USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 784 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 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.1: A 28 TYR OH : rot 120:sc= -0.166 USER MOD Set 2.2: A 48 THR OG1 : rot -74:sc= 0.532 USER MOD Set 3.1: A 16 TYR OH : rot 180:sc= -0.849 USER MOD Set 3.2: A 82 SER OG : rot 180:sc= -0.158 USER MOD Single : A 11 LYS NZ :NH3+ 168:sc= 1.05 (180deg=0.878) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 ASN : amide:sc= -0.367 K(o=-0.37,f=-6.5!) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0751) USER MOD Single : A 31 SER OG : rot 180:sc= -0.136 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 77:sc= -2.84! USER MOD Single : A 50 SER OG : rot -5:sc= -0.416 USER MOD Single : A 52 ASN : amide:sc= -0.309 K(o=-0.31,f=-3.2!) USER MOD Single : A 54 ASN : amide:sc= -2.3 K(o=-2.3,f=-3.5!) USER MOD Single : A 57 GLN : amide:sc= -0.0707 X(o=-0.071,f=0) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0.43 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot -53:sc= 0.432 USER MOD Single : A 73 SER OG : rot -48:sc= 0.315 USER MOD Single : A 83 TYR OH : rot 180:sc= 0.0158 USER MOD Single : A 85 CYS SG : rot 45:sc= -0.942 USER MOD Single : A 87 SER OG : rot 113:sc= 0.0154 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 TYR OH : rot 166:sc= -0.101 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.00351 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN : amide:sc= -0.843 K(o=-0.84,f=0.88) USER MOD Single : A 101 ASN : amide:sc= -1.54 X(o=-1.5,f=-1.6) USER MOD Single : A 103 ASN : amide:sc= -0.155 X(o=-0.16,f=0) USER MOD Single : A 105 SER OG : rot -57:sc= 0.155 USER MOD ----------------------------------------------------------------- ATOM 112 N ALA A 10 -8.141 5.042 11.444 1.00 0.00 N ATOM 113 CA ALA A 10 -7.001 4.646 10.624 1.00 0.00 C ATOM 114 C ALA A 10 -7.460 4.086 9.282 1.00 0.00 C ATOM 115 O ALA A 10 -8.366 3.255 9.221 1.00 0.00 O ATOM 116 CB ALA A 10 -6.152 3.624 11.363 1.00 0.00 C ATOM 0 HA ALA A 10 -6.397 5.532 10.430 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -5.305 3.337 10.741 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -5.788 4.059 12.294 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -6.754 2.743 11.585 1.00 0.00 H new ATOM 122 N LYS A 11 -6.825 4.544 8.208 1.00 0.00 N ATOM 123 CA LYS A 11 -7.167 4.089 6.865 1.00 0.00 C ATOM 124 C LYS A 11 -6.325 2.881 6.471 1.00 0.00 C ATOM 125 O LYS A 11 -5.105 2.979 6.336 1.00 0.00 O ATOM 126 CB LYS A 11 -6.968 5.221 5.854 1.00 0.00 C ATOM 127 CG LYS A 11 -8.270 5.848 5.381 1.00 0.00 C ATOM 128 CD LYS A 11 -8.296 7.348 5.636 1.00 0.00 C ATOM 129 CE LYS A 11 -7.234 8.068 4.822 1.00 0.00 C ATOM 130 NZ LYS A 11 -6.636 9.207 5.573 1.00 0.00 N ATOM 0 H LYS A 11 -6.071 5.230 8.241 1.00 0.00 H new ATOM 0 HA LYS A 11 -8.216 3.793 6.863 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.344 5.994 6.304 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.425 4.835 4.991 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -8.400 5.657 4.316 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -9.109 5.377 5.894 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -9.280 7.744 5.385 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -8.136 7.541 6.697 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -6.449 7.364 4.545 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -7.674 8.435 3.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -5.787 9.543 5.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -7.328 9.981 5.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -6.376 8.893 6.530 1.00 0.00 H new ATOM 144 N LYS A 12 -6.982 1.740 6.288 1.00 0.00 N ATOM 145 CA LYS A 12 -6.294 0.513 5.908 1.00 0.00 C ATOM 146 C LYS A 12 -5.828 0.577 4.457 1.00 0.00 C ATOM 147 O LYS A 12 -6.642 0.644 3.536 1.00 0.00 O ATOM 148 CB LYS A 12 -7.213 -0.694 6.108 1.00 0.00 C ATOM 149 CG LYS A 12 -7.151 -1.281 7.509 1.00 0.00 C ATOM 150 CD LYS A 12 -6.101 -2.375 7.609 1.00 0.00 C ATOM 151 CE LYS A 12 -5.486 -2.431 8.998 1.00 0.00 C ATOM 152 NZ LYS A 12 -6.457 -2.920 10.015 1.00 0.00 N ATOM 0 H LYS A 12 -7.991 1.640 6.397 1.00 0.00 H new ATOM 0 HA LYS A 12 -5.418 0.404 6.547 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -8.240 -0.398 5.892 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -6.946 -1.467 5.387 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -6.925 -0.491 8.226 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -8.126 -1.686 7.778 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -6.553 -3.338 7.371 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -5.319 -2.199 6.870 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -4.615 -3.086 8.983 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -5.134 -1.439 9.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -5.999 -2.944 10.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -7.277 -2.281 10.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -6.774 -3.877 9.760 1.00 0.00 H new ATOM 166 N VAL A 13 -4.514 0.554 4.261 1.00 0.00 N ATOM 167 CA VAL A 13 -3.940 0.610 2.922 1.00 0.00 C ATOM 168 C VAL A 13 -2.895 -0.483 2.726 1.00 0.00 C ATOM 169 O VAL A 13 -2.112 -0.776 3.630 1.00 0.00 O ATOM 170 CB VAL A 13 -3.294 1.979 2.644 1.00 0.00 C ATOM 171 CG1 VAL A 13 -4.346 3.077 2.637 1.00 0.00 C ATOM 172 CG2 VAL A 13 -2.211 2.277 3.671 1.00 0.00 C ATOM 0 H VAL A 13 -3.827 0.497 5.012 1.00 0.00 H new ATOM 0 HA VAL A 13 -4.759 0.455 2.220 1.00 0.00 H new ATOM 0 HB VAL A 13 -2.830 1.946 1.658 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.869 4.037 2.439 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -5.082 2.871 1.860 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -4.842 3.112 3.607 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -1.766 3.249 3.458 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.649 2.289 4.669 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.441 1.507 3.622 1.00 0.00 H new ATOM 182 N ARG A 14 -2.888 -1.083 1.541 1.00 0.00 N ATOM 183 CA ARG A 14 -1.938 -2.145 1.227 1.00 0.00 C ATOM 184 C ARG A 14 -0.903 -1.667 0.213 1.00 0.00 C ATOM 185 O ARG A 14 -1.250 -1.121 -0.833 1.00 0.00 O ATOM 186 CB ARG A 14 -2.675 -3.371 0.682 1.00 0.00 C ATOM 187 CG ARG A 14 -1.950 -4.681 0.945 1.00 0.00 C ATOM 188 CD ARG A 14 -2.928 -5.815 1.205 1.00 0.00 C ATOM 189 NE ARG A 14 -2.372 -6.823 2.106 1.00 0.00 N ATOM 190 CZ ARG A 14 -3.027 -7.915 2.491 1.00 0.00 C ATOM 191 NH1 ARG A 14 -4.260 -8.147 2.056 1.00 0.00 N ATOM 192 NH2 ARG A 14 -2.448 -8.780 3.311 1.00 0.00 N ATOM 0 H ARG A 14 -3.529 -0.853 0.782 1.00 0.00 H new ATOM 0 HA ARG A 14 -1.420 -2.419 2.146 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -3.667 -3.418 1.131 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -2.816 -3.252 -0.392 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -1.322 -4.929 0.089 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -1.288 -4.566 1.803 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -3.845 -5.411 1.634 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -3.199 -6.284 0.259 1.00 0.00 H new ATOM 0 HE ARG A 14 -1.426 -6.681 2.460 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -4.710 -7.486 1.423 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -4.757 -8.986 2.355 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -1.500 -8.608 3.647 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -2.950 -9.617 3.606 1.00 0.00 H new ATOM 206 N PHE A 15 0.370 -1.877 0.534 1.00 0.00 N ATOM 207 CA PHE A 15 1.457 -1.469 -0.349 1.00 0.00 C ATOM 208 C PHE A 15 2.162 -2.684 -0.941 1.00 0.00 C ATOM 209 O PHE A 15 2.679 -3.531 -0.212 1.00 0.00 O ATOM 210 CB PHE A 15 2.463 -0.604 0.414 1.00 0.00 C ATOM 211 CG PHE A 15 1.931 0.752 0.785 1.00 0.00 C ATOM 212 CD1 PHE A 15 1.642 1.689 -0.195 1.00 0.00 C ATOM 213 CD2 PHE A 15 1.721 1.089 2.112 1.00 0.00 C ATOM 214 CE1 PHE A 15 1.153 2.936 0.143 1.00 0.00 C ATOM 215 CE2 PHE A 15 1.232 2.334 2.456 1.00 0.00 C ATOM 216 CZ PHE A 15 0.947 3.259 1.471 1.00 0.00 C ATOM 0 H PHE A 15 0.674 -2.327 1.398 1.00 0.00 H new ATOM 0 HA PHE A 15 1.030 -0.886 -1.165 1.00 0.00 H new ATOM 0 HB2 PHE A 15 2.765 -1.127 1.321 1.00 0.00 H new ATOM 0 HB3 PHE A 15 3.358 -0.480 -0.195 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.801 1.441 -1.234 1.00 0.00 H new ATOM 0 HD2 PHE A 15 1.942 0.370 2.887 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.932 3.658 -0.630 1.00 0.00 H new ATOM 0 HE2 PHE A 15 1.073 2.584 3.495 1.00 0.00 H new ATOM 0 HZ PHE A 15 0.564 4.233 1.738 1.00 0.00 H new ATOM 226 N TYR A 16 2.180 -2.764 -2.267 1.00 0.00 N ATOM 227 CA TYR A 16 2.823 -3.876 -2.958 1.00 0.00 C ATOM 228 C TYR A 16 4.137 -3.436 -3.593 1.00 0.00 C ATOM 229 O TYR A 16 4.527 -2.272 -3.493 1.00 0.00 O ATOM 230 CB TYR A 16 1.890 -4.446 -4.029 1.00 0.00 C ATOM 231 CG TYR A 16 0.623 -5.052 -3.470 1.00 0.00 C ATOM 232 CD1 TYR A 16 0.577 -6.388 -3.092 1.00 0.00 C ATOM 233 CD2 TYR A 16 -0.527 -4.286 -3.318 1.00 0.00 C ATOM 234 CE1 TYR A 16 -0.580 -6.944 -2.581 1.00 0.00 C ATOM 235 CE2 TYR A 16 -1.688 -4.837 -2.807 1.00 0.00 C ATOM 236 CZ TYR A 16 -1.708 -6.165 -2.440 1.00 0.00 C ATOM 237 OH TYR A 16 -2.862 -6.717 -1.931 1.00 0.00 O ATOM 0 H TYR A 16 1.757 -2.072 -2.885 1.00 0.00 H new ATOM 0 HA TYR A 16 3.038 -4.652 -2.223 1.00 0.00 H new ATOM 0 HB2 TYR A 16 1.625 -3.652 -4.728 1.00 0.00 H new ATOM 0 HB3 TYR A 16 2.426 -5.206 -4.598 1.00 0.00 H new ATOM 0 HD1 TYR A 16 1.459 -7.002 -3.199 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -0.514 -3.244 -3.603 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -0.600 -7.985 -2.293 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -2.574 -4.230 -2.696 1.00 0.00 H new ATOM 0 HH TYR A 16 -3.564 -6.034 -1.896 1.00 0.00 H new ATOM 247 N ARG A 17 4.816 -4.372 -4.247 1.00 0.00 N ATOM 248 CA ARG A 17 6.087 -4.081 -4.898 1.00 0.00 C ATOM 249 C ARG A 17 5.923 -4.030 -6.414 1.00 0.00 C ATOM 250 O ARG A 17 5.495 -5.004 -7.035 1.00 0.00 O ATOM 251 CB ARG A 17 7.130 -5.134 -4.521 1.00 0.00 C ATOM 252 CG ARG A 17 8.530 -4.566 -4.339 1.00 0.00 C ATOM 253 CD ARG A 17 9.157 -5.020 -3.029 1.00 0.00 C ATOM 254 NE ARG A 17 10.239 -5.979 -3.243 1.00 0.00 N ATOM 255 CZ ARG A 17 10.045 -7.275 -3.477 1.00 0.00 C ATOM 256 NH1 ARG A 17 8.815 -7.772 -3.530 1.00 0.00 N ATOM 257 NH2 ARG A 17 11.085 -8.078 -3.658 1.00 0.00 N ATOM 0 H ARG A 17 4.507 -5.339 -4.340 1.00 0.00 H new ATOM 0 HA ARG A 17 6.427 -3.104 -4.555 1.00 0.00 H new ATOM 0 HB2 ARG A 17 6.822 -5.624 -3.597 1.00 0.00 H new ATOM 0 HB3 ARG A 17 7.156 -5.901 -5.295 1.00 0.00 H new ATOM 0 HG2 ARG A 17 9.160 -4.879 -5.171 1.00 0.00 H new ATOM 0 HG3 ARG A 17 8.487 -3.477 -4.363 1.00 0.00 H new ATOM 0 HD2 ARG A 17 9.542 -4.153 -2.492 1.00 0.00 H new ATOM 0 HD3 ARG A 17 8.392 -5.472 -2.398 1.00 0.00 H new ATOM 0 HE ARG A 17 11.199 -5.635 -3.211 1.00 0.00 H new ATOM 0 HH11 ARG A 17 8.011 -7.160 -3.391 1.00 0.00 H new ATOM 0 HH12 ARG A 17 8.674 -8.766 -3.710 1.00 0.00 H new ATOM 0 HH21 ARG A 17 12.032 -7.702 -3.618 1.00 0.00 H new ATOM 0 HH22 ARG A 17 10.937 -9.071 -3.837 1.00 0.00 H new ATOM 271 N ASN A 18 6.264 -2.889 -7.003 1.00 0.00 N ATOM 272 CA ASN A 18 6.154 -2.710 -8.446 1.00 0.00 C ATOM 273 C ASN A 18 7.207 -3.537 -9.178 1.00 0.00 C ATOM 274 O ASN A 18 8.400 -3.243 -9.109 1.00 0.00 O ATOM 275 CB ASN A 18 6.305 -1.233 -8.811 1.00 0.00 C ATOM 276 CG ASN A 18 5.862 -0.938 -10.231 1.00 0.00 C ATOM 277 OD1 ASN A 18 5.185 -1.749 -10.862 1.00 0.00 O ATOM 278 ND2 ASN A 18 6.244 0.228 -10.739 1.00 0.00 N ATOM 0 H ASN A 18 6.619 -2.074 -6.503 1.00 0.00 H new ATOM 0 HA ASN A 18 5.167 -3.054 -8.756 1.00 0.00 H new ATOM 0 HB2 ASN A 18 5.719 -0.629 -8.118 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.347 -0.937 -8.690 1.00 0.00 H new ATOM 0 HD21 ASN A 18 5.976 0.482 -11.690 1.00 0.00 H new ATOM 0 HD22 ASN A 18 6.805 0.869 -10.178 1.00 0.00 H new ATOM 285 N GLY A 19 6.756 -4.572 -9.879 1.00 0.00 N ATOM 286 CA GLY A 19 7.672 -5.425 -10.614 1.00 0.00 C ATOM 287 C GLY A 19 7.659 -6.856 -10.114 1.00 0.00 C ATOM 288 O GLY A 19 7.926 -7.789 -10.872 1.00 0.00 O ATOM 0 H GLY A 19 5.773 -4.835 -9.951 1.00 0.00 H new ATOM 0 HA2 GLY A 19 7.408 -5.410 -11.671 1.00 0.00 H new ATOM 0 HA3 GLY A 19 8.682 -5.024 -10.532 1.00 0.00 H new ATOM 292 N ASP A 20 7.350 -7.030 -8.833 1.00 0.00 N ATOM 293 CA ASP A 20 7.305 -8.358 -8.232 1.00 0.00 C ATOM 294 C ASP A 20 5.866 -8.785 -7.961 1.00 0.00 C ATOM 295 O ASP A 20 5.062 -8.006 -7.449 1.00 0.00 O ATOM 296 CB ASP A 20 8.110 -8.380 -6.931 1.00 0.00 C ATOM 297 CG ASP A 20 8.737 -9.734 -6.661 1.00 0.00 C ATOM 298 OD1 ASP A 20 9.647 -10.128 -7.420 1.00 0.00 O ATOM 299 OD2 ASP A 20 8.318 -10.400 -5.691 1.00 0.00 O ATOM 0 H ASP A 20 7.127 -6.269 -8.192 1.00 0.00 H new ATOM 0 HA ASP A 20 7.747 -9.063 -8.936 1.00 0.00 H new ATOM 0 HB2 ASP A 20 8.893 -7.623 -6.979 1.00 0.00 H new ATOM 0 HB3 ASP A 20 7.458 -8.112 -6.099 1.00 0.00 H new ATOM 304 N ARG A 21 5.550 -10.030 -8.305 1.00 0.00 N ATOM 305 CA ARG A 21 4.208 -10.562 -8.098 1.00 0.00 C ATOM 306 C ARG A 21 4.194 -11.579 -6.961 1.00 0.00 C ATOM 307 O ARG A 21 3.181 -11.756 -6.286 1.00 0.00 O ATOM 308 CB ARG A 21 3.690 -11.210 -9.383 1.00 0.00 C ATOM 309 CG ARG A 21 4.544 -12.374 -9.863 1.00 0.00 C ATOM 310 CD ARG A 21 5.451 -11.964 -11.013 1.00 0.00 C ATOM 311 NE ARG A 21 5.875 -13.113 -11.810 1.00 0.00 N ATOM 312 CZ ARG A 21 6.406 -13.015 -13.028 1.00 0.00 C ATOM 313 NH1 ARG A 21 6.581 -11.825 -13.590 1.00 0.00 N ATOM 314 NH2 ARG A 21 6.763 -14.109 -13.684 1.00 0.00 N ATOM 0 H ARG A 21 6.204 -10.688 -8.728 1.00 0.00 H new ATOM 0 HA ARG A 21 3.554 -9.733 -7.827 1.00 0.00 H new ATOM 0 HB2 ARG A 21 2.671 -11.561 -9.218 1.00 0.00 H new ATOM 0 HB3 ARG A 21 3.644 -10.455 -10.168 1.00 0.00 H new ATOM 0 HG2 ARG A 21 5.149 -12.748 -9.037 1.00 0.00 H new ATOM 0 HG3 ARG A 21 3.899 -13.193 -10.181 1.00 0.00 H new ATOM 0 HD2 ARG A 21 4.928 -11.252 -11.652 1.00 0.00 H new ATOM 0 HD3 ARG A 21 6.329 -11.452 -10.618 1.00 0.00 H new ATOM 0 HE ARG A 21 5.758 -14.044 -11.411 1.00 0.00 H new ATOM 0 HH11 ARG A 21 6.308 -10.979 -13.089 1.00 0.00 H new ATOM 0 HH12 ARG A 21 6.988 -11.756 -14.523 1.00 0.00 H new ATOM 0 HH21 ARG A 21 6.631 -15.026 -13.257 1.00 0.00 H new ATOM 0 HH22 ARG A 21 7.170 -14.035 -14.617 1.00 0.00 H new ATOM 328 N TYR A 22 5.327 -12.244 -6.754 1.00 0.00 N ATOM 329 CA TYR A 22 5.447 -13.243 -5.699 1.00 0.00 C ATOM 330 C TYR A 22 5.100 -12.648 -4.337 1.00 0.00 C ATOM 331 O TYR A 22 4.663 -13.358 -3.431 1.00 0.00 O ATOM 332 CB TYR A 22 6.865 -13.817 -5.670 1.00 0.00 C ATOM 333 CG TYR A 22 7.248 -14.549 -6.937 1.00 0.00 C ATOM 334 CD1 TYR A 22 7.800 -13.869 -8.015 1.00 0.00 C ATOM 335 CD2 TYR A 22 7.059 -15.920 -7.053 1.00 0.00 C ATOM 336 CE1 TYR A 22 8.152 -14.535 -9.174 1.00 0.00 C ATOM 337 CE2 TYR A 22 7.409 -16.594 -8.208 1.00 0.00 C ATOM 338 CZ TYR A 22 7.954 -15.896 -9.265 1.00 0.00 C ATOM 339 OH TYR A 22 8.304 -16.563 -10.416 1.00 0.00 O ATOM 0 H TYR A 22 6.175 -12.108 -7.304 1.00 0.00 H new ATOM 0 HA TYR A 22 4.740 -14.045 -5.914 1.00 0.00 H new ATOM 0 HB2 TYR A 22 7.573 -13.006 -5.501 1.00 0.00 H new ATOM 0 HB3 TYR A 22 6.955 -14.499 -4.825 1.00 0.00 H new ATOM 0 HD1 TYR A 22 7.957 -12.803 -7.947 1.00 0.00 H new ATOM 0 HD2 TYR A 22 6.631 -16.469 -6.227 1.00 0.00 H new ATOM 0 HE1 TYR A 22 8.580 -13.992 -10.004 1.00 0.00 H new ATOM 0 HE2 TYR A 22 7.257 -17.661 -8.282 1.00 0.00 H new ATOM 0 HH TYR A 22 8.101 -17.516 -10.316 1.00 0.00 H new ATOM 349 N PHE A 23 5.299 -11.340 -4.198 1.00 0.00 N ATOM 350 CA PHE A 23 5.007 -10.651 -2.945 1.00 0.00 C ATOM 351 C PHE A 23 3.545 -10.837 -2.550 1.00 0.00 C ATOM 352 O PHE A 23 2.666 -10.925 -3.407 1.00 0.00 O ATOM 353 CB PHE A 23 5.327 -9.160 -3.073 1.00 0.00 C ATOM 354 CG PHE A 23 5.660 -8.505 -1.763 1.00 0.00 C ATOM 355 CD1 PHE A 23 6.741 -8.937 -1.012 1.00 0.00 C ATOM 356 CD2 PHE A 23 4.892 -7.455 -1.284 1.00 0.00 C ATOM 357 CE1 PHE A 23 7.049 -8.335 0.194 1.00 0.00 C ATOM 358 CE2 PHE A 23 5.196 -6.849 -0.080 1.00 0.00 C ATOM 359 CZ PHE A 23 6.276 -7.291 0.660 1.00 0.00 C ATOM 0 H PHE A 23 5.661 -10.737 -4.937 1.00 0.00 H new ATOM 0 HA PHE A 23 5.633 -11.085 -2.165 1.00 0.00 H new ATOM 0 HB2 PHE A 23 6.166 -9.034 -3.757 1.00 0.00 H new ATOM 0 HB3 PHE A 23 4.473 -8.650 -3.519 1.00 0.00 H new ATOM 0 HD1 PHE A 23 7.350 -9.753 -1.373 1.00 0.00 H new ATOM 0 HD2 PHE A 23 4.046 -7.107 -1.858 1.00 0.00 H new ATOM 0 HE1 PHE A 23 7.894 -8.681 0.771 1.00 0.00 H new ATOM 0 HE2 PHE A 23 4.591 -6.031 0.282 1.00 0.00 H new ATOM 0 HZ PHE A 23 6.515 -6.820 1.602 1.00 0.00 H new ATOM 369 N LYS A 24 3.294 -10.896 -1.246 1.00 0.00 N ATOM 370 CA LYS A 24 1.938 -11.073 -0.736 1.00 0.00 C ATOM 371 C LYS A 24 1.283 -9.726 -0.452 1.00 0.00 C ATOM 372 O LYS A 24 0.067 -9.578 -0.572 1.00 0.00 O ATOM 373 CB LYS A 24 1.957 -11.923 0.536 1.00 0.00 C ATOM 374 CG LYS A 24 1.865 -13.416 0.271 1.00 0.00 C ATOM 375 CD LYS A 24 3.165 -13.962 -0.299 1.00 0.00 C ATOM 376 CE LYS A 24 2.908 -15.000 -1.378 1.00 0.00 C ATOM 377 NZ LYS A 24 2.090 -16.136 -0.873 1.00 0.00 N ATOM 0 H LYS A 24 4.011 -10.824 -0.524 1.00 0.00 H new ATOM 0 HA LYS A 24 1.353 -11.586 -1.499 1.00 0.00 H new ATOM 0 HB2 LYS A 24 2.874 -11.716 1.088 1.00 0.00 H new ATOM 0 HB3 LYS A 24 1.126 -11.624 1.175 1.00 0.00 H new ATOM 0 HG2 LYS A 24 1.626 -13.937 1.198 1.00 0.00 H new ATOM 0 HG3 LYS A 24 1.050 -13.613 -0.425 1.00 0.00 H new ATOM 0 HD2 LYS A 24 3.754 -13.144 -0.713 1.00 0.00 H new ATOM 0 HD3 LYS A 24 3.756 -14.407 0.502 1.00 0.00 H new ATOM 0 HE2 LYS A 24 2.397 -14.531 -2.219 1.00 0.00 H new ATOM 0 HE3 LYS A 24 3.860 -15.377 -1.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 2.009 -16.861 -1.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 2.547 -16.547 -0.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 1.142 -15.794 -0.618 1.00 0.00 H new ATOM 391 N GLY A 25 2.097 -8.745 -0.073 1.00 0.00 N ATOM 392 CA GLY A 25 1.577 -7.423 0.224 1.00 0.00 C ATOM 393 C GLY A 25 1.612 -7.105 1.705 1.00 0.00 C ATOM 394 O GLY A 25 1.411 -7.987 2.542 1.00 0.00 O ATOM 0 H GLY A 25 3.107 -8.842 0.034 1.00 0.00 H new ATOM 0 HA2 GLY A 25 2.158 -6.677 -0.318 1.00 0.00 H new ATOM 0 HA3 GLY A 25 0.551 -7.351 -0.136 1.00 0.00 H new ATOM 398 N ILE A 26 1.868 -5.843 2.033 1.00 0.00 N ATOM 399 CA ILE A 26 1.930 -5.411 3.423 1.00 0.00 C ATOM 400 C ILE A 26 0.794 -4.444 3.748 1.00 0.00 C ATOM 401 O ILE A 26 0.439 -3.593 2.934 1.00 0.00 O ATOM 402 CB ILE A 26 3.279 -4.736 3.743 1.00 0.00 C ATOM 403 CG1 ILE A 26 3.363 -4.383 5.229 1.00 0.00 C ATOM 404 CG2 ILE A 26 3.469 -3.491 2.886 1.00 0.00 C ATOM 405 CD1 ILE A 26 4.781 -4.239 5.738 1.00 0.00 C ATOM 0 H ILE A 26 2.036 -5.101 1.353 1.00 0.00 H new ATOM 0 HA ILE A 26 1.828 -6.305 4.039 1.00 0.00 H new ATOM 0 HB ILE A 26 4.079 -5.439 3.511 1.00 0.00 H new ATOM 0 HG12 ILE A 26 2.827 -3.450 5.403 1.00 0.00 H new ATOM 0 HG13 ILE A 26 2.855 -5.155 5.807 1.00 0.00 H new ATOM 0 HG21 ILE A 26 4.426 -3.027 3.125 1.00 0.00 H new ATOM 0 HG22 ILE A 26 3.454 -3.769 1.832 1.00 0.00 H new ATOM 0 HG23 ILE A 26 2.663 -2.785 3.087 1.00 0.00 H new ATOM 0 HD11 ILE A 26 4.763 -3.988 6.799 1.00 0.00 H new ATOM 0 HD12 ILE A 26 5.316 -5.178 5.596 1.00 0.00 H new ATOM 0 HD13 ILE A 26 5.287 -3.447 5.186 1.00 0.00 H new ATOM 417 N VAL A 27 0.230 -4.583 4.944 1.00 0.00 N ATOM 418 CA VAL A 27 -0.863 -3.722 5.376 1.00 0.00 C ATOM 419 C VAL A 27 -0.336 -2.487 6.099 1.00 0.00 C ATOM 420 O VAL A 27 0.767 -2.498 6.645 1.00 0.00 O ATOM 421 CB VAL A 27 -1.836 -4.471 6.308 1.00 0.00 C ATOM 422 CG1 VAL A 27 -3.049 -3.610 6.622 1.00 0.00 C ATOM 423 CG2 VAL A 27 -2.260 -5.794 5.687 1.00 0.00 C ATOM 0 H VAL A 27 0.512 -5.283 5.630 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.397 -3.415 4.477 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.319 -4.683 7.244 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -3.723 -4.157 7.281 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.726 -2.692 7.114 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.569 -3.362 5.696 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.947 -6.308 6.360 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.757 -5.606 4.735 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -1.381 -6.416 5.521 1.00 0.00 H new ATOM 433 N TYR A 28 -1.131 -1.422 6.098 1.00 0.00 N ATOM 434 CA TYR A 28 -0.743 -0.178 6.753 1.00 0.00 C ATOM 435 C TYR A 28 -1.949 0.495 7.399 1.00 0.00 C ATOM 436 O TYR A 28 -3.071 0.390 6.905 1.00 0.00 O ATOM 437 CB TYR A 28 -0.090 0.772 5.746 1.00 0.00 C ATOM 438 CG TYR A 28 1.418 0.823 5.851 1.00 0.00 C ATOM 439 CD1 TYR A 28 2.204 -0.196 5.328 1.00 0.00 C ATOM 440 CD2 TYR A 28 2.054 1.890 6.473 1.00 0.00 C ATOM 441 CE1 TYR A 28 3.582 -0.153 5.422 1.00 0.00 C ATOM 442 CE2 TYR A 28 3.432 1.940 6.570 1.00 0.00 C ATOM 443 CZ TYR A 28 4.191 0.917 6.044 1.00 0.00 C ATOM 444 OH TYR A 28 5.563 0.963 6.140 1.00 0.00 O ATOM 0 H TYR A 28 -2.048 -1.395 5.651 1.00 0.00 H new ATOM 0 HA TYR A 28 -0.022 -0.417 7.535 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -0.365 0.464 4.737 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.490 1.775 5.893 1.00 0.00 H new ATOM 0 HD1 TYR A 28 1.731 -1.035 4.840 1.00 0.00 H new ATOM 0 HD2 TYR A 28 1.463 2.693 6.887 1.00 0.00 H new ATOM 0 HE1 TYR A 28 4.179 -0.953 5.010 1.00 0.00 H new ATOM 0 HE2 TYR A 28 3.912 2.777 7.056 1.00 0.00 H new ATOM 0 HH TYR A 28 5.896 1.764 5.684 1.00 0.00 H new ATOM 454 N ALA A 29 -1.709 1.189 8.508 1.00 0.00 N ATOM 455 CA ALA A 29 -2.776 1.882 9.222 1.00 0.00 C ATOM 456 C ALA A 29 -2.496 3.378 9.305 1.00 0.00 C ATOM 457 O ALA A 29 -1.801 3.841 10.211 1.00 0.00 O ATOM 458 CB ALA A 29 -2.944 1.295 10.615 1.00 0.00 C ATOM 0 H ALA A 29 -0.786 1.286 8.931 1.00 0.00 H new ATOM 0 HA ALA A 29 -3.704 1.743 8.667 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -3.743 1.821 11.137 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -3.196 0.238 10.536 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -2.013 1.405 11.171 1.00 0.00 H new ATOM 464 N ILE A 30 -3.043 4.132 8.357 1.00 0.00 N ATOM 465 CA ILE A 30 -2.852 5.576 8.324 1.00 0.00 C ATOM 466 C ILE A 30 -3.531 6.247 9.513 1.00 0.00 C ATOM 467 O ILE A 30 -4.707 6.607 9.448 1.00 0.00 O ATOM 468 CB ILE A 30 -3.401 6.187 7.020 1.00 0.00 C ATOM 469 CG1 ILE A 30 -2.866 5.425 5.807 1.00 0.00 C ATOM 470 CG2 ILE A 30 -3.035 7.661 6.930 1.00 0.00 C ATOM 471 CD1 ILE A 30 -1.354 5.380 5.740 1.00 0.00 C ATOM 0 H ILE A 30 -3.622 3.766 7.601 1.00 0.00 H new ATOM 0 HA ILE A 30 -1.778 5.754 8.374 1.00 0.00 H new ATOM 0 HB ILE A 30 -4.488 6.102 7.027 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -3.251 4.406 5.830 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -3.248 5.890 4.898 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.430 8.078 6.004 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -3.462 8.194 7.779 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -1.950 7.768 6.943 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -1.045 4.824 4.855 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -0.962 6.396 5.686 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -0.965 4.888 6.631 1.00 0.00 H new ATOM 483 N SER A 31 -2.783 6.413 10.600 1.00 0.00 N ATOM 484 CA SER A 31 -3.312 7.041 11.804 1.00 0.00 C ATOM 485 C SER A 31 -2.539 8.315 12.139 1.00 0.00 C ATOM 486 O SER A 31 -1.359 8.438 11.810 1.00 0.00 O ATOM 487 CB SER A 31 -3.249 6.067 12.982 1.00 0.00 C ATOM 488 OG SER A 31 -4.444 6.109 13.744 1.00 0.00 O ATOM 0 H SER A 31 -1.808 6.121 10.671 1.00 0.00 H new ATOM 0 HA SER A 31 -4.352 7.308 11.617 1.00 0.00 H new ATOM 0 HB2 SER A 31 -3.085 5.055 12.612 1.00 0.00 H new ATOM 0 HB3 SER A 31 -2.400 6.315 13.618 1.00 0.00 H new ATOM 0 HG SER A 31 -4.379 5.476 14.490 1.00 0.00 H new ATOM 494 N PRO A 32 -3.197 9.283 12.799 1.00 0.00 N ATOM 495 CA PRO A 32 -2.565 10.551 13.177 1.00 0.00 C ATOM 496 C PRO A 32 -1.265 10.344 13.947 1.00 0.00 C ATOM 497 O PRO A 32 -0.269 11.025 13.699 1.00 0.00 O ATOM 498 CB PRO A 32 -3.613 11.221 14.069 1.00 0.00 C ATOM 499 CG PRO A 32 -4.911 10.631 13.637 1.00 0.00 C ATOM 500 CD PRO A 32 -4.606 9.216 13.229 1.00 0.00 C ATOM 0 HA PRO A 32 -2.288 11.143 12.304 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -3.420 11.024 15.123 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -3.608 12.303 13.941 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -5.640 10.655 14.447 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -5.338 11.193 12.807 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -4.741 8.521 14.057 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -5.257 8.881 12.422 1.00 0.00 H new ATOM 508 N ASP A 33 -1.281 9.402 14.884 1.00 0.00 N ATOM 509 CA ASP A 33 -0.103 9.107 15.691 1.00 0.00 C ATOM 510 C ASP A 33 0.874 8.218 14.927 1.00 0.00 C ATOM 511 O ASP A 33 2.089 8.396 15.014 1.00 0.00 O ATOM 512 CB ASP A 33 -0.513 8.429 17.000 1.00 0.00 C ATOM 513 CG ASP A 33 -0.726 9.423 18.124 1.00 0.00 C ATOM 514 OD1 ASP A 33 -1.829 10.003 18.203 1.00 0.00 O ATOM 515 OD2 ASP A 33 0.211 9.622 18.926 1.00 0.00 O ATOM 0 H ASP A 33 -2.097 8.830 15.103 1.00 0.00 H new ATOM 0 HA ASP A 33 0.396 10.049 15.918 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -1.431 7.863 16.841 1.00 0.00 H new ATOM 0 HB3 ASP A 33 0.256 7.714 17.292 1.00 0.00 H new ATOM 520 N ARG A 34 0.336 7.260 14.180 1.00 0.00 N ATOM 521 CA ARG A 34 1.161 6.343 13.402 1.00 0.00 C ATOM 522 C ARG A 34 1.915 7.088 12.305 1.00 0.00 C ATOM 523 O ARG A 34 3.082 6.804 12.037 1.00 0.00 O ATOM 524 CB ARG A 34 0.294 5.239 12.789 1.00 0.00 C ATOM 525 CG ARG A 34 0.669 3.843 13.258 1.00 0.00 C ATOM 526 CD ARG A 34 0.192 2.781 12.280 1.00 0.00 C ATOM 527 NE ARG A 34 0.356 1.431 12.816 1.00 0.00 N ATOM 528 CZ ARG A 34 1.519 0.786 12.856 1.00 0.00 C ATOM 529 NH1 ARG A 34 2.622 1.364 12.395 1.00 0.00 N ATOM 530 NH2 ARG A 34 1.580 -0.439 13.359 1.00 0.00 N ATOM 0 H ARG A 34 -0.668 7.098 14.097 1.00 0.00 H new ATOM 0 HA ARG A 34 1.891 5.889 14.073 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -0.750 5.429 13.037 1.00 0.00 H new ATOM 0 HB3 ARG A 34 0.377 5.283 11.703 1.00 0.00 H new ATOM 0 HG2 ARG A 34 1.751 3.775 13.372 1.00 0.00 H new ATOM 0 HG3 ARG A 34 0.232 3.658 14.239 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -0.858 2.952 12.043 1.00 0.00 H new ATOM 0 HD3 ARG A 34 0.748 2.871 11.347 1.00 0.00 H new ATOM 0 HE ARG A 34 -0.469 0.956 13.181 1.00 0.00 H new ATOM 0 HH11 ARG A 34 2.580 2.307 12.008 1.00 0.00 H new ATOM 0 HH12 ARG A 34 3.511 0.865 12.428 1.00 0.00 H new ATOM 0 HH21 ARG A 34 0.736 -0.887 13.715 1.00 0.00 H new ATOM 0 HH22 ARG A 34 2.471 -0.934 13.390 1.00 0.00 H new ATOM 544 N PHE A 35 1.238 8.042 11.673 1.00 0.00 N ATOM 545 CA PHE A 35 1.844 8.828 10.605 1.00 0.00 C ATOM 546 C PHE A 35 1.318 10.260 10.617 1.00 0.00 C ATOM 547 O PHE A 35 0.115 10.490 10.499 1.00 0.00 O ATOM 548 CB PHE A 35 1.564 8.183 9.246 1.00 0.00 C ATOM 549 CG PHE A 35 1.967 6.737 9.174 1.00 0.00 C ATOM 550 CD1 PHE A 35 3.286 6.381 8.944 1.00 0.00 C ATOM 551 CD2 PHE A 35 1.025 5.733 9.336 1.00 0.00 C ATOM 552 CE1 PHE A 35 3.658 5.052 8.877 1.00 0.00 C ATOM 553 CE2 PHE A 35 1.391 4.403 9.271 1.00 0.00 C ATOM 554 CZ PHE A 35 2.710 4.062 9.040 1.00 0.00 C ATOM 0 H PHE A 35 0.271 8.289 11.882 1.00 0.00 H new ATOM 0 HA PHE A 35 2.921 8.853 10.774 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.500 8.267 9.025 1.00 0.00 H new ATOM 0 HB3 PHE A 35 2.095 8.739 8.473 1.00 0.00 H new ATOM 0 HD1 PHE A 35 4.032 7.151 8.816 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.008 5.994 9.515 1.00 0.00 H new ATOM 0 HE1 PHE A 35 4.690 4.788 8.697 1.00 0.00 H new ATOM 0 HE2 PHE A 35 0.647 3.631 9.401 1.00 0.00 H new ATOM 0 HZ PHE A 35 2.999 3.023 8.987 1.00 0.00 H new ATOM 564 N ARG A 36 2.228 11.218 10.762 1.00 0.00 N ATOM 565 CA ARG A 36 1.856 12.627 10.789 1.00 0.00 C ATOM 566 C ARG A 36 1.535 13.132 9.386 1.00 0.00 C ATOM 567 O ARG A 36 0.487 13.737 9.157 1.00 0.00 O ATOM 568 CB ARG A 36 2.981 13.462 11.404 1.00 0.00 C ATOM 569 CG ARG A 36 2.500 14.456 12.449 1.00 0.00 C ATOM 570 CD ARG A 36 1.572 15.496 11.842 1.00 0.00 C ATOM 571 NE ARG A 36 2.268 16.747 11.551 1.00 0.00 N ATOM 572 CZ ARG A 36 1.652 17.911 11.361 1.00 0.00 C ATOM 573 NH1 ARG A 36 0.329 17.989 11.431 1.00 0.00 N ATOM 574 NH2 ARG A 36 2.361 19.001 11.101 1.00 0.00 N ATOM 0 H ARG A 36 3.228 11.044 10.863 1.00 0.00 H new ATOM 0 HA ARG A 36 0.962 12.730 11.404 1.00 0.00 H new ATOM 0 HB2 ARG A 36 3.711 12.793 11.860 1.00 0.00 H new ATOM 0 HB3 ARG A 36 3.496 14.003 10.610 1.00 0.00 H new ATOM 0 HG2 ARG A 36 1.981 13.925 13.247 1.00 0.00 H new ATOM 0 HG3 ARG A 36 3.358 14.953 12.903 1.00 0.00 H new ATOM 0 HD2 ARG A 36 1.136 15.101 10.924 1.00 0.00 H new ATOM 0 HD3 ARG A 36 0.748 15.691 12.528 1.00 0.00 H new ATOM 0 HE ARG A 36 3.286 16.727 11.490 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -0.221 17.154 11.631 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -0.138 18.884 11.284 1.00 0.00 H new ATOM 0 HH21 ARG A 36 3.378 18.947 11.047 1.00 0.00 H new ATOM 0 HH22 ARG A 36 1.889 19.894 10.955 1.00 0.00 H new ATOM 588 N SER A 37 2.443 12.879 8.450 1.00 0.00 N ATOM 589 CA SER A 37 2.257 13.306 7.068 1.00 0.00 C ATOM 590 C SER A 37 2.757 12.241 6.097 1.00 0.00 C ATOM 591 O SER A 37 3.202 11.171 6.510 1.00 0.00 O ATOM 592 CB SER A 37 2.990 14.625 6.818 1.00 0.00 C ATOM 593 OG SER A 37 4.372 14.506 7.109 1.00 0.00 O ATOM 0 H SER A 37 3.316 12.380 8.623 1.00 0.00 H new ATOM 0 HA SER A 37 1.190 13.453 6.899 1.00 0.00 H new ATOM 0 HB2 SER A 37 2.859 14.926 5.778 1.00 0.00 H new ATOM 0 HB3 SER A 37 2.552 15.410 7.434 1.00 0.00 H new ATOM 0 HG SER A 37 4.817 15.362 6.939 1.00 0.00 H new ATOM 599 N PHE A 38 2.681 12.544 4.805 1.00 0.00 N ATOM 600 CA PHE A 38 3.126 11.612 3.775 1.00 0.00 C ATOM 601 C PHE A 38 4.608 11.289 3.937 1.00 0.00 C ATOM 602 O PHE A 38 5.049 10.180 3.633 1.00 0.00 O ATOM 603 CB PHE A 38 2.868 12.195 2.384 1.00 0.00 C ATOM 604 CG PHE A 38 2.847 11.161 1.295 1.00 0.00 C ATOM 605 CD1 PHE A 38 2.068 10.022 1.418 1.00 0.00 C ATOM 606 CD2 PHE A 38 3.604 11.330 0.148 1.00 0.00 C ATOM 607 CE1 PHE A 38 2.047 9.069 0.418 1.00 0.00 C ATOM 608 CE2 PHE A 38 3.587 10.381 -0.857 1.00 0.00 C ATOM 609 CZ PHE A 38 2.807 9.249 -0.721 1.00 0.00 C ATOM 0 H PHE A 38 2.316 13.426 4.447 1.00 0.00 H new ATOM 0 HA PHE A 38 2.557 10.689 3.885 1.00 0.00 H new ATOM 0 HB2 PHE A 38 1.914 12.723 2.391 1.00 0.00 H new ATOM 0 HB3 PHE A 38 3.639 12.932 2.159 1.00 0.00 H new ATOM 0 HD1 PHE A 38 1.470 9.877 2.306 1.00 0.00 H new ATOM 0 HD2 PHE A 38 4.215 12.214 0.037 1.00 0.00 H new ATOM 0 HE1 PHE A 38 1.437 8.184 0.527 1.00 0.00 H new ATOM 0 HE2 PHE A 38 4.182 10.524 -1.747 1.00 0.00 H new ATOM 0 HZ PHE A 38 2.792 8.506 -1.504 1.00 0.00 H new ATOM 619 N GLU A 39 5.371 12.264 4.418 1.00 0.00 N ATOM 620 CA GLU A 39 6.804 12.084 4.621 1.00 0.00 C ATOM 621 C GLU A 39 7.075 10.963 5.619 1.00 0.00 C ATOM 622 O GLU A 39 7.963 10.137 5.413 1.00 0.00 O ATOM 623 CB GLU A 39 7.438 13.386 5.113 1.00 0.00 C ATOM 624 CG GLU A 39 7.739 14.375 3.999 1.00 0.00 C ATOM 625 CD GLU A 39 7.630 15.817 4.455 1.00 0.00 C ATOM 626 OE1 GLU A 39 6.767 16.107 5.311 1.00 0.00 O ATOM 627 OE2 GLU A 39 8.408 16.657 3.957 1.00 0.00 O ATOM 0 H GLU A 39 5.021 13.187 4.675 1.00 0.00 H new ATOM 0 HA GLU A 39 7.250 11.810 3.665 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.769 13.856 5.834 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.363 13.153 5.641 1.00 0.00 H new ATOM 0 HG2 GLU A 39 8.744 14.193 3.618 1.00 0.00 H new ATOM 0 HG3 GLU A 39 7.049 14.206 3.172 1.00 0.00 H new ATOM 634 N ALA A 40 6.304 10.941 6.701 1.00 0.00 N ATOM 635 CA ALA A 40 6.461 9.921 7.731 1.00 0.00 C ATOM 636 C ALA A 40 6.168 8.532 7.174 1.00 0.00 C ATOM 637 O ALA A 40 6.887 7.575 7.459 1.00 0.00 O ATOM 638 CB ALA A 40 5.551 10.221 8.913 1.00 0.00 C ATOM 0 H ALA A 40 5.564 11.618 6.887 1.00 0.00 H new ATOM 0 HA ALA A 40 7.496 9.937 8.071 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.678 9.452 9.675 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.809 11.193 9.333 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.513 10.233 8.579 1.00 0.00 H new ATOM 644 N LEU A 41 5.107 8.429 6.381 1.00 0.00 N ATOM 645 CA LEU A 41 4.720 7.156 5.784 1.00 0.00 C ATOM 646 C LEU A 41 5.774 6.678 4.792 1.00 0.00 C ATOM 647 O LEU A 41 6.115 5.496 4.753 1.00 0.00 O ATOM 648 CB LEU A 41 3.365 7.286 5.084 1.00 0.00 C ATOM 649 CG LEU A 41 2.871 6.017 4.389 1.00 0.00 C ATOM 650 CD1 LEU A 41 2.415 4.992 5.415 1.00 0.00 C ATOM 651 CD2 LEU A 41 1.743 6.345 3.422 1.00 0.00 C ATOM 0 H LEU A 41 4.500 9.211 6.137 1.00 0.00 H new ATOM 0 HA LEU A 41 4.638 6.419 6.583 1.00 0.00 H new ATOM 0 HB2 LEU A 41 2.621 7.592 5.820 1.00 0.00 H new ATOM 0 HB3 LEU A 41 3.430 8.085 4.345 1.00 0.00 H new ATOM 0 HG LEU A 41 3.697 5.590 3.821 1.00 0.00 H new ATOM 0 HD11 LEU A 41 2.067 4.095 4.903 1.00 0.00 H new ATOM 0 HD12 LEU A 41 3.249 4.736 6.069 1.00 0.00 H new ATOM 0 HD13 LEU A 41 1.602 5.409 6.010 1.00 0.00 H new ATOM 0 HD21 LEU A 41 1.403 5.431 2.936 1.00 0.00 H new ATOM 0 HD22 LEU A 41 0.914 6.795 3.969 1.00 0.00 H new ATOM 0 HD23 LEU A 41 2.102 7.045 2.668 1.00 0.00 H new ATOM 663 N LEU A 42 6.288 7.605 3.989 1.00 0.00 N ATOM 664 CA LEU A 42 7.304 7.278 2.996 1.00 0.00 C ATOM 665 C LEU A 42 8.553 6.711 3.663 1.00 0.00 C ATOM 666 O LEU A 42 9.176 5.783 3.148 1.00 0.00 O ATOM 667 CB LEU A 42 7.668 8.520 2.180 1.00 0.00 C ATOM 668 CG LEU A 42 6.699 8.858 1.046 1.00 0.00 C ATOM 669 CD1 LEU A 42 6.612 10.365 0.850 1.00 0.00 C ATOM 670 CD2 LEU A 42 7.131 8.176 -0.244 1.00 0.00 C ATOM 0 H LEU A 42 6.017 8.588 4.007 1.00 0.00 H new ATOM 0 HA LEU A 42 6.894 6.520 2.329 1.00 0.00 H new ATOM 0 HB2 LEU A 42 7.726 9.374 2.854 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.663 8.379 1.757 1.00 0.00 H new ATOM 0 HG LEU A 42 5.710 8.489 1.316 1.00 0.00 H new ATOM 0 HD11 LEU A 42 5.918 10.587 0.039 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.257 10.832 1.769 1.00 0.00 H new ATOM 0 HD13 LEU A 42 7.598 10.757 0.601 1.00 0.00 H new ATOM 0 HD21 LEU A 42 6.431 8.427 -1.041 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.130 8.516 -0.518 1.00 0.00 H new ATOM 0 HD23 LEU A 42 7.143 7.096 -0.098 1.00 0.00 H new ATOM 682 N ALA A 43 8.911 7.274 4.812 1.00 0.00 N ATOM 683 CA ALA A 43 10.084 6.824 5.550 1.00 0.00 C ATOM 684 C ALA A 43 9.946 5.364 5.968 1.00 0.00 C ATOM 685 O ALA A 43 10.883 4.579 5.833 1.00 0.00 O ATOM 686 CB ALA A 43 10.309 7.705 6.770 1.00 0.00 C ATOM 0 H ALA A 43 8.405 8.043 5.252 1.00 0.00 H new ATOM 0 HA ALA A 43 10.949 6.904 4.891 1.00 0.00 H new ATOM 0 HB1 ALA A 43 11.188 7.358 7.312 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.463 8.736 6.451 1.00 0.00 H new ATOM 0 HB3 ALA A 43 9.437 7.653 7.422 1.00 0.00 H new ATOM 692 N ASP A 44 8.770 5.008 6.474 1.00 0.00 N ATOM 693 CA ASP A 44 8.509 3.641 6.911 1.00 0.00 C ATOM 694 C ASP A 44 8.431 2.694 5.717 1.00 0.00 C ATOM 695 O ASP A 44 8.882 1.550 5.789 1.00 0.00 O ATOM 696 CB ASP A 44 7.209 3.579 7.715 1.00 0.00 C ATOM 697 CG ASP A 44 7.450 3.663 9.209 1.00 0.00 C ATOM 698 OD1 ASP A 44 7.855 2.641 9.804 1.00 0.00 O ATOM 699 OD2 ASP A 44 7.233 4.749 9.786 1.00 0.00 O ATOM 0 H ASP A 44 7.983 5.646 6.592 1.00 0.00 H new ATOM 0 HA ASP A 44 9.335 3.325 7.548 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.556 4.396 7.408 1.00 0.00 H new ATOM 0 HB3 ASP A 44 6.687 2.650 7.485 1.00 0.00 H new ATOM 704 N LEU A 45 7.858 3.178 4.621 1.00 0.00 N ATOM 705 CA LEU A 45 7.722 2.375 3.411 1.00 0.00 C ATOM 706 C LEU A 45 9.090 1.944 2.891 1.00 0.00 C ATOM 707 O LEU A 45 9.311 0.769 2.596 1.00 0.00 O ATOM 708 CB LEU A 45 6.979 3.163 2.331 1.00 0.00 C ATOM 709 CG LEU A 45 5.454 3.072 2.396 1.00 0.00 C ATOM 710 CD1 LEU A 45 4.818 4.085 1.456 1.00 0.00 C ATOM 711 CD2 LEU A 45 4.990 1.663 2.056 1.00 0.00 C ATOM 0 H LEU A 45 7.480 4.122 4.545 1.00 0.00 H new ATOM 0 HA LEU A 45 7.147 1.482 3.659 1.00 0.00 H new ATOM 0 HB2 LEU A 45 7.268 4.211 2.404 1.00 0.00 H new ATOM 0 HB3 LEU A 45 7.307 2.809 1.354 1.00 0.00 H new ATOM 0 HG LEU A 45 5.138 3.303 3.413 1.00 0.00 H new ATOM 0 HD11 LEU A 45 3.733 4.005 1.516 1.00 0.00 H new ATOM 0 HD12 LEU A 45 5.125 5.091 1.744 1.00 0.00 H new ATOM 0 HD13 LEU A 45 5.141 3.886 0.434 1.00 0.00 H new ATOM 0 HD21 LEU A 45 3.902 1.616 2.107 1.00 0.00 H new ATOM 0 HD22 LEU A 45 5.318 1.405 1.049 1.00 0.00 H new ATOM 0 HD23 LEU A 45 5.417 0.957 2.768 1.00 0.00 H new ATOM 723 N THR A 46 10.004 2.902 2.782 1.00 0.00 N ATOM 724 CA THR A 46 11.351 2.624 2.299 1.00 0.00 C ATOM 725 C THR A 46 12.057 1.619 3.205 1.00 0.00 C ATOM 726 O THR A 46 12.889 0.835 2.749 1.00 0.00 O ATOM 727 CB THR A 46 12.164 3.917 2.222 1.00 0.00 C ATOM 728 OG1 THR A 46 11.409 4.948 1.611 1.00 0.00 O ATOM 729 CG2 THR A 46 13.453 3.768 1.443 1.00 0.00 C ATOM 0 H THR A 46 9.836 3.879 3.022 1.00 0.00 H new ATOM 0 HA THR A 46 11.271 2.193 1.301 1.00 0.00 H new ATOM 0 HB THR A 46 12.409 4.166 3.254 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.755 5.298 2.251 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.981 4.722 1.427 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.080 3.014 1.918 1.00 0.00 H new ATOM 0 HG23 THR A 46 13.228 3.461 0.422 1.00 0.00 H new ATOM 737 N ARG A 47 11.719 1.648 4.490 1.00 0.00 N ATOM 738 CA ARG A 47 12.319 0.739 5.459 1.00 0.00 C ATOM 739 C ARG A 47 11.822 -0.687 5.246 1.00 0.00 C ATOM 740 O ARG A 47 12.545 -1.652 5.498 1.00 0.00 O ATOM 741 CB ARG A 47 12.003 1.199 6.884 1.00 0.00 C ATOM 742 CG ARG A 47 13.205 1.166 7.814 1.00 0.00 C ATOM 743 CD ARG A 47 12.860 1.713 9.189 1.00 0.00 C ATOM 744 NE ARG A 47 12.704 3.167 9.176 1.00 0.00 N ATOM 745 CZ ARG A 47 12.071 3.852 10.126 1.00 0.00 C ATOM 746 NH1 ARG A 47 11.535 3.222 11.164 1.00 0.00 N ATOM 747 NH2 ARG A 47 11.974 5.171 10.037 1.00 0.00 N ATOM 0 H ARG A 47 11.033 2.291 4.884 1.00 0.00 H new ATOM 0 HA ARG A 47 13.399 0.752 5.314 1.00 0.00 H new ATOM 0 HB2 ARG A 47 11.608 2.214 6.850 1.00 0.00 H new ATOM 0 HB3 ARG A 47 11.218 0.565 7.296 1.00 0.00 H new ATOM 0 HG2 ARG A 47 13.565 0.142 7.909 1.00 0.00 H new ATOM 0 HG3 ARG A 47 14.017 1.751 7.382 1.00 0.00 H new ATOM 0 HD2 ARG A 47 11.937 1.252 9.541 1.00 0.00 H new ATOM 0 HD3 ARG A 47 13.643 1.439 9.896 1.00 0.00 H new ATOM 0 HE ARG A 47 13.103 3.686 8.394 1.00 0.00 H new ATOM 0 HH11 ARG A 47 11.607 2.207 11.237 1.00 0.00 H new ATOM 0 HH12 ARG A 47 11.051 3.753 11.888 1.00 0.00 H new ATOM 0 HH21 ARG A 47 12.384 5.660 9.241 1.00 0.00 H new ATOM 0 HH22 ARG A 47 11.489 5.697 10.764 1.00 0.00 H new ATOM 761 N THR A 48 10.584 -0.813 4.780 1.00 0.00 N ATOM 762 CA THR A 48 9.989 -2.121 4.532 1.00 0.00 C ATOM 763 C THR A 48 10.129 -2.513 3.065 1.00 0.00 C ATOM 764 O THR A 48 10.879 -3.428 2.725 1.00 0.00 O ATOM 765 CB THR A 48 8.513 -2.117 4.932 1.00 0.00 C ATOM 766 OG1 THR A 48 7.880 -0.927 4.500 1.00 0.00 O ATOM 767 CG2 THR A 48 8.298 -2.237 6.426 1.00 0.00 C ATOM 0 H THR A 48 9.973 -0.025 4.566 1.00 0.00 H new ATOM 0 HA THR A 48 10.521 -2.855 5.138 1.00 0.00 H new ATOM 0 HB THR A 48 8.079 -2.992 4.448 1.00 0.00 H new ATOM 0 HG1 THR A 48 8.161 -0.181 5.070 1.00 0.00 H new ATOM 0 HG21 THR A 48 7.230 -2.228 6.642 1.00 0.00 H new ATOM 0 HG22 THR A 48 8.732 -3.171 6.782 1.00 0.00 H new ATOM 0 HG23 THR A 48 8.777 -1.398 6.931 1.00 0.00 H new ATOM 775 N LEU A 49 9.404 -1.813 2.199 1.00 0.00 N ATOM 776 CA LEU A 49 9.448 -2.085 0.768 1.00 0.00 C ATOM 777 C LEU A 49 10.507 -1.228 0.083 1.00 0.00 C ATOM 778 O LEU A 49 10.248 -0.085 -0.292 1.00 0.00 O ATOM 779 CB LEU A 49 8.079 -1.827 0.135 1.00 0.00 C ATOM 780 CG LEU A 49 6.890 -2.406 0.905 1.00 0.00 C ATOM 781 CD1 LEU A 49 5.595 -1.744 0.462 1.00 0.00 C ATOM 782 CD2 LEU A 49 6.814 -3.912 0.711 1.00 0.00 C ATOM 0 H LEU A 49 8.778 -1.052 2.464 1.00 0.00 H new ATOM 0 HA LEU A 49 9.711 -3.134 0.632 1.00 0.00 H new ATOM 0 HB2 LEU A 49 7.939 -0.751 0.036 1.00 0.00 H new ATOM 0 HB3 LEU A 49 8.077 -2.243 -0.872 1.00 0.00 H new ATOM 0 HG LEU A 49 7.034 -2.203 1.966 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.760 -2.168 1.020 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.651 -0.672 0.652 1.00 0.00 H new ATOM 0 HD13 LEU A 49 5.444 -1.917 -0.604 1.00 0.00 H new ATOM 0 HD21 LEU A 49 5.963 -4.308 1.265 1.00 0.00 H new ATOM 0 HD22 LEU A 49 6.693 -4.137 -0.349 1.00 0.00 H new ATOM 0 HD23 LEU A 49 7.731 -4.373 1.077 1.00 0.00 H new ATOM 794 N SER A 50 11.702 -1.788 -0.077 1.00 0.00 N ATOM 795 CA SER A 50 12.802 -1.076 -0.716 1.00 0.00 C ATOM 796 C SER A 50 14.010 -1.988 -0.896 1.00 0.00 C ATOM 797 O SER A 50 15.154 -1.551 -0.769 1.00 0.00 O ATOM 798 CB SER A 50 13.193 0.150 0.112 1.00 0.00 C ATOM 799 OG SER A 50 13.944 1.070 -0.662 1.00 0.00 O ATOM 0 H SER A 50 11.933 -2.734 0.228 1.00 0.00 H new ATOM 0 HA SER A 50 12.467 -0.750 -1.700 1.00 0.00 H new ATOM 0 HB2 SER A 50 12.295 0.637 0.492 1.00 0.00 H new ATOM 0 HB3 SER A 50 13.776 -0.163 0.978 1.00 0.00 H new ATOM 0 HG SER A 50 14.127 0.683 -1.544 1.00 0.00 H new ATOM 805 N ASP A 51 13.749 -3.257 -1.193 1.00 0.00 N ATOM 806 CA ASP A 51 14.816 -4.230 -1.389 1.00 0.00 C ATOM 807 C ASP A 51 15.682 -3.855 -2.589 1.00 0.00 C ATOM 808 O ASP A 51 15.460 -2.827 -3.228 1.00 0.00 O ATOM 809 CB ASP A 51 14.229 -5.629 -1.587 1.00 0.00 C ATOM 810 CG ASP A 51 14.074 -6.380 -0.278 1.00 0.00 C ATOM 811 OD1 ASP A 51 13.229 -5.970 0.544 1.00 0.00 O ATOM 812 OD2 ASP A 51 14.798 -7.378 -0.078 1.00 0.00 O ATOM 0 H ASP A 51 12.808 -3.635 -1.303 1.00 0.00 H new ATOM 0 HA ASP A 51 15.443 -4.229 -0.497 1.00 0.00 H new ATOM 0 HB2 ASP A 51 13.257 -5.547 -2.073 1.00 0.00 H new ATOM 0 HB3 ASP A 51 14.873 -6.199 -2.256 1.00 0.00 H new ATOM 817 N ASN A 52 16.668 -4.695 -2.886 1.00 0.00 N ATOM 818 CA ASN A 52 17.567 -4.450 -4.008 1.00 0.00 C ATOM 819 C ASN A 52 17.140 -5.251 -5.235 1.00 0.00 C ATOM 820 O ASN A 52 17.970 -5.629 -6.062 1.00 0.00 O ATOM 821 CB ASN A 52 19.004 -4.809 -3.623 1.00 0.00 C ATOM 822 CG ASN A 52 19.824 -3.589 -3.250 1.00 0.00 C ATOM 823 OD1 ASN A 52 19.315 -2.468 -3.224 1.00 0.00 O ATOM 824 ND2 ASN A 52 21.102 -3.802 -2.958 1.00 0.00 N ATOM 0 H ASN A 52 16.865 -5.550 -2.366 1.00 0.00 H new ATOM 0 HA ASN A 52 17.518 -3.390 -4.256 1.00 0.00 H new ATOM 0 HB2 ASN A 52 18.990 -5.504 -2.784 1.00 0.00 H new ATOM 0 HB3 ASN A 52 19.483 -5.324 -4.456 1.00 0.00 H new ATOM 0 HD21 ASN A 52 21.703 -3.020 -2.699 1.00 0.00 H new ATOM 0 HD22 ASN A 52 21.482 -4.748 -2.992 1.00 0.00 H new ATOM 831 N VAL A 53 15.840 -5.506 -5.347 1.00 0.00 N ATOM 832 CA VAL A 53 15.305 -6.261 -6.474 1.00 0.00 C ATOM 833 C VAL A 53 14.339 -5.413 -7.295 1.00 0.00 C ATOM 834 O VAL A 53 14.329 -5.481 -8.524 1.00 0.00 O ATOM 835 CB VAL A 53 14.577 -7.535 -6.003 1.00 0.00 C ATOM 836 CG1 VAL A 53 14.191 -8.400 -7.194 1.00 0.00 C ATOM 837 CG2 VAL A 53 15.442 -8.316 -5.024 1.00 0.00 C ATOM 0 H VAL A 53 15.139 -5.201 -4.672 1.00 0.00 H new ATOM 0 HA VAL A 53 16.154 -6.545 -7.095 1.00 0.00 H new ATOM 0 HB VAL A 53 13.664 -7.239 -5.487 1.00 0.00 H new ATOM 0 HG11 VAL A 53 13.678 -9.295 -6.842 1.00 0.00 H new ATOM 0 HG12 VAL A 53 13.529 -7.838 -7.853 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.089 -8.688 -7.741 1.00 0.00 H new ATOM 0 HG21 VAL A 53 14.910 -9.212 -4.703 1.00 0.00 H new ATOM 0 HG22 VAL A 53 16.374 -8.602 -5.511 1.00 0.00 H new ATOM 0 HG23 VAL A 53 15.662 -7.694 -4.156 1.00 0.00 H new ATOM 847 N ASN A 54 13.530 -4.614 -6.608 1.00 0.00 N ATOM 848 CA ASN A 54 12.560 -3.752 -7.274 1.00 0.00 C ATOM 849 C ASN A 54 12.908 -2.281 -7.070 1.00 0.00 C ATOM 850 O ASN A 54 13.118 -1.543 -8.032 1.00 0.00 O ATOM 851 CB ASN A 54 11.150 -4.031 -6.749 1.00 0.00 C ATOM 852 CG ASN A 54 10.536 -5.270 -7.372 1.00 0.00 C ATOM 853 OD1 ASN A 54 9.494 -5.199 -8.023 1.00 0.00 O ATOM 854 ND2 ASN A 54 11.182 -6.414 -7.176 1.00 0.00 N ATOM 0 H ASN A 54 13.527 -4.545 -5.590 1.00 0.00 H new ATOM 0 HA ASN A 54 12.592 -3.971 -8.341 1.00 0.00 H new ATOM 0 HB2 ASN A 54 11.186 -4.152 -5.666 1.00 0.00 H new ATOM 0 HB3 ASN A 54 10.512 -3.171 -6.953 1.00 0.00 H new ATOM 0 HD21 ASN A 54 10.817 -7.280 -7.572 1.00 0.00 H new ATOM 0 HD22 ASN A 54 12.043 -6.426 -6.629 1.00 0.00 H new ATOM 861 N LEU A 55 12.966 -1.861 -5.810 1.00 0.00 N ATOM 862 CA LEU A 55 13.289 -0.478 -5.479 1.00 0.00 C ATOM 863 C LEU A 55 14.533 -0.404 -4.597 1.00 0.00 C ATOM 864 O LEU A 55 14.435 -0.392 -3.371 1.00 0.00 O ATOM 865 CB LEU A 55 12.108 0.188 -4.770 1.00 0.00 C ATOM 866 CG LEU A 55 10.791 0.170 -5.548 1.00 0.00 C ATOM 867 CD1 LEU A 55 9.626 0.518 -4.634 1.00 0.00 C ATOM 868 CD2 LEU A 55 10.855 1.133 -6.724 1.00 0.00 C ATOM 0 H LEU A 55 12.794 -2.459 -5.002 1.00 0.00 H new ATOM 0 HA LEU A 55 13.493 0.053 -6.409 1.00 0.00 H new ATOM 0 HB2 LEU A 55 11.953 -0.308 -3.812 1.00 0.00 H new ATOM 0 HB3 LEU A 55 12.371 1.224 -4.554 1.00 0.00 H new ATOM 0 HG LEU A 55 10.633 -0.836 -5.936 1.00 0.00 H new ATOM 0 HD11 LEU A 55 8.698 0.500 -5.205 1.00 0.00 H new ATOM 0 HD12 LEU A 55 9.568 -0.210 -3.825 1.00 0.00 H new ATOM 0 HD13 LEU A 55 9.776 1.514 -4.216 1.00 0.00 H new ATOM 0 HD21 LEU A 55 9.910 1.108 -7.267 1.00 0.00 H new ATOM 0 HD22 LEU A 55 11.036 2.143 -6.357 1.00 0.00 H new ATOM 0 HD23 LEU A 55 11.665 0.839 -7.392 1.00 0.00 H new ATOM 880 N PRO A 56 15.727 -0.354 -5.215 1.00 0.00 N ATOM 881 CA PRO A 56 16.994 -0.281 -4.480 1.00 0.00 C ATOM 882 C PRO A 56 17.199 1.077 -3.816 1.00 0.00 C ATOM 883 O PRO A 56 17.711 1.162 -2.700 1.00 0.00 O ATOM 884 CB PRO A 56 18.046 -0.511 -5.565 1.00 0.00 C ATOM 885 CG PRO A 56 17.398 -0.051 -6.824 1.00 0.00 C ATOM 886 CD PRO A 56 15.934 -0.364 -6.676 1.00 0.00 C ATOM 0 HA PRO A 56 17.037 -1.005 -3.666 1.00 0.00 H new ATOM 0 HB2 PRO A 56 18.956 0.052 -5.360 1.00 0.00 H new ATOM 0 HB3 PRO A 56 18.328 -1.562 -5.626 1.00 0.00 H new ATOM 0 HG2 PRO A 56 17.555 1.017 -6.976 1.00 0.00 H new ATOM 0 HG3 PRO A 56 17.821 -0.562 -7.689 1.00 0.00 H new ATOM 0 HD2 PRO A 56 15.312 0.379 -7.175 1.00 0.00 H new ATOM 0 HD3 PRO A 56 15.684 -1.332 -7.110 1.00 0.00 H new ATOM 894 N GLN A 57 16.797 2.136 -4.511 1.00 0.00 N ATOM 895 CA GLN A 57 16.937 3.491 -3.990 1.00 0.00 C ATOM 896 C GLN A 57 15.969 3.730 -2.835 1.00 0.00 C ATOM 897 O GLN A 57 16.377 3.817 -1.677 1.00 0.00 O ATOM 898 CB GLN A 57 16.694 4.514 -5.102 1.00 0.00 C ATOM 899 CG GLN A 57 17.935 5.302 -5.485 1.00 0.00 C ATOM 900 CD GLN A 57 18.847 4.534 -6.422 1.00 0.00 C ATOM 901 OE1 GLN A 57 19.993 4.237 -6.086 1.00 0.00 O ATOM 902 NE2 GLN A 57 18.339 4.209 -7.605 1.00 0.00 N ATOM 0 H GLN A 57 16.372 2.082 -5.436 1.00 0.00 H new ATOM 0 HA GLN A 57 17.954 3.610 -3.616 1.00 0.00 H new ATOM 0 HB2 GLN A 57 16.316 3.997 -5.984 1.00 0.00 H new ATOM 0 HB3 GLN A 57 15.917 5.208 -4.782 1.00 0.00 H new ATOM 0 HG2 GLN A 57 17.635 6.236 -5.960 1.00 0.00 H new ATOM 0 HG3 GLN A 57 18.486 5.566 -4.582 1.00 0.00 H new ATOM 0 HE21 GLN A 57 17.383 4.476 -7.840 1.00 0.00 H new ATOM 0 HE22 GLN A 57 18.905 3.692 -8.278 1.00 0.00 H new ATOM 911 N GLY A 58 14.685 3.839 -3.158 1.00 0.00 N ATOM 912 CA GLY A 58 13.679 4.067 -2.137 1.00 0.00 C ATOM 913 C GLY A 58 12.338 4.462 -2.722 1.00 0.00 C ATOM 914 O GLY A 58 12.249 4.843 -3.889 1.00 0.00 O ATOM 0 H GLY A 58 14.323 3.774 -4.109 1.00 0.00 H new ATOM 0 HA2 GLY A 58 13.559 3.162 -1.541 1.00 0.00 H new ATOM 0 HA3 GLY A 58 14.022 4.851 -1.462 1.00 0.00 H new ATOM 918 N VAL A 59 11.290 4.370 -1.909 1.00 0.00 N ATOM 919 CA VAL A 59 9.946 4.720 -2.353 1.00 0.00 C ATOM 920 C VAL A 59 9.782 6.233 -2.469 1.00 0.00 C ATOM 921 O VAL A 59 10.371 6.992 -1.699 1.00 0.00 O ATOM 922 CB VAL A 59 8.876 4.164 -1.391 1.00 0.00 C ATOM 923 CG1 VAL A 59 9.057 4.740 0.006 1.00 0.00 C ATOM 924 CG2 VAL A 59 7.478 4.454 -1.919 1.00 0.00 C ATOM 0 H VAL A 59 11.346 4.056 -0.940 1.00 0.00 H new ATOM 0 HA VAL A 59 9.807 4.269 -3.336 1.00 0.00 H new ATOM 0 HB VAL A 59 8.999 3.083 -1.330 1.00 0.00 H new ATOM 0 HG11 VAL A 59 8.292 4.335 0.669 1.00 0.00 H new ATOM 0 HG12 VAL A 59 10.044 4.473 0.385 1.00 0.00 H new ATOM 0 HG13 VAL A 59 8.965 5.825 -0.033 1.00 0.00 H new ATOM 0 HG21 VAL A 59 6.737 4.054 -1.227 1.00 0.00 H new ATOM 0 HG22 VAL A 59 7.341 5.531 -2.014 1.00 0.00 H new ATOM 0 HG23 VAL A 59 7.353 3.985 -2.895 1.00 0.00 H new ATOM 934 N ARG A 60 8.978 6.663 -3.435 1.00 0.00 N ATOM 935 CA ARG A 60 8.736 8.085 -3.652 1.00 0.00 C ATOM 936 C ARG A 60 7.287 8.335 -4.058 1.00 0.00 C ATOM 937 O ARG A 60 6.571 9.095 -3.404 1.00 0.00 O ATOM 938 CB ARG A 60 9.682 8.625 -4.726 1.00 0.00 C ATOM 939 CG ARG A 60 10.889 9.355 -4.161 1.00 0.00 C ATOM 940 CD ARG A 60 10.596 10.831 -3.935 1.00 0.00 C ATOM 941 NE ARG A 60 11.236 11.676 -4.940 1.00 0.00 N ATOM 942 CZ ARG A 60 11.324 13.001 -4.845 1.00 0.00 C ATOM 943 NH1 ARG A 60 10.814 13.634 -3.796 1.00 0.00 N ATOM 944 NH2 ARG A 60 11.924 13.694 -5.803 1.00 0.00 N ATOM 0 H ARG A 60 8.483 6.048 -4.080 1.00 0.00 H new ATOM 0 HA ARG A 60 8.925 8.609 -2.715 1.00 0.00 H new ATOM 0 HB2 ARG A 60 10.026 7.797 -5.345 1.00 0.00 H new ATOM 0 HB3 ARG A 60 9.130 9.303 -5.377 1.00 0.00 H new ATOM 0 HG2 ARG A 60 11.186 8.894 -3.219 1.00 0.00 H new ATOM 0 HG3 ARG A 60 11.731 9.251 -4.846 1.00 0.00 H new ATOM 0 HD2 ARG A 60 9.519 10.994 -3.957 1.00 0.00 H new ATOM 0 HD3 ARG A 60 10.942 11.122 -2.943 1.00 0.00 H new ATOM 0 HE ARG A 60 11.639 11.225 -5.762 1.00 0.00 H new ATOM 0 HH11 ARG A 60 10.351 13.105 -3.057 1.00 0.00 H new ATOM 0 HH12 ARG A 60 10.885 14.649 -3.729 1.00 0.00 H new ATOM 0 HH21 ARG A 60 12.317 13.212 -6.611 1.00 0.00 H new ATOM 0 HH22 ARG A 60 11.992 14.709 -5.732 1.00 0.00 H new ATOM 958 N THR A 61 6.860 7.691 -5.139 1.00 0.00 N ATOM 959 CA THR A 61 5.496 7.845 -5.632 1.00 0.00 C ATOM 960 C THR A 61 4.777 6.500 -5.673 1.00 0.00 C ATOM 961 O THR A 61 5.263 5.543 -6.273 1.00 0.00 O ATOM 962 CB THR A 61 5.504 8.475 -7.026 1.00 0.00 C ATOM 963 OG1 THR A 61 6.507 9.470 -7.120 1.00 0.00 O ATOM 964 CG2 THR A 61 4.185 9.116 -7.400 1.00 0.00 C ATOM 0 H THR A 61 7.439 7.057 -5.690 1.00 0.00 H new ATOM 0 HA THR A 61 4.960 8.502 -4.947 1.00 0.00 H new ATOM 0 HB THR A 61 5.698 7.652 -7.714 1.00 0.00 H new ATOM 0 HG1 THR A 61 6.498 9.860 -8.019 1.00 0.00 H new ATOM 0 HG21 THR A 61 4.259 9.544 -8.400 1.00 0.00 H new ATOM 0 HG22 THR A 61 3.397 8.363 -7.385 1.00 0.00 H new ATOM 0 HG23 THR A 61 3.948 9.904 -6.685 1.00 0.00 H new ATOM 972 N ILE A 62 3.616 6.437 -5.029 1.00 0.00 N ATOM 973 CA ILE A 62 2.829 5.210 -4.991 1.00 0.00 C ATOM 974 C ILE A 62 1.555 5.350 -5.816 1.00 0.00 C ATOM 975 O ILE A 62 0.767 6.274 -5.609 1.00 0.00 O ATOM 976 CB ILE A 62 2.452 4.828 -3.546 1.00 0.00 C ATOM 977 CG1 ILE A 62 3.693 4.831 -2.651 1.00 0.00 C ATOM 978 CG2 ILE A 62 1.773 3.467 -3.516 1.00 0.00 C ATOM 979 CD1 ILE A 62 3.447 5.417 -1.278 1.00 0.00 C ATOM 0 H ILE A 62 3.200 7.221 -4.527 1.00 0.00 H new ATOM 0 HA ILE A 62 3.451 4.422 -5.416 1.00 0.00 H new ATOM 0 HB ILE A 62 1.751 5.570 -3.163 1.00 0.00 H new ATOM 0 HG12 ILE A 62 4.054 3.808 -2.541 1.00 0.00 H new ATOM 0 HG13 ILE A 62 4.484 5.397 -3.142 1.00 0.00 H new ATOM 0 HG21 ILE A 62 1.513 3.212 -2.488 1.00 0.00 H new ATOM 0 HG22 ILE A 62 0.867 3.499 -4.122 1.00 0.00 H new ATOM 0 HG23 ILE A 62 2.451 2.713 -3.916 1.00 0.00 H new ATOM 0 HD11 ILE A 62 4.370 5.387 -0.699 1.00 0.00 H new ATOM 0 HD12 ILE A 62 3.115 6.450 -1.378 1.00 0.00 H new ATOM 0 HD13 ILE A 62 2.679 4.837 -0.767 1.00 0.00 H new ATOM 991 N TYR A 63 1.358 4.427 -6.753 1.00 0.00 N ATOM 992 CA TYR A 63 0.178 4.448 -7.610 1.00 0.00 C ATOM 993 C TYR A 63 -0.849 3.421 -7.145 1.00 0.00 C ATOM 994 O TYR A 63 -0.537 2.529 -6.356 1.00 0.00 O ATOM 995 CB TYR A 63 0.572 4.174 -9.062 1.00 0.00 C ATOM 996 CG TYR A 63 1.718 5.029 -9.551 1.00 0.00 C ATOM 997 CD1 TYR A 63 3.021 4.780 -9.138 1.00 0.00 C ATOM 998 CD2 TYR A 63 1.497 6.087 -10.424 1.00 0.00 C ATOM 999 CE1 TYR A 63 4.071 5.562 -9.582 1.00 0.00 C ATOM 1000 CE2 TYR A 63 2.542 6.872 -10.873 1.00 0.00 C ATOM 1001 CZ TYR A 63 3.827 6.604 -10.448 1.00 0.00 C ATOM 1002 OH TYR A 63 4.870 7.385 -10.892 1.00 0.00 O ATOM 0 H TYR A 63 2.000 3.656 -6.938 1.00 0.00 H new ATOM 0 HA TYR A 63 -0.271 5.439 -7.545 1.00 0.00 H new ATOM 0 HB2 TYR A 63 0.845 3.124 -9.163 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -0.294 4.342 -9.702 1.00 0.00 H new ATOM 0 HD1 TYR A 63 3.217 3.963 -8.460 1.00 0.00 H new ATOM 0 HD2 TYR A 63 0.492 6.299 -10.757 1.00 0.00 H new ATOM 0 HE1 TYR A 63 5.078 5.356 -9.251 1.00 0.00 H new ATOM 0 HE2 TYR A 63 2.354 7.690 -11.552 1.00 0.00 H new ATOM 0 HH TYR A 63 4.527 8.075 -11.497 1.00 0.00 H new ATOM 1012 N THR A 64 -2.076 3.553 -7.640 1.00 0.00 N ATOM 1013 CA THR A 64 -3.150 2.636 -7.275 1.00 0.00 C ATOM 1014 C THR A 64 -2.917 1.257 -7.884 1.00 0.00 C ATOM 1015 O THR A 64 -1.986 1.061 -8.665 1.00 0.00 O ATOM 1016 CB THR A 64 -4.498 3.190 -7.736 1.00 0.00 C ATOM 1017 OG1 THR A 64 -4.547 3.281 -9.149 1.00 0.00 O ATOM 1018 CG2 THR A 64 -4.805 4.562 -7.176 1.00 0.00 C ATOM 0 H THR A 64 -2.351 4.286 -8.294 1.00 0.00 H new ATOM 0 HA THR A 64 -3.158 2.537 -6.190 1.00 0.00 H new ATOM 0 HB THR A 64 -5.242 2.488 -7.360 1.00 0.00 H new ATOM 0 HG1 THR A 64 -5.418 3.636 -9.424 1.00 0.00 H new ATOM 0 HG21 THR A 64 -5.776 4.896 -7.543 1.00 0.00 H new ATOM 0 HG22 THR A 64 -4.825 4.514 -6.087 1.00 0.00 H new ATOM 0 HG23 THR A 64 -4.035 5.265 -7.494 1.00 0.00 H new ATOM 1026 N ILE A 65 -3.771 0.305 -7.522 1.00 0.00 N ATOM 1027 CA ILE A 65 -3.660 -1.056 -8.033 1.00 0.00 C ATOM 1028 C ILE A 65 -3.853 -1.091 -9.546 1.00 0.00 C ATOM 1029 O ILE A 65 -3.178 -1.840 -10.251 1.00 0.00 O ATOM 1030 CB ILE A 65 -4.689 -1.991 -7.366 1.00 0.00 C ATOM 1031 CG1 ILE A 65 -4.479 -3.435 -7.829 1.00 0.00 C ATOM 1032 CG2 ILE A 65 -6.106 -1.531 -7.675 1.00 0.00 C ATOM 1033 CD1 ILE A 65 -3.268 -4.098 -7.207 1.00 0.00 C ATOM 0 H ILE A 65 -4.547 0.451 -6.877 1.00 0.00 H new ATOM 0 HA ILE A 65 -2.656 -1.407 -7.792 1.00 0.00 H new ATOM 0 HB ILE A 65 -4.543 -1.951 -6.287 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.367 -4.019 -7.587 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -4.374 -3.449 -8.914 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -6.819 -2.202 -7.196 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -6.251 -0.519 -7.297 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -6.265 -1.542 -8.753 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -3.180 -5.119 -7.580 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -2.371 -3.537 -7.470 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -3.380 -4.116 -6.123 1.00 0.00 H new ATOM 1045 N ASP A 66 -4.779 -0.274 -10.038 1.00 0.00 N ATOM 1046 CA ASP A 66 -5.061 -0.211 -11.467 1.00 0.00 C ATOM 1047 C ASP A 66 -4.041 0.666 -12.185 1.00 0.00 C ATOM 1048 O ASP A 66 -3.684 0.407 -13.334 1.00 0.00 O ATOM 1049 CB ASP A 66 -6.473 0.329 -11.705 1.00 0.00 C ATOM 1050 CG ASP A 66 -7.541 -0.720 -11.468 1.00 0.00 C ATOM 1051 OD1 ASP A 66 -7.694 -1.160 -10.309 1.00 0.00 O ATOM 1052 OD2 ASP A 66 -8.225 -1.102 -12.441 1.00 0.00 O ATOM 0 H ASP A 66 -5.346 0.353 -9.468 1.00 0.00 H new ATOM 0 HA ASP A 66 -4.992 -1.221 -11.871 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -6.650 1.179 -11.046 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -6.550 0.698 -12.728 1.00 0.00 H new ATOM 1057 N GLY A 67 -3.574 1.704 -11.499 1.00 0.00 N ATOM 1058 CA GLY A 67 -2.599 2.603 -12.087 1.00 0.00 C ATOM 1059 C GLY A 67 -3.246 3.766 -12.815 1.00 0.00 C ATOM 1060 O GLY A 67 -2.864 4.094 -13.938 1.00 0.00 O ATOM 0 H GLY A 67 -3.853 1.938 -10.546 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.945 2.987 -11.304 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.970 2.047 -12.783 1.00 0.00 H new ATOM 1064 N LEU A 68 -4.230 4.388 -12.174 1.00 0.00 N ATOM 1065 CA LEU A 68 -4.932 5.520 -12.766 1.00 0.00 C ATOM 1066 C LEU A 68 -4.437 6.837 -12.178 1.00 0.00 C ATOM 1067 O LEU A 68 -4.283 7.829 -12.891 1.00 0.00 O ATOM 1068 CB LEU A 68 -6.440 5.384 -12.547 1.00 0.00 C ATOM 1069 CG LEU A 68 -7.098 4.211 -13.275 1.00 0.00 C ATOM 1070 CD1 LEU A 68 -8.387 3.805 -12.578 1.00 0.00 C ATOM 1071 CD2 LEU A 68 -7.365 4.571 -14.728 1.00 0.00 C ATOM 0 H LEU A 68 -4.559 4.127 -11.245 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.726 5.522 -13.836 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -6.628 5.280 -11.478 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -6.923 6.307 -12.867 1.00 0.00 H new ATOM 0 HG LEU A 68 -6.415 3.362 -13.251 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -8.841 2.969 -13.110 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -8.168 3.506 -11.553 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -9.078 4.648 -12.570 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -7.833 3.726 -15.232 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -8.029 5.434 -14.773 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -6.424 4.812 -15.222 1.00 0.00 H new ATOM 1083 N LYS A 69 -4.188 6.839 -10.872 1.00 0.00 N ATOM 1084 CA LYS A 69 -3.709 8.034 -10.187 1.00 0.00 C ATOM 1085 C LYS A 69 -2.585 7.690 -9.214 1.00 0.00 C ATOM 1086 O LYS A 69 -2.361 6.522 -8.897 1.00 0.00 O ATOM 1087 CB LYS A 69 -4.860 8.715 -9.442 1.00 0.00 C ATOM 1088 CG LYS A 69 -5.190 10.102 -9.970 1.00 0.00 C ATOM 1089 CD LYS A 69 -4.541 11.192 -9.130 1.00 0.00 C ATOM 1090 CE LYS A 69 -5.578 12.008 -8.375 1.00 0.00 C ATOM 1091 NZ LYS A 69 -5.709 11.567 -6.959 1.00 0.00 N ATOM 0 H LYS A 69 -4.310 6.027 -10.267 1.00 0.00 H new ATOM 0 HA LYS A 69 -3.316 8.721 -10.936 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -5.749 8.088 -9.512 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -4.604 8.789 -8.385 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -4.852 10.188 -11.003 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -6.271 10.242 -9.976 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -3.846 10.741 -8.422 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -3.958 11.850 -9.774 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -5.301 13.062 -8.403 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -6.543 11.919 -8.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -6.426 12.148 -6.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.998 10.568 -6.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -4.795 11.676 -6.475 1.00 0.00 H new ATOM 1105 N LYS A 70 -1.880 8.716 -8.746 1.00 0.00 N ATOM 1106 CA LYS A 70 -0.779 8.523 -7.811 1.00 0.00 C ATOM 1107 C LYS A 70 -1.084 9.179 -6.468 1.00 0.00 C ATOM 1108 O LYS A 70 -1.446 10.354 -6.409 1.00 0.00 O ATOM 1109 CB LYS A 70 0.516 9.096 -8.389 1.00 0.00 C ATOM 1110 CG LYS A 70 0.427 10.576 -8.726 1.00 0.00 C ATOM 1111 CD LYS A 70 0.943 10.863 -10.128 1.00 0.00 C ATOM 1112 CE LYS A 70 2.447 11.085 -10.135 1.00 0.00 C ATOM 1113 NZ LYS A 70 2.836 12.219 -11.018 1.00 0.00 N ATOM 0 H LYS A 70 -2.052 9.689 -9.000 1.00 0.00 H new ATOM 0 HA LYS A 70 -0.655 7.452 -7.652 1.00 0.00 H new ATOM 0 HB2 LYS A 70 1.323 8.942 -7.673 1.00 0.00 H new ATOM 0 HB3 LYS A 70 0.779 8.542 -9.290 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -0.608 10.907 -8.644 1.00 0.00 H new ATOM 0 HG3 LYS A 70 1.004 11.150 -8.001 1.00 0.00 H new ATOM 0 HD2 LYS A 70 0.694 10.030 -10.786 1.00 0.00 H new ATOM 0 HD3 LYS A 70 0.442 11.745 -10.527 1.00 0.00 H new ATOM 0 HE2 LYS A 70 2.790 11.282 -9.119 1.00 0.00 H new ATOM 0 HE3 LYS A 70 2.947 10.176 -10.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 3.869 12.338 -10.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 2.532 12.021 -11.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 2.380 13.092 -10.684 1.00 0.00 H new ATOM 1127 N ILE A 71 -0.934 8.413 -5.393 1.00 0.00 N ATOM 1128 CA ILE A 71 -1.194 8.921 -4.051 1.00 0.00 C ATOM 1129 C ILE A 71 -0.076 9.851 -3.589 1.00 0.00 C ATOM 1130 O ILE A 71 1.090 9.461 -3.541 1.00 0.00 O ATOM 1131 CB ILE A 71 -1.341 7.773 -3.034 1.00 0.00 C ATOM 1132 CG1 ILE A 71 -2.308 6.713 -3.565 1.00 0.00 C ATOM 1133 CG2 ILE A 71 -1.820 8.310 -1.694 1.00 0.00 C ATOM 1134 CD1 ILE A 71 -3.708 7.235 -3.800 1.00 0.00 C ATOM 0 H ILE A 71 -0.634 7.439 -5.425 1.00 0.00 H new ATOM 0 HA ILE A 71 -2.130 9.477 -4.100 1.00 0.00 H new ATOM 0 HB ILE A 71 -0.365 7.309 -2.889 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -1.917 6.312 -4.500 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -2.352 5.886 -2.857 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -1.919 7.487 -0.986 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -1.098 9.032 -1.312 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -2.787 8.797 -1.822 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -4.338 6.429 -4.176 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -4.119 7.610 -2.862 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -3.677 8.043 -4.531 1.00 0.00 H new ATOM 1146 N SER A 72 -0.442 11.082 -3.249 1.00 0.00 N ATOM 1147 CA SER A 72 0.530 12.068 -2.788 1.00 0.00 C ATOM 1148 C SER A 72 0.108 12.671 -1.451 1.00 0.00 C ATOM 1149 O SER A 72 0.517 13.780 -1.105 1.00 0.00 O ATOM 1150 CB SER A 72 0.694 13.176 -3.829 1.00 0.00 C ATOM 1151 OG SER A 72 1.822 13.984 -3.542 1.00 0.00 O ATOM 0 H SER A 72 -1.403 11.421 -3.284 1.00 0.00 H new ATOM 0 HA SER A 72 1.485 11.561 -2.650 1.00 0.00 H new ATOM 0 HB2 SER A 72 0.802 12.735 -4.820 1.00 0.00 H new ATOM 0 HB3 SER A 72 -0.204 13.794 -3.851 1.00 0.00 H new ATOM 0 HG SER A 72 1.765 14.310 -2.620 1.00 0.00 H new ATOM 1157 N SER A 73 -0.709 11.936 -0.703 1.00 0.00 N ATOM 1158 CA SER A 73 -1.183 12.400 0.596 1.00 0.00 C ATOM 1159 C SER A 73 -1.795 11.252 1.392 1.00 0.00 C ATOM 1160 O SER A 73 -2.016 10.164 0.861 1.00 0.00 O ATOM 1161 CB SER A 73 -2.215 13.517 0.418 1.00 0.00 C ATOM 1162 OG SER A 73 -1.838 14.402 -0.624 1.00 0.00 O ATOM 0 H SER A 73 -1.057 11.016 -0.974 1.00 0.00 H new ATOM 0 HA SER A 73 -0.328 12.789 1.149 1.00 0.00 H new ATOM 0 HB2 SER A 73 -3.190 13.083 0.195 1.00 0.00 H new ATOM 0 HB3 SER A 73 -2.319 14.072 1.350 1.00 0.00 H new ATOM 0 HG SER A 73 -0.900 14.661 -0.510 1.00 0.00 H new ATOM 1168 N LEU A 74 -2.067 11.504 2.669 1.00 0.00 N ATOM 1169 CA LEU A 74 -2.655 10.491 3.537 1.00 0.00 C ATOM 1170 C LEU A 74 -4.173 10.465 3.393 1.00 0.00 C ATOM 1171 O LEU A 74 -4.804 9.419 3.548 1.00 0.00 O ATOM 1172 CB LEU A 74 -2.276 10.757 4.996 1.00 0.00 C ATOM 1173 CG LEU A 74 -0.775 10.728 5.291 1.00 0.00 C ATOM 1174 CD1 LEU A 74 -0.471 11.474 6.581 1.00 0.00 C ATOM 1175 CD2 LEU A 74 -0.275 9.294 5.371 1.00 0.00 C ATOM 0 H LEU A 74 -1.890 12.399 3.124 1.00 0.00 H new ATOM 0 HA LEU A 74 -2.262 9.520 3.237 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -2.669 11.732 5.286 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -2.769 10.015 5.624 1.00 0.00 H new ATOM 0 HG LEU A 74 -0.253 11.228 4.475 1.00 0.00 H new ATOM 0 HD11 LEU A 74 0.601 11.443 6.775 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -0.793 12.511 6.486 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -1.003 11.003 7.408 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.794 9.293 5.581 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -0.802 8.769 6.167 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.459 8.791 4.421 1.00 0.00 H new ATOM 1187 N ASP A 75 -4.754 11.623 3.093 1.00 0.00 N ATOM 1188 CA ASP A 75 -6.197 11.734 2.927 1.00 0.00 C ATOM 1189 C ASP A 75 -6.636 11.166 1.580 1.00 0.00 C ATOM 1190 O ASP A 75 -7.746 10.650 1.445 1.00 0.00 O ATOM 1191 CB ASP A 75 -6.634 13.196 3.043 1.00 0.00 C ATOM 1192 CG ASP A 75 -6.280 13.799 4.389 1.00 0.00 C ATOM 1193 OD1 ASP A 75 -6.850 13.355 5.407 1.00 0.00 O ATOM 1194 OD2 ASP A 75 -5.433 14.716 4.424 1.00 0.00 O ATOM 0 H ASP A 75 -4.246 12.497 2.960 1.00 0.00 H new ATOM 0 HA ASP A 75 -6.674 11.155 3.718 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -6.162 13.778 2.252 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -7.711 13.264 2.889 1.00 0.00 H new ATOM 1199 N GLN A 76 -5.759 11.265 0.587 1.00 0.00 N ATOM 1200 CA GLN A 76 -6.057 10.762 -0.750 1.00 0.00 C ATOM 1201 C GLN A 76 -6.358 9.267 -0.715 1.00 0.00 C ATOM 1202 O GLN A 76 -7.146 8.763 -1.514 1.00 0.00 O ATOM 1203 CB GLN A 76 -4.884 11.035 -1.694 1.00 0.00 C ATOM 1204 CG GLN A 76 -4.546 12.511 -1.832 1.00 0.00 C ATOM 1205 CD GLN A 76 -5.054 13.105 -3.131 1.00 0.00 C ATOM 1206 OE1 GLN A 76 -6.206 13.528 -3.227 1.00 0.00 O ATOM 1207 NE2 GLN A 76 -4.192 13.141 -4.142 1.00 0.00 N ATOM 0 H GLN A 76 -4.836 11.689 0.682 1.00 0.00 H new ATOM 0 HA GLN A 76 -6.940 11.284 -1.118 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -4.005 10.502 -1.332 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -5.119 10.631 -2.679 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -4.976 13.059 -0.993 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -3.465 12.639 -1.776 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -3.246 12.779 -4.019 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -4.476 13.530 -5.041 1.00 0.00 H new ATOM 1216 N LEU A 77 -5.726 8.563 0.219 1.00 0.00 N ATOM 1217 CA LEU A 77 -5.927 7.125 0.358 1.00 0.00 C ATOM 1218 C LEU A 77 -7.368 6.813 0.747 1.00 0.00 C ATOM 1219 O LEU A 77 -8.171 7.719 0.971 1.00 0.00 O ATOM 1220 CB LEU A 77 -4.969 6.555 1.407 1.00 0.00 C ATOM 1221 CG LEU A 77 -3.484 6.781 1.118 1.00 0.00 C ATOM 1222 CD1 LEU A 77 -2.709 6.957 2.415 1.00 0.00 C ATOM 1223 CD2 LEU A 77 -2.917 5.626 0.308 1.00 0.00 C ATOM 0 H LEU A 77 -5.071 8.964 0.890 1.00 0.00 H new ATOM 0 HA LEU A 77 -5.720 6.659 -0.605 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -5.207 6.999 2.374 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -5.147 5.483 1.496 1.00 0.00 H new ATOM 0 HG LEU A 77 -3.382 7.694 0.531 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.655 7.117 2.190 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -3.099 7.818 2.958 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.818 6.062 3.028 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.860 5.804 0.112 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.031 4.698 0.868 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -3.453 5.547 -0.638 1.00 0.00 H new ATOM 1235 N VAL A 78 -7.689 5.526 0.824 1.00 0.00 N ATOM 1236 CA VAL A 78 -9.035 5.095 1.186 1.00 0.00 C ATOM 1237 C VAL A 78 -8.994 3.869 2.092 1.00 0.00 C ATOM 1238 O VAL A 78 -8.088 3.042 1.994 1.00 0.00 O ATOM 1239 CB VAL A 78 -9.875 4.768 -0.063 1.00 0.00 C ATOM 1240 CG1 VAL A 78 -11.325 4.517 0.319 1.00 0.00 C ATOM 1241 CG2 VAL A 78 -9.771 5.890 -1.085 1.00 0.00 C ATOM 0 H VAL A 78 -7.037 4.764 0.641 1.00 0.00 H new ATOM 0 HA VAL A 78 -9.500 5.924 1.720 1.00 0.00 H new ATOM 0 HB VAL A 78 -9.481 3.858 -0.516 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -11.903 4.288 -0.576 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -11.379 3.676 1.011 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -11.735 5.407 0.797 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -10.371 5.641 -1.961 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -10.138 6.818 -0.645 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -8.730 6.016 -1.382 1.00 0.00 H new ATOM 1251 N GLU A 79 -9.983 3.759 2.974 1.00 0.00 N ATOM 1252 CA GLU A 79 -10.060 2.635 3.898 1.00 0.00 C ATOM 1253 C GLU A 79 -10.231 1.320 3.143 1.00 0.00 C ATOM 1254 O GLU A 79 -11.193 1.143 2.396 1.00 0.00 O ATOM 1255 CB GLU A 79 -11.221 2.828 4.875 1.00 0.00 C ATOM 1256 CG GLU A 79 -11.073 2.034 6.163 1.00 0.00 C ATOM 1257 CD GLU A 79 -12.311 1.224 6.496 1.00 0.00 C ATOM 1258 OE1 GLU A 79 -13.430 1.727 6.261 1.00 0.00 O ATOM 1259 OE2 GLU A 79 -12.162 0.088 6.992 1.00 0.00 O ATOM 0 H GLU A 79 -10.741 4.435 3.067 1.00 0.00 H new ATOM 0 HA GLU A 79 -9.126 2.594 4.458 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -11.307 3.887 5.119 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -12.150 2.538 4.384 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -10.218 1.364 6.076 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -10.859 2.718 6.984 1.00 0.00 H new ATOM 1266 N GLY A 80 -9.292 0.402 3.344 1.00 0.00 N ATOM 1267 CA GLY A 80 -9.358 -0.884 2.675 1.00 0.00 C ATOM 1268 C GLY A 80 -9.117 -0.775 1.183 1.00 0.00 C ATOM 1269 O GLY A 80 -10.042 -0.929 0.385 1.00 0.00 O ATOM 0 H GLY A 80 -8.487 0.525 3.958 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -8.618 -1.555 3.111 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -10.337 -1.331 2.850 1.00 0.00 H new ATOM 1273 N GLU A 81 -7.872 -0.507 0.805 1.00 0.00 N ATOM 1274 CA GLU A 81 -7.510 -0.377 -0.603 1.00 0.00 C ATOM 1275 C GLU A 81 -6.128 -0.963 -0.866 1.00 0.00 C ATOM 1276 O GLU A 81 -5.428 -1.370 0.061 1.00 0.00 O ATOM 1277 CB GLU A 81 -7.544 1.093 -1.025 1.00 0.00 C ATOM 1278 CG GLU A 81 -8.900 1.549 -1.539 1.00 0.00 C ATOM 1279 CD GLU A 81 -9.406 0.695 -2.685 1.00 0.00 C ATOM 1280 OE1 GLU A 81 -8.657 0.519 -3.669 1.00 0.00 O ATOM 1281 OE2 GLU A 81 -10.551 0.204 -2.598 1.00 0.00 O ATOM 0 H GLU A 81 -7.096 -0.375 1.454 1.00 0.00 H new ATOM 0 HA GLU A 81 -8.238 -0.934 -1.193 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -7.260 1.713 -0.174 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -6.797 1.256 -1.802 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -9.622 1.520 -0.723 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -8.830 2.586 -1.867 1.00 0.00 H new ATOM 1288 N SER A 82 -5.740 -1.003 -2.136 1.00 0.00 N ATOM 1289 CA SER A 82 -4.440 -1.538 -2.523 1.00 0.00 C ATOM 1290 C SER A 82 -3.693 -0.559 -3.422 1.00 0.00 C ATOM 1291 O SER A 82 -4.262 -0.009 -4.365 1.00 0.00 O ATOM 1292 CB SER A 82 -4.610 -2.879 -3.239 1.00 0.00 C ATOM 1293 OG SER A 82 -4.769 -3.938 -2.311 1.00 0.00 O ATOM 0 H SER A 82 -6.308 -0.671 -2.916 1.00 0.00 H new ATOM 0 HA SER A 82 -3.853 -1.689 -1.617 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.478 -2.835 -3.897 1.00 0.00 H new ATOM 0 HB3 SER A 82 -3.741 -3.071 -3.869 1.00 0.00 H new ATOM 0 HG SER A 82 -4.877 -4.783 -2.795 1.00 0.00 H new ATOM 1299 N TYR A 83 -2.416 -0.346 -3.124 1.00 0.00 N ATOM 1300 CA TYR A 83 -1.591 0.569 -3.906 1.00 0.00 C ATOM 1301 C TYR A 83 -0.223 -0.041 -4.189 1.00 0.00 C ATOM 1302 O TYR A 83 0.298 -0.821 -3.391 1.00 0.00 O ATOM 1303 CB TYR A 83 -1.427 1.898 -3.169 1.00 0.00 C ATOM 1304 CG TYR A 83 -2.738 2.512 -2.727 1.00 0.00 C ATOM 1305 CD1 TYR A 83 -3.364 2.095 -1.559 1.00 0.00 C ATOM 1306 CD2 TYR A 83 -3.348 3.509 -3.479 1.00 0.00 C ATOM 1307 CE1 TYR A 83 -4.561 2.653 -1.152 1.00 0.00 C ATOM 1308 CE2 TYR A 83 -4.544 4.072 -3.078 1.00 0.00 C ATOM 1309 CZ TYR A 83 -5.147 3.641 -1.915 1.00 0.00 C ATOM 1310 OH TYR A 83 -6.338 4.200 -1.514 1.00 0.00 O ATOM 0 H TYR A 83 -1.930 -0.794 -2.347 1.00 0.00 H new ATOM 0 HA TYR A 83 -2.093 0.749 -4.857 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -0.795 1.743 -2.295 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -0.906 2.602 -3.818 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -2.908 1.322 -0.959 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -2.880 3.849 -4.391 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -5.035 2.317 -0.241 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -5.005 4.847 -3.673 1.00 0.00 H new ATOM 0 HH TYR A 83 -6.614 4.881 -2.162 1.00 0.00 H new ATOM 1320 N VAL A 84 0.356 0.319 -5.330 1.00 0.00 N ATOM 1321 CA VAL A 84 1.664 -0.193 -5.718 1.00 0.00 C ATOM 1322 C VAL A 84 2.756 0.841 -5.459 1.00 0.00 C ATOM 1323 O VAL A 84 2.649 1.991 -5.885 1.00 0.00 O ATOM 1324 CB VAL A 84 1.694 -0.594 -7.205 1.00 0.00 C ATOM 1325 CG1 VAL A 84 3.013 -1.267 -7.553 1.00 0.00 C ATOM 1326 CG2 VAL A 84 0.520 -1.503 -7.539 1.00 0.00 C ATOM 0 H VAL A 84 -0.061 0.964 -6.002 1.00 0.00 H new ATOM 0 HA VAL A 84 1.851 -1.077 -5.109 1.00 0.00 H new ATOM 0 HB VAL A 84 1.605 0.311 -7.806 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.014 -1.542 -8.608 1.00 0.00 H new ATOM 0 HG12 VAL A 84 3.835 -0.579 -7.357 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.136 -2.163 -6.944 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.559 -1.775 -8.594 1.00 0.00 H new ATOM 0 HG22 VAL A 84 0.573 -2.405 -6.929 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -0.414 -0.981 -7.333 1.00 0.00 H new ATOM 1336 N CYS A 85 3.804 0.424 -4.757 1.00 0.00 N ATOM 1337 CA CYS A 85 4.915 1.313 -4.439 1.00 0.00 C ATOM 1338 C CYS A 85 5.839 1.480 -5.642 1.00 0.00 C ATOM 1339 O CYS A 85 6.233 0.501 -6.276 1.00 0.00 O ATOM 1340 CB CYS A 85 5.704 0.771 -3.247 1.00 0.00 C ATOM 1341 SG CYS A 85 5.128 1.378 -1.643 1.00 0.00 S ATOM 0 H CYS A 85 3.907 -0.525 -4.397 1.00 0.00 H new ATOM 0 HA CYS A 85 4.504 2.289 -4.180 1.00 0.00 H new ATOM 0 HB2 CYS A 85 5.648 -0.318 -3.253 1.00 0.00 H new ATOM 0 HB3 CYS A 85 6.754 1.037 -3.369 1.00 0.00 H new ATOM 0 HG CYS A 85 3.830 1.319 -1.597 1.00 0.00 H new ATOM 1347 N GLY A 86 6.181 2.727 -5.950 1.00 0.00 N ATOM 1348 CA GLY A 86 7.057 3.000 -7.075 1.00 0.00 C ATOM 1349 C GLY A 86 8.063 4.093 -6.774 1.00 0.00 C ATOM 1350 O GLY A 86 7.867 4.891 -5.857 1.00 0.00 O ATOM 0 H GLY A 86 5.867 3.553 -5.441 1.00 0.00 H new ATOM 0 HA2 GLY A 86 7.587 2.088 -7.349 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.457 3.290 -7.937 1.00 0.00 H new ATOM 1354 N SER A 87 9.143 4.131 -7.547 1.00 0.00 N ATOM 1355 CA SER A 87 10.184 5.135 -7.358 1.00 0.00 C ATOM 1356 C SER A 87 10.404 5.942 -8.635 1.00 0.00 C ATOM 1357 O SER A 87 9.914 7.063 -8.764 1.00 0.00 O ATOM 1358 CB SER A 87 11.492 4.469 -6.926 1.00 0.00 C ATOM 1359 OG SER A 87 12.566 5.394 -6.941 1.00 0.00 O ATOM 0 H SER A 87 9.320 3.478 -8.310 1.00 0.00 H new ATOM 0 HA SER A 87 9.857 5.818 -6.574 1.00 0.00 H new ATOM 0 HB2 SER A 87 11.379 4.055 -5.924 1.00 0.00 H new ATOM 0 HB3 SER A 87 11.716 3.636 -7.592 1.00 0.00 H new ATOM 0 HG SER A 87 12.872 5.555 -6.024 1.00 0.00 H new ATOM 1365 N ILE A 88 11.145 5.364 -9.576 1.00 0.00 N ATOM 1366 CA ILE A 88 11.429 6.033 -10.842 1.00 0.00 C ATOM 1367 C ILE A 88 10.901 5.226 -12.026 1.00 0.00 C ATOM 1368 O ILE A 88 10.447 5.792 -13.020 1.00 0.00 O ATOM 1369 CB ILE A 88 12.940 6.267 -11.027 1.00 0.00 C ATOM 1370 CG1 ILE A 88 13.716 4.972 -10.777 1.00 0.00 C ATOM 1371 CG2 ILE A 88 13.424 7.368 -10.096 1.00 0.00 C ATOM 1372 CD1 ILE A 88 15.137 5.009 -11.295 1.00 0.00 C ATOM 0 H ILE A 88 11.559 4.436 -9.486 1.00 0.00 H new ATOM 0 HA ILE A 88 10.920 6.996 -10.809 1.00 0.00 H new ATOM 0 HB ILE A 88 13.119 6.582 -12.055 1.00 0.00 H new ATOM 0 HG12 ILE A 88 13.733 4.769 -9.706 1.00 0.00 H new ATOM 0 HG13 ILE A 88 13.187 4.144 -11.249 1.00 0.00 H new ATOM 0 HG21 ILE A 88 14.494 7.521 -10.239 1.00 0.00 H new ATOM 0 HG22 ILE A 88 12.892 8.293 -10.319 1.00 0.00 H new ATOM 0 HG23 ILE A 88 13.234 7.080 -9.062 1.00 0.00 H new ATOM 0 HD11 ILE A 88 15.626 4.058 -11.083 1.00 0.00 H new ATOM 0 HD12 ILE A 88 15.128 5.180 -12.371 1.00 0.00 H new ATOM 0 HD13 ILE A 88 15.682 5.815 -10.804 1.00 0.00 H new ATOM 1384 N GLU A 89 10.966 3.903 -11.913 1.00 0.00 N ATOM 1385 CA GLU A 89 10.495 3.022 -12.976 1.00 0.00 C ATOM 1386 C GLU A 89 9.008 3.235 -13.245 1.00 0.00 C ATOM 1387 O GLU A 89 8.262 3.655 -12.360 1.00 0.00 O ATOM 1388 CB GLU A 89 10.754 1.561 -12.605 1.00 0.00 C ATOM 1389 CG GLU A 89 10.266 1.191 -11.214 1.00 0.00 C ATOM 1390 CD GLU A 89 11.402 1.030 -10.222 1.00 0.00 C ATOM 1391 OE1 GLU A 89 12.047 2.045 -9.888 1.00 0.00 O ATOM 1392 OE2 GLU A 89 11.645 -0.112 -9.779 1.00 0.00 O ATOM 0 H GLU A 89 11.340 3.418 -11.097 1.00 0.00 H new ATOM 0 HA GLU A 89 11.046 3.264 -13.885 1.00 0.00 H new ATOM 0 HB2 GLU A 89 10.265 0.917 -13.336 1.00 0.00 H new ATOM 0 HB3 GLU A 89 11.824 1.362 -12.671 1.00 0.00 H new ATOM 0 HG2 GLU A 89 9.582 1.961 -10.856 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.700 0.261 -11.267 1.00 0.00 H new ATOM 1399 N PRO A 90 8.555 2.947 -14.478 1.00 0.00 N ATOM 1400 CA PRO A 90 7.148 3.110 -14.860 1.00 0.00 C ATOM 1401 C PRO A 90 6.242 2.088 -14.179 1.00 0.00 C ATOM 1402 O PRO A 90 6.712 1.080 -13.652 1.00 0.00 O ATOM 1403 CB PRO A 90 7.162 2.887 -16.374 1.00 0.00 C ATOM 1404 CG PRO A 90 8.357 2.032 -16.620 1.00 0.00 C ATOM 1405 CD PRO A 90 9.377 2.441 -15.593 1.00 0.00 C ATOM 0 HA PRO A 90 6.755 4.082 -14.563 1.00 0.00 H new ATOM 0 HB2 PRO A 90 6.248 2.397 -16.710 1.00 0.00 H new ATOM 0 HB3 PRO A 90 7.234 3.832 -16.913 1.00 0.00 H new ATOM 0 HG2 PRO A 90 8.108 0.975 -16.523 1.00 0.00 H new ATOM 0 HG3 PRO A 90 8.740 2.178 -17.630 1.00 0.00 H new ATOM 0 HD2 PRO A 90 9.997 1.599 -15.285 1.00 0.00 H new ATOM 0 HD3 PRO A 90 10.049 3.208 -15.977 1.00 0.00 H new ATOM 1413 N PHE A 91 4.940 2.356 -14.195 1.00 0.00 N ATOM 1414 CA PHE A 91 3.968 1.461 -13.580 1.00 0.00 C ATOM 1415 C PHE A 91 3.925 0.121 -14.308 1.00 0.00 C ATOM 1416 O PHE A 91 3.918 0.071 -15.538 1.00 0.00 O ATOM 1417 CB PHE A 91 2.579 2.101 -13.584 1.00 0.00 C ATOM 1418 CG PHE A 91 1.554 1.316 -12.816 1.00 0.00 C ATOM 1419 CD1 PHE A 91 1.004 0.161 -13.348 1.00 0.00 C ATOM 1420 CD2 PHE A 91 1.140 1.734 -11.561 1.00 0.00 C ATOM 1421 CE1 PHE A 91 0.061 -0.563 -12.643 1.00 0.00 C ATOM 1422 CE2 PHE A 91 0.198 1.015 -10.852 1.00 0.00 C ATOM 1423 CZ PHE A 91 -0.343 -0.135 -11.394 1.00 0.00 C ATOM 0 H PHE A 91 4.534 3.186 -14.627 1.00 0.00 H new ATOM 0 HA PHE A 91 4.276 1.285 -12.549 1.00 0.00 H new ATOM 0 HB2 PHE A 91 2.649 3.103 -13.161 1.00 0.00 H new ATOM 0 HB3 PHE A 91 2.242 2.212 -14.615 1.00 0.00 H new ATOM 0 HD1 PHE A 91 1.316 -0.178 -14.325 1.00 0.00 H new ATOM 0 HD2 PHE A 91 1.559 2.632 -11.133 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -0.359 -1.462 -13.069 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -0.116 1.351 -9.875 1.00 0.00 H new ATOM 0 HZ PHE A 91 -1.081 -0.698 -10.842 1.00 0.00 H new ATOM 1433 N LYS A 92 3.896 -0.964 -13.540 1.00 0.00 N ATOM 1434 CA LYS A 92 3.854 -2.306 -14.112 1.00 0.00 C ATOM 1435 C LYS A 92 2.629 -3.069 -13.620 1.00 0.00 C ATOM 1436 O LYS A 92 2.434 -3.241 -12.417 1.00 0.00 O ATOM 1437 CB LYS A 92 5.126 -3.075 -13.753 1.00 0.00 C ATOM 1438 CG LYS A 92 6.402 -2.389 -14.215 1.00 0.00 C ATOM 1439 CD LYS A 92 7.633 -3.027 -13.594 1.00 0.00 C ATOM 1440 CE LYS A 92 8.913 -2.390 -14.114 1.00 0.00 C ATOM 1441 NZ LYS A 92 9.962 -2.312 -13.060 1.00 0.00 N ATOM 0 H LYS A 92 3.901 -0.940 -12.520 1.00 0.00 H new ATOM 0 HA LYS A 92 3.789 -2.210 -15.196 1.00 0.00 H new ATOM 0 HB2 LYS A 92 5.166 -3.210 -12.672 1.00 0.00 H new ATOM 0 HB3 LYS A 92 5.077 -4.070 -14.196 1.00 0.00 H new ATOM 0 HG2 LYS A 92 6.472 -2.442 -15.301 1.00 0.00 H new ATOM 0 HG3 LYS A 92 6.365 -1.333 -13.949 1.00 0.00 H new ATOM 0 HD2 LYS A 92 7.589 -2.925 -12.510 1.00 0.00 H new ATOM 0 HD3 LYS A 92 7.641 -4.095 -13.814 1.00 0.00 H new ATOM 0 HE2 LYS A 92 9.289 -2.968 -14.958 1.00 0.00 H new ATOM 0 HE3 LYS A 92 8.695 -1.388 -14.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 10.818 -1.872 -13.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 9.613 -1.740 -12.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 10.188 -3.270 -12.724 1.00 0.00 H new ATOM 1455 N LYS A 93 1.805 -3.524 -14.558 1.00 0.00 N ATOM 1456 CA LYS A 93 0.598 -4.271 -14.220 1.00 0.00 C ATOM 1457 C LYS A 93 0.919 -5.741 -13.969 1.00 0.00 C ATOM 1458 O LYS A 93 1.239 -6.484 -14.897 1.00 0.00 O ATOM 1459 CB LYS A 93 -0.438 -4.142 -15.340 1.00 0.00 C ATOM 1460 CG LYS A 93 -1.716 -3.439 -14.908 1.00 0.00 C ATOM 1461 CD LYS A 93 -2.950 -4.279 -15.205 1.00 0.00 C ATOM 1462 CE LYS A 93 -4.021 -3.466 -15.916 1.00 0.00 C ATOM 1463 NZ LYS A 93 -5.379 -4.039 -15.711 1.00 0.00 N ATOM 0 H LYS A 93 1.951 -3.389 -15.558 1.00 0.00 H new ATOM 0 HA LYS A 93 0.184 -3.850 -13.304 1.00 0.00 H new ATOM 0 HB2 LYS A 93 0.005 -3.594 -16.172 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -0.687 -5.137 -15.710 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.670 -3.225 -13.840 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.796 -2.481 -15.422 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.670 -5.133 -15.822 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -3.353 -4.677 -14.274 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -4.001 -2.440 -15.550 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -3.800 -3.428 -16.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -6.081 -3.457 -16.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -5.406 -5.010 -16.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -5.601 -4.052 -14.695 1.00 0.00 H new ATOM 1477 N LEU A 94 0.832 -6.154 -12.709 1.00 0.00 N ATOM 1478 CA LEU A 94 1.113 -7.536 -12.336 1.00 0.00 C ATOM 1479 C LEU A 94 -0.014 -8.109 -11.484 1.00 0.00 C ATOM 1480 O LEU A 94 -0.743 -7.369 -10.822 1.00 0.00 O ATOM 1481 CB LEU A 94 2.437 -7.621 -11.573 1.00 0.00 C ATOM 1482 CG LEU A 94 3.634 -6.984 -12.283 1.00 0.00 C ATOM 1483 CD1 LEU A 94 4.849 -6.969 -11.368 1.00 0.00 C ATOM 1484 CD2 LEU A 94 3.945 -7.729 -13.572 1.00 0.00 C ATOM 0 H LEU A 94 0.569 -5.552 -11.929 1.00 0.00 H new ATOM 0 HA LEU A 94 1.189 -8.124 -13.250 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.311 -7.141 -10.603 1.00 0.00 H new ATOM 0 HB3 LEU A 94 2.663 -8.670 -11.383 1.00 0.00 H new ATOM 0 HG LEU A 94 3.380 -5.954 -12.533 1.00 0.00 H new ATOM 0 HD11 LEU A 94 5.691 -6.513 -11.889 1.00 0.00 H new ATOM 0 HD12 LEU A 94 4.622 -6.393 -10.471 1.00 0.00 H new ATOM 0 HD13 LEU A 94 5.106 -7.991 -11.088 1.00 0.00 H new ATOM 0 HD21 LEU A 94 4.799 -7.263 -14.065 1.00 0.00 H new ATOM 0 HD22 LEU A 94 4.180 -8.768 -13.344 1.00 0.00 H new ATOM 0 HD23 LEU A 94 3.079 -7.690 -14.233 1.00 0.00 H new ATOM 1496 N GLU A 95 -0.154 -9.431 -11.504 1.00 0.00 N ATOM 1497 CA GLU A 95 -1.194 -10.101 -10.732 1.00 0.00 C ATOM 1498 C GLU A 95 -0.848 -10.114 -9.247 1.00 0.00 C ATOM 1499 O GLU A 95 -0.196 -11.037 -8.758 1.00 0.00 O ATOM 1500 CB GLU A 95 -1.389 -11.533 -11.234 1.00 0.00 C ATOM 1501 CG GLU A 95 -0.093 -12.321 -11.344 1.00 0.00 C ATOM 1502 CD GLU A 95 0.445 -12.362 -12.761 1.00 0.00 C ATOM 1503 OE1 GLU A 95 -0.365 -12.502 -13.701 1.00 0.00 O ATOM 1504 OE2 GLU A 95 1.678 -12.256 -12.931 1.00 0.00 O ATOM 0 H GLU A 95 0.440 -10.059 -12.046 1.00 0.00 H new ATOM 0 HA GLU A 95 -2.123 -9.547 -10.865 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -2.067 -12.056 -10.560 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -1.871 -11.504 -12.211 1.00 0.00 H new ATOM 0 HG2 GLU A 95 0.655 -11.876 -10.688 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -0.260 -13.339 -10.993 1.00 0.00 H new ATOM 1511 N TYR A 96 -1.290 -9.084 -8.533 1.00 0.00 N ATOM 1512 CA TYR A 96 -1.029 -8.976 -7.102 1.00 0.00 C ATOM 1513 C TYR A 96 -2.138 -9.644 -6.296 1.00 0.00 C ATOM 1514 O TYR A 96 -1.876 -10.493 -5.445 1.00 0.00 O ATOM 1515 CB TYR A 96 -0.902 -7.507 -6.695 1.00 0.00 C ATOM 1516 CG TYR A 96 0.169 -6.758 -7.455 1.00 0.00 C ATOM 1517 CD1 TYR A 96 1.511 -6.913 -7.135 1.00 0.00 C ATOM 1518 CD2 TYR A 96 -0.163 -5.895 -8.491 1.00 0.00 C ATOM 1519 CE1 TYR A 96 2.493 -6.229 -7.826 1.00 0.00 C ATOM 1520 CE2 TYR A 96 0.813 -5.208 -9.188 1.00 0.00 C ATOM 1521 CZ TYR A 96 2.139 -5.379 -8.851 1.00 0.00 C ATOM 1522 OH TYR A 96 3.113 -4.695 -9.542 1.00 0.00 O ATOM 0 H TYR A 96 -1.831 -8.312 -8.922 1.00 0.00 H new ATOM 0 HA TYR A 96 -0.090 -9.487 -6.889 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -1.860 -7.011 -6.851 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -0.685 -7.452 -5.628 1.00 0.00 H new ATOM 0 HD1 TYR A 96 1.792 -7.579 -6.333 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -1.201 -5.758 -8.756 1.00 0.00 H new ATOM 0 HE1 TYR A 96 3.533 -6.360 -7.564 1.00 0.00 H new ATOM 0 HE2 TYR A 96 0.539 -4.541 -9.992 1.00 0.00 H new ATOM 0 HH TYR A 96 2.729 -4.319 -10.361 1.00 0.00 H new ATOM 1532 N THR A 97 -3.378 -9.250 -6.568 1.00 0.00 N ATOM 1533 CA THR A 97 -4.530 -9.806 -5.868 1.00 0.00 C ATOM 1534 C THR A 97 -4.693 -11.294 -6.168 1.00 0.00 C ATOM 1535 O THR A 97 -5.276 -12.034 -5.376 1.00 0.00 O ATOM 1536 CB THR A 97 -5.801 -9.053 -6.262 1.00 0.00 C ATOM 1537 OG1 THR A 97 -5.905 -8.946 -7.671 1.00 0.00 O ATOM 1538 CG2 THR A 97 -5.871 -7.655 -5.689 1.00 0.00 C ATOM 0 H THR A 97 -3.611 -8.547 -7.269 1.00 0.00 H new ATOM 0 HA THR A 97 -4.360 -9.690 -4.797 1.00 0.00 H new ATOM 0 HB THR A 97 -6.622 -9.639 -5.849 1.00 0.00 H new ATOM 0 HG1 THR A 97 -6.725 -8.463 -7.903 1.00 0.00 H new ATOM 0 HG21 THR A 97 -6.798 -7.177 -6.007 1.00 0.00 H new ATOM 0 HG22 THR A 97 -5.845 -7.706 -4.601 1.00 0.00 H new ATOM 0 HG23 THR A 97 -5.021 -7.073 -6.046 1.00 0.00 H new ATOM 1546 N LYS A 98 -4.177 -11.727 -7.316 1.00 0.00 N ATOM 1547 CA LYS A 98 -4.271 -13.129 -7.714 1.00 0.00 C ATOM 1548 C LYS A 98 -3.703 -14.046 -6.636 1.00 0.00 C ATOM 1549 O LYS A 98 -4.138 -15.188 -6.487 1.00 0.00 O ATOM 1550 CB LYS A 98 -3.532 -13.357 -9.033 1.00 0.00 C ATOM 1551 CG LYS A 98 -3.785 -14.727 -9.641 1.00 0.00 C ATOM 1552 CD LYS A 98 -2.642 -15.686 -9.351 1.00 0.00 C ATOM 1553 CE LYS A 98 -3.069 -17.132 -9.536 1.00 0.00 C ATOM 1554 NZ LYS A 98 -1.900 -18.048 -9.647 1.00 0.00 N ATOM 0 H LYS A 98 -3.691 -11.129 -7.985 1.00 0.00 H new ATOM 0 HA LYS A 98 -5.326 -13.369 -7.848 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -3.834 -12.590 -9.747 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -2.462 -13.234 -8.867 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -4.714 -15.136 -9.244 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -3.915 -14.629 -10.719 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -1.804 -15.465 -10.012 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -2.291 -15.537 -8.330 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -3.690 -17.437 -8.694 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -3.683 -17.217 -10.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -2.235 -19.025 -9.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -1.320 -17.773 -10.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -1.327 -17.987 -8.781 1.00 0.00 H new ATOM 1568 N ASN A 99 -2.727 -13.542 -5.887 1.00 0.00 N ATOM 1569 CA ASN A 99 -2.101 -14.319 -4.823 1.00 0.00 C ATOM 1570 C ASN A 99 -2.333 -13.669 -3.463 1.00 0.00 C ATOM 1571 O ASN A 99 -1.512 -13.797 -2.555 1.00 0.00 O ATOM 1572 CB ASN A 99 -0.600 -14.461 -5.083 1.00 0.00 C ATOM 1573 CG ASN A 99 0.109 -13.122 -5.120 1.00 0.00 C ATOM 1574 OD1 ASN A 99 0.765 -12.726 -4.156 1.00 0.00 O ATOM 1575 ND2 ASN A 99 -0.020 -12.414 -6.237 1.00 0.00 N ATOM 0 H ASN A 99 -2.353 -12.600 -5.997 1.00 0.00 H new ATOM 0 HA ASN A 99 -2.558 -15.309 -4.814 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -0.156 -15.083 -4.305 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -0.445 -14.977 -6.030 1.00 0.00 H new ATOM 0 HD21 ASN A 99 0.434 -11.504 -6.320 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -0.573 -12.780 -7.012 1.00 0.00 H new ATOM 1582 N VAL A 100 -3.458 -12.974 -3.327 1.00 0.00 N ATOM 1583 CA VAL A 100 -3.797 -12.305 -2.076 1.00 0.00 C ATOM 1584 C VAL A 100 -5.308 -12.246 -1.877 1.00 0.00 C ATOM 1585 O VAL A 100 -6.054 -11.923 -2.801 1.00 0.00 O ATOM 1586 CB VAL A 100 -3.227 -10.875 -2.030 1.00 0.00 C ATOM 1587 CG1 VAL A 100 -3.458 -10.249 -0.662 1.00 0.00 C ATOM 1588 CG2 VAL A 100 -1.746 -10.880 -2.378 1.00 0.00 C ATOM 0 H VAL A 100 -4.150 -12.859 -4.067 1.00 0.00 H new ATOM 0 HA VAL A 100 -3.350 -12.891 -1.273 1.00 0.00 H new ATOM 0 HB VAL A 100 -3.750 -10.272 -2.772 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -3.048 -9.239 -0.650 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -4.528 -10.209 -0.456 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -2.964 -10.850 0.101 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -1.360 -9.861 -2.341 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -1.206 -11.499 -1.662 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -1.609 -11.283 -3.381 1.00 0.00 H new ATOM 1598 N ASN A 101 -5.752 -12.561 -0.665 1.00 0.00 N ATOM 1599 CA ASN A 101 -7.173 -12.544 -0.344 1.00 0.00 C ATOM 1600 C ASN A 101 -7.573 -11.212 0.287 1.00 0.00 C ATOM 1601 O ASN A 101 -6.787 -10.598 1.009 1.00 0.00 O ATOM 1602 CB ASN A 101 -7.517 -13.696 0.603 1.00 0.00 C ATOM 1603 CG ASN A 101 -8.762 -14.446 0.172 1.00 0.00 C ATOM 1604 OD1 ASN A 101 -8.898 -14.833 -0.988 1.00 0.00 O ATOM 1605 ND2 ASN A 101 -9.681 -14.655 1.109 1.00 0.00 N ATOM 0 H ASN A 101 -5.148 -12.831 0.111 1.00 0.00 H new ATOM 0 HA ASN A 101 -7.732 -12.667 -1.272 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -6.677 -14.389 0.649 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -7.662 -13.304 1.610 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -10.540 -15.154 0.878 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -9.527 -14.317 2.059 1.00 0.00 H new ATOM 1612 N PRO A 102 -8.805 -10.745 0.022 1.00 0.00 N ATOM 1613 CA PRO A 102 -9.305 -9.480 0.565 1.00 0.00 C ATOM 1614 C PRO A 102 -9.744 -9.597 2.025 1.00 0.00 C ATOM 1615 O PRO A 102 -10.188 -8.619 2.626 1.00 0.00 O ATOM 1616 CB PRO A 102 -10.505 -9.173 -0.328 1.00 0.00 C ATOM 1617 CG PRO A 102 -11.013 -10.512 -0.742 1.00 0.00 C ATOM 1618 CD PRO A 102 -9.808 -11.413 -0.832 1.00 0.00 C ATOM 0 HA PRO A 102 -8.538 -8.705 0.566 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -11.266 -8.608 0.210 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -10.215 -8.574 -1.191 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -11.732 -10.896 -0.018 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -11.527 -10.453 -1.701 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -10.032 -12.418 -0.475 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -9.457 -11.511 -1.859 1.00 0.00 H new ATOM 1626 N ASN A 103 -9.621 -10.796 2.590 1.00 0.00 N ATOM 1627 CA ASN A 103 -10.009 -11.030 3.976 1.00 0.00 C ATOM 1628 C ASN A 103 -8.920 -10.554 4.936 1.00 0.00 C ATOM 1629 O ASN A 103 -8.372 -11.341 5.709 1.00 0.00 O ATOM 1630 CB ASN A 103 -10.293 -12.516 4.202 1.00 0.00 C ATOM 1631 CG ASN A 103 -11.410 -12.746 5.200 1.00 0.00 C ATOM 1632 OD1 ASN A 103 -12.427 -13.363 4.882 1.00 0.00 O ATOM 1633 ND2 ASN A 103 -11.228 -12.249 6.418 1.00 0.00 N ATOM 0 H ASN A 103 -9.256 -11.618 2.109 1.00 0.00 H new ATOM 0 HA ASN A 103 -10.916 -10.459 4.175 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -10.557 -12.981 3.252 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -9.386 -13.007 4.556 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -11.946 -12.372 7.132 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -10.370 -11.744 6.640 1.00 0.00 H new ATOM 1640 N TRP A 104 -8.615 -9.262 4.884 1.00 0.00 N ATOM 1641 CA TRP A 104 -7.595 -8.682 5.750 1.00 0.00 C ATOM 1642 C TRP A 104 -8.137 -7.462 6.491 1.00 0.00 C ATOM 1643 O TRP A 104 -7.890 -7.289 7.684 1.00 0.00 O ATOM 1644 CB TRP A 104 -6.361 -8.292 4.935 1.00 0.00 C ATOM 1645 CG TRP A 104 -6.673 -7.405 3.769 1.00 0.00 C ATOM 1646 CD1 TRP A 104 -7.166 -7.789 2.554 1.00 0.00 C ATOM 1647 CD2 TRP A 104 -6.512 -5.983 3.705 1.00 0.00 C ATOM 1648 NE1 TRP A 104 -7.321 -6.693 1.741 1.00 0.00 N ATOM 1649 CE2 TRP A 104 -6.927 -5.572 2.424 1.00 0.00 C ATOM 1650 CE3 TRP A 104 -6.057 -5.017 4.608 1.00 0.00 C ATOM 1651 CZ2 TRP A 104 -6.901 -4.239 2.025 1.00 0.00 C ATOM 1652 CZ3 TRP A 104 -6.032 -3.693 4.210 1.00 0.00 C ATOM 1653 CH2 TRP A 104 -6.452 -3.315 2.928 1.00 0.00 C ATOM 0 H TRP A 104 -9.059 -8.597 4.251 1.00 0.00 H new ATOM 0 HA TRP A 104 -7.311 -9.435 6.486 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -5.650 -7.785 5.587 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -5.873 -9.197 4.573 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -7.400 -8.806 2.274 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -7.673 -6.710 0.784 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -5.731 -5.300 5.598 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -7.224 -3.945 1.037 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -5.683 -2.938 4.899 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -6.421 -2.273 2.647 1.00 0.00 H new ATOM 1664 N SER A 105 -8.877 -6.621 5.775 1.00 0.00 N ATOM 1665 CA SER A 105 -9.454 -5.419 6.366 1.00 0.00 C ATOM 1666 C SER A 105 -10.890 -5.669 6.817 1.00 0.00 C ATOM 1667 O SER A 105 -11.773 -4.838 6.604 1.00 0.00 O ATOM 1668 CB SER A 105 -9.415 -4.265 5.361 1.00 0.00 C ATOM 1669 OG SER A 105 -9.659 -3.024 6.000 1.00 0.00 O ATOM 0 H SER A 105 -9.091 -6.750 4.786 1.00 0.00 H new ATOM 0 HA SER A 105 -8.861 -5.152 7.240 1.00 0.00 H new ATOM 0 HB2 SER A 105 -8.443 -4.239 4.869 1.00 0.00 H new ATOM 0 HB3 SER A 105 -10.161 -4.430 4.584 1.00 0.00 H new ATOM 0 HG SER A 105 -10.522 -3.058 6.462 1.00 0.00 H new