USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=23 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 28 TYR OH : rot 30:sc= 0.642 USER MOD Set 1.2: A 48 THR OG1 : rot -169:sc= 0.743 USER MOD Set 2.1: A 16 TYR OH : rot 180:sc= -1.56 USER MOD Set 2.2: A 82 SER OG : rot -119:sc= -0.196! USER MOD Single : A 11 LYS NZ :NH3+ 158:sc= 2.1 (180deg=1.55) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 ASN : amide:sc= 0.204 K(o=0.2,f=-4.1!) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 157:sc= 0 (180deg=-0.462) USER MOD Single : A 31 SER OG : rot 180:sc= -1.01 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 90:sc= -1.67! USER MOD Single : A 50 SER OG : rot -19:sc= -0.552 USER MOD Single : A 52 ASN : amide:sc= -0.0927 X(o=-0.093,f=-0.39) USER MOD Single : A 54 ASN : amide:sc= -0.934 K(o=-0.93,f=-0.038) USER MOD Single : A 57 GLN : amide:sc= -1.46 K(o=-1.5,f=-0.48) 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 160:sc= 0.123 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 153:sc= -0.24 (180deg=-1.06) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= -0.0814 X(o=-0.081,f=-0.52) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 CYS SG : rot -170:sc= -2.16 USER MOD Single : A 87 SER OG : rot 180:sc= 0 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 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN : amide:sc= 0.0705 X(o=0.071,f=0) USER MOD Single : A 101 ASN : amide:sc= -1.59 X(o=-1.6,f=-1.5) USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 SER OG : rot -55:sc= -0.567 USER MOD ----------------------------------------------------------------- ATOM 112 N ALA A 10 -9.043 4.015 12.095 1.00 0.00 N ATOM 113 CA ALA A 10 -7.883 4.207 11.235 1.00 0.00 C ATOM 114 C ALA A 10 -8.169 3.734 9.814 1.00 0.00 C ATOM 115 O ALA A 10 -9.113 2.979 9.579 1.00 0.00 O ATOM 116 CB ALA A 10 -6.677 3.475 11.804 1.00 0.00 C ATOM 0 HA ALA A 10 -7.662 5.274 11.198 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -5.818 3.627 11.151 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -6.451 3.863 12.797 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -6.897 2.410 11.872 1.00 0.00 H new ATOM 122 N LYS A 11 -7.349 4.182 8.870 1.00 0.00 N ATOM 123 CA LYS A 11 -7.514 3.803 7.470 1.00 0.00 C ATOM 124 C LYS A 11 -6.583 2.651 7.105 1.00 0.00 C ATOM 125 O LYS A 11 -5.415 2.637 7.492 1.00 0.00 O ATOM 126 CB LYS A 11 -7.242 5.003 6.561 1.00 0.00 C ATOM 127 CG LYS A 11 -8.143 5.056 5.338 1.00 0.00 C ATOM 128 CD LYS A 11 -8.308 6.480 4.829 1.00 0.00 C ATOM 129 CE LYS A 11 -7.029 6.993 4.185 1.00 0.00 C ATOM 130 NZ LYS A 11 -7.193 8.375 3.655 1.00 0.00 N ATOM 0 H LYS A 11 -6.563 4.808 9.048 1.00 0.00 H new ATOM 0 HA LYS A 11 -8.543 3.473 7.327 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -7.370 5.920 7.136 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.202 4.973 6.235 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -7.724 4.432 4.548 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -9.120 4.642 5.586 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -9.122 6.517 4.104 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -8.588 7.133 5.656 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -6.222 6.978 4.917 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -6.737 6.325 3.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -6.260 8.827 3.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -7.646 8.337 2.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -7.787 8.928 4.305 1.00 0.00 H new ATOM 144 N LYS A 12 -7.108 1.687 6.356 1.00 0.00 N ATOM 145 CA LYS A 12 -6.324 0.531 5.938 1.00 0.00 C ATOM 146 C LYS A 12 -5.827 0.700 4.505 1.00 0.00 C ATOM 147 O LYS A 12 -6.606 0.994 3.598 1.00 0.00 O ATOM 148 CB LYS A 12 -7.159 -0.746 6.052 1.00 0.00 C ATOM 149 CG LYS A 12 -7.353 -1.219 7.484 1.00 0.00 C ATOM 150 CD LYS A 12 -6.327 -2.273 7.867 1.00 0.00 C ATOM 151 CE LYS A 12 -6.118 -2.329 9.371 1.00 0.00 C ATOM 152 NZ LYS A 12 -4.676 -2.420 9.729 1.00 0.00 N ATOM 0 H LYS A 12 -8.073 1.684 6.026 1.00 0.00 H new ATOM 0 HA LYS A 12 -5.459 0.452 6.597 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -8.136 -0.574 5.599 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -6.677 -1.538 5.478 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -7.274 -0.370 8.163 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -8.357 -1.628 7.600 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -6.655 -3.248 7.508 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -5.379 -2.055 7.375 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -6.551 -1.440 9.831 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -6.648 -3.189 9.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -4.577 -2.456 10.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -4.268 -3.281 9.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -4.174 -1.586 9.362 1.00 0.00 H new ATOM 166 N VAL A 13 -4.526 0.512 4.309 1.00 0.00 N ATOM 167 CA VAL A 13 -3.926 0.643 2.988 1.00 0.00 C ATOM 168 C VAL A 13 -2.858 -0.422 2.760 1.00 0.00 C ATOM 169 O VAL A 13 -1.922 -0.554 3.549 1.00 0.00 O ATOM 170 CB VAL A 13 -3.295 2.034 2.793 1.00 0.00 C ATOM 171 CG1 VAL A 13 -4.374 3.104 2.712 1.00 0.00 C ATOM 172 CG2 VAL A 13 -2.316 2.339 3.918 1.00 0.00 C ATOM 0 H VAL A 13 -3.868 0.268 5.049 1.00 0.00 H new ATOM 0 HA VAL A 13 -4.729 0.510 2.263 1.00 0.00 H new ATOM 0 HB VAL A 13 -2.744 2.034 1.852 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.909 4.080 2.574 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -5.033 2.894 1.869 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -4.955 3.106 3.634 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -1.880 3.326 3.763 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.842 2.320 4.873 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.524 1.590 3.925 1.00 0.00 H new ATOM 182 N ARG A 14 -3.005 -1.176 1.676 1.00 0.00 N ATOM 183 CA ARG A 14 -2.052 -2.229 1.344 1.00 0.00 C ATOM 184 C ARG A 14 -1.132 -1.792 0.208 1.00 0.00 C ATOM 185 O ARG A 14 -1.594 -1.450 -0.880 1.00 0.00 O ATOM 186 CB ARG A 14 -2.792 -3.510 0.953 1.00 0.00 C ATOM 187 CG ARG A 14 -2.105 -4.779 1.430 1.00 0.00 C ATOM 188 CD ARG A 14 -2.738 -6.018 0.819 1.00 0.00 C ATOM 189 NE ARG A 14 -1.931 -7.214 1.046 1.00 0.00 N ATOM 190 CZ ARG A 14 -1.914 -7.892 2.191 1.00 0.00 C ATOM 191 NH1 ARG A 14 -2.659 -7.496 3.215 1.00 0.00 N ATOM 192 NH2 ARG A 14 -1.151 -8.970 2.312 1.00 0.00 N ATOM 0 H ARG A 14 -3.774 -1.078 1.013 1.00 0.00 H new ATOM 0 HA ARG A 14 -1.442 -2.425 2.226 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -3.801 -3.477 1.364 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -2.891 -3.546 -0.132 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -1.048 -4.742 1.168 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -2.162 -4.838 2.517 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -3.731 -6.165 1.244 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -2.869 -5.867 -0.253 1.00 0.00 H new ATOM 0 HE ARG A 14 -1.345 -7.550 0.281 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -3.248 -6.668 3.127 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -2.642 -8.019 4.090 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -0.577 -9.279 1.527 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -1.138 -9.490 3.190 1.00 0.00 H new ATOM 206 N PHE A 15 0.171 -1.805 0.470 1.00 0.00 N ATOM 207 CA PHE A 15 1.154 -1.409 -0.531 1.00 0.00 C ATOM 208 C PHE A 15 1.905 -2.624 -1.067 1.00 0.00 C ATOM 209 O PHE A 15 2.361 -3.473 -0.301 1.00 0.00 O ATOM 210 CB PHE A 15 2.143 -0.406 0.065 1.00 0.00 C ATOM 211 CG PHE A 15 1.508 0.891 0.476 1.00 0.00 C ATOM 212 CD1 PHE A 15 1.060 1.792 -0.478 1.00 0.00 C ATOM 213 CD2 PHE A 15 1.358 1.210 1.816 1.00 0.00 C ATOM 214 CE1 PHE A 15 0.476 2.986 -0.103 1.00 0.00 C ATOM 215 CE2 PHE A 15 0.774 2.404 2.197 1.00 0.00 C ATOM 216 CZ PHE A 15 0.332 3.293 1.236 1.00 0.00 C ATOM 0 H PHE A 15 0.570 -2.085 1.366 1.00 0.00 H new ATOM 0 HA PHE A 15 0.624 -0.938 -1.359 1.00 0.00 H new ATOM 0 HB2 PHE A 15 2.626 -0.856 0.933 1.00 0.00 H new ATOM 0 HB3 PHE A 15 2.926 -0.202 -0.665 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.169 1.557 -1.527 1.00 0.00 H new ATOM 0 HD2 PHE A 15 1.701 0.518 2.571 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.132 3.679 -0.856 1.00 0.00 H new ATOM 0 HE2 PHE A 15 0.663 2.642 3.245 1.00 0.00 H new ATOM 0 HZ PHE A 15 -0.125 4.226 1.531 1.00 0.00 H new ATOM 226 N TYR A 16 2.028 -2.701 -2.388 1.00 0.00 N ATOM 227 CA TYR A 16 2.723 -3.812 -3.027 1.00 0.00 C ATOM 228 C TYR A 16 4.063 -3.360 -3.598 1.00 0.00 C ATOM 229 O TYR A 16 4.433 -2.191 -3.490 1.00 0.00 O ATOM 230 CB TYR A 16 1.859 -4.409 -4.139 1.00 0.00 C ATOM 231 CG TYR A 16 0.643 -5.151 -3.629 1.00 0.00 C ATOM 232 CD1 TYR A 16 0.776 -6.350 -2.940 1.00 0.00 C ATOM 233 CD2 TYR A 16 -0.637 -4.652 -3.836 1.00 0.00 C ATOM 234 CE1 TYR A 16 -0.331 -7.031 -2.473 1.00 0.00 C ATOM 235 CE2 TYR A 16 -1.749 -5.327 -3.371 1.00 0.00 C ATOM 236 CZ TYR A 16 -1.592 -6.515 -2.690 1.00 0.00 C ATOM 237 OH TYR A 16 -2.697 -7.190 -2.225 1.00 0.00 O ATOM 0 H TYR A 16 1.655 -2.007 -3.037 1.00 0.00 H new ATOM 0 HA TYR A 16 2.909 -4.574 -2.270 1.00 0.00 H new ATOM 0 HB2 TYR A 16 1.534 -3.609 -4.804 1.00 0.00 H new ATOM 0 HB3 TYR A 16 2.467 -5.090 -4.734 1.00 0.00 H new ATOM 0 HD1 TYR A 16 1.762 -6.756 -2.767 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -0.765 -3.721 -4.369 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -0.210 -7.963 -1.941 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -2.737 -4.926 -3.540 1.00 0.00 H new ATOM 0 HH TYR A 16 -3.508 -6.692 -2.460 1.00 0.00 H new ATOM 247 N ARG A 17 4.787 -4.295 -4.205 1.00 0.00 N ATOM 248 CA ARG A 17 6.087 -3.993 -4.795 1.00 0.00 C ATOM 249 C ARG A 17 5.997 -3.954 -6.317 1.00 0.00 C ATOM 250 O ARG A 17 5.664 -4.953 -6.955 1.00 0.00 O ATOM 251 CB ARG A 17 7.122 -5.031 -4.355 1.00 0.00 C ATOM 252 CG ARG A 17 8.425 -4.419 -3.861 1.00 0.00 C ATOM 253 CD ARG A 17 8.787 -4.919 -2.471 1.00 0.00 C ATOM 254 NE ARG A 17 8.779 -6.378 -2.393 1.00 0.00 N ATOM 255 CZ ARG A 17 9.291 -7.068 -1.378 1.00 0.00 C ATOM 256 NH1 ARG A 17 9.852 -6.438 -0.354 1.00 0.00 N ATOM 257 NH2 ARG A 17 9.243 -8.394 -1.387 1.00 0.00 N ATOM 0 H ARG A 17 4.496 -5.268 -4.301 1.00 0.00 H new ATOM 0 HA ARG A 17 6.400 -3.009 -4.445 1.00 0.00 H new ATOM 0 HB2 ARG A 17 6.695 -5.645 -3.562 1.00 0.00 H new ATOM 0 HB3 ARG A 17 7.337 -5.696 -5.192 1.00 0.00 H new ATOM 0 HG2 ARG A 17 9.228 -4.662 -4.556 1.00 0.00 H new ATOM 0 HG3 ARG A 17 8.335 -3.333 -3.845 1.00 0.00 H new ATOM 0 HD2 ARG A 17 9.775 -4.547 -2.198 1.00 0.00 H new ATOM 0 HD3 ARG A 17 8.082 -4.514 -1.745 1.00 0.00 H new ATOM 0 HE ARG A 17 8.356 -6.898 -3.162 1.00 0.00 H new ATOM 0 HH11 ARG A 17 9.892 -5.419 -0.342 1.00 0.00 H new ATOM 0 HH12 ARG A 17 10.243 -6.973 0.422 1.00 0.00 H new ATOM 0 HH21 ARG A 17 8.814 -8.883 -2.172 1.00 0.00 H new ATOM 0 HH22 ARG A 17 9.636 -8.924 -0.609 1.00 0.00 H new ATOM 271 N ASN A 18 6.295 -2.793 -6.893 1.00 0.00 N ATOM 272 CA ASN A 18 6.247 -2.622 -8.342 1.00 0.00 C ATOM 273 C ASN A 18 7.187 -3.603 -9.037 1.00 0.00 C ATOM 274 O ASN A 18 8.408 -3.492 -8.927 1.00 0.00 O ATOM 275 CB ASN A 18 6.618 -1.187 -8.720 1.00 0.00 C ATOM 276 CG ASN A 18 6.234 -0.847 -10.146 1.00 0.00 C ATOM 277 OD1 ASN A 18 5.454 -1.559 -10.778 1.00 0.00 O ATOM 278 ND2 ASN A 18 6.782 0.248 -10.661 1.00 0.00 N ATOM 0 H ASN A 18 6.572 -1.957 -6.379 1.00 0.00 H new ATOM 0 HA ASN A 18 5.229 -2.826 -8.673 1.00 0.00 H new ATOM 0 HB2 ASN A 18 6.123 -0.495 -8.039 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.691 -1.047 -8.592 1.00 0.00 H new ATOM 0 HD21 ASN A 18 6.561 0.528 -11.617 1.00 0.00 H new ATOM 0 HD22 ASN A 18 7.424 0.809 -10.101 1.00 0.00 H new ATOM 285 N GLY A 19 6.609 -4.561 -9.754 1.00 0.00 N ATOM 286 CA GLY A 19 7.408 -5.547 -10.457 1.00 0.00 C ATOM 287 C GLY A 19 7.526 -6.851 -9.692 1.00 0.00 C ATOM 288 O GLY A 19 8.521 -7.565 -9.819 1.00 0.00 O ATOM 0 H GLY A 19 5.601 -4.672 -9.861 1.00 0.00 H new ATOM 0 HA2 GLY A 19 6.964 -5.741 -11.433 1.00 0.00 H new ATOM 0 HA3 GLY A 19 8.404 -5.143 -10.635 1.00 0.00 H new ATOM 292 N ASP A 20 6.509 -7.162 -8.895 1.00 0.00 N ATOM 293 CA ASP A 20 6.504 -8.389 -8.107 1.00 0.00 C ATOM 294 C ASP A 20 5.081 -8.785 -7.728 1.00 0.00 C ATOM 295 O ASP A 20 4.457 -8.155 -6.872 1.00 0.00 O ATOM 296 CB ASP A 20 7.351 -8.213 -6.845 1.00 0.00 C ATOM 297 CG ASP A 20 8.059 -9.492 -6.442 1.00 0.00 C ATOM 298 OD1 ASP A 20 7.375 -10.525 -6.283 1.00 0.00 O ATOM 299 OD2 ASP A 20 9.298 -9.460 -6.284 1.00 0.00 O ATOM 0 H ASP A 20 5.678 -6.582 -8.778 1.00 0.00 H new ATOM 0 HA ASP A 20 6.934 -9.185 -8.716 1.00 0.00 H new ATOM 0 HB2 ASP A 20 8.090 -7.429 -7.013 1.00 0.00 H new ATOM 0 HB3 ASP A 20 6.713 -7.880 -6.026 1.00 0.00 H new ATOM 304 N ARG A 21 4.572 -9.832 -8.368 1.00 0.00 N ATOM 305 CA ARG A 21 3.223 -10.313 -8.097 1.00 0.00 C ATOM 306 C ARG A 21 3.224 -11.326 -6.955 1.00 0.00 C ATOM 307 O ARG A 21 2.261 -11.423 -6.196 1.00 0.00 O ATOM 308 CB ARG A 21 2.621 -10.945 -9.353 1.00 0.00 C ATOM 309 CG ARG A 21 3.359 -12.189 -9.822 1.00 0.00 C ATOM 310 CD ARG A 21 3.148 -12.436 -11.306 1.00 0.00 C ATOM 311 NE ARG A 21 3.710 -13.715 -11.734 1.00 0.00 N ATOM 312 CZ ARG A 21 3.948 -14.032 -13.005 1.00 0.00 C ATOM 313 NH1 ARG A 21 3.675 -13.167 -13.974 1.00 0.00 N ATOM 314 NH2 ARG A 21 4.461 -15.217 -13.307 1.00 0.00 N ATOM 0 H ARG A 21 5.074 -10.364 -9.079 1.00 0.00 H new ATOM 0 HA ARG A 21 2.614 -9.459 -7.801 1.00 0.00 H new ATOM 0 HB2 ARG A 21 1.580 -11.202 -9.157 1.00 0.00 H new ATOM 0 HB3 ARG A 21 2.621 -10.208 -10.156 1.00 0.00 H new ATOM 0 HG2 ARG A 21 4.424 -12.080 -9.618 1.00 0.00 H new ATOM 0 HG3 ARG A 21 3.013 -13.054 -9.256 1.00 0.00 H new ATOM 0 HD2 ARG A 21 2.081 -12.416 -11.529 1.00 0.00 H new ATOM 0 HD3 ARG A 21 3.608 -11.629 -11.877 1.00 0.00 H new ATOM 0 HE ARG A 21 3.933 -14.405 -11.017 1.00 0.00 H new ATOM 0 HH11 ARG A 21 3.281 -12.254 -13.747 1.00 0.00 H new ATOM 0 HH12 ARG A 21 3.859 -13.415 -14.946 1.00 0.00 H new ATOM 0 HH21 ARG A 21 4.673 -15.885 -12.566 1.00 0.00 H new ATOM 0 HH22 ARG A 21 4.644 -15.461 -14.281 1.00 0.00 H new ATOM 328 N TYR A 22 4.314 -12.077 -6.841 1.00 0.00 N ATOM 329 CA TYR A 22 4.444 -13.083 -5.792 1.00 0.00 C ATOM 330 C TYR A 22 4.367 -12.445 -4.408 1.00 0.00 C ATOM 331 O TYR A 22 4.004 -13.100 -3.432 1.00 0.00 O ATOM 332 CB TYR A 22 5.763 -13.842 -5.945 1.00 0.00 C ATOM 333 CG TYR A 22 5.868 -14.619 -7.238 1.00 0.00 C ATOM 334 CD1 TYR A 22 6.280 -14.000 -8.411 1.00 0.00 C ATOM 335 CD2 TYR A 22 5.557 -15.973 -7.283 1.00 0.00 C ATOM 336 CE1 TYR A 22 6.377 -14.708 -9.594 1.00 0.00 C ATOM 337 CE2 TYR A 22 5.652 -16.687 -8.462 1.00 0.00 C ATOM 338 CZ TYR A 22 6.062 -16.050 -9.615 1.00 0.00 C ATOM 339 OH TYR A 22 6.158 -16.758 -10.791 1.00 0.00 O ATOM 0 H TYR A 22 5.120 -12.009 -7.462 1.00 0.00 H new ATOM 0 HA TYR A 22 3.615 -13.784 -5.893 1.00 0.00 H new ATOM 0 HB2 TYR A 22 6.589 -13.133 -5.889 1.00 0.00 H new ATOM 0 HB3 TYR A 22 5.876 -14.530 -5.107 1.00 0.00 H new ATOM 0 HD1 TYR A 22 6.528 -12.949 -8.399 1.00 0.00 H new ATOM 0 HD2 TYR A 22 5.236 -16.475 -6.382 1.00 0.00 H new ATOM 0 HE1 TYR A 22 6.698 -14.212 -10.498 1.00 0.00 H new ATOM 0 HE2 TYR A 22 5.407 -17.739 -8.481 1.00 0.00 H new ATOM 0 HH TYR A 22 5.902 -17.691 -10.633 1.00 0.00 H new ATOM 349 N PHE A 23 4.715 -11.163 -4.328 1.00 0.00 N ATOM 350 CA PHE A 23 4.686 -10.438 -3.061 1.00 0.00 C ATOM 351 C PHE A 23 3.309 -10.528 -2.410 1.00 0.00 C ATOM 352 O PHE A 23 2.288 -10.307 -3.061 1.00 0.00 O ATOM 353 CB PHE A 23 5.065 -8.973 -3.280 1.00 0.00 C ATOM 354 CG PHE A 23 5.257 -8.206 -2.004 1.00 0.00 C ATOM 355 CD1 PHE A 23 6.099 -8.684 -1.013 1.00 0.00 C ATOM 356 CD2 PHE A 23 4.596 -7.006 -1.795 1.00 0.00 C ATOM 357 CE1 PHE A 23 6.278 -7.980 0.163 1.00 0.00 C ATOM 358 CE2 PHE A 23 4.770 -6.298 -0.622 1.00 0.00 C ATOM 359 CZ PHE A 23 5.613 -6.784 0.358 1.00 0.00 C ATOM 0 H PHE A 23 5.020 -10.605 -5.126 1.00 0.00 H new ATOM 0 HA PHE A 23 5.413 -10.899 -2.392 1.00 0.00 H new ATOM 0 HB2 PHE A 23 5.984 -8.927 -3.864 1.00 0.00 H new ATOM 0 HB3 PHE A 23 4.288 -8.490 -3.872 1.00 0.00 H new ATOM 0 HD1 PHE A 23 6.622 -9.617 -1.161 1.00 0.00 H new ATOM 0 HD2 PHE A 23 3.937 -6.620 -2.559 1.00 0.00 H new ATOM 0 HE1 PHE A 23 6.936 -8.364 0.928 1.00 0.00 H new ATOM 0 HE2 PHE A 23 4.247 -5.365 -0.471 1.00 0.00 H new ATOM 0 HZ PHE A 23 5.752 -6.231 1.275 1.00 0.00 H new ATOM 369 N LYS A 24 3.290 -10.852 -1.121 1.00 0.00 N ATOM 370 CA LYS A 24 2.039 -10.971 -0.382 1.00 0.00 C ATOM 371 C LYS A 24 1.396 -9.603 -0.175 1.00 0.00 C ATOM 372 O LYS A 24 0.182 -9.451 -0.308 1.00 0.00 O ATOM 373 CB LYS A 24 2.284 -11.643 0.971 1.00 0.00 C ATOM 374 CG LYS A 24 2.585 -13.128 0.866 1.00 0.00 C ATOM 375 CD LYS A 24 3.336 -13.632 2.089 1.00 0.00 C ATOM 376 CE LYS A 24 4.839 -13.471 1.925 1.00 0.00 C ATOM 377 NZ LYS A 24 5.344 -12.246 2.603 1.00 0.00 N ATOM 0 H LYS A 24 4.126 -11.037 -0.567 1.00 0.00 H new ATOM 0 HA LYS A 24 1.357 -11.587 -0.968 1.00 0.00 H new ATOM 0 HB2 LYS A 24 3.117 -11.146 1.469 1.00 0.00 H new ATOM 0 HB3 LYS A 24 1.406 -11.502 1.602 1.00 0.00 H new ATOM 0 HG2 LYS A 24 1.653 -13.682 0.756 1.00 0.00 H new ATOM 0 HG3 LYS A 24 3.177 -13.318 -0.030 1.00 0.00 H new ATOM 0 HD2 LYS A 24 3.005 -13.085 2.972 1.00 0.00 H new ATOM 0 HD3 LYS A 24 3.098 -14.682 2.256 1.00 0.00 H new ATOM 0 HE2 LYS A 24 5.344 -14.346 2.333 1.00 0.00 H new ATOM 0 HE3 LYS A 24 5.086 -13.426 0.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 6.357 -12.357 2.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 5.207 -11.424 1.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 4.822 -12.100 3.490 1.00 0.00 H new ATOM 391 N GLY A 25 2.219 -8.612 0.151 1.00 0.00 N ATOM 392 CA GLY A 25 1.712 -7.269 0.370 1.00 0.00 C ATOM 393 C GLY A 25 1.717 -6.878 1.835 1.00 0.00 C ATOM 394 O GLY A 25 1.427 -7.699 2.705 1.00 0.00 O ATOM 0 H GLY A 25 3.227 -8.714 0.268 1.00 0.00 H new ATOM 0 HA2 GLY A 25 2.317 -6.559 -0.194 1.00 0.00 H new ATOM 0 HA3 GLY A 25 0.696 -7.200 -0.018 1.00 0.00 H new ATOM 398 N ILE A 26 2.047 -5.620 2.108 1.00 0.00 N ATOM 399 CA ILE A 26 2.089 -5.119 3.476 1.00 0.00 C ATOM 400 C ILE A 26 0.969 -4.113 3.727 1.00 0.00 C ATOM 401 O ILE A 26 0.708 -3.242 2.899 1.00 0.00 O ATOM 402 CB ILE A 26 3.446 -4.459 3.792 1.00 0.00 C ATOM 403 CG1 ILE A 26 3.508 -4.039 5.263 1.00 0.00 C ATOM 404 CG2 ILE A 26 3.681 -3.261 2.883 1.00 0.00 C ATOM 405 CD1 ILE A 26 4.885 -4.182 5.875 1.00 0.00 C ATOM 0 H ILE A 26 2.289 -4.928 1.399 1.00 0.00 H new ATOM 0 HA ILE A 26 1.953 -5.978 4.133 1.00 0.00 H new ATOM 0 HB ILE A 26 4.235 -5.188 3.609 1.00 0.00 H new ATOM 0 HG12 ILE A 26 3.187 -3.001 5.350 1.00 0.00 H new ATOM 0 HG13 ILE A 26 2.801 -4.641 5.834 1.00 0.00 H new ATOM 0 HG21 ILE A 26 4.643 -2.808 3.120 1.00 0.00 H new ATOM 0 HG22 ILE A 26 3.680 -3.588 1.843 1.00 0.00 H new ATOM 0 HG23 ILE A 26 2.888 -2.529 3.034 1.00 0.00 H new ATOM 0 HD11 ILE A 26 4.854 -3.867 6.918 1.00 0.00 H new ATOM 0 HD12 ILE A 26 5.201 -5.224 5.820 1.00 0.00 H new ATOM 0 HD13 ILE A 26 5.593 -3.559 5.328 1.00 0.00 H new ATOM 417 N VAL A 27 0.312 -4.240 4.876 1.00 0.00 N ATOM 418 CA VAL A 27 -0.777 -3.340 5.236 1.00 0.00 C ATOM 419 C VAL A 27 -0.300 -2.263 6.203 1.00 0.00 C ATOM 420 O VAL A 27 0.666 -2.460 6.941 1.00 0.00 O ATOM 421 CB VAL A 27 -1.951 -4.107 5.874 1.00 0.00 C ATOM 422 CG1 VAL A 27 -3.136 -3.180 6.102 1.00 0.00 C ATOM 423 CG2 VAL A 27 -2.353 -5.292 5.008 1.00 0.00 C ATOM 0 H VAL A 27 0.515 -4.957 5.573 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.120 -2.870 4.314 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.625 -4.488 6.842 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -3.955 -3.740 6.553 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.841 -2.369 6.768 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.462 -2.765 5.148 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -3.184 -5.820 5.477 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.658 -4.936 4.024 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -1.506 -5.970 4.902 1.00 0.00 H new ATOM 433 N TYR A 28 -0.984 -1.123 6.195 1.00 0.00 N ATOM 434 CA TYR A 28 -0.627 -0.014 7.073 1.00 0.00 C ATOM 435 C TYR A 28 -1.874 0.719 7.557 1.00 0.00 C ATOM 436 O TYR A 28 -2.777 1.014 6.774 1.00 0.00 O ATOM 437 CB TYR A 28 0.302 0.961 6.346 1.00 0.00 C ATOM 438 CG TYR A 28 1.750 0.526 6.341 1.00 0.00 C ATOM 439 CD1 TYR A 28 2.570 0.767 7.436 1.00 0.00 C ATOM 440 CD2 TYR A 28 2.296 -0.126 5.242 1.00 0.00 C ATOM 441 CE1 TYR A 28 3.895 0.372 7.436 1.00 0.00 C ATOM 442 CE2 TYR A 28 3.619 -0.524 5.235 1.00 0.00 C ATOM 443 CZ TYR A 28 4.414 -0.274 6.333 1.00 0.00 C ATOM 444 OH TYR A 28 5.732 -0.668 6.329 1.00 0.00 O ATOM 0 H TYR A 28 -1.787 -0.943 5.592 1.00 0.00 H new ATOM 0 HA TYR A 28 -0.107 -0.422 7.940 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -0.038 1.075 5.317 1.00 0.00 H new ATOM 0 HB3 TYR A 28 0.227 1.941 6.817 1.00 0.00 H new ATOM 0 HD1 TYR A 28 2.166 1.271 8.301 1.00 0.00 H new ATOM 0 HD2 TYR A 28 1.677 -0.325 4.380 1.00 0.00 H new ATOM 0 HE1 TYR A 28 4.520 0.568 8.295 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.029 -1.029 4.373 1.00 0.00 H new ATOM 0 HH TYR A 28 6.017 -0.867 7.245 1.00 0.00 H new ATOM 454 N ALA A 29 -1.916 1.011 8.853 1.00 0.00 N ATOM 455 CA ALA A 29 -3.052 1.709 9.443 1.00 0.00 C ATOM 456 C ALA A 29 -2.788 3.209 9.532 1.00 0.00 C ATOM 457 O ALA A 29 -1.998 3.662 10.359 1.00 0.00 O ATOM 458 CB ALA A 29 -3.361 1.144 10.820 1.00 0.00 C ATOM 0 H ALA A 29 -1.176 0.775 9.514 1.00 0.00 H new ATOM 0 HA ALA A 29 -3.917 1.556 8.797 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -4.211 1.675 11.249 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -3.601 0.084 10.733 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -2.493 1.267 11.467 1.00 0.00 H new ATOM 464 N ILE A 30 -3.457 3.973 8.674 1.00 0.00 N ATOM 465 CA ILE A 30 -3.294 5.422 8.655 1.00 0.00 C ATOM 466 C ILE A 30 -4.002 6.069 9.842 1.00 0.00 C ATOM 467 O ILE A 30 -5.230 6.110 9.898 1.00 0.00 O ATOM 468 CB ILE A 30 -3.844 6.032 7.352 1.00 0.00 C ATOM 469 CG1 ILE A 30 -3.311 5.266 6.140 1.00 0.00 C ATOM 470 CG2 ILE A 30 -3.475 7.505 7.259 1.00 0.00 C ATOM 471 CD1 ILE A 30 -1.799 5.233 6.062 1.00 0.00 C ATOM 0 H ILE A 30 -4.116 3.613 7.984 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.224 5.621 8.718 1.00 0.00 H new ATOM 0 HB ILE A 30 -4.931 5.950 7.361 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -3.687 4.244 6.172 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -3.704 5.722 5.231 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.871 7.921 6.333 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -3.899 8.041 8.108 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -2.390 7.610 7.269 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -1.492 4.674 5.178 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -1.416 6.251 5.998 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -1.399 4.750 6.954 1.00 0.00 H new ATOM 483 N SER A 31 -3.217 6.573 10.788 1.00 0.00 N ATOM 484 CA SER A 31 -3.769 7.218 11.974 1.00 0.00 C ATOM 485 C SER A 31 -2.947 8.446 12.360 1.00 0.00 C ATOM 486 O SER A 31 -1.738 8.490 12.131 1.00 0.00 O ATOM 487 CB SER A 31 -3.813 6.233 13.143 1.00 0.00 C ATOM 488 OG SER A 31 -5.064 5.568 13.204 1.00 0.00 O ATOM 0 H SER A 31 -2.198 6.547 10.757 1.00 0.00 H new ATOM 0 HA SER A 31 -4.784 7.541 11.741 1.00 0.00 H new ATOM 0 HB2 SER A 31 -3.013 5.500 13.035 1.00 0.00 H new ATOM 0 HB3 SER A 31 -3.635 6.765 14.078 1.00 0.00 H new ATOM 0 HG SER A 31 -5.066 4.943 13.959 1.00 0.00 H new ATOM 494 N PRO A 32 -3.595 9.464 12.953 1.00 0.00 N ATOM 495 CA PRO A 32 -2.918 10.696 13.369 1.00 0.00 C ATOM 496 C PRO A 32 -1.700 10.422 14.243 1.00 0.00 C ATOM 497 O PRO A 32 -0.725 11.173 14.222 1.00 0.00 O ATOM 498 CB PRO A 32 -3.991 11.441 14.168 1.00 0.00 C ATOM 499 CG PRO A 32 -5.284 10.928 13.635 1.00 0.00 C ATOM 500 CD PRO A 32 -5.038 9.493 13.262 1.00 0.00 C ATOM 0 HA PRO A 32 -2.536 11.257 12.516 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -3.897 11.245 15.236 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -3.907 12.519 14.034 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -6.073 11.007 14.383 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -5.606 11.507 12.769 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -5.288 8.817 14.079 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -5.639 9.192 12.404 1.00 0.00 H new ATOM 508 N ASP A 33 -1.761 9.339 15.013 1.00 0.00 N ATOM 509 CA ASP A 33 -0.661 8.966 15.895 1.00 0.00 C ATOM 510 C ASP A 33 0.450 8.270 15.117 1.00 0.00 C ATOM 511 O ASP A 33 1.615 8.663 15.191 1.00 0.00 O ATOM 512 CB ASP A 33 -1.166 8.053 17.014 1.00 0.00 C ATOM 513 CG ASP A 33 -2.143 8.754 17.936 1.00 0.00 C ATOM 514 OD1 ASP A 33 -1.800 9.839 18.452 1.00 0.00 O ATOM 515 OD2 ASP A 33 -3.253 8.219 18.143 1.00 0.00 O ATOM 0 H ASP A 33 -2.560 8.705 15.044 1.00 0.00 H new ATOM 0 HA ASP A 33 -0.255 9.877 16.333 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -1.648 7.179 16.576 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -0.317 7.692 17.595 1.00 0.00 H new ATOM 520 N ARG A 34 0.084 7.232 14.371 1.00 0.00 N ATOM 521 CA ARG A 34 1.051 6.481 13.579 1.00 0.00 C ATOM 522 C ARG A 34 1.729 7.382 12.552 1.00 0.00 C ATOM 523 O ARG A 34 2.947 7.566 12.582 1.00 0.00 O ATOM 524 CB ARG A 34 0.365 5.310 12.873 1.00 0.00 C ATOM 525 CG ARG A 34 0.426 4.007 13.655 1.00 0.00 C ATOM 526 CD ARG A 34 -0.580 2.993 13.136 1.00 0.00 C ATOM 527 NE ARG A 34 -1.321 2.352 14.220 1.00 0.00 N ATOM 528 CZ ARG A 34 -0.827 1.378 14.980 1.00 0.00 C ATOM 529 NH1 ARG A 34 0.405 0.929 14.778 1.00 0.00 N ATOM 530 NH2 ARG A 34 -1.568 0.850 15.946 1.00 0.00 N ATOM 0 H ARG A 34 -0.875 6.892 14.299 1.00 0.00 H new ATOM 0 HA ARG A 34 1.813 6.092 14.255 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -0.679 5.567 12.692 1.00 0.00 H new ATOM 0 HB3 ARG A 34 0.830 5.161 11.899 1.00 0.00 H new ATOM 0 HG2 ARG A 34 1.431 3.590 13.589 1.00 0.00 H new ATOM 0 HG3 ARG A 34 0.232 4.206 14.709 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -1.279 3.488 12.462 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -0.060 2.233 12.553 1.00 0.00 H new ATOM 0 HE ARG A 34 -2.272 2.670 14.405 1.00 0.00 H new ATOM 0 HH11 ARG A 34 0.979 1.331 14.037 1.00 0.00 H new ATOM 0 HH12 ARG A 34 0.778 0.182 15.364 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -2.516 1.191 16.106 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -1.190 0.103 16.529 1.00 0.00 H new ATOM 544 N PHE A 35 0.934 7.939 11.645 1.00 0.00 N ATOM 545 CA PHE A 35 1.457 8.820 10.608 1.00 0.00 C ATOM 546 C PHE A 35 0.852 10.215 10.723 1.00 0.00 C ATOM 547 O PHE A 35 -0.350 10.365 10.945 1.00 0.00 O ATOM 548 CB PHE A 35 1.168 8.238 9.223 1.00 0.00 C ATOM 549 CG PHE A 35 1.611 6.811 9.066 1.00 0.00 C ATOM 550 CD1 PHE A 35 2.944 6.509 8.836 1.00 0.00 C ATOM 551 CD2 PHE A 35 0.696 5.775 9.149 1.00 0.00 C ATOM 552 CE1 PHE A 35 3.355 5.196 8.691 1.00 0.00 C ATOM 553 CE2 PHE A 35 1.101 4.461 9.006 1.00 0.00 C ATOM 554 CZ PHE A 35 2.432 4.172 8.776 1.00 0.00 C ATOM 0 H PHE A 35 -0.075 7.796 11.607 1.00 0.00 H new ATOM 0 HA PHE A 35 2.536 8.900 10.743 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.097 8.301 9.028 1.00 0.00 H new ATOM 0 HB3 PHE A 35 1.666 8.849 8.470 1.00 0.00 H new ATOM 0 HD1 PHE A 35 3.669 7.307 8.769 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.346 5.996 9.327 1.00 0.00 H new ATOM 0 HE1 PHE A 35 4.396 4.972 8.512 1.00 0.00 H new ATOM 0 HE2 PHE A 35 0.378 3.662 9.074 1.00 0.00 H new ATOM 0 HZ PHE A 35 2.751 3.146 8.663 1.00 0.00 H new ATOM 564 N ARG A 36 1.692 11.234 10.571 1.00 0.00 N ATOM 565 CA ARG A 36 1.239 12.618 10.658 1.00 0.00 C ATOM 566 C ARG A 36 1.363 13.316 9.307 1.00 0.00 C ATOM 567 O ARG A 36 0.518 14.131 8.938 1.00 0.00 O ATOM 568 CB ARG A 36 2.046 13.374 11.715 1.00 0.00 C ATOM 569 CG ARG A 36 1.351 13.459 13.065 1.00 0.00 C ATOM 570 CD ARG A 36 2.336 13.292 14.211 1.00 0.00 C ATOM 571 NE ARG A 36 2.825 14.577 14.704 1.00 0.00 N ATOM 572 CZ ARG A 36 3.398 14.744 15.895 1.00 0.00 C ATOM 573 NH1 ARG A 36 3.557 13.713 16.714 1.00 0.00 N ATOM 574 NH2 ARG A 36 3.814 15.947 16.266 1.00 0.00 N ATOM 0 H ARG A 36 2.690 11.128 10.387 1.00 0.00 H new ATOM 0 HA ARG A 36 0.188 12.615 10.948 1.00 0.00 H new ATOM 0 HB2 ARG A 36 3.011 12.884 11.843 1.00 0.00 H new ATOM 0 HB3 ARG A 36 2.246 14.383 11.354 1.00 0.00 H new ATOM 0 HG2 ARG A 36 0.846 14.421 13.155 1.00 0.00 H new ATOM 0 HG3 ARG A 36 0.583 12.688 13.129 1.00 0.00 H new ATOM 0 HD2 ARG A 36 1.856 12.750 15.026 1.00 0.00 H new ATOM 0 HD3 ARG A 36 3.179 12.686 13.879 1.00 0.00 H new ATOM 0 HE ARG A 36 2.722 15.394 14.102 1.00 0.00 H new ATOM 0 HH11 ARG A 36 3.240 12.785 16.433 1.00 0.00 H new ATOM 0 HH12 ARG A 36 3.997 13.848 17.624 1.00 0.00 H new ATOM 0 HH21 ARG A 36 3.695 16.743 15.640 1.00 0.00 H new ATOM 0 HH22 ARG A 36 4.253 16.076 17.178 1.00 0.00 H new ATOM 588 N SER A 37 2.424 12.991 8.573 1.00 0.00 N ATOM 589 CA SER A 37 2.658 13.587 7.264 1.00 0.00 C ATOM 590 C SER A 37 2.975 12.515 6.227 1.00 0.00 C ATOM 591 O SER A 37 3.310 11.382 6.575 1.00 0.00 O ATOM 592 CB SER A 37 3.806 14.596 7.337 1.00 0.00 C ATOM 593 OG SER A 37 5.055 13.940 7.463 1.00 0.00 O ATOM 0 H SER A 37 3.134 12.319 8.864 1.00 0.00 H new ATOM 0 HA SER A 37 1.748 14.104 6.960 1.00 0.00 H new ATOM 0 HB2 SER A 37 3.806 15.216 6.441 1.00 0.00 H new ATOM 0 HB3 SER A 37 3.655 15.263 8.186 1.00 0.00 H new ATOM 0 HG SER A 37 5.772 14.607 7.506 1.00 0.00 H new ATOM 599 N PHE A 38 2.868 12.879 4.954 1.00 0.00 N ATOM 600 CA PHE A 38 3.144 11.947 3.867 1.00 0.00 C ATOM 601 C PHE A 38 4.607 11.517 3.878 1.00 0.00 C ATOM 602 O PHE A 38 4.938 10.397 3.490 1.00 0.00 O ATOM 603 CB PHE A 38 2.797 12.582 2.519 1.00 0.00 C ATOM 604 CG PHE A 38 2.826 11.612 1.373 1.00 0.00 C ATOM 605 CD1 PHE A 38 1.868 10.616 1.269 1.00 0.00 C ATOM 606 CD2 PHE A 38 3.809 11.696 0.401 1.00 0.00 C ATOM 607 CE1 PHE A 38 1.891 9.721 0.216 1.00 0.00 C ATOM 608 CE2 PHE A 38 3.838 10.804 -0.654 1.00 0.00 C ATOM 609 CZ PHE A 38 2.877 9.816 -0.747 1.00 0.00 C ATOM 0 H PHE A 38 2.592 13.813 4.649 1.00 0.00 H new ATOM 0 HA PHE A 38 2.523 11.064 4.014 1.00 0.00 H new ATOM 0 HB2 PHE A 38 1.804 13.028 2.582 1.00 0.00 H new ATOM 0 HB3 PHE A 38 3.498 13.392 2.317 1.00 0.00 H new ATOM 0 HD1 PHE A 38 1.095 10.538 2.019 1.00 0.00 H new ATOM 0 HD2 PHE A 38 4.562 12.468 0.468 1.00 0.00 H new ATOM 0 HE1 PHE A 38 1.139 8.949 0.146 1.00 0.00 H new ATOM 0 HE2 PHE A 38 4.611 10.879 -1.405 1.00 0.00 H new ATOM 0 HZ PHE A 38 2.896 9.119 -1.572 1.00 0.00 H new ATOM 619 N GLU A 39 5.479 12.414 4.326 1.00 0.00 N ATOM 620 CA GLU A 39 6.907 12.128 4.388 1.00 0.00 C ATOM 621 C GLU A 39 7.193 11.010 5.386 1.00 0.00 C ATOM 622 O GLU A 39 8.135 10.236 5.212 1.00 0.00 O ATOM 623 CB GLU A 39 7.686 13.386 4.777 1.00 0.00 C ATOM 624 CG GLU A 39 7.372 14.589 3.904 1.00 0.00 C ATOM 625 CD GLU A 39 7.440 15.897 4.668 1.00 0.00 C ATOM 626 OE1 GLU A 39 8.338 16.040 5.524 1.00 0.00 O ATOM 627 OE2 GLU A 39 6.594 16.779 4.411 1.00 0.00 O ATOM 0 H GLU A 39 5.221 13.346 4.652 1.00 0.00 H new ATOM 0 HA GLU A 39 7.230 11.802 3.399 1.00 0.00 H new ATOM 0 HB2 GLU A 39 7.465 13.633 5.815 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.754 13.175 4.720 1.00 0.00 H new ATOM 0 HG2 GLU A 39 8.074 14.622 3.071 1.00 0.00 H new ATOM 0 HG3 GLU A 39 6.376 14.473 3.477 1.00 0.00 H new ATOM 634 N ALA A 40 6.376 10.932 6.430 1.00 0.00 N ATOM 635 CA ALA A 40 6.541 9.910 7.457 1.00 0.00 C ATOM 636 C ALA A 40 6.186 8.529 6.919 1.00 0.00 C ATOM 637 O ALA A 40 6.801 7.530 7.292 1.00 0.00 O ATOM 638 CB ALA A 40 5.688 10.241 8.672 1.00 0.00 C ATOM 0 H ALA A 40 5.592 11.565 6.588 1.00 0.00 H new ATOM 0 HA ALA A 40 7.589 9.896 7.756 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.821 9.470 9.431 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.992 11.206 9.078 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.639 10.285 8.379 1.00 0.00 H new ATOM 644 N LEU A 41 5.188 8.479 6.042 1.00 0.00 N ATOM 645 CA LEU A 41 4.750 7.219 5.454 1.00 0.00 C ATOM 646 C LEU A 41 5.788 6.684 4.472 1.00 0.00 C ATOM 647 O LEU A 41 6.080 5.488 4.451 1.00 0.00 O ATOM 648 CB LEU A 41 3.408 7.403 4.744 1.00 0.00 C ATOM 649 CG LEU A 41 2.739 6.108 4.277 1.00 0.00 C ATOM 650 CD1 LEU A 41 2.026 5.429 5.435 1.00 0.00 C ATOM 651 CD2 LEU A 41 1.767 6.391 3.141 1.00 0.00 C ATOM 0 H LEU A 41 4.668 9.297 5.723 1.00 0.00 H new ATOM 0 HA LEU A 41 4.632 6.494 6.259 1.00 0.00 H new ATOM 0 HB2 LEU A 41 2.727 7.924 5.417 1.00 0.00 H new ATOM 0 HB3 LEU A 41 3.558 8.049 3.879 1.00 0.00 H new ATOM 0 HG LEU A 41 3.512 5.434 3.908 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.556 4.510 5.084 1.00 0.00 H new ATOM 0 HD12 LEU A 41 2.747 5.192 6.218 1.00 0.00 H new ATOM 0 HD13 LEU A 41 1.263 6.097 5.834 1.00 0.00 H new ATOM 0 HD21 LEU A 41 1.300 5.459 2.821 1.00 0.00 H new ATOM 0 HD22 LEU A 41 0.998 7.083 3.484 1.00 0.00 H new ATOM 0 HD23 LEU A 41 2.306 6.833 2.303 1.00 0.00 H new ATOM 663 N LEU A 42 6.343 7.578 3.660 1.00 0.00 N ATOM 664 CA LEU A 42 7.349 7.196 2.675 1.00 0.00 C ATOM 665 C LEU A 42 8.608 6.670 3.357 1.00 0.00 C ATOM 666 O LEU A 42 9.305 5.811 2.817 1.00 0.00 O ATOM 667 CB LEU A 42 7.696 8.388 1.781 1.00 0.00 C ATOM 668 CG LEU A 42 6.808 8.552 0.547 1.00 0.00 C ATOM 669 CD1 LEU A 42 7.083 9.882 -0.135 1.00 0.00 C ATOM 670 CD2 LEU A 42 7.024 7.399 -0.421 1.00 0.00 C ATOM 0 H LEU A 42 6.113 8.572 3.665 1.00 0.00 H new ATOM 0 HA LEU A 42 6.934 6.399 2.059 1.00 0.00 H new ATOM 0 HB2 LEU A 42 7.636 9.299 2.377 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.731 8.288 1.454 1.00 0.00 H new ATOM 0 HG LEU A 42 5.766 8.541 0.868 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.442 9.981 -1.011 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.877 10.696 0.559 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.128 9.924 -0.443 1.00 0.00 H new ATOM 0 HD21 LEU A 42 6.384 7.532 -1.293 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.067 7.379 -0.736 1.00 0.00 H new ATOM 0 HD23 LEU A 42 6.775 6.459 0.072 1.00 0.00 H new ATOM 682 N ALA A 43 8.894 7.193 4.545 1.00 0.00 N ATOM 683 CA ALA A 43 10.071 6.776 5.299 1.00 0.00 C ATOM 684 C ALA A 43 9.897 5.366 5.854 1.00 0.00 C ATOM 685 O ALA A 43 10.868 4.627 6.011 1.00 0.00 O ATOM 686 CB ALA A 43 10.348 7.759 6.427 1.00 0.00 C ATOM 0 H ALA A 43 8.328 7.905 5.006 1.00 0.00 H new ATOM 0 HA ALA A 43 10.924 6.767 4.620 1.00 0.00 H new ATOM 0 HB1 ALA A 43 11.229 7.437 6.982 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.524 8.751 6.010 1.00 0.00 H new ATOM 0 HB3 ALA A 43 9.489 7.795 7.098 1.00 0.00 H new ATOM 692 N ASP A 44 8.655 5.000 6.149 1.00 0.00 N ATOM 693 CA ASP A 44 8.354 3.679 6.688 1.00 0.00 C ATOM 694 C ASP A 44 8.256 2.644 5.570 1.00 0.00 C ATOM 695 O ASP A 44 8.582 1.473 5.765 1.00 0.00 O ATOM 696 CB ASP A 44 7.047 3.713 7.481 1.00 0.00 C ATOM 697 CG ASP A 44 7.261 4.102 8.932 1.00 0.00 C ATOM 698 OD1 ASP A 44 7.427 5.310 9.203 1.00 0.00 O ATOM 699 OD2 ASP A 44 7.265 3.199 9.794 1.00 0.00 O ATOM 0 H ASP A 44 7.840 5.600 6.024 1.00 0.00 H new ATOM 0 HA ASP A 44 9.168 3.393 7.354 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.361 4.421 7.015 1.00 0.00 H new ATOM 0 HB3 ASP A 44 6.573 2.733 7.437 1.00 0.00 H new ATOM 704 N LEU A 45 7.804 3.085 4.401 1.00 0.00 N ATOM 705 CA LEU A 45 7.663 2.197 3.253 1.00 0.00 C ATOM 706 C LEU A 45 9.027 1.785 2.710 1.00 0.00 C ATOM 707 O LEU A 45 9.190 0.683 2.186 1.00 0.00 O ATOM 708 CB LEU A 45 6.848 2.880 2.152 1.00 0.00 C ATOM 709 CG LEU A 45 5.344 2.959 2.415 1.00 0.00 C ATOM 710 CD1 LEU A 45 4.648 3.735 1.308 1.00 0.00 C ATOM 711 CD2 LEU A 45 4.752 1.563 2.544 1.00 0.00 C ATOM 0 H LEU A 45 7.529 4.051 4.224 1.00 0.00 H new ATOM 0 HA LEU A 45 7.139 1.300 3.582 1.00 0.00 H new ATOM 0 HB2 LEU A 45 7.231 3.891 2.012 1.00 0.00 H new ATOM 0 HB3 LEU A 45 7.010 2.345 1.216 1.00 0.00 H new ATOM 0 HG LEU A 45 5.186 3.488 3.355 1.00 0.00 H new ATOM 0 HD11 LEU A 45 3.578 3.781 1.513 1.00 0.00 H new ATOM 0 HD12 LEU A 45 5.052 4.746 1.263 1.00 0.00 H new ATOM 0 HD13 LEU A 45 4.814 3.235 0.354 1.00 0.00 H new ATOM 0 HD21 LEU A 45 3.681 1.638 2.731 1.00 0.00 H new ATOM 0 HD22 LEU A 45 4.921 1.009 1.621 1.00 0.00 H new ATOM 0 HD23 LEU A 45 5.229 1.041 3.373 1.00 0.00 H new ATOM 723 N THR A 46 10.004 2.675 2.840 1.00 0.00 N ATOM 724 CA THR A 46 11.355 2.403 2.362 1.00 0.00 C ATOM 725 C THR A 46 12.096 1.473 3.318 1.00 0.00 C ATOM 726 O THR A 46 12.959 0.700 2.902 1.00 0.00 O ATOM 727 CB THR A 46 12.133 3.710 2.200 1.00 0.00 C ATOM 728 OG1 THR A 46 11.319 4.711 1.616 1.00 0.00 O ATOM 729 CG2 THR A 46 13.371 3.567 1.342 1.00 0.00 C ATOM 0 H THR A 46 9.886 3.591 3.272 1.00 0.00 H new ATOM 0 HA THR A 46 11.277 1.910 1.393 1.00 0.00 H new ATOM 0 HB THR A 46 12.439 3.989 3.208 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.855 5.208 2.322 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.876 4.530 1.268 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.044 2.838 1.793 1.00 0.00 H new ATOM 0 HG23 THR A 46 13.086 3.229 0.346 1.00 0.00 H new ATOM 737 N ARG A 47 11.751 1.553 4.599 1.00 0.00 N ATOM 738 CA ARG A 47 12.384 0.718 5.614 1.00 0.00 C ATOM 739 C ARG A 47 12.027 -0.751 5.413 1.00 0.00 C ATOM 740 O ARG A 47 12.823 -1.640 5.712 1.00 0.00 O ATOM 741 CB ARG A 47 11.960 1.170 7.012 1.00 0.00 C ATOM 742 CG ARG A 47 13.048 1.008 8.061 1.00 0.00 C ATOM 743 CD ARG A 47 12.467 0.931 9.464 1.00 0.00 C ATOM 744 NE ARG A 47 12.777 -0.340 10.116 1.00 0.00 N ATOM 745 CZ ARG A 47 14.006 -0.711 10.467 1.00 0.00 C ATOM 746 NH1 ARG A 47 15.041 0.086 10.231 1.00 0.00 N ATOM 747 NH2 ARG A 47 14.201 -1.883 11.056 1.00 0.00 N ATOM 0 H ARG A 47 11.037 2.187 4.959 1.00 0.00 H new ATOM 0 HA ARG A 47 13.464 0.827 5.515 1.00 0.00 H new ATOM 0 HB2 ARG A 47 11.660 2.217 6.971 1.00 0.00 H new ATOM 0 HB3 ARG A 47 11.083 0.599 7.319 1.00 0.00 H new ATOM 0 HG2 ARG A 47 13.622 0.105 7.854 1.00 0.00 H new ATOM 0 HG3 ARG A 47 13.741 1.847 7.999 1.00 0.00 H new ATOM 0 HD2 ARG A 47 12.859 1.752 10.064 1.00 0.00 H new ATOM 0 HD3 ARG A 47 11.386 1.060 9.416 1.00 0.00 H new ATOM 0 HE ARG A 47 12.007 -0.979 10.313 1.00 0.00 H new ATOM 0 HH11 ARG A 47 14.897 0.989 9.778 1.00 0.00 H new ATOM 0 HH12 ARG A 47 15.980 -0.204 10.502 1.00 0.00 H new ATOM 0 HH21 ARG A 47 13.409 -2.499 11.240 1.00 0.00 H new ATOM 0 HH22 ARG A 47 15.143 -2.168 11.325 1.00 0.00 H new ATOM 761 N THR A 48 10.823 -0.999 4.907 1.00 0.00 N ATOM 762 CA THR A 48 10.360 -2.362 4.668 1.00 0.00 C ATOM 763 C THR A 48 10.423 -2.707 3.183 1.00 0.00 C ATOM 764 O THR A 48 11.302 -3.450 2.746 1.00 0.00 O ATOM 765 CB THR A 48 8.932 -2.536 5.185 1.00 0.00 C ATOM 766 OG1 THR A 48 8.240 -1.299 5.174 1.00 0.00 O ATOM 767 CG2 THR A 48 8.868 -3.084 6.594 1.00 0.00 C ATOM 0 H THR A 48 10.151 -0.275 4.655 1.00 0.00 H new ATOM 0 HA THR A 48 11.019 -3.042 5.208 1.00 0.00 H new ATOM 0 HB THR A 48 8.467 -3.255 4.511 1.00 0.00 H new ATOM 0 HG1 THR A 48 7.401 -1.389 5.672 1.00 0.00 H new ATOM 0 HG21 THR A 48 7.826 -3.183 6.899 1.00 0.00 H new ATOM 0 HG22 THR A 48 9.350 -4.061 6.627 1.00 0.00 H new ATOM 0 HG23 THR A 48 9.382 -2.403 7.273 1.00 0.00 H new ATOM 775 N LEU A 49 9.484 -2.166 2.415 1.00 0.00 N ATOM 776 CA LEU A 49 9.431 -2.418 0.979 1.00 0.00 C ATOM 777 C LEU A 49 10.606 -1.755 0.265 1.00 0.00 C ATOM 778 O LEU A 49 10.432 -0.780 -0.466 1.00 0.00 O ATOM 779 CB LEU A 49 8.110 -1.907 0.399 1.00 0.00 C ATOM 780 CG LEU A 49 6.858 -2.334 1.167 1.00 0.00 C ATOM 781 CD1 LEU A 49 5.628 -1.634 0.611 1.00 0.00 C ATOM 782 CD2 LEU A 49 6.687 -3.844 1.108 1.00 0.00 C ATOM 0 H LEU A 49 8.749 -1.550 2.762 1.00 0.00 H new ATOM 0 HA LEU A 49 9.496 -3.495 0.822 1.00 0.00 H new ATOM 0 HB2 LEU A 49 8.143 -0.818 0.365 1.00 0.00 H new ATOM 0 HB3 LEU A 49 8.023 -2.256 -0.630 1.00 0.00 H new ATOM 0 HG LEU A 49 6.976 -2.042 2.211 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.746 -1.949 1.169 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.750 -0.555 0.705 1.00 0.00 H new ATOM 0 HD13 LEU A 49 5.505 -1.895 -0.440 1.00 0.00 H new ATOM 0 HD21 LEU A 49 5.792 -4.131 1.659 1.00 0.00 H new ATOM 0 HD22 LEU A 49 6.590 -4.159 0.069 1.00 0.00 H new ATOM 0 HD23 LEU A 49 7.557 -4.326 1.553 1.00 0.00 H new ATOM 794 N SER A 50 11.803 -2.293 0.481 1.00 0.00 N ATOM 795 CA SER A 50 13.007 -1.755 -0.144 1.00 0.00 C ATOM 796 C SER A 50 14.237 -2.559 0.266 1.00 0.00 C ATOM 797 O SER A 50 14.327 -3.044 1.394 1.00 0.00 O ATOM 798 CB SER A 50 13.194 -0.286 0.240 1.00 0.00 C ATOM 799 OG SER A 50 13.720 0.461 -0.844 1.00 0.00 O ATOM 0 H SER A 50 11.965 -3.100 1.083 1.00 0.00 H new ATOM 0 HA SER A 50 12.889 -1.829 -1.225 1.00 0.00 H new ATOM 0 HB2 SER A 50 12.238 0.137 0.548 1.00 0.00 H new ATOM 0 HB3 SER A 50 13.865 -0.213 1.096 1.00 0.00 H new ATOM 0 HG SER A 50 14.130 -0.148 -1.493 1.00 0.00 H new ATOM 805 N ASP A 51 15.182 -2.696 -0.657 1.00 0.00 N ATOM 806 CA ASP A 51 16.408 -3.440 -0.392 1.00 0.00 C ATOM 807 C ASP A 51 17.458 -3.162 -1.464 1.00 0.00 C ATOM 808 O ASP A 51 18.367 -2.357 -1.261 1.00 0.00 O ATOM 809 CB ASP A 51 16.114 -4.940 -0.319 1.00 0.00 C ATOM 810 CG ASP A 51 15.761 -5.393 1.084 1.00 0.00 C ATOM 811 OD1 ASP A 51 16.523 -5.073 2.021 1.00 0.00 O ATOM 812 OD2 ASP A 51 14.722 -6.067 1.247 1.00 0.00 O ATOM 0 H ASP A 51 15.123 -2.302 -1.596 1.00 0.00 H new ATOM 0 HA ASP A 51 16.804 -3.109 0.568 1.00 0.00 H new ATOM 0 HB2 ASP A 51 15.291 -5.179 -0.993 1.00 0.00 H new ATOM 0 HB3 ASP A 51 16.984 -5.495 -0.669 1.00 0.00 H new ATOM 817 N ASN A 52 17.327 -3.832 -2.606 1.00 0.00 N ATOM 818 CA ASN A 52 18.266 -3.655 -3.709 1.00 0.00 C ATOM 819 C ASN A 52 17.901 -4.558 -4.886 1.00 0.00 C ATOM 820 O ASN A 52 18.775 -5.115 -5.549 1.00 0.00 O ATOM 821 CB ASN A 52 19.696 -3.949 -3.243 1.00 0.00 C ATOM 822 CG ASN A 52 20.594 -2.730 -3.328 1.00 0.00 C ATOM 823 OD1 ASN A 52 20.526 -1.960 -4.286 1.00 0.00 O ATOM 824 ND2 ASN A 52 21.443 -2.549 -2.323 1.00 0.00 N ATOM 0 H ASN A 52 16.580 -4.502 -2.791 1.00 0.00 H new ATOM 0 HA ASN A 52 18.208 -2.618 -4.041 1.00 0.00 H new ATOM 0 HB2 ASN A 52 19.673 -4.309 -2.214 1.00 0.00 H new ATOM 0 HB3 ASN A 52 20.116 -4.750 -3.852 1.00 0.00 H new ATOM 0 HD21 ASN A 52 22.072 -1.746 -2.325 1.00 0.00 H new ATOM 0 HD22 ASN A 52 21.466 -3.213 -1.549 1.00 0.00 H new ATOM 831 N VAL A 53 16.603 -4.696 -5.139 1.00 0.00 N ATOM 832 CA VAL A 53 16.124 -5.530 -6.234 1.00 0.00 C ATOM 833 C VAL A 53 15.034 -4.821 -7.030 1.00 0.00 C ATOM 834 O VAL A 53 15.102 -4.738 -8.256 1.00 0.00 O ATOM 835 CB VAL A 53 15.576 -6.874 -5.719 1.00 0.00 C ATOM 836 CG1 VAL A 53 15.269 -7.807 -6.880 1.00 0.00 C ATOM 837 CG2 VAL A 53 16.560 -7.517 -4.753 1.00 0.00 C ATOM 0 H VAL A 53 15.866 -4.241 -4.601 1.00 0.00 H new ATOM 0 HA VAL A 53 16.979 -5.720 -6.883 1.00 0.00 H new ATOM 0 HB VAL A 53 14.647 -6.684 -5.182 1.00 0.00 H new ATOM 0 HG11 VAL A 53 14.883 -8.751 -6.496 1.00 0.00 H new ATOM 0 HG12 VAL A 53 14.523 -7.347 -7.529 1.00 0.00 H new ATOM 0 HG13 VAL A 53 16.180 -7.992 -7.449 1.00 0.00 H new ATOM 0 HG21 VAL A 53 16.156 -8.466 -4.400 1.00 0.00 H new ATOM 0 HG22 VAL A 53 17.507 -7.694 -5.262 1.00 0.00 H new ATOM 0 HG23 VAL A 53 16.723 -6.853 -3.904 1.00 0.00 H new ATOM 847 N ASN A 54 14.029 -4.311 -6.324 1.00 0.00 N ATOM 848 CA ASN A 54 12.924 -3.610 -6.966 1.00 0.00 C ATOM 849 C ASN A 54 13.062 -2.101 -6.790 1.00 0.00 C ATOM 850 O ASN A 54 12.791 -1.331 -7.711 1.00 0.00 O ATOM 851 CB ASN A 54 11.589 -4.083 -6.389 1.00 0.00 C ATOM 852 CG ASN A 54 11.322 -5.547 -6.673 1.00 0.00 C ATOM 853 OD1 ASN A 54 10.443 -5.888 -7.466 1.00 0.00 O ATOM 854 ND2 ASN A 54 12.081 -6.424 -6.025 1.00 0.00 N ATOM 0 H ASN A 54 13.958 -4.370 -5.308 1.00 0.00 H new ATOM 0 HA ASN A 54 12.952 -3.837 -8.032 1.00 0.00 H new ATOM 0 HB2 ASN A 54 11.583 -3.918 -5.312 1.00 0.00 H new ATOM 0 HB3 ASN A 54 10.782 -3.482 -6.808 1.00 0.00 H new ATOM 0 HD21 ASN A 54 11.947 -7.424 -6.176 1.00 0.00 H new ATOM 0 HD22 ASN A 54 12.798 -6.097 -5.377 1.00 0.00 H new ATOM 861 N LEU A 55 13.483 -1.685 -5.600 1.00 0.00 N ATOM 862 CA LEU A 55 13.656 -0.268 -5.303 1.00 0.00 C ATOM 863 C LEU A 55 14.967 -0.023 -4.558 1.00 0.00 C ATOM 864 O LEU A 55 15.007 -0.062 -3.328 1.00 0.00 O ATOM 865 CB LEU A 55 12.480 0.246 -4.470 1.00 0.00 C ATOM 866 CG LEU A 55 11.096 -0.032 -5.063 1.00 0.00 C ATOM 867 CD1 LEU A 55 10.090 -0.320 -3.960 1.00 0.00 C ATOM 868 CD2 LEU A 55 10.638 1.143 -5.913 1.00 0.00 C ATOM 0 H LEU A 55 13.711 -2.309 -4.826 1.00 0.00 H new ATOM 0 HA LEU A 55 13.689 0.274 -6.248 1.00 0.00 H new ATOM 0 HB2 LEU A 55 12.531 -0.205 -3.479 1.00 0.00 H new ATOM 0 HB3 LEU A 55 12.592 1.322 -4.336 1.00 0.00 H new ATOM 0 HG LEU A 55 11.164 -0.913 -5.701 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.112 -0.515 -4.401 1.00 0.00 H new ATOM 0 HD12 LEU A 55 10.413 -1.193 -3.392 1.00 0.00 H new ATOM 0 HD13 LEU A 55 10.023 0.541 -3.295 1.00 0.00 H new ATOM 0 HD21 LEU A 55 9.653 0.930 -6.327 1.00 0.00 H new ATOM 0 HD22 LEU A 55 10.586 2.040 -5.296 1.00 0.00 H new ATOM 0 HD23 LEU A 55 11.347 1.302 -6.726 1.00 0.00 H new ATOM 880 N PRO A 56 16.062 0.234 -5.296 1.00 0.00 N ATOM 881 CA PRO A 56 17.376 0.486 -4.695 1.00 0.00 C ATOM 882 C PRO A 56 17.419 1.803 -3.927 1.00 0.00 C ATOM 883 O PRO A 56 17.907 1.857 -2.798 1.00 0.00 O ATOM 884 CB PRO A 56 18.317 0.539 -5.901 1.00 0.00 C ATOM 885 CG PRO A 56 17.446 0.917 -7.048 1.00 0.00 C ATOM 886 CD PRO A 56 16.104 0.301 -6.768 1.00 0.00 C ATOM 0 HA PRO A 56 17.642 -0.278 -3.965 1.00 0.00 H new ATOM 0 HB2 PRO A 56 19.112 1.270 -5.751 1.00 0.00 H new ATOM 0 HB3 PRO A 56 18.798 -0.425 -6.070 1.00 0.00 H new ATOM 0 HG2 PRO A 56 17.367 2.000 -7.138 1.00 0.00 H new ATOM 0 HG3 PRO A 56 17.856 0.548 -7.988 1.00 0.00 H new ATOM 0 HD2 PRO A 56 15.291 0.909 -7.166 1.00 0.00 H new ATOM 0 HD3 PRO A 56 16.013 -0.687 -7.218 1.00 0.00 H new ATOM 894 N GLN A 57 16.906 2.860 -4.546 1.00 0.00 N ATOM 895 CA GLN A 57 16.886 4.177 -3.918 1.00 0.00 C ATOM 896 C GLN A 57 15.804 4.251 -2.847 1.00 0.00 C ATOM 897 O GLN A 57 15.954 4.952 -1.846 1.00 0.00 O ATOM 898 CB GLN A 57 16.657 5.264 -4.971 1.00 0.00 C ATOM 899 CG GLN A 57 17.943 5.864 -5.515 1.00 0.00 C ATOM 900 CD GLN A 57 18.776 4.859 -6.285 1.00 0.00 C ATOM 901 OE1 GLN A 57 19.962 4.677 -6.011 1.00 0.00 O ATOM 902 NE2 GLN A 57 18.156 4.198 -7.256 1.00 0.00 N ATOM 0 H GLN A 57 16.499 2.832 -5.481 1.00 0.00 H new ATOM 0 HA GLN A 57 17.853 4.341 -3.443 1.00 0.00 H new ATOM 0 HB2 GLN A 57 16.084 4.843 -5.797 1.00 0.00 H new ATOM 0 HB3 GLN A 57 16.051 6.058 -4.535 1.00 0.00 H new ATOM 0 HG2 GLN A 57 17.701 6.704 -6.166 1.00 0.00 H new ATOM 0 HG3 GLN A 57 18.532 6.261 -4.688 1.00 0.00 H new ATOM 0 HE21 GLN A 57 17.171 4.381 -7.449 1.00 0.00 H new ATOM 0 HE22 GLN A 57 18.665 3.508 -7.809 1.00 0.00 H new ATOM 911 N GLY A 58 14.712 3.525 -3.063 1.00 0.00 N ATOM 912 CA GLY A 58 13.620 3.522 -2.108 1.00 0.00 C ATOM 913 C GLY A 58 12.286 3.848 -2.751 1.00 0.00 C ATOM 914 O GLY A 58 12.101 3.644 -3.951 1.00 0.00 O ATOM 0 H GLY A 58 14.564 2.938 -3.884 1.00 0.00 H new ATOM 0 HA2 GLY A 58 13.561 2.543 -1.632 1.00 0.00 H new ATOM 0 HA3 GLY A 58 13.827 4.247 -1.321 1.00 0.00 H new ATOM 918 N VAL A 59 11.355 4.356 -1.951 1.00 0.00 N ATOM 919 CA VAL A 59 10.031 4.710 -2.447 1.00 0.00 C ATOM 920 C VAL A 59 9.833 6.223 -2.450 1.00 0.00 C ATOM 921 O VAL A 59 10.348 6.929 -1.582 1.00 0.00 O ATOM 922 CB VAL A 59 8.920 4.055 -1.601 1.00 0.00 C ATOM 923 CG1 VAL A 59 9.005 4.512 -0.153 1.00 0.00 C ATOM 924 CG2 VAL A 59 7.549 4.359 -2.186 1.00 0.00 C ATOM 0 H VAL A 59 11.493 4.532 -0.956 1.00 0.00 H new ATOM 0 HA VAL A 59 9.964 4.337 -3.469 1.00 0.00 H new ATOM 0 HB VAL A 59 9.066 2.975 -1.623 1.00 0.00 H new ATOM 0 HG11 VAL A 59 8.212 4.038 0.425 1.00 0.00 H new ATOM 0 HG12 VAL A 59 9.974 4.231 0.261 1.00 0.00 H new ATOM 0 HG13 VAL A 59 8.890 5.595 -0.106 1.00 0.00 H new ATOM 0 HG21 VAL A 59 6.780 3.888 -1.574 1.00 0.00 H new ATOM 0 HG22 VAL A 59 7.391 5.437 -2.201 1.00 0.00 H new ATOM 0 HG23 VAL A 59 7.493 3.970 -3.203 1.00 0.00 H new ATOM 934 N ARG A 60 9.087 6.716 -3.433 1.00 0.00 N ATOM 935 CA ARG A 60 8.822 8.146 -3.549 1.00 0.00 C ATOM 936 C ARG A 60 7.380 8.398 -3.978 1.00 0.00 C ATOM 937 O ARG A 60 6.684 9.225 -3.389 1.00 0.00 O ATOM 938 CB ARG A 60 9.788 8.784 -4.551 1.00 0.00 C ATOM 939 CG ARG A 60 10.811 9.706 -3.906 1.00 0.00 C ATOM 940 CD ARG A 60 12.184 9.545 -4.539 1.00 0.00 C ATOM 941 NE ARG A 60 13.010 10.737 -4.364 1.00 0.00 N ATOM 942 CZ ARG A 60 14.183 10.921 -4.966 1.00 0.00 C ATOM 943 NH1 ARG A 60 14.670 9.994 -5.782 1.00 0.00 N ATOM 944 NH2 ARG A 60 14.870 12.034 -4.752 1.00 0.00 N ATOM 0 H ARG A 60 8.655 6.147 -4.161 1.00 0.00 H new ATOM 0 HA ARG A 60 8.974 8.601 -2.570 1.00 0.00 H new ATOM 0 HB2 ARG A 60 10.311 7.995 -5.091 1.00 0.00 H new ATOM 0 HB3 ARG A 60 9.215 9.348 -5.287 1.00 0.00 H new ATOM 0 HG2 ARG A 60 10.483 10.741 -4.005 1.00 0.00 H new ATOM 0 HG3 ARG A 60 10.874 9.492 -2.839 1.00 0.00 H new ATOM 0 HD2 ARG A 60 12.689 8.686 -4.097 1.00 0.00 H new ATOM 0 HD3 ARG A 60 12.071 9.335 -5.603 1.00 0.00 H new ATOM 0 HE ARG A 60 12.668 11.471 -3.744 1.00 0.00 H new ATOM 0 HH11 ARG A 60 14.145 9.136 -5.950 1.00 0.00 H new ATOM 0 HH12 ARG A 60 15.569 10.140 -6.241 1.00 0.00 H new ATOM 0 HH21 ARG A 60 14.500 12.749 -4.126 1.00 0.00 H new ATOM 0 HH22 ARG A 60 15.769 12.175 -5.213 1.00 0.00 H new ATOM 958 N THR A 61 6.939 7.681 -5.006 1.00 0.00 N ATOM 959 CA THR A 61 5.579 7.828 -5.512 1.00 0.00 C ATOM 960 C THR A 61 4.829 6.502 -5.456 1.00 0.00 C ATOM 961 O THR A 61 5.351 5.463 -5.862 1.00 0.00 O ATOM 962 CB THR A 61 5.602 8.352 -6.949 1.00 0.00 C ATOM 963 OG1 THR A 61 6.600 9.346 -7.105 1.00 0.00 O ATOM 964 CG2 THR A 61 4.284 8.953 -7.388 1.00 0.00 C ATOM 0 H THR A 61 7.503 6.993 -5.505 1.00 0.00 H new ATOM 0 HA THR A 61 5.059 8.545 -4.877 1.00 0.00 H new ATOM 0 HB THR A 61 5.811 7.481 -7.570 1.00 0.00 H new ATOM 0 HG1 THR A 61 6.600 9.667 -8.031 1.00 0.00 H new ATOM 0 HG21 THR A 61 4.369 9.305 -8.416 1.00 0.00 H new ATOM 0 HG22 THR A 61 3.501 8.197 -7.327 1.00 0.00 H new ATOM 0 HG23 THR A 61 4.031 9.790 -6.738 1.00 0.00 H new ATOM 972 N ILE A 62 3.601 6.544 -4.948 1.00 0.00 N ATOM 973 CA ILE A 62 2.778 5.346 -4.836 1.00 0.00 C ATOM 974 C ILE A 62 1.561 5.431 -5.751 1.00 0.00 C ATOM 975 O ILE A 62 0.700 6.293 -5.577 1.00 0.00 O ATOM 976 CB ILE A 62 2.303 5.123 -3.388 1.00 0.00 C ATOM 977 CG1 ILE A 62 3.482 5.227 -2.419 1.00 0.00 C ATOM 978 CG2 ILE A 62 1.620 3.770 -3.257 1.00 0.00 C ATOM 979 CD1 ILE A 62 3.063 5.432 -0.980 1.00 0.00 C ATOM 0 H ILE A 62 3.154 7.395 -4.607 1.00 0.00 H new ATOM 0 HA ILE A 62 3.401 4.504 -5.139 1.00 0.00 H new ATOM 0 HB ILE A 62 1.580 5.899 -3.135 1.00 0.00 H new ATOM 0 HG12 ILE A 62 4.081 4.319 -2.489 1.00 0.00 H new ATOM 0 HG13 ILE A 62 4.121 6.055 -2.725 1.00 0.00 H new ATOM 0 HG21 ILE A 62 1.290 3.627 -2.228 1.00 0.00 H new ATOM 0 HG22 ILE A 62 0.758 3.731 -3.923 1.00 0.00 H new ATOM 0 HG23 ILE A 62 2.322 2.981 -3.526 1.00 0.00 H new ATOM 0 HD11 ILE A 62 3.949 5.497 -0.349 1.00 0.00 H new ATOM 0 HD12 ILE A 62 2.489 6.355 -0.896 1.00 0.00 H new ATOM 0 HD13 ILE A 62 2.448 4.592 -0.657 1.00 0.00 H new ATOM 991 N TYR A 63 1.495 4.529 -6.726 1.00 0.00 N ATOM 992 CA TYR A 63 0.382 4.504 -7.667 1.00 0.00 C ATOM 993 C TYR A 63 -0.681 3.504 -7.225 1.00 0.00 C ATOM 994 O TYR A 63 -0.412 2.611 -6.422 1.00 0.00 O ATOM 995 CB TYR A 63 0.881 4.149 -9.069 1.00 0.00 C ATOM 996 CG TYR A 63 2.041 5.002 -9.533 1.00 0.00 C ATOM 997 CD1 TYR A 63 3.333 4.749 -9.090 1.00 0.00 C ATOM 998 CD2 TYR A 63 1.844 6.057 -10.414 1.00 0.00 C ATOM 999 CE1 TYR A 63 4.396 5.526 -9.511 1.00 0.00 C ATOM 1000 CE2 TYR A 63 2.901 6.837 -10.840 1.00 0.00 C ATOM 1001 CZ TYR A 63 4.174 6.568 -10.386 1.00 0.00 C ATOM 1002 OH TYR A 63 5.230 7.344 -10.807 1.00 0.00 O ATOM 0 H TYR A 63 2.198 3.807 -6.884 1.00 0.00 H new ATOM 0 HA TYR A 63 -0.066 5.497 -7.689 1.00 0.00 H new ATOM 0 HB2 TYR A 63 1.182 3.102 -9.084 1.00 0.00 H new ATOM 0 HB3 TYR A 63 0.058 4.254 -9.776 1.00 0.00 H new ATOM 0 HD1 TYR A 63 3.510 3.932 -8.406 1.00 0.00 H new ATOM 0 HD2 TYR A 63 0.848 6.271 -10.772 1.00 0.00 H new ATOM 0 HE1 TYR A 63 5.395 5.318 -9.156 1.00 0.00 H new ATOM 0 HE2 TYR A 63 2.731 7.654 -11.526 1.00 0.00 H new ATOM 0 HH TYR A 63 4.904 8.034 -11.422 1.00 0.00 H new ATOM 1012 N THR A 64 -1.890 3.659 -7.756 1.00 0.00 N ATOM 1013 CA THR A 64 -2.993 2.769 -7.416 1.00 0.00 C ATOM 1014 C THR A 64 -2.730 1.356 -7.931 1.00 0.00 C ATOM 1015 O THR A 64 -1.717 1.100 -8.581 1.00 0.00 O ATOM 1016 CB THR A 64 -4.303 3.301 -7.999 1.00 0.00 C ATOM 1017 OG1 THR A 64 -4.059 4.067 -9.165 1.00 0.00 O ATOM 1018 CG2 THR A 64 -5.078 4.171 -7.032 1.00 0.00 C ATOM 0 H THR A 64 -2.130 4.392 -8.423 1.00 0.00 H new ATOM 0 HA THR A 64 -3.076 2.731 -6.330 1.00 0.00 H new ATOM 0 HB THR A 64 -4.899 2.417 -8.225 1.00 0.00 H new ATOM 0 HG1 THR A 64 -4.881 4.127 -9.695 1.00 0.00 H new ATOM 0 HG21 THR A 64 -5.996 4.515 -7.508 1.00 0.00 H new ATOM 0 HG22 THR A 64 -5.326 3.594 -6.141 1.00 0.00 H new ATOM 0 HG23 THR A 64 -4.471 5.031 -6.750 1.00 0.00 H new ATOM 1026 N ILE A 65 -3.648 0.442 -7.634 1.00 0.00 N ATOM 1027 CA ILE A 65 -3.514 -0.943 -8.066 1.00 0.00 C ATOM 1028 C ILE A 65 -3.586 -1.054 -9.587 1.00 0.00 C ATOM 1029 O ILE A 65 -2.982 -1.946 -10.183 1.00 0.00 O ATOM 1030 CB ILE A 65 -4.606 -1.836 -7.439 1.00 0.00 C ATOM 1031 CG1 ILE A 65 -4.386 -3.302 -7.822 1.00 0.00 C ATOM 1032 CG2 ILE A 65 -5.989 -1.368 -7.870 1.00 0.00 C ATOM 1033 CD1 ILE A 65 -4.314 -4.233 -6.631 1.00 0.00 C ATOM 0 H ILE A 65 -4.492 0.636 -7.096 1.00 0.00 H new ATOM 0 HA ILE A 65 -2.537 -1.288 -7.727 1.00 0.00 H new ATOM 0 HB ILE A 65 -4.540 -1.753 -6.354 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.196 -3.624 -8.476 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -3.462 -3.385 -8.394 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -6.747 -2.009 -7.419 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -6.143 -0.339 -7.544 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -6.069 -1.421 -8.956 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -4.157 -5.255 -6.977 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -3.486 -3.937 -5.987 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -5.247 -4.179 -6.070 1.00 0.00 H new ATOM 1045 N ASP A 66 -4.331 -0.145 -10.208 1.00 0.00 N ATOM 1046 CA ASP A 66 -4.481 -0.142 -11.659 1.00 0.00 C ATOM 1047 C ASP A 66 -3.367 0.661 -12.321 1.00 0.00 C ATOM 1048 O ASP A 66 -2.949 0.358 -13.439 1.00 0.00 O ATOM 1049 CB ASP A 66 -5.843 0.433 -12.050 1.00 0.00 C ATOM 1050 CG ASP A 66 -6.985 -0.505 -11.713 1.00 0.00 C ATOM 1051 OD1 ASP A 66 -6.769 -1.735 -11.731 1.00 0.00 O ATOM 1052 OD2 ASP A 66 -8.097 -0.010 -11.433 1.00 0.00 O ATOM 0 H ASP A 66 -4.840 0.598 -9.730 1.00 0.00 H new ATOM 0 HA ASP A 66 -4.416 -1.173 -12.008 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -5.994 1.383 -11.538 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -5.852 0.643 -13.120 1.00 0.00 H new ATOM 1057 N GLY A 67 -2.889 1.687 -11.624 1.00 0.00 N ATOM 1058 CA GLY A 67 -1.827 2.518 -12.161 1.00 0.00 C ATOM 1059 C GLY A 67 -2.355 3.747 -12.873 1.00 0.00 C ATOM 1060 O GLY A 67 -1.743 4.234 -13.823 1.00 0.00 O ATOM 0 H GLY A 67 -3.218 1.958 -10.697 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.167 2.827 -11.350 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.226 1.930 -12.855 1.00 0.00 H new ATOM 1064 N LEU A 68 -3.497 4.250 -12.413 1.00 0.00 N ATOM 1065 CA LEU A 68 -4.108 5.430 -13.012 1.00 0.00 C ATOM 1066 C LEU A 68 -3.728 6.691 -12.242 1.00 0.00 C ATOM 1067 O LEU A 68 -3.126 7.610 -12.796 1.00 0.00 O ATOM 1068 CB LEU A 68 -5.631 5.279 -13.047 1.00 0.00 C ATOM 1069 CG LEU A 68 -6.137 3.942 -13.590 1.00 0.00 C ATOM 1070 CD1 LEU A 68 -7.617 3.768 -13.285 1.00 0.00 C ATOM 1071 CD2 LEU A 68 -5.884 3.846 -15.087 1.00 0.00 C ATOM 0 H LEU A 68 -4.017 3.858 -11.628 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.735 5.523 -14.032 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -6.017 5.413 -12.037 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -6.046 6.082 -13.656 1.00 0.00 H new ATOM 0 HG LEU A 68 -5.589 3.139 -13.096 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -7.960 2.811 -13.679 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -7.772 3.793 -12.206 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -8.182 4.575 -13.751 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -6.250 2.888 -15.457 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -6.406 4.656 -15.597 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -4.814 3.925 -15.281 1.00 0.00 H new ATOM 1083 N LYS A 69 -4.086 6.726 -10.962 1.00 0.00 N ATOM 1084 CA LYS A 69 -3.783 7.875 -10.117 1.00 0.00 C ATOM 1085 C LYS A 69 -2.624 7.564 -9.173 1.00 0.00 C ATOM 1086 O LYS A 69 -2.354 6.404 -8.866 1.00 0.00 O ATOM 1087 CB LYS A 69 -5.017 8.280 -9.309 1.00 0.00 C ATOM 1088 CG LYS A 69 -5.066 9.763 -8.977 1.00 0.00 C ATOM 1089 CD LYS A 69 -6.136 10.483 -9.782 1.00 0.00 C ATOM 1090 CE LYS A 69 -5.863 10.397 -11.276 1.00 0.00 C ATOM 1091 NZ LYS A 69 -7.099 10.098 -12.050 1.00 0.00 N ATOM 0 H LYS A 69 -4.585 5.973 -10.488 1.00 0.00 H new ATOM 0 HA LYS A 69 -3.492 8.703 -10.763 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -5.912 8.012 -9.870 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -5.038 7.707 -8.382 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -5.263 9.892 -7.913 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -4.094 10.214 -9.178 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -7.111 10.048 -9.564 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -6.179 11.529 -9.479 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -5.437 11.339 -11.622 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.120 9.622 -11.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -6.870 10.048 -13.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -7.492 9.187 -11.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -7.799 10.850 -11.890 1.00 0.00 H new ATOM 1105 N LYS A 70 -1.944 8.611 -8.717 1.00 0.00 N ATOM 1106 CA LYS A 70 -0.814 8.452 -7.808 1.00 0.00 C ATOM 1107 C LYS A 70 -1.094 9.129 -6.471 1.00 0.00 C ATOM 1108 O LYS A 70 -1.516 10.285 -6.425 1.00 0.00 O ATOM 1109 CB LYS A 70 0.456 9.033 -8.432 1.00 0.00 C ATOM 1110 CG LYS A 70 0.307 10.478 -8.881 1.00 0.00 C ATOM 1111 CD LYS A 70 1.659 11.153 -9.042 1.00 0.00 C ATOM 1112 CE LYS A 70 2.230 10.931 -10.433 1.00 0.00 C ATOM 1113 NZ LYS A 70 1.299 11.400 -11.497 1.00 0.00 N ATOM 0 H LYS A 70 -2.155 9.578 -8.962 1.00 0.00 H new ATOM 0 HA LYS A 70 -0.668 7.386 -7.632 1.00 0.00 H new ATOM 0 HB2 LYS A 70 1.269 8.968 -7.709 1.00 0.00 H new ATOM 0 HB3 LYS A 70 0.742 8.423 -9.289 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -0.233 10.512 -9.827 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -0.290 11.027 -8.153 1.00 0.00 H new ATOM 0 HD2 LYS A 70 1.558 12.222 -8.855 1.00 0.00 H new ATOM 0 HD3 LYS A 70 2.352 10.764 -8.296 1.00 0.00 H new ATOM 0 HE2 LYS A 70 3.180 11.458 -10.524 1.00 0.00 H new ATOM 0 HE3 LYS A 70 2.439 9.871 -10.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 1.843 11.664 -12.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 0.634 10.637 -11.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 0.768 12.226 -11.155 1.00 0.00 H new ATOM 1127 N ILE A 71 -0.856 8.403 -5.383 1.00 0.00 N ATOM 1128 CA ILE A 71 -1.083 8.933 -4.045 1.00 0.00 C ATOM 1129 C ILE A 71 0.033 9.889 -3.636 1.00 0.00 C ATOM 1130 O ILE A 71 1.208 9.520 -3.624 1.00 0.00 O ATOM 1131 CB ILE A 71 -1.183 7.804 -3.002 1.00 0.00 C ATOM 1132 CG1 ILE A 71 -2.162 6.727 -3.475 1.00 0.00 C ATOM 1133 CG2 ILE A 71 -1.614 8.363 -1.654 1.00 0.00 C ATOM 1134 CD1 ILE A 71 -3.559 7.252 -3.729 1.00 0.00 C ATOM 0 H ILE A 71 -0.506 7.445 -5.403 1.00 0.00 H new ATOM 0 HA ILE A 71 -2.029 9.474 -4.076 1.00 0.00 H new ATOM 0 HB ILE A 71 -0.199 7.349 -2.887 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -1.780 6.276 -4.391 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -2.210 5.936 -2.726 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -1.680 7.552 -0.928 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -0.883 9.096 -1.314 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -2.588 8.841 -1.753 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -4.200 6.435 -4.061 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -3.961 7.677 -2.809 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -3.524 8.022 -4.500 1.00 0.00 H new ATOM 1146 N SER A 72 -0.342 11.119 -3.301 1.00 0.00 N ATOM 1147 CA SER A 72 0.627 12.130 -2.891 1.00 0.00 C ATOM 1148 C SER A 72 0.509 12.422 -1.398 1.00 0.00 C ATOM 1149 O SER A 72 1.495 12.752 -0.740 1.00 0.00 O ATOM 1150 CB SER A 72 0.425 13.416 -3.692 1.00 0.00 C ATOM 1151 OG SER A 72 1.569 14.249 -3.621 1.00 0.00 O ATOM 0 H SER A 72 -1.310 11.440 -3.305 1.00 0.00 H new ATOM 0 HA SER A 72 1.626 11.741 -3.089 1.00 0.00 H new ATOM 0 HB2 SER A 72 0.215 13.170 -4.733 1.00 0.00 H new ATOM 0 HB3 SER A 72 -0.443 13.953 -3.310 1.00 0.00 H new ATOM 0 HG SER A 72 1.413 15.064 -4.143 1.00 0.00 H new ATOM 1157 N SER A 73 -0.705 12.299 -0.871 1.00 0.00 N ATOM 1158 CA SER A 73 -0.953 12.549 0.543 1.00 0.00 C ATOM 1159 C SER A 73 -1.638 11.353 1.196 1.00 0.00 C ATOM 1160 O SER A 73 -1.987 10.383 0.525 1.00 0.00 O ATOM 1161 CB SER A 73 -1.814 13.802 0.717 1.00 0.00 C ATOM 1162 OG SER A 73 -1.010 14.958 0.873 1.00 0.00 O ATOM 0 H SER A 73 -1.532 12.028 -1.403 1.00 0.00 H new ATOM 0 HA SER A 73 0.008 12.705 1.032 1.00 0.00 H new ATOM 0 HB2 SER A 73 -2.465 13.923 -0.149 1.00 0.00 H new ATOM 0 HB3 SER A 73 -2.460 13.685 1.587 1.00 0.00 H new ATOM 0 HG SER A 73 -1.585 15.744 0.981 1.00 0.00 H new ATOM 1168 N LEU A 74 -1.826 11.430 2.510 1.00 0.00 N ATOM 1169 CA LEU A 74 -2.468 10.353 3.254 1.00 0.00 C ATOM 1170 C LEU A 74 -3.983 10.398 3.077 1.00 0.00 C ATOM 1171 O LEU A 74 -4.647 9.362 3.068 1.00 0.00 O ATOM 1172 CB LEU A 74 -2.114 10.449 4.739 1.00 0.00 C ATOM 1173 CG LEU A 74 -0.626 10.633 5.039 1.00 0.00 C ATOM 1174 CD1 LEU A 74 -0.433 11.496 6.275 1.00 0.00 C ATOM 1175 CD2 LEU A 74 0.051 9.281 5.219 1.00 0.00 C ATOM 0 H LEU A 74 -1.543 12.227 3.081 1.00 0.00 H new ATOM 0 HA LEU A 74 -2.102 9.405 2.861 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -2.663 11.284 5.174 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -2.461 9.544 5.239 1.00 0.00 H new ATOM 0 HG LEU A 74 -0.164 11.140 4.192 1.00 0.00 H new ATOM 0 HD11 LEU A 74 0.632 11.616 6.473 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -0.883 12.475 6.109 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -0.909 11.018 7.131 1.00 0.00 H new ATOM 0 HD21 LEU A 74 1.110 9.430 5.432 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -0.415 8.748 6.048 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.057 8.696 4.306 1.00 0.00 H new ATOM 1187 N ASP A 75 -4.522 11.604 2.939 1.00 0.00 N ATOM 1188 CA ASP A 75 -5.958 11.785 2.763 1.00 0.00 C ATOM 1189 C ASP A 75 -6.433 11.134 1.467 1.00 0.00 C ATOM 1190 O ASP A 75 -7.562 10.649 1.381 1.00 0.00 O ATOM 1191 CB ASP A 75 -6.308 13.275 2.760 1.00 0.00 C ATOM 1192 CG ASP A 75 -7.402 13.613 3.755 1.00 0.00 C ATOM 1193 OD1 ASP A 75 -8.589 13.565 3.371 1.00 0.00 O ATOM 1194 OD2 ASP A 75 -7.070 13.926 4.918 1.00 0.00 O ATOM 0 H ASP A 75 -3.986 12.472 2.946 1.00 0.00 H new ATOM 0 HA ASP A 75 -6.466 11.302 3.597 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -5.416 13.856 2.994 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -6.627 13.569 1.760 1.00 0.00 H new ATOM 1199 N GLN A 76 -5.564 11.125 0.461 1.00 0.00 N ATOM 1200 CA GLN A 76 -5.896 10.535 -0.830 1.00 0.00 C ATOM 1201 C GLN A 76 -6.166 9.039 -0.691 1.00 0.00 C ATOM 1202 O GLN A 76 -6.959 8.469 -1.440 1.00 0.00 O ATOM 1203 CB GLN A 76 -4.759 10.768 -1.828 1.00 0.00 C ATOM 1204 CG GLN A 76 -4.431 12.237 -2.041 1.00 0.00 C ATOM 1205 CD GLN A 76 -4.690 12.693 -3.465 1.00 0.00 C ATOM 1206 OE1 GLN A 76 -5.619 12.221 -4.121 1.00 0.00 O ATOM 1207 NE2 GLN A 76 -3.866 13.614 -3.950 1.00 0.00 N ATOM 0 H GLN A 76 -4.625 11.520 0.515 1.00 0.00 H new ATOM 0 HA GLN A 76 -6.801 11.017 -1.200 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -3.866 10.252 -1.476 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -5.029 10.322 -2.785 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -5.026 12.841 -1.356 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -3.384 12.411 -1.792 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -3.109 13.977 -3.371 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.990 13.958 -4.902 1.00 0.00 H new ATOM 1216 N LEU A 77 -5.501 8.409 0.273 1.00 0.00 N ATOM 1217 CA LEU A 77 -5.670 6.979 0.510 1.00 0.00 C ATOM 1218 C LEU A 77 -7.122 6.651 0.840 1.00 0.00 C ATOM 1219 O LEU A 77 -7.942 7.546 1.048 1.00 0.00 O ATOM 1220 CB LEU A 77 -4.759 6.519 1.649 1.00 0.00 C ATOM 1221 CG LEU A 77 -3.263 6.550 1.335 1.00 0.00 C ATOM 1222 CD1 LEU A 77 -2.448 6.424 2.613 1.00 0.00 C ATOM 1223 CD2 LEU A 77 -2.903 5.442 0.357 1.00 0.00 C ATOM 0 H LEU A 77 -4.841 8.866 0.902 1.00 0.00 H new ATOM 0 HA LEU A 77 -5.395 6.449 -0.402 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -4.945 7.148 2.519 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -5.035 5.502 1.926 1.00 0.00 H new ATOM 0 HG LEU A 77 -3.026 7.508 0.871 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.386 6.448 2.371 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.687 7.252 3.280 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.687 5.481 3.105 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.835 5.478 0.144 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.154 4.475 0.794 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -3.462 5.578 -0.569 1.00 0.00 H new ATOM 1235 N VAL A 78 -7.435 5.359 0.885 1.00 0.00 N ATOM 1236 CA VAL A 78 -8.789 4.911 1.190 1.00 0.00 C ATOM 1237 C VAL A 78 -8.773 3.726 2.149 1.00 0.00 C ATOM 1238 O VAL A 78 -7.768 3.024 2.266 1.00 0.00 O ATOM 1239 CB VAL A 78 -9.550 4.513 -0.089 1.00 0.00 C ATOM 1240 CG1 VAL A 78 -11.013 4.239 0.224 1.00 0.00 C ATOM 1241 CG2 VAL A 78 -9.417 5.596 -1.149 1.00 0.00 C ATOM 0 H VAL A 78 -6.770 4.605 0.714 1.00 0.00 H new ATOM 0 HA VAL A 78 -9.301 5.749 1.662 1.00 0.00 H new ATOM 0 HB VAL A 78 -9.109 3.597 -0.482 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -11.535 3.959 -0.691 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -11.084 3.425 0.946 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -11.470 5.136 0.642 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -9.961 5.297 -2.045 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -9.830 6.530 -0.769 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -8.364 5.738 -1.394 1.00 0.00 H new ATOM 1251 N GLU A 79 -9.892 3.509 2.833 1.00 0.00 N ATOM 1252 CA GLU A 79 -10.006 2.409 3.782 1.00 0.00 C ATOM 1253 C GLU A 79 -10.299 1.096 3.062 1.00 0.00 C ATOM 1254 O GLU A 79 -11.396 0.894 2.541 1.00 0.00 O ATOM 1255 CB GLU A 79 -11.107 2.701 4.804 1.00 0.00 C ATOM 1256 CG GLU A 79 -10.784 2.209 6.204 1.00 0.00 C ATOM 1257 CD GLU A 79 -11.992 1.627 6.911 1.00 0.00 C ATOM 1258 OE1 GLU A 79 -12.839 1.011 6.230 1.00 0.00 O ATOM 1259 OE2 GLU A 79 -12.090 1.786 8.146 1.00 0.00 O ATOM 0 H GLU A 79 -10.732 4.081 2.747 1.00 0.00 H new ATOM 0 HA GLU A 79 -9.053 2.312 4.303 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -11.284 3.776 4.838 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -12.034 2.236 4.469 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -10.001 1.452 6.148 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -10.386 3.036 6.793 1.00 0.00 H new ATOM 1266 N GLY A 80 -9.311 0.207 3.038 1.00 0.00 N ATOM 1267 CA GLY A 80 -9.482 -1.075 2.380 1.00 0.00 C ATOM 1268 C GLY A 80 -9.162 -1.014 0.899 1.00 0.00 C ATOM 1269 O GLY A 80 -9.992 -1.371 0.062 1.00 0.00 O ATOM 0 H GLY A 80 -8.395 0.352 3.463 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -8.838 -1.814 2.858 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -10.509 -1.414 2.513 1.00 0.00 H new ATOM 1273 N GLU A 81 -7.955 -0.563 0.575 1.00 0.00 N ATOM 1274 CA GLU A 81 -7.527 -0.457 -0.816 1.00 0.00 C ATOM 1275 C GLU A 81 -6.089 -0.939 -0.980 1.00 0.00 C ATOM 1276 O GLU A 81 -5.371 -1.127 0.001 1.00 0.00 O ATOM 1277 CB GLU A 81 -7.653 0.989 -1.303 1.00 0.00 C ATOM 1278 CG GLU A 81 -8.956 1.272 -2.033 1.00 0.00 C ATOM 1279 CD GLU A 81 -9.148 0.384 -3.248 1.00 0.00 C ATOM 1280 OE1 GLU A 81 -8.698 0.774 -4.345 1.00 0.00 O ATOM 1281 OE2 GLU A 81 -9.748 -0.701 -3.101 1.00 0.00 O ATOM 0 H GLU A 81 -7.256 -0.265 1.256 1.00 0.00 H new ATOM 0 HA GLU A 81 -8.175 -1.093 -1.419 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -7.572 1.660 -0.448 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -6.818 1.215 -1.966 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -9.791 1.129 -1.347 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -8.975 2.316 -2.344 1.00 0.00 H new ATOM 1288 N SER A 82 -5.676 -1.137 -2.228 1.00 0.00 N ATOM 1289 CA SER A 82 -4.323 -1.597 -2.522 1.00 0.00 C ATOM 1290 C SER A 82 -3.632 -0.660 -3.507 1.00 0.00 C ATOM 1291 O SER A 82 -4.242 -0.198 -4.473 1.00 0.00 O ATOM 1292 CB SER A 82 -4.357 -3.018 -3.089 1.00 0.00 C ATOM 1293 OG SER A 82 -4.164 -3.979 -2.066 1.00 0.00 O ATOM 0 H SER A 82 -6.258 -0.986 -3.052 1.00 0.00 H new ATOM 0 HA SER A 82 -3.756 -1.598 -1.591 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.313 -3.194 -3.582 1.00 0.00 H new ATOM 0 HB3 SER A 82 -3.582 -3.129 -3.848 1.00 0.00 H new ATOM 0 HG SER A 82 -3.360 -4.505 -2.259 1.00 0.00 H new ATOM 1299 N TYR A 83 -2.356 -0.382 -3.257 1.00 0.00 N ATOM 1300 CA TYR A 83 -1.583 0.500 -4.123 1.00 0.00 C ATOM 1301 C TYR A 83 -0.188 -0.067 -4.372 1.00 0.00 C ATOM 1302 O TYR A 83 0.329 -0.844 -3.569 1.00 0.00 O ATOM 1303 CB TYR A 83 -1.476 1.894 -3.502 1.00 0.00 C ATOM 1304 CG TYR A 83 -2.804 2.456 -3.044 1.00 0.00 C ATOM 1305 CD1 TYR A 83 -3.418 1.989 -1.889 1.00 0.00 C ATOM 1306 CD2 TYR A 83 -3.442 3.455 -3.769 1.00 0.00 C ATOM 1307 CE1 TYR A 83 -4.631 2.500 -1.469 1.00 0.00 C ATOM 1308 CE2 TYR A 83 -4.655 3.972 -3.354 1.00 0.00 C ATOM 1309 CZ TYR A 83 -5.245 3.491 -2.205 1.00 0.00 C ATOM 1310 OH TYR A 83 -6.453 4.003 -1.789 1.00 0.00 O ATOM 0 H TYR A 83 -1.836 -0.755 -2.462 1.00 0.00 H new ATOM 0 HA TYR A 83 -2.101 0.575 -5.079 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -0.796 1.853 -2.651 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -1.035 2.574 -4.230 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -2.939 1.213 -1.310 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -2.983 3.833 -4.671 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -5.096 2.125 -0.569 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -5.138 4.749 -3.927 1.00 0.00 H new ATOM 0 HH TYR A 83 -6.749 4.694 -2.418 1.00 0.00 H new ATOM 1320 N VAL A 84 0.415 0.328 -5.488 1.00 0.00 N ATOM 1321 CA VAL A 84 1.750 -0.141 -5.842 1.00 0.00 C ATOM 1322 C VAL A 84 2.805 0.911 -5.519 1.00 0.00 C ATOM 1323 O VAL A 84 2.706 2.059 -5.954 1.00 0.00 O ATOM 1324 CB VAL A 84 1.841 -0.500 -7.337 1.00 0.00 C ATOM 1325 CG1 VAL A 84 3.170 -1.172 -7.645 1.00 0.00 C ATOM 1326 CG2 VAL A 84 0.678 -1.392 -7.744 1.00 0.00 C ATOM 0 H VAL A 84 0.001 0.971 -6.163 1.00 0.00 H new ATOM 0 HA VAL A 84 1.939 -1.036 -5.249 1.00 0.00 H new ATOM 0 HB VAL A 84 1.783 0.421 -7.917 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.216 -1.418 -8.706 1.00 0.00 H new ATOM 0 HG12 VAL A 84 3.987 -0.495 -7.394 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.261 -2.085 -7.056 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.759 -1.635 -8.803 1.00 0.00 H new ATOM 0 HG22 VAL A 84 0.702 -2.311 -7.158 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -0.262 -0.870 -7.563 1.00 0.00 H new ATOM 1336 N CYS A 85 3.815 0.513 -4.752 1.00 0.00 N ATOM 1337 CA CYS A 85 4.890 1.421 -4.371 1.00 0.00 C ATOM 1338 C CYS A 85 5.915 1.554 -5.492 1.00 0.00 C ATOM 1339 O CYS A 85 6.329 0.560 -6.089 1.00 0.00 O ATOM 1340 CB CYS A 85 5.575 0.927 -3.095 1.00 0.00 C ATOM 1341 SG CYS A 85 4.825 1.543 -1.570 1.00 0.00 S ATOM 0 H CYS A 85 3.911 -0.433 -4.382 1.00 0.00 H new ATOM 0 HA CYS A 85 4.453 2.402 -4.185 1.00 0.00 H new ATOM 0 HB2 CYS A 85 5.555 -0.163 -3.083 1.00 0.00 H new ATOM 0 HB3 CYS A 85 6.623 1.226 -3.119 1.00 0.00 H new ATOM 0 HG CYS A 85 5.589 1.247 -0.560 1.00 0.00 H new ATOM 1347 N GLY A 86 6.320 2.788 -5.775 1.00 0.00 N ATOM 1348 CA GLY A 86 7.292 3.028 -6.823 1.00 0.00 C ATOM 1349 C GLY A 86 8.229 4.174 -6.495 1.00 0.00 C ATOM 1350 O GLY A 86 8.192 4.717 -5.391 1.00 0.00 O ATOM 0 H GLY A 86 5.991 3.626 -5.296 1.00 0.00 H new ATOM 0 HA2 GLY A 86 7.875 2.122 -6.988 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.770 3.245 -7.755 1.00 0.00 H new ATOM 1354 N SER A 87 9.070 4.542 -7.456 1.00 0.00 N ATOM 1355 CA SER A 87 10.021 5.631 -7.262 1.00 0.00 C ATOM 1356 C SER A 87 10.350 6.309 -8.589 1.00 0.00 C ATOM 1357 O SER A 87 9.876 7.410 -8.869 1.00 0.00 O ATOM 1358 CB SER A 87 11.303 5.107 -6.612 1.00 0.00 C ATOM 1359 OG SER A 87 12.290 6.121 -6.541 1.00 0.00 O ATOM 0 H SER A 87 9.113 4.103 -8.376 1.00 0.00 H new ATOM 0 HA SER A 87 9.562 6.367 -6.602 1.00 0.00 H new ATOM 0 HB2 SER A 87 11.082 4.739 -5.610 1.00 0.00 H new ATOM 0 HB3 SER A 87 11.686 4.262 -7.185 1.00 0.00 H new ATOM 0 HG SER A 87 13.099 5.761 -6.120 1.00 0.00 H new ATOM 1365 N ILE A 88 11.163 5.644 -9.403 1.00 0.00 N ATOM 1366 CA ILE A 88 11.555 6.182 -10.699 1.00 0.00 C ATOM 1367 C ILE A 88 11.005 5.330 -11.838 1.00 0.00 C ATOM 1368 O ILE A 88 10.617 5.849 -12.884 1.00 0.00 O ATOM 1369 CB ILE A 88 13.087 6.268 -10.834 1.00 0.00 C ATOM 1370 CG1 ILE A 88 13.720 4.896 -10.595 1.00 0.00 C ATOM 1371 CG2 ILE A 88 13.649 7.293 -9.859 1.00 0.00 C ATOM 1372 CD1 ILE A 88 15.222 4.882 -10.785 1.00 0.00 C ATOM 0 H ILE A 88 11.563 4.731 -9.187 1.00 0.00 H new ATOM 0 HA ILE A 88 11.135 7.186 -10.762 1.00 0.00 H new ATOM 0 HB ILE A 88 13.329 6.588 -11.847 1.00 0.00 H new ATOM 0 HG12 ILE A 88 13.487 4.569 -9.582 1.00 0.00 H new ATOM 0 HG13 ILE A 88 13.269 4.173 -11.275 1.00 0.00 H new ATOM 0 HG21 ILE A 88 14.733 7.342 -9.967 1.00 0.00 H new ATOM 0 HG22 ILE A 88 13.219 8.272 -10.072 1.00 0.00 H new ATOM 0 HG23 ILE A 88 13.399 7.001 -8.839 1.00 0.00 H new ATOM 0 HD11 ILE A 88 15.603 3.878 -10.599 1.00 0.00 H new ATOM 0 HD12 ILE A 88 15.462 5.178 -11.806 1.00 0.00 H new ATOM 0 HD13 ILE A 88 15.684 5.580 -10.086 1.00 0.00 H new ATOM 1384 N GLU A 89 10.975 4.018 -11.627 1.00 0.00 N ATOM 1385 CA GLU A 89 10.473 3.093 -12.636 1.00 0.00 C ATOM 1386 C GLU A 89 8.982 3.312 -12.882 1.00 0.00 C ATOM 1387 O GLU A 89 8.243 3.690 -11.974 1.00 0.00 O ATOM 1388 CB GLU A 89 10.723 1.647 -12.202 1.00 0.00 C ATOM 1389 CG GLU A 89 10.012 1.267 -10.913 1.00 0.00 C ATOM 1390 CD GLU A 89 10.976 0.922 -9.794 1.00 0.00 C ATOM 1391 OE1 GLU A 89 11.774 1.801 -9.405 1.00 0.00 O ATOM 1392 OE2 GLU A 89 10.932 -0.227 -9.306 1.00 0.00 O ATOM 0 H GLU A 89 11.292 3.572 -10.766 1.00 0.00 H new ATOM 0 HA GLU A 89 11.008 3.284 -13.566 1.00 0.00 H new ATOM 0 HB2 GLU A 89 10.398 0.976 -12.998 1.00 0.00 H new ATOM 0 HB3 GLU A 89 11.795 1.495 -12.074 1.00 0.00 H new ATOM 0 HG2 GLU A 89 9.375 2.093 -10.597 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.359 0.415 -11.100 1.00 0.00 H new ATOM 1399 N PRO A 90 8.518 3.076 -14.122 1.00 0.00 N ATOM 1400 CA PRO A 90 7.108 3.250 -14.484 1.00 0.00 C ATOM 1401 C PRO A 90 6.217 2.174 -13.871 1.00 0.00 C ATOM 1402 O PRO A 90 6.703 1.148 -13.396 1.00 0.00 O ATOM 1403 CB PRO A 90 7.116 3.132 -16.009 1.00 0.00 C ATOM 1404 CG PRO A 90 8.305 2.290 -16.316 1.00 0.00 C ATOM 1405 CD PRO A 90 9.332 2.622 -15.268 1.00 0.00 C ATOM 0 HA PRO A 90 6.706 4.195 -14.119 1.00 0.00 H new ATOM 0 HB2 PRO A 90 6.199 2.671 -16.375 1.00 0.00 H new ATOM 0 HB3 PRO A 90 7.191 4.111 -16.482 1.00 0.00 H new ATOM 0 HG2 PRO A 90 8.050 1.231 -16.290 1.00 0.00 H new ATOM 0 HG3 PRO A 90 8.685 2.502 -17.315 1.00 0.00 H new ATOM 0 HD2 PRO A 90 9.939 1.754 -15.011 1.00 0.00 H new ATOM 0 HD3 PRO A 90 10.016 3.400 -15.608 1.00 0.00 H new ATOM 1413 N PHE A 91 4.910 2.415 -13.887 1.00 0.00 N ATOM 1414 CA PHE A 91 3.951 1.467 -13.333 1.00 0.00 C ATOM 1415 C PHE A 91 3.944 0.171 -14.136 1.00 0.00 C ATOM 1416 O PHE A 91 4.127 0.181 -15.353 1.00 0.00 O ATOM 1417 CB PHE A 91 2.549 2.077 -13.318 1.00 0.00 C ATOM 1418 CG PHE A 91 1.550 1.270 -12.538 1.00 0.00 C ATOM 1419 CD1 PHE A 91 1.450 1.410 -11.164 1.00 0.00 C ATOM 1420 CD2 PHE A 91 0.713 0.372 -13.181 1.00 0.00 C ATOM 1421 CE1 PHE A 91 0.532 0.669 -10.444 1.00 0.00 C ATOM 1422 CE2 PHE A 91 -0.206 -0.372 -12.466 1.00 0.00 C ATOM 1423 CZ PHE A 91 -0.298 -0.223 -11.096 1.00 0.00 C ATOM 0 H PHE A 91 4.491 3.259 -14.278 1.00 0.00 H new ATOM 0 HA PHE A 91 4.252 1.240 -12.310 1.00 0.00 H new ATOM 0 HB2 PHE A 91 2.603 3.080 -12.895 1.00 0.00 H new ATOM 0 HB3 PHE A 91 2.197 2.182 -14.344 1.00 0.00 H new ATOM 0 HD1 PHE A 91 2.096 2.106 -10.649 1.00 0.00 H new ATOM 0 HD2 PHE A 91 0.780 0.252 -14.252 1.00 0.00 H new ATOM 0 HE1 PHE A 91 0.463 0.787 -9.373 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -0.852 -1.070 -12.978 1.00 0.00 H new ATOM 0 HZ PHE A 91 -1.017 -0.802 -10.536 1.00 0.00 H new ATOM 1433 N LYS A 92 3.733 -0.946 -13.446 1.00 0.00 N ATOM 1434 CA LYS A 92 3.704 -2.251 -14.097 1.00 0.00 C ATOM 1435 C LYS A 92 2.403 -2.986 -13.785 1.00 0.00 C ATOM 1436 O LYS A 92 1.984 -3.063 -12.630 1.00 0.00 O ATOM 1437 CB LYS A 92 4.899 -3.094 -13.647 1.00 0.00 C ATOM 1438 CG LYS A 92 6.195 -2.736 -14.355 1.00 0.00 C ATOM 1439 CD LYS A 92 7.391 -2.859 -13.425 1.00 0.00 C ATOM 1440 CE LYS A 92 8.662 -2.345 -14.081 1.00 0.00 C ATOM 1441 NZ LYS A 92 9.864 -3.104 -13.634 1.00 0.00 N ATOM 0 H LYS A 92 3.580 -0.973 -12.438 1.00 0.00 H new ATOM 0 HA LYS A 92 3.763 -2.094 -15.174 1.00 0.00 H new ATOM 0 HB2 LYS A 92 5.036 -2.972 -12.573 1.00 0.00 H new ATOM 0 HB3 LYS A 92 4.677 -4.147 -13.822 1.00 0.00 H new ATOM 0 HG2 LYS A 92 6.333 -3.390 -15.216 1.00 0.00 H new ATOM 0 HG3 LYS A 92 6.133 -1.717 -14.736 1.00 0.00 H new ATOM 0 HD2 LYS A 92 7.201 -2.299 -12.510 1.00 0.00 H new ATOM 0 HD3 LYS A 92 7.525 -3.902 -13.138 1.00 0.00 H new ATOM 0 HE2 LYS A 92 8.567 -2.420 -15.164 1.00 0.00 H new ATOM 0 HE3 LYS A 92 8.791 -1.289 -13.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 10.710 -2.723 -14.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 9.969 -3.012 -12.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 9.753 -4.108 -13.882 1.00 0.00 H new ATOM 1455 N LYS A 93 1.769 -3.522 -14.822 1.00 0.00 N ATOM 1456 CA LYS A 93 0.516 -4.248 -14.659 1.00 0.00 C ATOM 1457 C LYS A 93 0.777 -5.721 -14.353 1.00 0.00 C ATOM 1458 O LYS A 93 1.147 -6.493 -15.238 1.00 0.00 O ATOM 1459 CB LYS A 93 -0.340 -4.118 -15.922 1.00 0.00 C ATOM 1460 CG LYS A 93 -1.743 -3.596 -15.654 1.00 0.00 C ATOM 1461 CD LYS A 93 -2.783 -4.697 -15.776 1.00 0.00 C ATOM 1462 CE LYS A 93 -4.098 -4.297 -15.126 1.00 0.00 C ATOM 1463 NZ LYS A 93 -4.761 -3.182 -15.856 1.00 0.00 N ATOM 0 H LYS A 93 2.103 -3.467 -15.784 1.00 0.00 H new ATOM 0 HA LYS A 93 -0.023 -3.812 -13.818 1.00 0.00 H new ATOM 0 HB2 LYS A 93 0.160 -3.449 -16.623 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -0.410 -5.092 -16.406 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.786 -3.163 -14.654 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.975 -2.796 -16.358 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.951 -4.925 -16.829 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.407 -5.607 -15.309 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -4.765 -5.159 -15.096 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -3.917 -3.998 -14.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -5.654 -2.939 -15.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -4.135 -2.351 -15.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -4.958 -3.476 -16.834 1.00 0.00 H new ATOM 1477 N LEU A 94 0.583 -6.101 -13.095 1.00 0.00 N ATOM 1478 CA LEU A 94 0.797 -7.481 -12.671 1.00 0.00 C ATOM 1479 C LEU A 94 -0.376 -7.982 -11.836 1.00 0.00 C ATOM 1480 O LEU A 94 -1.187 -7.194 -11.351 1.00 0.00 O ATOM 1481 CB LEU A 94 2.095 -7.594 -11.869 1.00 0.00 C ATOM 1482 CG LEU A 94 3.364 -7.213 -12.632 1.00 0.00 C ATOM 1483 CD1 LEU A 94 4.580 -7.298 -11.723 1.00 0.00 C ATOM 1484 CD2 LEU A 94 3.542 -8.110 -13.848 1.00 0.00 C ATOM 0 H LEU A 94 0.278 -5.474 -12.351 1.00 0.00 H new ATOM 0 HA LEU A 94 0.874 -8.102 -13.564 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.015 -6.959 -10.987 1.00 0.00 H new ATOM 0 HB3 LEU A 94 2.197 -8.620 -11.515 1.00 0.00 H new ATOM 0 HG LEU A 94 3.264 -6.183 -12.975 1.00 0.00 H new ATOM 0 HD11 LEU A 94 5.473 -7.023 -12.284 1.00 0.00 H new ATOM 0 HD12 LEU A 94 4.455 -6.615 -10.883 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.685 -8.317 -11.350 1.00 0.00 H new ATOM 0 HD21 LEU A 94 4.450 -7.826 -14.380 1.00 0.00 H new ATOM 0 HD22 LEU A 94 3.620 -9.148 -13.526 1.00 0.00 H new ATOM 0 HD23 LEU A 94 2.683 -7.999 -14.510 1.00 0.00 H new ATOM 1496 N GLU A 95 -0.458 -9.298 -11.670 1.00 0.00 N ATOM 1497 CA GLU A 95 -1.532 -9.904 -10.891 1.00 0.00 C ATOM 1498 C GLU A 95 -1.210 -9.868 -9.401 1.00 0.00 C ATOM 1499 O GLU A 95 -0.611 -10.798 -8.862 1.00 0.00 O ATOM 1500 CB GLU A 95 -1.763 -11.349 -11.341 1.00 0.00 C ATOM 1501 CG GLU A 95 -2.797 -11.484 -12.446 1.00 0.00 C ATOM 1502 CD GLU A 95 -2.541 -12.680 -13.341 1.00 0.00 C ATOM 1503 OE1 GLU A 95 -1.619 -12.609 -14.180 1.00 0.00 O ATOM 1504 OE2 GLU A 95 -3.263 -13.691 -13.202 1.00 0.00 O ATOM 0 H GLU A 95 0.206 -9.965 -12.064 1.00 0.00 H new ATOM 0 HA GLU A 95 -2.441 -9.328 -11.061 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -0.818 -11.769 -11.686 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -2.081 -11.942 -10.483 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -3.788 -11.573 -12.002 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -2.798 -10.577 -13.050 1.00 0.00 H new ATOM 1511 N TYR A 96 -1.614 -8.788 -8.740 1.00 0.00 N ATOM 1512 CA TYR A 96 -1.368 -8.628 -7.311 1.00 0.00 C ATOM 1513 C TYR A 96 -2.446 -9.332 -6.492 1.00 0.00 C ATOM 1514 O TYR A 96 -2.150 -10.209 -5.682 1.00 0.00 O ATOM 1515 CB TYR A 96 -1.317 -7.145 -6.943 1.00 0.00 C ATOM 1516 CG TYR A 96 -0.153 -6.406 -7.562 1.00 0.00 C ATOM 1517 CD1 TYR A 96 1.140 -6.585 -7.085 1.00 0.00 C ATOM 1518 CD2 TYR A 96 -0.346 -5.531 -8.624 1.00 0.00 C ATOM 1519 CE1 TYR A 96 2.207 -5.910 -7.648 1.00 0.00 C ATOM 1520 CE2 TYR A 96 0.716 -4.855 -9.193 1.00 0.00 C ATOM 1521 CZ TYR A 96 1.990 -5.048 -8.702 1.00 0.00 C ATOM 1522 OH TYR A 96 3.051 -4.375 -9.265 1.00 0.00 O ATOM 0 H TYR A 96 -2.113 -8.010 -9.171 1.00 0.00 H new ATOM 0 HA TYR A 96 -0.405 -9.084 -7.080 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -2.246 -6.670 -7.257 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -1.261 -7.050 -5.859 1.00 0.00 H new ATOM 0 HD1 TYR A 96 1.314 -7.262 -6.262 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -1.342 -5.377 -9.011 1.00 0.00 H new ATOM 0 HE1 TYR A 96 3.206 -6.057 -7.264 1.00 0.00 H new ATOM 0 HE2 TYR A 96 0.549 -4.179 -10.018 1.00 0.00 H new ATOM 0 HH TYR A 96 2.728 -3.809 -9.997 1.00 0.00 H new ATOM 1532 N THR A 97 -3.698 -8.938 -6.709 1.00 0.00 N ATOM 1533 CA THR A 97 -4.822 -9.529 -5.990 1.00 0.00 C ATOM 1534 C THR A 97 -4.864 -11.043 -6.184 1.00 0.00 C ATOM 1535 O THR A 97 -5.359 -11.774 -5.328 1.00 0.00 O ATOM 1536 CB THR A 97 -6.138 -8.907 -6.459 1.00 0.00 C ATOM 1537 OG1 THR A 97 -6.428 -9.293 -7.791 1.00 0.00 O ATOM 1538 CG2 THR A 97 -6.136 -7.394 -6.410 1.00 0.00 C ATOM 0 H THR A 97 -3.959 -8.212 -7.377 1.00 0.00 H new ATOM 0 HA THR A 97 -4.687 -9.323 -4.928 1.00 0.00 H new ATOM 0 HB THR A 97 -6.895 -9.276 -5.767 1.00 0.00 H new ATOM 0 HG1 THR A 97 -7.274 -8.887 -8.072 1.00 0.00 H new ATOM 0 HG21 THR A 97 -7.099 -7.017 -6.756 1.00 0.00 H new ATOM 0 HG22 THR A 97 -5.964 -7.063 -5.386 1.00 0.00 H new ATOM 0 HG23 THR A 97 -5.344 -7.010 -7.053 1.00 0.00 H new ATOM 1546 N LYS A 98 -4.342 -11.505 -7.316 1.00 0.00 N ATOM 1547 CA LYS A 98 -4.320 -12.931 -7.621 1.00 0.00 C ATOM 1548 C LYS A 98 -3.575 -13.711 -6.542 1.00 0.00 C ATOM 1549 O LYS A 98 -3.877 -14.876 -6.285 1.00 0.00 O ATOM 1550 CB LYS A 98 -3.667 -13.172 -8.983 1.00 0.00 C ATOM 1551 CG LYS A 98 -4.187 -14.409 -9.698 1.00 0.00 C ATOM 1552 CD LYS A 98 -3.064 -15.176 -10.377 1.00 0.00 C ATOM 1553 CE LYS A 98 -2.475 -16.233 -9.458 1.00 0.00 C ATOM 1554 NZ LYS A 98 -1.707 -17.262 -10.213 1.00 0.00 N ATOM 0 H LYS A 98 -3.929 -10.913 -8.037 1.00 0.00 H new ATOM 0 HA LYS A 98 -5.351 -13.285 -7.651 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -3.834 -12.300 -9.616 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -2.590 -13.267 -8.848 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -4.691 -15.059 -8.983 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -4.929 -14.116 -10.441 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -3.442 -15.650 -11.283 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -2.281 -14.482 -10.683 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -1.821 -15.756 -8.728 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -3.277 -16.716 -8.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -1.322 -17.964 -9.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -2.336 -17.736 -10.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -0.926 -16.805 -10.726 1.00 0.00 H new ATOM 1568 N ASN A 99 -2.599 -13.062 -5.915 1.00 0.00 N ATOM 1569 CA ASN A 99 -1.810 -13.697 -4.865 1.00 0.00 C ATOM 1570 C ASN A 99 -2.123 -13.085 -3.503 1.00 0.00 C ATOM 1571 O ASN A 99 -1.260 -13.019 -2.628 1.00 0.00 O ATOM 1572 CB ASN A 99 -0.317 -13.560 -5.166 1.00 0.00 C ATOM 1573 CG ASN A 99 0.046 -14.085 -6.542 1.00 0.00 C ATOM 1574 OD1 ASN A 99 0.191 -15.292 -6.740 1.00 0.00 O ATOM 1575 ND2 ASN A 99 0.195 -13.179 -7.501 1.00 0.00 N ATOM 0 H ASN A 99 -2.336 -12.097 -6.116 1.00 0.00 H new ATOM 0 HA ASN A 99 -2.073 -14.754 -4.838 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -0.029 -12.511 -5.093 1.00 0.00 H new ATOM 0 HB3 ASN A 99 0.254 -14.101 -4.411 1.00 0.00 H new ATOM 0 HD21 ASN A 99 0.439 -13.473 -8.447 1.00 0.00 H new ATOM 0 HD22 ASN A 99 0.065 -12.189 -7.292 1.00 0.00 H new ATOM 1582 N VAL A 100 -3.363 -12.640 -3.330 1.00 0.00 N ATOM 1583 CA VAL A 100 -3.788 -12.034 -2.073 1.00 0.00 C ATOM 1584 C VAL A 100 -5.282 -12.239 -1.842 1.00 0.00 C ATOM 1585 O VAL A 100 -5.695 -12.740 -0.796 1.00 0.00 O ATOM 1586 CB VAL A 100 -3.476 -10.526 -2.042 1.00 0.00 C ATOM 1587 CG1 VAL A 100 -3.777 -9.944 -0.669 1.00 0.00 C ATOM 1588 CG2 VAL A 100 -2.026 -10.274 -2.430 1.00 0.00 C ATOM 0 H VAL A 100 -4.091 -12.687 -4.043 1.00 0.00 H new ATOM 0 HA VAL A 100 -3.229 -12.528 -1.278 1.00 0.00 H new ATOM 0 HB VAL A 100 -4.116 -10.027 -2.769 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -3.550 -8.878 -0.668 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -4.831 -10.091 -0.435 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -3.166 -10.446 0.081 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -1.823 -9.203 -2.403 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -1.367 -10.786 -1.729 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -1.848 -10.652 -3.437 1.00 0.00 H new ATOM 1598 N ASN A 101 -6.088 -11.846 -2.824 1.00 0.00 N ATOM 1599 CA ASN A 101 -7.536 -11.987 -2.726 1.00 0.00 C ATOM 1600 C ASN A 101 -8.084 -11.170 -1.556 1.00 0.00 C ATOM 1601 O ASN A 101 -7.374 -10.911 -0.584 1.00 0.00 O ATOM 1602 CB ASN A 101 -7.916 -13.461 -2.562 1.00 0.00 C ATOM 1603 CG ASN A 101 -8.801 -13.959 -3.688 1.00 0.00 C ATOM 1604 OD1 ASN A 101 -8.474 -13.805 -4.864 1.00 0.00 O ATOM 1605 ND2 ASN A 101 -9.930 -14.561 -3.331 1.00 0.00 N ATOM 0 H ASN A 101 -5.763 -11.428 -3.696 1.00 0.00 H new ATOM 0 HA ASN A 101 -7.978 -11.608 -3.647 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -7.009 -14.065 -2.522 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -8.432 -13.597 -1.611 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -10.566 -14.917 -4.045 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -10.161 -14.667 -2.343 1.00 0.00 H new ATOM 1612 N PRO A 102 -9.359 -10.754 -1.636 1.00 0.00 N ATOM 1613 CA PRO A 102 -9.999 -9.963 -0.579 1.00 0.00 C ATOM 1614 C PRO A 102 -10.222 -10.773 0.693 1.00 0.00 C ATOM 1615 O PRO A 102 -10.855 -11.828 0.666 1.00 0.00 O ATOM 1616 CB PRO A 102 -11.339 -9.557 -1.197 1.00 0.00 C ATOM 1617 CG PRO A 102 -11.616 -10.601 -2.222 1.00 0.00 C ATOM 1618 CD PRO A 102 -10.276 -11.019 -2.761 1.00 0.00 C ATOM 0 HA PRO A 102 -9.383 -9.117 -0.274 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -12.127 -9.522 -0.445 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -11.283 -8.566 -1.647 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -12.142 -11.449 -1.783 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -12.251 -10.209 -3.016 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -10.268 -12.071 -3.047 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -10.002 -10.446 -3.647 1.00 0.00 H new ATOM 1626 N ASN A 103 -9.697 -10.272 1.807 1.00 0.00 N ATOM 1627 CA ASN A 103 -9.839 -10.949 3.092 1.00 0.00 C ATOM 1628 C ASN A 103 -9.185 -10.140 4.207 1.00 0.00 C ATOM 1629 O ASN A 103 -9.709 -10.058 5.318 1.00 0.00 O ATOM 1630 CB ASN A 103 -9.216 -12.345 3.028 1.00 0.00 C ATOM 1631 CG ASN A 103 -9.960 -13.349 3.887 1.00 0.00 C ATOM 1632 OD1 ASN A 103 -11.013 -13.855 3.500 1.00 0.00 O ATOM 1633 ND2 ASN A 103 -9.414 -13.642 5.061 1.00 0.00 N ATOM 0 H ASN A 103 -9.170 -9.400 1.846 1.00 0.00 H new ATOM 0 HA ASN A 103 -10.903 -11.043 3.310 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -9.209 -12.690 1.994 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -8.177 -12.292 3.353 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -9.869 -14.311 5.682 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -8.539 -13.198 5.342 1.00 0.00 H new ATOM 1640 N TRP A 104 -8.036 -9.546 3.904 1.00 0.00 N ATOM 1641 CA TRP A 104 -7.305 -8.745 4.879 1.00 0.00 C ATOM 1642 C TRP A 104 -8.144 -7.564 5.357 1.00 0.00 C ATOM 1643 O TRP A 104 -8.203 -7.276 6.552 1.00 0.00 O ATOM 1644 CB TRP A 104 -5.996 -8.239 4.272 1.00 0.00 C ATOM 1645 CG TRP A 104 -6.199 -7.368 3.070 1.00 0.00 C ATOM 1646 CD1 TRP A 104 -6.501 -7.777 1.803 1.00 0.00 C ATOM 1647 CD2 TRP A 104 -6.116 -5.939 3.023 1.00 0.00 C ATOM 1648 NE1 TRP A 104 -6.611 -6.690 0.971 1.00 0.00 N ATOM 1649 CE2 TRP A 104 -6.380 -5.550 1.696 1.00 0.00 C ATOM 1650 CE3 TRP A 104 -5.846 -4.951 3.974 1.00 0.00 C ATOM 1651 CZ2 TRP A 104 -6.379 -4.216 1.297 1.00 0.00 C ATOM 1652 CZ3 TRP A 104 -5.847 -3.627 3.576 1.00 0.00 C ATOM 1653 CH2 TRP A 104 -6.113 -3.270 2.249 1.00 0.00 C ATOM 0 H TRP A 104 -7.590 -9.604 2.989 1.00 0.00 H new ATOM 0 HA TRP A 104 -7.082 -9.379 5.737 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -5.445 -7.680 5.028 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -5.379 -9.093 3.993 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -6.634 -8.805 1.499 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -6.829 -6.725 -0.025 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -5.640 -5.217 5.000 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -6.581 -3.938 0.273 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -5.639 -2.855 4.302 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -6.108 -2.226 1.971 1.00 0.00 H new ATOM 1664 N SER A 105 -8.786 -6.879 4.416 1.00 0.00 N ATOM 1665 CA SER A 105 -9.615 -5.724 4.744 1.00 0.00 C ATOM 1666 C SER A 105 -11.097 -6.082 4.714 1.00 0.00 C ATOM 1667 O SER A 105 -11.932 -5.268 4.320 1.00 0.00 O ATOM 1668 CB SER A 105 -9.336 -4.578 3.771 1.00 0.00 C ATOM 1669 OG SER A 105 -9.793 -3.342 4.292 1.00 0.00 O ATOM 0 H SER A 105 -8.748 -7.103 3.422 1.00 0.00 H new ATOM 0 HA SER A 105 -9.361 -5.406 5.755 1.00 0.00 H new ATOM 0 HB2 SER A 105 -8.266 -4.519 3.572 1.00 0.00 H new ATOM 0 HB3 SER A 105 -9.827 -4.778 2.819 1.00 0.00 H new ATOM 0 HG SER A 105 -10.741 -3.417 4.528 1.00 0.00 H new