USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 710 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 321 LYS NZ :NH3+ 177:sc= 1.23 (180deg=0) USER MOD Set 1.2: A 399 TYR OH : rot 180:sc= 1.04 USER MOD Set 2.1: A 384 HIS : no HE2:sc= -0.51 K(o=0.1,f=-1.4) USER MOD Set 2.2: B 149 THR OG1 : rot -19:sc= 0.614 USER MOD Set 3.1: A 366 GLN : amide:sc= 0.873 K(o=3.1,f=-5.4) USER MOD Set 3.2: A 404 LYS NZ :NH3+ 162:sc= 2.2 (180deg=1.02) USER MOD Set 4.1: A 347 SER OG : rot 84:sc= 1.74 USER MOD Set 4.2: A 370 LYS NZ :NH3+ -175:sc= 3.24 (180deg=2.02) USER MOD Set 5.1: A 327 LYS NZ :NH3+ -113:sc= 0.602 (180deg=-0.855) USER MOD Set 5.2: B 150 GLN : amide:sc= -1.31 K(o=-0.71,f=-1.2) USER MOD Single : A 318 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 324 LYS NZ :NH3+ 170:sc= 1.06 (180deg=0.403) USER MOD Single : A 332 SER OG : rot -118:sc= 1.19 USER MOD Single : A 339 ASN : amide:sc= 0.0312 K(o=0.031,f=-0.89) USER MOD Single : A 340 GLN : amide:sc= -0.43 X(o=-0.43,f=-0.62) USER MOD Single : A 341 HIS : no HD1:sc= 0 X(o=0,f=-0.0016) USER MOD Single : A 346 ASN : amide:sc= -1.05 K(o=-1,f=-5.4) USER MOD Single : A 349 TYR OH : rot -34:sc= 1.22 USER MOD Single : A 351 THR OG1 : rot 180:sc= 0 USER MOD Single : A 352 LYS NZ :NH3+ 147:sc= 0.469 (180deg=-1.33!) USER MOD Single : A 360 HIS : no HE2:sc= -0.0775 K(o=-0.077,f=-2.7!) USER MOD Single : A 361 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 364 LYS NZ :NH3+ -160:sc= 0.993 (180deg=0.085) USER MOD Single : A 375 ASN : amide:sc= -1.47! C(o=-1.5!,f=-6.7!) USER MOD Single : A 376 ASN : amide:sc= -1.35 K(o=-1.3,f=-4.5!) USER MOD Single : A 378 CYS SG : rot 180:sc= 0.118 USER MOD Single : A 383 THR OG1 : rot -77:sc= 0.398 USER MOD Single : A 389 THR OG1 : rot 88:sc= 1 USER MOD Single : A 392 LYS NZ :NH3+ 175:sc= -0.964! (180deg=-1.05!) USER MOD Single : A 393 ASN : amide:sc=-0.00707 K(o=-0.0071,f=-0.51) USER MOD Single : A 394 THR OG1 : rot -83:sc= 0.673 USER MOD Single : A 395 SER OG : rot -4:sc= 0.422 USER MOD Single : A 401 LYS NZ :NH3+ 168:sc= 1.09 (180deg=0.934) USER MOD Single : B 147 ASN : amide:sc= 1.09 K(o=1.1,f=-0.056) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 318 1.409 -2.439 0.236 1.00 51.11 N ATOM 2 CA MET A 318 2.211 -1.668 -0.695 1.00 1.14 C ATOM 3 C MET A 318 3.580 -2.242 -0.641 1.00 34.41 C ATOM 4 O MET A 318 4.220 -2.207 0.386 1.00 41.01 O ATOM 5 CB MET A 318 2.227 -0.179 -0.313 1.00 64.32 C ATOM 6 CG MET A 318 3.096 0.681 -1.221 1.00 75.30 C ATOM 7 SD MET A 318 2.573 0.602 -2.940 1.00 53.42 S ATOM 8 CE MET A 318 3.789 1.678 -3.707 1.00 23.44 C ATOM 0 HA MET A 318 1.799 -1.723 -1.703 1.00 1.14 H new ATOM 0 HB2 MET A 318 1.206 0.203 -0.335 1.00 64.32 H new ATOM 0 HB3 MET A 318 2.582 -0.081 0.713 1.00 64.32 H new ATOM 0 HG2 MET A 318 3.061 1.716 -0.880 1.00 75.30 H new ATOM 0 HG3 MET A 318 4.133 0.355 -1.144 1.00 75.30 H new ATOM 0 HE1 MET A 318 3.600 1.734 -4.779 1.00 23.44 H new ATOM 0 HE2 MET A 318 3.717 2.675 -3.273 1.00 23.44 H new ATOM 0 HE3 MET A 318 4.788 1.278 -3.535 1.00 23.44 H new ATOM 20 N GLU A 319 3.996 -2.836 -1.691 1.00 52.20 N ATOM 21 CA GLU A 319 5.235 -3.501 -1.694 1.00 23.03 C ATOM 22 C GLU A 319 6.261 -3.012 -2.657 1.00 63.10 C ATOM 23 O GLU A 319 6.042 -2.861 -3.857 1.00 43.23 O ATOM 24 CB GLU A 319 5.157 -5.026 -1.503 1.00 55.12 C ATOM 25 CG GLU A 319 3.921 -5.695 -2.072 1.00 3.35 C ATOM 26 CD GLU A 319 2.753 -5.639 -1.068 1.00 13.25 C ATOM 27 OE1 GLU A 319 2.707 -6.501 -0.171 1.00 54.12 O ATOM 28 OE2 GLU A 319 1.908 -4.703 -1.125 1.00 44.03 O ATOM 0 H GLU A 319 3.486 -2.874 -2.573 1.00 52.20 H new ATOM 0 HA GLU A 319 5.673 -3.159 -0.756 1.00 23.03 H new ATOM 0 HB2 GLU A 319 6.037 -5.477 -1.962 1.00 55.12 H new ATOM 0 HB3 GLU A 319 5.208 -5.244 -0.436 1.00 55.12 H new ATOM 0 HG2 GLU A 319 3.631 -5.203 -3.001 1.00 3.35 H new ATOM 0 HG3 GLU A 319 4.145 -6.733 -2.318 1.00 3.35 H new ATOM 35 N ILE A 320 7.366 -2.754 -2.073 1.00 12.52 N ATOM 36 CA ILE A 320 8.521 -2.213 -2.666 1.00 45.44 C ATOM 37 C ILE A 320 9.523 -3.294 -2.894 1.00 52.41 C ATOM 38 O ILE A 320 10.104 -3.843 -1.955 1.00 52.32 O ATOM 39 CB ILE A 320 9.097 -1.116 -1.727 1.00 1.21 C ATOM 40 CG1 ILE A 320 8.105 0.065 -1.646 1.00 3.43 C ATOM 41 CG2 ILE A 320 10.489 -0.672 -2.140 1.00 32.25 C ATOM 42 CD1 ILE A 320 8.539 1.202 -0.752 1.00 41.51 C ATOM 0 H ILE A 320 7.495 -2.933 -1.077 1.00 12.52 H new ATOM 0 HA ILE A 320 8.277 -1.767 -3.630 1.00 45.44 H new ATOM 0 HB ILE A 320 9.213 -1.541 -0.730 1.00 1.21 H new ATOM 0 HG12 ILE A 320 7.944 0.454 -2.651 1.00 3.43 H new ATOM 0 HG13 ILE A 320 7.145 -0.310 -1.292 1.00 3.43 H new ATOM 0 HG21 ILE A 320 10.845 0.095 -1.452 1.00 32.25 H new ATOM 0 HG22 ILE A 320 11.166 -1.526 -2.114 1.00 32.25 H new ATOM 0 HG23 ILE A 320 10.456 -0.266 -3.151 1.00 32.25 H new ATOM 0 HD11 ILE A 320 7.778 1.982 -0.760 1.00 41.51 H new ATOM 0 HD12 ILE A 320 8.671 0.835 0.266 1.00 41.51 H new ATOM 0 HD13 ILE A 320 9.482 1.611 -1.115 1.00 41.51 H new ATOM 54 N LYS A 321 9.665 -3.665 -4.126 1.00 51.33 N ATOM 55 CA LYS A 321 10.718 -4.532 -4.485 1.00 31.30 C ATOM 56 C LYS A 321 11.935 -3.682 -4.613 1.00 65.31 C ATOM 57 O LYS A 321 12.014 -2.812 -5.493 1.00 32.52 O ATOM 58 CB LYS A 321 10.409 -5.340 -5.742 1.00 24.42 C ATOM 59 CG LYS A 321 11.592 -6.151 -6.269 1.00 62.22 C ATOM 60 CD LYS A 321 11.140 -7.320 -7.127 1.00 20.13 C ATOM 61 CE LYS A 321 10.236 -6.912 -8.275 1.00 24.30 C ATOM 62 NZ LYS A 321 9.682 -8.109 -8.957 1.00 32.32 N ATOM 0 H LYS A 321 9.060 -3.376 -4.894 1.00 51.33 H new ATOM 0 HA LYS A 321 10.872 -5.295 -3.722 1.00 31.30 H new ATOM 0 HB2 LYS A 321 9.583 -6.019 -5.531 1.00 24.42 H new ATOM 0 HB3 LYS A 321 10.071 -4.660 -6.524 1.00 24.42 H new ATOM 0 HG2 LYS A 321 12.245 -5.503 -6.853 1.00 62.22 H new ATOM 0 HG3 LYS A 321 12.180 -6.523 -5.430 1.00 62.22 H new ATOM 0 HD2 LYS A 321 12.018 -7.827 -7.528 1.00 20.13 H new ATOM 0 HD3 LYS A 321 10.615 -8.040 -6.499 1.00 20.13 H new ATOM 0 HE2 LYS A 321 9.422 -6.291 -7.901 1.00 24.30 H new ATOM 0 HE3 LYS A 321 10.796 -6.307 -8.988 1.00 24.30 H new ATOM 0 HZ1 LYS A 321 9.027 -7.809 -9.707 1.00 32.32 H new ATOM 0 HZ2 LYS A 321 10.458 -8.660 -9.376 1.00 32.32 H new ATOM 0 HZ3 LYS A 321 9.173 -8.697 -8.267 1.00 32.32 H new ATOM 76 N LEU A 322 12.809 -3.884 -3.698 1.00 71.14 N ATOM 77 CA LEU A 322 13.962 -3.076 -3.520 1.00 52.13 C ATOM 78 C LEU A 322 15.182 -3.849 -3.896 1.00 12.01 C ATOM 79 O LEU A 322 15.224 -5.067 -3.728 1.00 73.35 O ATOM 80 CB LEU A 322 14.041 -2.681 -2.047 1.00 73.35 C ATOM 81 CG LEU A 322 14.023 -1.197 -1.742 1.00 2.40 C ATOM 82 CD1 LEU A 322 13.869 -0.979 -0.244 1.00 3.12 C ATOM 83 CD2 LEU A 322 15.309 -0.560 -2.220 1.00 61.12 C ATOM 0 H LEU A 322 12.740 -4.647 -3.024 1.00 71.14 H new ATOM 0 HA LEU A 322 13.901 -2.188 -4.149 1.00 52.13 H new ATOM 0 HB2 LEU A 322 13.206 -3.147 -1.524 1.00 73.35 H new ATOM 0 HB3 LEU A 322 14.955 -3.104 -1.629 1.00 73.35 H new ATOM 0 HG LEU A 322 13.181 -0.738 -2.259 1.00 2.40 H new ATOM 0 HD11 LEU A 322 13.857 0.090 -0.031 1.00 3.12 H new ATOM 0 HD12 LEU A 322 12.935 -1.427 0.095 1.00 3.12 H new ATOM 0 HD13 LEU A 322 14.705 -1.443 0.279 1.00 3.12 H new ATOM 0 HD21 LEU A 322 15.291 0.507 -1.998 1.00 61.12 H new ATOM 0 HD22 LEU A 322 16.155 -1.022 -1.711 1.00 61.12 H new ATOM 0 HD23 LEU A 322 15.409 -0.705 -3.296 1.00 61.12 H new ATOM 95 N ILE A 323 16.134 -3.185 -4.436 1.00 4.01 N ATOM 96 CA ILE A 323 17.380 -3.805 -4.731 1.00 74.54 C ATOM 97 C ILE A 323 18.446 -3.370 -3.731 1.00 10.24 C ATOM 98 O ILE A 323 18.746 -2.184 -3.591 1.00 13.33 O ATOM 99 CB ILE A 323 17.824 -3.550 -6.189 1.00 31.20 C ATOM 100 CG1 ILE A 323 16.799 -4.163 -7.158 1.00 73.32 C ATOM 101 CG2 ILE A 323 19.223 -4.112 -6.462 1.00 45.05 C ATOM 102 CD1 ILE A 323 16.517 -5.649 -6.949 1.00 61.15 C ATOM 0 H ILE A 323 16.077 -2.198 -4.688 1.00 4.01 H new ATOM 0 HA ILE A 323 17.246 -4.882 -4.633 1.00 74.54 H new ATOM 0 HB ILE A 323 17.871 -2.472 -6.346 1.00 31.20 H new ATOM 0 HG12 ILE A 323 15.862 -3.615 -7.065 1.00 73.32 H new ATOM 0 HG13 ILE A 323 17.154 -4.017 -8.178 1.00 73.32 H new ATOM 0 HG21 ILE A 323 19.499 -3.913 -7.497 1.00 45.05 H new ATOM 0 HG22 ILE A 323 19.943 -3.636 -5.796 1.00 45.05 H new ATOM 0 HG23 ILE A 323 19.223 -5.188 -6.287 1.00 45.05 H new ATOM 0 HD11 ILE A 323 15.782 -5.986 -7.680 1.00 61.15 H new ATOM 0 HD12 ILE A 323 17.440 -6.216 -7.074 1.00 61.15 H new ATOM 0 HD13 ILE A 323 16.127 -5.807 -5.944 1.00 61.15 H new ATOM 114 N LYS A 324 18.940 -4.342 -2.985 1.00 70.04 N ATOM 115 CA LYS A 324 20.019 -4.162 -2.046 1.00 24.05 C ATOM 116 C LYS A 324 21.320 -3.809 -2.774 1.00 72.34 C ATOM 117 O LYS A 324 21.498 -4.138 -3.936 1.00 21.22 O ATOM 118 CB LYS A 324 20.114 -5.446 -1.215 1.00 3.32 C ATOM 119 CG LYS A 324 21.390 -5.696 -0.394 1.00 64.21 C ATOM 120 CD LYS A 324 22.529 -6.252 -1.276 1.00 23.32 C ATOM 121 CE LYS A 324 23.744 -6.758 -0.541 1.00 40.14 C ATOM 122 NZ LYS A 324 24.678 -7.398 -1.517 1.00 2.24 N ATOM 0 H LYS A 324 18.590 -5.299 -3.021 1.00 70.04 H new ATOM 0 HA LYS A 324 19.832 -3.322 -1.376 1.00 24.05 H new ATOM 0 HB2 LYS A 324 19.269 -5.458 -0.526 1.00 3.32 H new ATOM 0 HB3 LYS A 324 19.985 -6.290 -1.893 1.00 3.32 H new ATOM 0 HG2 LYS A 324 21.711 -4.765 0.074 1.00 64.21 H new ATOM 0 HG3 LYS A 324 21.175 -6.399 0.410 1.00 64.21 H new ATOM 0 HD2 LYS A 324 22.129 -7.066 -1.881 1.00 23.32 H new ATOM 0 HD3 LYS A 324 22.845 -5.468 -1.964 1.00 23.32 H new ATOM 0 HE2 LYS A 324 24.242 -5.935 -0.028 1.00 40.14 H new ATOM 0 HE3 LYS A 324 23.448 -7.477 0.223 1.00 40.14 H new ATOM 0 HZ1 LYS A 324 25.586 -7.596 -1.050 1.00 2.24 H new ATOM 0 HZ2 LYS A 324 24.264 -8.288 -1.861 1.00 2.24 H new ATOM 0 HZ3 LYS A 324 24.835 -6.756 -2.320 1.00 2.24 H new ATOM 136 N GLY A 325 22.218 -3.179 -2.071 1.00 51.33 N ATOM 137 CA GLY A 325 23.469 -2.759 -2.645 1.00 73.21 C ATOM 138 C GLY A 325 24.605 -2.967 -1.666 1.00 34.41 C ATOM 139 O GLY A 325 24.416 -3.639 -0.655 1.00 1.22 O ATOM 0 H GLY A 325 22.106 -2.941 -1.085 1.00 51.33 H new ATOM 0 HA2 GLY A 325 23.662 -3.321 -3.559 1.00 73.21 H new ATOM 0 HA3 GLY A 325 23.411 -1.707 -2.924 1.00 73.21 H new ATOM 143 N PRO A 326 25.795 -2.378 -1.905 1.00 61.12 N ATOM 144 CA PRO A 326 26.971 -2.543 -1.011 1.00 14.12 C ATOM 145 C PRO A 326 26.742 -1.938 0.384 1.00 44.25 C ATOM 146 O PRO A 326 27.380 -2.311 1.346 1.00 32.02 O ATOM 147 CB PRO A 326 28.091 -1.788 -1.747 1.00 71.41 C ATOM 148 CG PRO A 326 27.388 -0.846 -2.668 1.00 71.10 C ATOM 149 CD PRO A 326 26.111 -1.527 -3.073 1.00 25.10 C ATOM 0 HA PRO A 326 27.195 -3.594 -0.829 1.00 14.12 H new ATOM 0 HB2 PRO A 326 28.730 -1.250 -1.046 1.00 71.41 H new ATOM 0 HB3 PRO A 326 28.732 -2.475 -2.300 1.00 71.41 H new ATOM 0 HG2 PRO A 326 27.182 0.102 -2.172 1.00 71.10 H new ATOM 0 HG3 PRO A 326 28.003 -0.623 -3.540 1.00 71.10 H new ATOM 0 HD2 PRO A 326 25.317 -0.807 -3.273 1.00 25.10 H new ATOM 0 HD3 PRO A 326 26.240 -2.119 -3.979 1.00 25.10 H new ATOM 157 N LYS A 327 25.803 -1.022 0.456 1.00 55.52 N ATOM 158 CA LYS A 327 25.444 -0.345 1.697 1.00 52.11 C ATOM 159 C LYS A 327 24.307 -1.097 2.410 1.00 42.23 C ATOM 160 O LYS A 327 23.994 -0.858 3.584 1.00 15.54 O ATOM 161 CB LYS A 327 24.987 1.086 1.356 1.00 33.10 C ATOM 162 CG LYS A 327 24.334 1.823 2.505 1.00 33.14 C ATOM 163 CD LYS A 327 25.308 2.078 3.648 1.00 64.44 C ATOM 164 CE LYS A 327 24.576 2.437 4.931 1.00 55.23 C ATOM 165 NZ LYS A 327 23.723 1.316 5.433 1.00 10.34 N ATOM 0 H LYS A 327 25.257 -0.718 -0.350 1.00 55.52 H new ATOM 0 HA LYS A 327 26.307 -0.319 2.362 1.00 52.11 H new ATOM 0 HB2 LYS A 327 25.850 1.659 1.016 1.00 33.10 H new ATOM 0 HB3 LYS A 327 24.286 1.042 0.523 1.00 33.10 H new ATOM 0 HG2 LYS A 327 23.938 2.774 2.147 1.00 33.14 H new ATOM 0 HG3 LYS A 327 23.487 1.243 2.873 1.00 33.14 H new ATOM 0 HD2 LYS A 327 25.919 1.190 3.812 1.00 64.44 H new ATOM 0 HD3 LYS A 327 25.987 2.886 3.376 1.00 64.44 H new ATOM 0 HE2 LYS A 327 25.303 2.708 5.697 1.00 55.23 H new ATOM 0 HE3 LYS A 327 23.953 3.314 4.757 1.00 55.23 H new ATOM 0 HZ1 LYS A 327 22.721 1.584 5.362 1.00 10.34 H new ATOM 0 HZ2 LYS A 327 23.895 0.465 4.860 1.00 10.34 H new ATOM 0 HZ3 LYS A 327 23.959 1.118 6.426 1.00 10.34 H new ATOM 179 N GLY A 328 23.759 -2.020 1.728 1.00 13.31 N ATOM 180 CA GLY A 328 22.582 -2.676 2.191 1.00 30.41 C ATOM 181 C GLY A 328 21.408 -2.045 1.540 1.00 21.33 C ATOM 182 O GLY A 328 21.277 -2.133 0.321 1.00 13.50 O ATOM 0 H GLY A 328 24.106 -2.352 0.828 1.00 13.31 H new ATOM 0 HA2 GLY A 328 22.622 -3.739 1.953 1.00 30.41 H new ATOM 0 HA3 GLY A 328 22.504 -2.595 3.275 1.00 30.41 H new ATOM 186 N LEU A 329 20.588 -1.375 2.287 1.00 21.42 N ATOM 187 CA LEU A 329 19.435 -0.741 1.691 1.00 40.42 C ATOM 188 C LEU A 329 19.625 0.765 1.692 1.00 43.32 C ATOM 189 O LEU A 329 19.245 1.464 0.745 1.00 30.34 O ATOM 190 CB LEU A 329 18.108 -1.152 2.366 1.00 40.53 C ATOM 191 CG LEU A 329 17.720 -2.654 2.335 1.00 43.14 C ATOM 192 CD1 LEU A 329 18.583 -3.486 3.272 1.00 53.52 C ATOM 193 CD2 LEU A 329 16.252 -2.842 2.666 1.00 41.43 C ATOM 0 H LEU A 329 20.684 -1.249 3.295 1.00 21.42 H new ATOM 0 HA LEU A 329 19.357 -1.089 0.661 1.00 40.42 H new ATOM 0 HB2 LEU A 329 18.150 -0.838 3.409 1.00 40.53 H new ATOM 0 HB3 LEU A 329 17.303 -0.588 1.895 1.00 40.53 H new ATOM 0 HG LEU A 329 17.899 -3.007 1.320 1.00 43.14 H new ATOM 0 HD11 LEU A 329 18.276 -4.531 3.218 1.00 53.52 H new ATOM 0 HD12 LEU A 329 19.629 -3.399 2.977 1.00 53.52 H new ATOM 0 HD13 LEU A 329 18.463 -3.125 4.294 1.00 53.52 H new ATOM 0 HD21 LEU A 329 16.006 -3.903 2.638 1.00 41.43 H new ATOM 0 HD22 LEU A 329 16.051 -2.449 3.663 1.00 41.43 H new ATOM 0 HD23 LEU A 329 15.643 -2.309 1.936 1.00 41.43 H new ATOM 205 N GLY A 330 20.255 1.264 2.734 1.00 32.31 N ATOM 206 CA GLY A 330 20.565 2.674 2.779 1.00 72.42 C ATOM 207 C GLY A 330 19.443 3.559 3.290 1.00 54.31 C ATOM 208 O GLY A 330 19.083 4.537 2.638 1.00 63.45 O ATOM 0 H GLY A 330 20.557 0.726 3.546 1.00 32.31 H new ATOM 0 HA2 GLY A 330 21.440 2.819 3.413 1.00 72.42 H new ATOM 0 HA3 GLY A 330 20.840 3.003 1.777 1.00 72.42 H new ATOM 212 N PHE A 331 18.885 3.220 4.418 1.00 71.12 N ATOM 213 CA PHE A 331 17.900 4.065 5.084 1.00 73.31 C ATOM 214 C PHE A 331 17.882 3.777 6.569 1.00 3.33 C ATOM 215 O PHE A 331 18.415 2.764 7.011 1.00 52.32 O ATOM 216 CB PHE A 331 16.488 3.997 4.429 1.00 12.41 C ATOM 217 CG PHE A 331 15.778 2.677 4.395 1.00 72.22 C ATOM 218 CD1 PHE A 331 15.953 1.813 3.337 1.00 71.14 C ATOM 219 CD2 PHE A 331 14.887 2.335 5.386 1.00 32.20 C ATOM 220 CE1 PHE A 331 15.259 0.626 3.274 1.00 14.44 C ATOM 221 CE2 PHE A 331 14.184 1.152 5.322 1.00 55.30 C ATOM 222 CZ PHE A 331 14.372 0.299 4.267 1.00 44.22 C ATOM 0 H PHE A 331 19.092 2.352 4.912 1.00 71.12 H new ATOM 0 HA PHE A 331 18.210 5.102 4.951 1.00 73.31 H new ATOM 0 HB2 PHE A 331 15.846 4.706 4.952 1.00 12.41 H new ATOM 0 HB3 PHE A 331 16.582 4.350 3.402 1.00 12.41 H new ATOM 0 HD1 PHE A 331 16.643 2.070 2.547 1.00 71.14 H new ATOM 0 HD2 PHE A 331 14.737 3.001 6.223 1.00 32.20 H new ATOM 0 HE1 PHE A 331 15.413 -0.047 2.443 1.00 14.44 H new ATOM 0 HE2 PHE A 331 13.484 0.897 6.104 1.00 55.30 H new ATOM 0 HZ PHE A 331 13.823 -0.629 4.217 1.00 44.22 H new ATOM 232 N SER A 332 17.321 4.663 7.316 1.00 42.21 N ATOM 233 CA SER A 332 17.260 4.546 8.741 1.00 55.52 C ATOM 234 C SER A 332 15.851 4.250 9.166 1.00 11.03 C ATOM 235 O SER A 332 14.905 4.890 8.690 1.00 35.01 O ATOM 236 CB SER A 332 17.728 5.838 9.382 1.00 4.20 C ATOM 237 OG SER A 332 19.078 6.117 9.038 1.00 73.01 O ATOM 0 H SER A 332 16.881 5.508 6.951 1.00 42.21 H new ATOM 0 HA SER A 332 17.909 3.731 9.062 1.00 55.52 H new ATOM 0 HB2 SER A 332 17.089 6.660 9.059 1.00 4.20 H new ATOM 0 HB3 SER A 332 17.632 5.766 10.465 1.00 4.20 H new ATOM 0 HG SER A 332 19.627 6.126 9.850 1.00 73.01 H new ATOM 243 N ILE A 333 15.698 3.287 10.021 1.00 23.31 N ATOM 244 CA ILE A 333 14.409 2.928 10.536 1.00 63.14 C ATOM 245 C ILE A 333 14.415 3.019 12.035 1.00 70.12 C ATOM 246 O ILE A 333 15.472 2.870 12.671 1.00 31.43 O ATOM 247 CB ILE A 333 13.960 1.504 10.094 1.00 64.31 C ATOM 248 CG1 ILE A 333 15.048 0.454 10.412 1.00 12.12 C ATOM 249 CG2 ILE A 333 13.584 1.493 8.629 1.00 24.25 C ATOM 250 CD1 ILE A 333 14.682 -0.967 10.031 1.00 40.23 C ATOM 0 H ILE A 333 16.467 2.724 10.385 1.00 23.31 H new ATOM 0 HA ILE A 333 13.690 3.634 10.121 1.00 63.14 H new ATOM 0 HB ILE A 333 13.072 1.232 10.665 1.00 64.31 H new ATOM 0 HG12 ILE A 333 15.965 0.731 9.892 1.00 12.12 H new ATOM 0 HG13 ILE A 333 15.265 0.486 11.480 1.00 12.12 H new ATOM 0 HG21 ILE A 333 13.273 0.489 8.341 1.00 24.25 H new ATOM 0 HG22 ILE A 333 12.763 2.190 8.459 1.00 24.25 H new ATOM 0 HG23 ILE A 333 14.444 1.793 8.030 1.00 24.25 H new ATOM 0 HD11 ILE A 333 15.503 -1.636 10.290 1.00 40.23 H new ATOM 0 HD12 ILE A 333 13.784 -1.269 10.570 1.00 40.23 H new ATOM 0 HD13 ILE A 333 14.496 -1.020 8.958 1.00 40.23 H new ATOM 262 N ALA A 334 13.275 3.329 12.579 1.00 10.32 N ATOM 263 CA ALA A 334 13.073 3.374 13.991 1.00 35.20 C ATOM 264 C ALA A 334 11.655 2.947 14.287 1.00 55.12 C ATOM 265 O ALA A 334 10.703 3.402 13.640 1.00 74.33 O ATOM 266 CB ALA A 334 13.351 4.766 14.554 1.00 63.12 C ATOM 0 H ALA A 334 12.443 3.562 12.038 1.00 10.32 H new ATOM 0 HA ALA A 334 13.774 2.694 14.475 1.00 35.20 H new ATOM 0 HB1 ALA A 334 13.187 4.762 15.632 1.00 63.12 H new ATOM 0 HB2 ALA A 334 14.384 5.043 14.345 1.00 63.12 H new ATOM 0 HB3 ALA A 334 12.681 5.488 14.087 1.00 63.12 H new ATOM 272 N GLY A 335 11.526 2.033 15.178 1.00 40.33 N ATOM 273 CA GLY A 335 10.255 1.550 15.602 1.00 74.43 C ATOM 274 C GLY A 335 10.455 0.276 16.350 1.00 53.43 C ATOM 275 O GLY A 335 11.587 -0.102 16.588 1.00 55.32 O ATOM 0 H GLY A 335 12.316 1.588 15.645 1.00 40.33 H new ATOM 0 HA2 GLY A 335 9.762 2.287 16.236 1.00 74.43 H new ATOM 0 HA3 GLY A 335 9.607 1.386 14.741 1.00 74.43 H new ATOM 279 N GLY A 336 9.419 -0.335 16.786 1.00 52.12 N ATOM 280 CA GLY A 336 9.538 -1.557 17.506 1.00 45.13 C ATOM 281 C GLY A 336 8.686 -1.475 18.712 1.00 11.01 C ATOM 282 O GLY A 336 8.137 -0.403 18.976 1.00 12.31 O ATOM 0 H GLY A 336 8.462 -0.007 16.657 1.00 52.12 H new ATOM 0 HA2 GLY A 336 9.231 -2.396 16.882 1.00 45.13 H new ATOM 0 HA3 GLY A 336 10.577 -1.732 17.787 1.00 45.13 H new ATOM 286 N VAL A 337 8.553 -2.560 19.440 1.00 31.02 N ATOM 287 CA VAL A 337 7.791 -2.566 20.686 1.00 14.13 C ATOM 288 C VAL A 337 8.336 -1.498 21.663 1.00 11.12 C ATOM 289 O VAL A 337 9.396 -1.670 22.286 1.00 74.33 O ATOM 290 CB VAL A 337 7.802 -3.969 21.363 1.00 41.22 C ATOM 291 CG1 VAL A 337 7.027 -3.954 22.679 1.00 41.41 C ATOM 292 CG2 VAL A 337 7.209 -5.017 20.432 1.00 12.52 C ATOM 0 H VAL A 337 8.963 -3.461 19.195 1.00 31.02 H new ATOM 0 HA VAL A 337 6.758 -2.324 20.436 1.00 14.13 H new ATOM 0 HB VAL A 337 8.840 -4.224 21.575 1.00 41.22 H new ATOM 0 HG11 VAL A 337 7.053 -4.947 23.128 1.00 41.41 H new ATOM 0 HG12 VAL A 337 7.482 -3.236 23.361 1.00 41.41 H new ATOM 0 HG13 VAL A 337 5.992 -3.668 22.489 1.00 41.41 H new ATOM 0 HG21 VAL A 337 7.225 -5.990 20.922 1.00 12.52 H new ATOM 0 HG22 VAL A 337 6.180 -4.749 20.191 1.00 12.52 H new ATOM 0 HG23 VAL A 337 7.796 -5.063 19.515 1.00 12.52 H new ATOM 302 N GLY A 338 7.644 -0.375 21.717 1.00 10.52 N ATOM 303 CA GLY A 338 8.021 0.713 22.586 1.00 34.43 C ATOM 304 C GLY A 338 9.004 1.674 21.929 1.00 11.21 C ATOM 305 O GLY A 338 9.499 2.581 22.574 1.00 12.04 O ATOM 0 H GLY A 338 6.808 -0.196 21.160 1.00 10.52 H new ATOM 0 HA2 GLY A 338 7.127 1.261 22.885 1.00 34.43 H new ATOM 0 HA3 GLY A 338 8.466 0.309 23.495 1.00 34.43 H new ATOM 309 N ASN A 339 9.405 1.373 20.704 1.00 74.31 N ATOM 310 CA ASN A 339 10.272 2.278 19.926 1.00 23.32 C ATOM 311 C ASN A 339 9.470 2.904 18.787 1.00 24.04 C ATOM 312 O ASN A 339 10.002 3.611 17.942 1.00 61.15 O ATOM 313 CB ASN A 339 11.519 1.545 19.373 1.00 72.14 C ATOM 314 CG ASN A 339 12.554 2.496 18.722 1.00 42.33 C ATOM 315 OD1 ASN A 339 12.677 3.638 19.102 1.00 22.10 O ATOM 316 ND2 ASN A 339 13.351 1.994 17.795 1.00 32.54 N ATOM 0 H ASN A 339 9.151 0.513 20.218 1.00 74.31 H new ATOM 0 HA ASN A 339 10.629 3.063 20.593 1.00 23.32 H new ATOM 0 HB2 ASN A 339 11.999 0.998 20.184 1.00 72.14 H new ATOM 0 HB3 ASN A 339 11.201 0.807 18.636 1.00 72.14 H new ATOM 0 HD21 ASN A 339 14.086 2.572 17.387 1.00 32.54 H new ATOM 0 HD22 ASN A 339 13.231 1.029 17.488 1.00 32.54 H new ATOM 323 N GLN A 340 8.194 2.601 18.747 1.00 73.30 N ATOM 324 CA GLN A 340 7.363 3.023 17.667 1.00 12.35 C ATOM 325 C GLN A 340 7.244 4.535 17.496 1.00 44.42 C ATOM 326 O GLN A 340 6.918 5.270 18.418 1.00 32.11 O ATOM 327 CB GLN A 340 6.020 2.294 17.619 1.00 41.10 C ATOM 328 CG GLN A 340 5.315 1.991 18.951 1.00 50.11 C ATOM 329 CD GLN A 340 5.242 3.142 19.911 1.00 5.41 C ATOM 330 OE1 GLN A 340 6.073 3.263 20.794 1.00 51.45 O ATOM 331 NE2 GLN A 340 4.321 4.033 19.690 1.00 31.15 N ATOM 0 H GLN A 340 7.713 2.057 19.463 1.00 73.30 H new ATOM 0 HA GLN A 340 7.906 2.707 16.776 1.00 12.35 H new ATOM 0 HB2 GLN A 340 5.340 2.888 17.009 1.00 41.10 H new ATOM 0 HB3 GLN A 340 6.172 1.348 17.099 1.00 41.10 H new ATOM 0 HG2 GLN A 340 4.301 1.651 18.738 1.00 50.11 H new ATOM 0 HG3 GLN A 340 5.833 1.165 19.438 1.00 50.11 H new ATOM 0 HE21 GLN A 340 3.645 3.892 18.940 1.00 31.15 H new ATOM 0 HE22 GLN A 340 4.275 4.873 20.267 1.00 31.15 H new ATOM 340 N HIS A 341 7.518 4.957 16.279 1.00 52.01 N ATOM 341 CA HIS A 341 7.529 6.356 15.888 1.00 10.42 C ATOM 342 C HIS A 341 6.113 6.954 15.957 1.00 21.31 C ATOM 343 O HIS A 341 5.934 8.131 16.256 1.00 10.13 O ATOM 344 CB HIS A 341 8.122 6.443 14.464 1.00 53.02 C ATOM 345 CG HIS A 341 8.312 7.825 13.899 1.00 30.00 C ATOM 346 ND1 HIS A 341 9.509 8.511 13.938 1.00 73.45 N ATOM 347 CD2 HIS A 341 7.449 8.626 13.226 1.00 62.44 C ATOM 348 CE1 HIS A 341 9.339 9.674 13.305 1.00 12.11 C ATOM 349 NE2 HIS A 341 8.108 9.793 12.853 1.00 71.32 N ATOM 0 H HIS A 341 7.745 4.323 15.513 1.00 52.01 H new ATOM 0 HA HIS A 341 8.143 6.940 16.573 1.00 10.42 H new ATOM 0 HB2 HIS A 341 9.089 5.939 14.466 1.00 53.02 H new ATOM 0 HB3 HIS A 341 7.473 5.885 13.789 1.00 53.02 H new ATOM 0 HD2 HIS A 341 6.416 8.395 13.014 1.00 62.44 H new ATOM 0 HE1 HIS A 341 10.110 10.420 13.180 1.00 12.11 H new ATOM 0 HE2 HIS A 341 7.717 10.580 12.335 1.00 71.32 H new ATOM 357 N ILE A 342 5.121 6.135 15.689 1.00 64.05 N ATOM 358 CA ILE A 342 3.745 6.576 15.769 1.00 24.41 C ATOM 359 C ILE A 342 3.089 6.021 17.037 1.00 61.32 C ATOM 360 O ILE A 342 2.979 4.799 17.212 1.00 1.54 O ATOM 361 CB ILE A 342 2.927 6.199 14.492 1.00 22.23 C ATOM 362 CG1 ILE A 342 3.502 6.918 13.250 1.00 41.01 C ATOM 363 CG2 ILE A 342 1.438 6.528 14.657 1.00 21.20 C ATOM 364 CD1 ILE A 342 3.479 8.440 13.317 1.00 33.44 C ATOM 0 H ILE A 342 5.240 5.160 15.414 1.00 64.05 H new ATOM 0 HA ILE A 342 3.746 7.665 15.823 1.00 24.41 H new ATOM 0 HB ILE A 342 3.015 5.122 14.350 1.00 22.23 H new ATOM 0 HG12 ILE A 342 4.532 6.592 13.105 1.00 41.01 H new ATOM 0 HG13 ILE A 342 2.940 6.600 12.372 1.00 41.01 H new ATOM 0 HG21 ILE A 342 0.902 6.252 13.749 1.00 21.20 H new ATOM 0 HG22 ILE A 342 1.033 5.970 15.501 1.00 21.20 H new ATOM 0 HG23 ILE A 342 1.319 7.596 14.838 1.00 21.20 H new ATOM 0 HD11 ILE A 342 3.903 8.851 12.401 1.00 33.44 H new ATOM 0 HD12 ILE A 342 2.451 8.784 13.427 1.00 33.44 H new ATOM 0 HD13 ILE A 342 4.067 8.776 14.171 1.00 33.44 H new ATOM 376 N PRO A 343 2.712 6.909 17.980 1.00 53.41 N ATOM 377 CA PRO A 343 2.042 6.515 19.220 1.00 43.44 C ATOM 378 C PRO A 343 0.738 5.766 18.947 1.00 42.03 C ATOM 379 O PRO A 343 -0.217 6.334 18.433 1.00 5.50 O ATOM 380 CB PRO A 343 1.756 7.848 19.926 1.00 4.54 C ATOM 381 CG PRO A 343 2.725 8.808 19.337 1.00 14.43 C ATOM 382 CD PRO A 343 2.931 8.370 17.918 1.00 32.24 C ATOM 0 HA PRO A 343 2.653 5.835 19.814 1.00 43.44 H new ATOM 0 HB2 PRO A 343 0.728 8.171 19.759 1.00 4.54 H new ATOM 0 HB3 PRO A 343 1.891 7.761 21.004 1.00 4.54 H new ATOM 0 HG2 PRO A 343 2.339 9.827 19.379 1.00 14.43 H new ATOM 0 HG3 PRO A 343 3.665 8.800 19.888 1.00 14.43 H new ATOM 0 HD2 PRO A 343 2.227 8.854 17.241 1.00 32.24 H new ATOM 0 HD3 PRO A 343 3.933 8.612 17.563 1.00 32.24 H new ATOM 390 N GLY A 344 0.734 4.484 19.260 1.00 31.34 N ATOM 391 CA GLY A 344 -0.440 3.674 19.045 1.00 42.32 C ATOM 392 C GLY A 344 -0.225 2.665 17.943 1.00 64.44 C ATOM 393 O GLY A 344 -0.874 1.633 17.910 1.00 65.24 O ATOM 0 H GLY A 344 1.529 3.987 19.662 1.00 31.34 H new ATOM 0 HA2 GLY A 344 -0.699 3.156 19.968 1.00 42.32 H new ATOM 0 HA3 GLY A 344 -1.284 4.316 18.792 1.00 42.32 H new ATOM 397 N ASP A 345 0.715 2.951 17.072 1.00 12.23 N ATOM 398 CA ASP A 345 1.011 2.084 15.941 1.00 1.14 C ATOM 399 C ASP A 345 2.390 1.471 16.129 1.00 33.51 C ATOM 400 O ASP A 345 3.411 2.151 15.990 1.00 35.12 O ATOM 401 CB ASP A 345 0.965 2.883 14.644 1.00 32.33 C ATOM 402 CG ASP A 345 1.229 2.032 13.430 1.00 42.53 C ATOM 403 OD1 ASP A 345 0.298 1.426 12.872 1.00 71.11 O ATOM 404 OD2 ASP A 345 2.376 1.971 13.006 1.00 61.23 O ATOM 0 H ASP A 345 1.298 3.787 17.122 1.00 12.23 H new ATOM 0 HA ASP A 345 0.266 1.290 15.886 1.00 1.14 H new ATOM 0 HB2 ASP A 345 -0.013 3.355 14.547 1.00 32.33 H new ATOM 0 HB3 ASP A 345 1.703 3.684 14.689 1.00 32.33 H new ATOM 409 N ASN A 346 2.429 0.201 16.449 1.00 72.32 N ATOM 410 CA ASN A 346 3.666 -0.474 16.802 1.00 51.20 C ATOM 411 C ASN A 346 4.400 -0.966 15.554 1.00 63.21 C ATOM 412 O ASN A 346 4.570 -2.162 15.340 1.00 43.11 O ATOM 413 CB ASN A 346 3.365 -1.656 17.716 1.00 1.33 C ATOM 414 CG ASN A 346 4.560 -2.117 18.516 1.00 73.12 C ATOM 415 OD1 ASN A 346 5.705 -1.869 18.169 1.00 42.30 O ATOM 416 ND2 ASN A 346 4.304 -2.853 19.543 1.00 21.54 N ATOM 0 H ASN A 346 1.605 -0.400 16.474 1.00 72.32 H new ATOM 0 HA ASN A 346 4.307 0.239 17.320 1.00 51.20 H new ATOM 0 HB2 ASN A 346 2.563 -1.381 18.401 1.00 1.33 H new ATOM 0 HB3 ASN A 346 2.998 -2.487 17.114 1.00 1.33 H new ATOM 0 HD21 ASN A 346 5.068 -3.247 20.092 1.00 21.54 H new ATOM 0 HD22 ASN A 346 3.337 -3.042 19.807 1.00 21.54 H new ATOM 423 N SER A 347 4.800 -0.061 14.727 1.00 31.44 N ATOM 424 CA SER A 347 5.499 -0.451 13.529 1.00 24.22 C ATOM 425 C SER A 347 6.887 0.123 13.479 1.00 41.44 C ATOM 426 O SER A 347 7.321 0.876 14.375 1.00 13.51 O ATOM 427 CB SER A 347 4.738 0.007 12.319 1.00 71.11 C ATOM 428 OG SER A 347 3.406 -0.324 12.454 1.00 1.41 O ATOM 0 H SER A 347 4.663 0.943 14.846 1.00 31.44 H new ATOM 0 HA SER A 347 5.577 -1.538 13.538 1.00 24.22 H new ATOM 0 HB2 SER A 347 4.844 1.085 12.197 1.00 71.11 H new ATOM 0 HB3 SER A 347 5.149 -0.457 11.422 1.00 71.11 H new ATOM 0 HG SER A 347 2.950 0.364 12.982 1.00 1.41 H new ATOM 434 N ILE A 348 7.574 -0.240 12.439 1.00 55.42 N ATOM 435 CA ILE A 348 8.879 0.239 12.160 1.00 70.32 C ATOM 436 C ILE A 348 8.708 1.359 11.153 1.00 1.12 C ATOM 437 O ILE A 348 7.982 1.188 10.173 1.00 24.31 O ATOM 438 CB ILE A 348 9.719 -0.886 11.529 1.00 21.35 C ATOM 439 CG1 ILE A 348 9.584 -2.198 12.333 1.00 42.51 C ATOM 440 CG2 ILE A 348 11.175 -0.472 11.406 1.00 4.13 C ATOM 441 CD1 ILE A 348 10.016 -2.110 13.787 1.00 53.12 C ATOM 0 H ILE A 348 7.224 -0.899 11.744 1.00 55.42 H new ATOM 0 HA ILE A 348 9.382 0.579 13.065 1.00 70.32 H new ATOM 0 HB ILE A 348 9.334 -1.068 10.526 1.00 21.35 H new ATOM 0 HG12 ILE A 348 8.544 -2.522 12.298 1.00 42.51 H new ATOM 0 HG13 ILE A 348 10.175 -2.970 11.841 1.00 42.51 H new ATOM 0 HG21 ILE A 348 11.747 -1.284 10.957 1.00 4.13 H new ATOM 0 HG22 ILE A 348 11.249 0.415 10.777 1.00 4.13 H new ATOM 0 HG23 ILE A 348 11.575 -0.250 12.395 1.00 4.13 H new ATOM 0 HD11 ILE A 348 9.883 -3.080 14.265 1.00 53.12 H new ATOM 0 HD12 ILE A 348 11.066 -1.821 13.838 1.00 53.12 H new ATOM 0 HD13 ILE A 348 9.409 -1.366 14.302 1.00 53.12 H new ATOM 453 N TYR A 349 9.327 2.483 11.381 1.00 50.42 N ATOM 454 CA TYR A 349 9.148 3.621 10.512 1.00 30.22 C ATOM 455 C TYR A 349 10.443 4.128 9.954 1.00 12.32 C ATOM 456 O TYR A 349 11.435 4.284 10.678 1.00 23.32 O ATOM 457 CB TYR A 349 8.397 4.747 11.233 1.00 33.03 C ATOM 458 CG TYR A 349 6.914 4.540 11.291 1.00 64.52 C ATOM 459 CD1 TYR A 349 6.327 3.729 12.248 1.00 11.43 C ATOM 460 CD2 TYR A 349 6.099 5.151 10.365 1.00 4.42 C ATOM 461 CE1 TYR A 349 4.967 3.532 12.263 1.00 71.03 C ATOM 462 CE2 TYR A 349 4.745 4.966 10.377 1.00 2.41 C ATOM 463 CZ TYR A 349 4.180 4.153 11.318 1.00 21.22 C ATOM 464 OH TYR A 349 2.823 3.961 11.319 1.00 52.54 O ATOM 0 H TYR A 349 9.963 2.640 12.163 1.00 50.42 H new ATOM 0 HA TYR A 349 8.548 3.279 9.669 1.00 30.22 H new ATOM 0 HB2 TYR A 349 8.783 4.837 12.249 1.00 33.03 H new ATOM 0 HB3 TYR A 349 8.604 5.691 10.729 1.00 33.03 H new ATOM 0 HD1 TYR A 349 6.945 3.246 12.991 1.00 11.43 H new ATOM 0 HD2 TYR A 349 6.539 5.790 9.613 1.00 4.42 H new ATOM 0 HE1 TYR A 349 4.518 2.895 13.011 1.00 71.03 H new ATOM 0 HE2 TYR A 349 4.124 5.461 9.645 1.00 2.41 H new ATOM 0 HH TYR A 349 2.622 3.047 11.611 1.00 52.54 H new ATOM 474 N VAL A 350 10.437 4.351 8.660 1.00 65.02 N ATOM 475 CA VAL A 350 11.575 4.896 7.953 1.00 31.40 C ATOM 476 C VAL A 350 11.771 6.338 8.392 1.00 41.33 C ATOM 477 O VAL A 350 10.943 7.185 8.126 1.00 2.11 O ATOM 478 CB VAL A 350 11.363 4.840 6.417 1.00 54.43 C ATOM 479 CG1 VAL A 350 12.570 5.396 5.672 1.00 41.21 C ATOM 480 CG2 VAL A 350 11.070 3.414 5.972 1.00 30.10 C ATOM 0 H VAL A 350 9.634 4.157 8.062 1.00 65.02 H new ATOM 0 HA VAL A 350 12.457 4.301 8.189 1.00 31.40 H new ATOM 0 HB VAL A 350 10.504 5.465 6.174 1.00 54.43 H new ATOM 0 HG11 VAL A 350 12.391 5.343 4.598 1.00 41.21 H new ATOM 0 HG12 VAL A 350 12.730 6.434 5.962 1.00 41.21 H new ATOM 0 HG13 VAL A 350 13.454 4.809 5.922 1.00 41.21 H new ATOM 0 HG21 VAL A 350 10.924 3.393 4.892 1.00 30.10 H new ATOM 0 HG22 VAL A 350 11.909 2.770 6.238 1.00 30.10 H new ATOM 0 HG23 VAL A 350 10.167 3.056 6.467 1.00 30.10 H new ATOM 490 N THR A 351 12.839 6.588 9.074 1.00 24.44 N ATOM 491 CA THR A 351 13.115 7.895 9.623 1.00 22.23 C ATOM 492 C THR A 351 13.951 8.696 8.653 1.00 72.42 C ATOM 493 O THR A 351 13.887 9.919 8.612 1.00 14.21 O ATOM 494 CB THR A 351 13.920 7.723 10.897 1.00 23.42 C ATOM 495 OG1 THR A 351 13.359 6.621 11.636 1.00 11.02 O ATOM 496 CG2 THR A 351 13.860 8.979 11.761 1.00 63.23 C ATOM 0 H THR A 351 13.558 5.892 9.274 1.00 24.44 H new ATOM 0 HA THR A 351 12.174 8.410 9.815 1.00 22.23 H new ATOM 0 HB THR A 351 14.962 7.537 10.637 1.00 23.42 H new ATOM 0 HG1 THR A 351 13.866 6.491 12.464 1.00 11.02 H new ATOM 0 HG21 THR A 351 14.446 8.826 12.667 1.00 63.23 H new ATOM 0 HG22 THR A 351 14.267 9.823 11.204 1.00 63.23 H new ATOM 0 HG23 THR A 351 12.824 9.187 12.030 1.00 63.23 H new ATOM 504 N LYS A 352 14.729 8.011 7.874 1.00 63.33 N ATOM 505 CA LYS A 352 15.596 8.670 6.975 1.00 4.41 C ATOM 506 C LYS A 352 15.903 7.740 5.859 1.00 30.44 C ATOM 507 O LYS A 352 15.822 6.546 6.030 1.00 3.15 O ATOM 508 CB LYS A 352 16.917 9.013 7.672 1.00 24.43 C ATOM 509 CG LYS A 352 17.743 10.006 6.902 1.00 24.40 C ATOM 510 CD LYS A 352 19.117 10.235 7.504 1.00 21.13 C ATOM 511 CE LYS A 352 19.892 11.276 6.696 1.00 72.32 C ATOM 512 NZ LYS A 352 20.096 10.866 5.288 1.00 23.03 N ATOM 0 H LYS A 352 14.774 6.992 7.850 1.00 63.33 H new ATOM 0 HA LYS A 352 15.118 9.583 6.618 1.00 4.41 H new ATOM 0 HB2 LYS A 352 16.706 9.414 8.663 1.00 24.43 H new ATOM 0 HB3 LYS A 352 17.495 8.100 7.814 1.00 24.43 H new ATOM 0 HG2 LYS A 352 17.857 9.656 5.876 1.00 24.40 H new ATOM 0 HG3 LYS A 352 17.210 10.956 6.858 1.00 24.40 H new ATOM 0 HD2 LYS A 352 19.016 10.569 8.537 1.00 21.13 H new ATOM 0 HD3 LYS A 352 19.672 9.297 7.525 1.00 21.13 H new ATOM 0 HE2 LYS A 352 19.354 12.224 6.720 1.00 72.32 H new ATOM 0 HE3 LYS A 352 20.861 11.447 7.165 1.00 72.32 H new ATOM 0 HZ1 LYS A 352 20.089 11.707 4.677 1.00 23.03 H new ATOM 0 HZ2 LYS A 352 21.011 10.380 5.197 1.00 23.03 H new ATOM 0 HZ3 LYS A 352 19.332 10.222 5.000 1.00 23.03 H new ATOM 526 N ILE A 353 16.213 8.275 4.734 1.00 52.34 N ATOM 527 CA ILE A 353 16.732 7.517 3.648 1.00 33.41 C ATOM 528 C ILE A 353 18.114 8.093 3.396 1.00 31.14 C ATOM 529 O ILE A 353 18.330 9.298 3.643 1.00 44.24 O ATOM 530 CB ILE A 353 15.823 7.615 2.383 1.00 10.30 C ATOM 531 CG1 ILE A 353 14.426 7.068 2.707 1.00 13.12 C ATOM 532 CG2 ILE A 353 16.427 6.831 1.223 1.00 21.21 C ATOM 533 CD1 ILE A 353 13.416 7.250 1.597 1.00 33.44 C ATOM 0 H ILE A 353 16.112 9.270 4.536 1.00 52.34 H new ATOM 0 HA ILE A 353 16.772 6.453 3.880 1.00 33.41 H new ATOM 0 HB ILE A 353 15.746 8.662 2.090 1.00 10.30 H new ATOM 0 HG12 ILE A 353 14.509 6.006 2.937 1.00 13.12 H new ATOM 0 HG13 ILE A 353 14.055 7.561 3.605 1.00 13.12 H new ATOM 0 HG21 ILE A 353 15.778 6.913 0.351 1.00 21.21 H new ATOM 0 HG22 ILE A 353 17.410 7.236 0.982 1.00 21.21 H new ATOM 0 HG23 ILE A 353 16.526 5.783 1.505 1.00 21.21 H new ATOM 0 HD11 ILE A 353 12.456 6.837 1.907 1.00 33.44 H new ATOM 0 HD12 ILE A 353 13.301 8.312 1.380 1.00 33.44 H new ATOM 0 HD13 ILE A 353 13.762 6.733 0.702 1.00 33.44 H new ATOM 545 N ILE A 354 19.057 7.269 3.032 1.00 43.41 N ATOM 546 CA ILE A 354 20.395 7.740 2.794 1.00 10.34 C ATOM 547 C ILE A 354 20.477 8.363 1.430 1.00 41.53 C ATOM 548 O ILE A 354 20.033 7.781 0.438 1.00 74.23 O ATOM 549 CB ILE A 354 21.472 6.622 2.985 1.00 2.33 C ATOM 550 CG1 ILE A 354 21.496 6.144 4.451 1.00 43.21 C ATOM 551 CG2 ILE A 354 22.868 7.077 2.542 1.00 73.25 C ATOM 552 CD1 ILE A 354 21.758 7.245 5.466 1.00 63.24 C ATOM 0 H ILE A 354 18.925 6.267 2.893 1.00 43.41 H new ATOM 0 HA ILE A 354 20.621 8.498 3.544 1.00 10.34 H new ATOM 0 HB ILE A 354 21.190 5.788 2.343 1.00 2.33 H new ATOM 0 HG12 ILE A 354 20.541 5.673 4.683 1.00 43.21 H new ATOM 0 HG13 ILE A 354 22.264 5.378 4.558 1.00 43.21 H new ATOM 0 HG21 ILE A 354 23.580 6.266 2.694 1.00 73.25 H new ATOM 0 HG22 ILE A 354 22.845 7.346 1.486 1.00 73.25 H new ATOM 0 HG23 ILE A 354 23.172 7.943 3.130 1.00 73.25 H new ATOM 0 HD11 ILE A 354 21.758 6.821 6.470 1.00 63.24 H new ATOM 0 HD12 ILE A 354 22.727 7.702 5.265 1.00 63.24 H new ATOM 0 HD13 ILE A 354 20.977 8.002 5.391 1.00 63.24 H new ATOM 564 N GLU A 355 21.013 9.537 1.410 1.00 12.41 N ATOM 565 CA GLU A 355 21.166 10.337 0.247 1.00 31.45 C ATOM 566 C GLU A 355 22.093 9.677 -0.757 1.00 53.54 C ATOM 567 O GLU A 355 23.302 9.614 -0.585 1.00 14.21 O ATOM 568 CB GLU A 355 21.581 11.803 0.602 1.00 71.54 C ATOM 569 CG GLU A 355 22.611 11.979 1.750 1.00 1.45 C ATOM 570 CD GLU A 355 22.031 11.674 3.134 1.00 12.40 C ATOM 571 OE1 GLU A 355 21.385 12.544 3.745 1.00 41.45 O ATOM 572 OE2 GLU A 355 22.137 10.512 3.607 1.00 54.44 O ATOM 0 H GLU A 355 21.375 9.986 2.251 1.00 12.41 H new ATOM 0 HA GLU A 355 20.194 10.415 -0.239 1.00 31.45 H new ATOM 0 HB2 GLU A 355 21.990 12.267 -0.295 1.00 71.54 H new ATOM 0 HB3 GLU A 355 20.680 12.357 0.866 1.00 71.54 H new ATOM 0 HG2 GLU A 355 23.463 11.324 1.568 1.00 1.45 H new ATOM 0 HG3 GLU A 355 22.987 13.002 1.738 1.00 1.45 H new ATOM 579 N GLY A 356 21.485 9.148 -1.795 1.00 14.42 N ATOM 580 CA GLY A 356 22.216 8.457 -2.814 1.00 12.45 C ATOM 581 C GLY A 356 22.232 6.953 -2.596 1.00 44.42 C ATOM 582 O GLY A 356 22.747 6.214 -3.437 1.00 42.13 O ATOM 0 H GLY A 356 20.478 9.188 -1.949 1.00 14.42 H new ATOM 0 HA2 GLY A 356 21.774 8.676 -3.786 1.00 12.45 H new ATOM 0 HA3 GLY A 356 23.240 8.829 -2.838 1.00 12.45 H new ATOM 586 N GLY A 357 21.626 6.511 -1.497 1.00 72.31 N ATOM 587 CA GLY A 357 21.565 5.098 -1.159 1.00 41.44 C ATOM 588 C GLY A 357 20.654 4.311 -2.091 1.00 73.01 C ATOM 589 O GLY A 357 19.909 4.901 -2.894 1.00 3.23 O ATOM 0 H GLY A 357 21.167 7.121 -0.821 1.00 72.31 H new ATOM 0 HA2 GLY A 357 22.569 4.676 -1.197 1.00 41.44 H new ATOM 0 HA3 GLY A 357 21.211 4.989 -0.134 1.00 41.44 H new ATOM 593 N ALA A 358 20.671 2.987 -1.952 1.00 12.32 N ATOM 594 CA ALA A 358 19.885 2.086 -2.799 1.00 54.13 C ATOM 595 C ALA A 358 18.412 2.423 -2.724 1.00 3.21 C ATOM 596 O ALA A 358 17.732 2.524 -3.739 1.00 44.42 O ATOM 597 CB ALA A 358 20.111 0.633 -2.395 1.00 44.34 C ATOM 0 H ALA A 358 21.231 2.506 -1.248 1.00 12.32 H new ATOM 0 HA ALA A 358 20.218 2.219 -3.828 1.00 54.13 H new ATOM 0 HB1 ALA A 358 19.518 -0.019 -3.036 1.00 44.34 H new ATOM 0 HB2 ALA A 358 21.167 0.385 -2.503 1.00 44.34 H new ATOM 0 HB3 ALA A 358 19.809 0.493 -1.357 1.00 44.34 H new ATOM 603 N ALA A 359 17.930 2.663 -1.533 1.00 53.00 N ATOM 604 CA ALA A 359 16.538 2.981 -1.366 1.00 73.33 C ATOM 605 C ALA A 359 16.200 4.412 -1.805 1.00 42.04 C ATOM 606 O ALA A 359 15.036 4.779 -1.896 1.00 22.05 O ATOM 607 CB ALA A 359 16.065 2.703 0.039 1.00 41.05 C ATOM 0 H ALA A 359 18.476 2.645 -0.671 1.00 53.00 H new ATOM 0 HA ALA A 359 15.990 2.316 -2.034 1.00 73.33 H new ATOM 0 HB1 ALA A 359 15.008 2.956 0.124 1.00 41.05 H new ATOM 0 HB2 ALA A 359 16.204 1.646 0.267 1.00 41.05 H new ATOM 0 HB3 ALA A 359 16.640 3.305 0.742 1.00 41.05 H new ATOM 613 N HIS A 360 17.206 5.204 -2.072 1.00 51.52 N ATOM 614 CA HIS A 360 16.980 6.547 -2.552 1.00 31.44 C ATOM 615 C HIS A 360 17.039 6.524 -4.085 1.00 0.31 C ATOM 616 O HIS A 360 16.508 7.402 -4.756 1.00 35.40 O ATOM 617 CB HIS A 360 18.040 7.504 -1.981 1.00 61.43 C ATOM 618 CG HIS A 360 17.729 8.979 -2.108 1.00 33.44 C ATOM 619 ND1 HIS A 360 17.277 9.592 -3.256 1.00 32.55 N ATOM 620 CD2 HIS A 360 17.826 9.962 -1.183 1.00 51.03 C ATOM 621 CE1 HIS A 360 17.127 10.893 -3.002 1.00 4.11 C ATOM 622 NE2 HIS A 360 17.448 11.170 -1.757 1.00 62.44 N ATOM 0 H HIS A 360 18.187 4.946 -1.966 1.00 51.52 H new ATOM 0 HA HIS A 360 16.003 6.904 -2.226 1.00 31.44 H new ATOM 0 HB2 HIS A 360 18.182 7.271 -0.926 1.00 61.43 H new ATOM 0 HB3 HIS A 360 18.988 7.307 -2.482 1.00 61.43 H new ATOM 0 HD1 HIS A 360 17.089 9.131 -4.146 1.00 32.55 H new ATOM 0 HD2 HIS A 360 18.147 9.829 -0.160 1.00 51.03 H new ATOM 0 HE1 HIS A 360 16.787 11.622 -3.723 1.00 4.11 H new ATOM 630 N LYS A 361 17.735 5.536 -4.629 1.00 31.44 N ATOM 631 CA LYS A 361 17.817 5.390 -6.075 1.00 2.21 C ATOM 632 C LYS A 361 16.681 4.509 -6.576 1.00 0.14 C ATOM 633 O LYS A 361 15.842 4.930 -7.354 1.00 33.23 O ATOM 634 CB LYS A 361 19.132 4.686 -6.446 1.00 24.10 C ATOM 635 CG LYS A 361 20.423 5.406 -6.079 1.00 14.05 C ATOM 636 CD LYS A 361 20.619 6.693 -6.857 1.00 51.04 C ATOM 637 CE LYS A 361 21.976 7.303 -6.541 1.00 63.34 C ATOM 638 NZ LYS A 361 22.223 8.549 -7.308 1.00 43.53 N ATOM 0 H LYS A 361 18.246 4.831 -4.098 1.00 31.44 H new ATOM 0 HA LYS A 361 17.761 6.382 -6.523 1.00 2.21 H new ATOM 0 HB2 LYS A 361 19.141 3.707 -5.966 1.00 24.10 H new ATOM 0 HB3 LYS A 361 19.133 4.513 -7.522 1.00 24.10 H new ATOM 0 HG2 LYS A 361 20.419 5.629 -5.012 1.00 14.05 H new ATOM 0 HG3 LYS A 361 21.268 4.743 -6.263 1.00 14.05 H new ATOM 0 HD2 LYS A 361 20.543 6.494 -7.926 1.00 51.04 H new ATOM 0 HD3 LYS A 361 19.828 7.400 -6.607 1.00 51.04 H new ATOM 0 HE2 LYS A 361 22.036 7.517 -5.474 1.00 63.34 H new ATOM 0 HE3 LYS A 361 22.759 6.579 -6.766 1.00 63.34 H new ATOM 0 HZ1 LYS A 361 23.159 8.929 -7.061 1.00 43.53 H new ATOM 0 HZ2 LYS A 361 22.192 8.342 -8.327 1.00 43.53 H new ATOM 0 HZ3 LYS A 361 21.492 9.251 -7.075 1.00 43.53 H new ATOM 652 N ASP A 362 16.673 3.303 -6.084 1.00 32.14 N ATOM 653 CA ASP A 362 15.695 2.292 -6.442 1.00 51.21 C ATOM 654 C ASP A 362 14.506 2.376 -5.599 1.00 42.45 C ATOM 655 O ASP A 362 13.402 2.364 -6.077 1.00 42.23 O ATOM 656 CB ASP A 362 16.254 0.910 -6.217 1.00 53.42 C ATOM 657 CG ASP A 362 15.194 -0.170 -6.446 1.00 41.34 C ATOM 658 OD1 ASP A 362 14.707 -0.332 -7.580 1.00 62.02 O ATOM 659 OD2 ASP A 362 14.770 -0.807 -5.463 1.00 72.41 O ATOM 0 H ASP A 362 17.361 2.978 -5.404 1.00 32.14 H new ATOM 0 HA ASP A 362 15.447 2.467 -7.489 1.00 51.21 H new ATOM 0 HB2 ASP A 362 17.095 0.743 -6.889 1.00 53.42 H new ATOM 0 HB3 ASP A 362 16.639 0.833 -5.200 1.00 53.42 H new ATOM 664 N GLY A 363 14.787 2.529 -4.334 1.00 63.05 N ATOM 665 CA GLY A 363 13.847 2.288 -3.232 1.00 53.32 C ATOM 666 C GLY A 363 12.438 2.761 -3.346 1.00 75.20 C ATOM 667 O GLY A 363 11.594 2.163 -2.715 1.00 33.44 O ATOM 0 H GLY A 363 15.705 2.835 -4.013 1.00 63.05 H new ATOM 0 HA2 GLY A 363 13.816 1.212 -3.060 1.00 53.32 H new ATOM 0 HA3 GLY A 363 14.272 2.742 -2.337 1.00 53.32 H new ATOM 671 N LYS A 364 12.174 3.787 -4.154 1.00 11.40 N ATOM 672 CA LYS A 364 10.814 4.374 -4.340 1.00 24.32 C ATOM 673 C LYS A 364 10.055 4.492 -2.980 1.00 25.01 C ATOM 674 O LYS A 364 8.839 4.364 -2.908 1.00 32.32 O ATOM 675 CB LYS A 364 9.960 3.621 -5.482 1.00 54.24 C ATOM 676 CG LYS A 364 9.395 2.167 -5.228 1.00 10.54 C ATOM 677 CD LYS A 364 10.431 1.011 -5.250 1.00 32.15 C ATOM 678 CE LYS A 364 11.063 0.744 -6.616 1.00 52.43 C ATOM 679 NZ LYS A 364 12.183 -0.262 -6.521 1.00 74.40 N ATOM 0 H LYS A 364 12.893 4.250 -4.710 1.00 11.40 H new ATOM 0 HA LYS A 364 10.949 5.390 -4.712 1.00 24.32 H new ATOM 0 HB2 LYS A 364 9.110 4.260 -5.723 1.00 54.24 H new ATOM 0 HB3 LYS A 364 10.585 3.573 -6.373 1.00 54.24 H new ATOM 0 HG2 LYS A 364 8.895 2.159 -4.260 1.00 10.54 H new ATOM 0 HG3 LYS A 364 8.635 1.959 -5.981 1.00 10.54 H new ATOM 0 HD2 LYS A 364 11.223 1.238 -4.537 1.00 32.15 H new ATOM 0 HD3 LYS A 364 9.944 0.099 -4.906 1.00 32.15 H new ATOM 0 HE2 LYS A 364 10.302 0.378 -7.305 1.00 52.43 H new ATOM 0 HE3 LYS A 364 11.445 1.677 -7.030 1.00 52.43 H new ATOM 0 HZ1 LYS A 364 12.799 -0.175 -7.354 1.00 74.40 H new ATOM 0 HZ2 LYS A 364 12.738 -0.083 -5.660 1.00 74.40 H new ATOM 0 HZ3 LYS A 364 11.785 -1.222 -6.483 1.00 74.40 H new ATOM 693 N LEU A 365 10.828 4.825 -1.947 1.00 12.53 N ATOM 694 CA LEU A 365 10.412 4.794 -0.551 1.00 3.31 C ATOM 695 C LEU A 365 10.241 6.219 -0.014 1.00 42.12 C ATOM 696 O LEU A 365 10.818 7.173 -0.563 1.00 74.21 O ATOM 697 CB LEU A 365 11.529 4.063 0.229 1.00 23.41 C ATOM 698 CG LEU A 365 11.329 3.793 1.724 1.00 63.14 C ATOM 699 CD1 LEU A 365 10.234 2.770 1.954 1.00 40.21 C ATOM 700 CD2 LEU A 365 12.629 3.328 2.343 1.00 41.41 C ATOM 0 H LEU A 365 11.793 5.134 -2.066 1.00 12.53 H new ATOM 0 HA LEU A 365 9.455 4.283 -0.441 1.00 3.31 H new ATOM 0 HB2 LEU A 365 11.700 3.104 -0.260 1.00 23.41 H new ATOM 0 HB3 LEU A 365 12.444 4.645 0.118 1.00 23.41 H new ATOM 0 HG LEU A 365 11.021 4.723 2.202 1.00 63.14 H new ATOM 0 HD11 LEU A 365 10.115 2.599 3.024 1.00 40.21 H new ATOM 0 HD12 LEU A 365 9.297 3.141 1.539 1.00 40.21 H new ATOM 0 HD13 LEU A 365 10.502 1.834 1.464 1.00 40.21 H new ATOM 0 HD21 LEU A 365 12.479 3.138 3.406 1.00 41.41 H new ATOM 0 HD22 LEU A 365 12.958 2.411 1.854 1.00 41.41 H new ATOM 0 HD23 LEU A 365 13.389 4.099 2.216 1.00 41.41 H new ATOM 712 N GLN A 366 9.469 6.363 1.041 1.00 30.55 N ATOM 713 CA GLN A 366 9.213 7.637 1.665 1.00 53.11 C ATOM 714 C GLN A 366 9.649 7.620 3.130 1.00 52.11 C ATOM 715 O GLN A 366 9.570 6.600 3.816 1.00 32.01 O ATOM 716 CB GLN A 366 7.716 7.940 1.625 1.00 33.04 C ATOM 717 CG GLN A 366 7.113 8.127 0.245 1.00 35.05 C ATOM 718 CD GLN A 366 5.608 8.171 0.322 1.00 13.34 C ATOM 719 OE1 GLN A 366 4.932 7.149 0.189 1.00 20.04 O ATOM 720 NE2 GLN A 366 5.067 9.321 0.581 1.00 70.31 N ATOM 0 H GLN A 366 8.995 5.582 1.495 1.00 30.55 H new ATOM 0 HA GLN A 366 9.776 8.396 1.121 1.00 53.11 H new ATOM 0 HB2 GLN A 366 7.187 7.128 2.124 1.00 33.04 H new ATOM 0 HB3 GLN A 366 7.533 8.844 2.206 1.00 33.04 H new ATOM 0 HG2 GLN A 366 7.486 9.050 -0.198 1.00 35.05 H new ATOM 0 HG3 GLN A 366 7.425 7.311 -0.407 1.00 35.05 H new ATOM 0 HE21 GLN A 366 5.654 10.149 0.685 1.00 70.31 H new ATOM 0 HE22 GLN A 366 4.055 9.398 0.680 1.00 70.31 H new ATOM 729 N ILE A 367 10.168 8.731 3.598 1.00 34.21 N ATOM 730 CA ILE A 367 10.408 8.882 5.012 1.00 73.34 C ATOM 731 C ILE A 367 9.035 8.903 5.708 1.00 52.02 C ATOM 732 O ILE A 367 8.162 9.687 5.323 1.00 72.24 O ATOM 733 CB ILE A 367 11.196 10.184 5.335 1.00 24.21 C ATOM 734 CG1 ILE A 367 12.588 10.140 4.674 1.00 34.33 C ATOM 735 CG2 ILE A 367 11.304 10.399 6.843 1.00 3.24 C ATOM 736 CD1 ILE A 367 13.431 11.385 4.889 1.00 33.23 C ATOM 0 H ILE A 367 10.429 9.535 3.027 1.00 34.21 H new ATOM 0 HA ILE A 367 11.021 8.054 5.368 1.00 73.34 H new ATOM 0 HB ILE A 367 10.649 11.032 4.924 1.00 24.21 H new ATOM 0 HG12 ILE A 367 13.132 9.278 5.060 1.00 34.33 H new ATOM 0 HG13 ILE A 367 12.462 9.983 3.603 1.00 34.33 H new ATOM 0 HG21 ILE A 367 11.859 11.316 7.041 1.00 3.24 H new ATOM 0 HG22 ILE A 367 10.305 10.480 7.271 1.00 3.24 H new ATOM 0 HG23 ILE A 367 11.825 9.555 7.295 1.00 3.24 H new ATOM 0 HD11 ILE A 367 14.392 11.264 4.389 1.00 33.23 H new ATOM 0 HD12 ILE A 367 12.913 12.251 4.476 1.00 33.23 H new ATOM 0 HD13 ILE A 367 13.594 11.534 5.956 1.00 33.23 H new ATOM 748 N GLY A 368 8.841 8.058 6.680 1.00 30.12 N ATOM 749 CA GLY A 368 7.560 7.979 7.339 1.00 30.31 C ATOM 750 C GLY A 368 6.835 6.694 7.013 1.00 10.03 C ATOM 751 O GLY A 368 5.736 6.463 7.495 1.00 31.44 O ATOM 0 H GLY A 368 9.548 7.414 7.036 1.00 30.12 H new ATOM 0 HA2 GLY A 368 7.702 8.052 8.417 1.00 30.31 H new ATOM 0 HA3 GLY A 368 6.945 8.828 7.040 1.00 30.31 H new ATOM 755 N ASP A 369 7.446 5.873 6.179 1.00 52.12 N ATOM 756 CA ASP A 369 6.876 4.579 5.807 1.00 11.12 C ATOM 757 C ASP A 369 6.807 3.597 6.968 1.00 14.52 C ATOM 758 O ASP A 369 7.790 3.416 7.714 1.00 54.41 O ATOM 759 CB ASP A 369 7.616 3.951 4.625 1.00 32.44 C ATOM 760 CG ASP A 369 7.048 4.372 3.283 1.00 33.21 C ATOM 761 OD1 ASP A 369 5.819 4.290 3.106 1.00 65.13 O ATOM 762 OD2 ASP A 369 7.805 4.793 2.412 1.00 34.01 O ATOM 0 H ASP A 369 8.344 6.076 5.740 1.00 52.12 H new ATOM 0 HA ASP A 369 5.850 4.790 5.505 1.00 11.12 H new ATOM 0 HB2 ASP A 369 8.669 4.230 4.672 1.00 32.44 H new ATOM 0 HB3 ASP A 369 7.570 2.865 4.709 1.00 32.44 H new ATOM 767 N LYS A 370 5.636 2.980 7.115 1.00 24.12 N ATOM 768 CA LYS A 370 5.347 1.975 8.139 1.00 3.13 C ATOM 769 C LYS A 370 5.633 0.600 7.567 1.00 73.31 C ATOM 770 O LYS A 370 4.948 0.143 6.649 1.00 31.22 O ATOM 771 CB LYS A 370 3.844 2.089 8.515 1.00 62.40 C ATOM 772 CG LYS A 370 3.200 0.901 9.245 1.00 40.22 C ATOM 773 CD LYS A 370 1.673 1.087 9.301 1.00 10.01 C ATOM 774 CE LYS A 370 0.926 -0.172 9.762 1.00 1.53 C ATOM 775 NZ LYS A 370 1.157 -0.499 11.168 1.00 54.44 N ATOM 0 H LYS A 370 4.839 3.170 6.508 1.00 24.12 H new ATOM 0 HA LYS A 370 5.964 2.131 9.024 1.00 3.13 H new ATOM 0 HB2 LYS A 370 3.720 2.974 9.140 1.00 62.40 H new ATOM 0 HB3 LYS A 370 3.281 2.265 7.598 1.00 62.40 H new ATOM 0 HG2 LYS A 370 3.443 -0.029 8.731 1.00 40.22 H new ATOM 0 HG3 LYS A 370 3.603 0.821 10.255 1.00 40.22 H new ATOM 0 HD2 LYS A 370 1.438 1.909 9.978 1.00 10.01 H new ATOM 0 HD3 LYS A 370 1.312 1.374 8.313 1.00 10.01 H new ATOM 0 HE2 LYS A 370 -0.143 -0.032 9.600 1.00 1.53 H new ATOM 0 HE3 LYS A 370 1.234 -1.016 9.145 1.00 1.53 H new ATOM 0 HZ1 LYS A 370 0.695 -1.403 11.395 1.00 54.44 H new ATOM 0 HZ2 LYS A 370 2.179 -0.579 11.342 1.00 54.44 H new ATOM 0 HZ3 LYS A 370 0.761 0.252 11.769 1.00 54.44 H new ATOM 789 N LEU A 371 6.607 -0.060 8.104 1.00 10.34 N ATOM 790 CA LEU A 371 6.956 -1.365 7.622 1.00 40.13 C ATOM 791 C LEU A 371 6.102 -2.405 8.279 1.00 13.11 C ATOM 792 O LEU A 371 6.149 -2.588 9.495 1.00 71.30 O ATOM 793 CB LEU A 371 8.430 -1.665 7.821 1.00 62.15 C ATOM 794 CG LEU A 371 9.398 -0.721 7.120 1.00 71.34 C ATOM 795 CD1 LEU A 371 10.834 -1.087 7.427 1.00 14.40 C ATOM 796 CD2 LEU A 371 9.163 -0.726 5.630 1.00 41.12 C ATOM 0 H LEU A 371 7.178 0.280 8.878 1.00 10.34 H new ATOM 0 HA LEU A 371 6.769 -1.386 6.548 1.00 40.13 H new ATOM 0 HB2 LEU A 371 8.644 -1.647 8.890 1.00 62.15 H new ATOM 0 HB3 LEU A 371 8.625 -2.680 7.474 1.00 62.15 H new ATOM 0 HG LEU A 371 9.215 0.285 7.498 1.00 71.34 H new ATOM 0 HD11 LEU A 371 11.503 -0.397 6.914 1.00 14.40 H new ATOM 0 HD12 LEU A 371 11.004 -1.025 8.502 1.00 14.40 H new ATOM 0 HD13 LEU A 371 11.031 -2.104 7.087 1.00 14.40 H new ATOM 0 HD21 LEU A 371 9.865 -0.045 5.149 1.00 41.12 H new ATOM 0 HD22 LEU A 371 9.311 -1.734 5.242 1.00 41.12 H new ATOM 0 HD23 LEU A 371 8.143 -0.403 5.421 1.00 41.12 H new ATOM 808 N LEU A 372 5.329 -3.056 7.463 1.00 2.03 N ATOM 809 CA LEU A 372 4.399 -4.072 7.887 1.00 32.22 C ATOM 810 C LEU A 372 5.160 -5.398 7.898 1.00 14.01 C ATOM 811 O LEU A 372 4.999 -6.234 8.794 1.00 34.32 O ATOM 812 CB LEU A 372 3.249 -4.103 6.842 1.00 1.21 C ATOM 813 CG LEU A 372 1.895 -4.726 7.241 1.00 33.22 C ATOM 814 CD1 LEU A 372 0.884 -4.527 6.124 1.00 32.13 C ATOM 815 CD2 LEU A 372 2.001 -6.209 7.580 1.00 73.22 C ATOM 0 H LEU A 372 5.324 -2.895 6.456 1.00 2.03 H new ATOM 0 HA LEU A 372 3.983 -3.884 8.877 1.00 32.22 H new ATOM 0 HB2 LEU A 372 3.060 -3.076 6.530 1.00 1.21 H new ATOM 0 HB3 LEU A 372 3.614 -4.640 5.967 1.00 1.21 H new ATOM 0 HG LEU A 372 1.565 -4.213 8.144 1.00 33.22 H new ATOM 0 HD11 LEU A 372 -0.069 -4.969 6.413 1.00 32.13 H new ATOM 0 HD12 LEU A 372 0.749 -3.461 5.941 1.00 32.13 H new ATOM 0 HD13 LEU A 372 1.246 -5.008 5.215 1.00 32.13 H new ATOM 0 HD21 LEU A 372 1.017 -6.591 7.853 1.00 73.22 H new ATOM 0 HD22 LEU A 372 2.375 -6.755 6.713 1.00 73.22 H new ATOM 0 HD23 LEU A 372 2.687 -6.343 8.416 1.00 73.22 H new ATOM 827 N ALA A 373 6.014 -5.577 6.902 1.00 1.24 N ATOM 828 CA ALA A 373 6.784 -6.789 6.762 1.00 75.55 C ATOM 829 C ALA A 373 7.891 -6.592 5.742 1.00 45.44 C ATOM 830 O ALA A 373 7.799 -5.727 4.895 1.00 30.45 O ATOM 831 CB ALA A 373 5.868 -7.930 6.311 1.00 74.43 C ATOM 0 H ALA A 373 6.188 -4.885 6.173 1.00 1.24 H new ATOM 0 HA ALA A 373 7.230 -7.038 7.725 1.00 75.55 H new ATOM 0 HB1 ALA A 373 6.451 -8.845 6.206 1.00 74.43 H new ATOM 0 HB2 ALA A 373 5.084 -8.083 7.053 1.00 74.43 H new ATOM 0 HB3 ALA A 373 5.415 -7.676 5.353 1.00 74.43 H new ATOM 837 N VAL A 374 8.933 -7.366 5.834 1.00 65.53 N ATOM 838 CA VAL A 374 9.969 -7.350 4.819 1.00 64.21 C ATOM 839 C VAL A 374 10.339 -8.784 4.467 1.00 43.45 C ATOM 840 O VAL A 374 10.644 -9.585 5.337 1.00 62.23 O ATOM 841 CB VAL A 374 11.227 -6.495 5.208 1.00 52.40 C ATOM 842 CG1 VAL A 374 11.932 -7.031 6.433 1.00 75.25 C ATOM 843 CG2 VAL A 374 12.195 -6.380 4.037 1.00 2.14 C ATOM 0 H VAL A 374 9.096 -8.020 6.599 1.00 65.53 H new ATOM 0 HA VAL A 374 9.564 -6.849 3.940 1.00 64.21 H new ATOM 0 HB VAL A 374 10.863 -5.498 5.457 1.00 52.40 H new ATOM 0 HG11 VAL A 374 12.795 -6.404 6.660 1.00 75.25 H new ATOM 0 HG12 VAL A 374 11.246 -7.024 7.280 1.00 75.25 H new ATOM 0 HG13 VAL A 374 12.265 -8.052 6.244 1.00 75.25 H new ATOM 0 HG21 VAL A 374 13.057 -5.783 4.335 1.00 2.14 H new ATOM 0 HG22 VAL A 374 12.528 -7.375 3.741 1.00 2.14 H new ATOM 0 HG23 VAL A 374 11.694 -5.900 3.196 1.00 2.14 H new ATOM 853 N ASN A 375 10.207 -9.111 3.181 1.00 14.45 N ATOM 854 CA ASN A 375 10.442 -10.472 2.623 1.00 61.42 C ATOM 855 C ASN A 375 9.498 -11.421 3.259 1.00 45.21 C ATOM 856 O ASN A 375 9.754 -12.600 3.462 1.00 4.24 O ATOM 857 CB ASN A 375 11.878 -10.894 2.775 1.00 33.10 C ATOM 858 CG ASN A 375 12.721 -9.972 1.996 1.00 72.52 C ATOM 859 OD1 ASN A 375 12.328 -9.484 0.940 1.00 53.45 O ATOM 860 ND2 ASN A 375 13.832 -9.663 2.479 1.00 3.44 N ATOM 0 H ASN A 375 9.928 -8.433 2.471 1.00 14.45 H new ATOM 0 HA ASN A 375 10.252 -10.463 1.550 1.00 61.42 H new ATOM 0 HB2 ASN A 375 12.169 -10.877 3.825 1.00 33.10 H new ATOM 0 HB3 ASN A 375 12.011 -11.917 2.424 1.00 33.10 H new ATOM 0 HD21 ASN A 375 14.430 -8.994 1.995 1.00 3.44 H new ATOM 0 HD22 ASN A 375 14.140 -10.080 3.358 1.00 3.44 H new ATOM 867 N ASN A 376 8.371 -10.844 3.480 1.00 51.20 N ATOM 868 CA ASN A 376 7.178 -11.441 4.131 1.00 32.24 C ATOM 869 C ASN A 376 7.386 -11.748 5.620 1.00 65.22 C ATOM 870 O ASN A 376 6.512 -12.322 6.259 1.00 41.32 O ATOM 871 CB ASN A 376 6.676 -12.709 3.396 1.00 71.14 C ATOM 872 CG ASN A 376 6.117 -12.445 2.004 1.00 34.52 C ATOM 873 OD1 ASN A 376 5.542 -11.387 1.724 1.00 71.01 O ATOM 874 ND2 ASN A 376 6.282 -13.400 1.120 1.00 73.04 N ATOM 0 H ASN A 376 8.210 -9.875 3.205 1.00 51.20 H new ATOM 0 HA ASN A 376 6.410 -10.671 4.059 1.00 32.24 H new ATOM 0 HB2 ASN A 376 7.500 -13.419 3.316 1.00 71.14 H new ATOM 0 HB3 ASN A 376 5.904 -13.184 4.001 1.00 71.14 H new ATOM 0 HD21 ASN A 376 5.931 -13.281 0.170 1.00 73.04 H new ATOM 0 HD22 ASN A 376 6.761 -14.261 1.383 1.00 73.04 H new ATOM 881 N VAL A 377 8.509 -11.328 6.178 1.00 71.25 N ATOM 882 CA VAL A 377 8.739 -11.463 7.605 1.00 51.31 C ATOM 883 C VAL A 377 7.993 -10.330 8.284 1.00 65.20 C ATOM 884 O VAL A 377 8.199 -9.177 7.934 1.00 24.43 O ATOM 885 CB VAL A 377 10.249 -11.365 7.963 1.00 31.01 C ATOM 886 CG1 VAL A 377 10.473 -11.539 9.464 1.00 12.11 C ATOM 887 CG2 VAL A 377 11.063 -12.387 7.178 1.00 51.34 C ATOM 0 H VAL A 377 9.274 -10.891 5.665 1.00 71.25 H new ATOM 0 HA VAL A 377 8.391 -12.442 7.936 1.00 51.31 H new ATOM 0 HB VAL A 377 10.591 -10.368 7.684 1.00 31.01 H new ATOM 0 HG11 VAL A 377 11.538 -11.466 9.684 1.00 12.11 H new ATOM 0 HG12 VAL A 377 9.936 -10.759 10.005 1.00 12.11 H new ATOM 0 HG13 VAL A 377 10.105 -12.516 9.776 1.00 12.11 H new ATOM 0 HG21 VAL A 377 12.116 -12.298 7.447 1.00 51.34 H new ATOM 0 HG22 VAL A 377 10.712 -13.391 7.415 1.00 51.34 H new ATOM 0 HG23 VAL A 377 10.944 -12.204 6.110 1.00 51.34 H new ATOM 897 N CYS A 378 7.120 -10.662 9.201 1.00 34.50 N ATOM 898 CA CYS A 378 6.274 -9.696 9.878 1.00 31.01 C ATOM 899 C CYS A 378 7.067 -8.690 10.725 1.00 25.45 C ATOM 900 O CYS A 378 7.865 -9.071 11.572 1.00 1.03 O ATOM 901 CB CYS A 378 5.257 -10.446 10.731 1.00 71.51 C ATOM 902 SG CYS A 378 6.002 -11.707 11.791 1.00 60.11 S ATOM 0 H CYS A 378 6.970 -11.623 9.507 1.00 34.50 H new ATOM 0 HA CYS A 378 5.765 -9.104 9.118 1.00 31.01 H new ATOM 0 HB2 CYS A 378 4.718 -9.731 11.353 1.00 71.51 H new ATOM 0 HB3 CYS A 378 4.523 -10.918 10.078 1.00 71.51 H new ATOM 0 HG CYS A 378 5.073 -12.296 12.484 1.00 60.11 H new ATOM 908 N LEU A 379 6.856 -7.417 10.445 1.00 3.05 N ATOM 909 CA LEU A 379 7.460 -6.309 11.194 1.00 70.11 C ATOM 910 C LEU A 379 6.389 -5.542 11.952 1.00 13.51 C ATOM 911 O LEU A 379 6.684 -4.621 12.718 1.00 24.32 O ATOM 912 CB LEU A 379 8.217 -5.356 10.256 1.00 51.11 C ATOM 913 CG LEU A 379 9.694 -5.669 9.968 1.00 65.44 C ATOM 914 CD1 LEU A 379 9.907 -7.068 9.445 1.00 44.43 C ATOM 915 CD2 LEU A 379 10.256 -4.658 9.001 1.00 2.30 C ATOM 0 H LEU A 379 6.253 -7.110 9.682 1.00 3.05 H new ATOM 0 HA LEU A 379 8.172 -6.731 11.904 1.00 70.11 H new ATOM 0 HB2 LEU A 379 7.687 -5.330 9.304 1.00 51.11 H new ATOM 0 HB3 LEU A 379 8.162 -4.353 10.679 1.00 51.11 H new ATOM 0 HG LEU A 379 10.224 -5.606 10.918 1.00 65.44 H new ATOM 0 HD11 LEU A 379 10.969 -7.230 9.260 1.00 44.43 H new ATOM 0 HD12 LEU A 379 9.553 -7.790 10.181 1.00 44.43 H new ATOM 0 HD13 LEU A 379 9.353 -7.197 8.515 1.00 44.43 H new ATOM 0 HD21 LEU A 379 11.303 -4.887 8.803 1.00 2.30 H new ATOM 0 HD22 LEU A 379 9.693 -4.695 8.068 1.00 2.30 H new ATOM 0 HD23 LEU A 379 10.179 -3.660 9.432 1.00 2.30 H new ATOM 927 N GLU A 380 5.160 -5.920 11.701 1.00 23.33 N ATOM 928 CA GLU A 380 4.001 -5.354 12.340 1.00 3.43 C ATOM 929 C GLU A 380 3.980 -5.869 13.793 1.00 40.31 C ATOM 930 O GLU A 380 3.711 -7.050 14.030 1.00 21.14 O ATOM 931 CB GLU A 380 2.761 -5.830 11.559 1.00 53.45 C ATOM 932 CG GLU A 380 1.447 -5.144 11.890 1.00 50.31 C ATOM 933 CD GLU A 380 1.397 -3.688 11.468 1.00 13.44 C ATOM 934 OE1 GLU A 380 1.799 -3.365 10.336 1.00 24.24 O ATOM 935 OE2 GLU A 380 0.899 -2.855 12.246 1.00 51.21 O ATOM 0 H GLU A 380 4.933 -6.651 11.027 1.00 23.33 H new ATOM 0 HA GLU A 380 4.015 -4.264 12.349 1.00 3.43 H new ATOM 0 HB2 GLU A 380 2.956 -5.697 10.495 1.00 53.45 H new ATOM 0 HB3 GLU A 380 2.640 -6.900 11.730 1.00 53.45 H new ATOM 0 HG2 GLU A 380 0.634 -5.682 11.404 1.00 50.31 H new ATOM 0 HG3 GLU A 380 1.274 -5.208 12.964 1.00 50.31 H new ATOM 942 N GLU A 381 4.341 -4.983 14.719 1.00 14.41 N ATOM 943 CA GLU A 381 4.470 -5.258 16.147 1.00 73.11 C ATOM 944 C GLU A 381 5.513 -6.347 16.481 1.00 34.33 C ATOM 945 O GLU A 381 5.194 -7.513 16.698 1.00 60.54 O ATOM 946 CB GLU A 381 3.109 -5.437 16.866 1.00 0.23 C ATOM 947 CG GLU A 381 3.231 -5.650 18.374 1.00 54.41 C ATOM 948 CD GLU A 381 1.978 -5.270 19.138 1.00 24.14 C ATOM 949 OE1 GLU A 381 1.055 -6.091 19.234 1.00 73.21 O ATOM 950 OE2 GLU A 381 1.943 -4.118 19.679 1.00 34.44 O ATOM 0 H GLU A 381 4.560 -4.015 14.485 1.00 14.41 H new ATOM 0 HA GLU A 381 4.889 -4.348 16.576 1.00 73.11 H new ATOM 0 HB2 GLU A 381 2.493 -4.557 16.682 1.00 0.23 H new ATOM 0 HB3 GLU A 381 2.587 -6.289 16.429 1.00 0.23 H new ATOM 0 HG2 GLU A 381 3.463 -6.697 18.568 1.00 54.41 H new ATOM 0 HG3 GLU A 381 4.069 -5.063 18.750 1.00 54.41 H new ATOM 957 N VAL A 382 6.779 -5.930 16.458 1.00 61.34 N ATOM 958 CA VAL A 382 7.940 -6.768 16.798 1.00 11.34 C ATOM 959 C VAL A 382 8.989 -5.864 17.442 1.00 22.51 C ATOM 960 O VAL A 382 8.789 -4.636 17.515 1.00 23.45 O ATOM 961 CB VAL A 382 8.595 -7.469 15.546 1.00 31.44 C ATOM 962 CG1 VAL A 382 7.659 -8.479 14.896 1.00 34.00 C ATOM 963 CG2 VAL A 382 9.072 -6.444 14.516 1.00 72.41 C ATOM 0 H VAL A 382 7.037 -4.978 16.197 1.00 61.34 H new ATOM 0 HA VAL A 382 7.594 -7.559 17.463 1.00 11.34 H new ATOM 0 HB VAL A 382 9.463 -8.015 15.917 1.00 31.44 H new ATOM 0 HG11 VAL A 382 8.154 -8.935 14.039 1.00 34.00 H new ATOM 0 HG12 VAL A 382 7.400 -9.252 15.619 1.00 34.00 H new ATOM 0 HG13 VAL A 382 6.752 -7.974 14.564 1.00 34.00 H new ATOM 0 HG21 VAL A 382 9.518 -6.962 13.667 1.00 72.41 H new ATOM 0 HG22 VAL A 382 8.224 -5.850 14.174 1.00 72.41 H new ATOM 0 HG23 VAL A 382 9.814 -5.789 14.972 1.00 72.41 H new ATOM 973 N THR A 383 10.075 -6.417 17.915 1.00 61.44 N ATOM 974 CA THR A 383 11.127 -5.599 18.450 1.00 44.54 C ATOM 975 C THR A 383 11.962 -5.066 17.289 1.00 63.51 C ATOM 976 O THR A 383 12.021 -5.702 16.214 1.00 35.30 O ATOM 977 CB THR A 383 12.015 -6.349 19.480 1.00 54.33 C ATOM 978 OG1 THR A 383 12.610 -7.496 18.892 1.00 64.30 O ATOM 979 CG2 THR A 383 11.197 -6.767 20.696 1.00 30.32 C ATOM 0 H THR A 383 10.252 -7.421 17.940 1.00 61.44 H new ATOM 0 HA THR A 383 10.674 -4.775 19.001 1.00 44.54 H new ATOM 0 HB THR A 383 12.802 -5.665 19.799 1.00 54.33 H new ATOM 0 HG1 THR A 383 11.944 -8.211 18.823 1.00 64.30 H new ATOM 0 HG21 THR A 383 11.839 -7.291 21.404 1.00 30.32 H new ATOM 0 HG22 THR A 383 10.776 -5.882 21.173 1.00 30.32 H new ATOM 0 HG23 THR A 383 10.389 -7.428 20.381 1.00 30.32 H new ATOM 987 N HIS A 384 12.631 -3.934 17.501 1.00 43.31 N ATOM 988 CA HIS A 384 13.336 -3.237 16.430 1.00 63.21 C ATOM 989 C HIS A 384 14.370 -4.158 15.835 1.00 54.13 C ATOM 990 O HIS A 384 14.517 -4.245 14.628 1.00 73.01 O ATOM 991 CB HIS A 384 13.990 -1.948 16.956 1.00 53.14 C ATOM 992 CG HIS A 384 14.472 -1.016 15.877 1.00 20.40 C ATOM 993 ND1 HIS A 384 15.609 -0.252 15.961 1.00 23.51 N ATOM 994 CD2 HIS A 384 13.892 -0.682 14.700 1.00 72.32 C ATOM 995 CE1 HIS A 384 15.679 0.503 14.871 1.00 55.05 C ATOM 996 NE2 HIS A 384 14.656 0.277 14.073 1.00 1.04 N ATOM 0 H HIS A 384 12.699 -3.479 18.411 1.00 43.31 H new ATOM 0 HA HIS A 384 12.623 -2.952 15.657 1.00 63.21 H new ATOM 0 HB2 HIS A 384 13.272 -1.419 17.583 1.00 53.14 H new ATOM 0 HB3 HIS A 384 14.833 -2.215 17.593 1.00 53.14 H new ATOM 0 HD1 HIS A 384 16.283 -0.262 16.727 1.00 23.51 H new ATOM 0 HD2 HIS A 384 12.975 -1.102 14.314 1.00 72.32 H new ATOM 0 HE1 HIS A 384 16.470 1.209 14.666 1.00 55.05 H new ATOM 1004 N GLU A 385 15.026 -4.870 16.703 1.00 62.31 N ATOM 1005 CA GLU A 385 15.992 -5.868 16.368 1.00 64.14 C ATOM 1006 C GLU A 385 15.491 -6.878 15.352 1.00 14.23 C ATOM 1007 O GLU A 385 16.207 -7.176 14.381 1.00 30.33 O ATOM 1008 CB GLU A 385 16.452 -6.604 17.610 1.00 65.32 C ATOM 1009 CG GLU A 385 17.335 -5.811 18.533 1.00 54.10 C ATOM 1010 CD GLU A 385 16.582 -4.966 19.554 1.00 55.31 C ATOM 1011 OE1 GLU A 385 15.718 -4.176 19.160 1.00 72.52 O ATOM 1012 OE2 GLU A 385 16.852 -5.109 20.783 1.00 13.03 O ATOM 0 H GLU A 385 14.894 -4.764 17.709 1.00 62.31 H new ATOM 0 HA GLU A 385 16.824 -5.332 15.912 1.00 64.14 H new ATOM 0 HB2 GLU A 385 15.573 -6.931 18.166 1.00 65.32 H new ATOM 0 HB3 GLU A 385 16.988 -7.502 17.303 1.00 65.32 H new ATOM 0 HG2 GLU A 385 17.995 -6.498 19.064 1.00 54.10 H new ATOM 0 HG3 GLU A 385 17.970 -5.157 17.935 1.00 54.10 H new ATOM 1019 N GLU A 386 14.270 -7.369 15.536 1.00 53.10 N ATOM 1020 CA GLU A 386 13.721 -8.402 14.669 1.00 3.42 C ATOM 1021 C GLU A 386 13.487 -7.827 13.298 1.00 30.13 C ATOM 1022 O GLU A 386 13.703 -8.483 12.279 1.00 53.25 O ATOM 1023 CB GLU A 386 12.417 -8.923 15.249 1.00 61.21 C ATOM 1024 CG GLU A 386 12.576 -9.619 16.587 1.00 31.22 C ATOM 1025 CD GLU A 386 11.250 -9.919 17.250 1.00 74.32 C ATOM 1026 OE1 GLU A 386 10.699 -8.992 17.911 1.00 34.33 O ATOM 1027 OE2 GLU A 386 10.770 -11.045 17.142 1.00 73.01 O ATOM 0 H GLU A 386 13.641 -7.066 16.280 1.00 53.10 H new ATOM 0 HA GLU A 386 14.426 -9.230 14.596 1.00 3.42 H new ATOM 0 HB2 GLU A 386 11.723 -8.090 15.364 1.00 61.21 H new ATOM 0 HB3 GLU A 386 11.967 -9.618 14.540 1.00 61.21 H new ATOM 0 HG2 GLU A 386 13.125 -10.550 16.445 1.00 31.22 H new ATOM 0 HG3 GLU A 386 13.175 -8.993 17.249 1.00 31.22 H new ATOM 1034 N ALA A 387 13.140 -6.567 13.291 1.00 52.24 N ATOM 1035 CA ALA A 387 12.842 -5.864 12.091 1.00 62.21 C ATOM 1036 C ALA A 387 14.104 -5.567 11.330 1.00 13.24 C ATOM 1037 O ALA A 387 14.270 -6.032 10.214 1.00 22.45 O ATOM 1038 CB ALA A 387 12.118 -4.589 12.408 1.00 70.04 C ATOM 0 H ALA A 387 13.058 -6.001 14.135 1.00 52.24 H new ATOM 0 HA ALA A 387 12.201 -6.490 11.470 1.00 62.21 H new ATOM 0 HB1 ALA A 387 11.894 -4.058 11.483 1.00 70.04 H new ATOM 0 HB2 ALA A 387 11.188 -4.818 12.929 1.00 70.04 H new ATOM 0 HB3 ALA A 387 12.745 -3.963 13.043 1.00 70.04 H new ATOM 1044 N VAL A 388 15.026 -4.843 11.966 1.00 15.10 N ATOM 1045 CA VAL A 388 16.263 -4.418 11.312 1.00 62.22 C ATOM 1046 C VAL A 388 17.034 -5.618 10.819 1.00 10.20 C ATOM 1047 O VAL A 388 17.577 -5.600 9.731 1.00 25.45 O ATOM 1048 CB VAL A 388 17.199 -3.602 12.234 1.00 14.43 C ATOM 1049 CG1 VAL A 388 18.322 -2.988 11.441 1.00 33.15 C ATOM 1050 CG2 VAL A 388 16.465 -2.548 13.012 1.00 11.12 C ATOM 0 H VAL A 388 14.939 -4.538 12.936 1.00 15.10 H new ATOM 0 HA VAL A 388 15.952 -3.776 10.488 1.00 62.22 H new ATOM 0 HB VAL A 388 17.617 -4.300 12.959 1.00 14.43 H new ATOM 0 HG11 VAL A 388 18.969 -2.418 12.108 1.00 33.15 H new ATOM 0 HG12 VAL A 388 18.901 -3.776 10.960 1.00 33.15 H new ATOM 0 HG13 VAL A 388 17.910 -2.324 10.681 1.00 33.15 H new ATOM 0 HG21 VAL A 388 17.169 -2.005 13.643 1.00 11.12 H new ATOM 0 HG22 VAL A 388 15.986 -1.854 12.322 1.00 11.12 H new ATOM 0 HG23 VAL A 388 15.707 -3.019 13.637 1.00 11.12 H new ATOM 1060 N THR A 389 17.055 -6.664 11.615 1.00 5.20 N ATOM 1061 CA THR A 389 17.735 -7.876 11.246 1.00 4.35 C ATOM 1062 C THR A 389 17.088 -8.507 9.991 1.00 72.03 C ATOM 1063 O THR A 389 17.788 -8.978 9.113 1.00 60.33 O ATOM 1064 CB THR A 389 17.799 -8.863 12.453 1.00 51.01 C ATOM 1065 OG1 THR A 389 18.553 -8.246 13.527 1.00 71.31 O ATOM 1066 CG2 THR A 389 18.433 -10.198 12.079 1.00 70.31 C ATOM 0 H THR A 389 16.603 -6.695 12.529 1.00 5.20 H new ATOM 0 HA THR A 389 18.765 -7.637 10.981 1.00 4.35 H new ATOM 0 HB THR A 389 16.777 -9.071 12.771 1.00 51.01 H new ATOM 0 HG1 THR A 389 17.948 -7.722 14.092 1.00 71.31 H new ATOM 0 HG21 THR A 389 18.454 -10.849 12.953 1.00 70.31 H new ATOM 0 HG22 THR A 389 17.848 -10.670 11.289 1.00 70.31 H new ATOM 0 HG23 THR A 389 19.451 -10.031 11.727 1.00 70.31 H new ATOM 1074 N ALA A 390 15.770 -8.421 9.879 1.00 55.52 N ATOM 1075 CA ALA A 390 15.070 -8.947 8.718 1.00 3.31 C ATOM 1076 C ALA A 390 15.414 -8.134 7.461 1.00 54.50 C ATOM 1077 O ALA A 390 15.507 -8.689 6.368 1.00 74.23 O ATOM 1078 CB ALA A 390 13.569 -8.985 8.959 1.00 71.55 C ATOM 0 H ALA A 390 15.165 -7.992 10.579 1.00 55.52 H new ATOM 0 HA ALA A 390 15.403 -9.972 8.554 1.00 3.31 H new ATOM 0 HB1 ALA A 390 13.069 -9.382 8.076 1.00 71.55 H new ATOM 0 HB2 ALA A 390 13.354 -9.624 9.816 1.00 71.55 H new ATOM 0 HB3 ALA A 390 13.207 -7.976 9.158 1.00 71.55 H new ATOM 1084 N LEU A 391 15.616 -6.818 7.621 1.00 73.41 N ATOM 1085 CA LEU A 391 16.044 -5.988 6.498 1.00 24.01 C ATOM 1086 C LEU A 391 17.508 -6.209 6.198 1.00 51.03 C ATOM 1087 O LEU A 391 17.931 -6.111 5.060 1.00 1.31 O ATOM 1088 CB LEU A 391 15.805 -4.474 6.695 1.00 4.41 C ATOM 1089 CG LEU A 391 14.361 -3.964 6.686 1.00 2.13 C ATOM 1090 CD1 LEU A 391 13.693 -4.112 8.017 1.00 21.42 C ATOM 1091 CD2 LEU A 391 14.292 -2.539 6.206 1.00 74.44 C ATOM 0 H LEU A 391 15.492 -6.318 8.501 1.00 73.41 H new ATOM 0 HA LEU A 391 15.420 -6.305 5.663 1.00 24.01 H new ATOM 0 HB2 LEU A 391 16.254 -4.187 7.646 1.00 4.41 H new ATOM 0 HB3 LEU A 391 16.350 -3.946 5.912 1.00 4.41 H new ATOM 0 HG LEU A 391 13.812 -4.591 5.984 1.00 2.13 H new ATOM 0 HD11 LEU A 391 12.672 -3.735 7.956 1.00 21.42 H new ATOM 0 HD12 LEU A 391 13.675 -5.164 8.300 1.00 21.42 H new ATOM 0 HD13 LEU A 391 14.245 -3.544 8.766 1.00 21.42 H new ATOM 0 HD21 LEU A 391 13.255 -2.204 6.210 1.00 74.44 H new ATOM 0 HD22 LEU A 391 14.882 -1.904 6.867 1.00 74.44 H new ATOM 0 HD23 LEU A 391 14.690 -2.477 5.193 1.00 74.44 H new ATOM 1103 N LYS A 392 18.287 -6.489 7.220 1.00 3.43 N ATOM 1104 CA LYS A 392 19.693 -6.721 7.026 1.00 2.24 C ATOM 1105 C LYS A 392 19.966 -8.060 6.370 1.00 62.24 C ATOM 1106 O LYS A 392 20.952 -8.222 5.664 1.00 43.20 O ATOM 1107 CB LYS A 392 20.501 -6.513 8.299 1.00 1.14 C ATOM 1108 CG LYS A 392 20.470 -5.062 8.735 1.00 51.34 C ATOM 1109 CD LYS A 392 21.496 -4.748 9.781 1.00 43.43 C ATOM 1110 CE LYS A 392 21.568 -3.247 10.020 1.00 54.33 C ATOM 1111 NZ LYS A 392 22.165 -2.491 8.877 1.00 14.14 N ATOM 0 H LYS A 392 17.969 -6.560 8.187 1.00 3.43 H new ATOM 0 HA LYS A 392 20.040 -5.960 6.326 1.00 2.24 H new ATOM 0 HB2 LYS A 392 20.102 -7.143 9.094 1.00 1.14 H new ATOM 0 HB3 LYS A 392 21.532 -6.824 8.133 1.00 1.14 H new ATOM 0 HG2 LYS A 392 20.635 -4.423 7.867 1.00 51.34 H new ATOM 0 HG3 LYS A 392 19.479 -4.825 9.122 1.00 51.34 H new ATOM 0 HD2 LYS A 392 21.245 -5.259 10.711 1.00 43.43 H new ATOM 0 HD3 LYS A 392 22.471 -5.120 9.466 1.00 43.43 H new ATOM 0 HE2 LYS A 392 20.564 -2.869 10.211 1.00 54.33 H new ATOM 0 HE3 LYS A 392 22.156 -3.058 10.918 1.00 54.33 H new ATOM 0 HZ1 LYS A 392 22.107 -1.470 9.068 1.00 14.14 H new ATOM 0 HZ2 LYS A 392 23.161 -2.766 8.762 1.00 14.14 H new ATOM 0 HZ3 LYS A 392 21.642 -2.710 8.005 1.00 14.14 H new ATOM 1125 N ASN A 393 19.056 -8.994 6.563 1.00 22.53 N ATOM 1126 CA ASN A 393 19.123 -10.308 5.937 1.00 72.40 C ATOM 1127 C ASN A 393 18.605 -10.246 4.493 1.00 43.20 C ATOM 1128 O ASN A 393 17.792 -11.076 4.071 1.00 54.21 O ATOM 1129 CB ASN A 393 18.285 -11.332 6.724 1.00 44.13 C ATOM 1130 CG ASN A 393 18.835 -11.695 8.095 1.00 54.24 C ATOM 1131 OD1 ASN A 393 20.032 -11.653 8.345 1.00 71.54 O ATOM 1132 ND2 ASN A 393 17.956 -12.080 8.994 1.00 34.13 N ATOM 0 H ASN A 393 18.241 -8.865 7.163 1.00 22.53 H new ATOM 0 HA ASN A 393 20.167 -10.620 5.937 1.00 72.40 H new ATOM 0 HB2 ASN A 393 17.277 -10.936 6.847 1.00 44.13 H new ATOM 0 HB3 ASN A 393 18.200 -12.242 6.131 1.00 44.13 H new ATOM 0 HD21 ASN A 393 18.266 -12.353 9.927 1.00 34.13 H new ATOM 0 HD22 ASN A 393 16.964 -12.106 8.759 1.00 34.13 H new ATOM 1139 N THR A 394 19.084 -9.294 3.735 1.00 15.45 N ATOM 1140 CA THR A 394 18.682 -9.151 2.364 1.00 70.51 C ATOM 1141 C THR A 394 19.894 -9.168 1.485 1.00 40.11 C ATOM 1142 O THR A 394 20.982 -8.735 1.892 1.00 73.44 O ATOM 1143 CB THR A 394 17.905 -7.844 2.104 1.00 34.04 C ATOM 1144 OG1 THR A 394 18.666 -6.718 2.552 1.00 40.02 O ATOM 1145 CG2 THR A 394 16.551 -7.856 2.783 1.00 52.44 C ATOM 0 H THR A 394 19.761 -8.600 4.051 1.00 15.45 H new ATOM 0 HA THR A 394 18.018 -9.986 2.138 1.00 70.51 H new ATOM 0 HB THR A 394 17.741 -7.765 1.029 1.00 34.04 H new ATOM 0 HG1 THR A 394 18.535 -6.597 3.516 1.00 40.02 H new ATOM 0 HG21 THR A 394 16.033 -6.919 2.578 1.00 52.44 H new ATOM 0 HG22 THR A 394 15.960 -8.689 2.402 1.00 52.44 H new ATOM 0 HG23 THR A 394 16.685 -7.968 3.859 1.00 52.44 H new ATOM 1153 N SER A 395 19.751 -9.678 0.301 1.00 55.01 N ATOM 1154 CA SER A 395 20.862 -9.713 -0.599 1.00 63.30 C ATOM 1155 C SER A 395 20.432 -9.569 -2.028 1.00 21.55 C ATOM 1156 O SER A 395 19.868 -10.463 -2.636 1.00 52.12 O ATOM 1157 CB SER A 395 21.762 -10.944 -0.389 1.00 21.41 C ATOM 1158 OG SER A 395 22.325 -10.950 0.920 1.00 14.34 O ATOM 0 H SER A 395 18.884 -10.073 -0.063 1.00 55.01 H new ATOM 0 HA SER A 395 21.475 -8.844 -0.359 1.00 63.30 H new ATOM 0 HB2 SER A 395 21.181 -11.854 -0.543 1.00 21.41 H new ATOM 0 HB3 SER A 395 22.560 -10.946 -1.132 1.00 21.41 H new ATOM 0 HG SER A 395 22.070 -10.128 1.390 1.00 14.34 H new ATOM 1164 N ASP A 396 20.587 -8.353 -2.443 1.00 12.51 N ATOM 1165 CA ASP A 396 20.515 -7.863 -3.824 1.00 34.34 C ATOM 1166 C ASP A 396 19.131 -8.000 -4.437 1.00 55.24 C ATOM 1167 O ASP A 396 18.934 -7.788 -5.623 1.00 40.15 O ATOM 1168 CB ASP A 396 21.653 -8.502 -4.660 1.00 35.54 C ATOM 1169 CG ASP A 396 23.024 -8.277 -3.980 1.00 14.40 C ATOM 1170 OD1 ASP A 396 23.682 -7.244 -4.212 1.00 73.55 O ATOM 1171 OD2 ASP A 396 23.419 -9.091 -3.094 1.00 53.35 O ATOM 0 H ASP A 396 20.785 -7.597 -1.787 1.00 12.51 H new ATOM 0 HA ASP A 396 20.679 -6.785 -3.822 1.00 34.34 H new ATOM 0 HB2 ASP A 396 21.470 -9.570 -4.776 1.00 35.54 H new ATOM 0 HB3 ASP A 396 21.663 -8.070 -5.661 1.00 35.54 H new ATOM 1176 N PHE A 397 18.163 -8.274 -3.578 1.00 3.33 N ATOM 1177 CA PHE A 397 16.780 -8.420 -3.948 1.00 12.40 C ATOM 1178 C PHE A 397 15.965 -8.369 -2.651 1.00 10.35 C ATOM 1179 O PHE A 397 16.324 -9.033 -1.672 1.00 44.51 O ATOM 1180 CB PHE A 397 16.602 -9.766 -4.663 1.00 22.23 C ATOM 1181 CG PHE A 397 15.255 -10.019 -5.266 1.00 73.50 C ATOM 1182 CD1 PHE A 397 14.972 -9.582 -6.549 1.00 32.45 C ATOM 1183 CD2 PHE A 397 14.285 -10.717 -4.569 1.00 53.04 C ATOM 1184 CE1 PHE A 397 13.746 -9.831 -7.123 1.00 42.34 C ATOM 1185 CE2 PHE A 397 13.060 -10.972 -5.138 1.00 14.23 C ATOM 1186 CZ PHE A 397 12.788 -10.528 -6.418 1.00 74.10 C ATOM 0 H PHE A 397 18.330 -8.403 -2.580 1.00 3.33 H new ATOM 0 HA PHE A 397 16.448 -7.632 -4.624 1.00 12.40 H new ATOM 0 HB2 PHE A 397 17.350 -9.836 -5.453 1.00 22.23 H new ATOM 0 HB3 PHE A 397 16.814 -10.563 -3.951 1.00 22.23 H new ATOM 0 HD1 PHE A 397 15.722 -9.040 -7.106 1.00 32.45 H new ATOM 0 HD2 PHE A 397 14.492 -11.065 -3.568 1.00 53.04 H new ATOM 0 HE1 PHE A 397 13.535 -9.481 -8.123 1.00 42.34 H new ATOM 0 HE2 PHE A 397 12.311 -11.519 -4.585 1.00 14.23 H new ATOM 0 HZ PHE A 397 11.826 -10.727 -6.866 1.00 74.10 H new ATOM 1196 N VAL A 398 14.943 -7.527 -2.611 1.00 42.43 N ATOM 1197 CA VAL A 398 14.121 -7.334 -1.412 1.00 22.41 C ATOM 1198 C VAL A 398 12.643 -7.139 -1.801 1.00 72.03 C ATOM 1199 O VAL A 398 12.349 -6.530 -2.823 1.00 42.14 O ATOM 1200 CB VAL A 398 14.554 -6.025 -0.634 1.00 70.41 C ATOM 1201 CG1 VAL A 398 13.807 -5.864 0.683 1.00 13.34 C ATOM 1202 CG2 VAL A 398 16.055 -5.942 -0.406 1.00 12.21 C ATOM 0 H VAL A 398 14.655 -6.956 -3.405 1.00 42.43 H new ATOM 0 HA VAL A 398 14.256 -8.218 -0.789 1.00 22.41 H new ATOM 0 HB VAL A 398 14.277 -5.196 -1.285 1.00 70.41 H new ATOM 0 HG11 VAL A 398 14.138 -4.952 1.180 1.00 13.34 H new ATOM 0 HG12 VAL A 398 12.736 -5.803 0.489 1.00 13.34 H new ATOM 0 HG13 VAL A 398 14.011 -6.721 1.324 1.00 13.34 H new ATOM 0 HG21 VAL A 398 16.291 -5.024 0.132 1.00 12.21 H new ATOM 0 HG22 VAL A 398 16.382 -6.800 0.181 1.00 12.21 H new ATOM 0 HG23 VAL A 398 16.570 -5.942 -1.367 1.00 12.21 H new ATOM 1212 N TYR A 399 11.742 -7.680 -1.004 1.00 32.35 N ATOM 1213 CA TYR A 399 10.321 -7.383 -1.099 1.00 43.42 C ATOM 1214 C TYR A 399 9.862 -6.756 0.210 1.00 73.15 C ATOM 1215 O TYR A 399 9.553 -7.442 1.169 1.00 41.12 O ATOM 1216 CB TYR A 399 9.473 -8.632 -1.401 1.00 64.35 C ATOM 1217 CG TYR A 399 9.298 -8.942 -2.871 1.00 14.21 C ATOM 1218 CD1 TYR A 399 8.527 -8.111 -3.680 1.00 25.31 C ATOM 1219 CD2 TYR A 399 9.869 -10.064 -3.446 1.00 64.43 C ATOM 1220 CE1 TYR A 399 8.339 -8.389 -5.019 1.00 63.15 C ATOM 1221 CE2 TYR A 399 9.685 -10.348 -4.789 1.00 2.40 C ATOM 1222 CZ TYR A 399 8.921 -9.508 -5.570 1.00 20.44 C ATOM 1223 OH TYR A 399 8.741 -9.790 -6.927 1.00 21.04 O ATOM 0 H TYR A 399 11.975 -8.344 -0.265 1.00 32.35 H new ATOM 0 HA TYR A 399 10.179 -6.694 -1.931 1.00 43.42 H new ATOM 0 HB2 TYR A 399 9.934 -9.492 -0.915 1.00 64.35 H new ATOM 0 HB3 TYR A 399 8.488 -8.502 -0.952 1.00 64.35 H new ATOM 0 HD1 TYR A 399 8.067 -7.232 -3.252 1.00 25.31 H new ATOM 0 HD2 TYR A 399 10.467 -10.728 -2.839 1.00 64.43 H new ATOM 0 HE1 TYR A 399 7.739 -7.732 -5.631 1.00 63.15 H new ATOM 0 HE2 TYR A 399 10.139 -11.226 -5.223 1.00 2.40 H new ATOM 0 HH TYR A 399 9.219 -10.614 -7.156 1.00 21.04 H new ATOM 1233 N LEU A 400 9.834 -5.473 0.238 1.00 44.31 N ATOM 1234 CA LEU A 400 9.481 -4.709 1.417 1.00 13.33 C ATOM 1235 C LEU A 400 7.992 -4.380 1.391 1.00 10.33 C ATOM 1236 O LEU A 400 7.507 -3.758 0.465 1.00 33.03 O ATOM 1237 CB LEU A 400 10.401 -3.446 1.481 1.00 55.25 C ATOM 1238 CG LEU A 400 10.186 -2.390 2.595 1.00 41.40 C ATOM 1239 CD1 LEU A 400 11.453 -1.569 2.755 1.00 55.22 C ATOM 1240 CD2 LEU A 400 9.061 -1.437 2.215 1.00 4.33 C ATOM 0 H LEU A 400 10.059 -4.894 -0.571 1.00 44.31 H new ATOM 0 HA LEU A 400 9.648 -5.282 2.329 1.00 13.33 H new ATOM 0 HB2 LEU A 400 11.430 -3.797 1.561 1.00 55.25 H new ATOM 0 HB3 LEU A 400 10.313 -2.931 0.524 1.00 55.25 H new ATOM 0 HG LEU A 400 9.935 -2.910 3.519 1.00 41.40 H new ATOM 0 HD11 LEU A 400 11.308 -0.824 3.538 1.00 55.22 H new ATOM 0 HD12 LEU A 400 12.280 -2.225 3.028 1.00 55.22 H new ATOM 0 HD13 LEU A 400 11.683 -1.067 1.815 1.00 55.22 H new ATOM 0 HD21 LEU A 400 8.923 -0.702 3.008 1.00 4.33 H new ATOM 0 HD22 LEU A 400 9.315 -0.926 1.287 1.00 4.33 H new ATOM 0 HD23 LEU A 400 8.138 -2.000 2.078 1.00 4.33 H new ATOM 1252 N LYS A 401 7.283 -4.809 2.401 1.00 25.54 N ATOM 1253 CA LYS A 401 5.856 -4.607 2.485 1.00 64.11 C ATOM 1254 C LYS A 401 5.581 -3.485 3.466 1.00 13.10 C ATOM 1255 O LYS A 401 5.754 -3.629 4.687 1.00 54.23 O ATOM 1256 CB LYS A 401 5.167 -5.904 2.925 1.00 74.13 C ATOM 1257 CG LYS A 401 5.475 -7.089 2.009 1.00 34.42 C ATOM 1258 CD LYS A 401 4.976 -8.413 2.581 1.00 62.20 C ATOM 1259 CE LYS A 401 3.455 -8.525 2.617 1.00 74.12 C ATOM 1260 NZ LYS A 401 2.870 -8.604 1.260 1.00 61.55 N ATOM 0 H LYS A 401 7.679 -5.312 3.195 1.00 25.54 H new ATOM 0 HA LYS A 401 5.457 -4.333 1.508 1.00 64.11 H new ATOM 0 HB2 LYS A 401 5.479 -6.147 3.941 1.00 74.13 H new ATOM 0 HB3 LYS A 401 4.089 -5.744 2.952 1.00 74.13 H new ATOM 0 HG2 LYS A 401 5.015 -6.921 1.035 1.00 34.42 H new ATOM 0 HG3 LYS A 401 6.551 -7.149 1.847 1.00 34.42 H new ATOM 0 HD2 LYS A 401 5.379 -9.232 1.985 1.00 62.20 H new ATOM 0 HD3 LYS A 401 5.365 -8.533 3.592 1.00 62.20 H new ATOM 0 HE2 LYS A 401 3.171 -9.410 3.186 1.00 74.12 H new ATOM 0 HE3 LYS A 401 3.041 -7.663 3.140 1.00 74.12 H new ATOM 0 HZ1 LYS A 401 1.870 -8.881 1.329 1.00 61.55 H new ATOM 0 HZ2 LYS A 401 2.941 -7.676 0.797 1.00 61.55 H new ATOM 0 HZ3 LYS A 401 3.387 -9.311 0.700 1.00 61.55 H new ATOM 1274 N VAL A 402 5.191 -2.385 2.931 1.00 20.42 N ATOM 1275 CA VAL A 402 4.953 -1.190 3.677 1.00 32.03 C ATOM 1276 C VAL A 402 3.453 -0.816 3.622 1.00 32.42 C ATOM 1277 O VAL A 402 2.692 -1.262 2.707 1.00 33.34 O ATOM 1278 CB VAL A 402 5.844 -0.024 3.103 1.00 72.21 C ATOM 1279 CG1 VAL A 402 5.539 0.294 1.652 1.00 2.12 C ATOM 1280 CG2 VAL A 402 5.751 1.217 3.925 1.00 21.21 C ATOM 0 H VAL A 402 5.022 -2.282 1.930 1.00 20.42 H new ATOM 0 HA VAL A 402 5.222 -1.354 4.720 1.00 32.03 H new ATOM 0 HB VAL A 402 6.867 -0.396 3.154 1.00 72.21 H new ATOM 0 HG11 VAL A 402 6.184 1.105 1.314 1.00 2.12 H new ATOM 0 HG12 VAL A 402 5.717 -0.591 1.040 1.00 2.12 H new ATOM 0 HG13 VAL A 402 4.496 0.597 1.557 1.00 2.12 H new ATOM 0 HG21 VAL A 402 6.383 1.991 3.489 1.00 21.21 H new ATOM 0 HG22 VAL A 402 4.717 1.562 3.947 1.00 21.21 H new ATOM 0 HG23 VAL A 402 6.085 1.006 4.941 1.00 21.21 H new ATOM 1290 N ALA A 403 3.042 -0.058 4.596 1.00 44.11 N ATOM 1291 CA ALA A 403 1.727 0.477 4.722 1.00 71.42 C ATOM 1292 C ALA A 403 1.880 1.928 5.135 1.00 40.01 C ATOM 1293 O ALA A 403 2.947 2.319 5.591 1.00 11.20 O ATOM 1294 CB ALA A 403 0.927 -0.301 5.757 1.00 11.02 C ATOM 0 H ALA A 403 3.654 0.216 5.365 1.00 44.11 H new ATOM 0 HA ALA A 403 1.184 0.400 3.780 1.00 71.42 H new ATOM 0 HB1 ALA A 403 -0.074 0.124 5.838 1.00 11.02 H new ATOM 0 HB2 ALA A 403 0.855 -1.345 5.452 1.00 11.02 H new ATOM 0 HB3 ALA A 403 1.426 -0.240 6.724 1.00 11.02 H new ATOM 1300 N LYS A 404 0.881 2.733 4.906 1.00 52.41 N ATOM 1301 CA LYS A 404 0.950 4.126 5.321 1.00 63.01 C ATOM 1302 C LYS A 404 0.641 4.203 6.793 1.00 72.54 C ATOM 1303 O LYS A 404 -0.038 3.319 7.320 1.00 14.12 O ATOM 1304 CB LYS A 404 -0.010 4.996 4.481 1.00 42.12 C ATOM 1305 CG LYS A 404 0.255 5.054 2.949 1.00 15.15 C ATOM 1306 CD LYS A 404 1.505 5.877 2.547 1.00 42.44 C ATOM 1307 CE LYS A 404 2.835 5.150 2.758 1.00 64.24 C ATOM 1308 NZ LYS A 404 3.997 6.018 2.489 1.00 44.14 N ATOM 0 H LYS A 404 0.014 2.464 4.441 1.00 52.41 H new ATOM 0 HA LYS A 404 1.952 4.519 5.151 1.00 63.01 H new ATOM 0 HB2 LYS A 404 -1.025 4.630 4.637 1.00 42.12 H new ATOM 0 HB3 LYS A 404 0.025 6.013 4.871 1.00 42.12 H new ATOM 0 HG2 LYS A 404 0.368 4.037 2.573 1.00 15.15 H new ATOM 0 HG3 LYS A 404 -0.619 5.480 2.457 1.00 15.15 H new ATOM 0 HD2 LYS A 404 1.420 6.155 1.497 1.00 42.44 H new ATOM 0 HD3 LYS A 404 1.516 6.803 3.122 1.00 42.44 H new ATOM 0 HE2 LYS A 404 2.888 4.784 3.783 1.00 64.24 H new ATOM 0 HE3 LYS A 404 2.877 4.278 2.106 1.00 64.24 H new ATOM 0 HZ1 LYS A 404 4.847 5.606 2.925 1.00 44.14 H new ATOM 0 HZ2 LYS A 404 4.139 6.099 1.462 1.00 44.14 H new ATOM 0 HZ3 LYS A 404 3.826 6.962 2.891 1.00 44.14 H new ATOM 1538 N ASN B 147 16.291 3.546 19.511 1.00 70.41 N ATOM 1539 CA ASN B 147 17.266 4.225 18.722 1.00 63.44 C ATOM 1540 C ASN B 147 17.020 3.803 17.305 1.00 44.44 C ATOM 1541 O ASN B 147 16.173 2.917 17.074 1.00 62.04 O ATOM 1542 CB ASN B 147 18.727 3.939 19.162 1.00 31.52 C ATOM 1543 CG ASN B 147 19.116 2.459 19.141 1.00 51.31 C ATOM 1544 OD1 ASN B 147 18.958 1.755 20.121 1.00 15.45 O ATOM 1545 ND2 ASN B 147 19.641 1.985 18.039 1.00 72.14 N ATOM 0 HA ASN B 147 17.159 5.303 18.846 1.00 63.44 H new ATOM 0 HB2 ASN B 147 19.404 4.489 18.509 1.00 31.52 H new ATOM 0 HB3 ASN B 147 18.872 4.326 20.171 1.00 31.52 H new ATOM 0 HD21 ASN B 147 19.927 1.007 17.990 1.00 72.14 H new ATOM 0 HD22 ASN B 147 19.764 2.594 17.230 1.00 72.14 H new ATOM 1552 N GLU B 148 17.682 4.427 16.362 1.00 24.24 N ATOM 1553 CA GLU B 148 17.510 4.055 14.984 1.00 11.23 C ATOM 1554 C GLU B 148 18.531 3.019 14.671 1.00 24.35 C ATOM 1555 O GLU B 148 19.478 2.824 15.449 1.00 41.41 O ATOM 1556 CB GLU B 148 17.638 5.294 14.028 1.00 21.55 C ATOM 1557 CG GLU B 148 19.059 5.909 13.818 1.00 55.43 C ATOM 1558 CD GLU B 148 19.922 5.203 12.735 1.00 43.22 C ATOM 1559 OE1 GLU B 148 19.780 5.540 11.539 1.00 11.35 O ATOM 1560 OE2 GLU B 148 20.736 4.325 13.074 1.00 73.21 O ATOM 0 H GLU B 148 18.340 5.189 16.524 1.00 24.24 H new ATOM 0 HA GLU B 148 16.507 3.658 14.827 1.00 11.23 H new ATOM 0 HB2 GLU B 148 17.251 5.005 13.051 1.00 21.55 H new ATOM 0 HB3 GLU B 148 16.986 6.080 14.409 1.00 21.55 H new ATOM 0 HG2 GLU B 148 18.948 6.959 13.547 1.00 55.43 H new ATOM 0 HG3 GLU B 148 19.596 5.880 14.766 1.00 55.43 H new ATOM 1567 N THR B 149 18.333 2.302 13.639 1.00 63.44 N ATOM 1568 CA THR B 149 19.352 1.447 13.172 1.00 30.20 C ATOM 1569 C THR B 149 19.328 1.459 11.665 1.00 72.14 C ATOM 1570 O THR B 149 18.420 0.903 11.028 1.00 41.02 O ATOM 1571 CB THR B 149 19.246 0.012 13.726 1.00 53.43 C ATOM 1572 OG1 THR B 149 19.175 0.049 15.170 1.00 35.42 O ATOM 1573 CG2 THR B 149 20.480 -0.774 13.338 1.00 34.23 C ATOM 0 H THR B 149 17.470 2.288 13.096 1.00 63.44 H new ATOM 0 HA THR B 149 20.308 1.821 13.538 1.00 30.20 H new ATOM 0 HB THR B 149 18.351 -0.456 13.316 1.00 53.43 H new ATOM 0 HG1 THR B 149 19.507 0.913 15.492 1.00 35.42 H new ATOM 0 HG21 THR B 149 20.404 -1.788 13.730 1.00 34.23 H new ATOM 0 HG22 THR B 149 20.562 -0.810 12.252 1.00 34.23 H new ATOM 0 HG23 THR B 149 21.365 -0.290 13.752 1.00 34.23 H new ATOM 1581 N GLN B 150 20.276 2.160 11.124 1.00 34.25 N ATOM 1582 CA GLN B 150 20.454 2.302 9.713 1.00 52.25 C ATOM 1583 C GLN B 150 20.689 0.940 9.052 1.00 42.42 C ATOM 1584 O GLN B 150 21.500 0.111 9.532 1.00 12.42 O ATOM 1585 CB GLN B 150 21.637 3.213 9.465 1.00 61.24 C ATOM 1586 CG GLN B 150 21.699 3.792 8.077 1.00 71.11 C ATOM 1587 CD GLN B 150 22.927 4.620 7.883 1.00 25.20 C ATOM 1588 OE1 GLN B 150 23.950 4.128 7.416 1.00 32.11 O ATOM 1589 NE2 GLN B 150 22.864 5.853 8.289 1.00 42.24 N ATOM 0 H GLN B 150 20.971 2.666 11.672 1.00 34.25 H new ATOM 0 HA GLN B 150 19.552 2.732 9.277 1.00 52.25 H new ATOM 0 HB2 GLN B 150 21.607 4.031 10.185 1.00 61.24 H new ATOM 0 HB3 GLN B 150 22.554 2.656 9.654 1.00 61.24 H new ATOM 0 HG2 GLN B 150 21.684 2.985 7.344 1.00 71.11 H new ATOM 0 HG3 GLN B 150 20.815 4.403 7.897 1.00 71.11 H new ATOM 0 HE21 GLN B 150 21.992 6.220 8.671 1.00 42.24 H new ATOM 0 HE22 GLN B 150 23.686 6.453 8.226 1.00 42.24 H new ATOM 1598 N VAL B 151 19.980 0.690 7.985 1.00 1.12 N ATOM 1599 CA VAL B 151 20.138 -0.532 7.255 1.00 63.23 C ATOM 1600 C VAL B 151 21.273 -0.426 6.244 1.00 42.15 C ATOM 1601 O VAL B 151 21.098 0.147 5.133 1.00 5.20 O ATOM 1602 CB VAL B 151 18.818 -1.103 6.649 1.00 21.43 C ATOM 1603 CG1 VAL B 151 17.904 -1.577 7.766 1.00 71.12 C ATOM 1604 CG2 VAL B 151 18.090 -0.077 5.805 1.00 51.04 C ATOM 1605 OXT VAL B 151 22.383 -0.854 6.603 1.00 38.99 O ATOM 0 H VAL B 151 19.281 1.326 7.601 1.00 1.12 H new ATOM 0 HA VAL B 151 20.424 -1.286 7.989 1.00 63.23 H new ATOM 0 HB VAL B 151 19.088 -1.938 6.002 1.00 21.43 H new ATOM 0 HG11 VAL B 151 16.984 -1.975 7.339 1.00 71.12 H new ATOM 0 HG12 VAL B 151 18.405 -2.357 8.340 1.00 71.12 H new ATOM 0 HG13 VAL B 151 17.667 -0.740 8.422 1.00 71.12 H new ATOM 0 HG21 VAL B 151 17.177 -0.518 5.403 1.00 51.04 H new ATOM 0 HG22 VAL B 151 17.836 0.786 6.420 1.00 51.04 H new ATOM 0 HG23 VAL B 151 18.732 0.240 4.983 1.00 51.04 H new