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 28 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 48 THR OG1 : rot -77:sc= 1.14 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ -175:sc= -0.0317 (180deg=-0.0955) USER MOD Single : A 16 TYR OH : rot 180:sc= -0.139 USER MOD Single : A 18 ASN : amide:sc= -1.4 K(o=-1.4,f=-4.3!) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= -4.25! USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 72:sc= -1.58! USER MOD Single : A 50 SER OG : rot -30:sc= 0.352 USER MOD Single : A 52 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 ASN : amide:sc= -0.677 K(o=-0.68,f=-1.5) USER MOD Single : A 57 GLN : amide:sc= 0 K(o=0,f=-1.6!) 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= 0.418 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ -120:sc= -1.32 (180deg=-4.98!) 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= -0.0068 X(o=-0.0068,f=0) USER MOD Single : A 82 SER OG : rot 170:sc= -0.137 USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 CYS SG : rot -150:sc= -0.534 USER MOD Single : A 87 SER OG : rot 110:sc= -1.01 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 110:sc= -0.481 USER MOD Single : A 97 THR OG1 : rot -93:sc= 0.0591 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 ASN : amide:sc= 0.391 X(o=0.39,f=0) USER MOD Single : A 105 SER OG : rot -53:sc= 0.155 USER MOD ----------------------------------------------------------------- ATOM 112 N ALA A 10 -8.222 3.089 12.118 1.00 0.00 N ATOM 113 CA ALA A 10 -7.424 3.807 11.132 1.00 0.00 C ATOM 114 C ALA A 10 -7.701 3.292 9.723 1.00 0.00 C ATOM 115 O ALA A 10 -8.329 2.248 9.546 1.00 0.00 O ATOM 116 CB ALA A 10 -5.943 3.685 11.463 1.00 0.00 C ATOM 0 HA ALA A 10 -7.706 4.859 11.166 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -5.358 4.226 10.719 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -5.755 4.108 12.450 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -5.654 2.634 11.458 1.00 0.00 H new ATOM 122 N LYS A 11 -7.229 4.031 8.725 1.00 0.00 N ATOM 123 CA LYS A 11 -7.426 3.647 7.331 1.00 0.00 C ATOM 124 C LYS A 11 -6.566 2.440 6.973 1.00 0.00 C ATOM 125 O LYS A 11 -5.338 2.506 7.010 1.00 0.00 O ATOM 126 CB LYS A 11 -7.096 4.821 6.406 1.00 0.00 C ATOM 127 CG LYS A 11 -8.277 5.283 5.565 1.00 0.00 C ATOM 128 CD LYS A 11 -8.779 6.648 6.006 1.00 0.00 C ATOM 129 CE LYS A 11 -7.873 7.762 5.507 1.00 0.00 C ATOM 130 NZ LYS A 11 -8.464 9.108 5.745 1.00 0.00 N ATOM 0 H LYS A 11 -6.708 4.898 8.854 1.00 0.00 H new ATOM 0 HA LYS A 11 -8.473 3.374 7.198 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.739 5.657 7.007 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.279 4.533 5.744 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -7.983 5.324 4.516 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -9.085 4.556 5.641 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -9.790 6.804 5.630 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -8.835 6.682 7.094 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -6.907 7.696 6.008 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -7.689 7.630 4.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -7.815 9.840 5.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -9.374 9.181 5.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -8.616 9.245 6.765 1.00 0.00 H new ATOM 144 N LYS A 12 -7.220 1.336 6.625 1.00 0.00 N ATOM 145 CA LYS A 12 -6.516 0.113 6.259 1.00 0.00 C ATOM 146 C LYS A 12 -6.031 0.177 4.814 1.00 0.00 C ATOM 147 O LYS A 12 -6.744 -0.217 3.891 1.00 0.00 O ATOM 148 CB LYS A 12 -7.425 -1.102 6.451 1.00 0.00 C ATOM 149 CG LYS A 12 -7.340 -1.713 7.840 1.00 0.00 C ATOM 150 CD LYS A 12 -6.104 -2.585 7.990 1.00 0.00 C ATOM 151 CE LYS A 12 -5.916 -3.041 9.428 1.00 0.00 C ATOM 152 NZ LYS A 12 -4.901 -4.125 9.538 1.00 0.00 N ATOM 0 H LYS A 12 -8.237 1.264 6.589 1.00 0.00 H new ATOM 0 HA LYS A 12 -5.648 0.014 6.911 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -8.456 -0.808 6.255 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -7.164 -1.861 5.713 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -7.320 -0.920 8.587 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -8.232 -2.309 8.032 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -6.190 -3.455 7.339 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -5.224 -2.030 7.665 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -5.610 -2.193 10.041 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -6.868 -3.393 9.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -4.863 -4.467 10.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -5.162 -4.910 8.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -3.968 -3.756 9.263 1.00 0.00 H new ATOM 166 N VAL A 13 -4.814 0.677 4.625 1.00 0.00 N ATOM 167 CA VAL A 13 -4.234 0.794 3.293 1.00 0.00 C ATOM 168 C VAL A 13 -3.125 -0.232 3.085 1.00 0.00 C ATOM 169 O VAL A 13 -2.313 -0.474 3.979 1.00 0.00 O ATOM 170 CB VAL A 13 -3.665 2.203 3.049 1.00 0.00 C ATOM 171 CG1 VAL A 13 -4.788 3.226 2.962 1.00 0.00 C ATOM 172 CG2 VAL A 13 -2.677 2.576 4.143 1.00 0.00 C ATOM 0 H VAL A 13 -4.211 1.008 5.378 1.00 0.00 H new ATOM 0 HA VAL A 13 -5.038 0.607 2.581 1.00 0.00 H new ATOM 0 HB VAL A 13 -3.134 2.201 2.097 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -4.366 4.216 2.789 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -5.453 2.967 2.139 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -5.350 3.229 3.896 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -2.285 3.575 3.954 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -3.181 2.561 5.109 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.856 1.860 4.151 1.00 0.00 H new ATOM 182 N ARG A 14 -3.097 -0.833 1.900 1.00 0.00 N ATOM 183 CA ARG A 14 -2.087 -1.833 1.573 1.00 0.00 C ATOM 184 C ARG A 14 -1.114 -1.304 0.524 1.00 0.00 C ATOM 185 O ARG A 14 -1.436 -0.381 -0.224 1.00 0.00 O ATOM 186 CB ARG A 14 -2.753 -3.114 1.067 1.00 0.00 C ATOM 187 CG ARG A 14 -2.025 -4.382 1.481 1.00 0.00 C ATOM 188 CD ARG A 14 -2.915 -5.607 1.340 1.00 0.00 C ATOM 189 NE ARG A 14 -2.471 -6.708 2.191 1.00 0.00 N ATOM 190 CZ ARG A 14 -3.139 -7.851 2.335 1.00 0.00 C ATOM 191 NH1 ARG A 14 -4.280 -8.046 1.687 1.00 0.00 N ATOM 192 NH2 ARG A 14 -2.663 -8.801 3.129 1.00 0.00 N ATOM 0 H ARG A 14 -3.762 -0.645 1.150 1.00 0.00 H new ATOM 0 HA ARG A 14 -1.527 -2.056 2.481 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -3.776 -3.154 1.441 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -2.812 -3.078 -0.021 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -1.132 -4.507 0.868 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -1.691 -4.290 2.515 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -3.940 -5.341 1.597 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -2.921 -5.933 0.300 1.00 0.00 H new ATOM 0 HE ARG A 14 -1.598 -6.595 2.705 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -4.650 -7.319 1.075 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -4.788 -8.923 1.801 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -1.786 -8.656 3.629 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -3.174 -9.677 3.240 1.00 0.00 H new ATOM 206 N PHE A 15 0.076 -1.894 0.477 1.00 0.00 N ATOM 207 CA PHE A 15 1.095 -1.480 -0.481 1.00 0.00 C ATOM 208 C PHE A 15 1.866 -2.686 -1.007 1.00 0.00 C ATOM 209 O PHE A 15 2.404 -3.478 -0.233 1.00 0.00 O ATOM 210 CB PHE A 15 2.060 -0.486 0.166 1.00 0.00 C ATOM 211 CG PHE A 15 1.402 0.792 0.602 1.00 0.00 C ATOM 212 CD1 PHE A 15 1.050 1.757 -0.329 1.00 0.00 C ATOM 213 CD2 PHE A 15 1.137 1.031 1.941 1.00 0.00 C ATOM 214 CE1 PHE A 15 0.445 2.935 0.067 1.00 0.00 C ATOM 215 CE2 PHE A 15 0.531 2.206 2.343 1.00 0.00 C ATOM 216 CZ PHE A 15 0.185 3.159 1.405 1.00 0.00 C ATOM 0 H PHE A 15 0.358 -2.659 1.090 1.00 0.00 H new ATOM 0 HA PHE A 15 0.595 -0.996 -1.320 1.00 0.00 H new ATOM 0 HB2 PHE A 15 2.529 -0.957 1.030 1.00 0.00 H new ATOM 0 HB3 PHE A 15 2.856 -0.252 -0.541 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.251 1.586 -1.376 1.00 0.00 H new ATOM 0 HD2 PHE A 15 1.407 0.290 2.679 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.176 3.679 -0.668 1.00 0.00 H new ATOM 0 HE2 PHE A 15 0.328 2.379 3.390 1.00 0.00 H new ATOM 0 HZ PHE A 15 -0.288 4.078 1.717 1.00 0.00 H new ATOM 226 N TYR A 16 1.916 -2.819 -2.329 1.00 0.00 N ATOM 227 CA TYR A 16 2.623 -3.929 -2.959 1.00 0.00 C ATOM 228 C TYR A 16 3.917 -3.451 -3.609 1.00 0.00 C ATOM 229 O TYR A 16 4.137 -2.250 -3.769 1.00 0.00 O ATOM 230 CB TYR A 16 1.731 -4.601 -4.004 1.00 0.00 C ATOM 231 CG TYR A 16 0.522 -5.293 -3.415 1.00 0.00 C ATOM 232 CD1 TYR A 16 0.609 -6.593 -2.933 1.00 0.00 C ATOM 233 CD2 TYR A 16 -0.705 -4.646 -3.340 1.00 0.00 C ATOM 234 CE1 TYR A 16 -0.493 -7.230 -2.394 1.00 0.00 C ATOM 235 CE2 TYR A 16 -1.811 -5.275 -2.801 1.00 0.00 C ATOM 236 CZ TYR A 16 -1.700 -6.567 -2.330 1.00 0.00 C ATOM 237 OH TYR A 16 -2.800 -7.196 -1.795 1.00 0.00 O ATOM 0 H TYR A 16 1.476 -2.173 -2.984 1.00 0.00 H new ATOM 0 HA TYR A 16 2.873 -4.654 -2.185 1.00 0.00 H new ATOM 0 HB2 TYR A 16 1.396 -3.851 -4.720 1.00 0.00 H new ATOM 0 HB3 TYR A 16 2.322 -5.330 -4.559 1.00 0.00 H new ATOM 0 HD1 TYR A 16 1.553 -7.115 -2.980 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -0.796 -3.635 -3.709 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -0.409 -8.242 -2.025 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -2.758 -4.758 -2.749 1.00 0.00 H new ATOM 0 HH TYR A 16 -3.570 -6.590 -1.824 1.00 0.00 H new ATOM 247 N ARG A 17 4.770 -4.399 -3.984 1.00 0.00 N ATOM 248 CA ARG A 17 6.042 -4.075 -4.618 1.00 0.00 C ATOM 249 C ARG A 17 5.924 -4.132 -6.137 1.00 0.00 C ATOM 250 O ARG A 17 5.399 -5.097 -6.694 1.00 0.00 O ATOM 251 CB ARG A 17 7.133 -5.038 -4.141 1.00 0.00 C ATOM 252 CG ARG A 17 8.443 -4.350 -3.795 1.00 0.00 C ATOM 253 CD ARG A 17 9.470 -5.339 -3.268 1.00 0.00 C ATOM 254 NE ARG A 17 9.237 -5.675 -1.866 1.00 0.00 N ATOM 255 CZ ARG A 17 9.746 -6.750 -1.266 1.00 0.00 C ATOM 256 NH1 ARG A 17 10.516 -7.594 -1.944 1.00 0.00 N ATOM 257 NH2 ARG A 17 9.486 -6.981 0.012 1.00 0.00 N ATOM 0 H ARG A 17 4.603 -5.398 -3.860 1.00 0.00 H new ATOM 0 HA ARG A 17 6.314 -3.059 -4.332 1.00 0.00 H new ATOM 0 HB2 ARG A 17 6.773 -5.577 -3.265 1.00 0.00 H new ATOM 0 HB3 ARG A 17 7.316 -5.780 -4.918 1.00 0.00 H new ATOM 0 HG2 ARG A 17 8.838 -3.851 -4.680 1.00 0.00 H new ATOM 0 HG3 ARG A 17 8.263 -3.578 -3.047 1.00 0.00 H new ATOM 0 HD2 ARG A 17 9.439 -6.248 -3.869 1.00 0.00 H new ATOM 0 HD3 ARG A 17 10.469 -4.918 -3.379 1.00 0.00 H new ATOM 0 HE ARG A 17 8.650 -5.050 -1.314 1.00 0.00 H new ATOM 0 HH11 ARG A 17 10.720 -7.420 -2.928 1.00 0.00 H new ATOM 0 HH12 ARG A 17 10.903 -8.416 -1.480 1.00 0.00 H new ATOM 0 HH21 ARG A 17 8.896 -6.336 0.537 1.00 0.00 H new ATOM 0 HH22 ARG A 17 9.876 -7.804 0.471 1.00 0.00 H new ATOM 271 N ASN A 18 6.413 -3.091 -6.804 1.00 0.00 N ATOM 272 CA ASN A 18 6.362 -3.024 -8.260 1.00 0.00 C ATOM 273 C ASN A 18 7.292 -4.058 -8.886 1.00 0.00 C ATOM 274 O ASN A 18 8.512 -3.889 -8.888 1.00 0.00 O ATOM 275 CB ASN A 18 6.742 -1.621 -8.740 1.00 0.00 C ATOM 276 CG ASN A 18 6.280 -1.352 -10.159 1.00 0.00 C ATOM 277 OD1 ASN A 18 5.622 -2.187 -10.779 1.00 0.00 O ATOM 278 ND2 ASN A 18 6.625 -0.181 -10.681 1.00 0.00 N ATOM 0 H ASN A 18 6.849 -2.283 -6.359 1.00 0.00 H new ATOM 0 HA ASN A 18 5.342 -3.244 -8.573 1.00 0.00 H new ATOM 0 HB2 ASN A 18 6.304 -0.880 -8.071 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.824 -1.501 -8.684 1.00 0.00 H new ATOM 0 HD21 ASN A 18 6.344 0.056 -11.632 1.00 0.00 H new ATOM 0 HD22 ASN A 18 7.171 0.482 -10.131 1.00 0.00 H new ATOM 285 N GLY A 19 6.709 -5.127 -9.418 1.00 0.00 N ATOM 286 CA GLY A 19 7.501 -6.172 -10.039 1.00 0.00 C ATOM 287 C GLY A 19 7.739 -7.348 -9.113 1.00 0.00 C ATOM 288 O GLY A 19 8.747 -8.043 -9.228 1.00 0.00 O ATOM 0 H GLY A 19 5.702 -5.288 -9.430 1.00 0.00 H new ATOM 0 HA2 GLY A 19 6.995 -6.520 -10.940 1.00 0.00 H new ATOM 0 HA3 GLY A 19 8.460 -5.759 -10.351 1.00 0.00 H new ATOM 292 N ASP A 20 6.805 -7.572 -8.193 1.00 0.00 N ATOM 293 CA ASP A 20 6.918 -8.672 -7.243 1.00 0.00 C ATOM 294 C ASP A 20 5.558 -9.315 -6.990 1.00 0.00 C ATOM 295 O ASP A 20 4.815 -8.890 -6.106 1.00 0.00 O ATOM 296 CB ASP A 20 7.514 -8.177 -5.924 1.00 0.00 C ATOM 297 CG ASP A 20 8.355 -9.234 -5.236 1.00 0.00 C ATOM 298 OD1 ASP A 20 8.021 -10.431 -5.359 1.00 0.00 O ATOM 299 OD2 ASP A 20 9.349 -8.864 -4.575 1.00 0.00 O ATOM 0 H ASP A 20 5.963 -7.007 -8.086 1.00 0.00 H new ATOM 0 HA ASP A 20 7.581 -9.423 -7.673 1.00 0.00 H new ATOM 0 HB2 ASP A 20 8.127 -7.296 -6.114 1.00 0.00 H new ATOM 0 HB3 ASP A 20 6.708 -7.868 -5.258 1.00 0.00 H new ATOM 304 N ARG A 21 5.240 -10.341 -7.772 1.00 0.00 N ATOM 305 CA ARG A 21 3.969 -11.042 -7.634 1.00 0.00 C ATOM 306 C ARG A 21 3.985 -11.965 -6.419 1.00 0.00 C ATOM 307 O ARG A 21 2.960 -12.175 -5.772 1.00 0.00 O ATOM 308 CB ARG A 21 3.667 -11.850 -8.898 1.00 0.00 C ATOM 309 CG ARG A 21 4.826 -12.721 -9.353 1.00 0.00 C ATOM 310 CD ARG A 21 4.380 -13.752 -10.377 1.00 0.00 C ATOM 311 NE ARG A 21 5.499 -14.264 -11.164 1.00 0.00 N ATOM 312 CZ ARG A 21 6.048 -13.609 -12.185 1.00 0.00 C ATOM 313 NH1 ARG A 21 5.583 -12.420 -12.547 1.00 0.00 N ATOM 314 NH2 ARG A 21 7.064 -14.146 -12.847 1.00 0.00 N ATOM 0 H ARG A 21 5.845 -10.706 -8.508 1.00 0.00 H new ATOM 0 HA ARG A 21 3.186 -10.297 -7.492 1.00 0.00 H new ATOM 0 HB2 ARG A 21 2.798 -12.482 -8.716 1.00 0.00 H new ATOM 0 HB3 ARG A 21 3.400 -11.165 -9.703 1.00 0.00 H new ATOM 0 HG2 ARG A 21 5.607 -12.094 -9.783 1.00 0.00 H new ATOM 0 HG3 ARG A 21 5.262 -13.227 -8.492 1.00 0.00 H new ATOM 0 HD2 ARG A 21 3.887 -14.580 -9.867 1.00 0.00 H new ATOM 0 HD3 ARG A 21 3.643 -13.305 -11.044 1.00 0.00 H new ATOM 0 HE ARG A 21 5.882 -15.176 -10.917 1.00 0.00 H new ATOM 0 HH11 ARG A 21 4.801 -12.003 -12.042 1.00 0.00 H new ATOM 0 HH12 ARG A 21 6.008 -11.923 -13.330 1.00 0.00 H new ATOM 0 HH21 ARG A 21 7.424 -15.060 -12.574 1.00 0.00 H new ATOM 0 HH22 ARG A 21 7.485 -13.645 -13.629 1.00 0.00 H new ATOM 328 N TYR A 22 5.158 -12.513 -6.115 1.00 0.00 N ATOM 329 CA TYR A 22 5.308 -13.413 -4.978 1.00 0.00 C ATOM 330 C TYR A 22 5.004 -12.692 -3.669 1.00 0.00 C ATOM 331 O TYR A 22 4.419 -13.270 -2.752 1.00 0.00 O ATOM 332 CB TYR A 22 6.726 -13.986 -4.939 1.00 0.00 C ATOM 333 CG TYR A 22 7.066 -14.846 -6.135 1.00 0.00 C ATOM 334 CD1 TYR A 22 6.688 -16.182 -6.184 1.00 0.00 C ATOM 335 CD2 TYR A 22 7.766 -14.322 -7.215 1.00 0.00 C ATOM 336 CE1 TYR A 22 6.997 -16.971 -7.276 1.00 0.00 C ATOM 337 CE2 TYR A 22 8.078 -15.104 -8.310 1.00 0.00 C ATOM 338 CZ TYR A 22 7.691 -16.428 -8.336 1.00 0.00 C ATOM 339 OH TYR A 22 8.002 -17.210 -9.425 1.00 0.00 O ATOM 0 H TYR A 22 6.017 -12.349 -6.640 1.00 0.00 H new ATOM 0 HA TYR A 22 4.595 -14.229 -5.097 1.00 0.00 H new ATOM 0 HB2 TYR A 22 7.439 -13.164 -4.879 1.00 0.00 H new ATOM 0 HB3 TYR A 22 6.845 -14.578 -4.031 1.00 0.00 H new ATOM 0 HD1 TYR A 22 6.144 -16.611 -5.356 1.00 0.00 H new ATOM 0 HD2 TYR A 22 8.071 -13.286 -7.198 1.00 0.00 H new ATOM 0 HE1 TYR A 22 6.696 -18.008 -7.299 1.00 0.00 H new ATOM 0 HE2 TYR A 22 8.622 -14.681 -9.142 1.00 0.00 H new ATOM 0 HH TYR A 22 8.491 -16.674 -10.083 1.00 0.00 H new ATOM 349 N PHE A 23 5.404 -11.427 -3.588 1.00 0.00 N ATOM 350 CA PHE A 23 5.173 -10.627 -2.391 1.00 0.00 C ATOM 351 C PHE A 23 3.681 -10.506 -2.096 1.00 0.00 C ATOM 352 O PHE A 23 2.858 -10.475 -3.011 1.00 0.00 O ATOM 353 CB PHE A 23 5.786 -9.236 -2.556 1.00 0.00 C ATOM 354 CG PHE A 23 6.058 -8.541 -1.252 1.00 0.00 C ATOM 355 CD1 PHE A 23 6.799 -9.166 -0.262 1.00 0.00 C ATOM 356 CD2 PHE A 23 5.572 -7.266 -1.017 1.00 0.00 C ATOM 357 CE1 PHE A 23 7.051 -8.529 0.939 1.00 0.00 C ATOM 358 CE2 PHE A 23 5.820 -6.625 0.182 1.00 0.00 C ATOM 359 CZ PHE A 23 6.561 -7.258 1.161 1.00 0.00 C ATOM 0 H PHE A 23 5.890 -10.934 -4.337 1.00 0.00 H new ATOM 0 HA PHE A 23 5.651 -11.130 -1.551 1.00 0.00 H new ATOM 0 HB2 PHE A 23 6.719 -9.323 -3.114 1.00 0.00 H new ATOM 0 HB3 PHE A 23 5.114 -8.620 -3.153 1.00 0.00 H new ATOM 0 HD1 PHE A 23 7.184 -10.161 -0.430 1.00 0.00 H new ATOM 0 HD2 PHE A 23 4.992 -6.767 -1.779 1.00 0.00 H new ATOM 0 HE1 PHE A 23 7.631 -9.026 1.703 1.00 0.00 H new ATOM 0 HE2 PHE A 23 5.435 -5.631 0.353 1.00 0.00 H new ATOM 0 HZ PHE A 23 6.757 -6.759 2.099 1.00 0.00 H new ATOM 369 N LYS A 24 3.340 -10.437 -0.813 1.00 0.00 N ATOM 370 CA LYS A 24 1.947 -10.318 -0.399 1.00 0.00 C ATOM 371 C LYS A 24 1.638 -8.902 0.078 1.00 0.00 C ATOM 372 O LYS A 24 0.761 -8.696 0.917 1.00 0.00 O ATOM 373 CB LYS A 24 1.638 -11.322 0.714 1.00 0.00 C ATOM 374 CG LYS A 24 1.215 -12.688 0.201 1.00 0.00 C ATOM 375 CD LYS A 24 1.418 -13.766 1.253 1.00 0.00 C ATOM 376 CE LYS A 24 0.285 -14.777 1.241 1.00 0.00 C ATOM 377 NZ LYS A 24 0.444 -15.804 2.308 1.00 0.00 N ATOM 0 H LYS A 24 4.009 -10.461 -0.043 1.00 0.00 H new ATOM 0 HA LYS A 24 1.318 -10.535 -1.262 1.00 0.00 H new ATOM 0 HB2 LYS A 24 2.520 -11.437 1.343 1.00 0.00 H new ATOM 0 HB3 LYS A 24 0.846 -10.919 1.346 1.00 0.00 H new ATOM 0 HG2 LYS A 24 0.166 -12.658 -0.093 1.00 0.00 H new ATOM 0 HG3 LYS A 24 1.789 -12.936 -0.691 1.00 0.00 H new ATOM 0 HD2 LYS A 24 2.364 -14.277 1.074 1.00 0.00 H new ATOM 0 HD3 LYS A 24 1.486 -13.306 2.239 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -0.665 -14.259 1.375 1.00 0.00 H new ATOM 0 HE3 LYS A 24 0.247 -15.267 0.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -0.350 -16.475 2.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 1.338 -16.316 2.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 0.455 -15.339 3.238 1.00 0.00 H new ATOM 391 N GLY A 25 2.365 -7.928 -0.463 1.00 0.00 N ATOM 392 CA GLY A 25 2.152 -6.543 -0.081 1.00 0.00 C ATOM 393 C GLY A 25 2.310 -6.319 1.410 1.00 0.00 C ATOM 394 O GLY A 25 2.692 -7.231 2.144 1.00 0.00 O ATOM 0 H GLY A 25 3.097 -8.073 -1.158 1.00 0.00 H new ATOM 0 HA2 GLY A 25 2.859 -5.909 -0.617 1.00 0.00 H new ATOM 0 HA3 GLY A 25 1.152 -6.235 -0.387 1.00 0.00 H new ATOM 398 N ILE A 26 2.014 -5.104 1.859 1.00 0.00 N ATOM 399 CA ILE A 26 2.123 -4.762 3.272 1.00 0.00 C ATOM 400 C ILE A 26 0.889 -4.002 3.749 1.00 0.00 C ATOM 401 O ILE A 26 0.354 -3.157 3.034 1.00 0.00 O ATOM 402 CB ILE A 26 3.382 -3.915 3.547 1.00 0.00 C ATOM 403 CG1 ILE A 26 3.535 -3.658 5.049 1.00 0.00 C ATOM 404 CG2 ILE A 26 3.318 -2.600 2.783 1.00 0.00 C ATOM 405 CD1 ILE A 26 4.942 -3.280 5.457 1.00 0.00 C ATOM 0 H ILE A 26 1.696 -4.339 1.264 1.00 0.00 H new ATOM 0 HA ILE A 26 2.200 -5.699 3.823 1.00 0.00 H new ATOM 0 HB ILE A 26 4.254 -4.470 3.201 1.00 0.00 H new ATOM 0 HG12 ILE A 26 2.853 -2.861 5.344 1.00 0.00 H new ATOM 0 HG13 ILE A 26 3.235 -4.552 5.595 1.00 0.00 H new ATOM 0 HG21 ILE A 26 4.215 -2.015 2.989 1.00 0.00 H new ATOM 0 HG22 ILE A 26 3.255 -2.803 1.714 1.00 0.00 H new ATOM 0 HG23 ILE A 26 2.438 -2.039 3.098 1.00 0.00 H new ATOM 0 HD11 ILE A 26 4.976 -3.113 6.534 1.00 0.00 H new ATOM 0 HD12 ILE A 26 5.626 -4.086 5.193 1.00 0.00 H new ATOM 0 HD13 ILE A 26 5.239 -2.368 4.939 1.00 0.00 H new ATOM 417 N VAL A 27 0.444 -4.311 4.964 1.00 0.00 N ATOM 418 CA VAL A 27 -0.726 -3.656 5.536 1.00 0.00 C ATOM 419 C VAL A 27 -0.321 -2.481 6.420 1.00 0.00 C ATOM 420 O VAL A 27 0.692 -2.537 7.117 1.00 0.00 O ATOM 421 CB VAL A 27 -1.570 -4.641 6.367 1.00 0.00 C ATOM 422 CG1 VAL A 27 -2.882 -3.998 6.788 1.00 0.00 C ATOM 423 CG2 VAL A 27 -1.822 -5.920 5.584 1.00 0.00 C ATOM 0 H VAL A 27 0.876 -5.009 5.569 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.324 -3.290 4.701 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.013 -4.897 7.268 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -3.464 -4.709 7.374 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.677 -3.113 7.391 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.447 -3.710 5.901 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.420 -6.604 6.187 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.358 -5.684 4.664 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.870 -6.390 5.339 1.00 0.00 H new ATOM 433 N TYR A 28 -1.120 -1.420 6.385 1.00 0.00 N ATOM 434 CA TYR A 28 -0.845 -0.231 7.184 1.00 0.00 C ATOM 435 C TYR A 28 -2.142 0.448 7.612 1.00 0.00 C ATOM 436 O TYR A 28 -3.094 0.537 6.837 1.00 0.00 O ATOM 437 CB TYR A 28 0.022 0.751 6.393 1.00 0.00 C ATOM 438 CG TYR A 28 1.505 0.582 6.635 1.00 0.00 C ATOM 439 CD1 TYR A 28 2.039 0.715 7.909 1.00 0.00 C ATOM 440 CD2 TYR A 28 2.369 0.288 5.588 1.00 0.00 C ATOM 441 CE1 TYR A 28 3.394 0.562 8.134 1.00 0.00 C ATOM 442 CE2 TYR A 28 3.725 0.132 5.804 1.00 0.00 C ATOM 443 CZ TYR A 28 4.232 0.270 7.079 1.00 0.00 C ATOM 444 OH TYR A 28 5.582 0.116 7.299 1.00 0.00 O ATOM 0 H TYR A 28 -1.962 -1.359 5.813 1.00 0.00 H new ATOM 0 HA TYR A 28 -0.306 -0.541 8.079 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -0.180 0.626 5.329 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.266 1.769 6.655 1.00 0.00 H new ATOM 0 HD1 TYR A 28 1.385 0.942 8.738 1.00 0.00 H new ATOM 0 HD2 TYR A 28 1.975 0.180 4.588 1.00 0.00 H new ATOM 0 HE1 TYR A 28 3.794 0.671 9.131 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.384 -0.097 4.979 1.00 0.00 H new ATOM 0 HH TYR A 28 6.030 -0.088 6.452 1.00 0.00 H new ATOM 454 N ALA A 29 -2.172 0.926 8.852 1.00 0.00 N ATOM 455 CA ALA A 29 -3.351 1.598 9.384 1.00 0.00 C ATOM 456 C ALA A 29 -3.079 3.079 9.624 1.00 0.00 C ATOM 457 O ALA A 29 -2.470 3.453 10.626 1.00 0.00 O ATOM 458 CB ALA A 29 -3.803 0.927 10.672 1.00 0.00 C ATOM 0 H ALA A 29 -1.393 0.860 9.507 1.00 0.00 H new ATOM 0 HA ALA A 29 -4.148 1.518 8.645 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -4.684 1.439 11.059 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -4.047 -0.116 10.472 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -3.002 0.977 11.409 1.00 0.00 H new ATOM 464 N ILE A 30 -3.534 3.917 8.698 1.00 0.00 N ATOM 465 CA ILE A 30 -3.339 5.357 8.810 1.00 0.00 C ATOM 466 C ILE A 30 -4.208 5.945 9.918 1.00 0.00 C ATOM 467 O ILE A 30 -5.413 6.126 9.744 1.00 0.00 O ATOM 468 CB ILE A 30 -3.662 6.073 7.485 1.00 0.00 C ATOM 469 CG1 ILE A 30 -2.952 5.382 6.320 1.00 0.00 C ATOM 470 CG2 ILE A 30 -3.261 7.539 7.563 1.00 0.00 C ATOM 471 CD1 ILE A 30 -1.448 5.317 6.481 1.00 0.00 C ATOM 0 H ILE A 30 -4.040 3.623 7.862 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.288 5.516 9.053 1.00 0.00 H new ATOM 0 HB ILE A 30 -4.737 6.020 7.313 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -3.342 4.370 6.216 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -3.188 5.911 5.396 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.496 8.031 6.619 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -3.809 8.024 8.371 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -2.191 7.614 7.755 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -1.011 4.814 5.618 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -1.046 6.327 6.554 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -1.203 4.762 7.387 1.00 0.00 H new ATOM 483 N SER A 31 -3.588 6.241 11.054 1.00 0.00 N ATOM 484 CA SER A 31 -4.304 6.808 12.191 1.00 0.00 C ATOM 485 C SER A 31 -3.732 8.174 12.568 1.00 0.00 C ATOM 486 O SER A 31 -2.650 8.549 12.115 1.00 0.00 O ATOM 487 CB SER A 31 -4.230 5.859 13.390 1.00 0.00 C ATOM 488 OG SER A 31 -5.522 5.427 13.778 1.00 0.00 O ATOM 0 H SER A 31 -2.591 6.098 11.213 1.00 0.00 H new ATOM 0 HA SER A 31 -5.348 6.939 11.905 1.00 0.00 H new ATOM 0 HB2 SER A 31 -3.615 4.995 13.137 1.00 0.00 H new ATOM 0 HB3 SER A 31 -3.745 6.362 14.226 1.00 0.00 H new ATOM 0 HG SER A 31 -5.448 4.821 14.544 1.00 0.00 H new ATOM 494 N PRO A 32 -4.454 8.937 13.407 1.00 0.00 N ATOM 495 CA PRO A 32 -4.011 10.266 13.843 1.00 0.00 C ATOM 496 C PRO A 32 -2.782 10.200 14.743 1.00 0.00 C ATOM 497 O PRO A 32 -1.988 11.138 14.795 1.00 0.00 O ATOM 498 CB PRO A 32 -5.214 10.808 14.620 1.00 0.00 C ATOM 499 CG PRO A 32 -5.953 9.595 15.071 1.00 0.00 C ATOM 500 CD PRO A 32 -5.754 8.565 13.995 1.00 0.00 C ATOM 0 HA PRO A 32 -3.715 10.892 13.001 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -4.897 11.416 15.467 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -5.839 11.441 13.990 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -5.571 9.239 16.028 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -7.012 9.813 15.212 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -5.737 7.555 14.403 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -6.554 8.596 13.255 1.00 0.00 H new ATOM 508 N ASP A 33 -2.631 9.085 15.450 1.00 0.00 N ATOM 509 CA ASP A 33 -1.497 8.897 16.347 1.00 0.00 C ATOM 510 C ASP A 33 -0.517 7.875 15.779 1.00 0.00 C ATOM 511 O ASP A 33 0.150 7.159 16.525 1.00 0.00 O ATOM 512 CB ASP A 33 -1.981 8.444 17.726 1.00 0.00 C ATOM 513 CG ASP A 33 -2.802 7.171 17.662 1.00 0.00 C ATOM 514 OD1 ASP A 33 -2.231 6.113 17.324 1.00 0.00 O ATOM 515 OD2 ASP A 33 -4.016 7.233 17.951 1.00 0.00 O ATOM 0 H ASP A 33 -3.279 8.298 15.419 1.00 0.00 H new ATOM 0 HA ASP A 33 -0.981 9.852 16.445 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -1.120 8.286 18.376 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -2.579 9.236 18.176 1.00 0.00 H new ATOM 520 N ARG A 34 -0.436 7.815 14.453 1.00 0.00 N ATOM 521 CA ARG A 34 0.464 6.882 13.784 1.00 0.00 C ATOM 522 C ARG A 34 1.387 7.615 12.816 1.00 0.00 C ATOM 523 O ARG A 34 2.605 7.623 12.991 1.00 0.00 O ATOM 524 CB ARG A 34 -0.339 5.814 13.037 1.00 0.00 C ATOM 525 CG ARG A 34 -0.281 4.441 13.689 1.00 0.00 C ATOM 526 CD ARG A 34 -1.577 4.107 14.409 1.00 0.00 C ATOM 527 NE ARG A 34 -1.363 3.193 15.528 1.00 0.00 N ATOM 528 CZ ARG A 34 -1.136 1.889 15.387 1.00 0.00 C ATOM 529 NH1 ARG A 34 -1.094 1.342 14.179 1.00 0.00 N ATOM 530 NH2 ARG A 34 -0.950 1.129 16.459 1.00 0.00 N ATOM 0 H ARG A 34 -0.982 8.401 13.821 1.00 0.00 H new ATOM 0 HA ARG A 34 1.078 6.398 14.544 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -1.379 6.133 12.973 1.00 0.00 H new ATOM 0 HB3 ARG A 34 0.035 5.738 12.016 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -0.081 3.685 12.929 1.00 0.00 H new ATOM 0 HG3 ARG A 34 0.548 4.409 14.397 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -2.036 5.026 14.774 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -2.278 3.659 13.704 1.00 0.00 H new ATOM 0 HE ARG A 34 -1.389 3.576 16.473 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -1.236 1.921 13.352 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -0.920 0.342 14.078 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -0.981 1.544 17.390 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -0.776 0.130 16.352 1.00 0.00 H new ATOM 544 N PHE A 35 0.798 8.231 11.796 1.00 0.00 N ATOM 545 CA PHE A 35 1.567 8.967 10.800 1.00 0.00 C ATOM 546 C PHE A 35 1.237 10.455 10.847 1.00 0.00 C ATOM 547 O PHE A 35 0.068 10.841 10.885 1.00 0.00 O ATOM 548 CB PHE A 35 1.288 8.415 9.400 1.00 0.00 C ATOM 549 CG PHE A 35 1.660 6.969 9.240 1.00 0.00 C ATOM 550 CD1 PHE A 35 0.754 5.969 9.551 1.00 0.00 C ATOM 551 CD2 PHE A 35 2.917 6.610 8.778 1.00 0.00 C ATOM 552 CE1 PHE A 35 1.092 4.637 9.405 1.00 0.00 C ATOM 553 CE2 PHE A 35 3.261 5.280 8.630 1.00 0.00 C ATOM 554 CZ PHE A 35 2.348 4.292 8.944 1.00 0.00 C ATOM 0 H PHE A 35 -0.210 8.235 11.638 1.00 0.00 H new ATOM 0 HA PHE A 35 2.625 8.841 11.029 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.228 8.536 9.175 1.00 0.00 H new ATOM 0 HB3 PHE A 35 1.839 9.007 8.669 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.229 6.233 9.912 1.00 0.00 H new ATOM 0 HD2 PHE A 35 3.635 7.378 8.531 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.376 3.867 9.651 1.00 0.00 H new ATOM 0 HE2 PHE A 35 4.243 5.013 8.269 1.00 0.00 H new ATOM 0 HZ PHE A 35 2.615 3.252 8.829 1.00 0.00 H new ATOM 564 N ARG A 36 2.273 11.286 10.845 1.00 0.00 N ATOM 565 CA ARG A 36 2.095 12.733 10.888 1.00 0.00 C ATOM 566 C ARG A 36 1.917 13.300 9.483 1.00 0.00 C ATOM 567 O ARG A 36 0.854 13.817 9.142 1.00 0.00 O ATOM 568 CB ARG A 36 3.291 13.397 11.571 1.00 0.00 C ATOM 569 CG ARG A 36 3.012 14.813 12.049 1.00 0.00 C ATOM 570 CD ARG A 36 2.940 14.887 13.566 1.00 0.00 C ATOM 571 NE ARG A 36 4.107 14.277 14.200 1.00 0.00 N ATOM 572 CZ ARG A 36 4.154 13.927 15.483 1.00 0.00 C ATOM 573 NH1 ARG A 36 3.104 14.122 16.271 1.00 0.00 N ATOM 574 NH2 ARG A 36 5.255 13.378 15.979 1.00 0.00 N ATOM 0 H ARG A 36 3.246 10.982 10.814 1.00 0.00 H new ATOM 0 HA ARG A 36 1.194 12.946 11.464 1.00 0.00 H new ATOM 0 HB2 ARG A 36 3.596 12.789 12.423 1.00 0.00 H new ATOM 0 HB3 ARG A 36 4.131 13.416 10.876 1.00 0.00 H new ATOM 0 HG2 ARG A 36 3.795 15.480 11.688 1.00 0.00 H new ATOM 0 HG3 ARG A 36 2.072 15.163 11.622 1.00 0.00 H new ATOM 0 HD2 ARG A 36 2.863 15.930 13.875 1.00 0.00 H new ATOM 0 HD3 ARG A 36 2.036 14.385 13.911 1.00 0.00 H new ATOM 0 HE ARG A 36 4.933 14.110 13.626 1.00 0.00 H new ATOM 0 HH11 ARG A 36 2.255 14.542 15.894 1.00 0.00 H new ATOM 0 HH12 ARG A 36 3.147 13.851 17.254 1.00 0.00 H new ATOM 0 HH21 ARG A 36 6.064 13.225 15.377 1.00 0.00 H new ATOM 0 HH22 ARG A 36 5.292 13.109 16.962 1.00 0.00 H new ATOM 588 N SER A 37 2.966 13.198 8.673 1.00 0.00 N ATOM 589 CA SER A 37 2.927 13.701 7.305 1.00 0.00 C ATOM 590 C SER A 37 3.363 12.623 6.318 1.00 0.00 C ATOM 591 O SER A 37 3.637 11.487 6.704 1.00 0.00 O ATOM 592 CB SER A 37 3.826 14.930 7.164 1.00 0.00 C ATOM 593 OG SER A 37 5.195 14.566 7.183 1.00 0.00 O ATOM 0 H SER A 37 3.853 12.772 8.940 1.00 0.00 H new ATOM 0 HA SER A 37 1.899 13.984 7.078 1.00 0.00 H new ATOM 0 HB2 SER A 37 3.597 15.447 6.232 1.00 0.00 H new ATOM 0 HB3 SER A 37 3.621 15.629 7.975 1.00 0.00 H new ATOM 0 HG SER A 37 5.748 15.369 7.090 1.00 0.00 H new ATOM 599 N PHE A 38 3.425 12.987 5.042 1.00 0.00 N ATOM 600 CA PHE A 38 3.828 12.051 3.998 1.00 0.00 C ATOM 601 C PHE A 38 5.254 11.561 4.227 1.00 0.00 C ATOM 602 O PHE A 38 5.574 10.403 3.959 1.00 0.00 O ATOM 603 CB PHE A 38 3.718 12.710 2.622 1.00 0.00 C ATOM 604 CG PHE A 38 3.383 11.746 1.520 1.00 0.00 C ATOM 605 CD1 PHE A 38 2.205 11.017 1.553 1.00 0.00 C ATOM 606 CD2 PHE A 38 4.247 11.569 0.451 1.00 0.00 C ATOM 607 CE1 PHE A 38 1.894 10.129 0.540 1.00 0.00 C ATOM 608 CE2 PHE A 38 3.942 10.683 -0.565 1.00 0.00 C ATOM 609 CZ PHE A 38 2.764 9.962 -0.520 1.00 0.00 C ATOM 0 H PHE A 38 3.201 13.923 4.705 1.00 0.00 H new ATOM 0 HA PHE A 38 3.157 11.193 4.037 1.00 0.00 H new ATOM 0 HB2 PHE A 38 2.953 13.486 2.660 1.00 0.00 H new ATOM 0 HB3 PHE A 38 4.661 13.203 2.388 1.00 0.00 H new ATOM 0 HD1 PHE A 38 1.522 11.144 2.380 1.00 0.00 H new ATOM 0 HD2 PHE A 38 5.169 12.130 0.411 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.973 9.567 0.577 1.00 0.00 H new ATOM 0 HE2 PHE A 38 4.623 10.554 -1.393 1.00 0.00 H new ATOM 0 HZ PHE A 38 2.524 9.269 -1.313 1.00 0.00 H new ATOM 619 N GLU A 39 6.107 12.449 4.729 1.00 0.00 N ATOM 620 CA GLU A 39 7.499 12.106 4.994 1.00 0.00 C ATOM 621 C GLU A 39 7.595 10.971 6.009 1.00 0.00 C ATOM 622 O GLU A 39 8.521 10.161 5.964 1.00 0.00 O ATOM 623 CB GLU A 39 8.259 13.333 5.506 1.00 0.00 C ATOM 624 CG GLU A 39 9.154 13.975 4.458 1.00 0.00 C ATOM 625 CD GLU A 39 10.560 13.408 4.469 1.00 0.00 C ATOM 626 OE1 GLU A 39 10.724 12.232 4.856 1.00 0.00 O ATOM 627 OE2 GLU A 39 11.498 14.140 4.089 1.00 0.00 O ATOM 0 H GLU A 39 5.858 13.411 4.960 1.00 0.00 H new ATOM 0 HA GLU A 39 7.951 11.772 4.060 1.00 0.00 H new ATOM 0 HB2 GLU A 39 7.541 14.072 5.861 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.867 13.042 6.362 1.00 0.00 H new ATOM 0 HG2 GLU A 39 8.715 13.829 3.471 1.00 0.00 H new ATOM 0 HG3 GLU A 39 9.198 15.050 4.632 1.00 0.00 H new ATOM 634 N ALA A 40 6.632 10.917 6.923 1.00 0.00 N ATOM 635 CA ALA A 40 6.609 9.882 7.948 1.00 0.00 C ATOM 636 C ALA A 40 6.195 8.537 7.361 1.00 0.00 C ATOM 637 O ALA A 40 6.642 7.485 7.817 1.00 0.00 O ATOM 638 CB ALA A 40 5.669 10.278 9.077 1.00 0.00 C ATOM 0 H ALA A 40 5.857 11.578 6.974 1.00 0.00 H new ATOM 0 HA ALA A 40 7.618 9.780 8.348 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.662 9.495 9.836 1.00 0.00 H new ATOM 0 HB2 ALA A 40 6.009 11.213 9.523 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.662 10.410 8.682 1.00 0.00 H new ATOM 644 N LEU A 41 5.337 8.579 6.346 1.00 0.00 N ATOM 645 CA LEU A 41 4.862 7.363 5.696 1.00 0.00 C ATOM 646 C LEU A 41 5.893 6.841 4.700 1.00 0.00 C ATOM 647 O LEU A 41 6.005 5.635 4.483 1.00 0.00 O ATOM 648 CB LEU A 41 3.534 7.627 4.983 1.00 0.00 C ATOM 649 CG LEU A 41 2.864 6.390 4.385 1.00 0.00 C ATOM 650 CD1 LEU A 41 2.330 5.487 5.486 1.00 0.00 C ATOM 651 CD2 LEU A 41 1.746 6.797 3.437 1.00 0.00 C ATOM 0 H LEU A 41 4.957 9.442 5.956 1.00 0.00 H new ATOM 0 HA LEU A 41 4.709 6.605 6.464 1.00 0.00 H new ATOM 0 HB2 LEU A 41 2.845 8.089 5.690 1.00 0.00 H new ATOM 0 HB3 LEU A 41 3.705 8.350 4.186 1.00 0.00 H new ATOM 0 HG LEU A 41 3.610 5.833 3.818 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.857 4.612 5.041 1.00 0.00 H new ATOM 0 HD12 LEU A 41 3.153 5.168 6.126 1.00 0.00 H new ATOM 0 HD13 LEU A 41 1.598 6.033 6.081 1.00 0.00 H new ATOM 0 HD21 LEU A 41 1.280 5.904 3.020 1.00 0.00 H new ATOM 0 HD22 LEU A 41 1.000 7.376 3.982 1.00 0.00 H new ATOM 0 HD23 LEU A 41 2.156 7.403 2.629 1.00 0.00 H new ATOM 663 N LEU A 42 6.643 7.758 4.097 1.00 0.00 N ATOM 664 CA LEU A 42 7.665 7.390 3.124 1.00 0.00 C ATOM 665 C LEU A 42 8.818 6.654 3.798 1.00 0.00 C ATOM 666 O LEU A 42 9.353 5.688 3.255 1.00 0.00 O ATOM 667 CB LEU A 42 8.188 8.637 2.407 1.00 0.00 C ATOM 668 CG LEU A 42 7.177 9.331 1.494 1.00 0.00 C ATOM 669 CD1 LEU A 42 7.687 10.703 1.079 1.00 0.00 C ATOM 670 CD2 LEU A 42 6.890 8.474 0.271 1.00 0.00 C ATOM 0 H LEU A 42 6.562 8.761 4.265 1.00 0.00 H new ATOM 0 HA LEU A 42 7.211 6.722 2.392 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.529 9.352 3.156 1.00 0.00 H new ATOM 0 HB3 LEU A 42 9.059 8.358 1.814 1.00 0.00 H new ATOM 0 HG LEU A 42 6.247 9.464 2.046 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.955 11.182 0.429 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.842 11.317 1.966 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.630 10.594 0.544 1.00 0.00 H new ATOM 0 HD21 LEU A 42 6.168 8.983 -0.368 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.814 8.310 -0.283 1.00 0.00 H new ATOM 0 HD23 LEU A 42 6.481 7.514 0.587 1.00 0.00 H new ATOM 682 N ALA A 43 9.197 7.118 4.985 1.00 0.00 N ATOM 683 CA ALA A 43 10.288 6.504 5.732 1.00 0.00 C ATOM 684 C ALA A 43 9.985 5.043 6.045 1.00 0.00 C ATOM 685 O ALA A 43 10.826 4.168 5.843 1.00 0.00 O ATOM 686 CB ALA A 43 10.547 7.278 7.017 1.00 0.00 C ATOM 0 H ALA A 43 8.765 7.917 5.449 1.00 0.00 H new ATOM 0 HA ALA A 43 11.184 6.537 5.113 1.00 0.00 H new ATOM 0 HB1 ALA A 43 11.364 6.809 7.566 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.816 8.306 6.775 1.00 0.00 H new ATOM 0 HB3 ALA A 43 9.647 7.273 7.632 1.00 0.00 H new ATOM 692 N ASP A 44 8.778 4.787 6.539 1.00 0.00 N ATOM 693 CA ASP A 44 8.364 3.430 6.879 1.00 0.00 C ATOM 694 C ASP A 44 8.252 2.565 5.628 1.00 0.00 C ATOM 695 O ASP A 44 8.605 1.385 5.645 1.00 0.00 O ATOM 696 CB ASP A 44 7.025 3.454 7.618 1.00 0.00 C ATOM 697 CG ASP A 44 7.131 4.098 8.987 1.00 0.00 C ATOM 698 OD1 ASP A 44 8.203 3.981 9.616 1.00 0.00 O ATOM 699 OD2 ASP A 44 6.142 4.719 9.430 1.00 0.00 O ATOM 0 H ASP A 44 8.070 5.500 6.713 1.00 0.00 H new ATOM 0 HA ASP A 44 9.124 2.998 7.530 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.293 3.997 7.020 1.00 0.00 H new ATOM 0 HB3 ASP A 44 6.655 2.435 7.727 1.00 0.00 H new ATOM 704 N LEU A 45 7.761 3.158 4.546 1.00 0.00 N ATOM 705 CA LEU A 45 7.603 2.441 3.287 1.00 0.00 C ATOM 706 C LEU A 45 8.960 2.130 2.664 1.00 0.00 C ATOM 707 O LEU A 45 9.127 1.114 1.989 1.00 0.00 O ATOM 708 CB LEU A 45 6.759 3.262 2.310 1.00 0.00 C ATOM 709 CG LEU A 45 5.248 3.178 2.532 1.00 0.00 C ATOM 710 CD1 LEU A 45 4.512 4.068 1.542 1.00 0.00 C ATOM 711 CD2 LEU A 45 4.772 1.738 2.412 1.00 0.00 C ATOM 0 H LEU A 45 7.465 4.134 4.516 1.00 0.00 H new ATOM 0 HA LEU A 45 7.094 1.500 3.496 1.00 0.00 H new ATOM 0 HB2 LEU A 45 7.064 4.306 2.379 1.00 0.00 H new ATOM 0 HB3 LEU A 45 6.981 2.932 1.295 1.00 0.00 H new ATOM 0 HG LEU A 45 5.028 3.531 3.539 1.00 0.00 H new ATOM 0 HD11 LEU A 45 3.438 3.995 1.715 1.00 0.00 H new ATOM 0 HD12 LEU A 45 4.832 5.102 1.675 1.00 0.00 H new ATOM 0 HD13 LEU A 45 4.738 3.746 0.525 1.00 0.00 H new ATOM 0 HD21 LEU A 45 3.695 1.696 2.573 1.00 0.00 H new ATOM 0 HD22 LEU A 45 5.005 1.359 1.417 1.00 0.00 H new ATOM 0 HD23 LEU A 45 5.274 1.125 3.160 1.00 0.00 H new ATOM 723 N THR A 46 9.928 3.011 2.896 1.00 0.00 N ATOM 724 CA THR A 46 11.272 2.830 2.358 1.00 0.00 C ATOM 725 C THR A 46 12.078 1.864 3.219 1.00 0.00 C ATOM 726 O THR A 46 12.956 1.158 2.720 1.00 0.00 O ATOM 727 CB THR A 46 11.993 4.176 2.269 1.00 0.00 C ATOM 728 OG1 THR A 46 11.205 5.120 1.565 1.00 0.00 O ATOM 729 CG2 THR A 46 13.335 4.091 1.575 1.00 0.00 C ATOM 0 H THR A 46 9.807 3.857 3.453 1.00 0.00 H new ATOM 0 HA THR A 46 11.182 2.407 1.358 1.00 0.00 H new ATOM 0 HB THR A 46 12.155 4.487 3.301 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.447 5.394 2.123 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.793 5.080 1.546 1.00 0.00 H new ATOM 0 HG22 THR A 46 13.984 3.406 2.121 1.00 0.00 H new ATOM 0 HG23 THR A 46 13.196 3.725 0.558 1.00 0.00 H new ATOM 737 N ARG A 47 11.777 1.837 4.513 1.00 0.00 N ATOM 738 CA ARG A 47 12.475 0.956 5.442 1.00 0.00 C ATOM 739 C ARG A 47 12.068 -0.499 5.224 1.00 0.00 C ATOM 740 O ARG A 47 12.861 -1.414 5.442 1.00 0.00 O ATOM 741 CB ARG A 47 12.186 1.373 6.887 1.00 0.00 C ATOM 742 CG ARG A 47 13.437 1.673 7.694 1.00 0.00 C ATOM 743 CD ARG A 47 13.120 2.509 8.924 1.00 0.00 C ATOM 744 NE ARG A 47 12.542 1.704 9.999 1.00 0.00 N ATOM 745 CZ ARG A 47 11.855 2.212 11.018 1.00 0.00 C ATOM 746 NH1 ARG A 47 11.657 3.522 11.108 1.00 0.00 N ATOM 747 NH2 ARG A 47 11.363 1.410 11.952 1.00 0.00 N ATOM 0 H ARG A 47 11.054 2.415 4.942 1.00 0.00 H new ATOM 0 HA ARG A 47 13.545 1.044 5.255 1.00 0.00 H new ATOM 0 HB2 ARG A 47 11.547 2.256 6.881 1.00 0.00 H new ATOM 0 HB3 ARG A 47 11.627 0.578 7.381 1.00 0.00 H new ATOM 0 HG2 ARG A 47 13.907 0.738 7.999 1.00 0.00 H new ATOM 0 HG3 ARG A 47 14.156 2.202 7.069 1.00 0.00 H new ATOM 0 HD2 ARG A 47 14.031 2.989 9.281 1.00 0.00 H new ATOM 0 HD3 ARG A 47 12.426 3.304 8.653 1.00 0.00 H new ATOM 0 HE ARG A 47 12.673 0.693 9.965 1.00 0.00 H new ATOM 0 HH11 ARG A 47 12.033 4.145 10.393 1.00 0.00 H new ATOM 0 HH12 ARG A 47 11.129 3.905 11.892 1.00 0.00 H new ATOM 0 HH21 ARG A 47 11.511 0.403 11.889 1.00 0.00 H new ATOM 0 HH22 ARG A 47 10.836 1.800 12.733 1.00 0.00 H new ATOM 761 N THR A 48 10.827 -0.703 4.793 1.00 0.00 N ATOM 762 CA THR A 48 10.317 -2.047 4.546 1.00 0.00 C ATOM 763 C THR A 48 10.333 -2.369 3.054 1.00 0.00 C ATOM 764 O THR A 48 11.187 -3.118 2.581 1.00 0.00 O ATOM 765 CB THR A 48 8.895 -2.184 5.094 1.00 0.00 C ATOM 766 OG1 THR A 48 8.181 -0.970 4.945 1.00 0.00 O ATOM 767 CG2 THR A 48 8.853 -2.565 6.558 1.00 0.00 C ATOM 0 H THR A 48 10.157 0.044 4.608 1.00 0.00 H new ATOM 0 HA THR A 48 10.967 -2.756 5.060 1.00 0.00 H new ATOM 0 HB THR A 48 8.437 -2.985 4.513 1.00 0.00 H new ATOM 0 HG1 THR A 48 8.471 -0.334 5.631 1.00 0.00 H new ATOM 0 HG21 THR A 48 7.816 -2.646 6.883 1.00 0.00 H new ATOM 0 HG22 THR A 48 9.353 -3.523 6.699 1.00 0.00 H new ATOM 0 HG23 THR A 48 9.360 -1.801 7.147 1.00 0.00 H new ATOM 775 N LEU A 49 9.384 -1.798 2.320 1.00 0.00 N ATOM 776 CA LEU A 49 9.289 -2.026 0.883 1.00 0.00 C ATOM 777 C LEU A 49 10.434 -1.334 0.147 1.00 0.00 C ATOM 778 O LEU A 49 10.218 -0.386 -0.608 1.00 0.00 O ATOM 779 CB LEU A 49 7.945 -1.522 0.354 1.00 0.00 C ATOM 780 CG LEU A 49 6.727 -1.940 1.178 1.00 0.00 C ATOM 781 CD1 LEU A 49 5.457 -1.333 0.599 1.00 0.00 C ATOM 782 CD2 LEU A 49 6.617 -3.456 1.234 1.00 0.00 C ATOM 0 H LEU A 49 8.670 -1.174 2.696 1.00 0.00 H new ATOM 0 HA LEU A 49 9.362 -3.099 0.703 1.00 0.00 H new ATOM 0 HB2 LEU A 49 7.976 -0.433 0.306 1.00 0.00 H new ATOM 0 HB3 LEU A 49 7.815 -1.882 -0.666 1.00 0.00 H new ATOM 0 HG LEU A 49 6.854 -1.566 2.194 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.600 -1.641 1.198 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.535 -0.246 0.610 1.00 0.00 H new ATOM 0 HD13 LEU A 49 5.325 -1.676 -0.427 1.00 0.00 H new ATOM 0 HD21 LEU A 49 5.745 -3.736 1.824 1.00 0.00 H new ATOM 0 HD22 LEU A 49 6.513 -3.851 0.223 1.00 0.00 H new ATOM 0 HD23 LEU A 49 7.514 -3.869 1.694 1.00 0.00 H new ATOM 794 N SER A 50 11.651 -1.816 0.374 1.00 0.00 N ATOM 795 CA SER A 50 12.831 -1.245 -0.267 1.00 0.00 C ATOM 796 C SER A 50 14.090 -2.003 0.140 1.00 0.00 C ATOM 797 O SER A 50 14.484 -1.991 1.307 1.00 0.00 O ATOM 798 CB SER A 50 12.971 0.235 0.098 1.00 0.00 C ATOM 799 OG SER A 50 13.230 1.021 -1.053 1.00 0.00 O ATOM 0 H SER A 50 11.847 -2.600 0.996 1.00 0.00 H new ATOM 0 HA SER A 50 12.707 -1.335 -1.346 1.00 0.00 H new ATOM 0 HB2 SER A 50 12.058 0.582 0.581 1.00 0.00 H new ATOM 0 HB3 SER A 50 13.780 0.361 0.818 1.00 0.00 H new ATOM 0 HG SER A 50 13.728 0.488 -1.708 1.00 0.00 H new ATOM 805 N ASP A 51 14.718 -2.662 -0.828 1.00 0.00 N ATOM 806 CA ASP A 51 15.933 -3.427 -0.571 1.00 0.00 C ATOM 807 C ASP A 51 17.079 -2.941 -1.454 1.00 0.00 C ATOM 808 O ASP A 51 17.975 -2.236 -0.993 1.00 0.00 O ATOM 809 CB ASP A 51 15.683 -4.917 -0.809 1.00 0.00 C ATOM 810 CG ASP A 51 15.278 -5.646 0.456 1.00 0.00 C ATOM 811 OD1 ASP A 51 16.159 -5.899 1.304 1.00 0.00 O ATOM 812 OD2 ASP A 51 14.079 -5.962 0.602 1.00 0.00 O ATOM 0 H ASP A 51 14.405 -2.682 -1.799 1.00 0.00 H new ATOM 0 HA ASP A 51 16.214 -3.277 0.471 1.00 0.00 H new ATOM 0 HB2 ASP A 51 14.901 -5.036 -1.559 1.00 0.00 H new ATOM 0 HB3 ASP A 51 16.586 -5.374 -1.215 1.00 0.00 H new ATOM 817 N ASN A 52 17.042 -3.325 -2.727 1.00 0.00 N ATOM 818 CA ASN A 52 18.078 -2.930 -3.675 1.00 0.00 C ATOM 819 C ASN A 52 17.775 -3.473 -5.068 1.00 0.00 C ATOM 820 O ASN A 52 17.987 -2.790 -6.071 1.00 0.00 O ATOM 821 CB ASN A 52 19.447 -3.427 -3.207 1.00 0.00 C ATOM 822 CG ASN A 52 20.546 -2.412 -3.453 1.00 0.00 C ATOM 823 OD1 ASN A 52 20.836 -1.575 -2.600 1.00 0.00 O ATOM 824 ND2 ASN A 52 21.164 -2.483 -4.627 1.00 0.00 N ATOM 0 H ASN A 52 16.306 -3.909 -3.125 1.00 0.00 H new ATOM 0 HA ASN A 52 18.094 -1.841 -3.724 1.00 0.00 H new ATOM 0 HB2 ASN A 52 19.402 -3.659 -2.143 1.00 0.00 H new ATOM 0 HB3 ASN A 52 19.690 -4.355 -3.725 1.00 0.00 H new ATOM 0 HD21 ASN A 52 21.912 -1.826 -4.850 1.00 0.00 H new ATOM 0 HD22 ASN A 52 20.890 -3.194 -5.305 1.00 0.00 H new ATOM 831 N VAL A 53 17.281 -4.705 -5.124 1.00 0.00 N ATOM 832 CA VAL A 53 16.950 -5.340 -6.393 1.00 0.00 C ATOM 833 C VAL A 53 15.649 -4.785 -6.962 1.00 0.00 C ATOM 834 O VAL A 53 15.550 -4.513 -8.159 1.00 0.00 O ATOM 835 CB VAL A 53 16.820 -6.866 -6.241 1.00 0.00 C ATOM 836 CG1 VAL A 53 16.660 -7.528 -7.601 1.00 0.00 C ATOM 837 CG2 VAL A 53 18.023 -7.435 -5.502 1.00 0.00 C ATOM 0 H VAL A 53 17.101 -5.284 -4.304 1.00 0.00 H new ATOM 0 HA VAL A 53 17.768 -5.119 -7.079 1.00 0.00 H new ATOM 0 HB VAL A 53 15.927 -7.078 -5.652 1.00 0.00 H new ATOM 0 HG11 VAL A 53 16.570 -8.607 -7.472 1.00 0.00 H new ATOM 0 HG12 VAL A 53 15.764 -7.145 -8.089 1.00 0.00 H new ATOM 0 HG13 VAL A 53 17.532 -7.308 -8.218 1.00 0.00 H new ATOM 0 HG21 VAL A 53 17.913 -8.515 -5.404 1.00 0.00 H new ATOM 0 HG22 VAL A 53 18.932 -7.212 -6.061 1.00 0.00 H new ATOM 0 HG23 VAL A 53 18.087 -6.986 -4.511 1.00 0.00 H new ATOM 847 N ASN A 54 14.653 -4.618 -6.098 1.00 0.00 N ATOM 848 CA ASN A 54 13.358 -4.095 -6.516 1.00 0.00 C ATOM 849 C ASN A 54 13.369 -2.569 -6.537 1.00 0.00 C ATOM 850 O ASN A 54 13.424 -1.953 -7.602 1.00 0.00 O ATOM 851 CB ASN A 54 12.256 -4.595 -5.581 1.00 0.00 C ATOM 852 CG ASN A 54 12.039 -6.092 -5.693 1.00 0.00 C ATOM 853 OD1 ASN A 54 12.980 -6.878 -5.582 1.00 0.00 O ATOM 854 ND2 ASN A 54 10.793 -6.494 -5.918 1.00 0.00 N ATOM 0 H ASN A 54 14.718 -4.837 -5.104 1.00 0.00 H new ATOM 0 HA ASN A 54 13.158 -4.454 -7.526 1.00 0.00 H new ATOM 0 HB2 ASN A 54 12.514 -4.344 -4.552 1.00 0.00 H new ATOM 0 HB3 ASN A 54 11.325 -4.077 -5.811 1.00 0.00 H new ATOM 0 HD21 ASN A 54 10.586 -7.489 -6.006 1.00 0.00 H new ATOM 0 HD22 ASN A 54 10.043 -5.808 -6.003 1.00 0.00 H new ATOM 861 N LEU A 55 13.317 -1.965 -5.355 1.00 0.00 N ATOM 862 CA LEU A 55 13.322 -0.511 -5.237 1.00 0.00 C ATOM 863 C LEU A 55 14.586 -0.026 -4.531 1.00 0.00 C ATOM 864 O LEU A 55 14.599 0.147 -3.313 1.00 0.00 O ATOM 865 CB LEU A 55 12.084 -0.036 -4.474 1.00 0.00 C ATOM 866 CG LEU A 55 10.745 -0.486 -5.067 1.00 0.00 C ATOM 867 CD1 LEU A 55 10.078 -1.514 -4.165 1.00 0.00 C ATOM 868 CD2 LEU A 55 9.827 0.708 -5.286 1.00 0.00 C ATOM 0 H LEU A 55 13.271 -2.460 -4.464 1.00 0.00 H new ATOM 0 HA LEU A 55 13.305 -0.090 -6.242 1.00 0.00 H new ATOM 0 HB2 LEU A 55 12.149 -0.396 -3.447 1.00 0.00 H new ATOM 0 HB3 LEU A 55 12.098 1.053 -4.432 1.00 0.00 H new ATOM 0 HG LEU A 55 10.939 -0.951 -6.033 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.128 -1.821 -4.603 1.00 0.00 H new ATOM 0 HD12 LEU A 55 10.728 -2.383 -4.061 1.00 0.00 H new ATOM 0 HD13 LEU A 55 9.899 -1.075 -3.183 1.00 0.00 H new ATOM 0 HD21 LEU A 55 8.881 0.367 -5.708 1.00 0.00 H new ATOM 0 HD22 LEU A 55 9.642 1.204 -4.333 1.00 0.00 H new ATOM 0 HD23 LEU A 55 10.300 1.409 -5.974 1.00 0.00 H new ATOM 880 N PRO A 56 15.670 0.201 -5.293 1.00 0.00 N ATOM 881 CA PRO A 56 16.943 0.669 -4.735 1.00 0.00 C ATOM 882 C PRO A 56 16.866 2.113 -4.249 1.00 0.00 C ATOM 883 O PRO A 56 17.332 2.437 -3.157 1.00 0.00 O ATOM 884 CB PRO A 56 17.913 0.553 -5.912 1.00 0.00 C ATOM 885 CG PRO A 56 17.053 0.656 -7.124 1.00 0.00 C ATOM 886 CD PRO A 56 15.741 0.021 -6.755 1.00 0.00 C ATOM 0 HA PRO A 56 17.242 0.089 -3.862 1.00 0.00 H new ATOM 0 HB2 PRO A 56 18.660 1.346 -5.889 1.00 0.00 H new ATOM 0 HB3 PRO A 56 18.452 -0.394 -5.889 1.00 0.00 H new ATOM 0 HG2 PRO A 56 16.914 1.697 -7.417 1.00 0.00 H new ATOM 0 HG3 PRO A 56 17.510 0.145 -7.971 1.00 0.00 H new ATOM 0 HD2 PRO A 56 14.905 0.505 -7.260 1.00 0.00 H new ATOM 0 HD3 PRO A 56 15.714 -1.033 -7.031 1.00 0.00 H new ATOM 894 N GLN A 57 16.273 2.976 -5.068 1.00 0.00 N ATOM 895 CA GLN A 57 16.135 4.386 -4.721 1.00 0.00 C ATOM 896 C GLN A 57 15.234 4.560 -3.503 1.00 0.00 C ATOM 897 O GLN A 57 15.609 5.215 -2.530 1.00 0.00 O ATOM 898 CB GLN A 57 15.566 5.170 -5.906 1.00 0.00 C ATOM 899 CG GLN A 57 16.424 5.085 -7.158 1.00 0.00 C ATOM 900 CD GLN A 57 17.584 6.062 -7.137 1.00 0.00 C ATOM 901 OE1 GLN A 57 17.397 7.269 -7.298 1.00 0.00 O ATOM 902 NE2 GLN A 57 18.790 5.544 -6.939 1.00 0.00 N ATOM 0 H GLN A 57 15.881 2.724 -5.975 1.00 0.00 H new ATOM 0 HA GLN A 57 17.124 4.774 -4.478 1.00 0.00 H new ATOM 0 HB2 GLN A 57 14.568 4.796 -6.133 1.00 0.00 H new ATOM 0 HB3 GLN A 57 15.457 6.216 -5.620 1.00 0.00 H new ATOM 0 HG2 GLN A 57 16.810 4.071 -7.262 1.00 0.00 H new ATOM 0 HG3 GLN A 57 15.804 5.281 -8.033 1.00 0.00 H new ATOM 0 HE21 GLN A 57 18.898 4.538 -6.810 1.00 0.00 H new ATOM 0 HE22 GLN A 57 19.609 6.152 -6.916 1.00 0.00 H new ATOM 911 N GLY A 58 14.046 3.969 -3.562 1.00 0.00 N ATOM 912 CA GLY A 58 13.111 4.072 -2.456 1.00 0.00 C ATOM 913 C GLY A 58 11.670 4.154 -2.920 1.00 0.00 C ATOM 914 O GLY A 58 11.299 3.550 -3.927 1.00 0.00 O ATOM 0 H GLY A 58 13.713 3.421 -4.355 1.00 0.00 H new ATOM 0 HA2 GLY A 58 13.230 3.208 -1.802 1.00 0.00 H new ATOM 0 HA3 GLY A 58 13.350 4.955 -1.864 1.00 0.00 H new ATOM 918 N VAL A 59 10.855 4.903 -2.184 1.00 0.00 N ATOM 919 CA VAL A 59 9.447 5.063 -2.524 1.00 0.00 C ATOM 920 C VAL A 59 9.075 6.538 -2.642 1.00 0.00 C ATOM 921 O VAL A 59 9.175 7.293 -1.674 1.00 0.00 O ATOM 922 CB VAL A 59 8.537 4.392 -1.475 1.00 0.00 C ATOM 923 CG1 VAL A 59 8.732 5.030 -0.109 1.00 0.00 C ATOM 924 CG2 VAL A 59 7.078 4.468 -1.905 1.00 0.00 C ATOM 0 H VAL A 59 11.147 5.409 -1.348 1.00 0.00 H new ATOM 0 HA VAL A 59 9.294 4.577 -3.488 1.00 0.00 H new ATOM 0 HB VAL A 59 8.816 3.341 -1.401 1.00 0.00 H new ATOM 0 HG11 VAL A 59 8.081 4.542 0.617 1.00 0.00 H new ATOM 0 HG12 VAL A 59 9.771 4.916 0.201 1.00 0.00 H new ATOM 0 HG13 VAL A 59 8.484 6.090 -0.164 1.00 0.00 H new ATOM 0 HG21 VAL A 59 6.451 3.989 -1.152 1.00 0.00 H new ATOM 0 HG22 VAL A 59 6.784 5.512 -2.011 1.00 0.00 H new ATOM 0 HG23 VAL A 59 6.953 3.957 -2.860 1.00 0.00 H new ATOM 934 N ARG A 60 8.646 6.942 -3.833 1.00 0.00 N ATOM 935 CA ARG A 60 8.259 8.327 -4.078 1.00 0.00 C ATOM 936 C ARG A 60 6.848 8.405 -4.653 1.00 0.00 C ATOM 937 O ARG A 60 5.979 9.078 -4.100 1.00 0.00 O ATOM 938 CB ARG A 60 9.251 8.993 -5.033 1.00 0.00 C ATOM 939 CG ARG A 60 10.617 9.247 -4.413 1.00 0.00 C ATOM 940 CD ARG A 60 11.727 8.590 -5.217 1.00 0.00 C ATOM 941 NE ARG A 60 12.400 9.540 -6.100 1.00 0.00 N ATOM 942 CZ ARG A 60 13.540 9.283 -6.736 1.00 0.00 C ATOM 943 NH1 ARG A 60 14.138 8.107 -6.591 1.00 0.00 N ATOM 944 NH2 ARG A 60 14.083 10.203 -7.521 1.00 0.00 N ATOM 0 H ARG A 60 8.557 6.330 -4.644 1.00 0.00 H new ATOM 0 HA ARG A 60 8.272 8.856 -3.125 1.00 0.00 H new ATOM 0 HB2 ARG A 60 9.373 8.363 -5.914 1.00 0.00 H new ATOM 0 HB3 ARG A 60 8.834 9.941 -5.374 1.00 0.00 H new ATOM 0 HG2 ARG A 60 10.796 10.320 -4.354 1.00 0.00 H new ATOM 0 HG3 ARG A 60 10.631 8.865 -3.392 1.00 0.00 H new ATOM 0 HD2 ARG A 60 12.455 8.149 -4.536 1.00 0.00 H new ATOM 0 HD3 ARG A 60 11.311 7.775 -5.810 1.00 0.00 H new ATOM 0 HE ARG A 60 11.970 10.455 -6.237 1.00 0.00 H new ATOM 0 HH11 ARG A 60 13.724 7.395 -5.990 1.00 0.00 H new ATOM 0 HH12 ARG A 60 15.012 7.915 -7.081 1.00 0.00 H new ATOM 0 HH21 ARG A 60 13.627 11.108 -7.637 1.00 0.00 H new ATOM 0 HH22 ARG A 60 14.957 10.006 -8.009 1.00 0.00 H new ATOM 958 N THR A 61 6.629 7.713 -5.765 1.00 0.00 N ATOM 959 CA THR A 61 5.323 7.705 -6.415 1.00 0.00 C ATOM 960 C THR A 61 4.605 6.380 -6.173 1.00 0.00 C ATOM 961 O THR A 61 5.018 5.337 -6.679 1.00 0.00 O ATOM 962 CB THR A 61 5.475 7.951 -7.918 1.00 0.00 C ATOM 963 OG1 THR A 61 6.722 8.558 -8.204 1.00 0.00 O ATOM 964 CG2 THR A 61 4.390 8.837 -8.491 1.00 0.00 C ATOM 0 H THR A 61 7.338 7.150 -6.235 1.00 0.00 H new ATOM 0 HA THR A 61 4.724 8.507 -5.983 1.00 0.00 H new ATOM 0 HB THR A 61 5.401 6.967 -8.381 1.00 0.00 H new ATOM 0 HG1 THR A 61 6.800 8.705 -9.170 1.00 0.00 H new ATOM 0 HG21 THR A 61 4.557 8.971 -9.560 1.00 0.00 H new ATOM 0 HG22 THR A 61 3.418 8.371 -8.331 1.00 0.00 H new ATOM 0 HG23 THR A 61 4.413 9.808 -7.995 1.00 0.00 H new ATOM 972 N ILE A 62 3.527 6.431 -5.397 1.00 0.00 N ATOM 973 CA ILE A 62 2.752 5.236 -5.088 1.00 0.00 C ATOM 974 C ILE A 62 1.489 5.165 -5.940 1.00 0.00 C ATOM 975 O ILE A 62 0.430 5.649 -5.540 1.00 0.00 O ATOM 976 CB ILE A 62 2.356 5.191 -3.598 1.00 0.00 C ATOM 977 CG1 ILE A 62 3.584 5.413 -2.713 1.00 0.00 C ATOM 978 CG2 ILE A 62 1.691 3.863 -3.265 1.00 0.00 C ATOM 979 CD1 ILE A 62 3.264 6.078 -1.392 1.00 0.00 C ATOM 0 H ILE A 62 3.171 7.287 -4.971 1.00 0.00 H new ATOM 0 HA ILE A 62 3.388 4.380 -5.313 1.00 0.00 H new ATOM 0 HB ILE A 62 1.642 5.992 -3.404 1.00 0.00 H new ATOM 0 HG12 ILE A 62 4.062 4.452 -2.521 1.00 0.00 H new ATOM 0 HG13 ILE A 62 4.306 6.025 -3.254 1.00 0.00 H new ATOM 0 HG21 ILE A 62 1.418 3.847 -2.210 1.00 0.00 H new ATOM 0 HG22 ILE A 62 0.795 3.742 -3.874 1.00 0.00 H new ATOM 0 HG23 ILE A 62 2.383 3.047 -3.473 1.00 0.00 H new ATOM 0 HD11 ILE A 62 4.181 6.204 -0.816 1.00 0.00 H new ATOM 0 HD12 ILE A 62 2.814 7.054 -1.575 1.00 0.00 H new ATOM 0 HD13 ILE A 62 2.566 5.456 -0.831 1.00 0.00 H new ATOM 991 N TYR A 63 1.607 4.558 -7.116 1.00 0.00 N ATOM 992 CA TYR A 63 0.474 4.422 -8.025 1.00 0.00 C ATOM 993 C TYR A 63 -0.527 3.400 -7.496 1.00 0.00 C ATOM 994 O TYR A 63 -0.210 2.609 -6.608 1.00 0.00 O ATOM 995 CB TYR A 63 0.956 4.008 -9.416 1.00 0.00 C ATOM 996 CG TYR A 63 2.058 4.887 -9.965 1.00 0.00 C ATOM 997 CD1 TYR A 63 1.780 6.154 -10.463 1.00 0.00 C ATOM 998 CD2 TYR A 63 3.377 4.449 -9.984 1.00 0.00 C ATOM 999 CE1 TYR A 63 2.783 6.959 -10.966 1.00 0.00 C ATOM 1000 CE2 TYR A 63 4.386 5.249 -10.484 1.00 0.00 C ATOM 1001 CZ TYR A 63 4.085 6.502 -10.973 1.00 0.00 C ATOM 1002 OH TYR A 63 5.088 7.302 -11.473 1.00 0.00 O ATOM 0 H TYR A 63 2.476 4.152 -7.463 1.00 0.00 H new ATOM 0 HA TYR A 63 -0.023 5.390 -8.094 1.00 0.00 H new ATOM 0 HB2 TYR A 63 1.311 2.978 -9.376 1.00 0.00 H new ATOM 0 HB3 TYR A 63 0.111 4.028 -10.104 1.00 0.00 H new ATOM 0 HD1 TYR A 63 0.762 6.515 -10.457 1.00 0.00 H new ATOM 0 HD2 TYR A 63 3.617 3.468 -9.602 1.00 0.00 H new ATOM 0 HE1 TYR A 63 2.550 7.940 -11.352 1.00 0.00 H new ATOM 0 HE2 TYR A 63 5.406 4.894 -10.492 1.00 0.00 H new ATOM 0 HH TYR A 63 5.946 6.833 -11.404 1.00 0.00 H new ATOM 1012 N THR A 64 -1.736 3.424 -8.047 1.00 0.00 N ATOM 1013 CA THR A 64 -2.784 2.499 -7.631 1.00 0.00 C ATOM 1014 C THR A 64 -2.470 1.078 -8.089 1.00 0.00 C ATOM 1015 O THR A 64 -1.407 0.818 -8.651 1.00 0.00 O ATOM 1016 CB THR A 64 -4.136 2.941 -8.192 1.00 0.00 C ATOM 1017 OG1 THR A 64 -4.133 2.890 -9.607 1.00 0.00 O ATOM 1018 CG2 THR A 64 -4.523 4.346 -7.784 1.00 0.00 C ATOM 0 H THR A 64 -2.014 4.074 -8.782 1.00 0.00 H new ATOM 0 HA THR A 64 -2.830 2.508 -6.542 1.00 0.00 H new ATOM 0 HB THR A 64 -4.863 2.245 -7.774 1.00 0.00 H new ATOM 0 HG1 THR A 64 -5.007 3.175 -9.946 1.00 0.00 H new ATOM 0 HG21 THR A 64 -5.492 4.596 -8.216 1.00 0.00 H new ATOM 0 HG22 THR A 64 -4.584 4.406 -6.697 1.00 0.00 H new ATOM 0 HG23 THR A 64 -3.773 5.049 -8.145 1.00 0.00 H new ATOM 1026 N ILE A 65 -3.404 0.164 -7.847 1.00 0.00 N ATOM 1027 CA ILE A 65 -3.226 -1.231 -8.236 1.00 0.00 C ATOM 1028 C ILE A 65 -3.373 -1.402 -9.745 1.00 0.00 C ATOM 1029 O ILE A 65 -2.716 -2.249 -10.349 1.00 0.00 O ATOM 1030 CB ILE A 65 -4.239 -2.147 -7.518 1.00 0.00 C ATOM 1031 CG1 ILE A 65 -3.947 -3.616 -7.830 1.00 0.00 C ATOM 1032 CG2 ILE A 65 -5.662 -1.786 -7.917 1.00 0.00 C ATOM 1033 CD1 ILE A 65 -3.124 -4.308 -6.765 1.00 0.00 C ATOM 0 H ILE A 65 -4.291 0.363 -7.384 1.00 0.00 H new ATOM 0 HA ILE A 65 -2.218 -1.520 -7.940 1.00 0.00 H new ATOM 0 HB ILE A 65 -4.137 -1.998 -6.443 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -4.891 -4.148 -7.951 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -3.421 -3.679 -8.783 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -6.362 -2.443 -7.401 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -5.865 -0.751 -7.643 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -5.779 -1.906 -8.994 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.956 -5.346 -7.052 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -2.165 -3.801 -6.659 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -3.658 -4.277 -5.815 1.00 0.00 H new ATOM 1045 N ASP A 66 -4.238 -0.592 -10.345 1.00 0.00 N ATOM 1046 CA ASP A 66 -4.470 -0.654 -11.785 1.00 0.00 C ATOM 1047 C ASP A 66 -3.419 0.151 -12.541 1.00 0.00 C ATOM 1048 O ASP A 66 -2.862 -0.316 -13.535 1.00 0.00 O ATOM 1049 CB ASP A 66 -5.869 -0.131 -12.119 1.00 0.00 C ATOM 1050 CG ASP A 66 -6.908 -1.234 -12.141 1.00 0.00 C ATOM 1051 OD1 ASP A 66 -6.719 -2.242 -11.428 1.00 0.00 O ATOM 1052 OD2 ASP A 66 -7.911 -1.090 -12.871 1.00 0.00 O ATOM 0 H ASP A 66 -4.790 0.115 -9.858 1.00 0.00 H new ATOM 0 HA ASP A 66 -4.395 -1.696 -12.096 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -6.157 0.622 -11.385 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -5.847 0.363 -13.090 1.00 0.00 H new ATOM 1057 N GLY A 67 -3.151 1.362 -12.062 1.00 0.00 N ATOM 1058 CA GLY A 67 -2.166 2.212 -12.706 1.00 0.00 C ATOM 1059 C GLY A 67 -2.786 3.440 -13.342 1.00 0.00 C ATOM 1060 O GLY A 67 -2.405 3.837 -14.443 1.00 0.00 O ATOM 0 H GLY A 67 -3.598 1.769 -11.240 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.423 2.523 -11.971 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.639 1.639 -13.469 1.00 0.00 H new ATOM 1064 N LEU A 68 -3.745 4.044 -12.647 1.00 0.00 N ATOM 1065 CA LEU A 68 -4.420 5.235 -13.151 1.00 0.00 C ATOM 1066 C LEU A 68 -4.156 6.434 -12.246 1.00 0.00 C ATOM 1067 O LEU A 68 -3.667 7.468 -12.698 1.00 0.00 O ATOM 1068 CB LEU A 68 -5.927 4.985 -13.259 1.00 0.00 C ATOM 1069 CG LEU A 68 -6.349 4.052 -14.394 1.00 0.00 C ATOM 1070 CD1 LEU A 68 -7.585 3.259 -14.002 1.00 0.00 C ATOM 1071 CD2 LEU A 68 -6.603 4.844 -15.668 1.00 0.00 C ATOM 0 H LEU A 68 -4.072 3.728 -11.734 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.023 5.456 -14.142 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -6.279 4.567 -12.316 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -6.430 5.943 -13.391 1.00 0.00 H new ATOM 0 HG LEU A 68 -5.537 3.350 -14.582 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -7.870 2.601 -14.823 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -7.368 2.662 -13.116 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -8.404 3.945 -13.786 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -6.902 4.164 -16.466 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -7.397 5.570 -15.493 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -5.692 5.366 -15.960 1.00 0.00 H new ATOM 1083 N LYS A 69 -4.483 6.286 -10.966 1.00 0.00 N ATOM 1084 CA LYS A 69 -4.280 7.356 -9.997 1.00 0.00 C ATOM 1085 C LYS A 69 -2.993 7.139 -9.207 1.00 0.00 C ATOM 1086 O LYS A 69 -2.505 6.014 -9.095 1.00 0.00 O ATOM 1087 CB LYS A 69 -5.475 7.440 -9.043 1.00 0.00 C ATOM 1088 CG LYS A 69 -6.152 8.802 -9.036 1.00 0.00 C ATOM 1089 CD LYS A 69 -7.665 8.673 -8.961 1.00 0.00 C ATOM 1090 CE LYS A 69 -8.316 9.979 -8.538 1.00 0.00 C ATOM 1091 NZ LYS A 69 -9.794 9.948 -8.717 1.00 0.00 N ATOM 0 H LYS A 69 -4.890 5.436 -10.576 1.00 0.00 H new ATOM 0 HA LYS A 69 -4.193 8.296 -10.542 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -6.206 6.681 -9.322 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -5.140 7.204 -8.033 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -5.793 9.383 -8.187 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -5.877 9.351 -9.937 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -8.054 8.370 -9.933 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -7.929 7.888 -8.253 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -8.081 10.179 -7.493 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -7.897 10.799 -9.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -10.199 10.858 -8.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -10.019 9.782 -9.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -10.198 9.182 -8.140 1.00 0.00 H new ATOM 1105 N LYS A 70 -2.449 8.222 -8.663 1.00 0.00 N ATOM 1106 CA LYS A 70 -1.218 8.149 -7.882 1.00 0.00 C ATOM 1107 C LYS A 70 -1.378 8.864 -6.544 1.00 0.00 C ATOM 1108 O LYS A 70 -2.033 9.904 -6.459 1.00 0.00 O ATOM 1109 CB LYS A 70 -0.056 8.763 -8.667 1.00 0.00 C ATOM 1110 CG LYS A 70 -0.303 10.202 -9.091 1.00 0.00 C ATOM 1111 CD LYS A 70 1.002 10.954 -9.290 1.00 0.00 C ATOM 1112 CE LYS A 70 1.506 11.553 -7.986 1.00 0.00 C ATOM 1113 NZ LYS A 70 2.989 11.678 -7.966 1.00 0.00 N ATOM 0 H LYS A 70 -2.840 9.160 -8.748 1.00 0.00 H new ATOM 0 HA LYS A 70 -1.002 7.099 -7.687 1.00 0.00 H new ATOM 0 HB2 LYS A 70 0.846 8.722 -8.056 1.00 0.00 H new ATOM 0 HB3 LYS A 70 0.132 8.158 -9.554 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -0.878 10.216 -10.017 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -0.904 10.707 -8.335 1.00 0.00 H new ATOM 0 HD2 LYS A 70 1.754 10.278 -9.695 1.00 0.00 H new ATOM 0 HD3 LYS A 70 0.858 11.747 -10.024 1.00 0.00 H new ATOM 0 HE2 LYS A 70 1.057 12.536 -7.841 1.00 0.00 H new ATOM 0 HE3 LYS A 70 1.183 10.930 -7.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 3.374 11.120 -7.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 3.379 11.324 -8.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 3.252 12.677 -7.844 1.00 0.00 H new ATOM 1127 N ILE A 71 -0.776 8.300 -5.502 1.00 0.00 N ATOM 1128 CA ILE A 71 -0.851 8.884 -4.169 1.00 0.00 C ATOM 1129 C ILE A 71 0.247 9.922 -3.961 1.00 0.00 C ATOM 1130 O ILE A 71 1.412 9.679 -4.275 1.00 0.00 O ATOM 1131 CB ILE A 71 -0.734 7.804 -3.076 1.00 0.00 C ATOM 1132 CG1 ILE A 71 -1.690 6.647 -3.367 1.00 0.00 C ATOM 1133 CG2 ILE A 71 -1.019 8.402 -1.707 1.00 0.00 C ATOM 1134 CD1 ILE A 71 -3.144 7.062 -3.421 1.00 0.00 C ATOM 0 H ILE A 71 -0.231 7.439 -5.556 1.00 0.00 H new ATOM 0 HA ILE A 71 -1.825 9.368 -4.090 1.00 0.00 H new ATOM 0 HB ILE A 71 0.285 7.417 -3.077 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -1.416 6.190 -4.318 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -1.567 5.883 -2.599 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -0.932 7.626 -0.946 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -0.301 9.195 -1.500 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -2.028 8.813 -1.693 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -3.764 6.190 -3.631 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -3.436 7.492 -2.463 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -3.282 7.803 -4.208 1.00 0.00 H new ATOM 1146 N SER A 72 -0.134 11.079 -3.431 1.00 0.00 N ATOM 1147 CA SER A 72 0.818 12.156 -3.182 1.00 0.00 C ATOM 1148 C SER A 72 0.755 12.613 -1.728 1.00 0.00 C ATOM 1149 O SER A 72 1.786 12.814 -1.085 1.00 0.00 O ATOM 1150 CB SER A 72 0.539 13.336 -4.113 1.00 0.00 C ATOM 1151 OG SER A 72 1.501 14.363 -3.937 1.00 0.00 O ATOM 0 H SER A 72 -1.095 11.295 -3.166 1.00 0.00 H new ATOM 0 HA SER A 72 1.820 11.775 -3.380 1.00 0.00 H new ATOM 0 HB2 SER A 72 0.550 12.997 -5.149 1.00 0.00 H new ATOM 0 HB3 SER A 72 -0.458 13.730 -3.917 1.00 0.00 H new ATOM 0 HG SER A 72 1.302 15.106 -4.545 1.00 0.00 H new ATOM 1157 N SER A 73 -0.460 12.777 -1.216 1.00 0.00 N ATOM 1158 CA SER A 73 -0.658 13.212 0.163 1.00 0.00 C ATOM 1159 C SER A 73 -1.386 12.144 0.972 1.00 0.00 C ATOM 1160 O SER A 73 -1.669 11.055 0.471 1.00 0.00 O ATOM 1161 CB SER A 73 -1.447 14.521 0.198 1.00 0.00 C ATOM 1162 OG SER A 73 -0.748 15.557 -0.471 1.00 0.00 O ATOM 0 H SER A 73 -1.323 12.615 -1.735 1.00 0.00 H new ATOM 0 HA SER A 73 0.323 13.375 0.610 1.00 0.00 H new ATOM 0 HB2 SER A 73 -2.421 14.375 -0.269 1.00 0.00 H new ATOM 0 HB3 SER A 73 -1.630 14.811 1.233 1.00 0.00 H new ATOM 0 HG SER A 73 -1.275 16.383 -0.436 1.00 0.00 H new ATOM 1168 N LEU A 74 -1.687 12.463 2.226 1.00 0.00 N ATOM 1169 CA LEU A 74 -2.383 11.532 3.108 1.00 0.00 C ATOM 1170 C LEU A 74 -3.899 11.673 2.979 1.00 0.00 C ATOM 1171 O LEU A 74 -4.652 10.852 3.506 1.00 0.00 O ATOM 1172 CB LEU A 74 -1.960 11.762 4.560 1.00 0.00 C ATOM 1173 CG LEU A 74 -0.473 11.542 4.843 1.00 0.00 C ATOM 1174 CD1 LEU A 74 -0.145 11.905 6.282 1.00 0.00 C ATOM 1175 CD2 LEU A 74 -0.084 10.101 4.552 1.00 0.00 C ATOM 0 H LEU A 74 -1.460 13.360 2.655 1.00 0.00 H new ATOM 0 HA LEU A 74 -2.109 10.520 2.809 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -2.221 12.782 4.841 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -2.539 11.097 5.201 1.00 0.00 H new ATOM 0 HG LEU A 74 0.104 12.193 4.186 1.00 0.00 H new ATOM 0 HD11 LEU A 74 0.917 11.742 6.465 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -0.387 12.953 6.457 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -0.730 11.280 6.957 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.977 9.962 4.759 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -0.668 9.432 5.184 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.282 9.875 3.504 1.00 0.00 H new ATOM 1187 N ASP A 75 -4.345 12.715 2.281 1.00 0.00 N ATOM 1188 CA ASP A 75 -5.773 12.951 2.092 1.00 0.00 C ATOM 1189 C ASP A 75 -6.256 12.376 0.764 1.00 0.00 C ATOM 1190 O ASP A 75 -7.260 12.825 0.212 1.00 0.00 O ATOM 1191 CB ASP A 75 -6.072 14.450 2.150 1.00 0.00 C ATOM 1192 CG ASP A 75 -6.265 14.948 3.567 1.00 0.00 C ATOM 1193 OD1 ASP A 75 -5.580 14.432 4.477 1.00 0.00 O ATOM 1194 OD2 ASP A 75 -7.099 15.855 3.770 1.00 0.00 O ATOM 0 H ASP A 75 -3.740 13.407 1.839 1.00 0.00 H new ATOM 0 HA ASP A 75 -6.307 12.446 2.897 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -5.254 14.999 1.684 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -6.970 14.661 1.569 1.00 0.00 H new ATOM 1199 N GLN A 76 -5.538 11.379 0.255 1.00 0.00 N ATOM 1200 CA GLN A 76 -5.898 10.745 -1.008 1.00 0.00 C ATOM 1201 C GLN A 76 -6.235 9.271 -0.801 1.00 0.00 C ATOM 1202 O GLN A 76 -7.132 8.732 -1.448 1.00 0.00 O ATOM 1203 CB GLN A 76 -4.755 10.881 -2.016 1.00 0.00 C ATOM 1204 CG GLN A 76 -4.270 12.311 -2.196 1.00 0.00 C ATOM 1205 CD GLN A 76 -4.444 12.813 -3.616 1.00 0.00 C ATOM 1206 OE1 GLN A 76 -5.527 13.254 -4.003 1.00 0.00 O ATOM 1207 NE2 GLN A 76 -3.375 12.749 -4.402 1.00 0.00 N ATOM 0 H GLN A 76 -4.704 10.993 0.698 1.00 0.00 H new ATOM 0 HA GLN A 76 -6.781 11.250 -1.400 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -3.919 10.261 -1.691 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -5.084 10.493 -2.980 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -4.816 12.964 -1.515 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -3.217 12.371 -1.920 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -2.497 12.376 -4.040 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.432 13.073 -5.368 1.00 0.00 H new ATOM 1216 N LEU A 77 -5.510 8.625 0.107 1.00 0.00 N ATOM 1217 CA LEU A 77 -5.732 7.214 0.400 1.00 0.00 C ATOM 1218 C LEU A 77 -7.129 6.990 0.972 1.00 0.00 C ATOM 1219 O LEU A 77 -7.711 7.887 1.581 1.00 0.00 O ATOM 1220 CB LEU A 77 -4.678 6.704 1.385 1.00 0.00 C ATOM 1221 CG LEU A 77 -3.229 6.848 0.914 1.00 0.00 C ATOM 1222 CD1 LEU A 77 -2.319 7.186 2.085 1.00 0.00 C ATOM 1223 CD2 LEU A 77 -2.765 5.572 0.227 1.00 0.00 C ATOM 0 H LEU A 77 -4.764 9.057 0.652 1.00 0.00 H new ATOM 0 HA LEU A 77 -5.647 6.657 -0.533 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -4.793 7.240 2.327 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -4.874 5.652 1.591 1.00 0.00 H new ATOM 0 HG LEU A 77 -3.179 7.665 0.194 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.293 7.285 1.732 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.639 8.125 2.536 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.372 6.391 2.828 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.733 5.691 -0.102 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.829 4.738 0.926 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -3.400 5.372 -0.636 1.00 0.00 H new ATOM 1235 N VAL A 78 -7.658 5.788 0.773 1.00 0.00 N ATOM 1236 CA VAL A 78 -8.986 5.445 1.269 1.00 0.00 C ATOM 1237 C VAL A 78 -8.952 4.153 2.078 1.00 0.00 C ATOM 1238 O VAL A 78 -8.039 3.341 1.931 1.00 0.00 O ATOM 1239 CB VAL A 78 -9.996 5.291 0.116 1.00 0.00 C ATOM 1240 CG1 VAL A 78 -11.403 5.087 0.660 1.00 0.00 C ATOM 1241 CG2 VAL A 78 -9.945 6.499 -0.808 1.00 0.00 C ATOM 0 H VAL A 78 -7.188 5.034 0.272 1.00 0.00 H new ATOM 0 HA VAL A 78 -9.305 6.265 1.912 1.00 0.00 H new ATOM 0 HB VAL A 78 -9.723 4.409 -0.463 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -12.102 4.980 -0.170 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -11.429 4.187 1.274 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -11.687 5.948 1.266 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -10.666 6.370 -1.615 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -10.189 7.399 -0.244 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -8.943 6.594 -1.228 1.00 0.00 H new ATOM 1251 N GLU A 79 -9.953 3.969 2.933 1.00 0.00 N ATOM 1252 CA GLU A 79 -10.038 2.774 3.765 1.00 0.00 C ATOM 1253 C GLU A 79 -10.418 1.555 2.931 1.00 0.00 C ATOM 1254 O GLU A 79 -11.501 1.504 2.348 1.00 0.00 O ATOM 1255 CB GLU A 79 -11.060 2.979 4.885 1.00 0.00 C ATOM 1256 CG GLU A 79 -10.824 2.089 6.095 1.00 0.00 C ATOM 1257 CD GLU A 79 -12.111 1.512 6.653 1.00 0.00 C ATOM 1258 OE1 GLU A 79 -13.084 2.279 6.813 1.00 0.00 O ATOM 1259 OE2 GLU A 79 -12.144 0.296 6.931 1.00 0.00 O ATOM 0 H GLU A 79 -10.716 4.632 3.068 1.00 0.00 H new ATOM 0 HA GLU A 79 -9.057 2.598 4.205 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -11.036 4.022 5.201 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -12.059 2.788 4.493 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -10.155 1.274 5.818 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -10.321 2.664 6.872 1.00 0.00 H new ATOM 1266 N GLY A 80 -9.520 0.577 2.880 1.00 0.00 N ATOM 1267 CA GLY A 80 -9.780 -0.628 2.114 1.00 0.00 C ATOM 1268 C GLY A 80 -9.386 -0.487 0.658 1.00 0.00 C ATOM 1269 O GLY A 80 -10.235 -0.556 -0.231 1.00 0.00 O ATOM 0 H GLY A 80 -8.618 0.597 3.355 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -9.233 -1.461 2.556 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -10.840 -0.874 2.178 1.00 0.00 H new ATOM 1273 N GLU A 81 -8.095 -0.290 0.413 1.00 0.00 N ATOM 1274 CA GLU A 81 -7.590 -0.138 -0.947 1.00 0.00 C ATOM 1275 C GLU A 81 -6.156 -0.649 -1.055 1.00 0.00 C ATOM 1276 O GLU A 81 -5.500 -0.906 -0.045 1.00 0.00 O ATOM 1277 CB GLU A 81 -7.654 1.329 -1.377 1.00 0.00 C ATOM 1278 CG GLU A 81 -8.983 1.722 -1.999 1.00 0.00 C ATOM 1279 CD GLU A 81 -9.236 1.025 -3.322 1.00 0.00 C ATOM 1280 OE1 GLU A 81 -8.389 1.152 -4.231 1.00 0.00 O ATOM 1281 OE2 GLU A 81 -10.281 0.354 -3.449 1.00 0.00 O ATOM 0 H GLU A 81 -7.380 -0.232 1.138 1.00 0.00 H new ATOM 0 HA GLU A 81 -8.220 -0.731 -1.610 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -7.467 1.962 -0.510 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -6.855 1.525 -2.092 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -9.789 1.482 -1.306 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -9.004 2.801 -2.151 1.00 0.00 H new ATOM 1288 N SER A 82 -5.676 -0.792 -2.286 1.00 0.00 N ATOM 1289 CA SER A 82 -4.320 -1.273 -2.526 1.00 0.00 C ATOM 1290 C SER A 82 -3.605 -0.393 -3.547 1.00 0.00 C ATOM 1291 O SER A 82 -4.217 0.094 -4.498 1.00 0.00 O ATOM 1292 CB SER A 82 -4.349 -2.721 -3.016 1.00 0.00 C ATOM 1293 OG SER A 82 -4.553 -3.621 -1.939 1.00 0.00 O ATOM 0 H SER A 82 -6.205 -0.582 -3.132 1.00 0.00 H new ATOM 0 HA SER A 82 -3.772 -1.227 -1.585 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.144 -2.843 -3.752 1.00 0.00 H new ATOM 0 HB3 SER A 82 -3.411 -2.957 -3.518 1.00 0.00 H new ATOM 0 HG SER A 82 -4.728 -4.519 -2.291 1.00 0.00 H new ATOM 1299 N TYR A 83 -2.307 -0.193 -3.342 1.00 0.00 N ATOM 1300 CA TYR A 83 -1.509 0.629 -4.245 1.00 0.00 C ATOM 1301 C TYR A 83 -0.116 0.037 -4.432 1.00 0.00 C ATOM 1302 O TYR A 83 0.389 -0.675 -3.562 1.00 0.00 O ATOM 1303 CB TYR A 83 -1.402 2.056 -3.708 1.00 0.00 C ATOM 1304 CG TYR A 83 -2.729 2.652 -3.298 1.00 0.00 C ATOM 1305 CD1 TYR A 83 -3.326 2.304 -2.092 1.00 0.00 C ATOM 1306 CD2 TYR A 83 -3.387 3.562 -4.117 1.00 0.00 C ATOM 1307 CE1 TYR A 83 -4.540 2.847 -1.714 1.00 0.00 C ATOM 1308 CE2 TYR A 83 -4.599 4.110 -3.745 1.00 0.00 C ATOM 1309 CZ TYR A 83 -5.172 3.749 -2.544 1.00 0.00 C ATOM 1310 OH TYR A 83 -6.380 4.291 -2.171 1.00 0.00 O ATOM 0 H TYR A 83 -1.786 -0.588 -2.559 1.00 0.00 H new ATOM 0 HA TYR A 83 -2.008 0.650 -5.214 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -0.730 2.062 -2.850 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -0.950 2.689 -4.471 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -2.834 1.598 -1.440 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -2.943 3.845 -5.060 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -4.991 2.566 -0.774 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -5.096 4.818 -4.392 1.00 0.00 H new ATOM 0 HH TYR A 83 -6.690 4.909 -2.866 1.00 0.00 H new ATOM 1320 N VAL A 84 0.500 0.336 -5.569 1.00 0.00 N ATOM 1321 CA VAL A 84 1.836 -0.165 -5.870 1.00 0.00 C ATOM 1322 C VAL A 84 2.893 0.905 -5.622 1.00 0.00 C ATOM 1323 O VAL A 84 2.688 2.079 -5.937 1.00 0.00 O ATOM 1324 CB VAL A 84 1.941 -0.645 -7.330 1.00 0.00 C ATOM 1325 CG1 VAL A 84 3.270 -1.345 -7.568 1.00 0.00 C ATOM 1326 CG2 VAL A 84 0.777 -1.562 -7.675 1.00 0.00 C ATOM 0 H VAL A 84 0.096 0.923 -6.298 1.00 0.00 H new ATOM 0 HA VAL A 84 2.014 -1.009 -5.204 1.00 0.00 H new ATOM 0 HB VAL A 84 1.894 0.226 -7.984 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.326 -1.677 -8.605 1.00 0.00 H new ATOM 0 HG12 VAL A 84 4.087 -0.653 -7.364 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.351 -2.207 -6.906 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.868 -1.891 -8.710 1.00 0.00 H new ATOM 0 HG22 VAL A 84 0.790 -2.430 -7.016 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -0.161 -1.023 -7.547 1.00 0.00 H new ATOM 1336 N CYS A 85 4.023 0.495 -5.055 1.00 0.00 N ATOM 1337 CA CYS A 85 5.111 1.421 -4.763 1.00 0.00 C ATOM 1338 C CYS A 85 6.105 1.474 -5.920 1.00 0.00 C ATOM 1339 O CYS A 85 6.665 0.452 -6.318 1.00 0.00 O ATOM 1340 CB CYS A 85 5.828 1.007 -3.477 1.00 0.00 C ATOM 1341 SG CYS A 85 4.778 1.030 -2.006 1.00 0.00 S ATOM 0 H CYS A 85 4.209 -0.472 -4.789 1.00 0.00 H new ATOM 0 HA CYS A 85 4.684 2.415 -4.629 1.00 0.00 H new ATOM 0 HB2 CYS A 85 6.232 0.003 -3.606 1.00 0.00 H new ATOM 0 HB3 CYS A 85 6.675 1.673 -3.316 1.00 0.00 H new ATOM 0 HG CYS A 85 5.502 1.296 -0.960 1.00 0.00 H new ATOM 1347 N GLY A 86 6.319 2.672 -6.454 1.00 0.00 N ATOM 1348 CA GLY A 86 7.247 2.837 -7.557 1.00 0.00 C ATOM 1349 C GLY A 86 8.181 4.015 -7.359 1.00 0.00 C ATOM 1350 O GLY A 86 7.803 5.020 -6.756 1.00 0.00 O ATOM 0 H GLY A 86 5.866 3.531 -6.143 1.00 0.00 H new ATOM 0 HA2 GLY A 86 7.835 1.927 -7.672 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.686 2.973 -8.482 1.00 0.00 H new ATOM 1354 N SER A 87 9.402 3.892 -7.867 1.00 0.00 N ATOM 1355 CA SER A 87 10.393 4.956 -7.742 1.00 0.00 C ATOM 1356 C SER A 87 10.752 5.531 -9.107 1.00 0.00 C ATOM 1357 O SER A 87 10.439 6.682 -9.409 1.00 0.00 O ATOM 1358 CB SER A 87 11.651 4.429 -7.050 1.00 0.00 C ATOM 1359 OG SER A 87 12.527 5.489 -6.705 1.00 0.00 O ATOM 0 H SER A 87 9.730 3.067 -8.369 1.00 0.00 H new ATOM 0 HA SER A 87 9.959 5.752 -7.137 1.00 0.00 H new ATOM 0 HB2 SER A 87 11.372 3.877 -6.152 1.00 0.00 H new ATOM 0 HB3 SER A 87 12.165 3.728 -7.708 1.00 0.00 H new ATOM 0 HG SER A 87 12.538 5.601 -5.731 1.00 0.00 H new ATOM 1365 N ILE A 88 11.414 4.722 -9.929 1.00 0.00 N ATOM 1366 CA ILE A 88 11.816 5.151 -11.263 1.00 0.00 C ATOM 1367 C ILE A 88 11.612 4.038 -12.286 1.00 0.00 C ATOM 1368 O ILE A 88 12.343 3.947 -13.272 1.00 0.00 O ATOM 1369 CB ILE A 88 13.293 5.592 -11.290 1.00 0.00 C ATOM 1370 CG1 ILE A 88 14.185 4.503 -10.690 1.00 0.00 C ATOM 1371 CG2 ILE A 88 13.467 6.903 -10.540 1.00 0.00 C ATOM 1372 CD1 ILE A 88 14.896 3.664 -11.730 1.00 0.00 C ATOM 0 H ILE A 88 11.683 3.767 -9.694 1.00 0.00 H new ATOM 0 HA ILE A 88 11.185 6.000 -11.524 1.00 0.00 H new ATOM 0 HB ILE A 88 13.592 5.747 -12.327 1.00 0.00 H new ATOM 0 HG12 ILE A 88 14.927 4.969 -10.041 1.00 0.00 H new ATOM 0 HG13 ILE A 88 13.577 3.851 -10.063 1.00 0.00 H new ATOM 0 HG21 ILE A 88 14.515 7.202 -10.568 1.00 0.00 H new ATOM 0 HG22 ILE A 88 12.857 7.675 -11.010 1.00 0.00 H new ATOM 0 HG23 ILE A 88 13.154 6.774 -9.504 1.00 0.00 H new ATOM 0 HD11 ILE A 88 15.510 2.913 -11.234 1.00 0.00 H new ATOM 0 HD12 ILE A 88 14.160 3.170 -12.364 1.00 0.00 H new ATOM 0 HD13 ILE A 88 15.531 4.305 -12.342 1.00 0.00 H new ATOM 1384 N GLU A 89 10.615 3.195 -12.043 1.00 0.00 N ATOM 1385 CA GLU A 89 10.314 2.088 -12.943 1.00 0.00 C ATOM 1386 C GLU A 89 8.892 2.198 -13.485 1.00 0.00 C ATOM 1387 O GLU A 89 8.007 2.742 -12.825 1.00 0.00 O ATOM 1388 CB GLU A 89 10.495 0.751 -12.220 1.00 0.00 C ATOM 1389 CG GLU A 89 9.693 0.644 -10.933 1.00 0.00 C ATOM 1390 CD GLU A 89 10.557 0.308 -9.732 1.00 0.00 C ATOM 1391 OE1 GLU A 89 10.999 -0.855 -9.627 1.00 0.00 O ATOM 1392 OE2 GLU A 89 10.789 1.208 -8.898 1.00 0.00 O ATOM 0 H GLU A 89 10.001 3.257 -11.230 1.00 0.00 H new ATOM 0 HA GLU A 89 11.008 2.136 -13.782 1.00 0.00 H new ATOM 0 HB2 GLU A 89 10.202 -0.058 -12.890 1.00 0.00 H new ATOM 0 HB3 GLU A 89 11.552 0.610 -11.993 1.00 0.00 H new ATOM 0 HG2 GLU A 89 9.177 1.587 -10.752 1.00 0.00 H new ATOM 0 HG3 GLU A 89 8.926 -0.122 -11.050 1.00 0.00 H new ATOM 1399 N PRO A 90 8.651 1.679 -14.702 1.00 0.00 N ATOM 1400 CA PRO A 90 7.328 1.721 -15.331 1.00 0.00 C ATOM 1401 C PRO A 90 6.317 0.833 -14.613 1.00 0.00 C ATOM 1402 O PRO A 90 6.670 -0.220 -14.081 1.00 0.00 O ATOM 1403 CB PRO A 90 7.586 1.201 -16.747 1.00 0.00 C ATOM 1404 CG PRO A 90 8.812 0.366 -16.627 1.00 0.00 C ATOM 1405 CD PRO A 90 9.650 1.011 -15.558 1.00 0.00 C ATOM 0 HA PRO A 90 6.898 2.722 -15.304 1.00 0.00 H new ATOM 0 HB2 PRO A 90 6.743 0.615 -17.113 1.00 0.00 H new ATOM 0 HB3 PRO A 90 7.733 2.022 -17.449 1.00 0.00 H new ATOM 0 HG2 PRO A 90 8.560 -0.660 -16.359 1.00 0.00 H new ATOM 0 HG3 PRO A 90 9.351 0.326 -17.574 1.00 0.00 H new ATOM 0 HD2 PRO A 90 10.229 0.274 -15.001 1.00 0.00 H new ATOM 0 HD3 PRO A 90 10.360 1.723 -15.978 1.00 0.00 H new ATOM 1413 N PHE A 91 5.060 1.263 -14.602 1.00 0.00 N ATOM 1414 CA PHE A 91 3.998 0.508 -13.950 1.00 0.00 C ATOM 1415 C PHE A 91 3.859 -0.880 -14.569 1.00 0.00 C ATOM 1416 O PHE A 91 3.551 -1.015 -15.752 1.00 0.00 O ATOM 1417 CB PHE A 91 2.671 1.260 -14.054 1.00 0.00 C ATOM 1418 CG PHE A 91 1.610 0.736 -13.127 1.00 0.00 C ATOM 1419 CD1 PHE A 91 0.906 -0.416 -13.440 1.00 0.00 C ATOM 1420 CD2 PHE A 91 1.317 1.397 -11.945 1.00 0.00 C ATOM 1421 CE1 PHE A 91 -0.070 -0.899 -12.589 1.00 0.00 C ATOM 1422 CE2 PHE A 91 0.341 0.919 -11.091 1.00 0.00 C ATOM 1423 CZ PHE A 91 -0.353 -0.231 -11.413 1.00 0.00 C ATOM 0 H PHE A 91 4.752 2.132 -15.038 1.00 0.00 H new ATOM 0 HA PHE A 91 4.261 0.393 -12.898 1.00 0.00 H new ATOM 0 HB2 PHE A 91 2.842 2.315 -13.838 1.00 0.00 H new ATOM 0 HB3 PHE A 91 2.308 1.200 -15.080 1.00 0.00 H new ATOM 0 HD1 PHE A 91 1.122 -0.942 -14.358 1.00 0.00 H new ATOM 0 HD2 PHE A 91 1.857 2.296 -11.688 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -0.611 -1.798 -12.843 1.00 0.00 H new ATOM 0 HE2 PHE A 91 0.121 1.444 -10.173 1.00 0.00 H new ATOM 0 HZ PHE A 91 -1.115 -0.607 -10.747 1.00 0.00 H new ATOM 1433 N LYS A 92 4.088 -1.909 -13.758 1.00 0.00 N ATOM 1434 CA LYS A 92 3.989 -3.287 -14.225 1.00 0.00 C ATOM 1435 C LYS A 92 2.656 -3.906 -13.815 1.00 0.00 C ATOM 1436 O LYS A 92 2.298 -3.907 -12.637 1.00 0.00 O ATOM 1437 CB LYS A 92 5.144 -4.121 -13.669 1.00 0.00 C ATOM 1438 CG LYS A 92 6.516 -3.604 -14.069 1.00 0.00 C ATOM 1439 CD LYS A 92 7.572 -3.976 -13.040 1.00 0.00 C ATOM 1440 CE LYS A 92 8.872 -3.226 -13.281 1.00 0.00 C ATOM 1441 NZ LYS A 92 9.722 -3.181 -12.059 1.00 0.00 N ATOM 0 H LYS A 92 4.343 -1.814 -12.775 1.00 0.00 H new ATOM 0 HA LYS A 92 4.047 -3.280 -15.313 1.00 0.00 H new ATOM 0 HB2 LYS A 92 5.076 -4.141 -12.581 1.00 0.00 H new ATOM 0 HB3 LYS A 92 5.038 -5.149 -14.014 1.00 0.00 H new ATOM 0 HG2 LYS A 92 6.792 -4.015 -15.040 1.00 0.00 H new ATOM 0 HG3 LYS A 92 6.480 -2.520 -14.180 1.00 0.00 H new ATOM 0 HD2 LYS A 92 7.202 -3.752 -12.040 1.00 0.00 H new ATOM 0 HD3 LYS A 92 7.757 -5.049 -13.079 1.00 0.00 H new ATOM 0 HE2 LYS A 92 9.424 -3.706 -14.089 1.00 0.00 H new ATOM 0 HE3 LYS A 92 8.650 -2.210 -13.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 10.599 -2.661 -12.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 9.206 -2.700 -11.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 9.956 -4.150 -11.763 1.00 0.00 H new ATOM 1455 N LYS A 93 1.927 -4.431 -14.793 1.00 0.00 N ATOM 1456 CA LYS A 93 0.634 -5.053 -14.532 1.00 0.00 C ATOM 1457 C LYS A 93 0.812 -6.472 -14.003 1.00 0.00 C ATOM 1458 O LYS A 93 1.137 -7.390 -14.757 1.00 0.00 O ATOM 1459 CB LYS A 93 -0.213 -5.073 -15.805 1.00 0.00 C ATOM 1460 CG LYS A 93 -1.705 -5.190 -15.541 1.00 0.00 C ATOM 1461 CD LYS A 93 -2.157 -6.641 -15.533 1.00 0.00 C ATOM 1462 CE LYS A 93 -3.601 -6.773 -15.076 1.00 0.00 C ATOM 1463 NZ LYS A 93 -3.696 -7.156 -13.640 1.00 0.00 N ATOM 0 H LYS A 93 2.209 -4.438 -15.773 1.00 0.00 H new ATOM 0 HA LYS A 93 0.121 -4.462 -13.773 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -0.023 -4.162 -16.372 1.00 0.00 H new ATOM 0 HB3 LYS A 93 0.104 -5.909 -16.429 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.943 -4.728 -14.583 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -2.255 -4.641 -16.305 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.051 -7.062 -16.533 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -1.511 -7.221 -14.873 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -4.120 -5.828 -15.235 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -4.108 -7.521 -15.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -4.696 -7.236 -13.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -3.223 -8.070 -13.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -3.235 -6.430 -13.056 1.00 0.00 H new ATOM 1477 N LEU A 94 0.598 -6.646 -12.704 1.00 0.00 N ATOM 1478 CA LEU A 94 0.734 -7.953 -12.073 1.00 0.00 C ATOM 1479 C LEU A 94 -0.445 -8.238 -11.149 1.00 0.00 C ATOM 1480 O LEU A 94 -1.025 -7.323 -10.566 1.00 0.00 O ATOM 1481 CB LEU A 94 2.044 -8.029 -11.286 1.00 0.00 C ATOM 1482 CG LEU A 94 3.312 -7.799 -12.115 1.00 0.00 C ATOM 1483 CD1 LEU A 94 4.119 -6.639 -11.551 1.00 0.00 C ATOM 1484 CD2 LEU A 94 4.157 -9.064 -12.162 1.00 0.00 C ATOM 0 H LEU A 94 0.329 -5.897 -12.066 1.00 0.00 H new ATOM 0 HA LEU A 94 0.746 -8.708 -12.859 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.013 -7.290 -10.485 1.00 0.00 H new ATOM 0 HB3 LEU A 94 2.110 -9.009 -10.813 1.00 0.00 H new ATOM 0 HG LEU A 94 3.014 -7.546 -13.133 1.00 0.00 H new ATOM 0 HD11 LEU A 94 5.015 -6.492 -12.154 1.00 0.00 H new ATOM 0 HD12 LEU A 94 3.515 -5.732 -11.572 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.406 -6.861 -10.523 1.00 0.00 H new ATOM 0 HD21 LEU A 94 5.053 -8.881 -12.755 1.00 0.00 H new ATOM 0 HD22 LEU A 94 4.444 -9.348 -11.149 1.00 0.00 H new ATOM 0 HD23 LEU A 94 3.580 -9.870 -12.615 1.00 0.00 H new ATOM 1496 N GLU A 95 -0.796 -9.513 -11.023 1.00 0.00 N ATOM 1497 CA GLU A 95 -1.907 -9.918 -10.169 1.00 0.00 C ATOM 1498 C GLU A 95 -1.427 -10.200 -8.748 1.00 0.00 C ATOM 1499 O GLU A 95 -1.027 -11.319 -8.427 1.00 0.00 O ATOM 1500 CB GLU A 95 -2.595 -11.157 -10.747 1.00 0.00 C ATOM 1501 CG GLU A 95 -3.931 -10.859 -11.407 1.00 0.00 C ATOM 1502 CD GLU A 95 -3.827 -10.764 -12.916 1.00 0.00 C ATOM 1503 OE1 GLU A 95 -2.719 -10.483 -13.419 1.00 0.00 O ATOM 1504 OE2 GLU A 95 -4.855 -10.971 -13.596 1.00 0.00 O ATOM 0 H GLU A 95 -0.328 -10.283 -11.501 1.00 0.00 H new ATOM 0 HA GLU A 95 -2.624 -9.098 -10.132 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -1.934 -11.622 -11.478 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -2.748 -11.883 -9.949 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -4.644 -11.640 -11.144 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -4.325 -9.922 -11.014 1.00 0.00 H new ATOM 1511 N TYR A 96 -1.469 -9.177 -7.902 1.00 0.00 N ATOM 1512 CA TYR A 96 -1.039 -9.313 -6.514 1.00 0.00 C ATOM 1513 C TYR A 96 -2.150 -9.910 -5.656 1.00 0.00 C ATOM 1514 O TYR A 96 -1.916 -10.826 -4.868 1.00 0.00 O ATOM 1515 CB TYR A 96 -0.619 -7.955 -5.952 1.00 0.00 C ATOM 1516 CG TYR A 96 0.388 -7.226 -6.814 1.00 0.00 C ATOM 1517 CD1 TYR A 96 -0.026 -6.387 -7.841 1.00 0.00 C ATOM 1518 CD2 TYR A 96 1.752 -7.378 -6.600 1.00 0.00 C ATOM 1519 CE1 TYR A 96 0.891 -5.721 -8.631 1.00 0.00 C ATOM 1520 CE2 TYR A 96 2.675 -6.714 -7.385 1.00 0.00 C ATOM 1521 CZ TYR A 96 2.240 -5.887 -8.399 1.00 0.00 C ATOM 1522 OH TYR A 96 3.156 -5.224 -9.183 1.00 0.00 O ATOM 0 H TYR A 96 -1.796 -8.244 -8.152 1.00 0.00 H new ATOM 0 HA TYR A 96 -0.183 -9.988 -6.490 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -1.504 -7.330 -5.836 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -0.197 -8.098 -4.957 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -1.082 -6.253 -8.025 1.00 0.00 H new ATOM 0 HD2 TYR A 96 2.097 -8.026 -5.807 1.00 0.00 H new ATOM 0 HE1 TYR A 96 0.553 -5.073 -9.426 1.00 0.00 H new ATOM 0 HE2 TYR A 96 3.732 -6.842 -7.205 1.00 0.00 H new ATOM 0 HH TYR A 96 3.596 -4.527 -8.653 1.00 0.00 H new ATOM 1532 N THR A 97 -3.359 -9.383 -5.814 1.00 0.00 N ATOM 1533 CA THR A 97 -4.508 -9.862 -5.054 1.00 0.00 C ATOM 1534 C THR A 97 -4.763 -11.343 -5.320 1.00 0.00 C ATOM 1535 O THR A 97 -5.317 -12.048 -4.478 1.00 0.00 O ATOM 1536 CB THR A 97 -5.754 -9.047 -5.405 1.00 0.00 C ATOM 1537 OG1 THR A 97 -5.674 -8.554 -6.731 1.00 0.00 O ATOM 1538 CG2 THR A 97 -5.975 -7.865 -4.487 1.00 0.00 C ATOM 0 H THR A 97 -3.569 -8.624 -6.462 1.00 0.00 H new ATOM 0 HA THR A 97 -4.286 -9.737 -3.994 1.00 0.00 H new ATOM 0 HB THR A 97 -6.591 -9.736 -5.290 1.00 0.00 H new ATOM 0 HG1 THR A 97 -5.287 -7.654 -6.722 1.00 0.00 H new ATOM 0 HG21 THR A 97 -6.875 -7.331 -4.792 1.00 0.00 H new ATOM 0 HG22 THR A 97 -6.092 -8.217 -3.462 1.00 0.00 H new ATOM 0 HG23 THR A 97 -5.118 -7.194 -4.545 1.00 0.00 H new ATOM 1546 N LYS A 98 -4.354 -11.810 -6.496 1.00 0.00 N ATOM 1547 CA LYS A 98 -4.540 -13.208 -6.869 1.00 0.00 C ATOM 1548 C LYS A 98 -3.859 -14.137 -5.867 1.00 0.00 C ATOM 1549 O LYS A 98 -4.299 -15.268 -5.657 1.00 0.00 O ATOM 1550 CB LYS A 98 -3.987 -13.460 -8.273 1.00 0.00 C ATOM 1551 CG LYS A 98 -4.484 -14.754 -8.899 1.00 0.00 C ATOM 1552 CD LYS A 98 -5.502 -14.488 -9.997 1.00 0.00 C ATOM 1553 CE LYS A 98 -6.265 -15.750 -10.366 1.00 0.00 C ATOM 1554 NZ LYS A 98 -7.367 -16.035 -9.406 1.00 0.00 N ATOM 0 H LYS A 98 -3.892 -11.242 -7.206 1.00 0.00 H new ATOM 0 HA LYS A 98 -5.609 -13.420 -6.862 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -4.261 -12.625 -8.918 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -2.898 -13.483 -8.227 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -3.640 -15.308 -9.310 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -4.933 -15.382 -8.130 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -6.203 -13.721 -9.667 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -4.994 -14.098 -10.879 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -6.677 -15.645 -11.370 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -5.578 -16.595 -10.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -7.862 -16.903 -9.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -6.972 -16.161 -8.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -8.037 -15.240 -9.401 1.00 0.00 H new ATOM 1568 N ASN A 99 -2.784 -13.653 -5.254 1.00 0.00 N ATOM 1569 CA ASN A 99 -2.044 -14.442 -4.274 1.00 0.00 C ATOM 1570 C ASN A 99 -2.339 -13.966 -2.856 1.00 0.00 C ATOM 1571 O ASN A 99 -1.477 -14.022 -1.979 1.00 0.00 O ATOM 1572 CB ASN A 99 -0.542 -14.358 -4.550 1.00 0.00 C ATOM 1573 CG ASN A 99 -0.172 -14.907 -5.914 1.00 0.00 C ATOM 1574 OD1 ASN A 99 -0.056 -16.119 -6.096 1.00 0.00 O ATOM 1575 ND2 ASN A 99 0.014 -14.016 -6.880 1.00 0.00 N ATOM 0 H ASN A 99 -2.406 -12.720 -5.418 1.00 0.00 H new ATOM 0 HA ASN A 99 -2.366 -15.480 -4.363 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -0.220 -13.319 -4.480 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -0.003 -14.911 -3.781 1.00 0.00 H new ATOM 0 HD21 ASN A 99 0.264 -14.326 -7.819 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -0.093 -13.021 -6.683 1.00 0.00 H new ATOM 1582 N VAL A 100 -3.563 -13.497 -2.637 1.00 0.00 N ATOM 1583 CA VAL A 100 -3.974 -13.010 -1.325 1.00 0.00 C ATOM 1584 C VAL A 100 -5.479 -13.161 -1.127 1.00 0.00 C ATOM 1585 O VAL A 100 -5.935 -13.601 -0.072 1.00 0.00 O ATOM 1586 CB VAL A 100 -3.589 -11.532 -1.126 1.00 0.00 C ATOM 1587 CG1 VAL A 100 -3.847 -11.099 0.308 1.00 0.00 C ATOM 1588 CG2 VAL A 100 -2.133 -11.304 -1.507 1.00 0.00 C ATOM 0 H VAL A 100 -4.288 -13.444 -3.352 1.00 0.00 H new ATOM 0 HA VAL A 100 -3.450 -13.617 -0.587 1.00 0.00 H new ATOM 0 HB VAL A 100 -4.212 -10.923 -1.781 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -3.568 -10.052 0.428 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -4.905 -11.222 0.540 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -3.253 -11.712 0.986 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -1.879 -10.254 -1.360 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -1.492 -11.924 -0.881 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -1.985 -11.570 -2.554 1.00 0.00 H new ATOM 1598 N ASN A 101 -6.245 -12.794 -2.150 1.00 0.00 N ATOM 1599 CA ASN A 101 -7.701 -12.887 -2.093 1.00 0.00 C ATOM 1600 C ASN A 101 -8.275 -11.861 -1.116 1.00 0.00 C ATOM 1601 O ASN A 101 -7.763 -11.696 -0.009 1.00 0.00 O ATOM 1602 CB ASN A 101 -8.132 -14.297 -1.684 1.00 0.00 C ATOM 1603 CG ASN A 101 -9.340 -14.783 -2.461 1.00 0.00 C ATOM 1604 OD1 ASN A 101 -10.442 -14.882 -1.923 1.00 0.00 O ATOM 1605 ND2 ASN A 101 -9.137 -15.088 -3.738 1.00 0.00 N ATOM 0 H ASN A 101 -5.881 -12.429 -3.030 1.00 0.00 H new ATOM 0 HA ASN A 101 -8.091 -12.673 -3.088 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -7.302 -14.987 -1.840 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -8.361 -14.309 -0.618 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -9.912 -15.419 -4.313 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -8.206 -14.991 -4.144 1.00 0.00 H new ATOM 1612 N PRO A 102 -9.351 -11.155 -1.511 1.00 0.00 N ATOM 1613 CA PRO A 102 -9.987 -10.145 -0.657 1.00 0.00 C ATOM 1614 C PRO A 102 -10.391 -10.711 0.700 1.00 0.00 C ATOM 1615 O PRO A 102 -11.432 -11.353 0.830 1.00 0.00 O ATOM 1616 CB PRO A 102 -11.229 -9.729 -1.449 1.00 0.00 C ATOM 1617 CG PRO A 102 -10.915 -10.069 -2.864 1.00 0.00 C ATOM 1618 CD PRO A 102 -10.032 -11.283 -2.813 1.00 0.00 C ATOM 0 HA PRO A 102 -9.312 -9.318 -0.437 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -12.115 -10.261 -1.102 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -11.432 -8.664 -1.335 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -11.826 -10.272 -3.427 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -10.411 -9.241 -3.361 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -10.611 -12.204 -2.875 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -9.321 -11.298 -3.639 1.00 0.00 H new ATOM 1626 N ASN A 103 -9.559 -10.468 1.708 1.00 0.00 N ATOM 1627 CA ASN A 103 -9.832 -10.956 3.054 1.00 0.00 C ATOM 1628 C ASN A 103 -8.774 -10.465 4.037 1.00 0.00 C ATOM 1629 O ASN A 103 -8.243 -11.240 4.834 1.00 0.00 O ATOM 1630 CB ASN A 103 -9.887 -12.485 3.061 1.00 0.00 C ATOM 1631 CG ASN A 103 -10.872 -13.024 4.080 1.00 0.00 C ATOM 1632 OD1 ASN A 103 -11.812 -13.739 3.734 1.00 0.00 O ATOM 1633 ND2 ASN A 103 -10.661 -12.682 5.346 1.00 0.00 N ATOM 0 H ASN A 103 -8.693 -9.937 1.618 1.00 0.00 H new ATOM 0 HA ASN A 103 -10.799 -10.564 3.368 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -10.164 -12.840 2.069 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -8.894 -12.880 3.275 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -11.291 -13.014 6.076 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -9.869 -12.087 5.588 1.00 0.00 H new ATOM 1640 N TRP A 104 -8.471 -9.172 3.975 1.00 0.00 N ATOM 1641 CA TRP A 104 -7.476 -8.575 4.860 1.00 0.00 C ATOM 1642 C TRP A 104 -8.108 -7.503 5.742 1.00 0.00 C ATOM 1643 O TRP A 104 -7.801 -7.403 6.930 1.00 0.00 O ATOM 1644 CB TRP A 104 -6.331 -7.973 4.044 1.00 0.00 C ATOM 1645 CG TRP A 104 -6.792 -7.010 2.993 1.00 0.00 C ATOM 1646 CD1 TRP A 104 -7.388 -7.318 1.804 1.00 0.00 C ATOM 1647 CD2 TRP A 104 -6.693 -5.581 3.035 1.00 0.00 C ATOM 1648 NE1 TRP A 104 -7.667 -6.169 1.104 1.00 0.00 N ATOM 1649 CE2 TRP A 104 -7.249 -5.090 1.839 1.00 0.00 C ATOM 1650 CE3 TRP A 104 -6.189 -4.671 3.967 1.00 0.00 C ATOM 1651 CZ2 TRP A 104 -7.315 -3.729 1.552 1.00 0.00 C ATOM 1652 CZ3 TRP A 104 -6.254 -3.320 3.682 1.00 0.00 C ATOM 1653 CH2 TRP A 104 -6.814 -2.860 2.483 1.00 0.00 C ATOM 0 H TRP A 104 -8.900 -8.517 3.321 1.00 0.00 H new ATOM 0 HA TRP A 104 -7.079 -9.361 5.502 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -5.644 -7.462 4.718 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -5.771 -8.778 3.568 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -7.608 -8.319 1.463 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -8.112 -6.126 0.187 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -5.756 -5.017 4.894 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -7.746 -3.372 0.628 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -5.867 -2.607 4.395 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -6.851 -1.798 2.290 1.00 0.00 H new ATOM 1664 N SER A 105 -8.990 -6.703 5.153 1.00 0.00 N ATOM 1665 CA SER A 105 -9.665 -5.638 5.885 1.00 0.00 C ATOM 1666 C SER A 105 -11.077 -6.060 6.279 1.00 0.00 C ATOM 1667 O SER A 105 -11.982 -5.229 6.366 1.00 0.00 O ATOM 1668 CB SER A 105 -9.717 -4.364 5.040 1.00 0.00 C ATOM 1669 OG SER A 105 -9.993 -3.230 5.845 1.00 0.00 O ATOM 0 H SER A 105 -9.254 -6.772 4.170 1.00 0.00 H new ATOM 0 HA SER A 105 -9.098 -5.439 6.794 1.00 0.00 H new ATOM 0 HB2 SER A 105 -8.766 -4.226 4.525 1.00 0.00 H new ATOM 0 HB3 SER A 105 -10.484 -4.464 4.272 1.00 0.00 H new ATOM 0 HG SER A 105 -10.803 -3.392 6.372 1.00 0.00 H new