USER MOD reduce.3.24.130724 H: found=0, std=0, add=703, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 704 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 375 GLN : amide:sc= -10.2! C(o=-12!,f=-7.6!) USER MOD Set 1.2: A 381 ASN : amide:sc= -2.05 K(o=-12,f=-9.4!) USER MOD Set 2.1: A 374 MET CE :methyl -108:sc= -1.27 (180deg=-7!) USER MOD Set 2.2: A 394 GLN : amide:sc= -8.68! C(o=-10!,f=-10!) USER MOD Set 3.1: A 366 ASN : amide:sc= -3.74! K(o=-4.1!,f=-0.21) USER MOD Set 3.2: A 367 ASN : amide:sc= -0.334 K(o=-4.1,f=-0.22) USER MOD Set 4.1: A 347 HIS : no HE2:sc= -0.241! C(o=-1.2!,f=-7.2!) USER MOD Set 4.2: A 391 GLN : amide:sc= -0.995 X(o=-1.2,f=-1.7) USER MOD Set 5.1: A 321 SER OG : rot -147:sc= 0.597 USER MOD Set 5.2: A 325 THR OG1 : rot 180:sc= 0.798 USER MOD Set 6.1: A 311 LYS NZ :NH3+ -111:sc= 0.647 (180deg=-0.168) USER MOD Set 6.2: A 333 SER OG : rot -85:sc= 1.7 USER MOD Single : A 303 THR OG1 : rot 180:sc= 0 USER MOD Single : A 304 TYR OH : rot 180:sc= 0 USER MOD Single : A 305 THR OG1 : rot 180:sc= 0.132 USER MOD Single : A 309 LYS NZ :NH3+ 142:sc= 1.27 (180deg=1.17) USER MOD Single : A 310 THR OG1 : rot -47:sc= 0.276 USER MOD Single : A 313 THR OG1 : rot 180:sc= 0 USER MOD Single : A 315 LYS NZ :NH3+ -177:sc= 1.27 (180deg=1.18) USER MOD Single : A 319 THR OG1 : rot 67:sc= 1.35 USER MOD Single : A 323 HIS : no HD1:sc= -0.0925 X(o=-0.092,f=-0.023) USER MOD Single : A 328 MET CE :methyl -129:sc= -1.66! (180deg=-4.05!) USER MOD Single : A 335 THR OG1 : rot -160:sc= -0.943 USER MOD Single : A 353 ASN : amide:sc= 1.22 K(o=1.2,f=-9.2!) USER MOD Single : A 356 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 359 THR OG1 : rot 180:sc= -0.274 USER MOD Single : A 361 ASN : amide:sc= -0.122 K(o=-0.12,f=-1.5!) USER MOD Single : A 363 THR OG1 : rot 180:sc= 0 USER MOD Single : A 364 MET CE :methyl 143:sc= -3.81! (180deg=-6.43!) USER MOD Single : A 384 TYR OH : rot 180:sc= 0 USER MOD Single : A 389 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 390 HIS : no HD1:sc= -0.771 X(o=-0.77,f=-0.81) USER MOD Single : A 395 LYS NZ :NH3+ 141:sc= -1.41 (180deg=-3.55!) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 303 17.780 -4.119 -2.811 1.00 0.00 N ATOM 2 CA THR A 303 17.017 -4.887 -3.785 1.00 0.00 C ATOM 3 C THR A 303 15.836 -4.080 -4.347 1.00 0.00 C ATOM 4 O THR A 303 14.671 -4.376 -4.090 1.00 0.00 O ATOM 5 CB THR A 303 16.535 -6.232 -3.177 1.00 0.00 C ATOM 6 OG1 THR A 303 15.840 -7.019 -4.153 1.00 0.00 O ATOM 7 CG2 THR A 303 15.642 -6.008 -1.966 1.00 0.00 C ATOM 0 HA THR A 303 17.683 -5.111 -4.619 1.00 0.00 H new ATOM 0 HB THR A 303 17.424 -6.774 -2.854 1.00 0.00 H new ATOM 0 HG1 THR A 303 15.548 -7.861 -3.746 1.00 0.00 H new ATOM 0 HG21 THR A 303 15.323 -6.971 -1.566 1.00 0.00 H new ATOM 0 HG22 THR A 303 16.196 -5.463 -1.202 1.00 0.00 H new ATOM 0 HG23 THR A 303 14.766 -5.430 -2.262 1.00 0.00 H new ATOM 15 N TYR A 304 16.138 -3.045 -5.121 1.00 0.00 N ATOM 16 CA TYR A 304 15.089 -2.282 -5.771 1.00 0.00 C ATOM 17 C TYR A 304 14.460 -3.136 -6.865 1.00 0.00 C ATOM 18 O TYR A 304 15.123 -3.534 -7.824 1.00 0.00 O ATOM 19 CB TYR A 304 15.610 -0.942 -6.314 1.00 0.00 C ATOM 20 CG TYR A 304 16.572 -1.027 -7.481 1.00 0.00 C ATOM 21 CD1 TYR A 304 17.871 -1.490 -7.316 1.00 0.00 C ATOM 22 CD2 TYR A 304 16.181 -0.613 -8.747 1.00 0.00 C ATOM 23 CE1 TYR A 304 18.753 -1.538 -8.380 1.00 0.00 C ATOM 24 CE2 TYR A 304 17.052 -0.663 -9.816 1.00 0.00 C ATOM 25 CZ TYR A 304 18.338 -1.125 -9.629 1.00 0.00 C ATOM 26 OH TYR A 304 19.213 -1.165 -10.692 1.00 0.00 O ATOM 0 H TYR A 304 17.087 -2.721 -5.310 1.00 0.00 H new ATOM 0 HA TYR A 304 14.324 -2.029 -5.037 1.00 0.00 H new ATOM 0 HB2 TYR A 304 14.755 -0.338 -6.617 1.00 0.00 H new ATOM 0 HB3 TYR A 304 16.103 -0.410 -5.500 1.00 0.00 H new ATOM 0 HD1 TYR A 304 18.198 -1.818 -6.340 1.00 0.00 H new ATOM 0 HD2 TYR A 304 15.177 -0.245 -8.898 1.00 0.00 H new ATOM 0 HE1 TYR A 304 19.761 -1.897 -8.234 1.00 0.00 H new ATOM 0 HE2 TYR A 304 16.728 -0.342 -10.795 1.00 0.00 H new ATOM 0 HH TYR A 304 18.762 -0.841 -11.499 1.00 0.00 H new ATOM 36 N THR A 305 13.179 -3.428 -6.701 1.00 0.00 N ATOM 37 CA THR A 305 12.500 -4.430 -7.509 1.00 0.00 C ATOM 38 C THR A 305 11.109 -4.653 -6.939 1.00 0.00 C ATOM 39 O THR A 305 10.643 -3.849 -6.134 1.00 0.00 O ATOM 40 CB THR A 305 13.289 -5.769 -7.530 1.00 0.00 C ATOM 41 OG1 THR A 305 12.771 -6.647 -8.541 1.00 0.00 O ATOM 42 CG2 THR A 305 13.233 -6.470 -6.177 1.00 0.00 C ATOM 0 H THR A 305 12.582 -2.979 -6.006 1.00 0.00 H new ATOM 0 HA THR A 305 12.434 -4.072 -8.536 1.00 0.00 H new ATOM 0 HB THR A 305 14.328 -5.528 -7.756 1.00 0.00 H new ATOM 0 HG1 THR A 305 13.281 -7.484 -8.540 1.00 0.00 H new ATOM 0 HG21 THR A 305 13.795 -7.403 -6.227 1.00 0.00 H new ATOM 0 HG22 THR A 305 13.669 -5.824 -5.414 1.00 0.00 H new ATOM 0 HG23 THR A 305 12.195 -6.685 -5.921 1.00 0.00 H new ATOM 50 N VAL A 306 10.432 -5.706 -7.361 1.00 0.00 N ATOM 51 CA VAL A 306 9.186 -6.075 -6.723 1.00 0.00 C ATOM 52 C VAL A 306 9.493 -6.470 -5.285 1.00 0.00 C ATOM 53 O VAL A 306 10.115 -7.505 -5.036 1.00 0.00 O ATOM 54 CB VAL A 306 8.477 -7.241 -7.444 1.00 0.00 C ATOM 55 CG1 VAL A 306 7.115 -7.509 -6.818 1.00 0.00 C ATOM 56 CG2 VAL A 306 8.337 -6.948 -8.929 1.00 0.00 C ATOM 0 H VAL A 306 10.720 -6.311 -8.130 1.00 0.00 H new ATOM 0 HA VAL A 306 8.509 -5.222 -6.764 1.00 0.00 H new ATOM 0 HB VAL A 306 9.088 -8.136 -7.330 1.00 0.00 H new ATOM 0 HG11 VAL A 306 6.631 -8.334 -7.340 1.00 0.00 H new ATOM 0 HG12 VAL A 306 7.242 -7.769 -5.767 1.00 0.00 H new ATOM 0 HG13 VAL A 306 6.496 -6.616 -6.898 1.00 0.00 H new ATOM 0 HG21 VAL A 306 7.835 -7.782 -9.419 1.00 0.00 H new ATOM 0 HG22 VAL A 306 7.750 -6.040 -9.067 1.00 0.00 H new ATOM 0 HG23 VAL A 306 9.325 -6.812 -9.368 1.00 0.00 H new ATOM 66 N CYS A 307 9.079 -5.638 -4.345 1.00 0.00 N ATOM 67 CA CYS A 307 9.424 -5.831 -2.943 1.00 0.00 C ATOM 68 C CYS A 307 8.647 -7.004 -2.368 1.00 0.00 C ATOM 69 O CYS A 307 7.492 -7.239 -2.742 1.00 0.00 O ATOM 70 CB CYS A 307 9.116 -4.550 -2.163 1.00 0.00 C ATOM 71 SG CYS A 307 7.929 -3.455 -3.017 1.00 0.00 S ATOM 0 H CYS A 307 8.501 -4.818 -4.526 1.00 0.00 H new ATOM 0 HA CYS A 307 10.488 -6.052 -2.859 1.00 0.00 H new ATOM 0 HB2 CYS A 307 8.716 -4.816 -1.184 1.00 0.00 H new ATOM 0 HB3 CYS A 307 10.044 -4.005 -1.991 1.00 0.00 H new ATOM 76 N ASP A 308 9.281 -7.747 -1.470 1.00 0.00 N ATOM 77 CA ASP A 308 8.655 -8.928 -0.899 1.00 0.00 C ATOM 78 C ASP A 308 7.527 -8.537 0.041 1.00 0.00 C ATOM 79 O ASP A 308 7.693 -7.707 0.938 1.00 0.00 O ATOM 80 CB ASP A 308 9.665 -9.816 -0.184 1.00 0.00 C ATOM 81 CG ASP A 308 9.036 -11.121 0.257 1.00 0.00 C ATOM 82 OD1 ASP A 308 8.457 -11.165 1.356 1.00 0.00 O ATOM 83 OD2 ASP A 308 9.118 -12.109 -0.502 1.00 0.00 O ATOM 0 H ASP A 308 10.221 -7.553 -1.125 1.00 0.00 H new ATOM 0 HA ASP A 308 8.238 -9.506 -1.724 1.00 0.00 H new ATOM 0 HB2 ASP A 308 10.506 -10.021 -0.847 1.00 0.00 H new ATOM 0 HB3 ASP A 308 10.064 -9.291 0.684 1.00 0.00 H new ATOM 88 N LYS A 309 6.383 -9.134 -0.233 1.00 0.00 N ATOM 89 CA LYS A 309 5.110 -8.847 0.415 1.00 0.00 C ATOM 90 C LYS A 309 5.145 -8.712 1.940 1.00 0.00 C ATOM 91 O LYS A 309 4.220 -8.149 2.516 1.00 0.00 O ATOM 92 CB LYS A 309 4.100 -9.928 0.005 1.00 0.00 C ATOM 93 CG LYS A 309 4.574 -11.362 0.234 1.00 0.00 C ATOM 94 CD LYS A 309 4.350 -11.817 1.672 1.00 0.00 C ATOM 95 CE LYS A 309 4.656 -13.296 1.854 1.00 0.00 C ATOM 96 NZ LYS A 309 4.337 -13.772 3.227 1.00 0.00 N ATOM 0 H LYS A 309 6.308 -9.863 -0.942 1.00 0.00 H new ATOM 0 HA LYS A 309 4.819 -7.855 0.069 1.00 0.00 H new ATOM 0 HB2 LYS A 309 3.175 -9.772 0.561 1.00 0.00 H new ATOM 0 HB3 LYS A 309 3.862 -9.802 -1.051 1.00 0.00 H new ATOM 0 HG2 LYS A 309 4.044 -12.031 -0.444 1.00 0.00 H new ATOM 0 HG3 LYS A 309 5.634 -11.436 -0.008 1.00 0.00 H new ATOM 0 HD2 LYS A 309 4.981 -11.231 2.340 1.00 0.00 H new ATOM 0 HD3 LYS A 309 3.316 -11.623 1.957 1.00 0.00 H new ATOM 0 HE2 LYS A 309 4.085 -13.875 1.129 1.00 0.00 H new ATOM 0 HE3 LYS A 309 5.711 -13.475 1.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 309 3.938 -14.731 3.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 309 5.205 -13.787 3.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 309 3.645 -13.131 3.664 1.00 0.00 H new ATOM 110 N THR A 310 6.163 -9.201 2.616 1.00 0.00 N ATOM 111 CA THR A 310 6.125 -9.237 4.063 1.00 0.00 C ATOM 112 C THR A 310 7.078 -8.206 4.682 1.00 0.00 C ATOM 113 O THR A 310 7.242 -8.149 5.902 1.00 0.00 O ATOM 114 CB THR A 310 6.500 -10.651 4.533 1.00 0.00 C ATOM 115 OG1 THR A 310 6.207 -10.822 5.926 1.00 0.00 O ATOM 116 CG2 THR A 310 7.975 -10.917 4.277 1.00 0.00 C ATOM 0 H THR A 310 7.014 -9.574 2.196 1.00 0.00 H new ATOM 0 HA THR A 310 5.117 -8.984 4.391 1.00 0.00 H new ATOM 0 HB THR A 310 5.904 -11.366 3.965 1.00 0.00 H new ATOM 0 HG1 THR A 310 6.546 -10.052 6.428 1.00 0.00 H new ATOM 0 HG21 THR A 310 8.227 -11.922 4.615 1.00 0.00 H new ATOM 0 HG22 THR A 310 8.181 -10.830 3.210 1.00 0.00 H new ATOM 0 HG23 THR A 310 8.576 -10.189 4.823 1.00 0.00 H new ATOM 124 N LYS A 311 7.687 -7.379 3.843 1.00 0.00 N ATOM 125 CA LYS A 311 8.749 -6.487 4.300 1.00 0.00 C ATOM 126 C LYS A 311 8.227 -5.172 4.853 1.00 0.00 C ATOM 127 O LYS A 311 8.902 -4.528 5.656 1.00 0.00 O ATOM 128 CB LYS A 311 9.738 -6.221 3.176 1.00 0.00 C ATOM 129 CG LYS A 311 10.609 -7.423 2.875 1.00 0.00 C ATOM 130 CD LYS A 311 11.812 -7.033 2.051 1.00 0.00 C ATOM 131 CE LYS A 311 12.689 -6.035 2.798 1.00 0.00 C ATOM 132 NZ LYS A 311 13.248 -6.619 4.051 1.00 0.00 N ATOM 0 H LYS A 311 7.468 -7.306 2.850 1.00 0.00 H new ATOM 0 HA LYS A 311 9.251 -7.000 5.121 1.00 0.00 H new ATOM 0 HB2 LYS A 311 9.193 -5.937 2.276 1.00 0.00 H new ATOM 0 HB3 LYS A 311 10.371 -5.376 3.446 1.00 0.00 H new ATOM 0 HG2 LYS A 311 10.937 -7.880 3.808 1.00 0.00 H new ATOM 0 HG3 LYS A 311 10.026 -8.173 2.340 1.00 0.00 H new ATOM 0 HD2 LYS A 311 12.394 -7.922 1.808 1.00 0.00 H new ATOM 0 HD3 LYS A 311 11.484 -6.598 1.107 1.00 0.00 H new ATOM 0 HE2 LYS A 311 13.505 -5.713 2.151 1.00 0.00 H new ATOM 0 HE3 LYS A 311 12.105 -5.147 3.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 311 12.812 -6.157 4.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 311 13.046 -7.639 4.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 311 14.277 -6.469 4.075 1.00 0.00 H new ATOM 146 N PHE A 312 7.056 -4.757 4.410 1.00 0.00 N ATOM 147 CA PHE A 312 6.462 -3.533 4.906 1.00 0.00 C ATOM 148 C PHE A 312 5.727 -3.768 6.215 1.00 0.00 C ATOM 149 O PHE A 312 5.598 -4.898 6.691 1.00 0.00 O ATOM 150 CB PHE A 312 5.520 -2.903 3.875 1.00 0.00 C ATOM 151 CG PHE A 312 5.280 -3.745 2.663 1.00 0.00 C ATOM 152 CD1 PHE A 312 4.255 -4.667 2.639 1.00 0.00 C ATOM 153 CD2 PHE A 312 6.083 -3.607 1.544 1.00 0.00 C ATOM 154 CE1 PHE A 312 4.035 -5.437 1.514 1.00 0.00 C ATOM 155 CE2 PHE A 312 5.867 -4.375 0.419 1.00 0.00 C ATOM 156 CZ PHE A 312 4.841 -5.291 0.403 1.00 0.00 C ATOM 0 H PHE A 312 6.500 -5.248 3.710 1.00 0.00 H new ATOM 0 HA PHE A 312 7.279 -2.835 5.089 1.00 0.00 H new ATOM 0 HB2 PHE A 312 4.563 -2.696 4.354 1.00 0.00 H new ATOM 0 HB3 PHE A 312 5.933 -1.945 3.561 1.00 0.00 H new ATOM 0 HD1 PHE A 312 3.621 -4.788 3.505 1.00 0.00 H new ATOM 0 HD2 PHE A 312 6.889 -2.888 1.552 1.00 0.00 H new ATOM 0 HE1 PHE A 312 3.229 -6.156 1.503 1.00 0.00 H new ATOM 0 HE2 PHE A 312 6.502 -4.258 -0.447 1.00 0.00 H new ATOM 0 HZ PHE A 312 4.667 -5.894 -0.476 1.00 0.00 H new ATOM 166 N THR A 313 5.256 -2.678 6.777 1.00 0.00 N ATOM 167 CA THR A 313 4.568 -2.696 8.052 1.00 0.00 C ATOM 168 C THR A 313 3.379 -1.753 8.010 1.00 0.00 C ATOM 169 O THR A 313 3.355 -0.812 7.204 1.00 0.00 O ATOM 170 CB THR A 313 5.506 -2.278 9.204 1.00 0.00 C ATOM 171 OG1 THR A 313 6.153 -1.036 8.890 1.00 0.00 O ATOM 172 CG2 THR A 313 6.543 -3.340 9.485 1.00 0.00 C ATOM 0 H THR A 313 5.339 -1.750 6.363 1.00 0.00 H new ATOM 0 HA THR A 313 4.230 -3.716 8.234 1.00 0.00 H new ATOM 0 HB THR A 313 4.897 -2.153 10.100 1.00 0.00 H new ATOM 0 HG1 THR A 313 6.744 -0.779 9.628 1.00 0.00 H new ATOM 0 HG21 THR A 313 7.187 -3.013 10.302 1.00 0.00 H new ATOM 0 HG22 THR A 313 6.046 -4.269 9.764 1.00 0.00 H new ATOM 0 HG23 THR A 313 7.146 -3.505 8.592 1.00 0.00 H new ATOM 180 N TRP A 314 2.399 -1.993 8.877 1.00 0.00 N ATOM 181 CA TRP A 314 1.225 -1.135 8.942 1.00 0.00 C ATOM 182 C TRP A 314 1.578 0.149 9.656 1.00 0.00 C ATOM 183 O TRP A 314 1.505 0.230 10.886 1.00 0.00 O ATOM 184 CB TRP A 314 0.083 -1.803 9.725 1.00 0.00 C ATOM 185 CG TRP A 314 -0.513 -3.029 9.101 1.00 0.00 C ATOM 186 CD1 TRP A 314 -1.644 -3.082 8.341 1.00 0.00 C ATOM 187 CD2 TRP A 314 -0.039 -4.378 9.212 1.00 0.00 C ATOM 188 NE1 TRP A 314 -1.908 -4.377 7.977 1.00 0.00 N ATOM 189 CE2 TRP A 314 -0.934 -5.193 8.492 1.00 0.00 C ATOM 190 CE3 TRP A 314 1.056 -4.978 9.844 1.00 0.00 C ATOM 191 CZ2 TRP A 314 -0.770 -6.573 8.391 1.00 0.00 C ATOM 192 CZ3 TRP A 314 1.217 -6.346 9.741 1.00 0.00 C ATOM 193 CH2 TRP A 314 0.310 -7.131 9.018 1.00 0.00 C ATOM 0 H TRP A 314 2.396 -2.769 9.539 1.00 0.00 H new ATOM 0 HA TRP A 314 0.900 -0.945 7.919 1.00 0.00 H new ATOM 0 HB2 TRP A 314 0.454 -2.067 10.715 1.00 0.00 H new ATOM 0 HB3 TRP A 314 -0.711 -1.070 9.867 1.00 0.00 H new ATOM 0 HD1 TRP A 314 -2.245 -2.228 8.066 1.00 0.00 H new ATOM 0 HE1 TRP A 314 -2.701 -4.684 7.414 1.00 0.00 H new ATOM 0 HE3 TRP A 314 1.763 -4.382 10.402 1.00 0.00 H new ATOM 0 HZ2 TRP A 314 -1.471 -7.180 7.837 1.00 0.00 H new ATOM 0 HZ3 TRP A 314 2.058 -6.819 10.227 1.00 0.00 H new ATOM 0 HH2 TRP A 314 0.466 -8.198 8.954 1.00 0.00 H new ATOM 204 N LYS A 315 1.969 1.147 8.897 1.00 0.00 N ATOM 205 CA LYS A 315 2.121 2.461 9.462 1.00 0.00 C ATOM 206 C LYS A 315 0.748 3.096 9.621 1.00 0.00 C ATOM 207 O LYS A 315 0.392 3.574 10.699 1.00 0.00 O ATOM 208 CB LYS A 315 3.027 3.342 8.610 1.00 0.00 C ATOM 209 CG LYS A 315 3.347 4.637 9.317 1.00 0.00 C ATOM 210 CD LYS A 315 4.165 5.590 8.472 1.00 0.00 C ATOM 211 CE LYS A 315 4.430 6.880 9.238 1.00 0.00 C ATOM 212 NZ LYS A 315 5.118 7.898 8.407 1.00 0.00 N ATOM 0 H LYS A 315 2.184 1.074 7.903 1.00 0.00 H new ATOM 0 HA LYS A 315 2.598 2.367 10.438 1.00 0.00 H new ATOM 0 HB2 LYS A 315 3.951 2.809 8.385 1.00 0.00 H new ATOM 0 HB3 LYS A 315 2.542 3.554 7.657 1.00 0.00 H new ATOM 0 HG2 LYS A 315 2.416 5.125 9.607 1.00 0.00 H new ATOM 0 HG3 LYS A 315 3.891 4.417 10.236 1.00 0.00 H new ATOM 0 HD2 LYS A 315 5.110 5.122 8.195 1.00 0.00 H new ATOM 0 HD3 LYS A 315 3.636 5.811 7.545 1.00 0.00 H new ATOM 0 HE2 LYS A 315 3.485 7.287 9.598 1.00 0.00 H new ATOM 0 HE3 LYS A 315 5.037 6.660 10.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 315 5.322 8.738 8.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 315 6.009 7.504 8.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 315 4.506 8.167 7.610 1.00 0.00 H new ATOM 226 N ARG A 316 -0.023 3.101 8.540 1.00 0.00 N ATOM 227 CA ARG A 316 -1.406 3.531 8.579 1.00 0.00 C ATOM 228 C ARG A 316 -2.236 2.669 7.625 1.00 0.00 C ATOM 229 O ARG A 316 -1.957 2.606 6.427 1.00 0.00 O ATOM 230 CB ARG A 316 -1.504 5.022 8.218 1.00 0.00 C ATOM 231 CG ARG A 316 -2.914 5.502 7.900 1.00 0.00 C ATOM 232 CD ARG A 316 -2.998 7.024 7.871 1.00 0.00 C ATOM 233 NE ARG A 316 -1.932 7.636 7.072 1.00 0.00 N ATOM 234 CZ ARG A 316 -2.097 8.723 6.316 1.00 0.00 C ATOM 235 NH1 ARG A 316 -3.276 9.332 6.271 1.00 0.00 N ATOM 236 NH2 ARG A 316 -1.068 9.219 5.640 1.00 0.00 N ATOM 0 H ARG A 316 0.296 2.807 7.617 1.00 0.00 H new ATOM 0 HA ARG A 316 -1.803 3.406 9.587 1.00 0.00 H new ATOM 0 HB2 ARG A 316 -1.112 5.610 9.047 1.00 0.00 H new ATOM 0 HB3 ARG A 316 -0.864 5.218 7.358 1.00 0.00 H new ATOM 0 HG2 ARG A 316 -3.226 5.102 6.935 1.00 0.00 H new ATOM 0 HG3 ARG A 316 -3.608 5.113 8.646 1.00 0.00 H new ATOM 0 HD2 ARG A 316 -3.966 7.322 7.467 1.00 0.00 H new ATOM 0 HD3 ARG A 316 -2.947 7.406 8.891 1.00 0.00 H new ATOM 0 HE ARG A 316 -1.008 7.205 7.095 1.00 0.00 H new ATOM 0 HH11 ARG A 316 -4.059 8.969 6.815 1.00 0.00 H new ATOM 0 HH12 ARG A 316 -3.399 10.163 5.692 1.00 0.00 H new ATOM 0 HH21 ARG A 316 -0.154 8.769 5.699 1.00 0.00 H new ATOM 0 HH22 ARG A 316 -1.191 10.050 5.061 1.00 0.00 H new ATOM 250 N ALA A 317 -3.241 1.999 8.172 1.00 0.00 N ATOM 251 CA ALA A 317 -4.109 1.114 7.395 1.00 0.00 C ATOM 252 C ALA A 317 -5.031 1.938 6.506 1.00 0.00 C ATOM 253 O ALA A 317 -5.180 3.137 6.747 1.00 0.00 O ATOM 254 CB ALA A 317 -4.911 0.237 8.339 1.00 0.00 C ATOM 0 H ALA A 317 -3.480 2.051 9.162 1.00 0.00 H new ATOM 0 HA ALA A 317 -3.501 0.475 6.755 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -5.558 -0.423 7.761 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -4.231 -0.361 8.946 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -5.520 0.865 8.989 1.00 0.00 H new ATOM 260 N PRO A 318 -5.649 1.327 5.462 1.00 0.00 N ATOM 261 CA PRO A 318 -6.513 2.046 4.529 1.00 0.00 C ATOM 262 C PRO A 318 -7.444 3.037 5.226 1.00 0.00 C ATOM 263 O PRO A 318 -8.311 2.663 6.018 1.00 0.00 O ATOM 264 CB PRO A 318 -7.324 0.944 3.825 1.00 0.00 C ATOM 265 CG PRO A 318 -6.834 -0.364 4.369 1.00 0.00 C ATOM 266 CD PRO A 318 -5.536 -0.090 5.084 1.00 0.00 C ATOM 0 HA PRO A 318 -5.924 2.651 3.840 1.00 0.00 H new ATOM 0 HB2 PRO A 318 -8.390 1.067 4.014 1.00 0.00 H new ATOM 0 HB3 PRO A 318 -7.185 0.991 2.745 1.00 0.00 H new ATOM 0 HG2 PRO A 318 -7.566 -0.795 5.052 1.00 0.00 H new ATOM 0 HG3 PRO A 318 -6.686 -1.084 3.564 1.00 0.00 H new ATOM 0 HD2 PRO A 318 -5.415 -0.731 5.958 1.00 0.00 H new ATOM 0 HD3 PRO A 318 -4.676 -0.266 4.438 1.00 0.00 H new ATOM 274 N THR A 319 -7.227 4.298 4.922 1.00 0.00 N ATOM 275 CA THR A 319 -7.920 5.399 5.547 1.00 0.00 C ATOM 276 C THR A 319 -8.446 6.345 4.474 1.00 0.00 C ATOM 277 O THR A 319 -7.745 6.637 3.515 1.00 0.00 O ATOM 278 CB THR A 319 -6.944 6.153 6.470 1.00 0.00 C ATOM 279 OG1 THR A 319 -6.558 5.319 7.571 1.00 0.00 O ATOM 280 CG2 THR A 319 -7.543 7.452 6.974 1.00 0.00 C ATOM 0 H THR A 319 -6.549 4.591 4.218 1.00 0.00 H new ATOM 0 HA THR A 319 -8.757 5.021 6.133 1.00 0.00 H new ATOM 0 HB THR A 319 -6.058 6.403 5.886 1.00 0.00 H new ATOM 0 HG1 THR A 319 -6.024 4.567 7.240 1.00 0.00 H new ATOM 0 HG21 THR A 319 -6.826 7.956 7.622 1.00 0.00 H new ATOM 0 HG22 THR A 319 -7.782 8.095 6.127 1.00 0.00 H new ATOM 0 HG23 THR A 319 -8.453 7.239 7.536 1.00 0.00 H new ATOM 288 N ASP A 320 -9.674 6.811 4.629 1.00 0.00 N ATOM 289 CA ASP A 320 -10.262 7.728 3.655 1.00 0.00 C ATOM 290 C ASP A 320 -9.414 8.989 3.575 1.00 0.00 C ATOM 291 O ASP A 320 -9.280 9.698 4.573 1.00 0.00 O ATOM 292 CB ASP A 320 -11.698 8.114 4.022 1.00 0.00 C ATOM 293 CG ASP A 320 -12.567 6.930 4.385 1.00 0.00 C ATOM 294 OD1 ASP A 320 -12.942 6.151 3.481 1.00 0.00 O ATOM 295 OD2 ASP A 320 -12.879 6.777 5.584 1.00 0.00 O ATOM 0 H ASP A 320 -10.283 6.574 5.412 1.00 0.00 H new ATOM 0 HA ASP A 320 -10.287 7.217 2.693 1.00 0.00 H new ATOM 0 HB2 ASP A 320 -11.676 8.809 4.861 1.00 0.00 H new ATOM 0 HB3 ASP A 320 -12.150 8.642 3.182 1.00 0.00 H new ATOM 300 N SER A 321 -8.828 9.253 2.412 1.00 0.00 N ATOM 301 CA SER A 321 -7.793 10.268 2.269 1.00 0.00 C ATOM 302 C SER A 321 -8.245 11.606 2.840 1.00 0.00 C ATOM 303 O SER A 321 -7.565 12.206 3.679 1.00 0.00 O ATOM 304 CB SER A 321 -7.444 10.425 0.780 1.00 0.00 C ATOM 305 OG SER A 321 -8.556 10.908 0.041 1.00 0.00 O ATOM 0 H SER A 321 -9.057 8.770 1.544 1.00 0.00 H new ATOM 0 HA SER A 321 -6.913 9.948 2.828 1.00 0.00 H new ATOM 0 HB2 SER A 321 -6.605 11.112 0.671 1.00 0.00 H new ATOM 0 HB3 SER A 321 -7.124 9.465 0.375 1.00 0.00 H new ATOM 0 HG SER A 321 -8.537 10.530 -0.863 1.00 0.00 H new ATOM 311 N GLY A 322 -9.396 12.052 2.367 1.00 0.00 N ATOM 312 CA GLY A 322 -9.956 13.314 2.782 1.00 0.00 C ATOM 313 C GLY A 322 -10.613 14.015 1.614 1.00 0.00 C ATOM 314 O GLY A 322 -11.551 14.786 1.785 1.00 0.00 O ATOM 0 H GLY A 322 -9.963 11.546 1.686 1.00 0.00 H new ATOM 0 HA2 GLY A 322 -10.688 13.151 3.573 1.00 0.00 H new ATOM 0 HA3 GLY A 322 -9.172 13.946 3.198 1.00 0.00 H new ATOM 318 N HIS A 323 -10.134 13.710 0.412 1.00 0.00 N ATOM 319 CA HIS A 323 -10.649 14.331 -0.805 1.00 0.00 C ATOM 320 C HIS A 323 -11.648 13.395 -1.489 1.00 0.00 C ATOM 321 O HIS A 323 -12.004 13.587 -2.652 1.00 0.00 O ATOM 322 CB HIS A 323 -9.485 14.666 -1.744 1.00 0.00 C ATOM 323 CG HIS A 323 -9.806 15.700 -2.783 1.00 0.00 C ATOM 324 ND1 HIS A 323 -9.700 17.055 -2.552 1.00 0.00 N ATOM 325 CD2 HIS A 323 -10.216 15.572 -4.065 1.00 0.00 C ATOM 326 CE1 HIS A 323 -10.031 17.712 -3.645 1.00 0.00 C ATOM 327 NE2 HIS A 323 -10.349 16.837 -4.580 1.00 0.00 N ATOM 0 H HIS A 323 -9.387 13.034 0.254 1.00 0.00 H new ATOM 0 HA HIS A 323 -11.168 15.255 -0.550 1.00 0.00 H new ATOM 0 HB2 HIS A 323 -8.642 15.017 -1.148 1.00 0.00 H new ATOM 0 HB3 HIS A 323 -9.163 13.753 -2.245 1.00 0.00 H new ATOM 0 HD2 HIS A 323 -10.404 14.646 -4.587 1.00 0.00 H new ATOM 0 HE1 HIS A 323 -10.040 18.786 -3.757 1.00 0.00 H new ATOM 0 HE2 HIS A 323 -10.645 17.064 -5.529 1.00 0.00 H new ATOM 336 N ASP A 324 -12.040 12.358 -0.743 1.00 0.00 N ATOM 337 CA ASP A 324 -13.065 11.384 -1.156 1.00 0.00 C ATOM 338 C ASP A 324 -12.420 10.265 -1.968 1.00 0.00 C ATOM 339 O ASP A 324 -12.811 9.964 -3.096 1.00 0.00 O ATOM 340 CB ASP A 324 -14.220 12.044 -1.927 1.00 0.00 C ATOM 341 CG ASP A 324 -15.417 11.128 -2.094 1.00 0.00 C ATOM 342 OD1 ASP A 324 -16.070 10.811 -1.081 1.00 0.00 O ATOM 343 OD2 ASP A 324 -15.728 10.744 -3.242 1.00 0.00 O ATOM 0 H ASP A 324 -11.650 12.165 0.180 1.00 0.00 H new ATOM 0 HA ASP A 324 -13.505 10.957 -0.255 1.00 0.00 H new ATOM 0 HB2 ASP A 324 -14.531 12.948 -1.403 1.00 0.00 H new ATOM 0 HB3 ASP A 324 -13.865 12.352 -2.910 1.00 0.00 H new ATOM 348 N THR A 325 -11.405 9.682 -1.355 1.00 0.00 N ATOM 349 CA THR A 325 -10.667 8.543 -1.876 1.00 0.00 C ATOM 350 C THR A 325 -9.990 7.874 -0.689 1.00 0.00 C ATOM 351 O THR A 325 -10.338 8.188 0.446 1.00 0.00 O ATOM 352 CB THR A 325 -9.623 8.957 -2.930 1.00 0.00 C ATOM 353 OG1 THR A 325 -9.090 10.253 -2.628 1.00 0.00 O ATOM 354 CG2 THR A 325 -10.233 8.952 -4.324 1.00 0.00 C ATOM 0 H THR A 325 -11.059 9.999 -0.449 1.00 0.00 H new ATOM 0 HA THR A 325 -11.351 7.862 -2.381 1.00 0.00 H new ATOM 0 HB THR A 325 -8.811 8.231 -2.906 1.00 0.00 H new ATOM 0 HG1 THR A 325 -8.427 10.500 -3.306 1.00 0.00 H new ATOM 0 HG21 THR A 325 -9.478 9.247 -5.053 1.00 0.00 H new ATOM 0 HG22 THR A 325 -10.593 7.951 -4.560 1.00 0.00 H new ATOM 0 HG23 THR A 325 -11.066 9.654 -4.359 1.00 0.00 H new ATOM 362 N VAL A 326 -9.052 6.959 -0.897 1.00 0.00 N ATOM 363 CA VAL A 326 -8.418 6.292 0.234 1.00 0.00 C ATOM 364 C VAL A 326 -6.906 6.414 0.180 1.00 0.00 C ATOM 365 O VAL A 326 -6.305 6.446 -0.885 1.00 0.00 O ATOM 366 CB VAL A 326 -8.761 4.793 0.300 1.00 0.00 C ATOM 367 CG1 VAL A 326 -8.814 4.327 1.734 1.00 0.00 C ATOM 368 CG2 VAL A 326 -10.069 4.504 -0.379 1.00 0.00 C ATOM 0 H VAL A 326 -8.719 6.666 -1.815 1.00 0.00 H new ATOM 0 HA VAL A 326 -8.808 6.794 1.119 1.00 0.00 H new ATOM 0 HB VAL A 326 -7.975 4.249 -0.224 1.00 0.00 H new ATOM 0 HG11 VAL A 326 -9.058 3.265 1.763 1.00 0.00 H new ATOM 0 HG12 VAL A 326 -7.845 4.490 2.206 1.00 0.00 H new ATOM 0 HG13 VAL A 326 -9.578 4.889 2.271 1.00 0.00 H new ATOM 0 HG21 VAL A 326 -10.284 3.437 -0.316 1.00 0.00 H new ATOM 0 HG22 VAL A 326 -10.865 5.064 0.111 1.00 0.00 H new ATOM 0 HG23 VAL A 326 -10.009 4.801 -1.426 1.00 0.00 H new ATOM 378 N VAL A 327 -6.316 6.508 1.350 1.00 0.00 N ATOM 379 CA VAL A 327 -4.874 6.477 1.507 1.00 0.00 C ATOM 380 C VAL A 327 -4.461 5.369 2.453 1.00 0.00 C ATOM 381 O VAL A 327 -5.223 4.961 3.325 1.00 0.00 O ATOM 382 CB VAL A 327 -4.338 7.818 2.043 1.00 0.00 C ATOM 383 CG1 VAL A 327 -4.435 8.888 0.975 1.00 0.00 C ATOM 384 CG2 VAL A 327 -5.090 8.233 3.302 1.00 0.00 C ATOM 0 H VAL A 327 -6.825 6.609 2.228 1.00 0.00 H new ATOM 0 HA VAL A 327 -4.448 6.294 0.520 1.00 0.00 H new ATOM 0 HB VAL A 327 -3.288 7.693 2.306 1.00 0.00 H new ATOM 0 HG11 VAL A 327 -4.053 9.830 1.368 1.00 0.00 H new ATOM 0 HG12 VAL A 327 -3.846 8.591 0.108 1.00 0.00 H new ATOM 0 HG13 VAL A 327 -5.477 9.014 0.680 1.00 0.00 H new ATOM 0 HG21 VAL A 327 -4.696 9.183 3.665 1.00 0.00 H new ATOM 0 HG22 VAL A 327 -6.150 8.343 3.073 1.00 0.00 H new ATOM 0 HG23 VAL A 327 -4.962 7.470 4.070 1.00 0.00 H new ATOM 394 N MET A 328 -3.261 4.877 2.260 1.00 0.00 N ATOM 395 CA MET A 328 -2.666 3.918 3.168 1.00 0.00 C ATOM 396 C MET A 328 -1.193 4.240 3.278 1.00 0.00 C ATOM 397 O MET A 328 -0.605 4.769 2.332 1.00 0.00 O ATOM 398 CB MET A 328 -2.867 2.477 2.686 1.00 0.00 C ATOM 399 CG MET A 328 -2.109 2.124 1.410 1.00 0.00 C ATOM 400 SD MET A 328 -2.928 2.759 -0.071 1.00 0.00 S ATOM 401 CE MET A 328 -2.394 1.569 -1.298 1.00 0.00 C ATOM 0 H MET A 328 -2.667 5.128 1.470 1.00 0.00 H new ATOM 0 HA MET A 328 -3.151 3.991 4.142 1.00 0.00 H new ATOM 0 HB2 MET A 328 -2.556 1.796 3.478 1.00 0.00 H new ATOM 0 HB3 MET A 328 -3.931 2.308 2.520 1.00 0.00 H new ATOM 0 HG2 MET A 328 -1.099 2.529 1.466 1.00 0.00 H new ATOM 0 HG3 MET A 328 -2.014 1.041 1.334 1.00 0.00 H new ATOM 0 HE1 MET A 328 -1.983 2.095 -2.160 1.00 0.00 H new ATOM 0 HE2 MET A 328 -1.629 0.922 -0.869 1.00 0.00 H new ATOM 0 HE3 MET A 328 -3.245 0.965 -1.613 1.00 0.00 H new ATOM 411 N GLU A 329 -0.595 3.959 4.415 1.00 0.00 N ATOM 412 CA GLU A 329 0.792 4.324 4.632 1.00 0.00 C ATOM 413 C GLU A 329 1.578 3.118 5.134 1.00 0.00 C ATOM 414 O GLU A 329 1.207 2.495 6.128 1.00 0.00 O ATOM 415 CB GLU A 329 0.862 5.476 5.632 1.00 0.00 C ATOM 416 CG GLU A 329 2.149 6.272 5.566 1.00 0.00 C ATOM 417 CD GLU A 329 2.092 7.525 6.411 1.00 0.00 C ATOM 418 OE1 GLU A 329 0.984 7.898 6.848 1.00 0.00 O ATOM 419 OE2 GLU A 329 3.153 8.138 6.643 1.00 0.00 O ATOM 0 H GLU A 329 -1.041 3.483 5.199 1.00 0.00 H new ATOM 0 HA GLU A 329 1.237 4.649 3.691 1.00 0.00 H new ATOM 0 HB2 GLU A 329 0.022 6.148 5.456 1.00 0.00 H new ATOM 0 HB3 GLU A 329 0.745 5.077 6.639 1.00 0.00 H new ATOM 0 HG2 GLU A 329 2.977 5.648 5.901 1.00 0.00 H new ATOM 0 HG3 GLU A 329 2.353 6.544 4.530 1.00 0.00 H new ATOM 426 N VAL A 330 2.656 2.788 4.438 1.00 0.00 N ATOM 427 CA VAL A 330 3.425 1.583 4.736 1.00 0.00 C ATOM 428 C VAL A 330 4.924 1.874 4.866 1.00 0.00 C ATOM 429 O VAL A 330 5.459 2.753 4.187 1.00 0.00 O ATOM 430 CB VAL A 330 3.186 0.507 3.651 1.00 0.00 C ATOM 431 CG1 VAL A 330 1.855 -0.190 3.886 1.00 0.00 C ATOM 432 CG2 VAL A 330 3.202 1.128 2.257 1.00 0.00 C ATOM 0 H VAL A 330 3.021 3.338 3.660 1.00 0.00 H new ATOM 0 HA VAL A 330 3.077 1.208 5.699 1.00 0.00 H new ATOM 0 HB VAL A 330 3.992 -0.224 3.716 1.00 0.00 H new ATOM 0 HG11 VAL A 330 1.699 -0.945 3.116 1.00 0.00 H new ATOM 0 HG12 VAL A 330 1.862 -0.667 4.866 1.00 0.00 H new ATOM 0 HG13 VAL A 330 1.049 0.542 3.845 1.00 0.00 H new ATOM 0 HG21 VAL A 330 3.032 0.352 1.511 1.00 0.00 H new ATOM 0 HG22 VAL A 330 2.416 1.880 2.184 1.00 0.00 H new ATOM 0 HG23 VAL A 330 4.170 1.597 2.079 1.00 0.00 H new ATOM 442 N GLY A 331 5.599 1.126 5.744 1.00 0.00 N ATOM 443 CA GLY A 331 7.016 1.369 6.008 1.00 0.00 C ATOM 444 C GLY A 331 7.894 0.175 5.640 1.00 0.00 C ATOM 445 O GLY A 331 7.512 -0.963 5.899 1.00 0.00 O ATOM 0 H GLY A 331 5.192 0.357 6.277 1.00 0.00 H new ATOM 0 HA2 GLY A 331 7.342 2.243 5.444 1.00 0.00 H new ATOM 0 HA3 GLY A 331 7.150 1.603 7.064 1.00 0.00 H new ATOM 449 N PHE A 332 9.056 0.421 5.015 1.00 0.00 N ATOM 450 CA PHE A 332 9.970 -0.668 4.625 1.00 0.00 C ATOM 451 C PHE A 332 10.976 -1.018 5.714 1.00 0.00 C ATOM 452 O PHE A 332 11.267 -0.224 6.612 1.00 0.00 O ATOM 453 CB PHE A 332 10.764 -0.296 3.367 1.00 0.00 C ATOM 454 CG PHE A 332 11.960 0.600 3.626 1.00 0.00 C ATOM 455 CD1 PHE A 332 11.880 1.688 4.483 1.00 0.00 C ATOM 456 CD2 PHE A 332 13.172 0.337 3.014 1.00 0.00 C ATOM 457 CE1 PHE A 332 12.982 2.487 4.723 1.00 0.00 C ATOM 458 CE2 PHE A 332 14.276 1.135 3.247 1.00 0.00 C ATOM 459 CZ PHE A 332 14.181 2.210 4.102 1.00 0.00 C ATOM 0 H PHE A 332 9.384 1.355 4.770 1.00 0.00 H new ATOM 0 HA PHE A 332 9.329 -1.531 4.442 1.00 0.00 H new ATOM 0 HB2 PHE A 332 11.108 -1.211 2.885 1.00 0.00 H new ATOM 0 HB3 PHE A 332 10.096 0.203 2.664 1.00 0.00 H new ATOM 0 HD1 PHE A 332 10.943 1.914 4.970 1.00 0.00 H new ATOM 0 HD2 PHE A 332 13.257 -0.505 2.343 1.00 0.00 H new ATOM 0 HE1 PHE A 332 12.904 3.328 5.397 1.00 0.00 H new ATOM 0 HE2 PHE A 332 15.214 0.915 2.758 1.00 0.00 H new ATOM 0 HZ PHE A 332 15.043 2.834 4.285 1.00 0.00 H new ATOM 469 N SER A 333 11.462 -2.243 5.637 1.00 0.00 N ATOM 470 CA SER A 333 12.563 -2.698 6.472 1.00 0.00 C ATOM 471 C SER A 333 13.942 -2.574 5.803 1.00 0.00 C ATOM 472 O SER A 333 14.955 -2.595 6.500 1.00 0.00 O ATOM 473 CB SER A 333 12.303 -4.146 6.869 1.00 0.00 C ATOM 474 OG SER A 333 11.692 -4.851 5.798 1.00 0.00 O ATOM 0 H SER A 333 11.106 -2.952 4.995 1.00 0.00 H new ATOM 0 HA SER A 333 12.599 -2.048 7.346 1.00 0.00 H new ATOM 0 HB2 SER A 333 13.241 -4.629 7.142 1.00 0.00 H new ATOM 0 HB3 SER A 333 11.660 -4.179 7.748 1.00 0.00 H new ATOM 0 HG SER A 333 10.723 -4.706 5.822 1.00 0.00 H new ATOM 480 N GLY A 334 14.009 -2.467 4.471 1.00 0.00 N ATOM 481 CA GLY A 334 15.322 -2.349 3.834 1.00 0.00 C ATOM 482 C GLY A 334 15.289 -2.142 2.323 1.00 0.00 C ATOM 483 O GLY A 334 16.121 -1.424 1.778 1.00 0.00 O ATOM 0 H GLY A 334 13.209 -2.460 3.839 1.00 0.00 H new ATOM 0 HA2 GLY A 334 15.856 -1.514 4.288 1.00 0.00 H new ATOM 0 HA3 GLY A 334 15.896 -3.250 4.050 1.00 0.00 H new ATOM 487 N THR A 335 14.349 -2.797 1.661 1.00 0.00 N ATOM 488 CA THR A 335 14.213 -2.693 0.202 1.00 0.00 C ATOM 489 C THR A 335 14.114 -1.224 -0.244 1.00 0.00 C ATOM 490 O THR A 335 13.287 -0.472 0.259 1.00 0.00 O ATOM 491 CB THR A 335 12.967 -3.461 -0.283 1.00 0.00 C ATOM 492 OG1 THR A 335 13.062 -4.831 0.121 1.00 0.00 O ATOM 493 CG2 THR A 335 12.824 -3.390 -1.796 1.00 0.00 C ATOM 0 H THR A 335 13.664 -3.409 2.104 1.00 0.00 H new ATOM 0 HA THR A 335 15.105 -3.134 -0.243 1.00 0.00 H new ATOM 0 HB THR A 335 12.088 -2.997 0.165 1.00 0.00 H new ATOM 0 HG1 THR A 335 12.466 -5.377 -0.432 1.00 0.00 H new ATOM 0 HG21 THR A 335 11.936 -3.942 -2.104 1.00 0.00 H new ATOM 0 HG22 THR A 335 12.729 -2.349 -2.104 1.00 0.00 H new ATOM 0 HG23 THR A 335 13.704 -3.829 -2.266 1.00 0.00 H new ATOM 501 N ARG A 336 14.965 -0.822 -1.190 1.00 0.00 N ATOM 502 CA ARG A 336 14.973 0.554 -1.667 1.00 0.00 C ATOM 503 C ARG A 336 14.032 0.640 -2.875 1.00 0.00 C ATOM 504 O ARG A 336 13.490 -0.403 -3.243 1.00 0.00 O ATOM 505 CB ARG A 336 16.410 1.004 -1.996 1.00 0.00 C ATOM 506 CG ARG A 336 16.941 0.579 -3.359 1.00 0.00 C ATOM 507 CD ARG A 336 18.117 1.450 -3.775 1.00 0.00 C ATOM 508 NE ARG A 336 17.867 2.874 -3.530 1.00 0.00 N ATOM 509 CZ ARG A 336 18.468 3.868 -4.186 1.00 0.00 C ATOM 510 NH1 ARG A 336 19.333 3.608 -5.156 1.00 0.00 N ATOM 511 NH2 ARG A 336 18.193 5.126 -3.874 1.00 0.00 N ATOM 0 H ARG A 336 15.652 -1.429 -1.636 1.00 0.00 H new ATOM 0 HA ARG A 336 14.615 1.237 -0.897 1.00 0.00 H new ATOM 0 HB2 ARG A 336 16.454 2.091 -1.933 1.00 0.00 H new ATOM 0 HB3 ARG A 336 17.078 0.613 -1.229 1.00 0.00 H new ATOM 0 HG2 ARG A 336 17.250 -0.466 -3.324 1.00 0.00 H new ATOM 0 HG3 ARG A 336 16.147 0.652 -4.103 1.00 0.00 H new ATOM 0 HD2 ARG A 336 19.008 1.140 -3.228 1.00 0.00 H new ATOM 0 HD3 ARG A 336 18.324 1.296 -4.834 1.00 0.00 H new ATOM 0 HE ARG A 336 17.188 3.121 -2.810 1.00 0.00 H new ATOM 0 HH11 ARG A 336 19.544 2.642 -5.406 1.00 0.00 H new ATOM 0 HH12 ARG A 336 19.788 4.374 -5.652 1.00 0.00 H new ATOM 0 HH21 ARG A 336 17.523 5.333 -3.133 1.00 0.00 H new ATOM 0 HH22 ARG A 336 18.651 5.887 -4.374 1.00 0.00 H new ATOM 525 N PRO A 337 13.840 1.835 -3.527 1.00 0.00 N ATOM 526 CA PRO A 337 12.785 2.070 -4.523 1.00 0.00 C ATOM 527 C PRO A 337 12.282 0.819 -5.212 1.00 0.00 C ATOM 528 O PRO A 337 12.853 0.325 -6.186 1.00 0.00 O ATOM 529 CB PRO A 337 13.484 3.006 -5.483 1.00 0.00 C ATOM 530 CG PRO A 337 14.223 3.915 -4.565 1.00 0.00 C ATOM 531 CD PRO A 337 14.616 3.081 -3.358 1.00 0.00 C ATOM 0 HA PRO A 337 11.872 2.465 -4.079 1.00 0.00 H new ATOM 0 HB2 PRO A 337 14.157 2.471 -6.154 1.00 0.00 H new ATOM 0 HB3 PRO A 337 12.776 3.549 -6.109 1.00 0.00 H new ATOM 0 HG2 PRO A 337 15.105 4.328 -5.055 1.00 0.00 H new ATOM 0 HG3 PRO A 337 13.599 4.758 -4.268 1.00 0.00 H new ATOM 0 HD2 PRO A 337 15.688 2.886 -3.338 1.00 0.00 H new ATOM 0 HD3 PRO A 337 14.366 3.585 -2.424 1.00 0.00 H new ATOM 539 N CYS A 338 11.181 0.325 -4.685 1.00 0.00 N ATOM 540 CA CYS A 338 10.640 -0.951 -5.115 1.00 0.00 C ATOM 541 C CYS A 338 9.335 -0.735 -5.863 1.00 0.00 C ATOM 542 O CYS A 338 8.896 0.396 -6.055 1.00 0.00 O ATOM 543 CB CYS A 338 10.401 -1.880 -3.919 1.00 0.00 C ATOM 544 SG CYS A 338 8.807 -1.619 -3.067 1.00 0.00 S ATOM 0 H CYS A 338 10.640 0.789 -3.955 1.00 0.00 H new ATOM 0 HA CYS A 338 11.367 -1.422 -5.777 1.00 0.00 H new ATOM 0 HB2 CYS A 338 10.451 -2.914 -4.262 1.00 0.00 H new ATOM 0 HB3 CYS A 338 11.210 -1.743 -3.201 1.00 0.00 H new ATOM 549 N ARG A 339 8.718 -1.829 -6.264 1.00 0.00 N ATOM 550 CA ARG A 339 7.425 -1.786 -6.917 1.00 0.00 C ATOM 551 C ARG A 339 6.416 -2.362 -5.945 1.00 0.00 C ATOM 552 O ARG A 339 6.323 -3.583 -5.803 1.00 0.00 O ATOM 553 CB ARG A 339 7.423 -2.596 -8.220 1.00 0.00 C ATOM 554 CG ARG A 339 8.070 -1.892 -9.407 1.00 0.00 C ATOM 555 CD ARG A 339 9.555 -1.646 -9.198 1.00 0.00 C ATOM 556 NE ARG A 339 10.200 -1.158 -10.416 1.00 0.00 N ATOM 557 CZ ARG A 339 11.516 -1.113 -10.608 1.00 0.00 C ATOM 558 NH1 ARG A 339 12.352 -1.483 -9.646 1.00 0.00 N ATOM 559 NH2 ARG A 339 11.994 -0.694 -11.769 1.00 0.00 N ATOM 0 H ARG A 339 9.097 -2.769 -6.147 1.00 0.00 H new ATOM 0 HA ARG A 339 7.179 -0.758 -7.183 1.00 0.00 H new ATOM 0 HB2 ARG A 339 7.942 -3.539 -8.047 1.00 0.00 H new ATOM 0 HB3 ARG A 339 6.393 -2.842 -8.478 1.00 0.00 H new ATOM 0 HG2 ARG A 339 7.927 -2.494 -10.304 1.00 0.00 H new ATOM 0 HG3 ARG A 339 7.568 -0.940 -9.579 1.00 0.00 H new ATOM 0 HD2 ARG A 339 9.694 -0.920 -8.397 1.00 0.00 H new ATOM 0 HD3 ARG A 339 10.035 -2.571 -8.877 1.00 0.00 H new ATOM 0 HE ARG A 339 9.599 -0.829 -11.172 1.00 0.00 H new ATOM 0 HH11 ARG A 339 11.987 -1.806 -8.750 1.00 0.00 H new ATOM 0 HH12 ARG A 339 13.359 -1.445 -9.803 1.00 0.00 H new ATOM 0 HH21 ARG A 339 11.355 -0.408 -12.510 1.00 0.00 H new ATOM 0 HH22 ARG A 339 13.002 -0.657 -11.922 1.00 0.00 H new ATOM 573 N ILE A 340 5.687 -1.490 -5.261 1.00 0.00 N ATOM 574 CA ILE A 340 4.869 -1.931 -4.139 1.00 0.00 C ATOM 575 C ILE A 340 3.627 -2.668 -4.620 1.00 0.00 C ATOM 576 O ILE A 340 2.802 -2.105 -5.344 1.00 0.00 O ATOM 577 CB ILE A 340 4.441 -0.763 -3.227 1.00 0.00 C ATOM 578 CG1 ILE A 340 5.662 0.013 -2.727 1.00 0.00 C ATOM 579 CG2 ILE A 340 3.638 -1.289 -2.045 1.00 0.00 C ATOM 580 CD1 ILE A 340 5.314 1.136 -1.773 1.00 0.00 C ATOM 0 H ILE A 340 5.645 -0.490 -5.458 1.00 0.00 H new ATOM 0 HA ILE A 340 5.494 -2.608 -3.557 1.00 0.00 H new ATOM 0 HB ILE A 340 3.817 -0.085 -3.809 1.00 0.00 H new ATOM 0 HG12 ILE A 340 6.343 -0.678 -2.230 1.00 0.00 H new ATOM 0 HG13 ILE A 340 6.196 0.426 -3.583 1.00 0.00 H new ATOM 0 HG21 ILE A 340 3.341 -0.456 -1.408 1.00 0.00 H new ATOM 0 HG22 ILE A 340 2.748 -1.803 -2.409 1.00 0.00 H new ATOM 0 HG23 ILE A 340 4.249 -1.985 -1.471 1.00 0.00 H new ATOM 0 HD11 ILE A 340 6.227 1.643 -1.459 1.00 0.00 H new ATOM 0 HD12 ILE A 340 4.657 1.848 -2.273 1.00 0.00 H new ATOM 0 HD13 ILE A 340 4.807 0.727 -0.899 1.00 0.00 H new ATOM 592 N PRO A 341 3.488 -3.947 -4.241 1.00 0.00 N ATOM 593 CA PRO A 341 2.311 -4.734 -4.573 1.00 0.00 C ATOM 594 C PRO A 341 1.134 -4.367 -3.683 1.00 0.00 C ATOM 595 O PRO A 341 0.823 -5.047 -2.702 1.00 0.00 O ATOM 596 CB PRO A 341 2.760 -6.170 -4.328 1.00 0.00 C ATOM 597 CG PRO A 341 3.821 -6.067 -3.285 1.00 0.00 C ATOM 598 CD PRO A 341 4.477 -4.722 -3.470 1.00 0.00 C ATOM 0 HA PRO A 341 1.966 -4.567 -5.593 1.00 0.00 H new ATOM 0 HB2 PRO A 341 1.931 -6.791 -3.988 1.00 0.00 H new ATOM 0 HB3 PRO A 341 3.146 -6.625 -5.241 1.00 0.00 H new ATOM 0 HG2 PRO A 341 3.393 -6.155 -2.287 1.00 0.00 H new ATOM 0 HG3 PRO A 341 4.549 -6.871 -3.392 1.00 0.00 H new ATOM 0 HD2 PRO A 341 4.696 -4.249 -2.512 1.00 0.00 H new ATOM 0 HD3 PRO A 341 5.422 -4.809 -4.006 1.00 0.00 H new ATOM 606 N VAL A 342 0.488 -3.281 -4.042 1.00 0.00 N ATOM 607 CA VAL A 342 -0.671 -2.799 -3.327 1.00 0.00 C ATOM 608 C VAL A 342 -1.928 -3.155 -4.078 1.00 0.00 C ATOM 609 O VAL A 342 -2.193 -2.643 -5.164 1.00 0.00 O ATOM 610 CB VAL A 342 -0.613 -1.281 -3.124 1.00 0.00 C ATOM 611 CG1 VAL A 342 0.248 -0.958 -1.923 1.00 0.00 C ATOM 612 CG2 VAL A 342 -0.064 -0.603 -4.366 1.00 0.00 C ATOM 0 H VAL A 342 0.753 -2.705 -4.841 1.00 0.00 H new ATOM 0 HA VAL A 342 -0.678 -3.277 -2.348 1.00 0.00 H new ATOM 0 HB VAL A 342 -1.622 -0.908 -2.947 1.00 0.00 H new ATOM 0 HG11 VAL A 342 0.286 0.122 -1.783 1.00 0.00 H new ATOM 0 HG12 VAL A 342 -0.177 -1.425 -1.034 1.00 0.00 H new ATOM 0 HG13 VAL A 342 1.256 -1.339 -2.085 1.00 0.00 H new ATOM 0 HG21 VAL A 342 -0.029 0.475 -4.207 1.00 0.00 H new ATOM 0 HG22 VAL A 342 0.941 -0.973 -4.568 1.00 0.00 H new ATOM 0 HG23 VAL A 342 -0.710 -0.823 -5.216 1.00 0.00 H new ATOM 622 N ARG A 343 -2.694 -4.042 -3.502 1.00 0.00 N ATOM 623 CA ARG A 343 -3.940 -4.451 -4.096 1.00 0.00 C ATOM 624 C ARG A 343 -5.022 -4.289 -3.066 1.00 0.00 C ATOM 625 O ARG A 343 -4.741 -3.955 -1.924 1.00 0.00 O ATOM 626 CB ARG A 343 -3.884 -5.901 -4.554 1.00 0.00 C ATOM 627 CG ARG A 343 -3.761 -6.887 -3.400 1.00 0.00 C ATOM 628 CD ARG A 343 -3.622 -8.316 -3.889 1.00 0.00 C ATOM 629 NE ARG A 343 -3.265 -9.236 -2.806 1.00 0.00 N ATOM 630 CZ ARG A 343 -3.363 -10.563 -2.899 1.00 0.00 C ATOM 631 NH1 ARG A 343 -3.885 -11.117 -3.988 1.00 0.00 N ATOM 632 NH2 ARG A 343 -2.948 -11.333 -1.900 1.00 0.00 N ATOM 0 H ARG A 343 -2.476 -4.498 -2.616 1.00 0.00 H new ATOM 0 HA ARG A 343 -4.140 -3.834 -4.972 1.00 0.00 H new ATOM 0 HB2 ARG A 343 -4.783 -6.130 -5.126 1.00 0.00 H new ATOM 0 HB3 ARG A 343 -3.037 -6.031 -5.227 1.00 0.00 H new ATOM 0 HG2 ARG A 343 -2.896 -6.626 -2.790 1.00 0.00 H new ATOM 0 HG3 ARG A 343 -4.639 -6.807 -2.759 1.00 0.00 H new ATOM 0 HD2 ARG A 343 -4.560 -8.637 -4.342 1.00 0.00 H new ATOM 0 HD3 ARG A 343 -2.860 -8.360 -4.668 1.00 0.00 H new ATOM 0 HE ARG A 343 -2.922 -8.839 -1.931 1.00 0.00 H new ATOM 0 HH11 ARG A 343 -4.211 -10.527 -4.754 1.00 0.00 H new ATOM 0 HH12 ARG A 343 -3.960 -12.132 -4.058 1.00 0.00 H new ATOM 0 HH21 ARG A 343 -2.554 -10.910 -1.060 1.00 0.00 H new ATOM 0 HH22 ARG A 343 -3.024 -12.348 -1.973 1.00 0.00 H new ATOM 646 N ALA A 344 -6.245 -4.510 -3.457 1.00 0.00 N ATOM 647 CA ALA A 344 -7.332 -4.442 -2.521 1.00 0.00 C ATOM 648 C ALA A 344 -8.403 -5.440 -2.883 1.00 0.00 C ATOM 649 O ALA A 344 -8.619 -5.723 -4.052 1.00 0.00 O ATOM 650 CB ALA A 344 -7.886 -3.032 -2.475 1.00 0.00 C ATOM 0 H ALA A 344 -6.514 -4.738 -4.414 1.00 0.00 H new ATOM 0 HA ALA A 344 -6.964 -4.697 -1.527 1.00 0.00 H new ATOM 0 HB1 ALA A 344 -8.710 -2.988 -1.763 1.00 0.00 H new ATOM 0 HB2 ALA A 344 -7.101 -2.343 -2.164 1.00 0.00 H new ATOM 0 HB3 ALA A 344 -8.246 -2.750 -3.464 1.00 0.00 H new ATOM 656 N VAL A 345 -9.056 -6.003 -1.892 1.00 0.00 N ATOM 657 CA VAL A 345 -10.137 -6.926 -2.141 1.00 0.00 C ATOM 658 C VAL A 345 -11.412 -6.348 -1.563 1.00 0.00 C ATOM 659 O VAL A 345 -11.381 -5.585 -0.600 1.00 0.00 O ATOM 660 CB VAL A 345 -9.846 -8.318 -1.530 1.00 0.00 C ATOM 661 CG1 VAL A 345 -8.488 -8.835 -1.983 1.00 0.00 C ATOM 662 CG2 VAL A 345 -9.921 -8.288 -0.014 1.00 0.00 C ATOM 0 H VAL A 345 -8.856 -5.837 -0.906 1.00 0.00 H new ATOM 0 HA VAL A 345 -10.245 -7.064 -3.217 1.00 0.00 H new ATOM 0 HB VAL A 345 -10.616 -9.000 -1.890 1.00 0.00 H new ATOM 0 HG11 VAL A 345 -8.306 -9.814 -1.541 1.00 0.00 H new ATOM 0 HG12 VAL A 345 -8.475 -8.919 -3.070 1.00 0.00 H new ATOM 0 HG13 VAL A 345 -7.710 -8.142 -1.663 1.00 0.00 H new ATOM 0 HG21 VAL A 345 -9.711 -9.282 0.380 1.00 0.00 H new ATOM 0 HG22 VAL A 345 -9.186 -7.582 0.373 1.00 0.00 H new ATOM 0 HG23 VAL A 345 -10.919 -7.978 0.295 1.00 0.00 H new ATOM 672 N ALA A 346 -12.508 -6.606 -2.227 1.00 0.00 N ATOM 673 CA ALA A 346 -13.805 -6.193 -1.738 1.00 0.00 C ATOM 674 C ALA A 346 -14.201 -6.920 -0.458 1.00 0.00 C ATOM 675 O ALA A 346 -14.330 -8.141 -0.453 1.00 0.00 O ATOM 676 CB ALA A 346 -14.823 -6.453 -2.820 1.00 0.00 C ATOM 0 H ALA A 346 -12.532 -7.105 -3.116 1.00 0.00 H new ATOM 0 HA ALA A 346 -13.762 -5.132 -1.493 1.00 0.00 H new ATOM 0 HB1 ALA A 346 -15.810 -6.148 -2.472 1.00 0.00 H new ATOM 0 HB2 ALA A 346 -14.561 -5.883 -3.711 1.00 0.00 H new ATOM 0 HB3 ALA A 346 -14.835 -7.516 -3.060 1.00 0.00 H new ATOM 682 N HIS A 347 -14.400 -6.133 0.605 1.00 0.00 N ATOM 683 CA HIS A 347 -14.871 -6.627 1.912 1.00 0.00 C ATOM 684 C HIS A 347 -14.212 -7.959 2.293 1.00 0.00 C ATOM 685 O HIS A 347 -14.889 -8.976 2.381 1.00 0.00 O ATOM 686 CB HIS A 347 -16.407 -6.781 1.880 1.00 0.00 C ATOM 687 CG HIS A 347 -17.054 -7.072 3.212 1.00 0.00 C ATOM 688 ND1 HIS A 347 -17.655 -6.103 3.992 1.00 0.00 N ATOM 689 CD2 HIS A 347 -17.214 -8.237 3.888 1.00 0.00 C ATOM 690 CE1 HIS A 347 -18.149 -6.659 5.081 1.00 0.00 C ATOM 691 NE2 HIS A 347 -17.897 -7.949 5.041 1.00 0.00 N ATOM 0 H HIS A 347 -14.238 -5.126 0.586 1.00 0.00 H new ATOM 0 HA HIS A 347 -14.588 -5.898 2.671 1.00 0.00 H new ATOM 0 HB2 HIS A 347 -16.839 -5.865 1.477 1.00 0.00 H new ATOM 0 HB3 HIS A 347 -16.661 -7.584 1.188 1.00 0.00 H new ATOM 0 HD1 HIS A 347 -17.708 -5.111 3.761 1.00 0.00 H new ATOM 0 HD2 HIS A 347 -16.867 -9.211 3.576 1.00 0.00 H new ATOM 0 HE1 HIS A 347 -18.672 -6.142 5.872 1.00 0.00 H new ATOM 700 N GLY A 348 -12.900 -7.948 2.537 1.00 0.00 N ATOM 701 CA GLY A 348 -12.188 -9.173 2.877 1.00 0.00 C ATOM 702 C GLY A 348 -12.483 -10.367 1.979 1.00 0.00 C ATOM 703 O GLY A 348 -12.466 -11.505 2.453 1.00 0.00 O ATOM 0 H GLY A 348 -12.317 -7.111 2.505 1.00 0.00 H new ATOM 0 HA2 GLY A 348 -11.117 -8.972 2.846 1.00 0.00 H new ATOM 0 HA3 GLY A 348 -12.432 -9.443 3.904 1.00 0.00 H new ATOM 707 N VAL A 349 -12.724 -10.144 0.689 1.00 0.00 N ATOM 708 CA VAL A 349 -13.009 -11.230 -0.240 1.00 0.00 C ATOM 709 C VAL A 349 -12.215 -10.999 -1.519 1.00 0.00 C ATOM 710 O VAL A 349 -12.575 -10.146 -2.334 1.00 0.00 O ATOM 711 CB VAL A 349 -14.511 -11.314 -0.615 1.00 0.00 C ATOM 712 CG1 VAL A 349 -14.759 -12.459 -1.587 1.00 0.00 C ATOM 713 CG2 VAL A 349 -15.377 -11.474 0.623 1.00 0.00 C ATOM 0 H VAL A 349 -12.727 -9.217 0.264 1.00 0.00 H new ATOM 0 HA VAL A 349 -12.730 -12.162 0.251 1.00 0.00 H new ATOM 0 HB VAL A 349 -14.786 -10.378 -1.102 1.00 0.00 H new ATOM 0 HG11 VAL A 349 -15.819 -12.501 -1.837 1.00 0.00 H new ATOM 0 HG12 VAL A 349 -14.178 -12.298 -2.495 1.00 0.00 H new ATOM 0 HG13 VAL A 349 -14.458 -13.400 -1.126 1.00 0.00 H new ATOM 0 HG21 VAL A 349 -16.425 -11.530 0.329 1.00 0.00 H new ATOM 0 HG22 VAL A 349 -15.098 -12.388 1.147 1.00 0.00 H new ATOM 0 HG23 VAL A 349 -15.230 -10.619 1.283 1.00 0.00 H new ATOM 723 N PRO A 350 -11.112 -11.731 -1.703 1.00 0.00 N ATOM 724 CA PRO A 350 -10.248 -11.585 -2.876 1.00 0.00 C ATOM 725 C PRO A 350 -10.853 -12.192 -4.135 1.00 0.00 C ATOM 726 O PRO A 350 -10.302 -13.137 -4.706 1.00 0.00 O ATOM 727 CB PRO A 350 -8.964 -12.340 -2.482 1.00 0.00 C ATOM 728 CG PRO A 350 -9.107 -12.629 -1.026 1.00 0.00 C ATOM 729 CD PRO A 350 -10.583 -12.730 -0.773 1.00 0.00 C ATOM 0 HA PRO A 350 -10.084 -10.535 -3.120 1.00 0.00 H new ATOM 0 HB2 PRO A 350 -8.857 -13.260 -3.057 1.00 0.00 H new ATOM 0 HB3 PRO A 350 -8.077 -11.737 -2.678 1.00 0.00 H new ATOM 0 HG2 PRO A 350 -8.600 -13.556 -0.760 1.00 0.00 H new ATOM 0 HG3 PRO A 350 -8.660 -11.837 -0.424 1.00 0.00 H new ATOM 0 HD2 PRO A 350 -10.967 -13.728 -0.983 1.00 0.00 H new ATOM 0 HD3 PRO A 350 -10.838 -12.501 0.262 1.00 0.00 H new ATOM 737 N GLU A 351 -11.989 -11.667 -4.566 1.00 0.00 N ATOM 738 CA GLU A 351 -12.618 -12.126 -5.787 1.00 0.00 C ATOM 739 C GLU A 351 -12.292 -11.149 -6.901 1.00 0.00 C ATOM 740 O GLU A 351 -11.727 -11.514 -7.927 1.00 0.00 O ATOM 741 CB GLU A 351 -14.128 -12.218 -5.587 1.00 0.00 C ATOM 742 CG GLU A 351 -14.891 -12.603 -6.835 1.00 0.00 C ATOM 743 CD GLU A 351 -16.378 -12.631 -6.594 1.00 0.00 C ATOM 744 OE1 GLU A 351 -16.872 -13.618 -6.015 1.00 0.00 O ATOM 745 OE2 GLU A 351 -17.054 -11.645 -6.948 1.00 0.00 O ATOM 0 H GLU A 351 -12.492 -10.922 -4.085 1.00 0.00 H new ATOM 0 HA GLU A 351 -12.244 -13.115 -6.051 1.00 0.00 H new ATOM 0 HB2 GLU A 351 -14.337 -12.949 -4.806 1.00 0.00 H new ATOM 0 HB3 GLU A 351 -14.496 -11.256 -5.230 1.00 0.00 H new ATOM 0 HG2 GLU A 351 -14.665 -11.895 -7.632 1.00 0.00 H new ATOM 0 HG3 GLU A 351 -14.559 -13.584 -7.176 1.00 0.00 H new ATOM 752 N VAL A 352 -12.634 -9.892 -6.664 1.00 0.00 N ATOM 753 CA VAL A 352 -12.271 -8.815 -7.559 1.00 0.00 C ATOM 754 C VAL A 352 -11.428 -7.776 -6.825 1.00 0.00 C ATOM 755 O VAL A 352 -11.779 -7.323 -5.731 1.00 0.00 O ATOM 756 CB VAL A 352 -13.525 -8.150 -8.172 1.00 0.00 C ATOM 757 CG1 VAL A 352 -14.511 -7.746 -7.085 1.00 0.00 C ATOM 758 CG2 VAL A 352 -13.146 -6.950 -9.032 1.00 0.00 C ATOM 0 H VAL A 352 -13.169 -9.595 -5.848 1.00 0.00 H new ATOM 0 HA VAL A 352 -11.682 -9.239 -8.372 1.00 0.00 H new ATOM 0 HB VAL A 352 -14.010 -8.884 -8.816 1.00 0.00 H new ATOM 0 HG11 VAL A 352 -15.385 -7.280 -7.541 1.00 0.00 H new ATOM 0 HG12 VAL A 352 -14.820 -8.630 -6.528 1.00 0.00 H new ATOM 0 HG13 VAL A 352 -14.035 -7.038 -6.407 1.00 0.00 H new ATOM 0 HG21 VAL A 352 -14.048 -6.503 -9.450 1.00 0.00 H new ATOM 0 HG22 VAL A 352 -12.626 -6.213 -8.420 1.00 0.00 H new ATOM 0 HG23 VAL A 352 -12.493 -7.275 -9.842 1.00 0.00 H new ATOM 768 N ASN A 353 -10.299 -7.446 -7.421 1.00 0.00 N ATOM 769 CA ASN A 353 -9.416 -6.408 -6.904 1.00 0.00 C ATOM 770 C ASN A 353 -10.109 -5.044 -6.946 1.00 0.00 C ATOM 771 O ASN A 353 -10.498 -4.569 -8.013 1.00 0.00 O ATOM 772 CB ASN A 353 -8.119 -6.377 -7.727 1.00 0.00 C ATOM 773 CG ASN A 353 -7.166 -5.268 -7.311 1.00 0.00 C ATOM 774 OD1 ASN A 353 -7.123 -4.866 -6.152 1.00 0.00 O ATOM 775 ND2 ASN A 353 -6.381 -4.777 -8.257 1.00 0.00 N ATOM 0 H ASN A 353 -9.964 -7.887 -8.277 1.00 0.00 H new ATOM 0 HA ASN A 353 -9.173 -6.633 -5.866 1.00 0.00 H new ATOM 0 HB2 ASN A 353 -7.612 -7.337 -7.629 1.00 0.00 H new ATOM 0 HB3 ASN A 353 -8.369 -6.255 -8.781 1.00 0.00 H new ATOM 0 HD21 ASN A 353 -5.712 -4.040 -8.033 1.00 0.00 H new ATOM 0 HD22 ASN A 353 -6.445 -5.136 -9.210 1.00 0.00 H new ATOM 782 N VAL A 354 -10.266 -4.427 -5.780 1.00 0.00 N ATOM 783 CA VAL A 354 -10.904 -3.117 -5.681 1.00 0.00 C ATOM 784 C VAL A 354 -9.868 -2.015 -5.601 1.00 0.00 C ATOM 785 O VAL A 354 -10.207 -0.856 -5.392 1.00 0.00 O ATOM 786 CB VAL A 354 -11.851 -3.004 -4.461 1.00 0.00 C ATOM 787 CG1 VAL A 354 -13.030 -3.941 -4.631 1.00 0.00 C ATOM 788 CG2 VAL A 354 -11.120 -3.301 -3.166 1.00 0.00 C ATOM 0 H VAL A 354 -9.960 -4.813 -4.887 1.00 0.00 H new ATOM 0 HA VAL A 354 -11.501 -3.004 -6.586 1.00 0.00 H new ATOM 0 HB VAL A 354 -12.216 -1.978 -4.408 1.00 0.00 H new ATOM 0 HG11 VAL A 354 -13.691 -3.855 -3.768 1.00 0.00 H new ATOM 0 HG12 VAL A 354 -13.578 -3.676 -5.535 1.00 0.00 H new ATOM 0 HG13 VAL A 354 -12.671 -4.967 -4.712 1.00 0.00 H new ATOM 0 HG21 VAL A 354 -11.813 -3.213 -2.329 1.00 0.00 H new ATOM 0 HG22 VAL A 354 -10.718 -4.313 -3.199 1.00 0.00 H new ATOM 0 HG23 VAL A 354 -10.304 -2.590 -3.038 1.00 0.00 H new ATOM 798 N ALA A 355 -8.599 -2.366 -5.758 1.00 0.00 N ATOM 799 CA ALA A 355 -7.544 -1.371 -5.712 1.00 0.00 C ATOM 800 C ALA A 355 -7.471 -0.591 -7.010 1.00 0.00 C ATOM 801 O ALA A 355 -6.709 -0.926 -7.921 1.00 0.00 O ATOM 802 CB ALA A 355 -6.199 -2.010 -5.403 1.00 0.00 C ATOM 0 H ALA A 355 -8.280 -3.322 -5.916 1.00 0.00 H new ATOM 0 HA ALA A 355 -7.785 -0.676 -4.908 1.00 0.00 H new ATOM 0 HB1 ALA A 355 -5.428 -1.240 -5.375 1.00 0.00 H new ATOM 0 HB2 ALA A 355 -6.247 -2.510 -4.436 1.00 0.00 H new ATOM 0 HB3 ALA A 355 -5.956 -2.739 -6.176 1.00 0.00 H new ATOM 808 N MET A 356 -8.291 0.433 -7.090 1.00 0.00 N ATOM 809 CA MET A 356 -8.223 1.389 -8.162 1.00 0.00 C ATOM 810 C MET A 356 -7.468 2.579 -7.617 1.00 0.00 C ATOM 811 O MET A 356 -8.012 3.404 -6.884 1.00 0.00 O ATOM 812 CB MET A 356 -9.628 1.762 -8.645 1.00 0.00 C ATOM 813 CG MET A 356 -9.655 2.957 -9.582 1.00 0.00 C ATOM 814 SD MET A 356 -11.307 3.321 -10.209 1.00 0.00 S ATOM 815 CE MET A 356 -10.962 4.735 -11.257 1.00 0.00 C ATOM 0 H MET A 356 -9.025 0.623 -6.408 1.00 0.00 H new ATOM 0 HA MET A 356 -7.710 0.985 -9.035 1.00 0.00 H new ATOM 0 HB2 MET A 356 -10.068 0.904 -9.153 1.00 0.00 H new ATOM 0 HB3 MET A 356 -10.255 1.976 -7.780 1.00 0.00 H new ATOM 0 HG2 MET A 356 -9.270 3.832 -9.058 1.00 0.00 H new ATOM 0 HG3 MET A 356 -8.986 2.769 -10.422 1.00 0.00 H new ATOM 0 HE1 MET A 356 -11.887 5.079 -11.719 1.00 0.00 H new ATOM 0 HE2 MET A 356 -10.536 5.538 -10.656 1.00 0.00 H new ATOM 0 HE3 MET A 356 -10.253 4.448 -12.034 1.00 0.00 H new ATOM 825 N LEU A 357 -6.203 2.649 -7.953 1.00 0.00 N ATOM 826 CA LEU A 357 -5.284 3.464 -7.194 1.00 0.00 C ATOM 827 C LEU A 357 -5.284 4.899 -7.682 1.00 0.00 C ATOM 828 O LEU A 357 -5.029 5.171 -8.854 1.00 0.00 O ATOM 829 CB LEU A 357 -3.876 2.873 -7.253 1.00 0.00 C ATOM 830 CG LEU A 357 -3.732 1.455 -6.699 1.00 0.00 C ATOM 831 CD1 LEU A 357 -2.267 1.062 -6.649 1.00 0.00 C ATOM 832 CD2 LEU A 357 -4.362 1.344 -5.320 1.00 0.00 C ATOM 0 H LEU A 357 -5.787 2.155 -8.742 1.00 0.00 H new ATOM 0 HA LEU A 357 -5.618 3.469 -6.156 1.00 0.00 H new ATOM 0 HB2 LEU A 357 -3.544 2.874 -8.291 1.00 0.00 H new ATOM 0 HB3 LEU A 357 -3.202 3.529 -6.702 1.00 0.00 H new ATOM 0 HG LEU A 357 -4.258 0.770 -7.364 1.00 0.00 H new ATOM 0 HD11 LEU A 357 -2.175 0.051 -6.253 1.00 0.00 H new ATOM 0 HD12 LEU A 357 -1.846 1.098 -7.654 1.00 0.00 H new ATOM 0 HD13 LEU A 357 -1.726 1.755 -6.004 1.00 0.00 H new ATOM 0 HD21 LEU A 357 -4.246 0.326 -4.948 1.00 0.00 H new ATOM 0 HD22 LEU A 357 -3.870 2.038 -4.638 1.00 0.00 H new ATOM 0 HD23 LEU A 357 -5.422 1.589 -5.384 1.00 0.00 H new ATOM 844 N ILE A 358 -5.594 5.811 -6.763 1.00 0.00 N ATOM 845 CA ILE A 358 -5.532 7.237 -7.041 1.00 0.00 C ATOM 846 C ILE A 358 -4.081 7.603 -7.318 1.00 0.00 C ATOM 847 O ILE A 358 -3.778 8.532 -8.064 1.00 0.00 O ATOM 848 CB ILE A 358 -6.059 8.093 -5.858 1.00 0.00 C ATOM 849 CG1 ILE A 358 -7.257 7.423 -5.159 1.00 0.00 C ATOM 850 CG2 ILE A 358 -6.450 9.478 -6.349 1.00 0.00 C ATOM 851 CD1 ILE A 358 -8.323 6.914 -6.116 1.00 0.00 C ATOM 0 H ILE A 358 -5.892 5.582 -5.815 1.00 0.00 H new ATOM 0 HA ILE A 358 -6.169 7.447 -7.900 1.00 0.00 H new ATOM 0 HB ILE A 358 -5.254 8.180 -5.128 1.00 0.00 H new ATOM 0 HG12 ILE A 358 -6.894 6.589 -4.558 1.00 0.00 H new ATOM 0 HG13 ILE A 358 -7.711 8.138 -4.472 1.00 0.00 H new ATOM 0 HG21 ILE A 358 -6.818 10.070 -5.511 1.00 0.00 H new ATOM 0 HG22 ILE A 358 -5.580 9.968 -6.785 1.00 0.00 H new ATOM 0 HG23 ILE A 358 -7.232 9.389 -7.103 1.00 0.00 H new ATOM 0 HD11 ILE A 358 -9.133 6.456 -5.548 1.00 0.00 H new ATOM 0 HD12 ILE A 358 -8.715 7.747 -6.700 1.00 0.00 H new ATOM 0 HD13 ILE A 358 -7.886 6.174 -6.787 1.00 0.00 H new ATOM 863 N THR A 359 -3.196 6.833 -6.697 1.00 0.00 N ATOM 864 CA THR A 359 -1.768 6.913 -6.937 1.00 0.00 C ATOM 865 C THR A 359 -1.270 5.530 -7.363 1.00 0.00 C ATOM 866 O THR A 359 -0.805 4.741 -6.537 1.00 0.00 O ATOM 867 CB THR A 359 -1.026 7.390 -5.667 1.00 0.00 C ATOM 868 OG1 THR A 359 -1.530 8.670 -5.263 1.00 0.00 O ATOM 869 CG2 THR A 359 0.476 7.483 -5.899 1.00 0.00 C ATOM 0 H THR A 359 -3.456 6.129 -6.006 1.00 0.00 H new ATOM 0 HA THR A 359 -1.568 7.638 -7.726 1.00 0.00 H new ATOM 0 HB THR A 359 -1.202 6.656 -4.880 1.00 0.00 H new ATOM 0 HG1 THR A 359 -1.058 8.968 -4.457 1.00 0.00 H new ATOM 0 HG21 THR A 359 0.965 7.821 -4.985 1.00 0.00 H new ATOM 0 HG22 THR A 359 0.863 6.502 -6.176 1.00 0.00 H new ATOM 0 HG23 THR A 359 0.677 8.192 -6.702 1.00 0.00 H new ATOM 877 N PRO A 360 -1.385 5.214 -8.665 1.00 0.00 N ATOM 878 CA PRO A 360 -1.165 3.862 -9.181 1.00 0.00 C ATOM 879 C PRO A 360 0.292 3.537 -9.486 1.00 0.00 C ATOM 880 O PRO A 360 0.586 2.696 -10.339 1.00 0.00 O ATOM 881 CB PRO A 360 -1.996 3.860 -10.458 1.00 0.00 C ATOM 882 CG PRO A 360 -1.929 5.267 -10.956 1.00 0.00 C ATOM 883 CD PRO A 360 -1.754 6.151 -9.744 1.00 0.00 C ATOM 0 HA PRO A 360 -1.443 3.105 -8.448 1.00 0.00 H new ATOM 0 HB2 PRO A 360 -1.594 3.161 -11.191 1.00 0.00 H new ATOM 0 HB3 PRO A 360 -3.025 3.558 -10.261 1.00 0.00 H new ATOM 0 HG2 PRO A 360 -1.097 5.392 -11.649 1.00 0.00 H new ATOM 0 HG3 PRO A 360 -2.838 5.529 -11.498 1.00 0.00 H new ATOM 0 HD2 PRO A 360 -0.978 6.899 -9.905 1.00 0.00 H new ATOM 0 HD3 PRO A 360 -2.672 6.690 -9.508 1.00 0.00 H new ATOM 891 N ASN A 361 1.187 4.190 -8.778 1.00 0.00 N ATOM 892 CA ASN A 361 2.620 3.940 -8.913 1.00 0.00 C ATOM 893 C ASN A 361 3.347 4.186 -7.596 1.00 0.00 C ATOM 894 O ASN A 361 4.149 5.116 -7.487 1.00 0.00 O ATOM 895 CB ASN A 361 3.232 4.815 -10.015 1.00 0.00 C ATOM 896 CG ASN A 361 3.172 4.165 -11.385 1.00 0.00 C ATOM 897 OD1 ASN A 361 3.234 2.941 -11.509 1.00 0.00 O ATOM 898 ND2 ASN A 361 3.055 4.976 -12.424 1.00 0.00 N ATOM 0 H ASN A 361 0.952 4.908 -8.093 1.00 0.00 H new ATOM 0 HA ASN A 361 2.742 2.893 -9.189 1.00 0.00 H new ATOM 0 HB2 ASN A 361 2.707 5.770 -10.048 1.00 0.00 H new ATOM 0 HB3 ASN A 361 4.271 5.031 -9.766 1.00 0.00 H new ATOM 0 HD21 ASN A 361 3.013 4.592 -13.368 1.00 0.00 H new ATOM 0 HD22 ASN A 361 3.007 5.985 -12.281 1.00 0.00 H new ATOM 905 N PRO A 362 3.075 3.362 -6.567 1.00 0.00 N ATOM 906 CA PRO A 362 3.738 3.487 -5.278 1.00 0.00 C ATOM 907 C PRO A 362 5.110 2.836 -5.260 1.00 0.00 C ATOM 908 O PRO A 362 5.349 1.806 -5.913 1.00 0.00 O ATOM 909 CB PRO A 362 2.798 2.762 -4.330 1.00 0.00 C ATOM 910 CG PRO A 362 2.143 1.721 -5.164 1.00 0.00 C ATOM 911 CD PRO A 362 2.101 2.253 -6.574 1.00 0.00 C ATOM 0 HA PRO A 362 3.918 4.529 -5.015 1.00 0.00 H new ATOM 0 HB2 PRO A 362 3.343 2.317 -3.497 1.00 0.00 H new ATOM 0 HB3 PRO A 362 2.064 3.445 -3.902 1.00 0.00 H new ATOM 0 HG2 PRO A 362 2.700 0.785 -5.121 1.00 0.00 H new ATOM 0 HG3 PRO A 362 1.137 1.511 -4.800 1.00 0.00 H new ATOM 0 HD2 PRO A 362 2.375 1.486 -7.298 1.00 0.00 H new ATOM 0 HD3 PRO A 362 1.103 2.600 -6.840 1.00 0.00 H new ATOM 919 N THR A 363 5.989 3.401 -4.458 1.00 0.00 N ATOM 920 CA THR A 363 7.363 2.978 -4.401 1.00 0.00 C ATOM 921 C THR A 363 7.843 3.082 -2.964 1.00 0.00 C ATOM 922 O THR A 363 7.391 3.946 -2.212 1.00 0.00 O ATOM 923 CB THR A 363 8.261 3.838 -5.315 1.00 0.00 C ATOM 924 OG1 THR A 363 7.853 5.209 -5.253 1.00 0.00 O ATOM 925 CG2 THR A 363 8.216 3.348 -6.757 1.00 0.00 C ATOM 0 H THR A 363 5.764 4.170 -3.827 1.00 0.00 H new ATOM 0 HA THR A 363 7.427 1.948 -4.753 1.00 0.00 H new ATOM 0 HB THR A 363 9.287 3.748 -4.959 1.00 0.00 H new ATOM 0 HG1 THR A 363 8.429 5.748 -5.834 1.00 0.00 H new ATOM 0 HG21 THR A 363 8.859 3.975 -7.375 1.00 0.00 H new ATOM 0 HG22 THR A 363 8.564 2.316 -6.802 1.00 0.00 H new ATOM 0 HG23 THR A 363 7.192 3.402 -7.128 1.00 0.00 H new ATOM 933 N MET A 364 8.735 2.198 -2.583 1.00 0.00 N ATOM 934 CA MET A 364 9.281 2.269 -1.242 1.00 0.00 C ATOM 935 C MET A 364 10.651 2.870 -1.307 1.00 0.00 C ATOM 936 O MET A 364 11.468 2.466 -2.129 1.00 0.00 O ATOM 937 CB MET A 364 9.287 0.939 -0.482 1.00 0.00 C ATOM 938 CG MET A 364 10.364 -0.051 -0.884 1.00 0.00 C ATOM 939 SD MET A 364 10.401 -1.491 0.208 1.00 0.00 S ATOM 940 CE MET A 364 8.673 -1.949 0.245 1.00 0.00 C ATOM 0 H MET A 364 9.093 1.439 -3.163 1.00 0.00 H new ATOM 0 HA MET A 364 8.613 2.904 -0.660 1.00 0.00 H new ATOM 0 HB2 MET A 364 9.395 1.151 0.582 1.00 0.00 H new ATOM 0 HB3 MET A 364 8.316 0.463 -0.615 1.00 0.00 H new ATOM 0 HG2 MET A 364 10.192 -0.378 -1.909 1.00 0.00 H new ATOM 0 HG3 MET A 364 11.336 0.443 -0.866 1.00 0.00 H new ATOM 0 HE1 MET A 364 8.585 -3.035 0.266 1.00 0.00 H new ATOM 0 HE2 MET A 364 8.204 -1.530 1.135 1.00 0.00 H new ATOM 0 HE3 MET A 364 8.175 -1.562 -0.644 1.00 0.00 H new ATOM 950 N GLU A 365 10.856 3.868 -0.466 1.00 0.00 N ATOM 951 CA GLU A 365 12.053 4.681 -0.485 1.00 0.00 C ATOM 952 C GLU A 365 12.793 4.608 0.837 1.00 0.00 C ATOM 953 O GLU A 365 12.508 3.745 1.663 1.00 0.00 O ATOM 954 CB GLU A 365 11.681 6.126 -0.801 1.00 0.00 C ATOM 955 CG GLU A 365 11.584 6.405 -2.282 1.00 0.00 C ATOM 956 CD GLU A 365 12.945 6.637 -2.903 1.00 0.00 C ATOM 957 OE1 GLU A 365 13.958 6.244 -2.290 1.00 0.00 O ATOM 958 OE2 GLU A 365 13.008 7.245 -3.992 1.00 0.00 O ATOM 0 H GLU A 365 10.188 4.137 0.256 1.00 0.00 H new ATOM 0 HA GLU A 365 12.718 4.296 -1.258 1.00 0.00 H new ATOM 0 HB2 GLU A 365 10.726 6.360 -0.330 1.00 0.00 H new ATOM 0 HB3 GLU A 365 12.424 6.790 -0.361 1.00 0.00 H new ATOM 0 HG2 GLU A 365 11.097 5.566 -2.778 1.00 0.00 H new ATOM 0 HG3 GLU A 365 10.956 7.281 -2.446 1.00 0.00 H new ATOM 965 N ASN A 366 13.733 5.522 1.030 1.00 0.00 N ATOM 966 CA ASN A 366 14.564 5.562 2.236 1.00 0.00 C ATOM 967 C ASN A 366 13.753 5.660 3.541 1.00 0.00 C ATOM 968 O ASN A 366 14.304 5.463 4.624 1.00 0.00 O ATOM 969 CB ASN A 366 15.567 6.724 2.155 1.00 0.00 C ATOM 970 CG ASN A 366 14.930 8.114 2.146 1.00 0.00 C ATOM 971 OD1 ASN A 366 15.547 9.087 2.583 1.00 0.00 O ATOM 972 ND2 ASN A 366 13.699 8.226 1.657 1.00 0.00 N ATOM 0 H ASN A 366 13.945 6.259 0.358 1.00 0.00 H new ATOM 0 HA ASN A 366 15.094 4.610 2.270 1.00 0.00 H new ATOM 0 HB2 ASN A 366 16.250 6.657 3.002 1.00 0.00 H new ATOM 0 HB3 ASN A 366 16.166 6.607 1.252 1.00 0.00 H new ATOM 0 HD21 ASN A 366 13.239 9.136 1.636 1.00 0.00 H new ATOM 0 HD22 ASN A 366 13.214 7.402 1.302 1.00 0.00 H new ATOM 979 N ASN A 367 12.458 5.960 3.462 1.00 0.00 N ATOM 980 CA ASN A 367 11.620 5.988 4.660 1.00 0.00 C ATOM 981 C ASN A 367 10.475 4.988 4.547 1.00 0.00 C ATOM 982 O ASN A 367 9.626 4.899 5.432 1.00 0.00 O ATOM 983 CB ASN A 367 11.055 7.391 4.914 1.00 0.00 C ATOM 984 CG ASN A 367 12.101 8.366 5.416 1.00 0.00 C ATOM 985 OD1 ASN A 367 12.345 8.464 6.619 1.00 0.00 O ATOM 986 ND2 ASN A 367 12.713 9.108 4.509 1.00 0.00 N ATOM 0 H ASN A 367 11.971 6.184 2.594 1.00 0.00 H new ATOM 0 HA ASN A 367 12.253 5.710 5.503 1.00 0.00 H new ATOM 0 HB2 ASN A 367 10.621 7.775 3.991 1.00 0.00 H new ATOM 0 HB3 ASN A 367 10.247 7.325 5.643 1.00 0.00 H new ATOM 0 HD21 ASN A 367 13.414 9.790 4.797 1.00 0.00 H new ATOM 0 HD22 ASN A 367 12.484 8.998 3.521 1.00 0.00 H new ATOM 993 N GLY A 368 10.456 4.234 3.458 1.00 0.00 N ATOM 994 CA GLY A 368 9.398 3.264 3.247 1.00 0.00 C ATOM 995 C GLY A 368 8.523 3.663 2.082 1.00 0.00 C ATOM 996 O GLY A 368 8.797 4.674 1.432 1.00 0.00 O ATOM 0 H GLY A 368 11.154 4.276 2.715 1.00 0.00 H new ATOM 0 HA2 GLY A 368 9.832 2.282 3.061 1.00 0.00 H new ATOM 0 HA3 GLY A 368 8.792 3.179 4.149 1.00 0.00 H new ATOM 1000 N GLY A 369 7.506 2.856 1.784 1.00 0.00 N ATOM 1001 CA GLY A 369 6.519 3.234 0.784 1.00 0.00 C ATOM 1002 C GLY A 369 5.957 4.612 1.003 1.00 0.00 C ATOM 1003 O GLY A 369 5.778 5.373 0.053 1.00 0.00 O ATOM 0 H GLY A 369 7.348 1.946 2.218 1.00 0.00 H new ATOM 0 HA2 GLY A 369 6.975 3.187 -0.205 1.00 0.00 H new ATOM 0 HA3 GLY A 369 5.704 2.510 0.794 1.00 0.00 H new ATOM 1007 N GLY A 370 5.671 4.940 2.250 1.00 0.00 N ATOM 1008 CA GLY A 370 5.090 6.220 2.543 1.00 0.00 C ATOM 1009 C GLY A 370 3.602 6.194 2.320 1.00 0.00 C ATOM 1010 O GLY A 370 2.922 5.272 2.766 1.00 0.00 O ATOM 0 H GLY A 370 5.832 4.341 3.060 1.00 0.00 H new ATOM 0 HA2 GLY A 370 5.303 6.493 3.577 1.00 0.00 H new ATOM 0 HA3 GLY A 370 5.544 6.984 1.911 1.00 0.00 H new ATOM 1014 N PHE A 371 3.108 7.169 1.591 1.00 0.00 N ATOM 1015 CA PHE A 371 1.679 7.303 1.378 1.00 0.00 C ATOM 1016 C PHE A 371 1.282 6.826 -0.008 1.00 0.00 C ATOM 1017 O PHE A 371 1.973 7.083 -0.997 1.00 0.00 O ATOM 1018 CB PHE A 371 1.218 8.752 1.581 1.00 0.00 C ATOM 1019 CG PHE A 371 1.922 9.764 0.715 1.00 0.00 C ATOM 1020 CD1 PHE A 371 3.159 10.273 1.078 1.00 0.00 C ATOM 1021 CD2 PHE A 371 1.336 10.215 -0.459 1.00 0.00 C ATOM 1022 CE1 PHE A 371 3.799 11.208 0.287 1.00 0.00 C ATOM 1023 CE2 PHE A 371 1.973 11.148 -1.254 1.00 0.00 C ATOM 1024 CZ PHE A 371 3.206 11.646 -0.880 1.00 0.00 C ATOM 0 H PHE A 371 3.674 7.884 1.133 1.00 0.00 H new ATOM 0 HA PHE A 371 1.185 6.674 2.118 1.00 0.00 H new ATOM 0 HB2 PHE A 371 0.147 8.809 1.385 1.00 0.00 H new ATOM 0 HB3 PHE A 371 1.366 9.023 2.626 1.00 0.00 H new ATOM 0 HD1 PHE A 371 3.628 9.935 1.990 1.00 0.00 H new ATOM 0 HD2 PHE A 371 0.370 9.832 -0.755 1.00 0.00 H new ATOM 0 HE1 PHE A 371 4.763 11.596 0.582 1.00 0.00 H new ATOM 0 HE2 PHE A 371 1.507 11.488 -2.167 1.00 0.00 H new ATOM 0 HZ PHE A 371 3.705 12.377 -1.499 1.00 0.00 H new ATOM 1034 N ILE A 372 0.174 6.110 -0.065 1.00 0.00 N ATOM 1035 CA ILE A 372 -0.385 5.655 -1.322 1.00 0.00 C ATOM 1036 C ILE A 372 -1.859 6.003 -1.361 1.00 0.00 C ATOM 1037 O ILE A 372 -2.445 6.317 -0.325 1.00 0.00 O ATOM 1038 CB ILE A 372 -0.226 4.135 -1.509 1.00 0.00 C ATOM 1039 CG1 ILE A 372 0.856 3.590 -0.567 1.00 0.00 C ATOM 1040 CG2 ILE A 372 0.094 3.822 -2.958 1.00 0.00 C ATOM 1041 CD1 ILE A 372 1.349 2.201 -0.910 1.00 0.00 C ATOM 0 H ILE A 372 -0.361 5.829 0.757 1.00 0.00 H new ATOM 0 HA ILE A 372 0.156 6.151 -2.128 1.00 0.00 H new ATOM 0 HB ILE A 372 -1.165 3.643 -1.255 1.00 0.00 H new ATOM 0 HG12 ILE A 372 1.704 4.274 -0.575 1.00 0.00 H new ATOM 0 HG13 ILE A 372 0.463 3.581 0.450 1.00 0.00 H new ATOM 0 HG21 ILE A 372 0.205 2.745 -3.082 1.00 0.00 H new ATOM 0 HG22 ILE A 372 -0.716 4.179 -3.595 1.00 0.00 H new ATOM 0 HG23 ILE A 372 1.023 4.317 -3.241 1.00 0.00 H new ATOM 0 HD11 ILE A 372 2.111 1.898 -0.192 1.00 0.00 H new ATOM 0 HD12 ILE A 372 0.516 1.500 -0.873 1.00 0.00 H new ATOM 0 HD13 ILE A 372 1.776 2.204 -1.913 1.00 0.00 H new ATOM 1053 N GLU A 373 -2.466 5.939 -2.536 1.00 0.00 N ATOM 1054 CA GLU A 373 -3.868 6.277 -2.664 1.00 0.00 C ATOM 1055 C GLU A 373 -4.597 5.221 -3.474 1.00 0.00 C ATOM 1056 O GLU A 373 -4.168 4.849 -4.566 1.00 0.00 O ATOM 1057 CB GLU A 373 -4.046 7.662 -3.288 1.00 0.00 C ATOM 1058 CG GLU A 373 -3.633 8.799 -2.366 1.00 0.00 C ATOM 1059 CD GLU A 373 -3.905 10.167 -2.952 1.00 0.00 C ATOM 1060 OE1 GLU A 373 -5.086 10.567 -3.025 1.00 0.00 O ATOM 1061 OE2 GLU A 373 -2.938 10.859 -3.330 1.00 0.00 O ATOM 0 H GLU A 373 -2.012 5.658 -3.405 1.00 0.00 H new ATOM 0 HA GLU A 373 -4.303 6.305 -1.665 1.00 0.00 H new ATOM 0 HB2 GLU A 373 -3.460 7.717 -4.205 1.00 0.00 H new ATOM 0 HB3 GLU A 373 -5.091 7.794 -3.569 1.00 0.00 H new ATOM 0 HG2 GLU A 373 -4.166 8.703 -1.420 1.00 0.00 H new ATOM 0 HG3 GLU A 373 -2.570 8.710 -2.144 1.00 0.00 H new ATOM 1068 N MET A 374 -5.689 4.739 -2.913 1.00 0.00 N ATOM 1069 CA MET A 374 -6.506 3.705 -3.530 1.00 0.00 C ATOM 1070 C MET A 374 -7.965 4.121 -3.424 1.00 0.00 C ATOM 1071 O MET A 374 -8.265 5.067 -2.711 1.00 0.00 O ATOM 1072 CB MET A 374 -6.269 2.359 -2.814 1.00 0.00 C ATOM 1073 CG MET A 374 -7.082 2.158 -1.548 1.00 0.00 C ATOM 1074 SD MET A 374 -8.614 1.259 -1.854 1.00 0.00 S ATOM 1075 CE MET A 374 -9.200 1.010 -0.184 1.00 0.00 C ATOM 0 H MET A 374 -6.039 5.055 -2.009 1.00 0.00 H new ATOM 0 HA MET A 374 -6.238 3.583 -4.580 1.00 0.00 H new ATOM 0 HB2 MET A 374 -6.497 1.550 -3.508 1.00 0.00 H new ATOM 0 HB3 MET A 374 -5.211 2.277 -2.566 1.00 0.00 H new ATOM 0 HG2 MET A 374 -6.484 1.614 -0.817 1.00 0.00 H new ATOM 0 HG3 MET A 374 -7.314 3.129 -1.110 1.00 0.00 H new ATOM 0 HE1 MET A 374 -9.087 -0.039 0.089 1.00 0.00 H new ATOM 0 HE2 MET A 374 -8.620 1.628 0.501 1.00 0.00 H new ATOM 0 HE3 MET A 374 -10.252 1.289 -0.122 1.00 0.00 H new ATOM 1085 N GLN A 375 -8.845 3.470 -4.172 1.00 0.00 N ATOM 1086 CA GLN A 375 -10.286 3.628 -3.995 1.00 0.00 C ATOM 1087 C GLN A 375 -11.013 2.705 -4.965 1.00 0.00 C ATOM 1088 O GLN A 375 -10.397 2.063 -5.809 1.00 0.00 O ATOM 1089 CB GLN A 375 -10.726 5.099 -4.192 1.00 0.00 C ATOM 1090 CG GLN A 375 -12.187 5.414 -3.821 1.00 0.00 C ATOM 1091 CD GLN A 375 -12.565 5.022 -2.390 1.00 0.00 C ATOM 1092 OE1 GLN A 375 -12.486 5.841 -1.479 1.00 0.00 O ATOM 1093 NE2 GLN A 375 -12.972 3.766 -2.184 1.00 0.00 N ATOM 0 H GLN A 375 -8.585 2.821 -4.915 1.00 0.00 H new ATOM 0 HA GLN A 375 -10.546 3.355 -2.972 1.00 0.00 H new ATOM 0 HB2 GLN A 375 -10.073 5.737 -3.596 1.00 0.00 H new ATOM 0 HB3 GLN A 375 -10.569 5.369 -5.236 1.00 0.00 H new ATOM 0 HG2 GLN A 375 -12.362 6.482 -3.953 1.00 0.00 H new ATOM 0 HG3 GLN A 375 -12.847 4.895 -4.515 1.00 0.00 H new ATOM 0 HE21 GLN A 375 -13.025 3.113 -2.965 1.00 0.00 H new ATOM 0 HE22 GLN A 375 -13.229 3.461 -1.245 1.00 0.00 H new ATOM 1102 N LEU A 376 -12.311 2.644 -4.805 1.00 0.00 N ATOM 1103 CA LEU A 376 -13.208 1.850 -5.606 1.00 0.00 C ATOM 1104 C LEU A 376 -14.578 2.399 -5.264 1.00 0.00 C ATOM 1105 O LEU A 376 -14.817 2.659 -4.085 1.00 0.00 O ATOM 1106 CB LEU A 376 -13.087 0.361 -5.230 1.00 0.00 C ATOM 1107 CG LEU A 376 -13.670 -0.660 -6.225 1.00 0.00 C ATOM 1108 CD1 LEU A 376 -15.193 -0.648 -6.216 1.00 0.00 C ATOM 1109 CD2 LEU A 376 -13.136 -0.403 -7.628 1.00 0.00 C ATOM 0 H LEU A 376 -12.794 3.172 -4.078 1.00 0.00 H new ATOM 0 HA LEU A 376 -12.996 1.905 -6.674 1.00 0.00 H new ATOM 0 HB2 LEU A 376 -12.031 0.132 -5.089 1.00 0.00 H new ATOM 0 HB3 LEU A 376 -13.576 0.214 -4.267 1.00 0.00 H new ATOM 0 HG LEU A 376 -13.350 -1.652 -5.907 1.00 0.00 H new ATOM 0 HD11 LEU A 376 -15.567 -1.381 -6.931 1.00 0.00 H new ATOM 0 HD12 LEU A 376 -15.553 -0.898 -5.218 1.00 0.00 H new ATOM 0 HD13 LEU A 376 -15.551 0.344 -6.493 1.00 0.00 H new ATOM 0 HD21 LEU A 376 -13.558 -1.134 -8.318 1.00 0.00 H new ATOM 0 HD22 LEU A 376 -13.417 0.601 -7.946 1.00 0.00 H new ATOM 0 HD23 LEU A 376 -12.050 -0.492 -7.626 1.00 0.00 H new ATOM 1121 N PRO A 377 -15.447 2.663 -6.266 1.00 0.00 N ATOM 1122 CA PRO A 377 -16.800 3.180 -6.047 1.00 0.00 C ATOM 1123 C PRO A 377 -17.375 2.765 -4.693 1.00 0.00 C ATOM 1124 O PRO A 377 -17.407 1.571 -4.376 1.00 0.00 O ATOM 1125 CB PRO A 377 -17.560 2.532 -7.196 1.00 0.00 C ATOM 1126 CG PRO A 377 -16.572 2.485 -8.321 1.00 0.00 C ATOM 1127 CD PRO A 377 -15.187 2.484 -7.703 1.00 0.00 C ATOM 0 HA PRO A 377 -16.850 4.269 -6.028 1.00 0.00 H new ATOM 0 HB2 PRO A 377 -17.906 1.533 -6.930 1.00 0.00 H new ATOM 0 HB3 PRO A 377 -18.442 3.113 -7.466 1.00 0.00 H new ATOM 0 HG2 PRO A 377 -16.723 1.592 -8.928 1.00 0.00 H new ATOM 0 HG3 PRO A 377 -16.698 3.344 -8.980 1.00 0.00 H new ATOM 0 HD2 PRO A 377 -14.660 1.550 -7.902 1.00 0.00 H new ATOM 0 HD3 PRO A 377 -14.570 3.289 -8.102 1.00 0.00 H new ATOM 1135 N PRO A 378 -17.840 3.767 -3.898 1.00 0.00 N ATOM 1136 CA PRO A 378 -18.184 3.613 -2.476 1.00 0.00 C ATOM 1137 C PRO A 378 -18.788 2.260 -2.146 1.00 0.00 C ATOM 1138 O PRO A 378 -19.707 1.788 -2.821 1.00 0.00 O ATOM 1139 CB PRO A 378 -19.206 4.724 -2.267 1.00 0.00 C ATOM 1140 CG PRO A 378 -18.755 5.818 -3.175 1.00 0.00 C ATOM 1141 CD PRO A 378 -18.046 5.161 -4.338 1.00 0.00 C ATOM 0 HA PRO A 378 -17.306 3.674 -1.832 1.00 0.00 H new ATOM 0 HB2 PRO A 378 -20.213 4.390 -2.517 1.00 0.00 H new ATOM 0 HB3 PRO A 378 -19.228 5.053 -1.228 1.00 0.00 H new ATOM 0 HG2 PRO A 378 -19.605 6.406 -3.523 1.00 0.00 H new ATOM 0 HG3 PRO A 378 -18.087 6.502 -2.652 1.00 0.00 H new ATOM 0 HD2 PRO A 378 -18.646 5.207 -5.247 1.00 0.00 H new ATOM 0 HD3 PRO A 378 -17.098 5.654 -4.556 1.00 0.00 H new ATOM 1149 N GLY A 379 -18.306 1.655 -1.071 1.00 0.00 N ATOM 1150 CA GLY A 379 -18.518 0.243 -0.875 1.00 0.00 C ATOM 1151 C GLY A 379 -17.465 -0.311 0.046 1.00 0.00 C ATOM 1152 O GLY A 379 -16.701 0.450 0.627 1.00 0.00 O ATOM 0 H GLY A 379 -17.774 2.118 -0.335 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -19.509 0.070 -0.454 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -18.484 -0.275 -1.833 1.00 0.00 H new ATOM 1156 N ASP A 380 -17.401 -1.617 0.179 1.00 0.00 N ATOM 1157 CA ASP A 380 -16.446 -2.223 1.088 1.00 0.00 C ATOM 1158 C ASP A 380 -15.138 -2.501 0.376 1.00 0.00 C ATOM 1159 O ASP A 380 -15.096 -3.277 -0.579 1.00 0.00 O ATOM 1160 CB ASP A 380 -16.985 -3.530 1.664 1.00 0.00 C ATOM 1161 CG ASP A 380 -18.262 -3.358 2.457 1.00 0.00 C ATOM 1162 OD1 ASP A 380 -19.318 -3.072 1.851 1.00 0.00 O ATOM 1163 OD2 ASP A 380 -18.218 -3.528 3.690 1.00 0.00 O ATOM 0 H ASP A 380 -17.992 -2.278 -0.325 1.00 0.00 H new ATOM 0 HA ASP A 380 -16.279 -1.518 1.903 1.00 0.00 H new ATOM 0 HB2 ASP A 380 -17.164 -4.231 0.849 1.00 0.00 H new ATOM 0 HB3 ASP A 380 -16.225 -3.976 2.306 1.00 0.00 H new ATOM 1168 N ASN A 381 -14.062 -1.907 0.855 1.00 0.00 N ATOM 1169 CA ASN A 381 -12.759 -2.169 0.282 1.00 0.00 C ATOM 1170 C ASN A 381 -11.828 -2.621 1.404 1.00 0.00 C ATOM 1171 O ASN A 381 -12.179 -2.549 2.579 1.00 0.00 O ATOM 1172 CB ASN A 381 -12.165 -0.935 -0.429 1.00 0.00 C ATOM 1173 CG ASN A 381 -13.038 -0.347 -1.535 1.00 0.00 C ATOM 1174 OD1 ASN A 381 -12.926 0.831 -1.861 1.00 0.00 O ATOM 1175 ND2 ASN A 381 -13.915 -1.144 -2.111 1.00 0.00 N ATOM 0 H ASN A 381 -14.065 -1.246 1.632 1.00 0.00 H new ATOM 0 HA ASN A 381 -12.866 -2.944 -0.477 1.00 0.00 H new ATOM 0 HB2 ASN A 381 -11.977 -0.161 0.315 1.00 0.00 H new ATOM 0 HB3 ASN A 381 -11.200 -1.209 -0.855 1.00 0.00 H new ATOM 0 HD21 ASN A 381 -14.523 -0.786 -2.848 1.00 0.00 H new ATOM 0 HD22 ASN A 381 -13.986 -2.119 -1.820 1.00 0.00 H new ATOM 1182 N ILE A 382 -10.686 -3.157 1.036 1.00 0.00 N ATOM 1183 CA ILE A 382 -9.610 -3.432 1.982 1.00 0.00 C ATOM 1184 C ILE A 382 -8.330 -3.577 1.212 1.00 0.00 C ATOM 1185 O ILE A 382 -8.318 -4.203 0.163 1.00 0.00 O ATOM 1186 CB ILE A 382 -9.866 -4.698 2.860 1.00 0.00 C ATOM 1187 CG1 ILE A 382 -8.559 -5.389 3.299 1.00 0.00 C ATOM 1188 CG2 ILE A 382 -10.724 -5.692 2.135 1.00 0.00 C ATOM 1189 CD1 ILE A 382 -8.036 -6.411 2.310 1.00 0.00 C ATOM 0 H ILE A 382 -10.470 -3.417 0.074 1.00 0.00 H new ATOM 0 HA ILE A 382 -9.553 -2.596 2.679 1.00 0.00 H new ATOM 0 HB ILE A 382 -10.382 -4.346 3.753 1.00 0.00 H new ATOM 0 HG12 ILE A 382 -7.794 -4.629 3.458 1.00 0.00 H new ATOM 0 HG13 ILE A 382 -8.725 -5.879 4.258 1.00 0.00 H new ATOM 0 HG21 ILE A 382 -10.886 -6.563 2.769 1.00 0.00 H new ATOM 0 HG22 ILE A 382 -11.684 -5.236 1.893 1.00 0.00 H new ATOM 0 HG23 ILE A 382 -10.226 -6.000 1.216 1.00 0.00 H new ATOM 0 HD11 ILE A 382 -7.115 -6.850 2.694 1.00 0.00 H new ATOM 0 HD12 ILE A 382 -8.780 -7.195 2.169 1.00 0.00 H new ATOM 0 HD13 ILE A 382 -7.836 -5.924 1.355 1.00 0.00 H new ATOM 1201 N ILE A 383 -7.252 -3.045 1.736 1.00 0.00 N ATOM 1202 CA ILE A 383 -6.016 -3.063 0.986 1.00 0.00 C ATOM 1203 C ILE A 383 -5.141 -4.196 1.479 1.00 0.00 C ATOM 1204 O ILE A 383 -4.889 -4.324 2.680 1.00 0.00 O ATOM 1205 CB ILE A 383 -5.239 -1.732 1.073 1.00 0.00 C ATOM 1206 CG1 ILE A 383 -6.147 -0.555 0.728 1.00 0.00 C ATOM 1207 CG2 ILE A 383 -4.047 -1.748 0.128 1.00 0.00 C ATOM 1208 CD1 ILE A 383 -5.548 0.777 1.104 1.00 0.00 C ATOM 0 H ILE A 383 -7.202 -2.605 2.655 1.00 0.00 H new ATOM 0 HA ILE A 383 -6.279 -3.210 -0.061 1.00 0.00 H new ATOM 0 HB ILE A 383 -4.882 -1.617 2.097 1.00 0.00 H new ATOM 0 HG12 ILE A 383 -6.356 -0.565 -0.342 1.00 0.00 H new ATOM 0 HG13 ILE A 383 -7.101 -0.676 1.240 1.00 0.00 H new ATOM 0 HG21 ILE A 383 -3.511 -0.802 0.203 1.00 0.00 H new ATOM 0 HG22 ILE A 383 -3.379 -2.566 0.399 1.00 0.00 H new ATOM 0 HG23 ILE A 383 -4.396 -1.888 -0.895 1.00 0.00 H new ATOM 0 HD11 ILE A 383 -6.239 1.576 0.835 1.00 0.00 H new ATOM 0 HD12 ILE A 383 -5.364 0.803 2.178 1.00 0.00 H new ATOM 0 HD13 ILE A 383 -4.607 0.916 0.571 1.00 0.00 H new ATOM 1220 N TYR A 384 -4.745 -5.039 0.546 1.00 0.00 N ATOM 1221 CA TYR A 384 -3.775 -6.077 0.794 1.00 0.00 C ATOM 1222 C TYR A 384 -2.434 -5.615 0.253 1.00 0.00 C ATOM 1223 O TYR A 384 -2.133 -5.797 -0.929 1.00 0.00 O ATOM 1224 CB TYR A 384 -4.194 -7.383 0.108 1.00 0.00 C ATOM 1225 CG TYR A 384 -4.516 -8.513 1.060 1.00 0.00 C ATOM 1226 CD1 TYR A 384 -3.517 -9.349 1.544 1.00 0.00 C ATOM 1227 CD2 TYR A 384 -5.819 -8.742 1.474 1.00 0.00 C ATOM 1228 CE1 TYR A 384 -3.812 -10.383 2.413 1.00 0.00 C ATOM 1229 CE2 TYR A 384 -6.123 -9.772 2.342 1.00 0.00 C ATOM 1230 CZ TYR A 384 -5.115 -10.589 2.810 1.00 0.00 C ATOM 1231 OH TYR A 384 -5.413 -11.614 3.678 1.00 0.00 O ATOM 0 H TYR A 384 -5.093 -5.019 -0.413 1.00 0.00 H new ATOM 0 HA TYR A 384 -3.706 -6.266 1.865 1.00 0.00 H new ATOM 0 HB2 TYR A 384 -5.067 -7.188 -0.514 1.00 0.00 H new ATOM 0 HB3 TYR A 384 -3.393 -7.703 -0.558 1.00 0.00 H new ATOM 0 HD1 TYR A 384 -2.494 -9.188 1.237 1.00 0.00 H new ATOM 0 HD2 TYR A 384 -6.611 -8.103 1.111 1.00 0.00 H new ATOM 0 HE1 TYR A 384 -3.025 -11.026 2.779 1.00 0.00 H new ATOM 0 HE2 TYR A 384 -7.144 -9.937 2.653 1.00 0.00 H new ATOM 0 HH TYR A 384 -6.376 -11.621 3.858 1.00 0.00 H new ATOM 1241 N VAL A 385 -1.644 -4.992 1.105 1.00 0.00 N ATOM 1242 CA VAL A 385 -0.331 -4.525 0.705 1.00 0.00 C ATOM 1243 C VAL A 385 0.633 -5.681 0.854 1.00 0.00 C ATOM 1244 O VAL A 385 1.263 -5.839 1.896 1.00 0.00 O ATOM 1245 CB VAL A 385 0.157 -3.332 1.559 1.00 0.00 C ATOM 1246 CG1 VAL A 385 1.387 -2.691 0.934 1.00 0.00 C ATOM 1247 CG2 VAL A 385 -0.943 -2.302 1.733 1.00 0.00 C ATOM 0 H VAL A 385 -1.887 -4.798 2.076 1.00 0.00 H new ATOM 0 HA VAL A 385 -0.384 -4.175 -0.326 1.00 0.00 H new ATOM 0 HB VAL A 385 0.427 -3.714 2.544 1.00 0.00 H new ATOM 0 HG11 VAL A 385 1.714 -1.854 1.551 1.00 0.00 H new ATOM 0 HG12 VAL A 385 2.188 -3.428 0.868 1.00 0.00 H new ATOM 0 HG13 VAL A 385 1.142 -2.332 -0.065 1.00 0.00 H new ATOM 0 HG21 VAL A 385 -0.573 -1.474 2.337 1.00 0.00 H new ATOM 0 HG22 VAL A 385 -1.250 -1.929 0.756 1.00 0.00 H new ATOM 0 HG23 VAL A 385 -1.797 -2.762 2.231 1.00 0.00 H new ATOM 1257 N GLY A 386 0.714 -6.508 -0.174 1.00 0.00 N ATOM 1258 CA GLY A 386 1.448 -7.744 -0.063 1.00 0.00 C ATOM 1259 C GLY A 386 0.866 -8.636 1.016 1.00 0.00 C ATOM 1260 O GLY A 386 -0.251 -9.137 0.880 1.00 0.00 O ATOM 0 H GLY A 386 0.283 -6.344 -1.084 1.00 0.00 H new ATOM 0 HA2 GLY A 386 1.430 -8.267 -1.019 1.00 0.00 H new ATOM 0 HA3 GLY A 386 2.493 -7.530 0.164 1.00 0.00 H new ATOM 1264 N ASP A 387 1.624 -8.835 2.086 1.00 0.00 N ATOM 1265 CA ASP A 387 1.168 -9.626 3.225 1.00 0.00 C ATOM 1266 C ASP A 387 0.316 -8.773 4.162 1.00 0.00 C ATOM 1267 O ASP A 387 -0.445 -9.293 4.981 1.00 0.00 O ATOM 1268 CB ASP A 387 2.377 -10.190 3.979 1.00 0.00 C ATOM 1269 CG ASP A 387 2.065 -11.454 4.752 1.00 0.00 C ATOM 1270 OD1 ASP A 387 2.090 -12.546 4.143 1.00 0.00 O ATOM 1271 OD2 ASP A 387 1.832 -11.371 5.975 1.00 0.00 O ATOM 0 H ASP A 387 2.565 -8.457 2.191 1.00 0.00 H new ATOM 0 HA ASP A 387 0.556 -10.451 2.859 1.00 0.00 H new ATOM 0 HB2 ASP A 387 3.176 -10.396 3.267 1.00 0.00 H new ATOM 0 HB3 ASP A 387 2.751 -9.434 4.669 1.00 0.00 H new ATOM 1276 N LEU A 388 0.439 -7.456 4.022 1.00 0.00 N ATOM 1277 CA LEU A 388 -0.349 -6.522 4.807 1.00 0.00 C ATOM 1278 C LEU A 388 -1.797 -6.538 4.332 1.00 0.00 C ATOM 1279 O LEU A 388 -2.077 -6.897 3.190 1.00 0.00 O ATOM 1280 CB LEU A 388 0.198 -5.099 4.669 1.00 0.00 C ATOM 1281 CG LEU A 388 0.998 -4.547 5.855 1.00 0.00 C ATOM 1282 CD1 LEU A 388 2.344 -5.236 6.004 1.00 0.00 C ATOM 1283 CD2 LEU A 388 1.201 -3.057 5.697 1.00 0.00 C ATOM 0 H LEU A 388 1.083 -7.013 3.366 1.00 0.00 H new ATOM 0 HA LEU A 388 -0.293 -6.828 5.852 1.00 0.00 H new ATOM 0 HB2 LEU A 388 0.834 -5.064 3.785 1.00 0.00 H new ATOM 0 HB3 LEU A 388 -0.642 -4.429 4.484 1.00 0.00 H new ATOM 0 HG LEU A 388 0.421 -4.746 6.758 1.00 0.00 H new ATOM 0 HD11 LEU A 388 2.877 -4.814 6.856 1.00 0.00 H new ATOM 0 HD12 LEU A 388 2.191 -6.303 6.165 1.00 0.00 H new ATOM 0 HD13 LEU A 388 2.932 -5.086 5.098 1.00 0.00 H new ATOM 0 HD21 LEU A 388 1.770 -2.675 6.545 1.00 0.00 H new ATOM 0 HD22 LEU A 388 1.748 -2.860 4.775 1.00 0.00 H new ATOM 0 HD23 LEU A 388 0.232 -2.560 5.658 1.00 0.00 H new ATOM 1295 N ASN A 389 -2.708 -6.139 5.203 1.00 0.00 N ATOM 1296 CA ASN A 389 -4.122 -6.050 4.854 1.00 0.00 C ATOM 1297 C ASN A 389 -4.887 -5.317 5.939 1.00 0.00 C ATOM 1298 O ASN A 389 -4.419 -5.224 7.074 1.00 0.00 O ATOM 1299 CB ASN A 389 -4.740 -7.436 4.632 1.00 0.00 C ATOM 1300 CG ASN A 389 -4.664 -8.326 5.859 1.00 0.00 C ATOM 1301 OD1 ASN A 389 -5.582 -8.350 6.676 1.00 0.00 O ATOM 1302 ND2 ASN A 389 -3.574 -9.068 5.995 1.00 0.00 N ATOM 0 H ASN A 389 -2.495 -5.869 6.163 1.00 0.00 H new ATOM 0 HA ASN A 389 -4.193 -5.494 3.919 1.00 0.00 H new ATOM 0 HB2 ASN A 389 -5.784 -7.319 4.340 1.00 0.00 H new ATOM 0 HB3 ASN A 389 -4.230 -7.926 3.803 1.00 0.00 H new ATOM 0 HD21 ASN A 389 -3.476 -9.687 6.800 1.00 0.00 H new ATOM 0 HD22 ASN A 389 -2.834 -9.020 5.295 1.00 0.00 H new ATOM 1309 N HIS A 390 -6.045 -4.774 5.578 1.00 0.00 N ATOM 1310 CA HIS A 390 -6.933 -4.131 6.547 1.00 0.00 C ATOM 1311 C HIS A 390 -8.235 -3.718 5.868 1.00 0.00 C ATOM 1312 O HIS A 390 -8.216 -2.915 4.927 1.00 0.00 O ATOM 1313 CB HIS A 390 -6.271 -2.909 7.182 1.00 0.00 C ATOM 1314 CG HIS A 390 -6.940 -2.475 8.453 1.00 0.00 C ATOM 1315 ND1 HIS A 390 -7.988 -1.576 8.490 1.00 0.00 N ATOM 1316 CD2 HIS A 390 -6.705 -2.824 9.740 1.00 0.00 C ATOM 1317 CE1 HIS A 390 -8.362 -1.391 9.741 1.00 0.00 C ATOM 1318 NE2 HIS A 390 -7.601 -2.136 10.519 1.00 0.00 N ATOM 0 H HIS A 390 -6.393 -4.765 4.619 1.00 0.00 H new ATOM 0 HA HIS A 390 -7.146 -4.851 7.337 1.00 0.00 H new ATOM 0 HB2 HIS A 390 -5.225 -3.135 7.387 1.00 0.00 H new ATOM 0 HB3 HIS A 390 -6.285 -2.084 6.470 1.00 0.00 H new ATOM 0 HD2 HIS A 390 -5.952 -3.515 10.089 1.00 0.00 H new ATOM 0 HE1 HIS A 390 -9.157 -0.740 10.072 1.00 0.00 H new ATOM 0 HE2 HIS A 390 -7.668 -2.192 11.535 1.00 0.00 H new ATOM 1327 N GLN A 391 -9.352 -4.299 6.305 1.00 0.00 N ATOM 1328 CA GLN A 391 -10.657 -4.005 5.726 1.00 0.00 C ATOM 1329 C GLN A 391 -11.215 -2.673 6.217 1.00 0.00 C ATOM 1330 O GLN A 391 -10.897 -2.218 7.318 1.00 0.00 O ATOM 1331 CB GLN A 391 -11.639 -5.134 6.046 1.00 0.00 C ATOM 1332 CG GLN A 391 -12.904 -5.114 5.195 1.00 0.00 C ATOM 1333 CD GLN A 391 -13.881 -6.202 5.583 1.00 0.00 C ATOM 1334 OE1 GLN A 391 -15.090 -6.028 5.470 1.00 0.00 O ATOM 1335 NE2 GLN A 391 -13.364 -7.333 6.032 1.00 0.00 N ATOM 0 H GLN A 391 -9.376 -4.980 7.064 1.00 0.00 H new ATOM 0 HA GLN A 391 -10.526 -3.928 4.647 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -11.135 -6.090 5.907 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -11.919 -5.071 7.097 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -13.389 -4.143 5.294 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -12.634 -5.230 4.145 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -12.352 -7.436 6.110 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -13.977 -8.103 6.300 1.00 0.00 H new ATOM 1344 N TRP A 392 -12.059 -2.078 5.381 1.00 0.00 N ATOM 1345 CA TRP A 392 -12.734 -0.821 5.677 1.00 0.00 C ATOM 1346 C TRP A 392 -13.639 -0.429 4.508 1.00 0.00 C ATOM 1347 O TRP A 392 -13.165 -0.205 3.398 1.00 0.00 O ATOM 1348 CB TRP A 392 -11.729 0.312 5.965 1.00 0.00 C ATOM 1349 CG TRP A 392 -12.340 1.668 5.801 1.00 0.00 C ATOM 1350 CD1 TRP A 392 -12.125 2.522 4.771 1.00 0.00 C ATOM 1351 CD2 TRP A 392 -13.282 2.309 6.665 1.00 0.00 C ATOM 1352 NE1 TRP A 392 -12.896 3.643 4.906 1.00 0.00 N ATOM 1353 CE2 TRP A 392 -13.605 3.547 6.076 1.00 0.00 C ATOM 1354 CE3 TRP A 392 -13.889 1.956 7.870 1.00 0.00 C ATOM 1355 CZ2 TRP A 392 -14.507 4.431 6.656 1.00 0.00 C ATOM 1356 CZ3 TRP A 392 -14.782 2.837 8.446 1.00 0.00 C ATOM 1357 CH2 TRP A 392 -15.085 4.060 7.838 1.00 0.00 C ATOM 0 H TRP A 392 -12.296 -2.461 4.466 1.00 0.00 H new ATOM 0 HA TRP A 392 -13.335 -0.969 6.574 1.00 0.00 H new ATOM 0 HB2 TRP A 392 -11.349 0.208 6.981 1.00 0.00 H new ATOM 0 HB3 TRP A 392 -10.875 0.217 5.294 1.00 0.00 H new ATOM 0 HD1 TRP A 392 -11.439 2.342 3.956 1.00 0.00 H new ATOM 0 HE1 TRP A 392 -12.937 4.420 4.247 1.00 0.00 H new ATOM 0 HE3 TRP A 392 -13.665 1.012 8.343 1.00 0.00 H new ATOM 0 HZ2 TRP A 392 -14.743 5.376 6.190 1.00 0.00 H new ATOM 0 HZ3 TRP A 392 -15.255 2.578 9.382 1.00 0.00 H new ATOM 0 HH2 TRP A 392 -15.791 4.725 8.313 1.00 0.00 H new ATOM 1368 N PHE A 393 -14.945 -0.395 4.732 1.00 0.00 N ATOM 1369 CA PHE A 393 -15.859 0.125 3.729 1.00 0.00 C ATOM 1370 C PHE A 393 -15.660 1.627 3.562 1.00 0.00 C ATOM 1371 O PHE A 393 -15.823 2.399 4.503 1.00 0.00 O ATOM 1372 CB PHE A 393 -17.316 -0.199 4.102 1.00 0.00 C ATOM 1373 CG PHE A 393 -17.792 0.426 5.389 1.00 0.00 C ATOM 1374 CD1 PHE A 393 -17.319 -0.022 6.611 1.00 0.00 C ATOM 1375 CD2 PHE A 393 -18.711 1.463 5.370 1.00 0.00 C ATOM 1376 CE1 PHE A 393 -17.753 0.552 7.790 1.00 0.00 C ATOM 1377 CE2 PHE A 393 -19.149 2.041 6.546 1.00 0.00 C ATOM 1378 CZ PHE A 393 -18.669 1.585 7.757 1.00 0.00 C ATOM 0 H PHE A 393 -15.391 -0.718 5.591 1.00 0.00 H new ATOM 0 HA PHE A 393 -15.642 -0.358 2.776 1.00 0.00 H new ATOM 0 HB2 PHE A 393 -17.966 0.131 3.292 1.00 0.00 H new ATOM 0 HB3 PHE A 393 -17.425 -1.281 4.177 1.00 0.00 H new ATOM 0 HD1 PHE A 393 -16.603 -0.830 6.643 1.00 0.00 H new ATOM 0 HD2 PHE A 393 -19.089 1.824 4.425 1.00 0.00 H new ATOM 0 HE1 PHE A 393 -17.376 0.193 8.737 1.00 0.00 H new ATOM 0 HE2 PHE A 393 -19.866 2.848 6.518 1.00 0.00 H new ATOM 0 HZ PHE A 393 -19.009 2.035 8.678 1.00 0.00 H new ATOM 1388 N GLN A 394 -15.330 2.034 2.351 1.00 0.00 N ATOM 1389 CA GLN A 394 -14.955 3.411 2.090 1.00 0.00 C ATOM 1390 C GLN A 394 -16.211 4.231 1.876 1.00 0.00 C ATOM 1391 O GLN A 394 -16.991 3.960 0.953 1.00 0.00 O ATOM 1392 CB GLN A 394 -14.054 3.522 0.854 1.00 0.00 C ATOM 1393 CG GLN A 394 -13.045 2.398 0.698 1.00 0.00 C ATOM 1394 CD GLN A 394 -11.925 2.503 1.698 1.00 0.00 C ATOM 1395 OE1 GLN A 394 -11.293 1.513 2.057 1.00 0.00 O ATOM 1396 NE2 GLN A 394 -11.685 3.714 2.175 1.00 0.00 N ATOM 0 H GLN A 394 -15.314 1.429 1.530 1.00 0.00 H new ATOM 0 HA GLN A 394 -14.396 3.786 2.948 1.00 0.00 H new ATOM 0 HB2 GLN A 394 -14.683 3.552 -0.035 1.00 0.00 H new ATOM 0 HB3 GLN A 394 -13.517 4.470 0.897 1.00 0.00 H new ATOM 0 HG2 GLN A 394 -13.549 1.439 0.818 1.00 0.00 H new ATOM 0 HG3 GLN A 394 -12.633 2.418 -0.311 1.00 0.00 H new ATOM 0 HE21 GLN A 394 -12.235 4.509 1.849 1.00 0.00 H new ATOM 0 HE22 GLN A 394 -10.950 3.852 2.869 1.00 0.00 H new ATOM 1405 N LYS A 395 -16.402 5.219 2.734 1.00 0.00 N ATOM 1406 CA LYS A 395 -17.591 6.058 2.707 1.00 0.00 C ATOM 1407 C LYS A 395 -17.242 7.446 3.225 1.00 0.00 C ATOM 1408 O LYS A 395 -16.855 8.307 2.411 1.00 0.00 O ATOM 1409 CB LYS A 395 -18.723 5.460 3.563 1.00 0.00 C ATOM 1410 CG LYS A 395 -19.264 4.121 3.071 1.00 0.00 C ATOM 1411 CD LYS A 395 -19.944 4.224 1.708 1.00 0.00 C ATOM 1412 CE LYS A 395 -21.344 4.825 1.785 1.00 0.00 C ATOM 1413 NZ LYS A 395 -21.335 6.276 2.111 1.00 0.00 N ATOM 1414 OXT LYS A 395 -17.337 7.663 4.451 1.00 0.00 O ATOM 0 H LYS A 395 -15.738 5.463 3.469 1.00 0.00 H new ATOM 0 HA LYS A 395 -17.942 6.118 1.677 1.00 0.00 H new ATOM 0 HB2 LYS A 395 -18.360 5.335 4.583 1.00 0.00 H new ATOM 0 HB3 LYS A 395 -19.545 6.175 3.602 1.00 0.00 H new ATOM 0 HG2 LYS A 395 -18.446 3.403 3.011 1.00 0.00 H new ATOM 0 HG3 LYS A 395 -19.976 3.732 3.799 1.00 0.00 H new ATOM 0 HD2 LYS A 395 -19.329 4.833 1.046 1.00 0.00 H new ATOM 0 HD3 LYS A 395 -20.005 3.231 1.262 1.00 0.00 H new ATOM 0 HE2 LYS A 395 -21.851 4.675 0.832 1.00 0.00 H new ATOM 0 HE3 LYS A 395 -21.922 4.292 2.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 -22.069 6.761 1.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 -21.525 6.405 3.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 -20.404 6.678 1.879 1.00 0.00 H new TER 1428 LYS A 395