USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 680 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 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 120 SER OG : rot -25:sc= 0.08 USER MOD Set 2.1: A 44 GLN : amide:sc= 1.01 K(o=2.8,f=0.84) USER MOD Set 2.2: A 94 TYR OH : rot 174:sc= 1.8 USER MOD Set 3.1: A 12 LYS NZ :NH3+ 154:sc= 1.15 (180deg=-0.297!) USER MOD Set 3.2: A 163 SER OG : rot -7:sc= 2.11 USER MOD Set 4.1: A 6 THR OG1 : rot 131:sc= 2.04 USER MOD Set 4.2: A 8 TYR OH : rot 180:sc= 0.915 USER MOD Single : A 5 ASN : amide:sc= 0.444 X(o=0.44,f=-0.00045) USER MOD Single : A 9 THR OG1 : rot -16:sc= 1.22 USER MOD Single : A 16 SER OG : rot 53:sc= 1.3 USER MOD Single : A 43 TYR OH : rot 23:sc= 1.15 USER MOD Single : A 53 MET CE :methyl 173:sc= 0 (180deg=-0.056) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= 0.625 K(o=0.62,f=-3.6!) USER MOD Single : A 80 THR OG1 : rot -41:sc= 0.82! USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 2.26 (180deg=2.26) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 THR OG1 : rot 88:sc= 1.22 USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 142 GLN : amide:sc= -0.264! X(o=-0.26!,f=-0.71) USER MOD Single : A 161 MET CE :methyl -170:sc= -0.403 (180deg=-0.485) USER MOD Single : A 167 SER OG : rot 150:sc= 0 USER MOD Single : A 168 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 59 N ASN A 5 -10.434 -15.084 -5.225 1.00 0.00 N ATOM 60 CA ASN A 5 -11.601 -15.077 -4.334 1.00 0.00 C ATOM 61 C ASN A 5 -11.198 -14.974 -2.859 1.00 0.00 C ATOM 62 O ASN A 5 -11.071 -15.979 -2.161 1.00 0.00 O ATOM 63 CB ASN A 5 -12.586 -16.233 -4.655 1.00 0.00 C ATOM 64 CG ASN A 5 -12.061 -17.301 -5.615 1.00 0.00 C ATOM 65 OD1 ASN A 5 -11.749 -18.423 -5.220 1.00 0.00 O ATOM 66 ND2 ASN A 5 -11.907 -16.976 -6.897 1.00 0.00 N ATOM 0 HA ASN A 5 -12.166 -14.166 -4.533 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -12.867 -16.717 -3.720 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -13.495 -15.805 -5.078 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -11.529 -17.658 -7.554 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -12.167 -16.045 -7.222 1.00 0.00 H new ATOM 73 N THR A 6 -10.995 -13.735 -2.399 1.00 0.00 N ATOM 74 CA THR A 6 -10.453 -13.372 -1.097 1.00 0.00 C ATOM 75 C THR A 6 -10.963 -11.975 -0.708 1.00 0.00 C ATOM 76 O THR A 6 -11.382 -11.196 -1.568 1.00 0.00 O ATOM 77 CB THR A 6 -8.906 -13.390 -1.135 1.00 0.00 C ATOM 78 OG1 THR A 6 -8.373 -12.618 -2.199 1.00 0.00 O ATOM 79 CG2 THR A 6 -8.297 -14.792 -1.223 1.00 0.00 C ATOM 0 H THR A 6 -11.220 -12.915 -2.963 1.00 0.00 H new ATOM 0 HA THR A 6 -10.784 -14.096 -0.353 1.00 0.00 H new ATOM 0 HB THR A 6 -8.629 -12.950 -0.177 1.00 0.00 H new ATOM 0 HG1 THR A 6 -7.670 -12.029 -1.855 1.00 0.00 H new ATOM 0 HG21 THR A 6 -7.210 -14.716 -1.245 1.00 0.00 H new ATOM 0 HG22 THR A 6 -8.602 -15.376 -0.355 1.00 0.00 H new ATOM 0 HG23 THR A 6 -8.645 -15.283 -2.132 1.00 0.00 H new ATOM 87 N TRP A 7 -10.885 -11.642 0.586 1.00 0.00 N ATOM 88 CA TRP A 7 -11.203 -10.330 1.142 1.00 0.00 C ATOM 89 C TRP A 7 -10.088 -9.965 2.124 1.00 0.00 C ATOM 90 O TRP A 7 -9.512 -10.853 2.756 1.00 0.00 O ATOM 91 CB TRP A 7 -12.591 -10.371 1.811 1.00 0.00 C ATOM 92 CG TRP A 7 -13.094 -9.088 2.418 1.00 0.00 C ATOM 93 CD1 TRP A 7 -12.585 -8.492 3.519 1.00 0.00 C ATOM 94 CD2 TRP A 7 -14.220 -8.245 2.015 1.00 0.00 C ATOM 95 NE1 TRP A 7 -13.263 -7.325 3.792 1.00 0.00 N ATOM 96 CE2 TRP A 7 -14.284 -7.118 2.890 1.00 0.00 C ATOM 97 CE3 TRP A 7 -15.206 -8.321 1.005 1.00 0.00 C ATOM 98 CZ2 TRP A 7 -15.246 -6.105 2.748 1.00 0.00 C ATOM 99 CZ3 TRP A 7 -16.180 -7.316 0.857 1.00 0.00 C ATOM 100 CH2 TRP A 7 -16.197 -6.205 1.720 1.00 0.00 C ATOM 0 H TRP A 7 -10.587 -12.308 1.299 1.00 0.00 H new ATOM 0 HA TRP A 7 -11.254 -9.565 0.367 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -13.316 -10.701 1.067 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -12.568 -11.130 2.593 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -11.762 -8.877 4.103 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -13.039 -6.695 4.562 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -15.212 -9.167 0.334 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -15.254 -5.260 3.421 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -16.920 -7.398 0.075 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -16.940 -5.431 1.592 1.00 0.00 H new ATOM 111 N TYR A 8 -9.808 -8.668 2.264 1.00 0.00 N ATOM 112 CA TYR A 8 -8.723 -8.089 3.045 1.00 0.00 C ATOM 113 C TYR A 8 -9.271 -6.914 3.854 1.00 0.00 C ATOM 114 O TYR A 8 -10.159 -6.195 3.387 1.00 0.00 O ATOM 115 CB TYR A 8 -7.612 -7.607 2.097 1.00 0.00 C ATOM 116 CG TYR A 8 -7.112 -8.666 1.134 1.00 0.00 C ATOM 117 CD1 TYR A 8 -7.755 -8.839 -0.107 1.00 0.00 C ATOM 118 CD2 TYR A 8 -6.043 -9.507 1.497 1.00 0.00 C ATOM 119 CE1 TYR A 8 -7.374 -9.884 -0.961 1.00 0.00 C ATOM 120 CE2 TYR A 8 -5.644 -10.547 0.637 1.00 0.00 C ATOM 121 CZ TYR A 8 -6.328 -10.755 -0.581 1.00 0.00 C ATOM 122 OH TYR A 8 -6.027 -11.832 -1.353 1.00 0.00 O ATOM 0 H TYR A 8 -10.371 -7.952 1.804 1.00 0.00 H new ATOM 0 HA TYR A 8 -8.308 -8.835 3.723 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -7.983 -6.757 1.524 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -6.772 -7.248 2.692 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -8.545 -8.164 -0.402 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -5.530 -9.354 2.435 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -7.878 -10.023 -1.906 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -4.816 -11.185 0.908 1.00 0.00 H new ATOM 0 HH TYR A 8 -5.283 -12.326 -0.950 1.00 0.00 H new ATOM 132 N THR A 9 -8.776 -6.688 5.073 1.00 0.00 N ATOM 133 CA THR A 9 -9.094 -5.502 5.873 1.00 0.00 C ATOM 134 C THR A 9 -7.893 -5.179 6.772 1.00 0.00 C ATOM 135 O THR A 9 -7.294 -6.087 7.347 1.00 0.00 O ATOM 136 CB THR A 9 -10.417 -5.732 6.624 1.00 0.00 C ATOM 137 OG1 THR A 9 -11.443 -5.975 5.672 1.00 0.00 O ATOM 138 CG2 THR A 9 -10.844 -4.524 7.461 1.00 0.00 C ATOM 0 H THR A 9 -8.135 -7.331 5.538 1.00 0.00 H new ATOM 0 HA THR A 9 -9.258 -4.622 5.252 1.00 0.00 H new ATOM 0 HB THR A 9 -10.262 -6.576 7.296 1.00 0.00 H new ATOM 0 HG1 THR A 9 -11.138 -5.696 4.784 1.00 0.00 H new ATOM 0 HG21 THR A 9 -11.784 -4.746 7.967 1.00 0.00 H new ATOM 0 HG22 THR A 9 -10.075 -4.305 8.202 1.00 0.00 H new ATOM 0 HG23 THR A 9 -10.978 -3.660 6.811 1.00 0.00 H new ATOM 146 N GLY A 10 -7.509 -3.899 6.851 1.00 0.00 N ATOM 147 CA GLY A 10 -6.191 -3.477 7.304 1.00 0.00 C ATOM 148 C GLY A 10 -6.076 -1.962 7.456 1.00 0.00 C ATOM 149 O GLY A 10 -7.078 -1.273 7.657 1.00 0.00 O ATOM 0 H GLY A 10 -8.118 -3.122 6.597 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -5.971 -3.951 8.260 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -5.439 -3.825 6.595 1.00 0.00 H new ATOM 153 N ALA A 11 -4.845 -1.445 7.364 1.00 0.00 N ATOM 154 CA ALA A 11 -4.534 -0.019 7.404 1.00 0.00 C ATOM 155 C ALA A 11 -3.460 0.338 6.371 1.00 0.00 C ATOM 156 O ALA A 11 -2.745 -0.542 5.881 1.00 0.00 O ATOM 157 CB ALA A 11 -4.091 0.366 8.821 1.00 0.00 C ATOM 0 H ALA A 11 -4.016 -2.029 7.256 1.00 0.00 H new ATOM 0 HA ALA A 11 -5.429 0.548 7.148 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -3.858 1.430 8.853 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -4.894 0.149 9.525 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -3.205 -0.207 9.094 1.00 0.00 H new ATOM 163 N LYS A 12 -3.345 1.637 6.063 1.00 0.00 N ATOM 164 CA LYS A 12 -2.435 2.202 5.067 1.00 0.00 C ATOM 165 C LYS A 12 -1.843 3.499 5.619 1.00 0.00 C ATOM 166 O LYS A 12 -2.544 4.273 6.272 1.00 0.00 O ATOM 167 CB LYS A 12 -3.217 2.421 3.757 1.00 0.00 C ATOM 168 CG LYS A 12 -2.449 3.122 2.614 1.00 0.00 C ATOM 169 CD LYS A 12 -3.352 3.161 1.369 1.00 0.00 C ATOM 170 CE LYS A 12 -2.928 4.124 0.253 1.00 0.00 C ATOM 171 NZ LYS A 12 -1.969 3.535 -0.705 1.00 0.00 N ATOM 0 H LYS A 12 -3.910 2.351 6.523 1.00 0.00 H new ATOM 0 HA LYS A 12 -1.606 1.527 4.853 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -3.559 1.451 3.396 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -4.107 3.009 3.983 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -2.169 4.133 2.910 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -1.525 2.587 2.395 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -3.404 2.155 0.952 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -4.360 3.427 1.686 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -3.815 4.452 -0.289 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -2.482 5.012 0.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -2.055 4.017 -1.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -1.001 3.650 -0.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -2.175 2.523 -0.825 1.00 0.00 H new ATOM 185 N LEU A 13 -0.563 3.740 5.332 1.00 0.00 N ATOM 186 CA LEU A 13 0.186 4.948 5.656 1.00 0.00 C ATOM 187 C LEU A 13 0.768 5.463 4.343 1.00 0.00 C ATOM 188 O LEU A 13 1.226 4.661 3.528 1.00 0.00 O ATOM 189 CB LEU A 13 1.325 4.660 6.651 1.00 0.00 C ATOM 190 CG LEU A 13 0.884 4.289 8.084 1.00 0.00 C ATOM 191 CD1 LEU A 13 0.582 2.791 8.251 1.00 0.00 C ATOM 192 CD2 LEU A 13 1.996 4.665 9.074 1.00 0.00 C ATOM 0 H LEU A 13 0.009 3.055 4.838 1.00 0.00 H new ATOM 0 HA LEU A 13 -0.470 5.680 6.127 1.00 0.00 H new ATOM 0 HB2 LEU A 13 1.932 3.846 6.255 1.00 0.00 H new ATOM 0 HB3 LEU A 13 1.967 5.539 6.704 1.00 0.00 H new ATOM 0 HG LEU A 13 -0.035 4.842 8.281 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.278 2.594 9.279 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -0.222 2.504 7.573 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.476 2.212 8.020 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.686 4.404 10.086 1.00 0.00 H new ATOM 0 HD22 LEU A 13 2.907 4.122 8.822 1.00 0.00 H new ATOM 0 HD23 LEU A 13 2.186 5.737 9.018 1.00 0.00 H new ATOM 204 N GLY A 14 0.749 6.780 4.134 1.00 0.00 N ATOM 205 CA GLY A 14 1.145 7.424 2.895 1.00 0.00 C ATOM 206 C GLY A 14 2.093 8.587 3.151 1.00 0.00 C ATOM 207 O GLY A 14 1.981 9.298 4.155 1.00 0.00 O ATOM 0 H GLY A 14 0.447 7.442 4.848 1.00 0.00 H new ATOM 0 HA2 GLY A 14 1.628 6.696 2.243 1.00 0.00 H new ATOM 0 HA3 GLY A 14 0.259 7.783 2.371 1.00 0.00 H new ATOM 211 N PHE A 15 2.988 8.801 2.187 1.00 0.00 N ATOM 212 CA PHE A 15 4.159 9.652 2.257 1.00 0.00 C ATOM 213 C PHE A 15 4.250 10.418 0.937 1.00 0.00 C ATOM 214 O PHE A 15 4.162 9.818 -0.128 1.00 0.00 O ATOM 215 CB PHE A 15 5.412 8.785 2.486 1.00 0.00 C ATOM 216 CG PHE A 15 5.215 7.634 3.463 1.00 0.00 C ATOM 217 CD1 PHE A 15 5.005 7.889 4.832 1.00 0.00 C ATOM 218 CD2 PHE A 15 5.161 6.309 2.987 1.00 0.00 C ATOM 219 CE1 PHE A 15 4.737 6.827 5.715 1.00 0.00 C ATOM 220 CE2 PHE A 15 4.894 5.247 3.870 1.00 0.00 C ATOM 221 CZ PHE A 15 4.681 5.506 5.234 1.00 0.00 C ATOM 0 H PHE A 15 2.901 8.350 1.277 1.00 0.00 H new ATOM 0 HA PHE A 15 4.089 10.357 3.086 1.00 0.00 H new ATOM 0 HB2 PHE A 15 5.738 8.380 1.528 1.00 0.00 H new ATOM 0 HB3 PHE A 15 6.217 9.422 2.853 1.00 0.00 H new ATOM 0 HD1 PHE A 15 5.050 8.902 5.205 1.00 0.00 H new ATOM 0 HD2 PHE A 15 5.325 6.108 1.939 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.574 7.026 6.764 1.00 0.00 H new ATOM 0 HE2 PHE A 15 4.853 4.233 3.499 1.00 0.00 H new ATOM 0 HZ PHE A 15 4.474 4.692 5.913 1.00 0.00 H new ATOM 231 N SER A 16 4.400 11.738 0.988 1.00 0.00 N ATOM 232 CA SER A 16 4.685 12.596 -0.147 1.00 0.00 C ATOM 233 C SER A 16 5.656 13.675 0.344 1.00 0.00 C ATOM 234 O SER A 16 6.147 13.609 1.481 1.00 0.00 O ATOM 235 CB SER A 16 3.379 13.159 -0.727 1.00 0.00 C ATOM 236 OG SER A 16 3.613 13.888 -1.920 1.00 0.00 O ATOM 0 H SER A 16 4.322 12.257 1.862 1.00 0.00 H new ATOM 0 HA SER A 16 5.153 12.053 -0.968 1.00 0.00 H new ATOM 0 HB2 SER A 16 2.687 12.341 -0.929 1.00 0.00 H new ATOM 0 HB3 SER A 16 2.902 13.806 0.009 1.00 0.00 H new ATOM 0 HG SER A 16 4.128 13.336 -2.545 1.00 0.00 H new ATOM 509 N LEU A 35 2.255 12.110 3.954 1.00 0.00 N ATOM 510 CA LEU A 35 1.028 12.518 3.279 1.00 0.00 C ATOM 511 C LEU A 35 -0.114 12.379 4.277 1.00 0.00 C ATOM 512 O LEU A 35 -0.765 13.381 4.570 1.00 0.00 O ATOM 513 CB LEU A 35 0.811 11.723 1.975 1.00 0.00 C ATOM 514 CG LEU A 35 -0.376 12.143 1.079 1.00 0.00 C ATOM 515 CD1 LEU A 35 -1.739 11.675 1.606 1.00 0.00 C ATOM 516 CD2 LEU A 35 -0.409 13.649 0.791 1.00 0.00 C ATOM 0 HA LEU A 35 1.086 13.558 2.959 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.723 11.792 1.382 1.00 0.00 H new ATOM 0 HB3 LEU A 35 0.681 10.673 2.238 1.00 0.00 H new ATOM 0 HG LEU A 35 -0.195 11.624 0.138 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.525 12.006 0.927 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.750 10.587 1.671 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -1.912 12.099 2.595 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -1.265 13.880 0.157 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -0.494 14.197 1.729 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.509 13.942 0.281 1.00 0.00 H new ATOM 528 N GLY A 36 -0.327 11.171 4.817 1.00 0.00 N ATOM 529 CA GLY A 36 -1.436 10.864 5.713 1.00 0.00 C ATOM 530 C GLY A 36 -1.468 9.370 6.037 1.00 0.00 C ATOM 531 O GLY A 36 -0.525 8.646 5.722 1.00 0.00 O ATOM 0 H GLY A 36 0.280 10.371 4.637 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -1.337 11.439 6.634 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -2.377 11.162 5.251 1.00 0.00 H new ATOM 535 N ALA A 37 -2.544 8.895 6.671 1.00 0.00 N ATOM 536 CA ALA A 37 -2.793 7.480 6.924 1.00 0.00 C ATOM 537 C ALA A 37 -4.306 7.243 6.947 1.00 0.00 C ATOM 538 O ALA A 37 -5.074 8.205 6.963 1.00 0.00 O ATOM 539 CB ALA A 37 -2.146 7.074 8.255 1.00 0.00 C ATOM 0 H ALA A 37 -3.282 9.501 7.030 1.00 0.00 H new ATOM 0 HA ALA A 37 -2.353 6.868 6.136 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -2.333 6.017 8.443 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -1.071 7.249 8.206 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -2.574 7.667 9.063 1.00 0.00 H new ATOM 545 N GLY A 38 -4.730 5.976 6.973 1.00 0.00 N ATOM 546 CA GLY A 38 -6.134 5.600 7.049 1.00 0.00 C ATOM 547 C GLY A 38 -6.299 4.095 7.251 1.00 0.00 C ATOM 548 O GLY A 38 -5.318 3.347 7.311 1.00 0.00 O ATOM 0 H GLY A 38 -4.096 5.178 6.941 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -6.611 6.133 7.871 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -6.643 5.904 6.134 1.00 0.00 H new ATOM 552 N ALA A 39 -7.557 3.652 7.315 1.00 0.00 N ATOM 553 CA ALA A 39 -7.915 2.240 7.377 1.00 0.00 C ATOM 554 C ALA A 39 -8.203 1.759 5.951 1.00 0.00 C ATOM 555 O ALA A 39 -8.459 2.569 5.057 1.00 0.00 O ATOM 556 CB ALA A 39 -9.136 2.063 8.285 1.00 0.00 C ATOM 0 H ALA A 39 -8.364 4.276 7.325 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.102 1.647 7.795 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -9.405 1.008 8.332 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -8.900 2.422 9.287 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -9.974 2.633 7.883 1.00 0.00 H new ATOM 562 N PHE A 40 -8.128 0.446 5.725 1.00 0.00 N ATOM 563 CA PHE A 40 -7.997 -0.130 4.393 1.00 0.00 C ATOM 564 C PHE A 40 -8.770 -1.445 4.283 1.00 0.00 C ATOM 565 O PHE A 40 -8.984 -2.124 5.288 1.00 0.00 O ATOM 566 CB PHE A 40 -6.500 -0.346 4.119 1.00 0.00 C ATOM 567 CG PHE A 40 -6.143 -0.280 2.654 1.00 0.00 C ATOM 568 CD1 PHE A 40 -6.177 0.964 1.999 1.00 0.00 C ATOM 569 CD2 PHE A 40 -5.772 -1.439 1.948 1.00 0.00 C ATOM 570 CE1 PHE A 40 -5.827 1.055 0.644 1.00 0.00 C ATOM 571 CE2 PHE A 40 -5.420 -1.344 0.591 1.00 0.00 C ATOM 572 CZ PHE A 40 -5.437 -0.096 -0.058 1.00 0.00 C ATOM 0 H PHE A 40 -8.157 -0.250 6.470 1.00 0.00 H new ATOM 0 HA PHE A 40 -8.420 0.547 3.651 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -5.927 0.408 4.659 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -6.202 -1.317 4.515 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -6.473 1.850 2.540 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -5.758 -2.397 2.447 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -5.858 2.010 0.141 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -5.136 -2.231 0.045 1.00 0.00 H new ATOM 0 HZ PHE A 40 -5.150 -0.024 -1.097 1.00 0.00 H new ATOM 582 N GLY A 41 -9.146 -1.840 3.066 1.00 0.00 N ATOM 583 CA GLY A 41 -9.714 -3.149 2.785 1.00 0.00 C ATOM 584 C GLY A 41 -9.680 -3.451 1.294 1.00 0.00 C ATOM 585 O GLY A 41 -9.349 -2.580 0.496 1.00 0.00 O ATOM 0 H GLY A 41 -9.061 -1.248 2.240 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -9.158 -3.914 3.327 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -10.743 -3.187 3.144 1.00 0.00 H new ATOM 589 N GLY A 42 -10.014 -4.678 0.902 1.00 0.00 N ATOM 590 CA GLY A 42 -10.105 -5.043 -0.504 1.00 0.00 C ATOM 591 C GLY A 42 -10.774 -6.390 -0.687 1.00 0.00 C ATOM 592 O GLY A 42 -10.940 -7.132 0.280 1.00 0.00 O ATOM 0 H GLY A 42 -10.227 -5.440 1.546 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -10.667 -4.280 -1.043 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -9.106 -5.070 -0.939 1.00 0.00 H new ATOM 596 N TYR A 43 -11.165 -6.700 -1.922 1.00 0.00 N ATOM 597 CA TYR A 43 -11.721 -7.987 -2.299 1.00 0.00 C ATOM 598 C TYR A 43 -11.347 -8.294 -3.745 1.00 0.00 C ATOM 599 O TYR A 43 -11.477 -7.453 -4.635 1.00 0.00 O ATOM 600 CB TYR A 43 -13.238 -8.033 -2.051 1.00 0.00 C ATOM 601 CG TYR A 43 -14.004 -6.741 -2.297 1.00 0.00 C ATOM 602 CD1 TYR A 43 -14.118 -5.792 -1.261 1.00 0.00 C ATOM 603 CD2 TYR A 43 -14.607 -6.488 -3.543 1.00 0.00 C ATOM 604 CE1 TYR A 43 -14.806 -4.585 -1.469 1.00 0.00 C ATOM 605 CE2 TYR A 43 -15.322 -5.294 -3.751 1.00 0.00 C ATOM 606 CZ TYR A 43 -15.411 -4.330 -2.721 1.00 0.00 C ATOM 607 OH TYR A 43 -16.069 -3.159 -2.946 1.00 0.00 O ATOM 0 H TYR A 43 -11.100 -6.045 -2.701 1.00 0.00 H new ATOM 0 HA TYR A 43 -11.294 -8.768 -1.670 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -13.665 -8.809 -2.686 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -13.406 -8.338 -1.018 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -13.672 -5.995 -0.298 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -14.521 -7.211 -4.341 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -14.872 -3.855 -0.676 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -15.804 -5.114 -4.700 1.00 0.00 H new ATOM 0 HH TYR A 43 -15.743 -2.476 -2.324 1.00 0.00 H new ATOM 617 N GLN A 44 -10.883 -9.520 -3.969 1.00 0.00 N ATOM 618 CA GLN A 44 -10.528 -10.057 -5.275 1.00 0.00 C ATOM 619 C GLN A 44 -11.386 -11.302 -5.492 1.00 0.00 C ATOM 620 O GLN A 44 -11.875 -11.891 -4.525 1.00 0.00 O ATOM 621 CB GLN A 44 -9.011 -10.321 -5.325 1.00 0.00 C ATOM 622 CG GLN A 44 -8.218 -9.036 -5.622 1.00 0.00 C ATOM 623 CD GLN A 44 -6.732 -9.129 -5.278 1.00 0.00 C ATOM 624 OE1 GLN A 44 -6.226 -8.307 -4.512 1.00 0.00 O ATOM 625 NE2 GLN A 44 -6.008 -10.078 -5.858 1.00 0.00 N ATOM 0 H GLN A 44 -10.739 -10.191 -3.215 1.00 0.00 H new ATOM 0 HA GLN A 44 -10.730 -9.361 -6.089 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -8.683 -10.739 -4.373 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -8.797 -11.066 -6.091 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -8.321 -8.794 -6.680 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -8.659 -8.211 -5.062 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -6.453 -10.746 -6.488 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -5.007 -10.140 -5.674 1.00 0.00 H new ATOM 634 N VAL A 45 -11.632 -11.667 -6.756 1.00 0.00 N ATOM 635 CA VAL A 45 -12.565 -12.742 -7.099 1.00 0.00 C ATOM 636 C VAL A 45 -12.222 -13.345 -8.456 1.00 0.00 C ATOM 637 O VAL A 45 -12.022 -14.561 -8.542 1.00 0.00 O ATOM 638 CB VAL A 45 -14.035 -12.269 -6.949 1.00 0.00 C ATOM 639 CG1 VAL A 45 -14.427 -11.052 -7.804 1.00 0.00 C ATOM 640 CG2 VAL A 45 -15.021 -13.417 -7.209 1.00 0.00 C ATOM 0 H VAL A 45 -11.192 -11.227 -7.564 1.00 0.00 H new ATOM 0 HA VAL A 45 -12.457 -13.560 -6.387 1.00 0.00 H new ATOM 0 HB VAL A 45 -14.099 -11.939 -5.912 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -15.473 -10.803 -7.625 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -13.801 -10.201 -7.535 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -14.285 -11.288 -8.859 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -16.042 -13.052 -7.096 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -14.881 -13.795 -8.222 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -14.841 -14.220 -6.494 1.00 0.00 H new ATOM 699 N VAL A 49 -7.886 -9.826 -10.957 1.00 0.00 N ATOM 700 CA VAL A 49 -8.648 -8.567 -10.981 1.00 0.00 C ATOM 701 C VAL A 49 -9.628 -8.506 -9.800 1.00 0.00 C ATOM 702 O VAL A 49 -10.387 -9.450 -9.556 1.00 0.00 O ATOM 703 CB VAL A 49 -9.377 -8.377 -12.336 1.00 0.00 C ATOM 704 CG1 VAL A 49 -10.044 -6.992 -12.417 1.00 0.00 C ATOM 705 CG2 VAL A 49 -8.452 -8.516 -13.558 1.00 0.00 C ATOM 0 HA VAL A 49 -7.944 -7.741 -10.875 1.00 0.00 H new ATOM 0 HB VAL A 49 -10.119 -9.175 -12.368 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -10.548 -6.886 -13.378 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -10.772 -6.891 -11.612 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -9.285 -6.216 -12.318 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -9.030 -8.371 -14.470 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.664 -7.765 -13.505 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -8.006 -9.511 -13.565 1.00 0.00 H new ATOM 715 N GLY A 50 -9.665 -7.364 -9.102 1.00 0.00 N ATOM 716 CA GLY A 50 -10.519 -7.115 -7.950 1.00 0.00 C ATOM 717 C GLY A 50 -10.691 -5.623 -7.672 1.00 0.00 C ATOM 718 O GLY A 50 -10.473 -4.777 -8.544 1.00 0.00 O ATOM 0 H GLY A 50 -9.078 -6.564 -9.338 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -11.496 -7.566 -8.120 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -10.092 -7.600 -7.072 1.00 0.00 H new ATOM 722 N PHE A 51 -11.119 -5.308 -6.449 1.00 0.00 N ATOM 723 CA PHE A 51 -11.407 -3.956 -5.995 1.00 0.00 C ATOM 724 C PHE A 51 -10.827 -3.767 -4.591 1.00 0.00 C ATOM 725 O PHE A 51 -10.610 -4.729 -3.854 1.00 0.00 O ATOM 726 CB PHE A 51 -12.926 -3.743 -6.040 1.00 0.00 C ATOM 727 CG PHE A 51 -13.370 -2.296 -6.099 1.00 0.00 C ATOM 728 CD1 PHE A 51 -13.468 -1.645 -7.344 1.00 0.00 C ATOM 729 CD2 PHE A 51 -13.704 -1.603 -4.921 1.00 0.00 C ATOM 730 CE1 PHE A 51 -13.890 -0.306 -7.411 1.00 0.00 C ATOM 731 CE2 PHE A 51 -14.136 -0.268 -4.989 1.00 0.00 C ATOM 732 CZ PHE A 51 -14.227 0.383 -6.233 1.00 0.00 C ATOM 0 H PHE A 51 -11.278 -6.012 -5.728 1.00 0.00 H new ATOM 0 HA PHE A 51 -10.944 -3.209 -6.640 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -13.325 -4.265 -6.910 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -13.369 -4.207 -5.159 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -13.218 -2.176 -8.250 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -13.628 -2.098 -3.964 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -13.955 0.193 -8.367 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -14.399 0.260 -4.084 1.00 0.00 H new ATOM 0 HZ PHE A 51 -14.555 1.411 -6.283 1.00 0.00 H new ATOM 742 N GLU A 52 -10.550 -2.521 -4.220 1.00 0.00 N ATOM 743 CA GLU A 52 -9.795 -2.160 -3.034 1.00 0.00 C ATOM 744 C GLU A 52 -10.342 -0.829 -2.504 1.00 0.00 C ATOM 745 O GLU A 52 -10.894 -0.022 -3.254 1.00 0.00 O ATOM 746 CB GLU A 52 -8.308 -2.182 -3.424 1.00 0.00 C ATOM 747 CG GLU A 52 -7.341 -1.821 -2.298 1.00 0.00 C ATOM 748 CD GLU A 52 -5.915 -2.253 -2.651 1.00 0.00 C ATOM 749 OE1 GLU A 52 -5.553 -3.405 -2.311 1.00 0.00 O ATOM 750 OE2 GLU A 52 -5.171 -1.443 -3.252 1.00 0.00 O ATOM 0 H GLU A 52 -10.857 -1.710 -4.758 1.00 0.00 H new ATOM 0 HA GLU A 52 -9.899 -2.855 -2.201 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -8.059 -3.177 -3.792 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -8.154 -1.489 -4.251 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -7.367 -0.746 -2.120 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -7.655 -2.305 -1.373 1.00 0.00 H new ATOM 757 N MET A 53 -10.284 -0.625 -1.188 1.00 0.00 N ATOM 758 CA MET A 53 -11.060 0.388 -0.486 1.00 0.00 C ATOM 759 C MET A 53 -10.326 0.866 0.767 1.00 0.00 C ATOM 760 O MET A 53 -9.316 0.292 1.175 1.00 0.00 O ATOM 761 CB MET A 53 -12.446 -0.171 -0.098 1.00 0.00 C ATOM 762 CG MET A 53 -13.312 -0.540 -1.309 1.00 0.00 C ATOM 763 SD MET A 53 -15.065 -0.839 -0.951 1.00 0.00 S ATOM 764 CE MET A 53 -15.631 0.865 -0.687 1.00 0.00 C ATOM 0 H MET A 53 -9.683 -1.172 -0.571 1.00 0.00 H new ATOM 0 HA MET A 53 -11.191 1.237 -1.157 1.00 0.00 H new ATOM 0 HB2 MET A 53 -12.312 -1.054 0.527 1.00 0.00 H new ATOM 0 HB3 MET A 53 -12.973 0.569 0.505 1.00 0.00 H new ATOM 0 HG2 MET A 53 -13.240 0.262 -2.043 1.00 0.00 H new ATOM 0 HG3 MET A 53 -12.896 -1.434 -1.773 1.00 0.00 H new ATOM 0 HE1 MET A 53 -16.715 0.875 -0.578 1.00 0.00 H new ATOM 0 HE2 MET A 53 -15.172 1.265 0.217 1.00 0.00 H new ATOM 0 HE3 MET A 53 -15.346 1.479 -1.541 1.00 0.00 H new ATOM 774 N GLY A 54 -10.858 1.911 1.402 1.00 0.00 N ATOM 775 CA GLY A 54 -10.346 2.407 2.671 1.00 0.00 C ATOM 776 C GLY A 54 -11.323 3.358 3.346 1.00 0.00 C ATOM 777 O GLY A 54 -12.393 3.621 2.795 1.00 0.00 O ATOM 0 H GLY A 54 -11.657 2.435 1.047 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -10.142 1.566 3.334 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -9.398 2.919 2.505 1.00 0.00 H new ATOM 781 N TYR A 55 -10.949 3.852 4.531 1.00 0.00 N ATOM 782 CA TYR A 55 -11.759 4.698 5.404 1.00 0.00 C ATOM 783 C TYR A 55 -10.862 5.664 6.191 1.00 0.00 C ATOM 784 O TYR A 55 -9.732 5.311 6.538 1.00 0.00 O ATOM 785 CB TYR A 55 -12.571 3.796 6.347 1.00 0.00 C ATOM 786 CG TYR A 55 -13.339 4.530 7.431 1.00 0.00 C ATOM 787 CD1 TYR A 55 -14.470 5.296 7.094 1.00 0.00 C ATOM 788 CD2 TYR A 55 -12.910 4.465 8.772 1.00 0.00 C ATOM 789 CE1 TYR A 55 -15.179 5.993 8.089 1.00 0.00 C ATOM 790 CE2 TYR A 55 -13.615 5.155 9.774 1.00 0.00 C ATOM 791 CZ TYR A 55 -14.753 5.922 9.436 1.00 0.00 C ATOM 792 OH TYR A 55 -15.439 6.576 10.414 1.00 0.00 O ATOM 0 H TYR A 55 -10.027 3.661 4.924 1.00 0.00 H new ATOM 0 HA TYR A 55 -12.445 5.301 4.810 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -13.276 3.215 5.752 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -11.893 3.086 6.820 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -14.796 5.349 6.066 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -12.037 3.884 9.031 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -16.046 6.581 7.825 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -13.287 5.099 10.801 1.00 0.00 H new ATOM 0 HH TYR A 55 -15.007 6.417 11.279 1.00 0.00 H new ATOM 1108 N GLY A 76 -13.706 10.109 5.642 1.00 0.00 N ATOM 1109 CA GLY A 76 -13.353 9.764 4.272 1.00 0.00 C ATOM 1110 C GLY A 76 -13.415 8.274 3.978 1.00 0.00 C ATOM 1111 O GLY A 76 -13.601 7.464 4.886 1.00 0.00 O ATOM 0 HA2 GLY A 76 -14.024 10.287 3.591 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -12.345 10.124 4.065 1.00 0.00 H new ATOM 1115 N VAL A 77 -13.243 7.930 2.698 1.00 0.00 N ATOM 1116 CA VAL A 77 -13.132 6.578 2.164 1.00 0.00 C ATOM 1117 C VAL A 77 -12.172 6.562 0.968 1.00 0.00 C ATOM 1118 O VAL A 77 -11.892 7.601 0.373 1.00 0.00 O ATOM 1119 CB VAL A 77 -14.510 5.981 1.776 1.00 0.00 C ATOM 1120 CG1 VAL A 77 -15.373 5.643 3.000 1.00 0.00 C ATOM 1121 CG2 VAL A 77 -15.318 6.870 0.817 1.00 0.00 C ATOM 0 H VAL A 77 -13.174 8.636 1.965 1.00 0.00 H new ATOM 0 HA VAL A 77 -12.729 5.945 2.954 1.00 0.00 H new ATOM 0 HB VAL A 77 -14.263 5.059 1.250 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -16.326 5.229 2.670 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -14.854 4.912 3.620 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -15.552 6.548 3.580 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -16.269 6.389 0.590 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -15.503 7.837 1.286 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -14.756 7.016 -0.105 1.00 0.00 H new ATOM 1131 N GLN A 78 -11.722 5.371 0.569 1.00 0.00 N ATOM 1132 CA GLN A 78 -11.099 5.105 -0.725 1.00 0.00 C ATOM 1133 C GLN A 78 -11.956 4.046 -1.417 1.00 0.00 C ATOM 1134 O GLN A 78 -12.487 3.162 -0.737 1.00 0.00 O ATOM 1135 CB GLN A 78 -9.642 4.643 -0.533 1.00 0.00 C ATOM 1136 CG GLN A 78 -8.890 4.368 -1.848 1.00 0.00 C ATOM 1137 CD GLN A 78 -7.683 3.467 -1.624 1.00 0.00 C ATOM 1138 OE1 GLN A 78 -6.570 3.946 -1.419 1.00 0.00 O ATOM 1139 NE2 GLN A 78 -7.872 2.155 -1.707 1.00 0.00 N ATOM 0 H GLN A 78 -11.784 4.540 1.157 1.00 0.00 H new ATOM 0 HA GLN A 78 -11.053 6.002 -1.342 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -9.102 5.405 0.029 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -9.637 3.737 0.072 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -9.566 3.901 -2.564 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -8.564 5.311 -2.286 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -8.807 1.784 -1.878 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -7.082 1.518 -1.600 1.00 0.00 H new ATOM 1148 N LEU A 79 -12.050 4.123 -2.751 1.00 0.00 N ATOM 1149 CA LEU A 79 -12.697 3.137 -3.608 1.00 0.00 C ATOM 1150 C LEU A 79 -11.926 3.062 -4.933 1.00 0.00 C ATOM 1151 O LEU A 79 -11.790 4.064 -5.639 1.00 0.00 O ATOM 1152 CB LEU A 79 -14.205 3.439 -3.761 1.00 0.00 C ATOM 1153 CG LEU A 79 -14.657 4.653 -4.607 1.00 0.00 C ATOM 1154 CD1 LEU A 79 -16.190 4.654 -4.679 1.00 0.00 C ATOM 1155 CD2 LEU A 79 -14.201 6.009 -4.047 1.00 0.00 C ATOM 0 H LEU A 79 -11.661 4.906 -3.277 1.00 0.00 H new ATOM 0 HA LEU A 79 -12.661 2.145 -3.157 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -14.674 2.552 -4.186 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -14.616 3.568 -2.760 1.00 0.00 H new ATOM 0 HG LEU A 79 -14.192 4.541 -5.587 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -16.526 5.504 -5.272 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -16.533 3.729 -5.143 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -16.601 4.729 -3.672 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -14.557 6.809 -4.696 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -14.609 6.145 -3.046 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -13.112 6.036 -4.002 1.00 0.00 H new ATOM 1167 N THR A 80 -11.333 1.902 -5.234 1.00 0.00 N ATOM 1168 CA THR A 80 -10.396 1.760 -6.340 1.00 0.00 C ATOM 1169 C THR A 80 -10.476 0.345 -6.930 1.00 0.00 C ATOM 1170 O THR A 80 -10.678 -0.623 -6.202 1.00 0.00 O ATOM 1171 CB THR A 80 -9.001 2.167 -5.803 1.00 0.00 C ATOM 1172 OG1 THR A 80 -8.167 2.738 -6.785 1.00 0.00 O ATOM 1173 CG2 THR A 80 -8.212 1.059 -5.105 1.00 0.00 C ATOM 0 H THR A 80 -11.493 1.039 -4.715 1.00 0.00 H new ATOM 0 HA THR A 80 -10.634 2.413 -7.179 1.00 0.00 H new ATOM 0 HB THR A 80 -9.266 2.912 -5.052 1.00 0.00 H new ATOM 0 HG1 THR A 80 -8.262 2.241 -7.624 1.00 0.00 H new ATOM 0 HG21 THR A 80 -7.252 1.452 -4.769 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.776 0.696 -4.246 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.044 0.238 -5.802 1.00 0.00 H new ATOM 1181 N ALA A 81 -10.290 0.213 -8.246 1.00 0.00 N ATOM 1182 CA ALA A 81 -10.122 -1.066 -8.919 1.00 0.00 C ATOM 1183 C ALA A 81 -8.648 -1.477 -8.847 1.00 0.00 C ATOM 1184 O ALA A 81 -7.760 -0.620 -8.767 1.00 0.00 O ATOM 1185 CB ALA A 81 -10.574 -0.932 -10.377 1.00 0.00 C ATOM 0 H ALA A 81 -10.252 1.011 -8.881 1.00 0.00 H new ATOM 0 HA ALA A 81 -10.727 -1.832 -8.434 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -10.450 -1.888 -10.886 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -11.623 -0.638 -10.407 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -9.971 -0.174 -10.877 1.00 0.00 H new ATOM 1191 N LYS A 82 -8.397 -2.789 -8.900 1.00 0.00 N ATOM 1192 CA LYS A 82 -7.094 -3.396 -8.659 1.00 0.00 C ATOM 1193 C LYS A 82 -6.911 -4.562 -9.627 1.00 0.00 C ATOM 1194 O LYS A 82 -7.842 -5.345 -9.822 1.00 0.00 O ATOM 1195 CB LYS A 82 -7.083 -3.861 -7.193 1.00 0.00 C ATOM 1196 CG LYS A 82 -5.801 -4.588 -6.765 1.00 0.00 C ATOM 1197 CD LYS A 82 -5.896 -4.923 -5.273 1.00 0.00 C ATOM 1198 CE LYS A 82 -4.602 -5.532 -4.728 1.00 0.00 C ATOM 1199 NZ LYS A 82 -4.691 -5.767 -3.277 1.00 0.00 N ATOM 0 H LYS A 82 -9.120 -3.474 -9.119 1.00 0.00 H new ATOM 0 HA LYS A 82 -6.272 -2.700 -8.824 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -7.226 -2.993 -6.549 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -7.933 -4.523 -7.029 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -5.672 -5.499 -7.349 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -4.930 -3.961 -6.956 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -6.131 -4.017 -4.714 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -6.718 -5.620 -5.112 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -4.397 -6.473 -5.239 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -3.766 -4.865 -4.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -3.799 -6.180 -2.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -4.863 -4.865 -2.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -5.474 -6.422 -3.079 1.00 0.00 H new ATOM 1213 N LEU A 83 -5.716 -4.710 -10.203 1.00 0.00 N ATOM 1214 CA LEU A 83 -5.343 -5.892 -10.972 1.00 0.00 C ATOM 1215 C LEU A 83 -3.877 -6.225 -10.715 1.00 0.00 C ATOM 1216 O LEU A 83 -3.087 -5.309 -10.496 1.00 0.00 O ATOM 1217 CB LEU A 83 -5.652 -5.729 -12.476 1.00 0.00 C ATOM 1218 CG LEU A 83 -4.831 -4.688 -13.273 1.00 0.00 C ATOM 1219 CD1 LEU A 83 -4.948 -4.998 -14.772 1.00 0.00 C ATOM 1220 CD2 LEU A 83 -5.302 -3.242 -13.054 1.00 0.00 C ATOM 0 H LEU A 83 -4.978 -4.008 -10.147 1.00 0.00 H new ATOM 0 HA LEU A 83 -5.952 -6.732 -10.637 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -5.515 -6.700 -12.953 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -6.706 -5.471 -12.575 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.804 -4.762 -12.915 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -4.372 -4.268 -15.341 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -4.561 -5.998 -14.968 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -5.994 -4.948 -15.073 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -4.683 -2.565 -13.642 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -6.342 -3.147 -13.366 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -5.216 -2.987 -11.998 1.00 0.00 H new ATOM 1232 N GLY A 84 -3.507 -7.508 -10.718 1.00 0.00 N ATOM 1233 CA GLY A 84 -2.154 -7.924 -10.362 1.00 0.00 C ATOM 1234 C GLY A 84 -2.011 -9.427 -10.159 1.00 0.00 C ATOM 1235 O GLY A 84 -3.009 -10.143 -10.166 1.00 0.00 O ATOM 0 H GLY A 84 -4.130 -8.277 -10.964 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -1.467 -7.605 -11.146 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -1.854 -7.412 -9.447 1.00 0.00 H new ATOM 1239 N TYR A 85 -0.766 -9.898 -10.031 1.00 0.00 N ATOM 1240 CA TYR A 85 -0.409 -11.310 -10.114 1.00 0.00 C ATOM 1241 C TYR A 85 0.933 -11.599 -9.410 1.00 0.00 C ATOM 1242 O TYR A 85 1.778 -10.701 -9.313 1.00 0.00 O ATOM 1243 CB TYR A 85 -0.315 -11.704 -11.604 1.00 0.00 C ATOM 1244 CG TYR A 85 0.900 -11.155 -12.341 1.00 0.00 C ATOM 1245 CD1 TYR A 85 0.982 -9.788 -12.677 1.00 0.00 C ATOM 1246 CD2 TYR A 85 1.974 -12.011 -12.654 1.00 0.00 C ATOM 1247 CE1 TYR A 85 2.138 -9.272 -13.290 1.00 0.00 C ATOM 1248 CE2 TYR A 85 3.132 -11.505 -13.269 1.00 0.00 C ATOM 1249 CZ TYR A 85 3.224 -10.131 -13.580 1.00 0.00 C ATOM 1250 OH TYR A 85 4.357 -9.647 -14.162 1.00 0.00 O ATOM 0 H TYR A 85 0.036 -9.291 -9.863 1.00 0.00 H new ATOM 0 HA TYR A 85 -1.176 -11.897 -9.609 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -0.304 -12.792 -11.676 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -1.216 -11.360 -12.113 1.00 0.00 H new ATOM 0 HD1 TYR A 85 0.151 -9.132 -12.462 1.00 0.00 H new ATOM 0 HD2 TYR A 85 1.907 -13.063 -12.420 1.00 0.00 H new ATOM 0 HE1 TYR A 85 2.196 -8.223 -13.539 1.00 0.00 H new ATOM 0 HE2 TYR A 85 3.952 -12.168 -13.504 1.00 0.00 H new ATOM 0 HH TYR A 85 4.998 -10.377 -14.287 1.00 0.00 H new ATOM 1260 N PRO A 86 1.183 -12.856 -8.986 1.00 0.00 N ATOM 1261 CA PRO A 86 2.471 -13.284 -8.457 1.00 0.00 C ATOM 1262 C PRO A 86 3.487 -13.449 -9.588 1.00 0.00 C ATOM 1263 O PRO A 86 3.210 -14.127 -10.580 1.00 0.00 O ATOM 1264 CB PRO A 86 2.201 -14.598 -7.722 1.00 0.00 C ATOM 1265 CG PRO A 86 1.003 -15.182 -8.470 1.00 0.00 C ATOM 1266 CD PRO A 86 0.218 -13.943 -8.899 1.00 0.00 C ATOM 0 HA PRO A 86 2.904 -12.549 -7.778 1.00 0.00 H new ATOM 0 HB2 PRO A 86 3.063 -15.264 -7.761 1.00 0.00 H new ATOM 0 HB3 PRO A 86 1.975 -14.430 -6.669 1.00 0.00 H new ATOM 0 HG2 PRO A 86 1.316 -15.777 -9.328 1.00 0.00 H new ATOM 0 HG3 PRO A 86 0.408 -15.834 -7.830 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -0.271 -14.106 -9.859 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.565 -13.710 -8.178 1.00 0.00 H new ATOM 1274 N ILE A 87 4.685 -12.875 -9.432 1.00 0.00 N ATOM 1275 CA ILE A 87 5.763 -12.909 -10.434 1.00 0.00 C ATOM 1276 C ILE A 87 6.448 -14.288 -10.531 1.00 0.00 C ATOM 1277 O ILE A 87 7.665 -14.384 -10.695 1.00 0.00 O ATOM 1278 CB ILE A 87 6.775 -11.763 -10.186 1.00 0.00 C ATOM 1279 CG1 ILE A 87 7.369 -11.785 -8.761 1.00 0.00 C ATOM 1280 CG2 ILE A 87 6.105 -10.414 -10.478 1.00 0.00 C ATOM 1281 CD1 ILE A 87 8.716 -11.062 -8.656 1.00 0.00 C ATOM 0 H ILE A 87 4.940 -12.362 -8.588 1.00 0.00 H new ATOM 0 HA ILE A 87 5.305 -12.745 -11.409 1.00 0.00 H new ATOM 0 HB ILE A 87 7.613 -11.912 -10.866 1.00 0.00 H new ATOM 0 HG12 ILE A 87 6.662 -11.323 -8.073 1.00 0.00 H new ATOM 0 HG13 ILE A 87 7.494 -12.820 -8.443 1.00 0.00 H new ATOM 0 HG21 ILE A 87 6.818 -9.608 -10.303 1.00 0.00 H new ATOM 0 HG22 ILE A 87 5.776 -10.388 -11.517 1.00 0.00 H new ATOM 0 HG23 ILE A 87 5.244 -10.286 -9.822 1.00 0.00 H new ATOM 0 HD11 ILE A 87 9.078 -11.114 -7.629 1.00 0.00 H new ATOM 0 HD12 ILE A 87 9.437 -11.538 -9.320 1.00 0.00 H new ATOM 0 HD13 ILE A 87 8.592 -10.018 -8.944 1.00 0.00 H new ATOM 1331 N LEU A 91 5.957 -13.059 -4.489 1.00 0.00 N ATOM 1332 CA LEU A 91 5.664 -11.630 -4.402 1.00 0.00 C ATOM 1333 C LEU A 91 4.552 -11.299 -5.397 1.00 0.00 C ATOM 1334 O LEU A 91 4.678 -11.603 -6.586 1.00 0.00 O ATOM 1335 CB LEU A 91 6.941 -10.822 -4.683 1.00 0.00 C ATOM 1336 CG LEU A 91 6.754 -9.299 -4.514 1.00 0.00 C ATOM 1337 CD1 LEU A 91 6.510 -8.912 -3.047 1.00 0.00 C ATOM 1338 CD2 LEU A 91 8.000 -8.569 -5.029 1.00 0.00 C ATOM 0 HA LEU A 91 5.324 -11.366 -3.401 1.00 0.00 H new ATOM 0 HB2 LEU A 91 7.731 -11.160 -4.012 1.00 0.00 H new ATOM 0 HB3 LEU A 91 7.276 -11.029 -5.699 1.00 0.00 H new ATOM 0 HG LEU A 91 5.877 -9.006 -5.091 1.00 0.00 H new ATOM 0 HD11 LEU A 91 6.384 -7.832 -2.972 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.610 -9.409 -2.684 1.00 0.00 H new ATOM 0 HD13 LEU A 91 7.363 -9.220 -2.443 1.00 0.00 H new ATOM 0 HD21 LEU A 91 7.867 -7.494 -4.909 1.00 0.00 H new ATOM 0 HD22 LEU A 91 8.872 -8.892 -4.461 1.00 0.00 H new ATOM 0 HD23 LEU A 91 8.148 -8.801 -6.084 1.00 0.00 H new ATOM 1350 N ASP A 92 3.470 -10.683 -4.911 1.00 0.00 N ATOM 1351 CA ASP A 92 2.236 -10.478 -5.661 1.00 0.00 C ATOM 1352 C ASP A 92 2.139 -9.002 -6.042 1.00 0.00 C ATOM 1353 O ASP A 92 2.071 -8.146 -5.159 1.00 0.00 O ATOM 1354 CB ASP A 92 1.066 -10.992 -4.806 1.00 0.00 C ATOM 1355 CG ASP A 92 -0.253 -11.098 -5.567 1.00 0.00 C ATOM 1356 OD1 ASP A 92 -0.230 -11.126 -6.813 1.00 0.00 O ATOM 1357 OD2 ASP A 92 -1.306 -11.138 -4.888 1.00 0.00 O ATOM 0 H ASP A 92 3.431 -10.306 -3.964 1.00 0.00 H new ATOM 0 HA ASP A 92 2.211 -11.038 -6.596 1.00 0.00 H new ATOM 0 HB2 ASP A 92 1.324 -11.973 -4.406 1.00 0.00 H new ATOM 0 HB3 ASP A 92 0.931 -10.326 -3.954 1.00 0.00 H new ATOM 1362 N ILE A 93 2.249 -8.675 -7.337 1.00 0.00 N ATOM 1363 CA ILE A 93 2.463 -7.298 -7.796 1.00 0.00 C ATOM 1364 C ILE A 93 1.206 -6.776 -8.483 1.00 0.00 C ATOM 1365 O ILE A 93 0.528 -7.535 -9.175 1.00 0.00 O ATOM 1366 CB ILE A 93 3.742 -7.164 -8.656 1.00 0.00 C ATOM 1367 CG1 ILE A 93 3.600 -7.704 -10.099 1.00 0.00 C ATOM 1368 CG2 ILE A 93 4.935 -7.817 -7.923 1.00 0.00 C ATOM 1369 CD1 ILE A 93 4.731 -7.240 -11.025 1.00 0.00 C ATOM 0 H ILE A 93 2.192 -9.357 -8.093 1.00 0.00 H new ATOM 0 HA ILE A 93 2.642 -6.661 -6.930 1.00 0.00 H new ATOM 0 HB ILE A 93 3.924 -6.096 -8.778 1.00 0.00 H new ATOM 0 HG12 ILE A 93 3.582 -8.794 -10.073 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.644 -7.379 -10.510 1.00 0.00 H new ATOM 0 HG21 ILE A 93 5.834 -7.720 -8.532 1.00 0.00 H new ATOM 0 HG22 ILE A 93 5.090 -7.319 -6.966 1.00 0.00 H new ATOM 0 HG23 ILE A 93 4.724 -8.873 -7.753 1.00 0.00 H new ATOM 0 HD11 ILE A 93 4.576 -7.651 -12.023 1.00 0.00 H new ATOM 0 HD12 ILE A 93 4.735 -6.151 -11.078 1.00 0.00 H new ATOM 0 HD13 ILE A 93 5.687 -7.588 -10.634 1.00 0.00 H new ATOM 1381 N TYR A 94 0.903 -5.484 -8.307 1.00 0.00 N ATOM 1382 CA TYR A 94 -0.391 -4.907 -8.650 1.00 0.00 C ATOM 1383 C TYR A 94 -0.272 -3.546 -9.330 1.00 0.00 C ATOM 1384 O TYR A 94 0.697 -2.810 -9.140 1.00 0.00 O ATOM 1385 CB TYR A 94 -1.254 -4.783 -7.380 1.00 0.00 C ATOM 1386 CG TYR A 94 -1.778 -6.106 -6.859 1.00 0.00 C ATOM 1387 CD1 TYR A 94 -3.000 -6.610 -7.340 1.00 0.00 C ATOM 1388 CD2 TYR A 94 -1.043 -6.841 -5.915 1.00 0.00 C ATOM 1389 CE1 TYR A 94 -3.473 -7.864 -6.917 1.00 0.00 C ATOM 1390 CE2 TYR A 94 -1.529 -8.075 -5.453 1.00 0.00 C ATOM 1391 CZ TYR A 94 -2.735 -8.605 -5.967 1.00 0.00 C ATOM 1392 OH TYR A 94 -3.193 -9.819 -5.552 1.00 0.00 O ATOM 0 H TYR A 94 1.560 -4.808 -7.918 1.00 0.00 H new ATOM 0 HA TYR A 94 -0.864 -5.579 -9.366 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -0.665 -4.304 -6.598 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -2.099 -4.127 -7.590 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -3.580 -6.028 -8.041 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -0.104 -6.457 -5.544 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -4.396 -8.259 -7.316 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -0.979 -8.622 -4.701 1.00 0.00 H new ATOM 0 HH TYR A 94 -2.524 -10.241 -4.973 1.00 0.00 H new ATOM 1402 N THR A 95 -1.347 -3.203 -10.039 1.00 0.00 N ATOM 1403 CA THR A 95 -1.693 -1.902 -10.580 1.00 0.00 C ATOM 1404 C THR A 95 -3.086 -1.568 -10.032 1.00 0.00 C ATOM 1405 O THR A 95 -3.912 -2.461 -9.810 1.00 0.00 O ATOM 1406 CB THR A 95 -1.660 -1.964 -12.118 1.00 0.00 C ATOM 1407 OG1 THR A 95 -0.375 -2.364 -12.552 1.00 0.00 O ATOM 1408 CG2 THR A 95 -1.976 -0.617 -12.779 1.00 0.00 C ATOM 0 H THR A 95 -2.059 -3.897 -10.266 1.00 0.00 H new ATOM 0 HA THR A 95 -0.990 -1.122 -10.288 1.00 0.00 H new ATOM 0 HB THR A 95 -2.427 -2.680 -12.412 1.00 0.00 H new ATOM 0 HG1 THR A 95 -0.358 -2.404 -13.531 1.00 0.00 H new ATOM 0 HG21 THR A 95 -1.937 -0.726 -13.863 1.00 0.00 H new ATOM 0 HG22 THR A 95 -2.973 -0.291 -12.482 1.00 0.00 H new ATOM 0 HG23 THR A 95 -1.243 0.125 -12.462 1.00 0.00 H new ATOM 1416 N ARG A 96 -3.350 -0.282 -9.794 1.00 0.00 N ATOM 1417 CA ARG A 96 -4.550 0.193 -9.119 1.00 0.00 C ATOM 1418 C ARG A 96 -4.982 1.517 -9.746 1.00 0.00 C ATOM 1419 O ARG A 96 -4.125 2.329 -10.094 1.00 0.00 O ATOM 1420 CB ARG A 96 -4.208 0.282 -7.617 1.00 0.00 C ATOM 1421 CG ARG A 96 -5.165 1.127 -6.773 1.00 0.00 C ATOM 1422 CD ARG A 96 -4.817 2.627 -6.818 1.00 0.00 C ATOM 1423 NE ARG A 96 -4.451 3.132 -5.488 1.00 0.00 N ATOM 1424 CZ ARG A 96 -5.257 3.728 -4.608 1.00 0.00 C ATOM 1425 NH1 ARG A 96 -6.526 4.021 -4.886 1.00 0.00 N ATOM 1426 NH2 ARG A 96 -4.756 3.999 -3.414 1.00 0.00 N ATOM 0 H ARG A 96 -2.720 0.470 -10.072 1.00 0.00 H new ATOM 0 HA ARG A 96 -5.403 -0.476 -9.230 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -4.184 -0.728 -7.207 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -3.203 0.691 -7.515 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -6.185 0.982 -7.130 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -5.137 0.781 -5.740 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -3.991 2.790 -7.511 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -5.669 3.189 -7.200 1.00 0.00 H new ATOM 0 HE ARG A 96 -3.477 3.014 -5.208 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -6.914 3.789 -5.800 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -7.109 4.477 -4.185 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -3.790 3.753 -3.198 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -5.336 4.454 -2.709 1.00 0.00 H new ATOM 1440 N LEU A 97 -6.293 1.761 -9.852 1.00 0.00 N ATOM 1441 CA LEU A 97 -6.863 3.015 -10.355 1.00 0.00 C ATOM 1442 C LEU A 97 -8.203 3.269 -9.667 1.00 0.00 C ATOM 1443 O LEU A 97 -8.888 2.314 -9.298 1.00 0.00 O ATOM 1444 CB LEU A 97 -6.997 2.923 -11.887 1.00 0.00 C ATOM 1445 CG LEU A 97 -7.561 4.199 -12.554 1.00 0.00 C ATOM 1446 CD1 LEU A 97 -6.835 4.485 -13.875 1.00 0.00 C ATOM 1447 CD2 LEU A 97 -9.066 4.081 -12.837 1.00 0.00 C ATOM 0 H LEU A 97 -7.002 1.078 -9.585 1.00 0.00 H new ATOM 0 HA LEU A 97 -6.213 3.860 -10.128 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -6.017 2.707 -12.313 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -7.645 2.082 -12.134 1.00 0.00 H new ATOM 0 HG LEU A 97 -7.399 5.017 -11.852 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -7.247 5.387 -14.329 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -5.772 4.629 -13.682 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -6.970 3.643 -14.554 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -9.421 4.999 -13.306 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -9.246 3.239 -13.506 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -9.601 3.921 -11.901 1.00 0.00 H new ATOM 1459 N GLY A 98 -8.583 4.526 -9.431 1.00 0.00 N ATOM 1460 CA GLY A 98 -9.842 4.881 -8.790 1.00 0.00 C ATOM 1461 C GLY A 98 -9.727 6.228 -8.098 1.00 0.00 C ATOM 1462 O GLY A 98 -9.115 7.147 -8.648 1.00 0.00 O ATOM 0 H GLY A 98 -8.014 5.334 -9.685 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -10.638 4.915 -9.534 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -10.116 4.115 -8.064 1.00 0.00 H new ATOM 1466 N GLY A 99 -10.333 6.356 -6.912 1.00 0.00 N ATOM 1467 CA GLY A 99 -10.364 7.615 -6.188 1.00 0.00 C ATOM 1468 C GLY A 99 -10.418 7.426 -4.679 1.00 0.00 C ATOM 1469 O GLY A 99 -10.514 6.308 -4.157 1.00 0.00 O ATOM 0 H GLY A 99 -10.810 5.590 -6.436 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -9.480 8.199 -6.445 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -11.231 8.192 -6.509 1.00 0.00 H new ATOM 1473 N MET A 100 -10.372 8.557 -3.980 1.00 0.00 N ATOM 1474 CA MET A 100 -10.631 8.649 -2.557 1.00 0.00 C ATOM 1475 C MET A 100 -11.437 9.911 -2.278 1.00 0.00 C ATOM 1476 O MET A 100 -11.456 10.844 -3.080 1.00 0.00 O ATOM 1477 CB MET A 100 -9.321 8.559 -1.755 1.00 0.00 C ATOM 1478 CG MET A 100 -8.299 9.656 -2.070 1.00 0.00 C ATOM 1479 SD MET A 100 -6.675 9.334 -1.332 1.00 0.00 S ATOM 1480 CE MET A 100 -5.818 10.840 -1.860 1.00 0.00 C ATOM 0 H MET A 100 -10.147 9.456 -4.405 1.00 0.00 H new ATOM 0 HA MET A 100 -11.231 7.802 -2.224 1.00 0.00 H new ATOM 0 HB2 MET A 100 -9.559 8.598 -0.692 1.00 0.00 H new ATOM 0 HB3 MET A 100 -8.862 7.589 -1.944 1.00 0.00 H new ATOM 0 HG2 MET A 100 -8.191 9.746 -3.151 1.00 0.00 H new ATOM 0 HG3 MET A 100 -8.675 10.612 -1.707 1.00 0.00 H new ATOM 0 HE1 MET A 100 -4.791 10.821 -1.495 1.00 0.00 H new ATOM 0 HE2 MET A 100 -5.815 10.894 -2.949 1.00 0.00 H new ATOM 0 HE3 MET A 100 -6.332 11.712 -1.455 1.00 0.00 H new ATOM 1490 N VAL A 101 -12.136 9.904 -1.149 1.00 0.00 N ATOM 1491 CA VAL A 101 -13.097 10.899 -0.715 1.00 0.00 C ATOM 1492 C VAL A 101 -12.686 11.239 0.709 1.00 0.00 C ATOM 1493 O VAL A 101 -12.494 10.334 1.518 1.00 0.00 O ATOM 1494 CB VAL A 101 -14.530 10.325 -0.793 1.00 0.00 C ATOM 1495 CG1 VAL A 101 -15.590 11.333 -0.324 1.00 0.00 C ATOM 1496 CG2 VAL A 101 -14.899 9.871 -2.215 1.00 0.00 C ATOM 0 H VAL A 101 -12.036 9.150 -0.470 1.00 0.00 H new ATOM 0 HA VAL A 101 -13.103 11.791 -1.342 1.00 0.00 H new ATOM 0 HB VAL A 101 -14.527 9.464 -0.124 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -16.579 10.882 -0.398 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -15.395 11.611 0.712 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -15.549 12.223 -0.952 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -15.915 9.475 -2.219 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -14.838 10.720 -2.895 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -14.206 9.095 -2.540 1.00 0.00 H new ATOM 1506 N PHE A 102 -12.520 12.521 1.018 1.00 0.00 N ATOM 1507 CA PHE A 102 -12.122 12.987 2.336 1.00 0.00 C ATOM 1508 C PHE A 102 -12.725 14.371 2.519 1.00 0.00 C ATOM 1509 O PHE A 102 -12.338 15.330 1.843 1.00 0.00 O ATOM 1510 CB PHE A 102 -10.595 12.962 2.457 1.00 0.00 C ATOM 1511 CG PHE A 102 -10.014 13.645 3.682 1.00 0.00 C ATOM 1512 CD1 PHE A 102 -9.784 12.914 4.864 1.00 0.00 C ATOM 1513 CD2 PHE A 102 -9.638 15.001 3.622 1.00 0.00 C ATOM 1514 CE1 PHE A 102 -9.150 13.529 5.959 1.00 0.00 C ATOM 1515 CE2 PHE A 102 -8.996 15.611 4.712 1.00 0.00 C ATOM 1516 CZ PHE A 102 -8.750 14.874 5.881 1.00 0.00 C ATOM 0 H PHE A 102 -12.661 13.276 0.346 1.00 0.00 H new ATOM 0 HA PHE A 102 -12.490 12.341 3.133 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -10.267 11.923 2.455 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -10.172 13.431 1.569 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -10.094 11.882 4.930 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -9.845 15.576 2.731 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -8.970 12.966 6.863 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -8.692 16.646 4.651 1.00 0.00 H new ATOM 0 HZ PHE A 102 -8.254 15.340 6.720 1.00 0.00 H new ATOM 1526 N ARG A 103 -13.713 14.454 3.409 1.00 0.00 N ATOM 1527 CA ARG A 103 -14.410 15.678 3.751 1.00 0.00 C ATOM 1528 C ARG A 103 -13.850 16.103 5.101 1.00 0.00 C ATOM 1529 O ARG A 103 -14.184 15.504 6.124 1.00 0.00 O ATOM 1530 CB ARG A 103 -15.936 15.435 3.763 1.00 0.00 C ATOM 1531 CG ARG A 103 -16.774 16.561 3.130 1.00 0.00 C ATOM 1532 CD ARG A 103 -16.874 17.886 3.914 1.00 0.00 C ATOM 1533 NE ARG A 103 -15.646 18.705 3.919 1.00 0.00 N ATOM 1534 CZ ARG A 103 -15.008 19.265 2.881 1.00 0.00 C ATOM 1535 NH1 ARG A 103 -15.480 19.161 1.641 1.00 0.00 N ATOM 1536 NH2 ARG A 103 -13.872 19.914 3.114 1.00 0.00 N ATOM 0 H ARG A 103 -14.056 13.643 3.924 1.00 0.00 H new ATOM 0 HA ARG A 103 -14.257 16.475 3.024 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -16.146 14.505 3.235 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -16.260 15.296 4.795 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -16.359 16.780 2.146 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -17.784 16.184 2.973 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -17.686 18.479 3.493 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -17.146 17.660 4.945 1.00 0.00 H new ATOM 0 HE ARG A 103 -15.227 18.867 4.835 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -16.344 18.647 1.465 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -14.978 19.595 0.866 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -13.506 19.977 4.064 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -13.366 20.349 2.343 1.00 0.00 H new ATOM 1779 N SER A 120 -10.588 13.090 -4.607 1.00 0.00 N ATOM 1780 CA SER A 120 -9.473 13.107 -5.545 1.00 0.00 C ATOM 1781 C SER A 120 -9.380 11.762 -6.287 1.00 0.00 C ATOM 1782 O SER A 120 -9.857 10.742 -5.775 1.00 0.00 O ATOM 1783 CB SER A 120 -8.165 13.403 -4.796 1.00 0.00 C ATOM 1784 OG SER A 120 -7.932 12.452 -3.781 1.00 0.00 O ATOM 0 HA SER A 120 -9.640 13.893 -6.281 1.00 0.00 H new ATOM 0 HB2 SER A 120 -7.332 13.400 -5.499 1.00 0.00 H new ATOM 0 HB3 SER A 120 -8.211 14.401 -4.360 1.00 0.00 H new ATOM 0 HG SER A 120 -8.785 12.066 -3.492 1.00 0.00 H new ATOM 1790 N PRO A 121 -8.760 11.727 -7.483 1.00 0.00 N ATOM 1791 CA PRO A 121 -8.369 10.483 -8.132 1.00 0.00 C ATOM 1792 C PRO A 121 -7.111 9.913 -7.464 1.00 0.00 C ATOM 1793 O PRO A 121 -6.301 10.659 -6.908 1.00 0.00 O ATOM 1794 CB PRO A 121 -8.090 10.874 -9.586 1.00 0.00 C ATOM 1795 CG PRO A 121 -7.553 12.301 -9.463 1.00 0.00 C ATOM 1796 CD PRO A 121 -8.343 12.872 -8.285 1.00 0.00 C ATOM 0 HA PRO A 121 -9.136 9.712 -8.060 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -7.363 10.208 -10.050 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -8.993 10.834 -10.195 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -6.480 12.312 -9.271 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -7.720 12.874 -10.375 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -7.729 13.555 -7.699 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -9.206 13.439 -8.633 1.00 0.00 H new ATOM 1804 N VAL A 122 -6.913 8.597 -7.578 1.00 0.00 N ATOM 1805 CA VAL A 122 -5.684 7.902 -7.208 1.00 0.00 C ATOM 1806 C VAL A 122 -5.506 6.710 -8.147 1.00 0.00 C ATOM 1807 O VAL A 122 -6.385 5.853 -8.253 1.00 0.00 O ATOM 1808 CB VAL A 122 -5.650 7.473 -5.716 1.00 0.00 C ATOM 1809 CG1 VAL A 122 -4.904 8.503 -4.856 1.00 0.00 C ATOM 1810 CG2 VAL A 122 -7.029 7.221 -5.084 1.00 0.00 C ATOM 0 H VAL A 122 -7.629 7.968 -7.943 1.00 0.00 H new ATOM 0 HA VAL A 122 -4.847 8.592 -7.318 1.00 0.00 H new ATOM 0 HB VAL A 122 -5.123 6.519 -5.729 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -4.898 8.173 -3.817 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -3.878 8.600 -5.212 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -5.405 9.468 -4.927 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -6.903 6.927 -4.042 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -7.624 8.133 -5.134 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -7.538 6.425 -5.627 1.00 0.00 H new ATOM 1820 N PHE A 123 -4.355 6.642 -8.821 1.00 0.00 N ATOM 1821 CA PHE A 123 -3.901 5.465 -9.544 1.00 0.00 C ATOM 1822 C PHE A 123 -2.441 5.223 -9.182 1.00 0.00 C ATOM 1823 O PHE A 123 -1.710 6.172 -8.902 1.00 0.00 O ATOM 1824 CB PHE A 123 -4.141 5.613 -11.055 1.00 0.00 C ATOM 1825 CG PHE A 123 -3.480 6.799 -11.735 1.00 0.00 C ATOM 1826 CD1 PHE A 123 -2.133 6.725 -12.144 1.00 0.00 C ATOM 1827 CD2 PHE A 123 -4.223 7.966 -12.001 1.00 0.00 C ATOM 1828 CE1 PHE A 123 -1.537 7.807 -12.815 1.00 0.00 C ATOM 1829 CE2 PHE A 123 -3.629 9.044 -12.680 1.00 0.00 C ATOM 1830 CZ PHE A 123 -2.286 8.965 -13.091 1.00 0.00 C ATOM 0 H PHE A 123 -3.703 7.424 -8.877 1.00 0.00 H new ATOM 0 HA PHE A 123 -4.477 4.587 -9.252 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -3.796 4.703 -11.546 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -5.216 5.678 -11.225 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -1.557 5.834 -11.941 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -5.253 8.033 -11.682 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -0.502 7.749 -13.119 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -4.205 9.934 -12.886 1.00 0.00 H new ATOM 0 HZ PHE A 123 -1.831 9.791 -13.617 1.00 0.00 H new ATOM 1840 N ALA A 124 -2.038 3.953 -9.120 1.00 0.00 N ATOM 1841 CA ALA A 124 -0.802 3.524 -8.486 1.00 0.00 C ATOM 1842 C ALA A 124 -0.362 2.166 -9.036 1.00 0.00 C ATOM 1843 O ALA A 124 -1.132 1.475 -9.710 1.00 0.00 O ATOM 1844 CB ALA A 124 -1.043 3.422 -6.970 1.00 0.00 C ATOM 0 H ALA A 124 -2.576 3.183 -9.518 1.00 0.00 H new ATOM 0 HA ALA A 124 -0.013 4.247 -8.694 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -0.126 3.101 -6.477 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -1.342 4.396 -6.583 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -1.833 2.696 -6.775 1.00 0.00 H new ATOM 1850 N GLY A 125 0.855 1.761 -8.670 1.00 0.00 N ATOM 1851 CA GLY A 125 1.326 0.386 -8.750 1.00 0.00 C ATOM 1852 C GLY A 125 1.851 -0.028 -7.380 1.00 0.00 C ATOM 1853 O GLY A 125 2.087 0.828 -6.526 1.00 0.00 O ATOM 0 H GLY A 125 1.557 2.402 -8.300 1.00 0.00 H new ATOM 0 HA2 GLY A 125 0.516 -0.274 -9.060 1.00 0.00 H new ATOM 0 HA3 GLY A 125 2.113 0.299 -9.499 1.00 0.00 H new ATOM 1857 N GLY A 126 2.050 -1.324 -7.149 1.00 0.00 N ATOM 1858 CA GLY A 126 2.510 -1.795 -5.854 1.00 0.00 C ATOM 1859 C GLY A 126 2.925 -3.255 -5.862 1.00 0.00 C ATOM 1860 O GLY A 126 2.770 -3.957 -6.863 1.00 0.00 O ATOM 0 H GLY A 126 1.900 -2.059 -7.840 1.00 0.00 H new ATOM 0 HA2 GLY A 126 3.354 -1.186 -5.532 1.00 0.00 H new ATOM 0 HA3 GLY A 126 1.717 -1.653 -5.120 1.00 0.00 H new ATOM 1864 N VAL A 127 3.441 -3.699 -4.717 1.00 0.00 N ATOM 1865 CA VAL A 127 3.815 -5.077 -4.444 1.00 0.00 C ATOM 1866 C VAL A 127 3.251 -5.441 -3.071 1.00 0.00 C ATOM 1867 O VAL A 127 3.228 -4.610 -2.157 1.00 0.00 O ATOM 1868 CB VAL A 127 5.342 -5.288 -4.570 1.00 0.00 C ATOM 1869 CG1 VAL A 127 5.873 -4.846 -5.945 1.00 0.00 C ATOM 1870 CG2 VAL A 127 6.171 -4.566 -3.494 1.00 0.00 C ATOM 0 H VAL A 127 3.615 -3.080 -3.925 1.00 0.00 H new ATOM 0 HA VAL A 127 3.389 -5.753 -5.186 1.00 0.00 H new ATOM 0 HB VAL A 127 5.466 -6.362 -4.435 1.00 0.00 H new ATOM 0 HG11 VAL A 127 6.949 -5.012 -5.990 1.00 0.00 H new ATOM 0 HG12 VAL A 127 5.384 -5.426 -6.728 1.00 0.00 H new ATOM 0 HG13 VAL A 127 5.663 -3.787 -6.093 1.00 0.00 H new ATOM 0 HG21 VAL A 127 7.230 -4.766 -3.655 1.00 0.00 H new ATOM 0 HG22 VAL A 127 5.991 -3.493 -3.556 1.00 0.00 H new ATOM 0 HG23 VAL A 127 5.880 -4.927 -2.507 1.00 0.00 H new ATOM 1880 N GLU A 128 2.748 -6.666 -2.941 1.00 0.00 N ATOM 1881 CA GLU A 128 1.971 -7.122 -1.801 1.00 0.00 C ATOM 1882 C GLU A 128 2.461 -8.523 -1.421 1.00 0.00 C ATOM 1883 O GLU A 128 2.946 -9.283 -2.269 1.00 0.00 O ATOM 1884 CB GLU A 128 0.463 -7.064 -2.136 1.00 0.00 C ATOM 1885 CG GLU A 128 0.030 -5.648 -2.575 1.00 0.00 C ATOM 1886 CD GLU A 128 -1.470 -5.454 -2.812 1.00 0.00 C ATOM 1887 OE1 GLU A 128 -2.304 -5.893 -1.988 1.00 0.00 O ATOM 1888 OE2 GLU A 128 -1.845 -4.672 -3.712 1.00 0.00 O ATOM 0 H GLU A 128 2.876 -7.388 -3.650 1.00 0.00 H new ATOM 0 HA GLU A 128 2.110 -6.475 -0.935 1.00 0.00 H new ATOM 0 HB2 GLU A 128 0.239 -7.776 -2.930 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -0.116 -7.368 -1.264 1.00 0.00 H new ATOM 0 HG2 GLU A 128 0.353 -4.937 -1.814 1.00 0.00 H new ATOM 0 HG3 GLU A 128 0.560 -5.395 -3.493 1.00 0.00 H new ATOM 1895 N TYR A 129 2.397 -8.834 -0.123 1.00 0.00 N ATOM 1896 CA TYR A 129 3.034 -10.006 0.465 1.00 0.00 C ATOM 1897 C TYR A 129 2.235 -10.496 1.677 1.00 0.00 C ATOM 1898 O TYR A 129 1.402 -9.756 2.204 1.00 0.00 O ATOM 1899 CB TYR A 129 4.470 -9.625 0.864 1.00 0.00 C ATOM 1900 CG TYR A 129 5.392 -10.816 0.998 1.00 0.00 C ATOM 1901 CD1 TYR A 129 5.778 -11.507 -0.164 1.00 0.00 C ATOM 1902 CD2 TYR A 129 5.835 -11.260 2.259 1.00 0.00 C ATOM 1903 CE1 TYR A 129 6.592 -12.644 -0.073 1.00 0.00 C ATOM 1904 CE2 TYR A 129 6.645 -12.407 2.356 1.00 0.00 C ATOM 1905 CZ TYR A 129 7.017 -13.115 1.190 1.00 0.00 C ATOM 1906 OH TYR A 129 7.760 -14.252 1.288 1.00 0.00 O ATOM 0 H TYR A 129 1.891 -8.266 0.557 1.00 0.00 H new ATOM 0 HA TYR A 129 3.062 -10.822 -0.257 1.00 0.00 H new ATOM 0 HB2 TYR A 129 4.877 -8.942 0.119 1.00 0.00 H new ATOM 0 HB3 TYR A 129 4.445 -9.086 1.811 1.00 0.00 H new ATOM 0 HD1 TYR A 129 5.446 -11.160 -1.131 1.00 0.00 H new ATOM 0 HD2 TYR A 129 5.553 -10.721 3.151 1.00 0.00 H new ATOM 0 HE1 TYR A 129 6.896 -13.162 -0.971 1.00 0.00 H new ATOM 0 HE2 TYR A 129 6.983 -12.747 3.324 1.00 0.00 H new ATOM 0 HH TYR A 129 7.965 -14.428 2.230 1.00 0.00 H new ATOM 1916 N ALA A 130 2.521 -11.714 2.152 1.00 0.00 N ATOM 1917 CA ALA A 130 1.860 -12.350 3.288 1.00 0.00 C ATOM 1918 C ALA A 130 2.909 -12.830 4.288 1.00 0.00 C ATOM 1919 O ALA A 130 3.977 -13.288 3.889 1.00 0.00 O ATOM 1920 CB ALA A 130 0.988 -13.512 2.801 1.00 0.00 C ATOM 0 H ALA A 130 3.245 -12.301 1.738 1.00 0.00 H new ATOM 0 HA ALA A 130 1.214 -11.628 3.787 1.00 0.00 H new ATOM 0 HB1 ALA A 130 0.498 -13.982 3.654 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.233 -13.136 2.111 1.00 0.00 H new ATOM 0 HB3 ALA A 130 1.612 -14.246 2.291 1.00 0.00 H new ATOM 1926 N ILE A 131 2.605 -12.740 5.586 1.00 0.00 N ATOM 1927 CA ILE A 131 3.522 -13.156 6.652 1.00 0.00 C ATOM 1928 C ILE A 131 3.671 -14.691 6.654 1.00 0.00 C ATOM 1929 O ILE A 131 4.728 -15.189 7.043 1.00 0.00 O ATOM 1930 CB ILE A 131 3.048 -12.548 8.001 1.00 0.00 C ATOM 1931 CG1 ILE A 131 3.484 -11.071 8.177 1.00 0.00 C ATOM 1932 CG2 ILE A 131 3.588 -13.285 9.242 1.00 0.00 C ATOM 1933 CD1 ILE A 131 3.049 -10.077 7.095 1.00 0.00 C ATOM 0 H ILE A 131 1.715 -12.376 5.928 1.00 0.00 H new ATOM 0 HA ILE A 131 4.527 -12.770 6.480 1.00 0.00 H new ATOM 0 HB ILE A 131 1.964 -12.644 7.942 1.00 0.00 H new ATOM 0 HG12 ILE A 131 3.100 -10.718 9.134 1.00 0.00 H new ATOM 0 HG13 ILE A 131 4.572 -11.046 8.241 1.00 0.00 H new ATOM 0 HG21 ILE A 131 3.213 -12.801 10.144 1.00 0.00 H new ATOM 0 HG22 ILE A 131 3.256 -14.323 9.222 1.00 0.00 H new ATOM 0 HG23 ILE A 131 4.678 -13.253 9.239 1.00 0.00 H new ATOM 0 HD11 ILE A 131 3.421 -9.083 7.343 1.00 0.00 H new ATOM 0 HD12 ILE A 131 3.455 -10.387 6.132 1.00 0.00 H new ATOM 0 HD13 ILE A 131 1.961 -10.053 7.039 1.00 0.00 H new ATOM 1945 N THR A 132 2.648 -15.418 6.173 1.00 0.00 N ATOM 1946 CA THR A 132 2.460 -16.864 5.954 1.00 0.00 C ATOM 1947 C THR A 132 1.026 -17.198 6.389 1.00 0.00 C ATOM 1948 O THR A 132 0.220 -17.518 5.516 1.00 0.00 O ATOM 1949 CB THR A 132 3.543 -17.803 6.541 1.00 0.00 C ATOM 1950 OG1 THR A 132 4.798 -17.489 5.992 1.00 0.00 O ATOM 1951 CG2 THR A 132 3.264 -19.278 6.234 1.00 0.00 C ATOM 0 H THR A 132 1.803 -14.926 5.884 1.00 0.00 H new ATOM 0 HA THR A 132 2.600 -17.069 4.893 1.00 0.00 H new ATOM 0 HB THR A 132 3.530 -17.655 7.621 1.00 0.00 H new ATOM 0 HG1 THR A 132 5.222 -16.786 6.527 1.00 0.00 H new ATOM 0 HG21 THR A 132 4.051 -19.895 6.667 1.00 0.00 H new ATOM 0 HG22 THR A 132 2.303 -19.563 6.662 1.00 0.00 H new ATOM 0 HG23 THR A 132 3.239 -19.426 5.154 1.00 0.00 H new ATOM 1959 N PRO A 133 0.651 -17.058 7.678 1.00 0.00 N ATOM 1960 CA PRO A 133 -0.748 -16.925 8.061 1.00 0.00 C ATOM 1961 C PRO A 133 -1.308 -15.587 7.547 1.00 0.00 C ATOM 1962 O PRO A 133 -0.600 -14.780 6.943 1.00 0.00 O ATOM 1963 CB PRO A 133 -0.756 -17.018 9.591 1.00 0.00 C ATOM 1964 CG PRO A 133 0.581 -16.387 9.968 1.00 0.00 C ATOM 1965 CD PRO A 133 1.497 -16.883 8.851 1.00 0.00 C ATOM 0 HA PRO A 133 -1.385 -17.697 7.629 1.00 0.00 H new ATOM 0 HB2 PRO A 133 -1.597 -16.477 10.026 1.00 0.00 H new ATOM 0 HB3 PRO A 133 -0.829 -18.050 9.934 1.00 0.00 H new ATOM 0 HG2 PRO A 133 0.525 -15.299 9.995 1.00 0.00 H new ATOM 0 HG3 PRO A 133 0.923 -16.713 10.950 1.00 0.00 H new ATOM 0 HD2 PRO A 133 2.293 -16.165 8.653 1.00 0.00 H new ATOM 0 HD3 PRO A 133 1.976 -17.822 9.129 1.00 0.00 H new ATOM 1973 N GLU A 134 -2.588 -15.354 7.835 1.00 0.00 N ATOM 1974 CA GLU A 134 -3.518 -14.362 7.297 1.00 0.00 C ATOM 1975 C GLU A 134 -3.084 -12.887 7.310 1.00 0.00 C ATOM 1976 O GLU A 134 -3.828 -12.052 6.795 1.00 0.00 O ATOM 1977 CB GLU A 134 -4.832 -14.496 8.093 1.00 0.00 C ATOM 1978 CG GLU A 134 -5.762 -15.634 7.656 1.00 0.00 C ATOM 1979 CD GLU A 134 -5.182 -17.049 7.700 1.00 0.00 C ATOM 1980 OE1 GLU A 134 -4.302 -17.315 8.546 1.00 0.00 O ATOM 1981 OE2 GLU A 134 -5.653 -17.881 6.883 1.00 0.00 O ATOM 0 H GLU A 134 -3.054 -15.928 8.538 1.00 0.00 H new ATOM 0 HA GLU A 134 -3.597 -14.593 6.235 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -4.585 -14.637 9.145 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -5.378 -13.556 8.017 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -6.650 -15.610 8.288 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -6.091 -15.432 6.637 1.00 0.00 H new ATOM 1988 N ILE A 135 -1.926 -12.534 7.870 1.00 0.00 N ATOM 1989 CA ILE A 135 -1.478 -11.148 7.967 1.00 0.00 C ATOM 1990 C ILE A 135 -0.728 -10.841 6.666 1.00 0.00 C ATOM 1991 O ILE A 135 0.049 -11.673 6.188 1.00 0.00 O ATOM 1992 CB ILE A 135 -0.610 -10.931 9.232 1.00 0.00 C ATOM 1993 CG1 ILE A 135 -1.382 -11.358 10.506 1.00 0.00 C ATOM 1994 CG2 ILE A 135 -0.177 -9.454 9.342 1.00 0.00 C ATOM 1995 CD1 ILE A 135 -0.547 -11.317 11.792 1.00 0.00 C ATOM 0 H ILE A 135 -1.271 -13.206 8.270 1.00 0.00 H new ATOM 0 HA ILE A 135 -2.316 -10.460 8.079 1.00 0.00 H new ATOM 0 HB ILE A 135 0.282 -11.552 9.144 1.00 0.00 H new ATOM 0 HG12 ILE A 135 -2.248 -10.707 10.628 1.00 0.00 H new ATOM 0 HG13 ILE A 135 -1.761 -12.370 10.365 1.00 0.00 H new ATOM 0 HG21 ILE A 135 0.432 -9.319 10.236 1.00 0.00 H new ATOM 0 HG22 ILE A 135 0.404 -9.179 8.462 1.00 0.00 H new ATOM 0 HG23 ILE A 135 -1.061 -8.819 9.406 1.00 0.00 H new ATOM 0 HD11 ILE A 135 -1.162 -11.630 12.635 1.00 0.00 H new ATOM 0 HD12 ILE A 135 0.305 -11.990 11.694 1.00 0.00 H new ATOM 0 HD13 ILE A 135 -0.189 -10.301 11.961 1.00 0.00 H new ATOM 2007 N ALA A 136 -0.949 -9.654 6.093 1.00 0.00 N ATOM 2008 CA ALA A 136 -0.399 -9.265 4.807 1.00 0.00 C ATOM 2009 C ALA A 136 0.201 -7.871 4.907 1.00 0.00 C ATOM 2010 O ALA A 136 -0.147 -7.112 5.813 1.00 0.00 O ATOM 2011 CB ALA A 136 -1.502 -9.347 3.744 1.00 0.00 C ATOM 0 H ALA A 136 -1.525 -8.931 6.523 1.00 0.00 H new ATOM 0 HA ALA A 136 0.402 -9.943 4.512 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -1.096 -9.056 2.775 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -1.878 -10.369 3.688 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -2.317 -8.675 4.013 1.00 0.00 H new ATOM 2017 N THR A 137 1.062 -7.536 3.948 1.00 0.00 N ATOM 2018 CA THR A 137 1.785 -6.274 3.864 1.00 0.00 C ATOM 2019 C THR A 137 1.706 -5.786 2.419 1.00 0.00 C ATOM 2020 O THR A 137 1.653 -6.593 1.488 1.00 0.00 O ATOM 2021 CB THR A 137 3.239 -6.479 4.331 1.00 0.00 C ATOM 2022 OG1 THR A 137 3.249 -7.002 5.643 1.00 0.00 O ATOM 2023 CG2 THR A 137 4.061 -5.184 4.353 1.00 0.00 C ATOM 0 H THR A 137 1.282 -8.166 3.176 1.00 0.00 H new ATOM 0 HA THR A 137 1.345 -5.518 4.515 1.00 0.00 H new ATOM 0 HB THR A 137 3.690 -7.162 3.611 1.00 0.00 H new ATOM 0 HG1 THR A 137 4.175 -7.133 5.936 1.00 0.00 H new ATOM 0 HG21 THR A 137 5.074 -5.402 4.691 1.00 0.00 H new ATOM 0 HG22 THR A 137 4.097 -4.759 3.350 1.00 0.00 H new ATOM 0 HG23 THR A 137 3.597 -4.470 5.033 1.00 0.00 H new ATOM 2031 N ARG A 138 1.706 -4.464 2.232 1.00 0.00 N ATOM 2032 CA ARG A 138 1.611 -3.810 0.934 1.00 0.00 C ATOM 2033 C ARG A 138 2.634 -2.685 0.872 1.00 0.00 C ATOM 2034 O ARG A 138 2.841 -1.999 1.875 1.00 0.00 O ATOM 2035 CB ARG A 138 0.204 -3.221 0.730 1.00 0.00 C ATOM 2036 CG ARG A 138 -0.947 -4.209 0.989 1.00 0.00 C ATOM 2037 CD ARG A 138 -2.305 -3.582 0.658 1.00 0.00 C ATOM 2038 NE ARG A 138 -2.470 -3.405 -0.791 1.00 0.00 N ATOM 2039 CZ ARG A 138 -2.560 -2.268 -1.497 1.00 0.00 C ATOM 2040 NH1 ARG A 138 -2.519 -1.078 -0.902 1.00 0.00 N ATOM 2041 NH2 ARG A 138 -2.692 -2.314 -2.814 1.00 0.00 N ATOM 0 H ARG A 138 1.774 -3.803 3.006 1.00 0.00 H new ATOM 0 HA ARG A 138 1.804 -4.544 0.151 1.00 0.00 H new ATOM 0 HB2 ARG A 138 0.084 -2.363 1.391 1.00 0.00 H new ATOM 0 HB3 ARG A 138 0.124 -2.850 -0.292 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -0.802 -5.106 0.387 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -0.933 -4.521 2.033 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -3.104 -4.215 1.043 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -2.394 -2.617 1.157 1.00 0.00 H new ATOM 0 HE ARG A 138 -2.524 -4.266 -1.336 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -2.417 -1.018 0.111 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -2.589 -0.227 -1.459 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -2.725 -3.214 -3.292 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -2.760 -1.449 -3.350 1.00 0.00 H new ATOM 2055 N LEU A 139 3.190 -2.445 -0.314 1.00 0.00 N ATOM 2056 CA LEU A 139 3.924 -1.242 -0.680 1.00 0.00 C ATOM 2057 C LEU A 139 3.293 -0.760 -1.980 1.00 0.00 C ATOM 2058 O LEU A 139 3.169 -1.546 -2.918 1.00 0.00 O ATOM 2059 CB LEU A 139 5.419 -1.546 -0.878 1.00 0.00 C ATOM 2060 CG LEU A 139 6.168 -1.997 0.390 1.00 0.00 C ATOM 2061 CD1 LEU A 139 7.594 -2.419 0.015 1.00 0.00 C ATOM 2062 CD2 LEU A 139 6.232 -0.887 1.448 1.00 0.00 C ATOM 0 H LEU A 139 3.137 -3.117 -1.079 1.00 0.00 H new ATOM 0 HA LEU A 139 3.867 -0.485 0.102 1.00 0.00 H new ATOM 0 HB2 LEU A 139 5.518 -2.323 -1.636 1.00 0.00 H new ATOM 0 HB3 LEU A 139 5.906 -0.654 -1.271 1.00 0.00 H new ATOM 0 HG LEU A 139 5.619 -2.836 0.818 1.00 0.00 H new ATOM 0 HD11 LEU A 139 8.126 -2.739 0.911 1.00 0.00 H new ATOM 0 HD12 LEU A 139 7.554 -3.243 -0.697 1.00 0.00 H new ATOM 0 HD13 LEU A 139 8.116 -1.575 -0.436 1.00 0.00 H new ATOM 0 HD21 LEU A 139 6.769 -1.250 2.324 1.00 0.00 H new ATOM 0 HD22 LEU A 139 6.752 -0.022 1.037 1.00 0.00 H new ATOM 0 HD23 LEU A 139 5.221 -0.600 1.736 1.00 0.00 H new ATOM 2074 N GLU A 140 2.852 0.497 -2.029 1.00 0.00 N ATOM 2075 CA GLU A 140 2.040 1.028 -3.119 1.00 0.00 C ATOM 2076 C GLU A 140 2.526 2.449 -3.419 1.00 0.00 C ATOM 2077 O GLU A 140 2.567 3.289 -2.517 1.00 0.00 O ATOM 2078 CB GLU A 140 0.560 0.958 -2.699 1.00 0.00 C ATOM 2079 CG GLU A 140 -0.429 1.469 -3.761 1.00 0.00 C ATOM 2080 CD GLU A 140 -1.784 1.860 -3.156 1.00 0.00 C ATOM 2081 OE1 GLU A 140 -2.208 1.273 -2.129 1.00 0.00 O ATOM 2082 OE2 GLU A 140 -2.374 2.869 -3.611 1.00 0.00 O ATOM 0 H GLU A 140 3.053 1.183 -1.301 1.00 0.00 H new ATOM 0 HA GLU A 140 2.137 0.450 -4.038 1.00 0.00 H new ATOM 0 HB2 GLU A 140 0.312 -0.076 -2.458 1.00 0.00 H new ATOM 0 HB3 GLU A 140 0.426 1.539 -1.787 1.00 0.00 H new ATOM 0 HG2 GLU A 140 0.001 2.332 -4.270 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -0.580 0.697 -4.515 1.00 0.00 H new ATOM 2089 N TYR A 141 2.914 2.706 -4.671 1.00 0.00 N ATOM 2090 CA TYR A 141 3.542 3.933 -5.141 1.00 0.00 C ATOM 2091 C TYR A 141 2.684 4.569 -6.235 1.00 0.00 C ATOM 2092 O TYR A 141 2.166 3.881 -7.119 1.00 0.00 O ATOM 2093 CB TYR A 141 4.957 3.619 -5.650 1.00 0.00 C ATOM 2094 CG TYR A 141 5.662 4.817 -6.260 1.00 0.00 C ATOM 2095 CD1 TYR A 141 5.966 5.936 -5.462 1.00 0.00 C ATOM 2096 CD2 TYR A 141 5.961 4.839 -7.637 1.00 0.00 C ATOM 2097 CE1 TYR A 141 6.528 7.089 -6.034 1.00 0.00 C ATOM 2098 CE2 TYR A 141 6.548 5.980 -8.213 1.00 0.00 C ATOM 2099 CZ TYR A 141 6.816 7.117 -7.417 1.00 0.00 C ATOM 2100 OH TYR A 141 7.315 8.244 -7.995 1.00 0.00 O ATOM 0 H TYR A 141 2.790 2.025 -5.420 1.00 0.00 H new ATOM 0 HA TYR A 141 3.623 4.647 -4.321 1.00 0.00 H new ATOM 0 HB2 TYR A 141 5.556 3.238 -4.823 1.00 0.00 H new ATOM 0 HB3 TYR A 141 4.899 2.824 -6.394 1.00 0.00 H new ATOM 0 HD1 TYR A 141 5.765 5.908 -4.401 1.00 0.00 H new ATOM 0 HD2 TYR A 141 5.739 3.979 -8.251 1.00 0.00 H new ATOM 0 HE1 TYR A 141 6.739 7.951 -5.419 1.00 0.00 H new ATOM 0 HE2 TYR A 141 6.794 5.987 -9.265 1.00 0.00 H new ATOM 0 HH TYR A 141 7.455 8.086 -8.952 1.00 0.00 H new ATOM 2110 N GLN A 142 2.549 5.895 -6.168 1.00 0.00 N ATOM 2111 CA GLN A 142 1.601 6.706 -6.906 1.00 0.00 C ATOM 2112 C GLN A 142 2.377 7.844 -7.575 1.00 0.00 C ATOM 2113 O GLN A 142 2.888 8.734 -6.891 1.00 0.00 O ATOM 2114 CB GLN A 142 0.545 7.204 -5.896 1.00 0.00 C ATOM 2115 CG GLN A 142 -0.592 8.020 -6.524 1.00 0.00 C ATOM 2116 CD GLN A 142 -0.561 9.531 -6.290 1.00 0.00 C ATOM 2117 OE1 GLN A 142 -1.597 10.137 -6.039 1.00 0.00 O ATOM 2118 NE2 GLN A 142 0.563 10.198 -6.499 1.00 0.00 N ATOM 0 H GLN A 142 3.140 6.458 -5.556 1.00 0.00 H new ATOM 0 HA GLN A 142 1.084 6.157 -7.693 1.00 0.00 H new ATOM 0 HB2 GLN A 142 0.118 6.344 -5.381 1.00 0.00 H new ATOM 0 HB3 GLN A 142 1.041 7.814 -5.141 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -0.586 7.842 -7.599 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -1.538 7.636 -6.143 1.00 0.00 H new ATOM 0 HE21 GLN A 142 1.424 9.693 -6.708 1.00 0.00 H new ATOM 0 HE22 GLN A 142 0.568 11.217 -6.451 1.00 0.00 H new ATOM 2127 N PHE A 143 2.416 7.864 -8.910 1.00 0.00 N ATOM 2128 CA PHE A 143 3.097 8.886 -9.701 1.00 0.00 C ATOM 2129 C PHE A 143 2.159 9.380 -10.808 1.00 0.00 C ATOM 2130 O PHE A 143 1.178 8.708 -11.129 1.00 0.00 O ATOM 2131 CB PHE A 143 4.403 8.297 -10.256 1.00 0.00 C ATOM 2132 CG PHE A 143 5.185 9.235 -11.156 1.00 0.00 C ATOM 2133 CD1 PHE A 143 5.824 10.367 -10.613 1.00 0.00 C ATOM 2134 CD2 PHE A 143 5.222 9.011 -12.546 1.00 0.00 C ATOM 2135 CE1 PHE A 143 6.481 11.276 -11.460 1.00 0.00 C ATOM 2136 CE2 PHE A 143 5.876 9.925 -13.391 1.00 0.00 C ATOM 2137 CZ PHE A 143 6.503 11.060 -12.848 1.00 0.00 C ATOM 0 H PHE A 143 1.963 7.151 -9.482 1.00 0.00 H new ATOM 0 HA PHE A 143 3.356 9.748 -9.087 1.00 0.00 H new ATOM 0 HB2 PHE A 143 5.038 8.003 -9.420 1.00 0.00 H new ATOM 0 HB3 PHE A 143 4.169 7.390 -10.814 1.00 0.00 H new ATOM 0 HD1 PHE A 143 5.809 10.536 -9.546 1.00 0.00 H new ATOM 0 HD2 PHE A 143 4.747 8.136 -12.964 1.00 0.00 H new ATOM 0 HE1 PHE A 143 6.971 12.143 -11.042 1.00 0.00 H new ATOM 0 HE2 PHE A 143 5.897 9.755 -14.457 1.00 0.00 H new ATOM 0 HZ PHE A 143 7.001 11.765 -13.497 1.00 0.00 H new ATOM 2372 N GLY A 160 5.720 12.374 -6.297 1.00 0.00 N ATOM 2373 CA GLY A 160 4.319 11.997 -6.229 1.00 0.00 C ATOM 2374 C GLY A 160 4.006 11.557 -4.803 1.00 0.00 C ATOM 2375 O GLY A 160 4.021 12.390 -3.892 1.00 0.00 O ATOM 0 HA2 GLY A 160 3.686 12.838 -6.514 1.00 0.00 H new ATOM 0 HA3 GLY A 160 4.110 11.189 -6.930 1.00 0.00 H new ATOM 2379 N MET A 161 3.716 10.270 -4.594 1.00 0.00 N ATOM 2380 CA MET A 161 3.369 9.735 -3.284 1.00 0.00 C ATOM 2381 C MET A 161 3.760 8.257 -3.219 1.00 0.00 C ATOM 2382 O MET A 161 3.596 7.519 -4.189 1.00 0.00 O ATOM 2383 CB MET A 161 1.867 9.997 -3.053 1.00 0.00 C ATOM 2384 CG MET A 161 1.210 9.353 -1.829 1.00 0.00 C ATOM 2385 SD MET A 161 0.681 7.631 -2.051 1.00 0.00 S ATOM 2386 CE MET A 161 -0.547 7.545 -0.726 1.00 0.00 C ATOM 0 H MET A 161 3.717 9.570 -5.336 1.00 0.00 H new ATOM 0 HA MET A 161 3.917 10.224 -2.478 1.00 0.00 H new ATOM 0 HB2 MET A 161 1.722 11.075 -2.983 1.00 0.00 H new ATOM 0 HB3 MET A 161 1.328 9.660 -3.939 1.00 0.00 H new ATOM 0 HG2 MET A 161 1.911 9.396 -0.996 1.00 0.00 H new ATOM 0 HG3 MET A 161 0.342 9.949 -1.547 1.00 0.00 H new ATOM 0 HE1 MET A 161 -0.859 6.510 -0.586 1.00 0.00 H new ATOM 0 HE2 MET A 161 -0.111 7.921 0.199 1.00 0.00 H new ATOM 0 HE3 MET A 161 -1.412 8.152 -0.992 1.00 0.00 H new ATOM 2396 N LEU A 162 4.257 7.821 -2.064 1.00 0.00 N ATOM 2397 CA LEU A 162 4.582 6.443 -1.725 1.00 0.00 C ATOM 2398 C LEU A 162 3.712 6.046 -0.537 1.00 0.00 C ATOM 2399 O LEU A 162 3.298 6.899 0.246 1.00 0.00 O ATOM 2400 CB LEU A 162 6.085 6.371 -1.395 1.00 0.00 C ATOM 2401 CG LEU A 162 6.620 4.989 -0.970 1.00 0.00 C ATOM 2402 CD1 LEU A 162 6.461 3.933 -2.072 1.00 0.00 C ATOM 2403 CD2 LEU A 162 8.102 5.113 -0.596 1.00 0.00 C ATOM 0 H LEU A 162 4.455 8.461 -1.295 1.00 0.00 H new ATOM 0 HA LEU A 162 4.386 5.753 -2.546 1.00 0.00 H new ATOM 0 HB2 LEU A 162 6.645 6.701 -2.270 1.00 0.00 H new ATOM 0 HB3 LEU A 162 6.295 7.081 -0.595 1.00 0.00 H new ATOM 0 HG LEU A 162 6.031 4.659 -0.114 1.00 0.00 H new ATOM 0 HD11 LEU A 162 6.853 2.979 -1.721 1.00 0.00 H new ATOM 0 HD12 LEU A 162 5.405 3.822 -2.320 1.00 0.00 H new ATOM 0 HD13 LEU A 162 7.011 4.247 -2.959 1.00 0.00 H new ATOM 0 HD21 LEU A 162 8.484 4.138 -0.295 1.00 0.00 H new ATOM 0 HD22 LEU A 162 8.665 5.474 -1.457 1.00 0.00 H new ATOM 0 HD23 LEU A 162 8.211 5.816 0.230 1.00 0.00 H new ATOM 2415 N SER A 163 3.430 4.756 -0.367 1.00 0.00 N ATOM 2416 CA SER A 163 2.641 4.277 0.749 1.00 0.00 C ATOM 2417 C SER A 163 2.973 2.831 1.097 1.00 0.00 C ATOM 2418 O SER A 163 3.535 2.087 0.290 1.00 0.00 O ATOM 2419 CB SER A 163 1.155 4.472 0.427 1.00 0.00 C ATOM 2420 OG SER A 163 0.750 3.827 -0.764 1.00 0.00 O ATOM 0 H SER A 163 3.744 4.021 -1.001 1.00 0.00 H new ATOM 0 HA SER A 163 2.885 4.858 1.639 1.00 0.00 H new ATOM 0 HB2 SER A 163 0.558 4.094 1.257 1.00 0.00 H new ATOM 0 HB3 SER A 163 0.946 5.538 0.343 1.00 0.00 H new ATOM 0 HG SER A 163 1.537 3.470 -1.227 1.00 0.00 H new ATOM 2426 N LEU A 164 2.579 2.452 2.311 1.00 0.00 N ATOM 2427 CA LEU A 164 2.743 1.144 2.918 1.00 0.00 C ATOM 2428 C LEU A 164 1.391 0.763 3.515 1.00 0.00 C ATOM 2429 O LEU A 164 0.648 1.642 3.955 1.00 0.00 O ATOM 2430 CB LEU A 164 3.868 1.246 3.970 1.00 0.00 C ATOM 2431 CG LEU A 164 4.097 -0.013 4.838 1.00 0.00 C ATOM 2432 CD1 LEU A 164 5.578 -0.120 5.228 1.00 0.00 C ATOM 2433 CD2 LEU A 164 3.285 0.017 6.144 1.00 0.00 C ATOM 0 H LEU A 164 2.103 3.102 2.937 1.00 0.00 H new ATOM 0 HA LEU A 164 3.035 0.368 2.210 1.00 0.00 H new ATOM 0 HB2 LEU A 164 4.799 1.483 3.456 1.00 0.00 H new ATOM 0 HB3 LEU A 164 3.646 2.084 4.631 1.00 0.00 H new ATOM 0 HG LEU A 164 3.776 -0.863 4.235 1.00 0.00 H new ATOM 0 HD11 LEU A 164 5.730 -1.010 5.839 1.00 0.00 H new ATOM 0 HD12 LEU A 164 6.187 -0.190 4.327 1.00 0.00 H new ATOM 0 HD13 LEU A 164 5.870 0.764 5.795 1.00 0.00 H new ATOM 0 HD21 LEU A 164 3.482 -0.890 6.716 1.00 0.00 H new ATOM 0 HD22 LEU A 164 3.575 0.888 6.733 1.00 0.00 H new ATOM 0 HD23 LEU A 164 2.222 0.074 5.910 1.00 0.00 H new ATOM 2445 N GLY A 165 1.076 -0.530 3.573 1.00 0.00 N ATOM 2446 CA GLY A 165 -0.091 -1.020 4.290 1.00 0.00 C ATOM 2447 C GLY A 165 0.192 -2.360 4.950 1.00 0.00 C ATOM 2448 O GLY A 165 1.143 -3.050 4.580 1.00 0.00 O ATOM 0 H GLY A 165 1.624 -1.263 3.124 1.00 0.00 H new ATOM 0 HA2 GLY A 165 -0.387 -0.294 5.047 1.00 0.00 H new ATOM 0 HA3 GLY A 165 -0.929 -1.121 3.600 1.00 0.00 H new ATOM 2452 N VAL A 166 -0.660 -2.726 5.909 1.00 0.00 N ATOM 2453 CA VAL A 166 -0.641 -4.004 6.621 1.00 0.00 C ATOM 2454 C VAL A 166 -2.105 -4.424 6.773 1.00 0.00 C ATOM 2455 O VAL A 166 -2.964 -3.553 6.948 1.00 0.00 O ATOM 2456 CB VAL A 166 0.083 -3.876 7.983 1.00 0.00 C ATOM 2457 CG1 VAL A 166 0.154 -5.224 8.721 1.00 0.00 C ATOM 2458 CG2 VAL A 166 1.522 -3.352 7.829 1.00 0.00 C ATOM 0 H VAL A 166 -1.413 -2.114 6.224 1.00 0.00 H new ATOM 0 HA VAL A 166 -0.083 -4.763 6.073 1.00 0.00 H new ATOM 0 HB VAL A 166 -0.508 -3.164 8.559 1.00 0.00 H new ATOM 0 HG11 VAL A 166 0.669 -5.091 9.672 1.00 0.00 H new ATOM 0 HG12 VAL A 166 -0.855 -5.592 8.904 1.00 0.00 H new ATOM 0 HG13 VAL A 166 0.698 -5.945 8.111 1.00 0.00 H new ATOM 0 HG21 VAL A 166 1.990 -3.279 8.811 1.00 0.00 H new ATOM 0 HG22 VAL A 166 2.094 -4.038 7.205 1.00 0.00 H new ATOM 0 HG23 VAL A 166 1.503 -2.367 7.362 1.00 0.00 H new ATOM 2468 N SER A 167 -2.417 -5.723 6.663 1.00 0.00 N ATOM 2469 CA SER A 167 -3.795 -6.170 6.535 1.00 0.00 C ATOM 2470 C SER A 167 -3.964 -7.571 7.113 1.00 0.00 C ATOM 2471 O SER A 167 -2.980 -8.262 7.369 1.00 0.00 O ATOM 2472 CB SER A 167 -4.155 -6.102 5.042 1.00 0.00 C ATOM 2473 OG SER A 167 -5.545 -6.175 4.814 1.00 0.00 O ATOM 0 H SER A 167 -1.728 -6.475 6.661 1.00 0.00 H new ATOM 0 HA SER A 167 -4.473 -5.532 7.102 1.00 0.00 H new ATOM 0 HB2 SER A 167 -3.770 -5.173 4.622 1.00 0.00 H new ATOM 0 HB3 SER A 167 -3.661 -6.919 4.516 1.00 0.00 H new ATOM 0 HG SER A 167 -5.770 -5.675 4.002 1.00 0.00 H new ATOM 2479 N TYR A 168 -5.219 -7.983 7.279 1.00 0.00 N ATOM 2480 CA TYR A 168 -5.665 -9.336 7.560 1.00 0.00 C ATOM 2481 C TYR A 168 -6.496 -9.773 6.354 1.00 0.00 C ATOM 2482 O TYR A 168 -7.425 -9.063 5.958 1.00 0.00 O ATOM 2483 CB TYR A 168 -6.484 -9.352 8.864 1.00 0.00 C ATOM 2484 CG TYR A 168 -7.399 -10.555 9.042 1.00 0.00 C ATOM 2485 CD1 TYR A 168 -6.883 -11.798 9.458 1.00 0.00 C ATOM 2486 CD2 TYR A 168 -8.778 -10.428 8.781 1.00 0.00 C ATOM 2487 CE1 TYR A 168 -7.729 -12.919 9.577 1.00 0.00 C ATOM 2488 CE2 TYR A 168 -9.630 -11.538 8.913 1.00 0.00 C ATOM 2489 CZ TYR A 168 -9.108 -12.797 9.285 1.00 0.00 C ATOM 2490 OH TYR A 168 -9.950 -13.870 9.333 1.00 0.00 O ATOM 0 H TYR A 168 -6.001 -7.331 7.215 1.00 0.00 H new ATOM 0 HA TYR A 168 -4.833 -10.024 7.707 1.00 0.00 H new ATOM 0 HB2 TYR A 168 -5.795 -9.313 9.707 1.00 0.00 H new ATOM 0 HB3 TYR A 168 -7.089 -8.446 8.905 1.00 0.00 H new ATOM 0 HD1 TYR A 168 -5.832 -11.893 9.687 1.00 0.00 H new ATOM 0 HD2 TYR A 168 -9.182 -9.473 8.478 1.00 0.00 H new ATOM 0 HE1 TYR A 168 -7.325 -13.870 9.891 1.00 0.00 H new ATOM 0 HE2 TYR A 168 -10.689 -11.428 8.729 1.00 0.00 H new ATOM 0 HH TYR A 168 -10.858 -13.584 9.101 1.00 0.00 H new ATOM 2500 N ARG A 169 -6.171 -10.934 5.775 1.00 0.00 N ATOM 2501 CA ARG A 169 -6.990 -11.564 4.745 1.00 0.00 C ATOM 2502 C ARG A 169 -7.988 -12.471 5.459 1.00 0.00 C ATOM 2503 O ARG A 169 -7.619 -13.172 6.398 1.00 0.00 O ATOM 2504 CB ARG A 169 -6.108 -12.285 3.697 1.00 0.00 C ATOM 2505 CG ARG A 169 -5.611 -13.702 4.047 1.00 0.00 C ATOM 2506 CD ARG A 169 -6.612 -14.780 3.600 1.00 0.00 C ATOM 2507 NE ARG A 169 -6.310 -16.115 4.149 1.00 0.00 N ATOM 2508 CZ ARG A 169 -7.031 -17.230 3.958 1.00 0.00 C ATOM 2509 NH1 ARG A 169 -8.192 -17.195 3.305 1.00 0.00 N ATOM 2510 NH2 ARG A 169 -6.610 -18.379 4.477 1.00 0.00 N ATOM 0 H ARG A 169 -5.330 -11.461 6.011 1.00 0.00 H new ATOM 0 HA ARG A 169 -7.548 -10.829 4.164 1.00 0.00 H new ATOM 0 HB2 ARG A 169 -6.671 -12.345 2.766 1.00 0.00 H new ATOM 0 HB3 ARG A 169 -5.236 -11.660 3.502 1.00 0.00 H new ATOM 0 HG2 ARG A 169 -4.648 -13.879 3.569 1.00 0.00 H new ATOM 0 HG3 ARG A 169 -5.451 -13.777 5.123 1.00 0.00 H new ATOM 0 HD2 ARG A 169 -7.615 -14.486 3.908 1.00 0.00 H new ATOM 0 HD3 ARG A 169 -6.616 -14.834 2.511 1.00 0.00 H new ATOM 0 HE ARG A 169 -5.475 -16.198 4.728 1.00 0.00 H new ATOM 0 HH11 ARG A 169 -8.546 -16.310 2.941 1.00 0.00 H new ATOM 0 HH12 ARG A 169 -8.727 -18.053 3.169 1.00 0.00 H new ATOM 0 HH21 ARG A 169 -5.745 -18.408 5.016 1.00 0.00 H new ATOM 0 HH22 ARG A 169 -7.152 -19.231 4.336 1.00 0.00 H new ATOM 2524 N PHE A 170 -9.247 -12.469 5.021 1.00 0.00 N ATOM 2525 CA PHE A 170 -10.299 -13.261 5.646 1.00 0.00 C ATOM 2526 C PHE A 170 -9.946 -14.745 5.501 1.00 0.00 C ATOM 2527 O PHE A 170 -9.827 -15.259 4.383 1.00 0.00 O ATOM 2528 CB PHE A 170 -11.668 -12.901 5.049 1.00 0.00 C ATOM 2529 CG PHE A 170 -12.320 -11.618 5.565 1.00 0.00 C ATOM 2530 CD1 PHE A 170 -11.582 -10.582 6.185 1.00 0.00 C ATOM 2531 CD2 PHE A 170 -13.716 -11.473 5.439 1.00 0.00 C ATOM 2532 CE1 PHE A 170 -12.235 -9.446 6.696 1.00 0.00 C ATOM 2533 CE2 PHE A 170 -14.367 -10.331 5.938 1.00 0.00 C ATOM 2534 CZ PHE A 170 -13.629 -9.320 6.575 1.00 0.00 C ATOM 0 H PHE A 170 -9.563 -11.918 4.223 1.00 0.00 H new ATOM 0 HA PHE A 170 -10.370 -13.038 6.711 1.00 0.00 H new ATOM 0 HB2 PHE A 170 -11.557 -12.817 3.968 1.00 0.00 H new ATOM 0 HB3 PHE A 170 -12.351 -13.730 5.236 1.00 0.00 H new ATOM 0 HD1 PHE A 170 -10.508 -10.664 6.266 1.00 0.00 H new ATOM 0 HD2 PHE A 170 -14.292 -12.247 4.954 1.00 0.00 H new ATOM 0 HE1 PHE A 170 -11.664 -8.669 7.182 1.00 0.00 H new ATOM 0 HE2 PHE A 170 -15.437 -10.231 5.831 1.00 0.00 H new ATOM 0 HZ PHE A 170 -14.131 -8.449 6.970 1.00 0.00 H new