG22 ILE A 101 -3.677 -4.970 -0.989 1.00 13.01 H new ATOM 0 HG23 ILE A 101 -2.563 -6.008 -0.068 1.00 13.01 H new ATOM 0 HD11 ILE A 101 -0.152 -3.403 2.317 1.00 23.30 H new ATOM 0 HD12 ILE A 101 -1.317 -2.395 1.426 1.00 23.30 H new ATOM 0 HD13 ILE A 101 -1.815 -3.981 2.061 1.00 23.30 H new ATOM 1710 N PHE A 102 -2.612 -5.732 -3.808 1.00 21.13 N ATOM 1711 CA PHE A 102 -3.552 -5.810 -4.937 1.00 43.25 C ATOM 1712 C PHE A 102 -4.975 -5.996 -4.392 1.00 71.32 C ATOM 1713 O PHE A 102 -5.259 -6.988 -3.709 1.00 34.42 O ATOM 1714 CB PHE A 102 -3.136 -7.000 -5.856 1.00 22.51 C ATOM 1715 CG PHE A 102 -1.730 -6.851 -6.471 1.00 11.43 C ATOM 1716 CD1 PHE A 102 -0.586 -6.858 -5.667 1.00 11.41 C ATOM 1717 CD2 PHE A 102 -1.557 -6.659 -7.837 1.00 51.33 C ATOM 1718 CE1 PHE A 102 0.670 -6.693 -6.214 1.00 75.43 C ATOM 1719 CE2 PHE A 102 -0.293 -6.492 -8.382 1.00 13.14 C ATOM 1720 CZ PHE A 102 0.817 -6.501 -7.569 1.00 73.33 C ATOM 0 H PHE A 102 -2.292 -6.650 -3.498 1.00 21.13 H new ATOM 0 HA PHE A 102 -3.528 -4.893 -5.526 1.00 43.25 H new ATOM 0 HB2 PHE A 102 -3.173 -7.923 -5.278 1.00 22.51 H new ATOM 0 HB3 PHE A 102 -3.865 -7.098 -6.660 1.00 22.51 H new ATOM 0 HD1 PHE A 102 -0.687 -6.995 -4.600 1.00 11.41 H new ATOM 0 HD2 PHE A 102 -2.421 -6.640 -8.484 1.00 51.33 H new ATOM 0 HE1 PHE A 102 1.541 -6.715 -5.576 1.00 75.43 H new ATOM 0 HE2 PHE A 102 -0.179 -6.355 -9.447 1.00 13.14 H new ATOM 0 HZ PHE A 102 1.800 -6.358 -7.993 1.00 73.33 H new ATOM 1730 N ALA A 103 -5.863 -5.038 -4.685 1.00 22.34 N ATOM 1731 CA ALA A 103 -7.233 -5.025 -4.145 1.00 24.41 C ATOM 1732 C ALA A 103 -8.202 -5.761 -5.089 1.00 70.21 C ATOM 1733 O ALA A 103 -8.064 -5.643 -6.305 1.00 63.45 O ATOM 1734 CB ALA A 103 -7.691 -3.574 -3.931 1.00 54.34 C ATOM 0 H ALA A 103 -5.656 -4.252 -5.301 1.00 22.34 H new ATOM 0 HA ALA A 103 -7.236 -5.546 -3.188 1.00 24.41 H new ATOM 0 HB1 ALA A 103 -8.705 -3.568 -3.531 1.00 54.34 H new ATOM 0 HB2 ALA A 103 -7.021 -3.081 -3.227 1.00 54.34 H new ATOM 0 HB3 ALA A 103 -7.673 -3.043 -4.883 1.00 54.34 H new ATOM 1740 N PRO A 104 -9.221 -6.516 -4.550 1.00 24.20 N ATOM 1741 CA PRO A 104 -10.257 -7.193 -5.377 1.00 54.23 C ATOM 1742 C PRO A 104 -11.392 -6.224 -5.766 1.00 21.51 C ATOM 1743 O PRO A 104 -12.418 -6.639 -6.303 1.00 63.24 O ATOM 1744 CB PRO A 104 -10.765 -8.303 -4.420 1.00 63.23 C ATOM 1745 CG PRO A 104 -10.679 -7.678 -3.065 1.00 70.02 C ATOM 1746 CD PRO A 104 -9.458 -6.770 -3.096 1.00 14.44 C ATOM 0 HA PRO A 104 -9.878 -7.572 -6.326 1.00 54.23 H new ATOM 0 HB2 PRO A 104 -11.786 -8.600 -4.659 1.00 63.23 H new ATOM 0 HB3 PRO A 104 -10.149 -9.200 -4.486 1.00 63.23 H new ATOM 0 HG2 PRO A 104 -11.582 -7.110 -2.840 1.00 70.02 H new ATOM 0 HG3 PRO A 104 -10.580 -8.439 -2.291 1.00 70.02 H new ATOM 0 HD2 PRO A 104 -9.639 -5.841 -2.555 1.00 14.44 H new ATOM 0 HD3 PRO A 104 -8.596 -7.247 -2.630 1.00 14.44 H new ATOM 1754 N SER A 105 -11.177 -4.935 -5.480 1.00 3.34 N ATOM 1755 CA SER A 105 -12.162 -3.885 -5.646 1.00 74.32 C ATOM 1756 C SER A 105 -11.418 -2.533 -5.750 1.00 12.24 C ATOM 1757 O SER A 105 -10.749 -2.137 -4.787 1.00 62.44 O ATOM 1758 CB SER A 105 -13.133 -3.902 -4.438 1.00 65.53 C ATOM 1759 OG SER A 105 -14.041 -2.826 -4.476 1.00 3.43 O ATOM 0 H SER A 105 -10.286 -4.595 -5.118 1.00 3.34 H new ATOM 0 HA SER A 105 -12.748 -4.037 -6.553 1.00 74.32 H new ATOM 0 HB2 SER A 105 -13.685 -4.842 -4.430 1.00 65.53 H new ATOM 0 HB3 SER A 105 -12.560 -3.860 -3.512 1.00 65.53 H new ATOM 0 HG SER A 105 -14.637 -2.873 -3.699 1.00 3.43 H new ATOM 1765 N PRO A 106 -11.489 -1.827 -6.931 1.00 4.40 N ATOM 1766 CA PRO A 106 -10.867 -0.484 -7.131 1.00 41.30 C ATOM 1767 C PRO A 106 -11.338 0.586 -6.115 1.00 62.54 C ATOM 1768 O PRO A 106 -10.601 1.543 -5.841 1.00 20.43 O ATOM 1769 CB PRO A 106 -11.277 -0.097 -8.583 1.00 72.21 C ATOM 1770 CG PRO A 106 -12.398 -1.023 -8.939 1.00 51.15 C ATOM 1771 CD PRO A 106 -12.127 -2.302 -8.190 1.00 73.41 C ATOM 0 HA PRO A 106 -9.789 -0.528 -6.975 1.00 41.30 H new ATOM 0 HB2 PRO A 106 -11.595 0.944 -8.637 1.00 72.21 H new ATOM 0 HB3 PRO A 106 -10.440 -0.211 -9.271 1.00 72.21 H new ATOM 0 HG2 PRO A 106 -13.361 -0.599 -8.654 1.00 51.15 H new ATOM 0 HG3 PRO A 106 -12.433 -1.199 -10.014 1.00 51.15 H new ATOM 0 HD2 PRO A 106 -13.045 -2.856 -7.993 1.00 73.41 H new ATOM 0 HD3 PRO A 106 -11.468 -2.966 -8.750 1.00 73.41 H new ATOM 1779 N GLN A 107 -12.536 0.392 -5.524 1.00 52.12 N ATOM 1780 CA GLN A 107 -13.117 1.358 -4.562 1.00 54.11 C ATOM 1781 C GLN A 107 -12.583 1.063 -3.148 1.00 3.20 C ATOM 1782 O GLN A 107 -12.384 1.984 -2.349 1.00 51.34 O ATOM 1783 CB GLN A 107 -14.674 1.343 -4.597 1.00 63.45 C ATOM 1784 CG GLN A 107 -15.325 0.004 -4.217 1.00 71.33 C ATOM 1785 CD GLN A 107 -16.855 0.024 -4.297 1.00 44.40 C ATOM 1786 OE1 GLN A 107 -17.536 0.312 -3.312 1.00 23.03 O ATOM 1787 NE2 GLN A 107 -17.401 -0.262 -5.471 1.00 33.23 N ATOM 0 H GLN A 107 -13.122 -0.425 -5.695 1.00 52.12 H new ATOM 0 HA GLN A 107 -12.810 2.363 -4.852 1.00 54.11 H new ATOM 0 HB2 GLN A 107 -15.044 2.113 -3.920 1.00 63.45 H new ATOM 0 HB3 GLN A 107 -15.001 1.616 -5.600 1.00 63.45 H new ATOM 0 HG2 GLN A 107 -14.945 -0.776 -4.877 1.00 71.33 H new ATOM 0 HG3 GLN A 107 -15.025 -0.262 -3.203 1.00 71.33 H new ATOM 0 HE21 GLN A 107 -16.807 -0.496 -6.266 1.00 33.23 H new ATOM 0 HE22 GLN A 107 -18.415 -0.248 -5.579 1.00 33.23 H new ATOM 1796 N SER A 108 -12.332 -0.242 -2.863 1.00 12.21 N ATOM 1797 CA SER A 108 -11.709 -0.680 -1.601 1.00 65.24 C ATOM 1798 C SER A 108 -10.288 -0.116 -1.530 1.00 11.00 C ATOM 1799 O SER A 108 -9.922 0.514 -0.539 1.00 42.23 O ATOM 1800 CB SER A 108 -11.690 -2.224 -1.492 1.00 55.43 C ATOM 1801 OG SER A 108 -11.147 -2.656 -0.254 1.00 24.54 O ATOM 0 H SER A 108 -12.556 -1.007 -3.499 1.00 12.21 H new ATOM 0 HA SER A 108 -12.296 -0.304 -0.763 1.00 65.24 H new ATOM 0 HB2 SER A 108 -12.704 -2.609 -1.599 1.00 55.43 H new ATOM 0 HB3 SER A 108 -11.104 -2.640 -2.311 1.00 55.43 H new ATOM 0 HG SER A 108 -11.859 -3.040 0.299 1.00 24.54 H new ATOM 1807 N ARG A 109 -9.522 -0.343 -2.628 1.00 34.04 N ATOM 1808 CA ARG A 109 -8.193 0.260 -2.866 1.00 31.31 C ATOM 1809 C ARG A 109 -8.186 1.755 -2.517 1.00 23.51 C ATOM 1810 O ARG A 109 -7.355 2.209 -1.738 1.00 24.13 O ATOM 1811 CB ARG A 109 -7.805 0.088 -4.366 1.00 14.24 C ATOM 1812 CG ARG A 109 -6.539 0.869 -4.824 1.00 32.11 C ATOM 1813 CD ARG A 109 -6.520 1.101 -6.346 1.00 41.22 C ATOM 1814 NE ARG A 109 -7.744 1.780 -6.818 1.00 74.25 N ATOM 1815 CZ ARG A 109 -7.895 2.376 -8.010 1.00 54.41 C ATOM 1816 NH1 ARG A 109 -6.898 2.420 -8.891 1.00 52.43 N ATOM 1817 NH2 ARG A 109 -9.066 2.910 -8.322 1.00 61.10 N ATOM 0 H ARG A 109 -9.819 -0.961 -3.383 1.00 34.04 H new ATOM 0 HA ARG A 109 -7.473 -0.249 -2.225 1.00 31.31 H new ATOM 0 HB2 ARG A 109 -7.648 -0.972 -4.563 1.00 14.24 H new ATOM 0 HB3 ARG A 109 -8.648 0.405 -4.980 1.00 14.24 H new ATOM 0 HG2 ARG A 109 -6.501 1.830 -4.311 1.00 32.11 H new ATOM 0 HG3 ARG A 109 -5.647 0.316 -4.531 1.00 32.11 H new ATOM 0 HD2 ARG A 109 -5.648 1.700 -6.611 1.00 41.22 H new ATOM 0 HD3 ARG A 109 -6.416 0.144 -6.857 1.00 41.22 H new ATOM 0 HE ARG A 109 -8.542 1.797 -6.183 1.00 74.25 H new ATOM 0 HH11 ARG A 109 -5.999 1.995 -8.665 1.00 52.43 H new ATOM 0 HH12 ARG A 109 -7.034 2.878 -9.792 1.00 52.43 H new ATOM 0 HH21 ARG A 109 -9.840 2.865 -7.659 1.00 61.10 H new ATOM 0 HH22 ARG A 109 -9.194 3.366 -9.225 1.00 61.10 H new ATOM 1831 N ASP A 110 -9.148 2.483 -3.112 1.00 14.14 N ATOM 1832 CA ASP A 110 -9.284 3.945 -2.972 1.00 23.24 C ATOM 1833 C ASP A 110 -9.427 4.357 -1.496 1.00 62.13 C ATOM 1834 O ASP A 110 -8.814 5.344 -1.047 1.00 24.11 O ATOM 1835 CB ASP A 110 -10.494 4.435 -3.808 1.00 0.45 C ATOM 1836 CG ASP A 110 -10.740 5.952 -3.701 1.00 72.33 C ATOM 1837 OD1 ASP A 110 -9.981 6.732 -4.312 1.00 15.44 O ATOM 1838 OD2 ASP A 110 -11.678 6.367 -2.990 1.00 45.13 O ATOM 0 H ASP A 110 -9.862 2.068 -3.711 1.00 14.14 H new ATOM 0 HA ASP A 110 -8.377 4.418 -3.349 1.00 23.24 H new ATOM 0 HB2 ASP A 110 -10.333 4.174 -4.854 1.00 0.45 H new ATOM 0 HB3 ASP A 110 -11.389 3.906 -3.482 1.00 0.45 H new ATOM 1843 N LEU A 111 -10.225 3.576 -0.755 1.00 21.24 N ATOM 1844 CA LEU A 111 -10.462 3.806 0.676 1.00 32.44 C ATOM 1845 C LEU A 111 -9.178 3.559 1.489 1.00 44.40 C ATOM 1846 O LEU A 111 -8.848 4.353 2.361 1.00 23.13 O ATOM 1847 CB LEU A 111 -11.625 2.917 1.205 1.00 33.45 C ATOM 1848 CG LEU A 111 -12.133 3.247 2.651 1.00 44.53 C ATOM 1849 CD1 LEU A 111 -12.689 4.693 2.747 1.00 5.43 C ATOM 1850 CD2 LEU A 111 -13.183 2.215 3.126 1.00 5.31 C ATOM 0 H LEU A 111 -10.723 2.769 -1.130 1.00 21.24 H new ATOM 0 HA LEU A 111 -10.753 4.849 0.801 1.00 32.44 H new ATOM 0 HB2 LEU A 111 -12.466 3.004 0.516 1.00 33.45 H new ATOM 0 HB3 LEU A 111 -11.301 1.877 1.183 1.00 33.45 H new ATOM 0 HG LEU A 111 -11.274 3.182 3.318 1.00 44.53 H new ATOM 0 HD11 LEU A 111 -13.031 4.884 3.764 1.00 5.43 H new ATOM 0 HD12 LEU A 111 -11.903 5.403 2.489 1.00 5.43 H new ATOM 0 HD13 LEU A 111 -13.524 4.809 2.055 1.00 5.43 H new ATOM 0 HD21 LEU A 111 -13.516 2.471 4.132 1.00 5.31 H new ATOM 0 HD22 LEU A 111 -14.036 2.226 2.448 1.00 5.31 H new ATOM 0 HD23 LEU A 111 -12.738 1.220 3.133 1.00 5.31 H new ATOM 1862 N TRP A 112 -8.460 2.461 1.180 1.00 52.10 N ATOM 1863 CA TRP A 112 -7.185 2.113 1.847 1.00 24.03 C ATOM 1864 C TRP A 112 -6.124 3.213 1.660 1.00 15.14 C ATOM 1865 O TRP A 112 -5.490 3.626 2.630 1.00 64.31 O ATOM 1866 CB TRP A 112 -6.634 0.754 1.331 1.00 2.14 C ATOM 1867 CG TRP A 112 -7.296 -0.465 1.933 1.00 51.14 C ATOM 1868 CD1 TRP A 112 -8.310 -1.212 1.409 1.00 50.02 C ATOM 1869 CD2 TRP A 112 -6.952 -1.087 3.179 1.00 31.55 C ATOM 1870 NE1 TRP A 112 -8.638 -2.229 2.259 1.00 33.34 N ATOM 1871 CE2 TRP A 112 -7.815 -2.179 3.353 1.00 33.41 C ATOM 1872 CE3 TRP A 112 -6.001 -0.816 4.166 1.00 24.33 C ATOM 1873 CZ2 TRP A 112 -7.758 -3.004 4.473 1.00 33.44 C ATOM 1874 CZ3 TRP A 112 -5.944 -1.636 5.271 1.00 70.41 C ATOM 1875 CH2 TRP A 112 -6.816 -2.720 5.419 1.00 4.41 C ATOM 0 H TRP A 112 -8.744 1.792 0.465 1.00 52.10 H new ATOM 0 HA TRP A 112 -7.400 2.024 2.912 1.00 24.03 H new ATOM 0 HB2 TRP A 112 -6.752 0.717 0.248 1.00 2.14 H new ATOM 0 HB3 TRP A 112 -5.565 0.709 1.537 1.00 2.14 H new ATOM 0 HD1 TRP A 112 -8.786 -1.026 0.457 1.00 50.02 H new ATOM 0 HE1 TRP A 112 -9.377 -2.915 2.104 1.00 33.34 H new ATOM 0 HE3 TRP A 112 -5.324 0.020 4.064 1.00 24.33 H new ATOM 0 HZ2 TRP A 112 -8.434 -3.838 4.589 1.00 33.44 H new ATOM 0 HZ3 TRP A 112 -5.211 -1.438 6.039 1.00 70.41 H new ATOM 0 HH2 TRP A 112 -6.742 -3.343 6.298 1.00 4.41 H new ATOM 1886 N VAL A 113 -5.950 3.678 0.408 1.00 12.20 N ATOM 1887 CA VAL A 113 -4.957 4.716 0.058 1.00 72.44 C ATOM 1888 C VAL A 113 -5.211 5.994 0.871 1.00 14.24 C ATOM 1889 O VAL A 113 -4.288 6.565 1.469 1.00 25.44 O ATOM 1890 CB VAL A 113 -4.985 5.043 -1.484 1.00 53.44 C ATOM 1891 CG1 VAL A 113 -4.008 6.179 -1.862 1.00 13.44 C ATOM 1892 CG2 VAL A 113 -4.689 3.789 -2.321 1.00 12.12 C ATOM 0 H VAL A 113 -6.492 3.346 -0.390 1.00 12.20 H new ATOM 0 HA VAL A 113 -3.969 4.326 0.303 1.00 72.44 H new ATOM 0 HB VAL A 113 -5.994 5.388 -1.710 1.00 53.44 H new ATOM 0 HG11 VAL A 113 -4.065 6.366 -2.934 1.00 13.44 H new ATOM 0 HG12 VAL A 113 -4.277 7.086 -1.321 1.00 13.44 H new ATOM 0 HG13 VAL A 113 -2.991 5.887 -1.598 1.00 13.44 H new ATOM 0 HG21 VAL A 113 -4.715 4.044 -3.380 1.00 12.12 H new ATOM 0 HG22 VAL A 113 -3.702 3.405 -2.064 1.00 12.12 H new ATOM 0 HG23 VAL A 113 -5.440 3.027 -2.113 1.00 12.12 H new ATOM 1902 N LYS A 114 -6.485 6.401 0.888 1.00 70.03 N ATOM 1903 CA LYS A 114 -6.959 7.592 1.597 1.00 3.32 C ATOM 1904 C LYS A 114 -6.764 7.468 3.122 1.00 43.15 C ATOM 1905 O LYS A 114 -6.163 8.347 3.731 1.00 34.53 O ATOM 1906 CB LYS A 114 -8.445 7.835 1.228 1.00 5.22 C ATOM 1907 CG LYS A 114 -9.128 8.992 1.988 1.00 74.02 C ATOM 1908 CD LYS A 114 -10.570 9.253 1.497 1.00 23.24 C ATOM 1909 CE LYS A 114 -11.461 8.004 1.541 1.00 3.53 C ATOM 1910 NZ LYS A 114 -12.832 8.296 1.059 1.00 63.11 N ATOM 0 H LYS A 114 -7.228 5.902 0.400 1.00 70.03 H new ATOM 0 HA LYS A 114 -6.366 8.452 1.286 1.00 3.32 H new ATOM 0 HB2 LYS A 114 -8.509 8.035 0.159 1.00 5.22 H new ATOM 0 HB3 LYS A 114 -9.004 6.918 1.415 1.00 5.22 H new ATOM 0 HG2 LYS A 114 -9.146 8.762 3.053 1.00 74.02 H new ATOM 0 HG3 LYS A 114 -8.537 9.900 1.868 1.00 74.02 H new ATOM 0 HD2 LYS A 114 -11.020 10.034 2.111 1.00 23.24 H new ATOM 0 HD3 LYS A 114 -10.536 9.631 0.475 1.00 23.24 H new ATOM 0 HE2 LYS A 114 -11.019 7.219 0.928 1.00 3.53 H new ATOM 0 HE3 LYS A 114 -11.506 7.624 2.562 1.00 3.53 H new ATOM 0 HZ1 LYS A 114 -13.407 7.430 1.102 1.00 63.11 H new ATOM 0 HZ2 LYS A 114 -13.263 9.028 1.659 1.00 63.11 H new ATOM 0 HZ3 LYS A 114 -12.790 8.635 0.077 1.00 63.11 H new ATOM 1924 N LYS A 115 -7.268 6.372 3.722 1.00 52.31 N ATOM 1925 CA LYS A 115 -7.185 6.142 5.185 1.00 64.42 C ATOM 1926 C LYS A 115 -5.726 6.182 5.683 1.00 21.22 C ATOM 1927 O LYS A 115 -5.405 6.923 6.622 1.00 52.22 O ATOM 1928 CB LYS A 115 -7.853 4.793 5.593 1.00 61.33 C ATOM 1929 CG LYS A 115 -9.394 4.744 5.438 1.00 13.13 C ATOM 1930 CD LYS A 115 -10.120 5.800 6.305 1.00 3.34 C ATOM 1931 CE LYS A 115 -11.653 5.732 6.174 1.00 13.53 C ATOM 1932 NZ LYS A 115 -12.335 6.754 7.015 1.00 41.04 N ATOM 0 H LYS A 115 -7.741 5.624 3.215 1.00 52.31 H new ATOM 0 HA LYS A 115 -7.733 6.954 5.662 1.00 64.42 H new ATOM 0 HB2 LYS A 115 -7.418 3.995 4.992 1.00 61.33 H new ATOM 0 HB3 LYS A 115 -7.602 4.582 6.632 1.00 61.33 H new ATOM 0 HG2 LYS A 115 -9.654 4.900 4.391 1.00 13.13 H new ATOM 0 HG3 LYS A 115 -9.750 3.750 5.710 1.00 13.13 H new ATOM 0 HD2 LYS A 115 -9.843 5.658 7.350 1.00 3.34 H new ATOM 0 HD3 LYS A 115 -9.780 6.795 6.018 1.00 3.34 H new ATOM 0 HE2 LYS A 115 -11.934 5.876 5.131 1.00 13.53 H new ATOM 0 HE3 LYS A 115 -11.997 4.739 6.462 1.00 13.53 H new ATOM 0 HZ1 LYS A 115 -13.365 6.671 6.895 1.00 41.04 H new ATOM 0 HZ2 LYS A 115 -12.089 6.602 8.014 1.00 41.04 H new ATOM 0 HZ3 LYS A 115 -12.028 7.704 6.724 1.00 41.04 H new ATOM 1946 N LEU A 116 -4.863 5.401 5.016 1.00 1.51 N ATOM 1947 CA LEU A 116 -3.437 5.274 5.356 1.00 62.12 C ATOM 1948 C LEU A 116 -2.704 6.633 5.262 1.00 64.40 C ATOM 1949 O LEU A 116 -1.984 7.009 6.198 1.00 2.22 O ATOM 1950 CB LEU A 116 -2.774 4.204 4.435 1.00 2.32 C ATOM 1951 CG LEU A 116 -3.124 2.703 4.742 1.00 34.33 C ATOM 1952 CD1 LEU A 116 -2.682 1.759 3.590 1.00 71.51 C ATOM 1953 CD2 LEU A 116 -2.483 2.266 6.078 1.00 55.35 C ATOM 0 H LEU A 116 -5.139 4.833 4.215 1.00 1.51 H new ATOM 0 HA LEU A 116 -3.355 4.947 6.392 1.00 62.12 H new ATOM 0 HB2 LEU A 116 -3.058 4.417 3.405 1.00 2.32 H new ATOM 0 HB3 LEU A 116 -1.692 4.322 4.498 1.00 2.32 H new ATOM 0 HG LEU A 116 -4.208 2.627 4.827 1.00 34.33 H new ATOM 0 HD11 LEU A 116 -2.942 0.731 3.842 1.00 71.51 H new ATOM 0 HD12 LEU A 116 -3.189 2.046 2.669 1.00 71.51 H new ATOM 0 HD13 LEU A 116 -1.604 1.836 3.450 1.00 71.51 H new ATOM 0 HD21 LEU A 116 -2.734 1.224 6.278 1.00 55.35 H new ATOM 0 HD22 LEU A 116 -1.400 2.373 6.014 1.00 55.35 H new ATOM 0 HD23 LEU A 116 -2.862 2.892 6.886 1.00 55.35 H new ATOM 1965 N LYS A 117 -2.879 7.368 4.136 1.00 43.42 N ATOM 1966 CA LYS A 117 -2.224 8.688 3.962 1.00 4.03 C ATOM 1967 C LYS A 117 -2.739 9.742 4.968 1.00 13.33 C ATOM 1968 O LYS A 117 -1.965 10.591 5.411 1.00 53.35 O ATOM 1969 CB LYS A 117 -2.292 9.213 2.498 1.00 43.32 C ATOM 1970 CG LYS A 117 -3.670 9.691 1.993 1.00 21.10 C ATOM 1971 CD LYS A 117 -3.598 10.340 0.580 1.00 11.32 C ATOM 1972 CE LYS A 117 -2.924 9.425 -0.463 1.00 2.10 C ATOM 1973 NZ LYS A 117 -2.920 10.012 -1.832 1.00 51.31 N ATOM 0 H LYS A 117 -3.457 7.076 3.348 1.00 43.42 H new ATOM 0 HA LYS A 117 -1.170 8.521 4.184 1.00 4.03 H new ATOM 0 HB2 LYS A 117 -1.589 10.040 2.401 1.00 43.32 H new ATOM 0 HB3 LYS A 117 -1.944 8.420 1.836 1.00 43.32 H new ATOM 0 HG2 LYS A 117 -4.356 8.845 1.965 1.00 21.10 H new ATOM 0 HG3 LYS A 117 -4.082 10.412 2.699 1.00 21.10 H new ATOM 0 HD2 LYS A 117 -4.606 10.584 0.245 1.00 11.32 H new ATOM 0 HD3 LYS A 117 -3.047 11.278 0.644 1.00 11.32 H new ATOM 0 HE2 LYS A 117 -1.897 9.226 -0.155 1.00 2.10 H new ATOM 0 HE3 LYS A 117 -3.441 8.466 -0.486 1.00 2.10 H new ATOM 0 HZ1 LYS A 117 -2.223 9.514 -2.421 1.00 51.31 H new ATOM 0 HZ2 LYS A 117 -3.865 9.913 -2.255 1.00 51.31 H new ATOM 0 HZ3 LYS A 117 -2.669 11.020 -1.777 1.00 51.31 H new ATOM 1987 N GLU A 118 -4.031 9.669 5.341 1.00 13.42 N ATOM 1988 CA GLU A 118 -4.621 10.573 6.358 1.00 70.01 C ATOM 1989 C GLU A 118 -4.142 10.248 7.789 1.00 73.52 C ATOM 1990 O GLU A 118 -4.312 11.074 8.689 1.00 14.25 O ATOM 1991 CB GLU A 118 -6.171 10.565 6.263 1.00 64.51 C ATOM 1992 CG GLU A 118 -6.737 11.171 4.953 1.00 53.14 C ATOM 1993 CD GLU A 118 -6.479 12.684 4.802 1.00 33.21 C ATOM 1994 OE1 GLU A 118 -5.427 13.081 4.254 1.00 65.02 O ATOM 1995 OE2 GLU A 118 -7.336 13.495 5.240 1.00 50.45 O ATOM 0 H GLU A 118 -4.690 8.993 4.955 1.00 13.42 H new ATOM 0 HA GLU A 118 -4.267 11.580 6.138 1.00 70.01 H new ATOM 0 HB2 GLU A 118 -6.523 9.537 6.355 1.00 64.51 H new ATOM 0 HB3 GLU A 118 -6.577 11.118 7.110 1.00 64.51 H new ATOM 0 HG2 GLU A 118 -6.296 10.651 4.103 1.00 53.14 H new ATOM 0 HG3 GLU A 118 -7.811 10.990 4.915 1.00 53.14 H new ATOM 2002 N GLU A 119 -3.564 9.055 7.998 1.00 13.02 N ATOM 2003 CA GLU A 119 -2.916 8.706 9.281 1.00 0.12 C ATOM 2004 C GLU A 119 -1.483 9.259 9.326 1.00 65.34 C ATOM 2005 O GLU A 119 -1.058 9.837 10.337 1.00 42.13 O ATOM 2006 CB GLU A 119 -2.918 7.168 9.511 1.00 22.21 C ATOM 2007 CG GLU A 119 -4.321 6.538 9.636 1.00 13.31 C ATOM 2008 CD GLU A 119 -5.206 7.217 10.700 1.00 10.41 C ATOM 2009 OE1 GLU A 119 -5.010 6.951 11.901 1.00 33.35 O ATOM 2010 OE2 GLU A 119 -6.096 8.029 10.340 1.00 34.05 O ATOM 0 H GLU A 119 -3.530 8.313 7.298 1.00 13.02 H new ATOM 0 HA GLU A 119 -3.491 9.164 10.086 1.00 0.12 H new ATOM 0 HB2 GLU A 119 -2.392 6.690 8.685 1.00 22.21 H new ATOM 0 HB3 GLU A 119 -2.354 6.949 10.418 1.00 22.21 H new ATOM 0 HG2 GLU A 119 -4.822 6.592 8.670 1.00 13.31 H new ATOM 0 HG3 GLU A 119 -4.216 5.481 9.882 1.00 13.31 H new ATOM 2017 N ILE A 120 -0.758 9.105 8.207 1.00 42.43 N ATOM 2018 CA ILE A 120 0.670 9.471 8.122 1.00 41.24 C ATOM 2019 C ILE A 120 0.875 10.960 7.745 1.00 11.44 C ATOM 2020 O ILE A 120 2.006 11.439 7.739 1.00 61.53 O ATOM 2021 CB ILE A 120 1.448 8.530 7.114 1.00 3.43 C ATOM 2022 CG1 ILE A 120 0.982 8.756 5.639 1.00 44.52 C ATOM 2023 CG2 ILE A 120 1.281 7.044 7.517 1.00 62.32 C ATOM 2024 CD1 ILE A 120 1.693 7.910 4.587 1.00 22.22 C ATOM 0 H ILE A 120 -1.139 8.726 7.340 1.00 42.43 H new ATOM 0 HA ILE A 120 1.086 9.327 9.119 1.00 41.24 H new ATOM 0 HB ILE A 120 2.505 8.790 7.169 1.00 3.43 H new ATOM 0 HG12 ILE A 120 -0.088 8.554 5.580 1.00 44.52 H new ATOM 0 HG13 ILE A 120 1.122 9.808 5.389 1.00 44.52 H new ATOM 0 HG21 ILE A 120 1.823 6.413 6.812 1.00 62.32 H new ATOM 0 HG22 ILE A 120 1.679 6.892 8.520 1.00 62.32 H new ATOM 0 HG23 ILE A 120 0.224 6.780 7.502 1.00 62.32 H new ATOM 0 HD11 ILE A 120 1.294 8.145 3.600 1.00 22.22 H new ATOM 0 HD12 ILE A 120 2.761 8.126 4.607 1.00 22.22 H new ATOM 0 HD13 ILE A 120 1.532 6.853 4.801 1.00 22.22 H new ATOM 2036 N LYS A 121 -0.223 11.694 7.461 1.00 25.05 N ATOM 2037 CA LYS A 121 -0.158 13.133 7.075 1.00 11.23 C ATOM 2038 C LYS A 121 0.371 14.042 8.212 1.00 44.44 C ATOM 2039 O LYS A 121 0.803 15.168 7.953 1.00 11.52 O ATOM 2040 CB LYS A 121 -1.553 13.632 6.601 1.00 42.40 C ATOM 2041 CG LYS A 121 -2.605 13.744 7.720 1.00 22.23 C ATOM 2042 CD LYS A 121 -4.003 14.154 7.210 1.00 43.11 C ATOM 2043 CE LYS A 121 -4.043 15.515 6.511 1.00 44.54 C ATOM 2044 NZ LYS A 121 -5.394 15.804 5.957 1.00 73.24 N ATOM 0 H LYS A 121 -1.171 11.318 7.490 1.00 25.05 H new ATOM 0 HA LYS A 121 0.556 13.201 6.254 1.00 11.23 H new ATOM 0 HB2 LYS A 121 -1.435 14.609 6.131 1.00 42.40 H new ATOM 0 HB3 LYS A 121 -1.927 12.953 5.835 1.00 42.40 H new ATOM 0 HG2 LYS A 121 -2.681 12.786 8.234 1.00 22.23 H new ATOM 0 HG3 LYS A 121 -2.266 14.474 8.455 1.00 22.23 H new ATOM 0 HD2 LYS A 121 -4.362 13.392 6.518 1.00 43.11 H new ATOM 0 HD3 LYS A 121 -4.694 14.171 8.053 1.00 43.11 H new ATOM 0 HE2 LYS A 121 -3.764 16.296 7.218 1.00 44.54 H new ATOM 0 HE3 LYS A 121 -3.307 15.534 5.707 1.00 44.54 H new ATOM 0 HZ1 LYS A 121 -5.311 16.049 4.950 1.00 73.24 H new ATOM 0 HZ2 LYS A 121 -5.998 14.964 6.060 1.00 73.24 H new ATOM 0 HZ3 LYS A 121 -5.818 16.601 6.474 1.00 73.24 H new ATOM 2058 N ASN A 122 0.316 13.549 9.465 1.00 52.00 N ATOM 2059 CA ASN A 122 0.847 14.269 10.645 1.00 51.25 C ATOM 2060 C ASN A 122 2.326 13.898 10.905 1.00 11.15 C ATOM 2061 O ASN A 122 2.976 14.521 11.745 1.00 24.31 O ATOM 2062 CB ASN A 122 -0.002 13.965 11.913 1.00 65.34 C ATOM 2063 CG ASN A 122 -1.461 14.448 11.844 1.00 21.54 C ATOM 2064 OD1 ASN A 122 -2.066 14.513 10.775 1.00 21.15 O ATOM 2065 ND2 ASN A 122 -2.042 14.777 12.991 1.00 11.10 N ATOM 0 H ASN A 122 -0.096 12.643 9.690 1.00 52.00 H new ATOM 0 HA ASN A 122 0.787 15.336 10.429 1.00 51.25 H new ATOM 0 HB2 ASN A 122 0.002 12.889 12.086 1.00 65.34 H new ATOM 0 HB3 ASN A 122 0.479 14.428 12.775 1.00 65.34 H new ATOM 0 HD21 ASN A 122 -3.012 15.092 12.999 1.00 11.10 H new ATOM 0 HD22 ASN A 122 -1.519 14.714 13.864 1.00 11.10 H new ATOM 2072 N ASN A 123 2.847 12.880 10.189 1.00 1.11 N ATOM 2073 CA ASN A 123 4.257 12.437 10.328 1.00 54.12 C ATOM 2074 C ASN A 123 5.173 13.332 9.473 1.00 13.12 C ATOM 2075 O ASN A 123 4.781 13.780 8.396 1.00 62.55 O ATOM 2076 CB ASN A 123 4.436 10.950 9.912 1.00 31.12 C ATOM 2077 CG ASN A 123 3.579 9.958 10.691 1.00 5.10 C ATOM 2078 OD1 ASN A 123 3.169 10.217 11.823 1.00 60.11 O ATOM 2079 ND2 ASN A 123 3.334 8.797 10.098 1.00 54.41 N ATOM 0 H ASN A 123 2.312 12.345 9.505 1.00 1.11 H new ATOM 0 HA ASN A 123 4.532 12.525 11.379 1.00 54.12 H new ATOM 0 HB2 ASN A 123 4.204 10.854 8.851 1.00 31.12 H new ATOM 0 HB3 ASN A 123 5.484 10.677 10.035 1.00 31.12 H new ATOM 0 HD21 ASN A 123 2.789 8.083 10.581 1.00 54.41 H new ATOM 0 HD22 ASN A 123 3.690 8.619 9.159 1.00 54.41 H new ATOM 2086 N ASN A 124 6.401 13.571 9.970 1.00 52.43 N ATOM 2087 CA ASN A 124 7.434 14.407 9.294 1.00 10.24 C ATOM 2088 C ASN A 124 8.386 13.520 8.436 1.00 15.40 C ATOM 2089 O ASN A 124 9.455 13.956 8.004 1.00 25.14 O ATOM 2090 CB ASN A 124 8.209 15.220 10.395 1.00 2.32 C ATOM 2091 CG ASN A 124 9.192 16.270 9.864 1.00 72.25 C ATOM 2092 OD1 ASN A 124 9.016 16.823 8.777 1.00 44.43 O ATOM 2093 ND2 ASN A 124 10.232 16.558 10.636 1.00 22.31 N ATOM 0 H ASN A 124 6.716 13.189 10.862 1.00 52.43 H new ATOM 0 HA ASN A 124 6.964 15.108 8.604 1.00 10.24 H new ATOM 0 HB2 ASN A 124 7.481 15.719 11.035 1.00 2.32 H new ATOM 0 HB3 ASN A 124 8.757 14.518 11.023 1.00 2.32 H new ATOM 0 HD21 ASN A 124 10.913 17.255 10.335 1.00 22.31 H new ATOM 0 HD22 ASN A 124 10.350 16.083 11.531 1.00 22.31 H new ATOM 2100 N ASN A 125 7.952 12.279 8.136 1.00 13.04 N ATOM 2101 CA ASN A 125 8.763 11.292 7.379 1.00 62.44 C ATOM 2102 C ASN A 125 8.330 11.219 5.901 1.00 2.43 C ATOM 2103 O ASN A 125 8.885 10.432 5.122 1.00 65.41 O ATOM 2104 CB ASN A 125 8.659 9.882 8.036 1.00 62.31 C ATOM 2105 CG ASN A 125 7.300 9.175 7.845 1.00 3.03 C ATOM 2106 OD1 ASN A 125 6.260 9.811 7.705 1.00 64.23 O ATOM 2107 ND2 ASN A 125 7.309 7.845 7.842 1.00 54.33 N ATOM 0 H ASN A 125 7.033 11.930 8.409 1.00 13.04 H new ATOM 0 HA ASN A 125 9.800 11.625 7.411 1.00 62.44 H new ATOM 0 HB2 ASN A 125 9.444 9.247 7.625 1.00 62.31 H new ATOM 0 HB3 ASN A 125 8.855 9.979 9.104 1.00 62.31 H new ATOM 0 HD21 ASN A 125 6.437 7.329 7.721 1.00 54.33 H new ATOM 0 HD22 ASN A 125 8.188 7.341 7.960 1.00 54.33 H new ATOM 2114 N ILE A 126 7.374 12.081 5.522 1.00 31.44 N ATOM 2115 CA ILE A 126 6.676 11.986 4.233 1.00 14.10 C ATOM 2116 C ILE A 126 7.599 12.376 3.072 1.00 35.15 C ATOM 2117 O ILE A 126 8.310 13.386 3.148 1.00 11.20 O ATOM 2118 CB ILE A 126 5.384 12.895 4.203 1.00 34.54 C ATOM 2119 CG1 ILE A 126 4.375 12.446 5.307 1.00 4.51 C ATOM 2120 CG2 ILE A 126 4.709 12.898 2.799 1.00 12.44 C ATOM 2121 CD1 ILE A 126 3.886 11.007 5.165 1.00 4.22 C ATOM 0 H ILE A 126 7.064 12.862 6.100 1.00 31.44 H new ATOM 0 HA ILE A 126 6.374 10.945 4.115 1.00 14.10 H new ATOM 0 HB ILE A 126 5.695 13.919 4.411 1.00 34.54 H new ATOM 0 HG12 ILE A 126 4.847 12.562 6.283 1.00 4.51 H new ATOM 0 HG13 ILE A 126 3.513 13.113 5.288 1.00 4.51 H new ATOM 0 HG21 ILE A 126 3.825 13.535 2.822 1.00 12.44 H new ATOM 0 HG22 ILE A 126 5.412 13.279 2.058 1.00 12.44 H new ATOM 0 HG23 ILE A 126 4.418 11.882 2.533 1.00 12.44 H new ATOM 0 HD11 ILE A 126 3.190 10.778 5.972 1.00 4.22 H new ATOM 0 HD12 ILE A 126 3.382 10.887 4.206 1.00 4.22 H new ATOM 0 HD13 ILE A 126 4.736 10.327 5.216 1.00 4.22 H new ATOM 2133 N MET A 127 7.585 11.557 2.017 1.00 45.33 N ATOM 2134 CA MET A 127 8.217 11.889 0.740 1.00 41.13 C ATOM 2135 C MET A 127 7.129 12.494 -0.159 1.00 3.01 C ATOM 2136 O MET A 127 6.080 11.878 -0.364 1.00 40.44 O ATOM 2137 CB MET A 127 8.847 10.630 0.084 1.00 52.12 C ATOM 2138 CG MET A 127 9.773 9.827 1.011 1.00 14.14 C ATOM 2139 SD MET A 127 10.633 8.463 0.182 1.00 71.33 S ATOM 2140 CE MET A 127 9.269 7.549 -0.552 1.00 4.42 C ATOM 0 H MET A 127 7.133 10.643 2.026 1.00 45.33 H new ATOM 0 HA MET A 127 9.029 12.600 0.889 1.00 41.13 H new ATOM 0 HB2 MET A 127 8.046 9.977 -0.264 1.00 52.12 H new ATOM 0 HB3 MET A 127 9.412 10.938 -0.796 1.00 52.12 H new ATOM 0 HG2 MET A 127 10.512 10.501 1.443 1.00 14.14 H new ATOM 0 HG3 MET A 127 9.186 9.426 1.837 1.00 14.14 H new ATOM 0 HE1 MET A 127 9.631 6.589 -0.921 1.00 4.42 H new ATOM 0 HE2 MET A 127 8.497 7.381 0.199 1.00 4.42 H new ATOM 0 HE3 MET A 127 8.851 8.122 -1.380 1.00 4.42 H new ATOM 2150 N ILE A 128 7.386 13.707 -0.669 1.00 0.12 N ATOM 2151 CA ILE A 128 6.451 14.447 -1.549 1.00 73.23 C ATOM 2152 C ILE A 128 6.462 13.846 -2.991 1.00 2.55 C ATOM 2153 O ILE A 128 5.745 14.300 -3.885 1.00 42.51 O ATOM 2154 CB ILE A 128 6.822 15.991 -1.539 1.00 62.43 C ATOM 2155 CG1 ILE A 128 6.878 16.506 -0.059 1.00 2.31 C ATOM 2156 CG2 ILE A 128 5.832 16.850 -2.381 1.00 54.03 C ATOM 2157 CD1 ILE A 128 7.259 17.964 0.098 1.00 40.30 C ATOM 0 H ILE A 128 8.253 14.212 -0.485 1.00 0.12 H new ATOM 0 HA ILE A 128 5.433 14.344 -1.172 1.00 73.23 H new ATOM 0 HB ILE A 128 7.801 16.100 -2.005 1.00 62.43 H new ATOM 0 HG12 ILE A 128 5.902 16.349 0.401 1.00 2.31 H new ATOM 0 HG13 ILE A 128 7.593 15.898 0.495 1.00 2.31 H new ATOM 0 HG21 ILE A 128 6.133 17.897 -2.339 1.00 54.03 H new ATOM 0 HG22 ILE A 128 5.845 16.510 -3.416 1.00 54.03 H new ATOM 0 HG23 ILE A 128 4.825 16.745 -1.977 1.00 54.03 H new ATOM 0 HD11 ILE A 128 7.270 18.225 1.156 1.00 40.30 H new ATOM 0 HD12 ILE A 128 8.249 18.129 -0.327 1.00 40.30 H new ATOM 0 HD13 ILE A 128 6.532 18.588 -0.422 1.00 40.30 H new ATOM 2169 N LYS A 129 7.287 12.793 -3.193 1.00 35.40 N ATOM 2170 CA LYS A 129 7.356 12.005 -4.443 1.00 24.14 C ATOM 2171 C LYS A 129 7.294 10.493 -4.099 1.00 54.04 C ATOM 2172 O LYS A 129 7.564 10.083 -2.964 1.00 22.54 O ATOM 2173 CB LYS A 129 8.654 12.296 -5.277 1.00 35.51 C ATOM 2174 CG LYS A 129 8.683 13.595 -6.127 1.00 60.20 C ATOM 2175 CD LYS A 129 8.748 14.877 -5.281 1.00 41.15 C ATOM 2176 CE LYS A 129 9.056 16.132 -6.108 1.00 32.45 C ATOM 2177 NZ LYS A 129 7.999 16.424 -7.103 1.00 15.41 N ATOM 0 H LYS A 129 7.935 12.462 -2.478 1.00 35.40 H new ATOM 0 HA LYS A 129 6.506 12.299 -5.058 1.00 24.14 H new ATOM 0 HB2 LYS A 129 9.497 12.326 -4.587 1.00 35.51 H new ATOM 0 HB3 LYS A 129 8.820 11.452 -5.946 1.00 35.51 H new ATOM 0 HG2 LYS A 129 9.545 13.565 -6.794 1.00 60.20 H new ATOM 0 HG3 LYS A 129 7.794 13.629 -6.756 1.00 60.20 H new ATOM 0 HD2 LYS A 129 7.797 15.013 -4.766 1.00 41.15 H new ATOM 0 HD3 LYS A 129 9.512 14.759 -4.513 1.00 41.15 H new ATOM 0 HE2 LYS A 129 9.169 16.986 -5.440 1.00 32.45 H new ATOM 0 HE3 LYS A 129 10.009 16.001 -6.621 1.00 32.45 H new ATOM 0 HZ1 LYS A 129 8.252 17.280 -7.637 1.00 15.41 H new ATOM 0 HZ2 LYS A 129 7.908 15.622 -7.758 1.00 15.41 H new ATOM 0 HZ3 LYS A 129 7.094 16.576 -6.614 1.00 15.41 H new ATOM 2191 N TYR A 130 6.916 9.691 -5.102 1.00 72.22 N ATOM 2192 CA TYR A 130 6.883 8.214 -5.036 1.00 41.22 C ATOM 2193 C TYR A 130 7.227 7.655 -6.446 1.00 23.41 C ATOM 2194 O TYR A 130 7.376 8.428 -7.405 1.00 60.42 O ATOM 2195 CB TYR A 130 5.474 7.726 -4.569 1.00 25.13 C ATOM 2196 CG TYR A 130 4.382 7.847 -5.656 1.00 33.03 C ATOM 2197 CD1 TYR A 130 3.959 9.092 -6.125 1.00 4.33 C ATOM 2198 CD2 TYR A 130 3.825 6.712 -6.248 1.00 60.30 C ATOM 2199 CE1 TYR A 130 3.032 9.192 -7.137 1.00 43.41 C ATOM 2200 CE2 TYR A 130 2.895 6.816 -7.254 1.00 41.44 C ATOM 2201 CZ TYR A 130 2.507 8.053 -7.695 1.00 51.21 C ATOM 2202 OH TYR A 130 1.589 8.151 -8.698 1.00 12.11 O ATOM 0 H TYR A 130 6.616 10.054 -6.007 1.00 72.22 H new ATOM 0 HA TYR A 130 7.613 7.851 -4.312 1.00 41.22 H new ATOM 0 HB2 TYR A 130 5.546 6.685 -4.253 1.00 25.13 H new ATOM 0 HB3 TYR A 130 5.170 8.303 -3.696 1.00 25.13 H new ATOM 0 HD1 TYR A 130 4.366 9.991 -5.686 1.00 4.33 H new ATOM 0 HD2 TYR A 130 4.131 5.733 -5.909 1.00 60.30 H new ATOM 0 HE1 TYR A 130 2.719 10.163 -7.491 1.00 43.41 H new ATOM 0 HE2 TYR A 130 2.472 5.926 -7.695 1.00 41.44 H new ATOM 0 HH TYR A 130 1.319 7.253 -8.983 1.00 12.11 H new ATOM 2212 N HIS A 131 7.359 6.328 -6.565 1.00 22.14 N ATOM 2213 CA HIS A 131 7.569 5.660 -7.871 1.00 72.41 C ATOM 2214 C HIS A 131 6.228 5.124 -8.388 1.00 72.25 C ATOM 2215 O HIS A 131 5.591 4.337 -7.687 1.00 40.33 O ATOM 2216 CB HIS A 131 8.599 4.518 -7.739 1.00 51.34 C ATOM 2217 CG HIS A 131 9.969 5.024 -7.395 1.00 4.24 C ATOM 2218 ND1 HIS A 131 10.865 5.360 -8.372 1.00 41.41 N ATOM 2219 CD2 HIS A 131 10.519 5.286 -6.184 1.00 53.02 C ATOM 2220 CE1 HIS A 131 11.927 5.817 -7.748 1.00 31.41 C ATOM 2221 NE2 HIS A 131 11.765 5.792 -6.421 1.00 13.20 N ATOM 0 H HIS A 131 7.325 5.686 -5.773 1.00 22.14 H new ATOM 0 HA HIS A 131 7.964 6.383 -8.584 1.00 72.41 H new ATOM 0 HB2 HIS A 131 8.268 3.820 -6.970 1.00 51.34 H new ATOM 0 HB3 HIS A 131 8.644 3.962 -8.676 1.00 51.34 H new ATOM 0 HD1 HIS A 131 10.735 5.273 -9.380 1.00 41.41 H new ATOM 0 HD2 HIS A 131 10.061 5.126 -5.219 1.00 53.02 H new ATOM 0 HE1 HIS A 131 12.819 6.169 -8.245 1.00 31.41 H new ATOM 2229 N PRO A 132 5.771 5.550 -9.611 1.00 20.22 N ATOM 2230 CA PRO A 132 4.434 5.189 -10.143 1.00 62.30 C ATOM 2231 C PRO A 132 4.305 3.690 -10.460 1.00 74.04 C ATOM 2232 O PRO A 132 3.241 3.105 -10.274 1.00 63.53 O ATOM 2233 CB PRO A 132 4.322 6.047 -11.426 1.00 43.40 C ATOM 2234 CG PRO A 132 5.732 6.265 -11.861 1.00 44.14 C ATOM 2235 CD PRO A 132 6.531 6.391 -10.585 1.00 41.42 C ATOM 0 HA PRO A 132 3.639 5.378 -9.421 1.00 62.30 H new ATOM 0 HB2 PRO A 132 3.745 5.535 -12.196 1.00 43.40 H new ATOM 0 HB3 PRO A 132 3.818 6.993 -11.227 1.00 43.40 H new ATOM 0 HG2 PRO A 132 6.089 5.433 -12.467 1.00 44.14 H new ATOM 0 HG3 PRO A 132 5.821 7.164 -12.470 1.00 44.14 H new ATOM 0 HD2 PRO A 132 7.552 6.032 -10.714 1.00 41.42 H new ATOM 0 HD3 PRO A 132 6.597 7.427 -10.254 1.00 41.42 H new ATOM 2243 N LYS A 133 5.408 3.083 -10.927 1.00 10.13 N ATOM 2244 CA LYS A 133 5.439 1.672 -11.358 1.00 35.03 C ATOM 2245 C LYS A 133 5.762 0.758 -10.158 1.00 53.40 C ATOM 2246 O LYS A 133 5.805 1.210 -9.007 1.00 45.32 O ATOM 2247 CB LYS A 133 6.485 1.492 -12.514 1.00 44.33 C ATOM 2248 CG LYS A 133 5.993 1.843 -13.949 1.00 75.45 C ATOM 2249 CD LYS A 133 5.391 3.260 -14.055 1.00 61.14 C ATOM 2250 CE LYS A 133 4.921 3.617 -15.466 1.00 74.11 C ATOM 2251 NZ LYS A 133 6.046 3.763 -16.412 1.00 4.52 N ATOM 0 H LYS A 133 6.307 3.557 -11.017 1.00 10.13 H new ATOM 0 HA LYS A 133 4.459 1.387 -11.740 1.00 35.03 H new ATOM 0 HB2 LYS A 133 7.354 2.111 -12.289 1.00 44.33 H new ATOM 0 HB3 LYS A 133 6.823 0.456 -12.512 1.00 44.33 H new ATOM 0 HG2 LYS A 133 6.828 1.757 -14.644 1.00 75.45 H new ATOM 0 HG3 LYS A 133 5.245 1.113 -14.258 1.00 75.45 H new ATOM 0 HD2 LYS A 133 4.548 3.341 -13.368 1.00 61.14 H new ATOM 0 HD3 LYS A 133 6.136 3.988 -13.733 1.00 61.14 H new ATOM 0 HE2 LYS A 133 4.244 2.843 -15.827 1.00 74.11 H new ATOM 0 HE3 LYS A 133 4.354 4.547 -15.433 1.00 74.11 H new ATOM 0 HZ1 LYS A 133 5.679 4.022 -17.350 1.00 4.52 H new ATOM 0 HZ2 LYS A 133 6.689 4.507 -16.074 1.00 4.52 H new ATOM 0 HZ3 LYS A 133 6.563 2.863 -16.478 1.00 4.52 H new ATOM 2265 N PHE A 134 5.999 -0.527 -10.456 1.00 14.21 N ATOM 2266 CA PHE A 134 6.271 -1.558 -9.453 1.00 74.33 C ATOM 2267 C PHE A 134 7.782 -1.673 -9.206 1.00 23.44 C ATOM 2268 O PHE A 134 8.551 -1.727 -10.159 1.00 13.23 O ATOM 2269 CB PHE A 134 5.732 -2.923 -9.947 1.00 1.55 C ATOM 2270 CG PHE A 134 4.218 -3.016 -10.083 1.00 0.21 C ATOM 2271 CD1 PHE A 134 3.437 -3.326 -8.981 1.00 23.20 C ATOM 2272 CD2 PHE A 134 3.585 -2.813 -11.309 1.00 53.42 C ATOM 2273 CE1 PHE A 134 2.072 -3.433 -9.085 1.00 30.52 C ATOM 2274 CE2 PHE A 134 2.214 -2.919 -11.417 1.00 44.21 C ATOM 2275 CZ PHE A 134 1.457 -3.230 -10.304 1.00 24.43 C ATOM 0 H PHE A 134 6.007 -0.881 -11.413 1.00 14.21 H new ATOM 0 HA PHE A 134 5.775 -1.280 -8.523 1.00 74.33 H new ATOM 0 HB2 PHE A 134 6.181 -3.143 -10.915 1.00 1.55 H new ATOM 0 HB3 PHE A 134 6.066 -3.698 -9.257 1.00 1.55 H new ATOM 0 HD1 PHE A 134 3.910 -3.486 -8.024 1.00 23.20 H new ATOM 0 HD2 PHE A 134 4.173 -2.571 -12.182 1.00 53.42 H new ATOM 0 HE1 PHE A 134 1.481 -3.676 -8.215 1.00 30.52 H new ATOM 0 HE2 PHE A 134 1.733 -2.759 -12.371 1.00 44.21 H new ATOM 0 HZ PHE A 134 0.384 -3.314 -10.388 1.00 24.43 H new ATOM 2285 N TRP A 135 8.200 -1.696 -7.930 1.00 13.14 N ATOM 2286 CA TRP A 135 9.550 -2.122 -7.533 1.00 41.51 C ATOM 2287 C TRP A 135 9.677 -3.633 -7.799 1.00 74.35 C ATOM 2288 O TRP A 135 9.471 -4.468 -6.912 1.00 25.23 O ATOM 2289 CB TRP A 135 9.835 -1.766 -6.042 1.00 53.13 C ATOM 2290 CG TRP A 135 10.077 -0.292 -5.780 1.00 75.24 C ATOM 2291 CD1 TRP A 135 9.273 0.762 -6.125 1.00 23.10 C ATOM 2292 CD2 TRP A 135 11.204 0.284 -5.100 1.00 22.33 C ATOM 2293 NE1 TRP A 135 9.829 1.938 -5.707 1.00 72.54 N ATOM 2294 CE2 TRP A 135 11.010 1.674 -5.076 1.00 40.51 C ATOM 2295 CE3 TRP A 135 12.358 -0.246 -4.512 1.00 41.30 C ATOM 2296 CZ2 TRP A 135 11.920 2.543 -4.487 1.00 74.22 C ATOM 2297 CZ3 TRP A 135 13.262 0.619 -3.930 1.00 52.41 C ATOM 2298 CH2 TRP A 135 13.035 2.000 -3.922 1.00 65.30 C ATOM 0 H TRP A 135 7.610 -1.419 -7.145 1.00 13.14 H new ATOM 0 HA TRP A 135 10.298 -1.591 -8.121 1.00 41.51 H new ATOM 0 HB2 TRP A 135 8.991 -2.096 -5.436 1.00 53.13 H new ATOM 0 HB3 TRP A 135 10.707 -2.329 -5.708 1.00 53.13 H new ATOM 0 HD1 TRP A 135 8.334 0.676 -6.652 1.00 23.10 H new ATOM 0 HE1 TRP A 135 9.426 2.865 -5.845 1.00 72.54 H new ATOM 0 HE3 TRP A 135 12.538 -1.311 -4.514 1.00 41.30 H new ATOM 0 HZ2 TRP A 135 11.750 3.610 -4.477 1.00 74.22 H new ATOM 0 HZ3 TRP A 135 14.158 0.224 -3.474 1.00 52.41 H new ATOM 0 HH2 TRP A 135 13.761 2.651 -3.457 1.00 65.30 H new ATOM 2309 N THR A 136 9.916 -3.953 -9.076 1.00 61.35 N ATOM 2310 CA THR A 136 10.081 -5.308 -9.564 1.00 41.10 C ATOM 2311 C THR A 136 11.557 -5.479 -9.931 1.00 51.52 C ATOM 2312 O THR A 136 12.012 -4.955 -10.963 1.00 62.32 O ATOM 2313 CB THR A 136 9.160 -5.540 -10.801 1.00 22.30 C ATOM 2314 OG1 THR A 136 7.797 -5.298 -10.434 1.00 61.22 O ATOM 2315 CG2 THR A 136 9.289 -6.961 -11.382 1.00 2.42 C ATOM 0 H THR A 136 10.000 -3.250 -9.811 1.00 61.35 H new ATOM 0 HA THR A 136 9.799 -6.040 -8.808 1.00 41.10 H new ATOM 0 HB THR A 136 9.480 -4.843 -11.576 1.00 22.30 H new ATOM 0 HG1 THR A 136 7.218 -5.442 -11.212 1.00 61.22 H new ATOM 0 HG21 THR A 136 8.625 -7.065 -12.240 1.00 2.42 H new ATOM 0 HG22 THR A 136 10.318 -7.134 -11.696 1.00 2.42 H new ATOM 0 HG23 THR A 136 9.015 -7.692 -10.621 1.00 2.42 H new ATOM 2323 N ASP A 137 12.298 -6.132 -9.024 1.00 41.24 N ATOM 2324 CA ASP A 137 13.754 -6.345 -9.142 1.00 40.05 C ATOM 2325 C ASP A 137 14.119 -7.067 -10.441 1.00 51.20 C ATOM 2326 O ASP A 137 13.525 -8.103 -10.760 1.00 5.42 O ATOM 2327 CB ASP A 137 14.272 -7.129 -7.908 1.00 14.30 C ATOM 2328 CG ASP A 137 14.106 -6.321 -6.616 1.00 61.34 C ATOM 2329 OD1 ASP A 137 14.958 -5.438 -6.342 1.00 20.02 O ATOM 2330 OD2 ASP A 137 13.102 -6.524 -5.894 1.00 3.03 O ATOM 0 H ASP A 137 11.900 -6.534 -8.175 1.00 41.24 H new ATOM 0 HA ASP A 137 14.239 -5.369 -9.173 1.00 40.05 H new ATOM 0 HB2 ASP A 137 13.730 -8.071 -7.821 1.00 14.30 H new ATOM 0 HB3 ASP A 137 15.324 -7.378 -8.050 1.00 14.30 H new ATOM 2335 N GLY A 138 15.086 -6.486 -11.181 1.00 52.40 N ATOM 2336 CA GLY A 138 15.532 -7.002 -12.472 1.00 30.32 C ATOM 2337 C GLY A 138 14.464 -6.906 -13.550 1.00 35.12 C ATOM 2338 O GLY A 138 14.294 -7.829 -14.353 1.00 24.13 O ATOM 0 H GLY A 138 15.576 -5.641 -10.889 1.00 52.40 H new ATOM 0 HA2 GLY A 138 16.415 -6.449 -12.793 1.00 30.32 H new ATOM 0 HA3 GLY A 138 15.832 -8.044 -12.357 1.00 30.32 H new ATOM 2342 N SER A 139 13.701 -5.804 -13.521 1.00 12.42 N ATOM 2343 CA SER A 139 12.694 -5.485 -14.549 1.00 65.40 C ATOM 2344 C SER A 139 12.660 -3.976 -14.819 1.00 52.34 C ATOM 2345 O SER A 139 13.057 -3.157 -13.976 1.00 10.41 O ATOM 2346 CB SER A 139 11.297 -5.979 -14.126 1.00 23.31 C ATOM 2347 OG SER A 139 11.267 -7.395 -13.953 1.00 72.55 O ATOM 0 H SER A 139 13.764 -5.104 -12.781 1.00 12.42 H new ATOM 0 HA SER A 139 12.977 -6.001 -15.467 1.00 65.40 H new ATOM 0 HB2 SER A 139 11.006 -5.493 -13.195 1.00 23.31 H new ATOM 0 HB3 SER A 139 10.565 -5.689 -14.880 1.00 23.31 H new ATOM 0 HG SER A 139 10.340 -7.691 -13.841 1.00 72.55 H new ATOM 2353 N TYR A 140 12.146 -3.621 -16.000 1.00 75.14 N ATOM 2354 CA TYR A 140 12.155 -2.254 -16.502 1.00 33.25 C ATOM 2355 C TYR A 140 10.926 -1.494 -15.981 1.00 53.52 C ATOM 2356 O TYR A 140 9.894 -1.402 -16.660 1.00 43.44 O ATOM 2357 CB TYR A 140 12.233 -2.274 -18.055 1.00 55.34 C ATOM 2358 CG TYR A 140 13.445 -3.065 -18.590 1.00 31.14 C ATOM 2359 CD1 TYR A 140 13.390 -4.456 -18.737 1.00 71.14 C ATOM 2360 CD2 TYR A 140 14.643 -2.429 -18.914 1.00 54.03 C ATOM 2361 CE1 TYR A 140 14.475 -5.169 -19.187 1.00 24.21 C ATOM 2362 CE2 TYR A 140 15.732 -3.149 -19.365 1.00 3.00 C ATOM 2363 CZ TYR A 140 15.638 -4.517 -19.500 1.00 22.41 C ATOM 2364 OH TYR A 140 16.710 -5.239 -19.952 1.00 12.25 O ATOM 0 H TYR A 140 11.708 -4.286 -16.638 1.00 75.14 H new ATOM 0 HA TYR A 140 13.034 -1.723 -16.136 1.00 33.25 H new ATOM 0 HB2 TYR A 140 11.317 -2.711 -18.453 1.00 55.34 H new ATOM 0 HB3 TYR A 140 12.284 -1.249 -18.424 1.00 55.34 H new ATOM 0 HD1 TYR A 140 12.477 -4.979 -18.492 1.00 71.14 H new ATOM 0 HD2 TYR A 140 14.720 -1.357 -18.811 1.00 54.03 H new ATOM 0 HE1 TYR A 140 14.411 -6.242 -19.294 1.00 24.21 H new ATOM 0 HE2 TYR A 140 16.653 -2.642 -19.611 1.00 3.00 H new ATOM 0 HH TYR A 140 17.459 -4.634 -20.132 1.00 12.25 H new ATOM 2374 N GLN A 141 11.023 -1.017 -14.725 1.00 74.23 N ATOM 2375 CA GLN A 141 10.001 -0.148 -14.118 1.00 14.33 C ATOM 2376 C GLN A 141 10.341 1.320 -14.424 1.00 1.32 C ATOM 2377 O GLN A 141 11.261 1.575 -15.207 1.00 14.35 O ATOM 2378 CB GLN A 141 9.862 -0.461 -12.599 1.00 34.13 C ATOM 2379 CG GLN A 141 11.127 -0.284 -11.702 1.00 60.54 C ATOM 2380 CD GLN A 141 11.136 1.020 -10.882 1.00 40.34 C ATOM 2381 OE1 GLN A 141 11.678 2.037 -11.311 1.00 1.43 O ATOM 2382 NE2 GLN A 141 10.511 0.998 -9.712 1.00 15.41 N ATOM 0 H GLN A 141 11.808 -1.223 -14.107 1.00 74.23 H new ATOM 0 HA GLN A 141 9.020 -0.342 -14.551 1.00 14.33 H new ATOM 0 HB2 GLN A 141 9.074 0.175 -12.196 1.00 34.13 H new ATOM 0 HB3 GLN A 141 9.522 -1.492 -12.499 1.00 34.13 H new ATOM 0 HG2 GLN A 141 11.197 -1.131 -11.019 1.00 60.54 H new ATOM 0 HG3 GLN A 141 12.015 -0.310 -12.334 1.00 60.54 H new ATOM 0 HE21 GLN A 141 10.071 0.138 -9.385 1.00 15.41 H new ATOM 0 HE22 GLN A 141 10.470 1.841 -9.140 1.00 15.41 H new ATOM 2391 N CYS A 142 9.603 2.255 -13.796 1.00 1.12 N ATOM 2392 CA CYS A 142 9.580 3.694 -14.146 1.00 21.43 C ATOM 2393 C CYS A 142 10.980 4.290 -14.442 1.00 21.23 C ATOM 2394 O CYS A 142 11.220 4.788 -15.549 1.00 22.04 O ATOM 2395 CB CYS A 142 8.855 4.471 -13.024 1.00 51.22 C ATOM 2396 SG CYS A 142 9.285 3.922 -11.344 1.00 42.43 S ATOM 0 H CYS A 142 8.991 2.029 -13.012 1.00 1.12 H new ATOM 0 HA CYS A 142 9.034 3.796 -15.084 1.00 21.43 H new ATOM 0 HB2 CYS A 142 9.091 5.531 -13.120 1.00 51.22 H new ATOM 0 HB3 CYS A 142 7.779 4.370 -13.164 1.00 51.22 H new ATOM 0 HG CYS A 142 10.382 3.226 -11.383 1.00 42.43 H new ATOM 2401 N CYS A 143 11.890 4.227 -13.457 1.00 13.33 N ATOM 2402 CA CYS A 143 13.293 4.677 -13.615 1.00 22.42 C ATOM 2403 C CYS A 143 14.278 3.498 -13.426 1.00 21.50 C ATOM 2404 O CYS A 143 15.493 3.695 -13.474 1.00 40.31 O ATOM 2405 CB CYS A 143 13.561 5.798 -12.600 1.00 54.03 C ATOM 2406 SG CYS A 143 13.043 5.373 -10.911 1.00 34.20 S ATOM 0 H CYS A 143 11.680 3.864 -12.527 1.00 13.33 H new ATOM 0 HA CYS A 143 13.447 5.058 -14.625 1.00 22.42 H new ATOM 0 HB2 CYS A 143 14.626 6.031 -12.599 1.00 54.03 H new ATOM 0 HB3 CYS A 143 13.038 6.700 -12.918 1.00 54.03 H new ATOM 0 HG CYS A 143 13.896 5.860 -10.060 1.00 34.20 H new ATOM 2411 N ARG A 144 13.715 2.282 -13.201 1.00 75.24 N ATOM 2412 CA ARG A 144 14.460 0.998 -12.992 1.00 52.53 C ATOM 2413 C ARG A 144 15.236 1.013 -11.648 1.00 62.01 C ATOM 2414 O ARG A 144 16.038 0.111 -11.388 1.00 74.03 O ATOM 2415 CB ARG A 144 15.417 0.631 -14.183 1.00 21.21 C ATOM 2416 CG ARG A 144 14.741 0.278 -15.537 1.00 32.23 C ATOM 2417 CD ARG A 144 14.257 1.508 -16.325 1.00 64.34 C ATOM 2418 NE ARG A 144 15.363 2.441 -16.623 1.00 5.31 N ATOM 2419 CZ ARG A 144 15.223 3.707 -17.053 1.00 53.41 C ATOM 2420 NH1 ARG A 144 14.014 4.242 -17.245 1.00 33.14 N ATOM 2421 NH2 ARG A 144 16.307 4.446 -17.254 1.00 32.41 N ATOM 0 H ARG A 144 12.704 2.157 -13.158 1.00 75.24 H new ATOM 0 HA ARG A 144 13.703 0.215 -12.953 1.00 52.53 H new ATOM 0 HB2 ARG A 144 16.092 1.471 -14.348 1.00 21.21 H new ATOM 0 HB3 ARG A 144 16.031 -0.216 -13.878 1.00 21.21 H new ATOM 0 HG2 ARG A 144 15.447 -0.281 -16.151 1.00 32.23 H new ATOM 0 HG3 ARG A 144 13.892 -0.379 -15.349 1.00 32.23 H new ATOM 0 HD2 ARG A 144 13.795 1.183 -17.257 1.00 64.34 H new ATOM 0 HD3 ARG A 144 13.489 2.027 -15.752 1.00 64.34 H new ATOM 0 HE ARG A 144 16.314 2.095 -16.491 1.00 5.31 H new ATOM 0 HH11 ARG A 144 13.177 3.688 -17.065 1.00 33.14 H new ATOM 0 HH12 ARG A 144 13.928 5.204 -17.572 1.00 33.14 H new ATOM 0 HH21 ARG A 144 17.232 4.052 -17.082 1.00 32.41 H new ATOM 0 HH22 ARG A 144 16.215 5.408 -17.580 1.00 32.41 H new ATOM 2435 N GLN A 145 14.933 1.998 -10.769 1.00 32.13 N ATOM 2436 CA GLN A 145 15.671 2.217 -9.497 1.00 33.34 C ATOM 2437 C GLN A 145 15.084 1.375 -8.336 1.00 74.22 C ATOM 2438 O GLN A 145 14.999 1.834 -7.182 1.00 22.34 O ATOM 2439 CB GLN A 145 15.684 3.728 -9.134 1.00 73.20 C ATOM 2440 CG GLN A 145 16.390 4.630 -10.175 1.00 72.40 C ATOM 2441 CD GLN A 145 16.469 6.116 -9.777 1.00 21.13 C ATOM 2442 OE1 GLN A 145 15.485 6.605 -9.037 1.00 45.23 O flip ATOM 2443 NE2 GLN A 145 17.405 6.823 -10.153 1.00 13.22 N flip ATOM 0 H GLN A 145 14.173 2.662 -10.919 1.00 32.13 H new ATOM 0 HA GLN A 145 16.698 1.883 -9.648 1.00 33.34 H new ATOM 0 HB2 GLN A 145 14.656 4.069 -9.014 1.00 73.20 H new ATOM 0 HB3 GLN A 145 16.176 3.853 -8.170 1.00 73.20 H new ATOM 0 HG2 GLN A 145 17.401 4.255 -10.337 1.00 72.40 H new ATOM 0 HG3 GLN A 145 15.863 4.548 -11.126 1.00 72.40 H new ATOM 0 HE21 GLN A 145 18.150 6.422 -10.722 1.00 13.22 H new ATOM 0 HE22 GLN A 145 17.435 7.809 -9.895 1.00 13.22 H new ATOM 2452 N THR A 146 14.710 0.126 -8.651 1.00 31.22 N ATOM 2453 CA THR A 146 14.346 -0.893 -7.653 1.00 23.30 C ATOM 2454 C THR A 146 15.647 -1.539 -7.110 1.00 3.10 C ATOM 2455 O THR A 146 16.007 -2.680 -7.426 1.00 51.30 O ATOM 2456 CB THR A 146 13.346 -1.942 -8.263 1.00 35.21 C ATOM 2457 OG1 THR A 146 13.107 -3.023 -7.349 1.00 31.23 O ATOM 2458 CG2 THR A 146 13.822 -2.498 -9.618 1.00 24.10 C ATOM 0 H THR A 146 14.651 -0.209 -9.613 1.00 31.22 H new ATOM 0 HA THR A 146 13.819 -0.435 -6.816 1.00 23.30 H new ATOM 0 HB THR A 146 12.413 -1.406 -8.437 1.00 35.21 H new ATOM 0 HG1 THR A 146 13.926 -3.551 -7.246 1.00 31.23 H new ATOM 0 HG21 THR A 146 13.094 -3.217 -9.992 1.00 24.10 H new ATOM 0 HG22 THR A 146 13.924 -1.680 -10.331 1.00 24.10 H new ATOM 0 HG23 THR A 146 14.786 -2.991 -9.491 1.00 24.10 H new ATOM 2466 N GLU A 147 16.370 -0.742 -6.314 1.00 10.35 N ATOM 2467 CA GLU A 147 17.720 -1.062 -5.825 1.00 15.22 C ATOM 2468 C GLU A 147 17.847 -0.687 -4.347 1.00 0.24 C ATOM 2469 O GLU A 147 18.292 -1.492 -3.522 1.00 35.21 O ATOM 2470 CB GLU A 147 18.773 -0.287 -6.674 1.00 14.43 C ATOM 2471 CG GLU A 147 20.246 -0.440 -6.230 1.00 54.13 C ATOM 2472 CD GLU A 147 20.784 -1.877 -6.344 1.00 13.32 C ATOM 2473 OE1 GLU A 147 21.201 -2.272 -7.452 1.00 51.44 O ATOM 2474 OE2 GLU A 147 20.778 -2.625 -5.340 1.00 33.24 O ATOM 0 H GLU A 147 16.028 0.161 -5.985 1.00 10.35 H new ATOM 0 HA GLU A 147 17.898 -2.133 -5.924 1.00 15.22 H new ATOM 0 HB2 GLU A 147 18.690 -0.617 -7.709 1.00 14.43 H new ATOM 0 HB3 GLU A 147 18.517 0.772 -6.656 1.00 14.43 H new ATOM 0 HG2 GLU A 147 20.868 0.220 -6.835 1.00 54.13 H new ATOM 0 HG3 GLU A 147 20.340 -0.108 -5.196 1.00 54.13 H new ATOM 2481 N LYS A 148 17.465 0.555 -4.036 1.00 54.44 N ATOM 2482 CA LYS A 148 17.527 1.114 -2.674 1.00 75.11 C ATOM 2483 C LYS A 148 16.555 2.309 -2.573 1.00 72.23 C ATOM 2484 O LYS A 148 16.011 2.722 -3.598 1.00 1.24 O ATOM 2485 CB LYS A 148 19.004 1.507 -2.332 1.00 53.05 C ATOM 2486 CG LYS A 148 19.283 1.819 -0.842 1.00 1.53 C ATOM 2487 CD LYS A 148 18.787 0.703 0.116 1.00 74.10 C ATOM 2488 CE LYS A 148 19.450 -0.663 -0.136 1.00 13.02 C ATOM 2489 NZ LYS A 148 18.806 -1.743 0.660 1.00 74.44 N ATOM 0 H LYS A 148 17.100 1.211 -4.727 1.00 54.44 H new ATOM 0 HA LYS A 148 17.215 0.372 -1.938 1.00 75.11 H new ATOM 0 HB2 LYS A 148 19.659 0.694 -2.644 1.00 53.05 H new ATOM 0 HB3 LYS A 148 19.276 2.380 -2.925 1.00 53.05 H new ATOM 0 HG2 LYS A 148 20.354 1.961 -0.701 1.00 1.53 H new ATOM 0 HG3 LYS A 148 18.799 2.759 -0.577 1.00 1.53 H new ATOM 0 HD2 LYS A 148 18.979 1.007 1.145 1.00 74.10 H new ATOM 0 HD3 LYS A 148 17.707 0.599 0.011 1.00 74.10 H new ATOM 0 HE2 LYS A 148 19.389 -0.907 -1.197 1.00 13.02 H new ATOM 0 HE3 LYS A 148 20.509 -0.606 0.118 1.00 13.02 H new ATOM 0 HZ1 LYS A 148 19.279 -2.648 0.464 1.00 74.44 H new ATOM 0 HZ2 LYS A 148 18.886 -1.523 1.673 1.00 74.44 H new ATOM 0 HZ3 LYS A 148 17.802 -1.814 0.400 1.00 74.44 H new ATOM 2503 N LEU A 149 16.342 2.834 -1.341 1.00 24.40 N ATOM 2504 CA LEU A 149 15.351 3.888 -1.035 1.00 43.41 C ATOM 2505 C LEU A 149 15.547 5.144 -1.917 1.00 53.32 C ATOM 2506 O LEU A 149 16.287 6.070 -1.563 1.00 62.32 O ATOM 2507 CB LEU A 149 15.427 4.265 0.477 1.00 22.01 C ATOM 2508 CG LEU A 149 15.346 3.086 1.501 1.00 54.25 C ATOM 2509 CD1 LEU A 149 15.453 3.606 2.957 1.00 1.40 C ATOM 2510 CD2 LEU A 149 14.063 2.239 1.291 1.00 41.55 C ATOM 0 H LEU A 149 16.865 2.529 -0.520 1.00 24.40 H new ATOM 0 HA LEU A 149 14.362 3.489 -1.260 1.00 43.41 H new ATOM 0 HB2 LEU A 149 16.361 4.800 0.648 1.00 22.01 H new ATOM 0 HB3 LEU A 149 14.617 4.961 0.695 1.00 22.01 H new ATOM 0 HG LEU A 149 16.198 2.430 1.321 1.00 54.25 H new ATOM 0 HD11 LEU A 149 15.394 2.766 3.649 1.00 1.40 H new ATOM 0 HD12 LEU A 149 16.405 4.120 3.091 1.00 1.40 H new ATOM 0 HD13 LEU A 149 14.636 4.299 3.157 1.00 1.40 H new ATOM 0 HD21 LEU A 149 14.039 1.428 2.019 1.00 41.55 H new ATOM 0 HD22 LEU A 149 13.184 2.871 1.422 1.00 41.55 H new ATOM 0 HD23 LEU A 149 14.063 1.822 0.284 1.00 41.55 H new ATOM 2522 N ALA A 150 14.921 5.124 -3.095 1.00 63.32 N ATOM 2523 CA ALA A 150 14.909 6.247 -4.025 1.00 73.15 C ATOM 2524 C ALA A 150 13.662 7.099 -3.717 1.00 23.40 C ATOM 2525 O ALA A 150 12.556 6.544 -3.639 1.00 74.42 O ATOM 2526 CB ALA A 150 14.917 5.719 -5.468 1.00 3.24 C ATOM 0 H ALA A 150 14.401 4.314 -3.432 1.00 63.32 H new ATOM 0 HA ALA A 150 15.795 6.872 -3.912 1.00 73.15 H new ATOM 0 HB1 ALA A 150 14.908 6.559 -6.163 1.00 3.24 H new ATOM 0 HB2 ALA A 150 15.814 5.122 -5.632 1.00 3.24 H new ATOM 0 HB3 ALA A 150 14.035 5.101 -5.634 1.00 3.24 H new ATOM 2532 N PRO A 151 13.813 8.447 -3.531 1.00 30.14 N ATOM 2533 CA PRO A 151 12.738 9.322 -2.975 1.00 23.54 C ATOM 2534 C PRO A 151 11.544 9.567 -3.931 1.00 31.41 C ATOM 2535 O PRO A 151 10.585 10.247 -3.556 1.00 11.43 O ATOM 2536 CB PRO A 151 13.506 10.627 -2.664 1.00 3.13 C ATOM 2537 CG PRO A 151 14.601 10.671 -3.677 1.00 33.21 C ATOM 2538 CD PRO A 151 15.044 9.236 -3.846 1.00 62.14 C ATOM 0 HA PRO A 151 12.250 8.867 -2.113 1.00 23.54 H new ATOM 0 HB2 PRO A 151 12.856 11.498 -2.745 1.00 3.13 H new ATOM 0 HB3 PRO A 151 13.905 10.620 -1.650 1.00 3.13 H new ATOM 0 HG2 PRO A 151 14.248 11.088 -4.620 1.00 33.21 H new ATOM 0 HG3 PRO A 151 15.425 11.300 -3.339 1.00 33.21 H new ATOM 0 HD2 PRO A 151 15.396 9.042 -4.859 1.00 62.14 H new ATOM 0 HD3 PRO A 151 15.863 8.987 -3.171 1.00 62.14 H new ATOM 2546 N GLY A 152 11.633 9.029 -5.164 1.00 3.11 N ATOM 2547 CA GLY A 152 10.511 9.012 -6.109 1.00 22.31 C ATOM 2548 C GLY A 152 10.698 9.932 -7.310 1.00 43.03 C ATOM 2549 O GLY A 152 11.486 10.879 -7.257 1.00 45.15 O ATOM 0 H GLY A 152 12.483 8.597 -5.526 1.00 3.11 H new ATOM 0 HA2 GLY A 152 10.364 7.992 -6.465 1.00 22.31 H new ATOM 0 HA3 GLY A 152 9.601 9.300 -5.582 1.00 22.31 H new ATOM 2553 N CYS A 153 9.934 9.667 -8.386 1.00 51.40 N ATOM 2554 CA CYS A 153 9.994 10.426 -9.654 1.00 75.14 C ATOM 2555 C CYS A 153 8.655 11.124 -9.973 1.00 32.32 C ATOM 2556 O CYS A 153 8.645 12.183 -10.608 1.00 75.21 O ATOM 2557 CB CYS A 153 10.416 9.476 -10.791 1.00 14.10 C ATOM 2558 SG CYS A 153 9.583 7.859 -10.748 1.00 75.15 S ATOM 0 H CYS A 153 9.249 8.911 -8.402 1.00 51.40 H new ATOM 0 HA CYS A 153 10.736 11.218 -9.552 1.00 75.14 H new ATOM 0 HB2 CYS A 153 10.208 9.955 -11.748 1.00 14.10 H new ATOM 0 HB3 CYS A 153 11.494 9.320 -10.740 1.00 14.10 H new ATOM 0 HG CYS A 153 10.143 7.106 -9.848 1.00 75.15 H new ATOM 2563 N GLU A 154 7.537 10.531 -9.543 1.00 22.04 N ATOM 2564 CA GLU A 154 6.192 11.136 -9.682 1.00 41.34 C ATOM 2565 C GLU A 154 5.816 11.854 -8.391 1.00 61.35 C ATOM 2566 O GLU A 154 6.169 11.395 -7.312 1.00 72.45 O ATOM 2567 CB GLU A 154 5.139 10.037 -10.019 1.00 71.00 C ATOM 2568 CG GLU A 154 4.970 9.751 -11.520 1.00 62.34 C ATOM 2569 CD GLU A 154 4.264 10.890 -12.275 1.00 54.12 C ATOM 2570 OE1 GLU A 154 3.044 11.077 -12.062 1.00 75.40 O ATOM 2571 OE2 GLU A 154 4.910 11.606 -13.076 1.00 22.45 O ATOM 0 H GLU A 154 7.530 9.618 -9.088 1.00 22.04 H new ATOM 0 HA GLU A 154 6.208 11.859 -10.498 1.00 41.34 H new ATOM 0 HB2 GLU A 154 5.424 9.113 -9.516 1.00 71.00 H new ATOM 0 HB3 GLU A 154 4.175 10.338 -9.609 1.00 71.00 H new ATOM 0 HG2 GLU A 154 5.951 9.582 -11.964 1.00 62.34 H new ATOM 0 HG3 GLU A 154 4.400 8.831 -11.647 1.00 62.34 H new ATOM 2578 N LYS A 155 5.091 12.971 -8.518 1.00 52.43 N ATOM 2579 CA LYS A 155 4.613 13.753 -7.365 1.00 25.43 C ATOM 2580 C LYS A 155 3.537 12.954 -6.581 1.00 51.05 C ATOM 2581 O LYS A 155 2.569 12.450 -7.159 1.00 61.43 O ATOM 2582 CB LYS A 155 4.122 15.168 -7.835 1.00 62.22 C ATOM 2583 CG LYS A 155 2.992 15.199 -8.907 1.00 23.24 C ATOM 2584 CD LYS A 155 1.567 15.222 -8.305 1.00 44.44 C ATOM 2585 CE LYS A 155 0.483 15.022 -9.370 1.00 64.45 C ATOM 2586 NZ LYS A 155 0.442 16.119 -10.362 1.00 70.32 N ATOM 0 H LYS A 155 4.818 13.361 -9.420 1.00 52.43 H new ATOM 0 HA LYS A 155 5.434 13.927 -6.669 1.00 25.43 H new ATOM 0 HB2 LYS A 155 3.774 15.715 -6.959 1.00 62.22 H new ATOM 0 HB3 LYS A 155 4.980 15.711 -8.230 1.00 62.22 H new ATOM 0 HG2 LYS A 155 3.125 16.078 -9.538 1.00 23.24 H new ATOM 0 HG3 LYS A 155 3.091 14.326 -9.552 1.00 23.24 H new ATOM 0 HD2 LYS A 155 1.481 14.440 -7.551 1.00 44.44 H new ATOM 0 HD3 LYS A 155 1.404 16.173 -7.798 1.00 44.44 H new ATOM 0 HE2 LYS A 155 0.658 14.078 -9.886 1.00 64.45 H new ATOM 0 HE3 LYS A 155 -0.489 14.943 -8.882 1.00 64.45 H new ATOM 0 HZ1 LYS A 155 -0.309 15.931 -11.057 1.00 70.32 H new ATOM 0 HZ2 LYS A 155 0.248 17.018 -9.877 1.00 70.32 H new ATOM 0 HZ3 LYS A 155 1.358 16.180 -10.850 1.00 70.32 H new ATOM 2600 N TYR A 156 3.768 12.779 -5.277 1.00 23.22 N ATOM 2601 CA TYR A 156 2.844 12.097 -4.355 1.00 13.54 C ATOM 2602 C TYR A 156 1.857 13.114 -3.758 1.00 44.50 C ATOM 2603 O TYR A 156 2.263 13.984 -2.971 1.00 14.03 O ATOM 2604 CB TYR A 156 3.686 11.411 -3.238 1.00 61.33 C ATOM 2605 CG TYR A 156 2.884 10.865 -2.040 1.00 41.55 C ATOM 2606 CD1 TYR A 156 2.020 9.788 -2.190 1.00 32.34 C ATOM 2607 CD2 TYR A 156 2.990 11.440 -0.763 1.00 0.21 C ATOM 2608 CE1 TYR A 156 1.295 9.303 -1.126 1.00 2.12 C ATOM 2609 CE2 TYR A 156 2.265 10.950 0.304 1.00 22.21 C ATOM 2610 CZ TYR A 156 1.420 9.883 0.115 1.00 13.40 C ATOM 2611 OH TYR A 156 0.700 9.386 1.177 1.00 31.42 O ATOM 0 H TYR A 156 4.617 13.112 -4.820 1.00 23.22 H new ATOM 0 HA TYR A 156 2.263 11.342 -4.884 1.00 13.54 H new ATOM 0 HB2 TYR A 156 4.245 10.588 -3.683 1.00 61.33 H new ATOM 0 HB3 TYR A 156 4.417 12.129 -2.866 1.00 61.33 H new ATOM 0 HD1 TYR A 156 1.915 9.323 -3.159 1.00 32.34 H new ATOM 0 HD2 TYR A 156 3.651 12.281 -0.613 1.00 0.21 H new ATOM 0 HE1 TYR A 156 0.627 8.466 -1.265 1.00 2.12 H new ATOM 0 HE2 TYR A 156 2.361 11.402 1.280 1.00 22.21 H new ATOM 0 HH TYR A 156 1.079 9.723 2.016 1.00 31.42 H new ATOM 2621 N ASN A 157 0.568 13.030 -4.143 1.00 63.42 N ATOM 2622 CA ASN A 157 -0.462 13.956 -3.631 1.00 63.12 C ATOM 2623 C ASN A 157 -0.948 13.532 -2.219 1.00 2.33 C ATOM 2624 O ASN A 157 -1.782 12.644 -2.062 1.00 63.14 O ATOM 2625 CB ASN A 157 -1.640 14.142 -4.653 1.00 31.44 C ATOM 2626 CG ASN A 157 -2.600 12.955 -4.897 1.00 74.21 C ATOM 2627 OD1 ASN A 157 -2.122 11.726 -4.827 1.00 52.24 O flip ATOM 2628 ND2 ASN A 157 -3.788 13.160 -5.156 1.00 22.03 N flip ATOM 0 H ASN A 157 0.217 12.335 -4.802 1.00 63.42 H new ATOM 0 HA ASN A 157 -0.003 14.938 -3.521 1.00 63.12 H new ATOM 0 HB2 ASN A 157 -2.239 14.989 -4.318 1.00 31.44 H new ATOM 0 HB3 ASN A 157 -1.205 14.419 -5.613 1.00 31.44 H new ATOM 0 HD21 ASN A 157 -4.141 14.115 -5.206 1.00 22.03 H new ATOM 0 HD22 ASN A 157 -4.417 12.374 -5.320 1.00 22.03 H new ATOM 2635 N LEU A 158 -0.331 14.132 -1.182 1.00 11.41 N ATOM 2636 CA LEU A 158 -0.765 13.947 0.229 1.00 13.55 C ATOM 2637 C LEU A 158 -1.893 14.937 0.581 1.00 41.40 C ATOM 2638 O LEU A 158 -2.777 14.629 1.380 1.00 53.42 O ATOM 2639 CB LEU A 158 0.436 14.124 1.207 1.00 40.12 C ATOM 2640 CG LEU A 158 0.130 13.857 2.722 1.00 71.42 C ATOM 2641 CD1 LEU A 158 -0.289 12.386 2.974 1.00 45.21 C ATOM 2642 CD2 LEU A 158 1.329 14.253 3.615 1.00 50.53 C ATOM 0 H LEU A 158 0.472 14.752 -1.289 1.00 11.41 H new ATOM 0 HA LEU A 158 -1.146 12.931 0.336 1.00 13.55 H new ATOM 0 HB2 LEU A 158 1.236 13.453 0.894 1.00 40.12 H new ATOM 0 HB3 LEU A 158 0.815 15.141 1.106 1.00 40.12 H new ATOM 0 HG LEU A 158 -0.716 14.488 2.995 1.00 71.42 H new ATOM 0 HD11 LEU A 158 -0.492 12.242 4.035 1.00 45.21 H new ATOM 0 HD12 LEU A 158 -1.187 12.160 2.399 1.00 45.21 H new ATOM 0 HD13 LEU A 158 0.517 11.720 2.665 1.00 45.21 H new ATOM 0 HD21 LEU A 158 1.086 14.056 4.659 1.00 50.53 H new ATOM 0 HD22 LEU A 158 2.204 13.669 3.330 1.00 50.53 H new ATOM 0 HD23 LEU A 158 1.544 15.314 3.486 1.00 50.53 H new ATOM 2654 N PHE A 159 -1.821 16.139 -0.014 1.00 63.10 N ATOM 2655 CA PHE A 159 -2.819 17.215 0.177 1.00 35.01 C ATOM 2656 C PHE A 159 -3.377 17.653 -1.184 1.00 65.35 C ATOM 2657 O PHE A 159 -4.598 17.677 -1.390 1.00 15.34 O ATOM 2658 CB PHE A 159 -2.195 18.439 0.903 1.00 61.02 C ATOM 2659 CG PHE A 159 -1.734 18.143 2.334 1.00 73.42 C ATOM 2660 CD1 PHE A 159 -2.650 18.131 3.384 1.00 33.44 C ATOM 2661 CD2 PHE A 159 -0.402 17.849 2.624 1.00 42.52 C ATOM 2662 CE1 PHE A 159 -2.252 17.847 4.674 1.00 73.45 C ATOM 2663 CE2 PHE A 159 -0.006 17.558 3.919 1.00 3.54 C ATOM 2664 CZ PHE A 159 -0.933 17.553 4.943 1.00 54.20 C ATOM 0 H PHE A 159 -1.064 16.398 -0.647 1.00 63.10 H new ATOM 0 HA PHE A 159 -3.625 16.824 0.798 1.00 35.01 H new ATOM 0 HB2 PHE A 159 -1.344 18.797 0.324 1.00 61.02 H new ATOM 0 HB3 PHE A 159 -2.927 19.247 0.927 1.00 61.02 H new ATOM 0 HD1 PHE A 159 -3.689 18.348 3.185 1.00 33.44 H new ATOM 0 HD2 PHE A 159 0.329 17.848 1.829 1.00 42.52 H new ATOM 0 HE1 PHE A 159 -2.976 17.855 5.475 1.00 73.45 H new ATOM 0 HE2 PHE A 159 1.030 17.335 4.129 1.00 3.54 H new ATOM 0 HZ PHE A 159 -0.625 17.319 5.951 1.00 54.20 H new