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 16 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 161 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 120 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 12 LYS NZ :NH3+ 173:sc= 2.26 (180deg=0.933) USER MOD Set 3.2: A 78 GLN : amide:sc= 0.883 K(o=3.1,f=-7.6!) USER MOD Set 4.1: A 6 THR OG1 : rot 88:sc= 1.19 USER MOD Set 4.2: A 44 GLN : amide:sc= 1.61 K(o=4.3,f=-1.7) USER MOD Set 4.3: A 94 TYR OH : rot 162:sc= 1.53 USER MOD Single : A 5 ASN :FLIP amide:sc= -0.0675 F(o=-1.3!,f=-0.068) USER MOD Single : A 8 TYR OH : rot 150:sc= 0.482 USER MOD Single : A 9 THR OG1 : rot 55:sc= 1.28 USER MOD Single : A 43 TYR OH : rot 111:sc= 0.406 USER MOD Single : A 53 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 169:sc= 1.16 USER MOD Single : A 82 LYS NZ :NH3+ -107:sc= 1.5 (180deg=-1.25!) 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 180:sc= 0 USER MOD Single : A 137 THR OG1 : rot -59:sc= 1.11 USER MOD Single : A 141 TYR OH : rot -77:sc= 0.495 USER MOD Single : A 142 GLN : amide:sc= 1.2 K(o=1.2,f=-0.21) USER MOD Single : A 163 SER OG : rot 110:sc= 1 USER MOD Single : A 167 SER OG : rot -3:sc= 1.12 USER MOD Single : A 168 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 59 N ASN A 5 -12.008 -14.627 -5.095 1.00 0.00 N ATOM 60 CA ASN A 5 -10.880 -15.492 -4.780 1.00 0.00 C ATOM 61 C ASN A 5 -10.532 -15.376 -3.293 1.00 0.00 C ATOM 62 O ASN A 5 -10.569 -16.400 -2.606 1.00 0.00 O ATOM 63 CB ASN A 5 -9.671 -15.171 -5.675 1.00 0.00 C ATOM 64 CG ASN A 5 -8.596 -16.259 -5.688 1.00 0.00 C ATOM 65 OD1 ASN A 5 -8.486 -17.108 -4.670 1.00 0.00 O flip ATOM 66 ND2 ASN A 5 -7.842 -16.346 -6.647 1.00 0.00 N flip ATOM 0 HA ASN A 5 -11.161 -16.526 -4.983 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -10.021 -15.009 -6.695 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -9.222 -14.236 -5.339 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -7.930 -15.693 -7.426 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -7.125 -17.072 -6.668 1.00 0.00 H new ATOM 73 N THR A 6 -10.169 -14.183 -2.804 1.00 0.00 N ATOM 74 CA THR A 6 -9.722 -13.961 -1.422 1.00 0.00 C ATOM 75 C THR A 6 -10.100 -12.556 -0.947 1.00 0.00 C ATOM 76 O THR A 6 -10.321 -11.676 -1.775 1.00 0.00 O ATOM 77 CB THR A 6 -8.191 -14.159 -1.287 1.00 0.00 C ATOM 78 OG1 THR A 6 -7.467 -13.627 -2.376 1.00 0.00 O ATOM 79 CG2 THR A 6 -7.798 -15.635 -1.173 1.00 0.00 C ATOM 0 H THR A 6 -10.178 -13.332 -3.366 1.00 0.00 H new ATOM 0 HA THR A 6 -10.225 -14.698 -0.796 1.00 0.00 H new ATOM 0 HB THR A 6 -7.936 -13.624 -0.372 1.00 0.00 H new ATOM 0 HG1 THR A 6 -7.267 -12.683 -2.206 1.00 0.00 H new ATOM 0 HG21 THR A 6 -6.715 -15.717 -1.081 1.00 0.00 H new ATOM 0 HG22 THR A 6 -8.271 -16.071 -0.293 1.00 0.00 H new ATOM 0 HG23 THR A 6 -8.128 -16.169 -2.064 1.00 0.00 H new ATOM 87 N TRP A 7 -10.089 -12.337 0.377 1.00 0.00 N ATOM 88 CA TRP A 7 -10.236 -11.042 1.038 1.00 0.00 C ATOM 89 C TRP A 7 -9.086 -10.852 2.029 1.00 0.00 C ATOM 90 O TRP A 7 -8.588 -11.833 2.592 1.00 0.00 O ATOM 91 CB TRP A 7 -11.561 -10.965 1.814 1.00 0.00 C ATOM 92 CG TRP A 7 -12.815 -10.711 1.047 1.00 0.00 C ATOM 93 CD1 TRP A 7 -13.430 -11.605 0.247 1.00 0.00 C ATOM 94 CD2 TRP A 7 -13.651 -9.512 1.025 1.00 0.00 C ATOM 95 NE1 TRP A 7 -14.579 -11.051 -0.269 1.00 0.00 N ATOM 96 CE2 TRP A 7 -14.766 -9.757 0.167 1.00 0.00 C ATOM 97 CE3 TRP A 7 -13.560 -8.229 1.610 1.00 0.00 C ATOM 98 CZ2 TRP A 7 -15.745 -8.784 -0.087 1.00 0.00 C ATOM 99 CZ3 TRP A 7 -14.539 -7.247 1.365 1.00 0.00 C ATOM 100 CH2 TRP A 7 -15.630 -7.522 0.521 1.00 0.00 C ATOM 0 H TRP A 7 -9.971 -13.100 1.044 1.00 0.00 H new ATOM 0 HA TRP A 7 -10.226 -10.265 0.274 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -11.686 -11.904 2.354 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -11.463 -10.178 2.562 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -13.075 -12.604 0.042 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -15.216 -11.539 -0.899 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -12.726 -7.998 2.256 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -16.576 -9.002 -0.741 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -14.451 -6.275 1.829 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -16.378 -6.765 0.340 1.00 0.00 H new ATOM 111 N TYR A 8 -8.736 -9.589 2.294 1.00 0.00 N ATOM 112 CA TYR A 8 -7.803 -9.150 3.326 1.00 0.00 C ATOM 113 C TYR A 8 -8.306 -7.807 3.884 1.00 0.00 C ATOM 114 O TYR A 8 -8.967 -7.051 3.167 1.00 0.00 O ATOM 115 CB TYR A 8 -6.392 -8.995 2.724 1.00 0.00 C ATOM 116 CG TYR A 8 -5.734 -10.272 2.214 1.00 0.00 C ATOM 117 CD1 TYR A 8 -5.974 -10.719 0.899 1.00 0.00 C ATOM 118 CD2 TYR A 8 -4.856 -10.999 3.044 1.00 0.00 C ATOM 119 CE1 TYR A 8 -5.371 -11.898 0.424 1.00 0.00 C ATOM 120 CE2 TYR A 8 -4.249 -12.181 2.577 1.00 0.00 C ATOM 121 CZ TYR A 8 -4.513 -12.642 1.266 1.00 0.00 C ATOM 122 OH TYR A 8 -3.948 -13.804 0.820 1.00 0.00 O ATOM 0 H TYR A 8 -9.119 -8.807 1.763 1.00 0.00 H new ATOM 0 HA TYR A 8 -7.747 -9.885 4.129 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -6.448 -8.285 1.899 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -5.743 -8.554 3.481 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -6.626 -10.152 0.251 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -4.648 -10.647 4.044 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -5.564 -12.235 -0.584 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -3.582 -12.736 3.220 1.00 0.00 H new ATOM 0 HH TYR A 8 -3.084 -13.938 1.262 1.00 0.00 H new ATOM 132 N THR A 9 -7.998 -7.478 5.145 1.00 0.00 N ATOM 133 CA THR A 9 -8.303 -6.164 5.719 1.00 0.00 C ATOM 134 C THR A 9 -7.281 -5.777 6.791 1.00 0.00 C ATOM 135 O THR A 9 -6.747 -6.638 7.489 1.00 0.00 O ATOM 136 CB THR A 9 -9.764 -6.131 6.226 1.00 0.00 C ATOM 137 OG1 THR A 9 -10.120 -4.878 6.781 1.00 0.00 O ATOM 138 CG2 THR A 9 -10.074 -7.205 7.279 1.00 0.00 C ATOM 0 H THR A 9 -7.532 -8.113 5.793 1.00 0.00 H new ATOM 0 HA THR A 9 -8.219 -5.404 4.942 1.00 0.00 H new ATOM 0 HB THR A 9 -10.351 -6.327 5.329 1.00 0.00 H new ATOM 0 HG1 THR A 9 -9.939 -4.168 6.130 1.00 0.00 H new ATOM 0 HG21 THR A 9 -11.116 -7.121 7.588 1.00 0.00 H new ATOM 0 HG22 THR A 9 -9.900 -8.193 6.853 1.00 0.00 H new ATOM 0 HG23 THR A 9 -9.426 -7.064 8.144 1.00 0.00 H new ATOM 146 N GLY A 10 -7.018 -4.473 6.921 1.00 0.00 N ATOM 147 CA GLY A 10 -6.112 -3.885 7.889 1.00 0.00 C ATOM 148 C GLY A 10 -5.990 -2.394 7.626 1.00 0.00 C ATOM 149 O GLY A 10 -6.913 -1.654 7.959 1.00 0.00 O ATOM 0 H GLY A 10 -7.456 -3.773 6.322 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -6.480 -4.058 8.900 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -5.133 -4.359 7.821 1.00 0.00 H new ATOM 153 N ALA A 11 -4.870 -1.943 7.045 1.00 0.00 N ATOM 154 CA ALA A 11 -4.524 -0.526 7.001 1.00 0.00 C ATOM 155 C ALA A 11 -3.552 -0.168 5.870 1.00 0.00 C ATOM 156 O ALA A 11 -2.942 -1.045 5.241 1.00 0.00 O ATOM 157 CB ALA A 11 -3.885 -0.163 8.354 1.00 0.00 C ATOM 0 H ALA A 11 -4.185 -2.551 6.596 1.00 0.00 H new ATOM 0 HA ALA A 11 -5.437 0.038 6.808 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -3.613 0.893 8.356 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -4.597 -0.356 9.156 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -2.992 -0.768 8.509 1.00 0.00 H new ATOM 163 N LYS A 12 -3.391 1.146 5.656 1.00 0.00 N ATOM 164 CA LYS A 12 -2.241 1.744 4.984 1.00 0.00 C ATOM 165 C LYS A 12 -1.890 3.067 5.668 1.00 0.00 C ATOM 166 O LYS A 12 -2.696 3.645 6.400 1.00 0.00 O ATOM 167 CB LYS A 12 -2.416 1.921 3.457 1.00 0.00 C ATOM 168 CG LYS A 12 -3.380 3.044 3.035 1.00 0.00 C ATOM 169 CD LYS A 12 -3.251 3.452 1.557 1.00 0.00 C ATOM 170 CE LYS A 12 -3.678 2.374 0.552 1.00 0.00 C ATOM 171 NZ LYS A 12 -3.859 2.941 -0.802 1.00 0.00 N ATOM 0 H LYS A 12 -4.079 1.836 5.956 1.00 0.00 H new ATOM 0 HA LYS A 12 -1.413 1.042 5.082 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -1.439 2.117 3.016 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -2.772 0.981 3.037 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -4.404 2.721 3.225 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -3.200 3.918 3.660 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -3.852 4.345 1.388 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -2.214 3.723 1.359 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -2.926 1.585 0.520 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -4.609 1.914 0.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -4.031 2.172 -1.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -4.672 3.590 -0.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -3.002 3.461 -1.078 1.00 0.00 H new ATOM 185 N LEU A 13 -0.704 3.569 5.347 1.00 0.00 N ATOM 186 CA LEU A 13 -0.254 4.924 5.557 1.00 0.00 C ATOM 187 C LEU A 13 0.330 5.356 4.218 1.00 0.00 C ATOM 188 O LEU A 13 1.307 4.761 3.758 1.00 0.00 O ATOM 189 CB LEU A 13 0.738 4.952 6.734 1.00 0.00 C ATOM 190 CG LEU A 13 1.218 6.365 7.126 1.00 0.00 C ATOM 191 CD1 LEU A 13 1.577 6.397 8.619 1.00 0.00 C ATOM 192 CD2 LEU A 13 2.460 6.801 6.339 1.00 0.00 C ATOM 0 H LEU A 13 0.012 2.994 4.903 1.00 0.00 H new ATOM 0 HA LEU A 13 -1.040 5.623 5.842 1.00 0.00 H new ATOM 0 HB2 LEU A 13 0.268 4.487 7.601 1.00 0.00 H new ATOM 0 HB3 LEU A 13 1.606 4.344 6.477 1.00 0.00 H new ATOM 0 HG LEU A 13 0.399 7.047 6.897 1.00 0.00 H new ATOM 0 HD11 LEU A 13 1.915 7.397 8.891 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.699 6.138 9.210 1.00 0.00 H new ATOM 0 HD13 LEU A 13 2.372 5.679 8.817 1.00 0.00 H new ATOM 0 HD21 LEU A 13 2.757 7.802 6.653 1.00 0.00 H new ATOM 0 HD22 LEU A 13 3.276 6.104 6.531 1.00 0.00 H new ATOM 0 HD23 LEU A 13 2.232 6.808 5.273 1.00 0.00 H new ATOM 204 N GLY A 14 -0.288 6.360 3.593 1.00 0.00 N ATOM 205 CA GLY A 14 0.263 7.074 2.450 1.00 0.00 C ATOM 206 C GLY A 14 1.137 8.205 2.980 1.00 0.00 C ATOM 207 O GLY A 14 0.831 8.744 4.041 1.00 0.00 O ATOM 0 H GLY A 14 -1.205 6.703 3.877 1.00 0.00 H new ATOM 0 HA2 GLY A 14 0.849 6.400 1.826 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -0.538 7.471 1.826 1.00 0.00 H new ATOM 211 N PHE A 15 2.221 8.548 2.283 1.00 0.00 N ATOM 212 CA PHE A 15 3.269 9.452 2.738 1.00 0.00 C ATOM 213 C PHE A 15 3.924 10.175 1.557 1.00 0.00 C ATOM 214 O PHE A 15 4.206 9.564 0.520 1.00 0.00 O ATOM 215 CB PHE A 15 4.335 8.631 3.482 1.00 0.00 C ATOM 216 CG PHE A 15 5.615 9.395 3.758 1.00 0.00 C ATOM 217 CD1 PHE A 15 5.668 10.321 4.816 1.00 0.00 C ATOM 218 CD2 PHE A 15 6.728 9.239 2.906 1.00 0.00 C ATOM 219 CE1 PHE A 15 6.832 11.080 5.024 1.00 0.00 C ATOM 220 CE2 PHE A 15 7.885 10.010 3.108 1.00 0.00 C ATOM 221 CZ PHE A 15 7.936 10.933 4.167 1.00 0.00 C ATOM 0 H PHE A 15 2.397 8.186 1.346 1.00 0.00 H new ATOM 0 HA PHE A 15 2.828 10.201 3.396 1.00 0.00 H new ATOM 0 HB2 PHE A 15 3.919 8.285 4.428 1.00 0.00 H new ATOM 0 HB3 PHE A 15 4.572 7.744 2.895 1.00 0.00 H new ATOM 0 HD1 PHE A 15 4.816 10.448 5.467 1.00 0.00 H new ATOM 0 HD2 PHE A 15 6.691 8.525 2.096 1.00 0.00 H new ATOM 0 HE1 PHE A 15 6.878 11.779 5.846 1.00 0.00 H new ATOM 0 HE2 PHE A 15 8.734 9.894 2.451 1.00 0.00 H new ATOM 0 HZ PHE A 15 8.823 11.529 4.322 1.00 0.00 H new ATOM 231 N SER A 16 4.258 11.452 1.760 1.00 0.00 N ATOM 232 CA SER A 16 5.205 12.192 0.942 1.00 0.00 C ATOM 233 C SER A 16 5.825 13.324 1.764 1.00 0.00 C ATOM 234 O SER A 16 5.363 13.633 2.865 1.00 0.00 O ATOM 235 CB SER A 16 4.467 12.779 -0.279 1.00 0.00 C ATOM 236 OG SER A 16 3.543 13.795 0.083 1.00 0.00 O ATOM 0 H SER A 16 3.864 12.008 2.519 1.00 0.00 H new ATOM 0 HA SER A 16 5.997 11.524 0.605 1.00 0.00 H new ATOM 0 HB2 SER A 16 5.196 13.188 -0.979 1.00 0.00 H new ATOM 0 HB3 SER A 16 3.939 11.980 -0.799 1.00 0.00 H new ATOM 0 HG SER A 16 3.102 14.138 -0.722 1.00 0.00 H new ATOM 509 N LEU A 35 0.999 12.928 5.237 1.00 0.00 N ATOM 510 CA LEU A 35 0.613 11.528 5.252 1.00 0.00 C ATOM 511 C LEU A 35 -0.906 11.397 5.276 1.00 0.00 C ATOM 512 O LEU A 35 -1.616 12.388 5.468 1.00 0.00 O ATOM 513 CB LEU A 35 1.349 10.778 6.387 1.00 0.00 C ATOM 514 CG LEU A 35 1.021 11.205 7.832 1.00 0.00 C ATOM 515 CD1 LEU A 35 -0.220 10.490 8.385 1.00 0.00 C ATOM 516 CD2 LEU A 35 2.209 10.882 8.748 1.00 0.00 C ATOM 0 HA LEU A 35 0.930 11.038 4.331 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.129 9.715 6.289 1.00 0.00 H new ATOM 0 HB3 LEU A 35 2.421 10.898 6.233 1.00 0.00 H new ATOM 0 HG LEU A 35 0.820 12.276 7.809 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -0.409 10.825 9.405 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.083 10.723 7.761 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -0.051 9.413 8.382 1.00 0.00 H new ATOM 0 HD21 LEU A 35 1.974 11.185 9.768 1.00 0.00 H new ATOM 0 HD22 LEU A 35 2.406 9.810 8.724 1.00 0.00 H new ATOM 0 HD23 LEU A 35 3.091 11.421 8.403 1.00 0.00 H new ATOM 528 N GLY A 36 -1.375 10.167 5.073 1.00 0.00 N ATOM 529 CA GLY A 36 -2.762 9.742 5.142 1.00 0.00 C ATOM 530 C GLY A 36 -2.768 8.337 5.726 1.00 0.00 C ATOM 531 O GLY A 36 -2.504 7.376 5.004 1.00 0.00 O ATOM 0 H GLY A 36 -0.751 9.394 4.841 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.343 10.421 5.766 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.218 9.750 4.152 1.00 0.00 H new ATOM 535 N ALA A 37 -2.985 8.222 7.040 1.00 0.00 N ATOM 536 CA ALA A 37 -2.970 6.968 7.782 1.00 0.00 C ATOM 537 C ALA A 37 -4.411 6.519 7.990 1.00 0.00 C ATOM 538 O ALA A 37 -5.245 7.324 8.416 1.00 0.00 O ATOM 539 CB ALA A 37 -2.270 7.177 9.129 1.00 0.00 C ATOM 0 H ALA A 37 -3.182 9.029 7.631 1.00 0.00 H new ATOM 0 HA ALA A 37 -2.425 6.202 7.230 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -2.259 6.238 9.683 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -1.246 7.510 8.959 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -2.806 7.932 9.704 1.00 0.00 H new ATOM 545 N GLY A 38 -4.714 5.257 7.664 1.00 0.00 N ATOM 546 CA GLY A 38 -6.091 4.802 7.617 1.00 0.00 C ATOM 547 C GLY A 38 -6.260 3.292 7.589 1.00 0.00 C ATOM 548 O GLY A 38 -5.306 2.543 7.371 1.00 0.00 O ATOM 0 H GLY A 38 -4.023 4.544 7.432 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -6.620 5.197 8.484 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -6.569 5.224 6.733 1.00 0.00 H new ATOM 552 N ALA A 39 -7.512 2.864 7.767 1.00 0.00 N ATOM 553 CA ALA A 39 -7.917 1.465 7.770 1.00 0.00 C ATOM 554 C ALA A 39 -8.394 1.083 6.368 1.00 0.00 C ATOM 555 O ALA A 39 -8.837 1.950 5.615 1.00 0.00 O ATOM 556 CB ALA A 39 -9.039 1.265 8.792 1.00 0.00 C ATOM 0 H ALA A 39 -8.292 3.504 7.917 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.076 0.829 8.045 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -9.345 0.219 8.797 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -8.682 1.543 9.784 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -9.891 1.890 8.524 1.00 0.00 H new ATOM 562 N PHE A 40 -8.311 -0.205 6.018 1.00 0.00 N ATOM 563 CA PHE A 40 -8.558 -0.707 4.669 1.00 0.00 C ATOM 564 C PHE A 40 -9.184 -2.102 4.688 1.00 0.00 C ATOM 565 O PHE A 40 -8.947 -2.899 5.601 1.00 0.00 O ATOM 566 CB PHE A 40 -7.230 -0.743 3.883 1.00 0.00 C ATOM 567 CG PHE A 40 -7.183 0.217 2.711 1.00 0.00 C ATOM 568 CD1 PHE A 40 -6.824 1.561 2.918 1.00 0.00 C ATOM 569 CD2 PHE A 40 -7.523 -0.224 1.418 1.00 0.00 C ATOM 570 CE1 PHE A 40 -6.825 2.465 1.841 1.00 0.00 C ATOM 571 CE2 PHE A 40 -7.501 0.677 0.337 1.00 0.00 C ATOM 572 CZ PHE A 40 -7.155 2.020 0.549 1.00 0.00 C ATOM 0 H PHE A 40 -8.065 -0.940 6.681 1.00 0.00 H new ATOM 0 HA PHE A 40 -9.264 -0.033 4.183 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -6.410 -0.511 4.563 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -7.063 -1.756 3.517 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -6.547 1.899 3.906 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -7.801 -1.255 1.255 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -6.572 3.502 2.006 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -7.751 0.334 -0.656 1.00 0.00 H new ATOM 0 HZ PHE A 40 -7.142 2.712 -0.280 1.00 0.00 H new ATOM 582 N GLY A 41 -9.896 -2.439 3.614 1.00 0.00 N ATOM 583 CA GLY A 41 -10.293 -3.792 3.261 1.00 0.00 C ATOM 584 C GLY A 41 -10.162 -3.965 1.753 1.00 0.00 C ATOM 585 O GLY A 41 -10.175 -2.981 1.012 1.00 0.00 O ATOM 0 H GLY A 41 -10.223 -1.745 2.942 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -9.666 -4.517 3.780 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -11.320 -3.978 3.574 1.00 0.00 H new ATOM 589 N GLY A 42 -10.044 -5.207 1.286 1.00 0.00 N ATOM 590 CA GLY A 42 -9.978 -5.495 -0.133 1.00 0.00 C ATOM 591 C GLY A 42 -10.146 -6.975 -0.414 1.00 0.00 C ATOM 592 O GLY A 42 -10.064 -7.807 0.492 1.00 0.00 O ATOM 0 H GLY A 42 -9.992 -6.033 1.882 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -10.755 -4.935 -0.654 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -9.021 -5.156 -0.529 1.00 0.00 H new ATOM 596 N TYR A 43 -10.384 -7.286 -1.686 1.00 0.00 N ATOM 597 CA TYR A 43 -10.544 -8.634 -2.181 1.00 0.00 C ATOM 598 C TYR A 43 -9.966 -8.760 -3.579 1.00 0.00 C ATOM 599 O TYR A 43 -10.052 -7.836 -4.389 1.00 0.00 O ATOM 600 CB TYR A 43 -12.025 -9.039 -2.153 1.00 0.00 C ATOM 601 CG TYR A 43 -12.990 -8.156 -2.923 1.00 0.00 C ATOM 602 CD1 TYR A 43 -13.561 -7.029 -2.300 1.00 0.00 C ATOM 603 CD2 TYR A 43 -13.361 -8.492 -4.239 1.00 0.00 C ATOM 604 CE1 TYR A 43 -14.500 -6.237 -2.983 1.00 0.00 C ATOM 605 CE2 TYR A 43 -14.301 -7.706 -4.929 1.00 0.00 C ATOM 606 CZ TYR A 43 -14.876 -6.578 -4.303 1.00 0.00 C ATOM 607 OH TYR A 43 -15.787 -5.827 -4.983 1.00 0.00 O ATOM 0 H TYR A 43 -10.472 -6.579 -2.416 1.00 0.00 H new ATOM 0 HA TYR A 43 -9.995 -9.315 -1.531 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -12.107 -10.053 -2.543 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -12.349 -9.070 -1.113 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -13.275 -6.772 -1.291 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -12.923 -9.355 -4.719 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -14.932 -5.372 -2.502 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -14.584 -7.965 -5.939 1.00 0.00 H new ATOM 0 HH TYR A 43 -15.341 -5.359 -5.719 1.00 0.00 H new ATOM 617 N GLN A 44 -9.414 -9.940 -3.851 1.00 0.00 N ATOM 618 CA GLN A 44 -9.125 -10.452 -5.174 1.00 0.00 C ATOM 619 C GLN A 44 -10.403 -11.158 -5.609 1.00 0.00 C ATOM 620 O GLN A 44 -10.753 -12.180 -5.017 1.00 0.00 O ATOM 621 CB GLN A 44 -7.957 -11.454 -5.124 1.00 0.00 C ATOM 622 CG GLN A 44 -6.605 -10.844 -4.729 1.00 0.00 C ATOM 623 CD GLN A 44 -6.433 -10.535 -3.236 1.00 0.00 C ATOM 624 OE1 GLN A 44 -7.111 -11.096 -2.370 1.00 0.00 O ATOM 625 NE2 GLN A 44 -5.494 -9.653 -2.920 1.00 0.00 N ATOM 0 H GLN A 44 -9.146 -10.592 -3.114 1.00 0.00 H new ATOM 0 HA GLN A 44 -8.833 -9.659 -5.863 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -8.204 -12.244 -4.415 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -7.856 -11.923 -6.103 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -5.814 -11.529 -5.034 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -6.463 -9.922 -5.292 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -4.948 -9.204 -3.655 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -5.318 -9.424 -1.942 1.00 0.00 H new ATOM 634 N VAL A 45 -11.125 -10.620 -6.598 1.00 0.00 N ATOM 635 CA VAL A 45 -12.292 -11.297 -7.166 1.00 0.00 C ATOM 636 C VAL A 45 -11.846 -12.443 -8.086 1.00 0.00 C ATOM 637 O VAL A 45 -12.585 -13.405 -8.291 1.00 0.00 O ATOM 638 CB VAL A 45 -13.242 -10.280 -7.841 1.00 0.00 C ATOM 639 CG1 VAL A 45 -12.782 -9.791 -9.221 1.00 0.00 C ATOM 640 CG2 VAL A 45 -14.666 -10.842 -7.944 1.00 0.00 C ATOM 0 H VAL A 45 -10.919 -9.715 -7.021 1.00 0.00 H new ATOM 0 HA VAL A 45 -12.875 -11.757 -6.368 1.00 0.00 H new ATOM 0 HB VAL A 45 -13.225 -9.409 -7.186 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -13.509 -9.082 -9.617 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -11.812 -9.303 -9.129 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -12.698 -10.641 -9.899 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -15.314 -10.107 -8.422 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -14.654 -11.756 -8.538 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -15.043 -11.063 -6.945 1.00 0.00 H new ATOM 699 N VAL A 49 -7.600 -9.776 -10.609 1.00 0.00 N ATOM 700 CA VAL A 49 -8.588 -8.687 -10.571 1.00 0.00 C ATOM 701 C VAL A 49 -9.162 -8.581 -9.153 1.00 0.00 C ATOM 702 O VAL A 49 -9.320 -9.596 -8.474 1.00 0.00 O ATOM 703 CB VAL A 49 -9.738 -8.935 -11.584 1.00 0.00 C ATOM 704 CG1 VAL A 49 -10.605 -7.677 -11.777 1.00 0.00 C ATOM 705 CG2 VAL A 49 -9.259 -9.379 -12.972 1.00 0.00 C ATOM 0 HA VAL A 49 -8.092 -7.757 -10.847 1.00 0.00 H new ATOM 0 HB VAL A 49 -10.316 -9.745 -11.139 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -11.399 -7.889 -12.493 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -11.044 -7.388 -10.822 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -9.986 -6.862 -12.153 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -10.120 -9.532 -13.622 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -8.615 -8.610 -13.398 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -8.701 -10.311 -12.883 1.00 0.00 H new ATOM 715 N GLY A 50 -9.561 -7.385 -8.710 1.00 0.00 N ATOM 716 CA GLY A 50 -10.167 -7.207 -7.398 1.00 0.00 C ATOM 717 C GLY A 50 -10.549 -5.760 -7.117 1.00 0.00 C ATOM 718 O GLY A 50 -10.554 -4.929 -8.025 1.00 0.00 O ATOM 0 H GLY A 50 -9.472 -6.524 -9.249 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -11.056 -7.834 -7.325 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -9.472 -7.550 -6.632 1.00 0.00 H new ATOM 722 N PHE A 51 -10.832 -5.457 -5.849 1.00 0.00 N ATOM 723 CA PHE A 51 -11.014 -4.100 -5.343 1.00 0.00 C ATOM 724 C PHE A 51 -10.409 -3.997 -3.946 1.00 0.00 C ATOM 725 O PHE A 51 -10.237 -5.002 -3.256 1.00 0.00 O ATOM 726 CB PHE A 51 -12.505 -3.732 -5.284 1.00 0.00 C ATOM 727 CG PHE A 51 -13.171 -3.486 -6.624 1.00 0.00 C ATOM 728 CD1 PHE A 51 -13.740 -4.554 -7.344 1.00 0.00 C ATOM 729 CD2 PHE A 51 -13.246 -2.178 -7.142 1.00 0.00 C ATOM 730 CE1 PHE A 51 -14.370 -4.319 -8.579 1.00 0.00 C ATOM 731 CE2 PHE A 51 -13.883 -1.942 -8.373 1.00 0.00 C ATOM 732 CZ PHE A 51 -14.441 -3.012 -9.094 1.00 0.00 C ATOM 0 H PHE A 51 -10.943 -6.170 -5.128 1.00 0.00 H new ATOM 0 HA PHE A 51 -10.514 -3.407 -6.019 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -13.039 -4.534 -4.774 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -12.616 -2.836 -4.673 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -13.692 -5.557 -6.946 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -12.813 -1.355 -6.592 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -14.799 -5.142 -9.132 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -13.944 -0.938 -8.765 1.00 0.00 H new ATOM 0 HZ PHE A 51 -14.924 -2.831 -10.043 1.00 0.00 H new ATOM 742 N GLU A 52 -10.137 -2.772 -3.510 1.00 0.00 N ATOM 743 CA GLU A 52 -9.784 -2.402 -2.151 1.00 0.00 C ATOM 744 C GLU A 52 -10.375 -1.015 -1.870 1.00 0.00 C ATOM 745 O GLU A 52 -10.550 -0.208 -2.784 1.00 0.00 O ATOM 746 CB GLU A 52 -8.257 -2.456 -1.946 1.00 0.00 C ATOM 747 CG GLU A 52 -7.445 -1.861 -3.109 1.00 0.00 C ATOM 748 CD GLU A 52 -6.133 -1.229 -2.657 1.00 0.00 C ATOM 749 OE1 GLU A 52 -5.203 -1.978 -2.257 1.00 0.00 O ATOM 750 OE2 GLU A 52 -6.072 0.023 -2.700 1.00 0.00 O ATOM 0 H GLU A 52 -10.159 -1.966 -4.135 1.00 0.00 H new ATOM 0 HA GLU A 52 -10.202 -3.111 -1.436 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -8.005 -1.921 -1.030 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -7.957 -3.494 -1.802 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -7.233 -2.645 -3.836 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -8.048 -1.109 -3.619 1.00 0.00 H new ATOM 757 N MET A 53 -10.719 -0.744 -0.610 1.00 0.00 N ATOM 758 CA MET A 53 -11.270 0.529 -0.157 1.00 0.00 C ATOM 759 C MET A 53 -10.819 0.758 1.284 1.00 0.00 C ATOM 760 O MET A 53 -10.585 -0.204 2.020 1.00 0.00 O ATOM 761 CB MET A 53 -12.810 0.524 -0.220 1.00 0.00 C ATOM 762 CG MET A 53 -13.374 0.212 -1.610 1.00 0.00 C ATOM 763 SD MET A 53 -15.166 0.413 -1.768 1.00 0.00 S ATOM 764 CE MET A 53 -15.363 -0.121 -3.489 1.00 0.00 C ATOM 0 H MET A 53 -10.618 -1.425 0.143 1.00 0.00 H new ATOM 0 HA MET A 53 -10.911 1.326 -0.808 1.00 0.00 H new ATOM 0 HB2 MET A 53 -13.190 -0.211 0.489 1.00 0.00 H new ATOM 0 HB3 MET A 53 -13.180 1.498 0.101 1.00 0.00 H new ATOM 0 HG2 MET A 53 -12.885 0.859 -2.338 1.00 0.00 H new ATOM 0 HG3 MET A 53 -13.114 -0.814 -1.870 1.00 0.00 H new ATOM 0 HE1 MET A 53 -16.415 -0.064 -3.769 1.00 0.00 H new ATOM 0 HE2 MET A 53 -14.778 0.528 -4.141 1.00 0.00 H new ATOM 0 HE3 MET A 53 -15.015 -1.149 -3.593 1.00 0.00 H new ATOM 774 N GLY A 54 -10.725 2.018 1.708 1.00 0.00 N ATOM 775 CA GLY A 54 -10.333 2.342 3.070 1.00 0.00 C ATOM 776 C GLY A 54 -10.530 3.813 3.382 1.00 0.00 C ATOM 777 O GLY A 54 -10.845 4.587 2.484 1.00 0.00 O ATOM 0 H GLY A 54 -10.917 2.830 1.122 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -10.917 1.742 3.768 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -9.286 2.077 3.219 1.00 0.00 H new ATOM 781 N TYR A 55 -10.334 4.205 4.642 1.00 0.00 N ATOM 782 CA TYR A 55 -10.568 5.563 5.120 1.00 0.00 C ATOM 783 C TYR A 55 -9.405 6.010 5.996 1.00 0.00 C ATOM 784 O TYR A 55 -8.917 5.225 6.812 1.00 0.00 O ATOM 785 CB TYR A 55 -11.921 5.657 5.842 1.00 0.00 C ATOM 786 CG TYR A 55 -12.118 4.675 6.986 1.00 0.00 C ATOM 787 CD1 TYR A 55 -11.704 5.012 8.290 1.00 0.00 C ATOM 788 CD2 TYR A 55 -12.711 3.420 6.744 1.00 0.00 C ATOM 789 CE1 TYR A 55 -11.877 4.100 9.346 1.00 0.00 C ATOM 790 CE2 TYR A 55 -12.888 2.502 7.795 1.00 0.00 C ATOM 791 CZ TYR A 55 -12.473 2.842 9.104 1.00 0.00 C ATOM 792 OH TYR A 55 -12.627 1.961 10.132 1.00 0.00 O ATOM 0 H TYR A 55 -10.002 3.573 5.370 1.00 0.00 H new ATOM 0 HA TYR A 55 -10.619 6.245 4.271 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -12.037 6.669 6.230 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -12.715 5.502 5.112 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -11.252 5.975 8.479 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -13.032 3.161 5.746 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -11.554 4.361 10.343 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -13.340 1.540 7.603 1.00 0.00 H new ATOM 0 HH TYR A 55 -13.054 1.143 9.801 1.00 0.00 H new ATOM 1108 N GLY A 76 -10.816 11.278 4.867 1.00 0.00 N ATOM 1109 CA GLY A 76 -11.156 10.874 3.514 1.00 0.00 C ATOM 1110 C GLY A 76 -11.301 9.370 3.389 1.00 0.00 C ATOM 1111 O GLY A 76 -11.003 8.624 4.323 1.00 0.00 O ATOM 0 HA2 GLY A 76 -12.088 11.354 3.216 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -10.384 11.222 2.827 1.00 0.00 H new ATOM 1115 N VAL A 77 -11.778 8.943 2.220 1.00 0.00 N ATOM 1116 CA VAL A 77 -12.041 7.556 1.879 1.00 0.00 C ATOM 1117 C VAL A 77 -11.514 7.311 0.463 1.00 0.00 C ATOM 1118 O VAL A 77 -11.830 8.053 -0.469 1.00 0.00 O ATOM 1119 CB VAL A 77 -13.530 7.208 2.125 1.00 0.00 C ATOM 1120 CG1 VAL A 77 -14.514 8.094 1.352 1.00 0.00 C ATOM 1121 CG2 VAL A 77 -13.856 5.736 1.833 1.00 0.00 C ATOM 0 H VAL A 77 -11.999 9.584 1.458 1.00 0.00 H new ATOM 0 HA VAL A 77 -11.509 6.860 2.528 1.00 0.00 H new ATOM 0 HB VAL A 77 -13.664 7.403 3.189 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -15.535 7.787 1.578 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -14.375 9.134 1.645 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -14.333 7.991 0.282 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -14.913 5.553 2.024 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -13.631 5.514 0.790 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -13.255 5.095 2.478 1.00 0.00 H new ATOM 1131 N GLN A 78 -10.658 6.296 0.341 1.00 0.00 N ATOM 1132 CA GLN A 78 -10.043 5.791 -0.876 1.00 0.00 C ATOM 1133 C GLN A 78 -10.872 4.611 -1.381 1.00 0.00 C ATOM 1134 O GLN A 78 -11.347 3.798 -0.581 1.00 0.00 O ATOM 1135 CB GLN A 78 -8.619 5.298 -0.555 1.00 0.00 C ATOM 1136 CG GLN A 78 -7.636 6.419 -0.184 1.00 0.00 C ATOM 1137 CD GLN A 78 -6.299 5.875 0.326 1.00 0.00 C ATOM 1138 OE1 GLN A 78 -5.690 4.987 -0.276 1.00 0.00 O ATOM 1139 NE2 GLN A 78 -5.817 6.390 1.449 1.00 0.00 N ATOM 0 H GLN A 78 -10.356 5.767 1.159 1.00 0.00 H new ATOM 0 HA GLN A 78 -9.999 6.577 -1.630 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -8.670 4.586 0.269 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -8.229 4.759 -1.418 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -7.460 7.048 -1.056 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -8.083 7.053 0.582 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -6.332 7.124 1.936 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -4.931 6.052 1.826 1.00 0.00 H new ATOM 1148 N LEU A 79 -10.985 4.480 -2.705 1.00 0.00 N ATOM 1149 CA LEU A 79 -11.544 3.313 -3.369 1.00 0.00 C ATOM 1150 C LEU A 79 -10.741 3.033 -4.637 1.00 0.00 C ATOM 1151 O LEU A 79 -10.547 3.917 -5.475 1.00 0.00 O ATOM 1152 CB LEU A 79 -13.064 3.439 -3.613 1.00 0.00 C ATOM 1153 CG LEU A 79 -13.582 4.497 -4.615 1.00 0.00 C ATOM 1154 CD1 LEU A 79 -15.068 4.223 -4.890 1.00 0.00 C ATOM 1155 CD2 LEU A 79 -13.453 5.942 -4.112 1.00 0.00 C ATOM 0 H LEU A 79 -10.681 5.204 -3.356 1.00 0.00 H new ATOM 0 HA LEU A 79 -11.453 2.448 -2.712 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -13.424 2.466 -3.948 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -13.535 3.640 -2.651 1.00 0.00 H new ATOM 0 HG LEU A 79 -12.966 4.409 -5.510 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -15.450 4.961 -5.596 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -15.182 3.225 -5.312 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -15.629 4.289 -3.958 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -13.837 6.626 -4.869 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -14.026 6.060 -3.192 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -12.404 6.167 -3.917 1.00 0.00 H new ATOM 1167 N THR A 80 -10.240 1.805 -4.752 1.00 0.00 N ATOM 1168 CA THR A 80 -9.239 1.416 -5.728 1.00 0.00 C ATOM 1169 C THR A 80 -9.618 0.041 -6.290 1.00 0.00 C ATOM 1170 O THR A 80 -9.793 -0.928 -5.555 1.00 0.00 O ATOM 1171 CB THR A 80 -7.824 1.470 -5.084 1.00 0.00 C ATOM 1172 OG1 THR A 80 -7.832 1.452 -3.660 1.00 0.00 O ATOM 1173 CG2 THR A 80 -7.125 2.774 -5.488 1.00 0.00 C ATOM 0 H THR A 80 -10.531 1.035 -4.149 1.00 0.00 H new ATOM 0 HA THR A 80 -9.207 2.109 -6.568 1.00 0.00 H new ATOM 0 HB THR A 80 -7.313 0.577 -5.443 1.00 0.00 H new ATOM 0 HG1 THR A 80 -6.921 1.306 -3.330 1.00 0.00 H new ATOM 0 HG21 THR A 80 -6.134 2.811 -5.036 1.00 0.00 H new ATOM 0 HG22 THR A 80 -7.031 2.815 -6.573 1.00 0.00 H new ATOM 0 HG23 THR A 80 -7.713 3.624 -5.142 1.00 0.00 H new ATOM 1181 N ALA A 81 -9.756 -0.057 -7.613 1.00 0.00 N ATOM 1182 CA ALA A 81 -9.935 -1.316 -8.314 1.00 0.00 C ATOM 1183 C ALA A 81 -8.543 -1.893 -8.547 1.00 0.00 C ATOM 1184 O ALA A 81 -7.606 -1.161 -8.874 1.00 0.00 O ATOM 1185 CB ALA A 81 -10.640 -1.073 -9.652 1.00 0.00 C ATOM 0 H ALA A 81 -9.745 0.754 -8.232 1.00 0.00 H new ATOM 0 HA ALA A 81 -10.549 -2.006 -7.735 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -10.771 -2.022 -10.172 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -11.615 -0.620 -9.473 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -10.036 -0.404 -10.265 1.00 0.00 H new ATOM 1191 N LYS A 82 -8.406 -3.203 -8.354 1.00 0.00 N ATOM 1192 CA LYS A 82 -7.154 -3.924 -8.492 1.00 0.00 C ATOM 1193 C LYS A 82 -7.133 -4.605 -9.849 1.00 0.00 C ATOM 1194 O LYS A 82 -8.050 -5.366 -10.168 1.00 0.00 O ATOM 1195 CB LYS A 82 -7.048 -5.022 -7.423 1.00 0.00 C ATOM 1196 CG LYS A 82 -6.845 -4.523 -5.993 1.00 0.00 C ATOM 1197 CD LYS A 82 -7.050 -5.684 -5.000 1.00 0.00 C ATOM 1198 CE LYS A 82 -6.266 -5.457 -3.707 1.00 0.00 C ATOM 1199 NZ LYS A 82 -4.839 -5.780 -3.888 1.00 0.00 N ATOM 0 H LYS A 82 -9.187 -3.804 -8.090 1.00 0.00 H new ATOM 0 HA LYS A 82 -6.330 -3.219 -8.383 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -7.955 -5.626 -7.454 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -6.218 -5.680 -7.682 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -5.843 -4.110 -5.881 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -7.548 -3.718 -5.776 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -8.111 -5.786 -4.771 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -6.732 -6.619 -5.461 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -6.370 -4.419 -3.393 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -6.684 -6.074 -2.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.620 -6.672 -3.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -4.632 -5.880 -4.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -4.257 -5.016 -3.490 1.00 0.00 H new ATOM 1213 N LEU A 83 -6.049 -4.398 -10.592 1.00 0.00 N ATOM 1214 CA LEU A 83 -5.642 -5.286 -11.672 1.00 0.00 C ATOM 1215 C LEU A 83 -4.182 -5.615 -11.380 1.00 0.00 C ATOM 1216 O LEU A 83 -3.445 -4.739 -10.924 1.00 0.00 O ATOM 1217 CB LEU A 83 -5.927 -4.675 -13.057 1.00 0.00 C ATOM 1218 CG LEU A 83 -5.129 -3.404 -13.422 1.00 0.00 C ATOM 1219 CD1 LEU A 83 -3.809 -3.732 -14.141 1.00 0.00 C ATOM 1220 CD2 LEU A 83 -5.964 -2.502 -14.341 1.00 0.00 C ATOM 0 H LEU A 83 -5.425 -3.602 -10.459 1.00 0.00 H new ATOM 0 HA LEU A 83 -6.218 -6.210 -11.712 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -5.726 -5.434 -13.813 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -6.990 -4.440 -13.115 1.00 0.00 H new ATOM 0 HG LEU A 83 -4.900 -2.897 -12.484 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -3.284 -2.807 -14.377 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -3.185 -4.348 -13.493 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -4.022 -4.274 -15.063 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -5.392 -1.609 -14.592 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -6.212 -3.043 -15.254 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -6.882 -2.213 -13.830 1.00 0.00 H new ATOM 1232 N GLY A 84 -3.774 -6.873 -11.538 1.00 0.00 N ATOM 1233 CA GLY A 84 -2.506 -7.333 -10.988 1.00 0.00 C ATOM 1234 C GLY A 84 -2.256 -8.795 -11.316 1.00 0.00 C ATOM 1235 O GLY A 84 -3.012 -9.372 -12.090 1.00 0.00 O ATOM 0 H GLY A 84 -4.302 -7.587 -12.040 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -1.693 -6.725 -11.386 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -2.506 -7.196 -9.907 1.00 0.00 H new ATOM 1239 N TYR A 85 -1.204 -9.383 -10.741 1.00 0.00 N ATOM 1240 CA TYR A 85 -0.882 -10.807 -10.852 1.00 0.00 C ATOM 1241 C TYR A 85 -0.035 -11.230 -9.644 1.00 0.00 C ATOM 1242 O TYR A 85 0.667 -10.384 -9.084 1.00 0.00 O ATOM 1243 CB TYR A 85 -0.063 -11.075 -12.132 1.00 0.00 C ATOM 1244 CG TYR A 85 -0.832 -10.948 -13.434 1.00 0.00 C ATOM 1245 CD1 TYR A 85 -1.746 -11.952 -13.809 1.00 0.00 C ATOM 1246 CD2 TYR A 85 -0.652 -9.820 -14.259 1.00 0.00 C ATOM 1247 CE1 TYR A 85 -2.491 -11.824 -14.994 1.00 0.00 C ATOM 1248 CE2 TYR A 85 -1.396 -9.683 -15.445 1.00 0.00 C ATOM 1249 CZ TYR A 85 -2.325 -10.685 -15.812 1.00 0.00 C ATOM 1250 OH TYR A 85 -3.064 -10.561 -16.951 1.00 0.00 O ATOM 0 H TYR A 85 -0.535 -8.867 -10.170 1.00 0.00 H new ATOM 0 HA TYR A 85 -1.813 -11.372 -10.888 1.00 0.00 H new ATOM 0 HB2 TYR A 85 0.778 -10.382 -12.157 1.00 0.00 H new ATOM 0 HB3 TYR A 85 0.354 -12.080 -12.072 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -1.875 -12.823 -13.184 1.00 0.00 H new ATOM 0 HD2 TYR A 85 0.060 -9.058 -13.980 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -3.190 -12.596 -15.279 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -1.258 -8.816 -16.074 1.00 0.00 H new ATOM 0 HH TYR A 85 -2.833 -9.722 -17.401 1.00 0.00 H new ATOM 1260 N PRO A 86 0.005 -12.529 -9.289 1.00 0.00 N ATOM 1261 CA PRO A 86 1.061 -13.062 -8.441 1.00 0.00 C ATOM 1262 C PRO A 86 2.410 -12.897 -9.149 1.00 0.00 C ATOM 1263 O PRO A 86 2.506 -13.095 -10.361 1.00 0.00 O ATOM 1264 CB PRO A 86 0.699 -14.530 -8.196 1.00 0.00 C ATOM 1265 CG PRO A 86 -0.123 -14.904 -9.428 1.00 0.00 C ATOM 1266 CD PRO A 86 -0.853 -13.605 -9.767 1.00 0.00 C ATOM 0 HA PRO A 86 1.149 -12.540 -7.488 1.00 0.00 H new ATOM 0 HB2 PRO A 86 1.589 -15.153 -8.103 1.00 0.00 H new ATOM 0 HB3 PRO A 86 0.125 -14.654 -7.278 1.00 0.00 H new ATOM 0 HG2 PRO A 86 0.511 -15.236 -10.250 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -0.820 -15.715 -9.216 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.023 -13.521 -10.840 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -1.830 -13.569 -9.285 1.00 0.00 H new ATOM 1274 N ILE A 87 3.458 -12.570 -8.385 1.00 0.00 N ATOM 1275 CA ILE A 87 4.845 -12.558 -8.864 1.00 0.00 C ATOM 1276 C ILE A 87 5.630 -13.743 -8.270 1.00 0.00 C ATOM 1277 O ILE A 87 6.776 -14.001 -8.637 1.00 0.00 O ATOM 1278 CB ILE A 87 5.469 -11.153 -8.665 1.00 0.00 C ATOM 1279 CG1 ILE A 87 6.836 -10.946 -9.355 1.00 0.00 C ATOM 1280 CG2 ILE A 87 5.606 -10.779 -7.183 1.00 0.00 C ATOM 1281 CD1 ILE A 87 6.810 -11.179 -10.870 1.00 0.00 C ATOM 0 H ILE A 87 3.366 -12.303 -7.405 1.00 0.00 H new ATOM 0 HA ILE A 87 4.887 -12.723 -9.941 1.00 0.00 H new ATOM 0 HB ILE A 87 4.754 -10.491 -9.154 1.00 0.00 H new ATOM 0 HG12 ILE A 87 7.180 -9.930 -9.160 1.00 0.00 H new ATOM 0 HG13 ILE A 87 7.564 -11.621 -8.906 1.00 0.00 H new ATOM 0 HG21 ILE A 87 6.048 -9.786 -7.098 1.00 0.00 H new ATOM 0 HG22 ILE A 87 4.622 -10.779 -6.715 1.00 0.00 H new ATOM 0 HG23 ILE A 87 6.246 -11.505 -6.682 1.00 0.00 H new ATOM 0 HD11 ILE A 87 7.806 -11.014 -11.281 1.00 0.00 H new ATOM 0 HD12 ILE A 87 6.498 -12.203 -11.075 1.00 0.00 H new ATOM 0 HD13 ILE A 87 6.108 -10.486 -11.333 1.00 0.00 H new ATOM 1331 N LEU A 91 3.773 -13.208 -2.985 1.00 0.00 N ATOM 1332 CA LEU A 91 3.764 -11.817 -3.416 1.00 0.00 C ATOM 1333 C LEU A 91 2.890 -11.702 -4.658 1.00 0.00 C ATOM 1334 O LEU A 91 3.010 -12.516 -5.584 1.00 0.00 O ATOM 1335 CB LEU A 91 5.171 -11.300 -3.776 1.00 0.00 C ATOM 1336 CG LEU A 91 6.104 -10.996 -2.594 1.00 0.00 C ATOM 1337 CD1 LEU A 91 6.938 -12.216 -2.184 1.00 0.00 C ATOM 1338 CD2 LEU A 91 7.062 -9.850 -2.948 1.00 0.00 C ATOM 0 HA LEU A 91 3.385 -11.218 -2.588 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.655 -12.040 -4.413 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.061 -10.392 -4.368 1.00 0.00 H new ATOM 0 HG LEU A 91 5.464 -10.714 -1.758 1.00 0.00 H new ATOM 0 HD11 LEU A 91 7.582 -11.951 -1.345 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.274 -13.029 -1.890 1.00 0.00 H new ATOM 0 HD13 LEU A 91 7.552 -12.536 -3.026 1.00 0.00 H new ATOM 0 HD21 LEU A 91 7.716 -9.647 -2.100 1.00 0.00 H new ATOM 0 HD22 LEU A 91 7.664 -10.133 -3.811 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.487 -8.955 -3.185 1.00 0.00 H new ATOM 1350 N ASP A 92 2.095 -10.634 -4.712 1.00 0.00 N ATOM 1351 CA ASP A 92 1.221 -10.291 -5.820 1.00 0.00 C ATOM 1352 C ASP A 92 1.247 -8.779 -6.054 1.00 0.00 C ATOM 1353 O ASP A 92 1.107 -7.976 -5.131 1.00 0.00 O ATOM 1354 CB ASP A 92 -0.187 -10.894 -5.633 1.00 0.00 C ATOM 1355 CG ASP A 92 -0.968 -10.492 -4.373 1.00 0.00 C ATOM 1356 OD1 ASP A 92 -0.364 -10.318 -3.295 1.00 0.00 O ATOM 1357 OD2 ASP A 92 -2.213 -10.394 -4.499 1.00 0.00 O ATOM 0 H ASP A 92 2.044 -9.959 -3.949 1.00 0.00 H new ATOM 0 HA ASP A 92 1.590 -10.745 -6.739 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.787 -10.623 -6.502 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -0.091 -11.980 -5.638 1.00 0.00 H new ATOM 1362 N ILE A 93 1.523 -8.395 -7.305 1.00 0.00 N ATOM 1363 CA ILE A 93 1.749 -7.020 -7.746 1.00 0.00 C ATOM 1364 C ILE A 93 0.472 -6.468 -8.375 1.00 0.00 C ATOM 1365 O ILE A 93 -0.354 -7.237 -8.872 1.00 0.00 O ATOM 1366 CB ILE A 93 2.992 -6.923 -8.669 1.00 0.00 C ATOM 1367 CG1 ILE A 93 3.068 -7.906 -9.866 1.00 0.00 C ATOM 1368 CG2 ILE A 93 4.253 -7.123 -7.810 1.00 0.00 C ATOM 1369 CD1 ILE A 93 2.138 -7.577 -11.039 1.00 0.00 C ATOM 0 H ILE A 93 1.598 -9.066 -8.069 1.00 0.00 H new ATOM 0 HA ILE A 93 1.980 -6.390 -6.887 1.00 0.00 H new ATOM 0 HB ILE A 93 2.912 -5.936 -9.124 1.00 0.00 H new ATOM 0 HG12 ILE A 93 4.094 -7.929 -10.232 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.835 -8.909 -9.508 1.00 0.00 H new ATOM 0 HG21 ILE A 93 5.138 -7.058 -8.443 1.00 0.00 H new ATOM 0 HG22 ILE A 93 4.297 -6.350 -7.043 1.00 0.00 H new ATOM 0 HG23 ILE A 93 4.218 -8.103 -7.335 1.00 0.00 H new ATOM 0 HD11 ILE A 93 2.266 -8.322 -11.824 1.00 0.00 H new ATOM 0 HD12 ILE A 93 1.103 -7.585 -10.696 1.00 0.00 H new ATOM 0 HD13 ILE A 93 2.383 -6.590 -11.432 1.00 0.00 H new ATOM 1381 N TYR A 94 0.303 -5.140 -8.344 1.00 0.00 N ATOM 1382 CA TYR A 94 -0.950 -4.487 -8.695 1.00 0.00 C ATOM 1383 C TYR A 94 -0.763 -3.092 -9.279 1.00 0.00 C ATOM 1384 O TYR A 94 0.185 -2.372 -8.965 1.00 0.00 O ATOM 1385 CB TYR A 94 -1.806 -4.302 -7.429 1.00 0.00 C ATOM 1386 CG TYR A 94 -2.383 -5.572 -6.858 1.00 0.00 C ATOM 1387 CD1 TYR A 94 -3.521 -6.145 -7.455 1.00 0.00 C ATOM 1388 CD2 TYR A 94 -1.785 -6.179 -5.740 1.00 0.00 C ATOM 1389 CE1 TYR A 94 -4.069 -7.330 -6.937 1.00 0.00 C ATOM 1390 CE2 TYR A 94 -2.321 -7.367 -5.228 1.00 0.00 C ATOM 1391 CZ TYR A 94 -3.458 -7.951 -5.826 1.00 0.00 C ATOM 1392 OH TYR A 94 -3.989 -9.086 -5.308 1.00 0.00 O ATOM 0 H TYR A 94 1.041 -4.490 -8.072 1.00 0.00 H new ATOM 0 HA TYR A 94 -1.418 -5.130 -9.440 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -1.196 -3.822 -6.664 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -2.625 -3.620 -7.659 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -3.974 -5.672 -8.314 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -0.917 -5.732 -5.279 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -4.951 -7.763 -7.385 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -1.862 -7.838 -4.372 1.00 0.00 H new ATOM 0 HH TYR A 94 -3.318 -9.539 -4.756 1.00 0.00 H new ATOM 1402 N THR A 95 -1.796 -2.695 -10.016 1.00 0.00 N ATOM 1403 CA THR A 95 -2.153 -1.333 -10.342 1.00 0.00 C ATOM 1404 C THR A 95 -3.489 -1.150 -9.617 1.00 0.00 C ATOM 1405 O THR A 95 -4.423 -1.941 -9.802 1.00 0.00 O ATOM 1406 CB THR A 95 -2.242 -1.130 -11.860 1.00 0.00 C ATOM 1407 OG1 THR A 95 -0.998 -1.441 -12.455 1.00 0.00 O ATOM 1408 CG2 THR A 95 -2.601 0.315 -12.223 1.00 0.00 C ATOM 0 H THR A 95 -2.445 -3.368 -10.425 1.00 0.00 H new ATOM 0 HA THR A 95 -1.418 -0.591 -10.030 1.00 0.00 H new ATOM 0 HB THR A 95 -3.027 -1.789 -12.230 1.00 0.00 H new ATOM 0 HG1 THR A 95 -1.058 -1.312 -13.425 1.00 0.00 H new ATOM 0 HG21 THR A 95 -2.654 0.415 -13.307 1.00 0.00 H new ATOM 0 HG22 THR A 95 -3.567 0.570 -11.787 1.00 0.00 H new ATOM 0 HG23 THR A 95 -1.838 0.988 -11.833 1.00 0.00 H new ATOM 1416 N ARG A 96 -3.537 -0.159 -8.724 1.00 0.00 N ATOM 1417 CA ARG A 96 -4.685 0.179 -7.892 1.00 0.00 C ATOM 1418 C ARG A 96 -5.266 1.453 -8.495 1.00 0.00 C ATOM 1419 O ARG A 96 -4.614 2.491 -8.420 1.00 0.00 O ATOM 1420 CB ARG A 96 -4.224 0.412 -6.441 1.00 0.00 C ATOM 1421 CG ARG A 96 -3.801 -0.856 -5.681 1.00 0.00 C ATOM 1422 CD ARG A 96 -3.169 -0.440 -4.345 1.00 0.00 C ATOM 1423 NE ARG A 96 -2.779 -1.596 -3.512 1.00 0.00 N ATOM 1424 CZ ARG A 96 -1.544 -1.828 -3.038 1.00 0.00 C ATOM 1425 NH1 ARG A 96 -0.677 -0.825 -2.959 1.00 0.00 N ATOM 1426 NH2 ARG A 96 -1.178 -3.042 -2.632 1.00 0.00 N ATOM 0 H ARG A 96 -2.739 0.455 -8.557 1.00 0.00 H new ATOM 0 HA ARG A 96 -5.429 -0.617 -7.866 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -3.386 1.109 -6.450 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -5.033 0.894 -5.892 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -4.664 -1.498 -5.507 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -3.089 -1.432 -6.273 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -2.290 0.175 -4.540 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -3.875 0.179 -3.792 1.00 0.00 H new ATOM 0 HE ARG A 96 -3.506 -2.272 -3.278 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -0.952 0.111 -3.257 1.00 0.00 H new ATOM 0 HH12 ARG A 96 0.263 -0.991 -2.600 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -1.840 -3.816 -2.678 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -0.235 -3.198 -2.275 1.00 0.00 H new ATOM 1440 N LEU A 97 -6.437 1.391 -9.133 1.00 0.00 N ATOM 1441 CA LEU A 97 -6.975 2.480 -9.952 1.00 0.00 C ATOM 1442 C LEU A 97 -8.377 2.847 -9.482 1.00 0.00 C ATOM 1443 O LEU A 97 -9.232 1.973 -9.373 1.00 0.00 O ATOM 1444 CB LEU A 97 -6.934 2.050 -11.430 1.00 0.00 C ATOM 1445 CG LEU A 97 -7.453 3.126 -12.412 1.00 0.00 C ATOM 1446 CD1 LEU A 97 -6.649 3.078 -13.719 1.00 0.00 C ATOM 1447 CD2 LEU A 97 -8.940 2.945 -12.754 1.00 0.00 C ATOM 0 H LEU A 97 -7.046 0.573 -9.095 1.00 0.00 H new ATOM 0 HA LEU A 97 -6.369 3.380 -9.846 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -5.908 1.795 -11.695 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -7.529 1.145 -11.551 1.00 0.00 H new ATOM 0 HG LEU A 97 -7.330 4.087 -11.913 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -7.022 3.839 -14.404 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -5.597 3.266 -13.506 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -6.757 2.095 -14.176 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -9.252 3.727 -13.446 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -9.091 1.969 -13.216 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -9.534 3.010 -11.842 1.00 0.00 H new ATOM 1459 N GLY A 98 -8.632 4.129 -9.219 1.00 0.00 N ATOM 1460 CA GLY A 98 -9.950 4.610 -8.844 1.00 0.00 C ATOM 1461 C GLY A 98 -9.823 6.038 -8.346 1.00 0.00 C ATOM 1462 O GLY A 98 -9.735 6.967 -9.150 1.00 0.00 O ATOM 0 H GLY A 98 -7.923 4.861 -9.262 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -10.625 4.566 -9.698 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -10.377 3.975 -8.067 1.00 0.00 H new ATOM 1466 N GLY A 99 -9.775 6.224 -7.026 1.00 0.00 N ATOM 1467 CA GLY A 99 -9.600 7.549 -6.472 1.00 0.00 C ATOM 1468 C GLY A 99 -9.881 7.604 -4.984 1.00 0.00 C ATOM 1469 O GLY A 99 -9.894 6.588 -4.287 1.00 0.00 O ATOM 0 H GLY A 99 -9.855 5.478 -6.335 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -8.579 7.884 -6.657 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -10.262 8.244 -6.988 1.00 0.00 H new ATOM 1473 N MET A 100 -10.093 8.826 -4.507 1.00 0.00 N ATOM 1474 CA MET A 100 -10.490 9.118 -3.143 1.00 0.00 C ATOM 1475 C MET A 100 -11.412 10.335 -3.120 1.00 0.00 C ATOM 1476 O MET A 100 -11.390 11.154 -4.045 1.00 0.00 O ATOM 1477 CB MET A 100 -9.234 9.318 -2.277 1.00 0.00 C ATOM 1478 CG MET A 100 -8.285 10.410 -2.789 1.00 0.00 C ATOM 1479 SD MET A 100 -6.684 10.441 -1.944 1.00 0.00 S ATOM 1480 CE MET A 100 -5.845 11.723 -2.912 1.00 0.00 C ATOM 0 H MET A 100 -9.989 9.663 -5.080 1.00 0.00 H new ATOM 0 HA MET A 100 -11.050 8.282 -2.725 1.00 0.00 H new ATOM 0 HB2 MET A 100 -9.542 9.567 -1.262 1.00 0.00 H new ATOM 0 HB3 MET A 100 -8.690 8.375 -2.223 1.00 0.00 H new ATOM 0 HG2 MET A 100 -8.119 10.263 -3.856 1.00 0.00 H new ATOM 0 HG3 MET A 100 -8.766 11.381 -2.672 1.00 0.00 H new ATOM 0 HE1 MET A 100 -4.837 11.871 -2.524 1.00 0.00 H new ATOM 0 HE2 MET A 100 -5.790 11.413 -3.956 1.00 0.00 H new ATOM 0 HE3 MET A 100 -6.403 12.657 -2.840 1.00 0.00 H new ATOM 1490 N VAL A 101 -12.184 10.468 -2.040 1.00 0.00 N ATOM 1491 CA VAL A 101 -12.955 11.663 -1.715 1.00 0.00 C ATOM 1492 C VAL A 101 -12.659 12.040 -0.265 1.00 0.00 C ATOM 1493 O VAL A 101 -12.334 11.171 0.549 1.00 0.00 O ATOM 1494 CB VAL A 101 -14.467 11.483 -1.985 1.00 0.00 C ATOM 1495 CG1 VAL A 101 -14.758 11.292 -3.477 1.00 0.00 C ATOM 1496 CG2 VAL A 101 -15.102 10.319 -1.217 1.00 0.00 C ATOM 0 H VAL A 101 -12.291 9.725 -1.350 1.00 0.00 H new ATOM 0 HA VAL A 101 -12.652 12.480 -2.370 1.00 0.00 H new ATOM 0 HB VAL A 101 -14.917 12.409 -1.626 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -15.831 11.169 -3.626 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -14.413 12.166 -4.030 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -14.238 10.405 -3.839 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -16.163 10.259 -1.460 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -14.612 9.387 -1.498 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -14.984 10.482 -0.146 1.00 0.00 H new ATOM 1506 N PHE A 102 -12.754 13.334 0.051 1.00 0.00 N ATOM 1507 CA PHE A 102 -12.325 13.890 1.326 1.00 0.00 C ATOM 1508 C PHE A 102 -13.357 14.879 1.873 1.00 0.00 C ATOM 1509 O PHE A 102 -13.970 15.658 1.129 1.00 0.00 O ATOM 1510 CB PHE A 102 -10.930 14.524 1.172 1.00 0.00 C ATOM 1511 CG PHE A 102 -9.783 13.615 1.572 1.00 0.00 C ATOM 1512 CD1 PHE A 102 -9.345 12.588 0.714 1.00 0.00 C ATOM 1513 CD2 PHE A 102 -9.170 13.780 2.832 1.00 0.00 C ATOM 1514 CE1 PHE A 102 -8.321 11.717 1.125 1.00 0.00 C ATOM 1515 CE2 PHE A 102 -8.137 12.916 3.234 1.00 0.00 C ATOM 1516 CZ PHE A 102 -7.716 11.880 2.383 1.00 0.00 C ATOM 0 H PHE A 102 -13.138 14.032 -0.586 1.00 0.00 H new ATOM 0 HA PHE A 102 -12.250 13.088 2.060 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -10.794 14.826 0.134 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -10.887 15.431 1.776 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -9.796 12.469 -0.260 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -9.496 14.573 3.489 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -7.998 10.920 0.472 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -7.667 13.048 4.197 1.00 0.00 H new ATOM 0 HZ PHE A 102 -6.929 11.210 2.695 1.00 0.00 H new ATOM 1526 N ARG A 103 -13.479 14.878 3.203 1.00 0.00 N ATOM 1527 CA ARG A 103 -14.385 15.649 4.040 1.00 0.00 C ATOM 1528 C ARG A 103 -13.517 16.505 4.958 1.00 0.00 C ATOM 1529 O ARG A 103 -12.910 15.965 5.886 1.00 0.00 O ATOM 1530 CB ARG A 103 -15.273 14.671 4.839 1.00 0.00 C ATOM 1531 CG ARG A 103 -16.146 15.330 5.927 1.00 0.00 C ATOM 1532 CD ARG A 103 -16.950 14.254 6.673 1.00 0.00 C ATOM 1533 NE ARG A 103 -17.756 14.807 7.778 1.00 0.00 N ATOM 1534 CZ ARG A 103 -18.864 14.274 8.311 1.00 0.00 C ATOM 1535 NH1 ARG A 103 -19.391 13.143 7.840 1.00 0.00 N ATOM 1536 NH2 ARG A 103 -19.435 14.899 9.335 1.00 0.00 N ATOM 0 H ARG A 103 -12.884 14.275 3.771 1.00 0.00 H new ATOM 0 HA ARG A 103 -15.044 16.293 3.459 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -15.923 14.142 4.143 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -14.634 13.924 5.309 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -15.517 15.878 6.628 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -16.823 16.054 5.474 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -17.608 13.745 5.969 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -16.265 13.504 7.069 1.00 0.00 H new ATOM 0 HE ARG A 103 -17.436 15.689 8.179 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -18.950 12.663 7.056 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -20.235 12.758 8.264 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -19.029 15.762 9.696 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -20.279 14.516 9.760 1.00 0.00 H new ATOM 1779 N SER A 120 -10.465 13.160 -5.804 1.00 0.00 N ATOM 1780 CA SER A 120 -9.212 12.969 -6.510 1.00 0.00 C ATOM 1781 C SER A 120 -9.281 11.608 -7.219 1.00 0.00 C ATOM 1782 O SER A 120 -9.082 10.583 -6.565 1.00 0.00 O ATOM 1783 CB SER A 120 -8.052 13.082 -5.511 1.00 0.00 C ATOM 1784 OG SER A 120 -6.813 13.235 -6.169 1.00 0.00 O ATOM 0 HA SER A 120 -9.040 13.733 -7.268 1.00 0.00 H new ATOM 0 HB2 SER A 120 -8.221 13.932 -4.851 1.00 0.00 H new ATOM 0 HB3 SER A 120 -8.024 12.191 -4.883 1.00 0.00 H new ATOM 0 HG SER A 120 -6.096 13.306 -5.504 1.00 0.00 H new ATOM 1790 N PRO A 121 -9.633 11.561 -8.520 1.00 0.00 N ATOM 1791 CA PRO A 121 -9.540 10.349 -9.324 1.00 0.00 C ATOM 1792 C PRO A 121 -8.061 10.087 -9.632 1.00 0.00 C ATOM 1793 O PRO A 121 -7.404 10.927 -10.248 1.00 0.00 O ATOM 1794 CB PRO A 121 -10.370 10.630 -10.579 1.00 0.00 C ATOM 1795 CG PRO A 121 -10.249 12.144 -10.763 1.00 0.00 C ATOM 1796 CD PRO A 121 -10.088 12.679 -9.339 1.00 0.00 C ATOM 0 HA PRO A 121 -9.919 9.456 -8.828 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -9.984 10.090 -11.443 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -11.408 10.324 -10.449 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -9.393 12.403 -11.386 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -11.133 12.559 -11.248 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -9.368 13.497 -9.312 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -11.033 13.074 -8.965 1.00 0.00 H new ATOM 1804 N VAL A 122 -7.520 8.956 -9.170 1.00 0.00 N ATOM 1805 CA VAL A 122 -6.091 8.649 -9.259 1.00 0.00 C ATOM 1806 C VAL A 122 -5.884 7.145 -9.455 1.00 0.00 C ATOM 1807 O VAL A 122 -6.812 6.343 -9.323 1.00 0.00 O ATOM 1808 CB VAL A 122 -5.311 9.172 -8.020 1.00 0.00 C ATOM 1809 CG1 VAL A 122 -5.219 10.705 -7.992 1.00 0.00 C ATOM 1810 CG2 VAL A 122 -5.872 8.685 -6.675 1.00 0.00 C ATOM 0 H VAL A 122 -8.067 8.222 -8.720 1.00 0.00 H new ATOM 0 HA VAL A 122 -5.687 9.169 -10.128 1.00 0.00 H new ATOM 0 HB VAL A 122 -4.315 8.746 -8.139 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -4.665 11.020 -7.108 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -4.704 11.055 -8.887 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -6.223 11.129 -7.962 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -5.273 9.094 -5.861 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -6.904 9.019 -6.569 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -5.838 7.596 -6.639 1.00 0.00 H new ATOM 1820 N PHE A 123 -4.639 6.753 -9.734 1.00 0.00 N ATOM 1821 CA PHE A 123 -4.199 5.377 -9.648 1.00 0.00 C ATOM 1822 C PHE A 123 -2.811 5.351 -9.019 1.00 0.00 C ATOM 1823 O PHE A 123 -2.110 6.365 -9.006 1.00 0.00 O ATOM 1824 CB PHE A 123 -4.217 4.709 -11.033 1.00 0.00 C ATOM 1825 CG PHE A 123 -3.127 5.165 -11.986 1.00 0.00 C ATOM 1826 CD1 PHE A 123 -3.309 6.317 -12.774 1.00 0.00 C ATOM 1827 CD2 PHE A 123 -1.924 4.437 -12.081 1.00 0.00 C ATOM 1828 CE1 PHE A 123 -2.293 6.743 -13.648 1.00 0.00 C ATOM 1829 CE2 PHE A 123 -0.909 4.863 -12.955 1.00 0.00 C ATOM 1830 CZ PHE A 123 -1.092 6.016 -13.738 1.00 0.00 C ATOM 0 H PHE A 123 -3.906 7.398 -10.029 1.00 0.00 H new ATOM 0 HA PHE A 123 -4.881 4.804 -9.020 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -4.132 3.631 -10.899 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -5.185 4.898 -11.497 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -4.231 6.875 -12.707 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -1.782 3.550 -11.481 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -2.435 7.628 -14.250 1.00 0.00 H new ATOM 0 HE2 PHE A 123 0.012 4.304 -13.025 1.00 0.00 H new ATOM 0 HZ PHE A 123 -0.311 6.344 -14.408 1.00 0.00 H new ATOM 1840 N ALA A 124 -2.422 4.172 -8.544 1.00 0.00 N ATOM 1841 CA ALA A 124 -1.121 3.853 -7.999 1.00 0.00 C ATOM 1842 C ALA A 124 -0.651 2.533 -8.608 1.00 0.00 C ATOM 1843 O ALA A 124 -1.463 1.740 -9.096 1.00 0.00 O ATOM 1844 CB ALA A 124 -1.239 3.730 -6.474 1.00 0.00 C ATOM 0 H ALA A 124 -3.051 3.369 -8.532 1.00 0.00 H new ATOM 0 HA ALA A 124 -0.399 4.634 -8.235 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -0.263 3.489 -6.052 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -1.591 4.674 -6.059 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -1.947 2.939 -6.226 1.00 0.00 H new ATOM 1850 N GLY A 125 0.647 2.265 -8.490 1.00 0.00 N ATOM 1851 CA GLY A 125 1.217 0.938 -8.663 1.00 0.00 C ATOM 1852 C GLY A 125 1.645 0.455 -7.284 1.00 0.00 C ATOM 1853 O GLY A 125 1.959 1.272 -6.416 1.00 0.00 O ATOM 0 H GLY A 125 1.341 2.978 -8.268 1.00 0.00 H new ATOM 0 HA2 GLY A 125 0.486 0.258 -9.100 1.00 0.00 H new ATOM 0 HA3 GLY A 125 2.069 0.970 -9.342 1.00 0.00 H new ATOM 1857 N GLY A 126 1.647 -0.858 -7.056 1.00 0.00 N ATOM 1858 CA GLY A 126 1.899 -1.385 -5.729 1.00 0.00 C ATOM 1859 C GLY A 126 1.988 -2.900 -5.707 1.00 0.00 C ATOM 1860 O GLY A 126 1.983 -3.565 -6.744 1.00 0.00 O ATOM 0 H GLY A 126 1.478 -1.566 -7.771 1.00 0.00 H new ATOM 0 HA2 GLY A 126 2.829 -0.965 -5.346 1.00 0.00 H new ATOM 0 HA3 GLY A 126 1.104 -1.062 -5.057 1.00 0.00 H new ATOM 1864 N VAL A 127 2.100 -3.435 -4.495 1.00 0.00 N ATOM 1865 CA VAL A 127 2.280 -4.853 -4.233 1.00 0.00 C ATOM 1866 C VAL A 127 1.569 -5.203 -2.925 1.00 0.00 C ATOM 1867 O VAL A 127 1.317 -4.318 -2.092 1.00 0.00 O ATOM 1868 CB VAL A 127 3.801 -5.166 -4.245 1.00 0.00 C ATOM 1869 CG1 VAL A 127 4.584 -4.396 -3.170 1.00 0.00 C ATOM 1870 CG2 VAL A 127 4.149 -6.656 -4.125 1.00 0.00 C ATOM 0 H VAL A 127 2.067 -2.874 -3.644 1.00 0.00 H new ATOM 0 HA VAL A 127 1.830 -5.481 -5.002 1.00 0.00 H new ATOM 0 HB VAL A 127 4.107 -4.828 -5.235 1.00 0.00 H new ATOM 0 HG11 VAL A 127 5.640 -4.659 -3.231 1.00 0.00 H new ATOM 0 HG12 VAL A 127 4.467 -3.324 -3.332 1.00 0.00 H new ATOM 0 HG13 VAL A 127 4.201 -4.658 -2.184 1.00 0.00 H new ATOM 0 HG21 VAL A 127 5.232 -6.779 -4.142 1.00 0.00 H new ATOM 0 HG22 VAL A 127 3.754 -7.048 -3.188 1.00 0.00 H new ATOM 0 HG23 VAL A 127 3.709 -7.201 -4.960 1.00 0.00 H new ATOM 1880 N GLU A 128 1.273 -6.492 -2.757 1.00 0.00 N ATOM 1881 CA GLU A 128 0.972 -7.164 -1.507 1.00 0.00 C ATOM 1882 C GLU A 128 1.956 -8.336 -1.374 1.00 0.00 C ATOM 1883 O GLU A 128 2.387 -8.928 -2.366 1.00 0.00 O ATOM 1884 CB GLU A 128 -0.506 -7.601 -1.477 1.00 0.00 C ATOM 1885 CG GLU A 128 -1.424 -6.455 -1.017 1.00 0.00 C ATOM 1886 CD GLU A 128 -2.671 -6.233 -1.873 1.00 0.00 C ATOM 1887 OE1 GLU A 128 -3.481 -7.163 -2.091 1.00 0.00 O ATOM 1888 OE2 GLU A 128 -2.854 -5.070 -2.321 1.00 0.00 O ATOM 0 H GLU A 128 1.237 -7.132 -3.550 1.00 0.00 H new ATOM 0 HA GLU A 128 1.098 -6.502 -0.650 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -0.808 -7.934 -2.470 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -0.621 -8.452 -0.806 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -1.738 -6.652 0.008 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -0.845 -5.532 -1.001 1.00 0.00 H new ATOM 1895 N TYR A 129 2.364 -8.615 -0.135 1.00 0.00 N ATOM 1896 CA TYR A 129 3.362 -9.603 0.240 1.00 0.00 C ATOM 1897 C TYR A 129 2.905 -10.245 1.546 1.00 0.00 C ATOM 1898 O TYR A 129 2.963 -9.622 2.615 1.00 0.00 O ATOM 1899 CB TYR A 129 4.742 -8.934 0.369 1.00 0.00 C ATOM 1900 CG TYR A 129 5.851 -9.757 1.021 1.00 0.00 C ATOM 1901 CD1 TYR A 129 5.907 -11.161 0.891 1.00 0.00 C ATOM 1902 CD2 TYR A 129 6.862 -9.095 1.745 1.00 0.00 C ATOM 1903 CE1 TYR A 129 6.967 -11.894 1.452 1.00 0.00 C ATOM 1904 CE2 TYR A 129 7.928 -9.819 2.309 1.00 0.00 C ATOM 1905 CZ TYR A 129 7.991 -11.222 2.155 1.00 0.00 C ATOM 1906 OH TYR A 129 9.034 -11.915 2.692 1.00 0.00 O ATOM 0 H TYR A 129 1.982 -8.127 0.675 1.00 0.00 H new ATOM 0 HA TYR A 129 3.462 -10.377 -0.521 1.00 0.00 H new ATOM 0 HB2 TYR A 129 5.074 -8.647 -0.629 1.00 0.00 H new ATOM 0 HB3 TYR A 129 4.621 -8.014 0.941 1.00 0.00 H new ATOM 0 HD1 TYR A 129 5.126 -11.679 0.354 1.00 0.00 H new ATOM 0 HD2 TYR A 129 6.818 -8.023 1.868 1.00 0.00 H new ATOM 0 HE1 TYR A 129 6.998 -12.968 1.346 1.00 0.00 H new ATOM 0 HE2 TYR A 129 8.699 -9.302 2.860 1.00 0.00 H new ATOM 0 HH TYR A 129 9.645 -11.292 3.139 1.00 0.00 H new ATOM 1916 N ALA A 130 2.430 -11.486 1.447 1.00 0.00 N ATOM 1917 CA ALA A 130 2.029 -12.311 2.569 1.00 0.00 C ATOM 1918 C ALA A 130 3.260 -13.063 3.076 1.00 0.00 C ATOM 1919 O ALA A 130 3.470 -14.227 2.742 1.00 0.00 O ATOM 1920 CB ALA A 130 0.903 -13.249 2.120 1.00 0.00 C ATOM 0 H ALA A 130 2.313 -11.954 0.549 1.00 0.00 H new ATOM 0 HA ALA A 130 1.640 -11.712 3.393 1.00 0.00 H new ATOM 0 HB1 ALA A 130 0.594 -13.874 2.958 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.054 -12.659 1.775 1.00 0.00 H new ATOM 0 HB3 ALA A 130 1.259 -13.882 1.307 1.00 0.00 H new ATOM 1926 N ILE A 131 4.078 -12.393 3.900 1.00 0.00 N ATOM 1927 CA ILE A 131 5.275 -12.992 4.503 1.00 0.00 C ATOM 1928 C ILE A 131 4.920 -14.221 5.363 1.00 0.00 C ATOM 1929 O ILE A 131 5.732 -15.132 5.501 1.00 0.00 O ATOM 1930 CB ILE A 131 6.124 -11.899 5.200 1.00 0.00 C ATOM 1931 CG1 ILE A 131 7.508 -12.404 5.676 1.00 0.00 C ATOM 1932 CG2 ILE A 131 5.380 -11.113 6.292 1.00 0.00 C ATOM 1933 CD1 ILE A 131 7.602 -12.940 7.114 1.00 0.00 C ATOM 0 H ILE A 131 3.927 -11.420 4.167 1.00 0.00 H new ATOM 0 HA ILE A 131 5.922 -13.403 3.728 1.00 0.00 H new ATOM 0 HB ILE A 131 6.316 -11.174 4.409 1.00 0.00 H new ATOM 0 HG12 ILE A 131 7.831 -13.195 4.999 1.00 0.00 H new ATOM 0 HG13 ILE A 131 8.220 -11.585 5.573 1.00 0.00 H new ATOM 0 HG21 ILE A 131 6.049 -10.370 6.726 1.00 0.00 H new ATOM 0 HG22 ILE A 131 4.516 -10.612 5.855 1.00 0.00 H new ATOM 0 HG23 ILE A 131 5.046 -11.799 7.071 1.00 0.00 H new ATOM 0 HD11 ILE A 131 8.624 -13.260 7.317 1.00 0.00 H new ATOM 0 HD12 ILE A 131 7.322 -12.153 7.815 1.00 0.00 H new ATOM 0 HD13 ILE A 131 6.927 -13.787 7.231 1.00 0.00 H new ATOM 1945 N THR A 132 3.685 -14.283 5.874 1.00 0.00 N ATOM 1946 CA THR A 132 3.008 -15.496 6.322 1.00 0.00 C ATOM 1947 C THR A 132 1.570 -15.379 5.789 1.00 0.00 C ATOM 1948 O THR A 132 1.057 -14.259 5.727 1.00 0.00 O ATOM 1949 CB THR A 132 3.065 -15.652 7.856 1.00 0.00 C ATOM 1950 OG1 THR A 132 3.013 -14.395 8.498 1.00 0.00 O ATOM 1951 CG2 THR A 132 4.354 -16.349 8.301 1.00 0.00 C ATOM 0 H THR A 132 3.108 -13.450 5.990 1.00 0.00 H new ATOM 0 HA THR A 132 3.492 -16.395 5.942 1.00 0.00 H new ATOM 0 HB THR A 132 2.201 -16.255 8.136 1.00 0.00 H new ATOM 0 HG1 THR A 132 3.049 -14.522 9.469 1.00 0.00 H new ATOM 0 HG21 THR A 132 4.361 -16.442 9.387 1.00 0.00 H new ATOM 0 HG22 THR A 132 4.405 -17.341 7.851 1.00 0.00 H new ATOM 0 HG23 THR A 132 5.214 -15.761 7.982 1.00 0.00 H new ATOM 1959 N PRO A 133 0.917 -16.476 5.361 1.00 0.00 N ATOM 1960 CA PRO A 133 -0.328 -16.408 4.594 1.00 0.00 C ATOM 1961 C PRO A 133 -1.512 -15.825 5.376 1.00 0.00 C ATOM 1962 O PRO A 133 -2.485 -15.382 4.762 1.00 0.00 O ATOM 1963 CB PRO A 133 -0.597 -17.838 4.111 1.00 0.00 C ATOM 1964 CG PRO A 133 0.169 -18.713 5.102 1.00 0.00 C ATOM 1965 CD PRO A 133 1.376 -17.852 5.466 1.00 0.00 C ATOM 0 HA PRO A 133 -0.216 -15.714 3.761 1.00 0.00 H new ATOM 0 HB2 PRO A 133 -1.663 -18.067 4.117 1.00 0.00 H new ATOM 0 HB3 PRO A 133 -0.244 -17.988 3.091 1.00 0.00 H new ATOM 0 HG2 PRO A 133 -0.434 -18.952 5.978 1.00 0.00 H new ATOM 0 HG3 PRO A 133 0.470 -19.660 4.654 1.00 0.00 H new ATOM 0 HD2 PRO A 133 1.726 -18.073 6.474 1.00 0.00 H new ATOM 0 HD3 PRO A 133 2.210 -18.040 4.790 1.00 0.00 H new ATOM 1973 N GLU A 134 -1.435 -15.797 6.710 1.00 0.00 N ATOM 1974 CA GLU A 134 -2.414 -15.225 7.629 1.00 0.00 C ATOM 1975 C GLU A 134 -2.577 -13.711 7.436 1.00 0.00 C ATOM 1976 O GLU A 134 -3.613 -13.148 7.796 1.00 0.00 O ATOM 1977 CB GLU A 134 -1.959 -15.489 9.078 1.00 0.00 C ATOM 1978 CG GLU A 134 -2.030 -16.961 9.524 1.00 0.00 C ATOM 1979 CD GLU A 134 -1.108 -17.907 8.743 1.00 0.00 C ATOM 1980 OE1 GLU A 134 -0.004 -17.463 8.350 1.00 0.00 O ATOM 1981 OE2 GLU A 134 -1.551 -19.048 8.481 1.00 0.00 O ATOM 0 H GLU A 134 -0.638 -16.198 7.203 1.00 0.00 H new ATOM 0 HA GLU A 134 -3.374 -15.698 7.423 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -0.932 -15.140 9.190 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -2.574 -14.891 9.751 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -1.777 -17.019 10.583 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -3.058 -17.309 9.422 1.00 0.00 H new ATOM 1988 N ILE A 135 -1.557 -13.042 6.895 1.00 0.00 N ATOM 1989 CA ILE A 135 -1.423 -11.593 6.866 1.00 0.00 C ATOM 1990 C ILE A 135 -0.974 -11.143 5.479 1.00 0.00 C ATOM 1991 O ILE A 135 -0.543 -11.955 4.663 1.00 0.00 O ATOM 1992 CB ILE A 135 -0.516 -11.078 8.016 1.00 0.00 C ATOM 1993 CG1 ILE A 135 0.873 -11.745 8.130 1.00 0.00 C ATOM 1994 CG2 ILE A 135 -1.239 -11.233 9.366 1.00 0.00 C ATOM 1995 CD1 ILE A 135 1.874 -11.301 7.061 1.00 0.00 C ATOM 0 H ILE A 135 -0.773 -13.518 6.449 1.00 0.00 H new ATOM 0 HA ILE A 135 -2.396 -11.137 7.050 1.00 0.00 H new ATOM 0 HB ILE A 135 -0.329 -10.035 7.762 1.00 0.00 H new ATOM 0 HG12 ILE A 135 1.289 -11.526 9.114 1.00 0.00 H new ATOM 0 HG13 ILE A 135 0.750 -12.826 8.069 1.00 0.00 H new ATOM 0 HG21 ILE A 135 -0.596 -10.869 10.167 1.00 0.00 H new ATOM 0 HG22 ILE A 135 -2.163 -10.655 9.352 1.00 0.00 H new ATOM 0 HG23 ILE A 135 -1.471 -12.284 9.536 1.00 0.00 H new ATOM 0 HD11 ILE A 135 2.822 -11.817 7.214 1.00 0.00 H new ATOM 0 HD12 ILE A 135 1.483 -11.545 6.073 1.00 0.00 H new ATOM 0 HD13 ILE A 135 2.030 -10.225 7.134 1.00 0.00 H new ATOM 2007 N ALA A 136 -1.102 -9.847 5.191 1.00 0.00 N ATOM 2008 CA ALA A 136 -0.379 -9.240 4.093 1.00 0.00 C ATOM 2009 C ALA A 136 0.358 -8.023 4.630 1.00 0.00 C ATOM 2010 O ALA A 136 -0.098 -7.358 5.560 1.00 0.00 O ATOM 2011 CB ALA A 136 -1.337 -8.875 2.954 1.00 0.00 C ATOM 0 H ALA A 136 -1.702 -9.204 5.708 1.00 0.00 H new ATOM 0 HA ALA A 136 0.345 -9.941 3.677 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -0.775 -8.420 2.138 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -1.835 -9.776 2.594 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -2.083 -8.169 3.318 1.00 0.00 H new ATOM 2017 N THR A 137 1.481 -7.723 3.997 1.00 0.00 N ATOM 2018 CA THR A 137 2.131 -6.426 4.002 1.00 0.00 C ATOM 2019 C THR A 137 1.870 -5.857 2.605 1.00 0.00 C ATOM 2020 O THR A 137 1.698 -6.629 1.659 1.00 0.00 O ATOM 2021 CB THR A 137 3.628 -6.582 4.331 1.00 0.00 C ATOM 2022 OG1 THR A 137 4.299 -7.454 3.441 1.00 0.00 O ATOM 2023 CG2 THR A 137 3.845 -7.099 5.757 1.00 0.00 C ATOM 0 H THR A 137 1.987 -8.412 3.440 1.00 0.00 H new ATOM 0 HA THR A 137 1.747 -5.749 4.765 1.00 0.00 H new ATOM 0 HB THR A 137 4.046 -5.581 4.227 1.00 0.00 H new ATOM 0 HG1 THR A 137 3.880 -8.339 3.472 1.00 0.00 H new ATOM 0 HG21 THR A 137 4.913 -7.196 5.950 1.00 0.00 H new ATOM 0 HG22 THR A 137 3.409 -6.398 6.469 1.00 0.00 H new ATOM 0 HG23 THR A 137 3.367 -8.072 5.868 1.00 0.00 H new ATOM 2031 N ARG A 138 1.788 -4.535 2.448 1.00 0.00 N ATOM 2032 CA ARG A 138 1.487 -3.927 1.152 1.00 0.00 C ATOM 2033 C ARG A 138 2.267 -2.634 0.988 1.00 0.00 C ATOM 2034 O ARG A 138 2.529 -1.952 1.976 1.00 0.00 O ATOM 2035 CB ARG A 138 -0.041 -3.795 0.956 1.00 0.00 C ATOM 2036 CG ARG A 138 -0.836 -3.067 2.048 1.00 0.00 C ATOM 2037 CD ARG A 138 -2.342 -3.380 2.011 1.00 0.00 C ATOM 2038 NE ARG A 138 -3.092 -2.615 0.995 1.00 0.00 N ATOM 2039 CZ ARG A 138 -3.988 -1.643 1.236 1.00 0.00 C ATOM 2040 NH1 ARG A 138 -4.159 -1.140 2.465 1.00 0.00 N ATOM 2041 NH2 ARG A 138 -4.737 -1.161 0.244 1.00 0.00 N ATOM 0 H ARG A 138 1.926 -3.864 3.204 1.00 0.00 H new ATOM 0 HA ARG A 138 1.822 -4.575 0.342 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -0.215 -3.278 0.012 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -0.454 -4.798 0.851 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -0.438 -3.344 3.024 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -0.692 -1.992 1.938 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -2.476 -4.445 1.821 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -2.769 -3.175 2.993 1.00 0.00 H new ATOM 0 HE ARG A 138 -2.913 -2.846 0.018 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -3.603 -1.494 3.243 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -4.845 -0.402 2.623 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -4.631 -1.530 -0.701 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -5.416 -0.423 0.430 1.00 0.00 H new ATOM 2055 N LEU A 139 2.646 -2.323 -0.254 1.00 0.00 N ATOM 2056 CA LEU A 139 3.475 -1.181 -0.645 1.00 0.00 C ATOM 2057 C LEU A 139 2.848 -0.554 -1.894 1.00 0.00 C ATOM 2058 O LEU A 139 2.052 -1.209 -2.583 1.00 0.00 O ATOM 2059 CB LEU A 139 4.926 -1.644 -0.923 1.00 0.00 C ATOM 2060 CG LEU A 139 6.022 -1.191 0.064 1.00 0.00 C ATOM 2061 CD1 LEU A 139 6.240 0.326 0.062 1.00 0.00 C ATOM 2062 CD2 LEU A 139 5.779 -1.687 1.493 1.00 0.00 C ATOM 0 H LEU A 139 2.368 -2.890 -1.055 1.00 0.00 H new ATOM 0 HA LEU A 139 3.517 -0.444 0.157 1.00 0.00 H new ATOM 0 HB2 LEU A 139 4.931 -2.734 -0.953 1.00 0.00 H new ATOM 0 HB3 LEU A 139 5.205 -1.296 -1.918 1.00 0.00 H new ATOM 0 HG LEU A 139 6.935 -1.659 -0.303 1.00 0.00 H new ATOM 0 HD11 LEU A 139 7.023 0.582 0.776 1.00 0.00 H new ATOM 0 HD12 LEU A 139 6.539 0.649 -0.935 1.00 0.00 H new ATOM 0 HD13 LEU A 139 5.314 0.827 0.344 1.00 0.00 H new ATOM 0 HD21 LEU A 139 6.582 -1.337 2.141 1.00 0.00 H new ATOM 0 HD22 LEU A 139 4.826 -1.301 1.855 1.00 0.00 H new ATOM 0 HD23 LEU A 139 5.755 -2.777 1.501 1.00 0.00 H new ATOM 2074 N GLU A 140 3.170 0.713 -2.175 1.00 0.00 N ATOM 2075 CA GLU A 140 2.461 1.524 -3.160 1.00 0.00 C ATOM 2076 C GLU A 140 3.277 2.757 -3.564 1.00 0.00 C ATOM 2077 O GLU A 140 4.004 3.298 -2.729 1.00 0.00 O ATOM 2078 CB GLU A 140 1.185 1.996 -2.460 1.00 0.00 C ATOM 2079 CG GLU A 140 0.099 2.589 -3.350 1.00 0.00 C ATOM 2080 CD GLU A 140 -1.190 2.624 -2.535 1.00 0.00 C ATOM 2081 OE1 GLU A 140 -1.443 3.622 -1.815 1.00 0.00 O ATOM 2082 OE2 GLU A 140 -1.883 1.582 -2.528 1.00 0.00 O ATOM 0 H GLU A 140 3.938 1.205 -1.719 1.00 0.00 H new ATOM 0 HA GLU A 140 2.270 0.945 -4.063 1.00 0.00 H new ATOM 0 HB2 GLU A 140 0.759 1.150 -1.920 1.00 0.00 H new ATOM 0 HB3 GLU A 140 1.461 2.743 -1.715 1.00 0.00 H new ATOM 0 HG2 GLU A 140 0.375 3.592 -3.675 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -0.032 1.987 -4.249 1.00 0.00 H new ATOM 2089 N TYR A 141 3.078 3.258 -4.790 1.00 0.00 N ATOM 2090 CA TYR A 141 3.443 4.611 -5.202 1.00 0.00 C ATOM 2091 C TYR A 141 2.418 5.139 -6.210 1.00 0.00 C ATOM 2092 O TYR A 141 2.007 4.414 -7.121 1.00 0.00 O ATOM 2093 CB TYR A 141 4.853 4.632 -5.816 1.00 0.00 C ATOM 2094 CG TYR A 141 5.456 6.022 -5.983 1.00 0.00 C ATOM 2095 CD1 TYR A 141 6.073 6.636 -4.879 1.00 0.00 C ATOM 2096 CD2 TYR A 141 5.446 6.688 -7.229 1.00 0.00 C ATOM 2097 CE1 TYR A 141 6.700 7.886 -5.018 1.00 0.00 C ATOM 2098 CE2 TYR A 141 6.072 7.946 -7.375 1.00 0.00 C ATOM 2099 CZ TYR A 141 6.718 8.547 -6.267 1.00 0.00 C ATOM 2100 OH TYR A 141 7.396 9.729 -6.365 1.00 0.00 O ATOM 0 H TYR A 141 2.647 2.716 -5.539 1.00 0.00 H new ATOM 0 HA TYR A 141 3.446 5.255 -4.323 1.00 0.00 H new ATOM 0 HB2 TYR A 141 5.516 4.036 -5.189 1.00 0.00 H new ATOM 0 HB3 TYR A 141 4.817 4.147 -6.792 1.00 0.00 H new ATOM 0 HD1 TYR A 141 6.065 6.144 -3.918 1.00 0.00 H new ATOM 0 HD2 TYR A 141 4.956 6.232 -8.076 1.00 0.00 H new ATOM 0 HE1 TYR A 141 7.172 8.346 -4.162 1.00 0.00 H new ATOM 0 HE2 TYR A 141 6.058 8.449 -8.331 1.00 0.00 H new ATOM 0 HH TYR A 141 6.862 10.446 -5.964 1.00 0.00 H new ATOM 2110 N GLN A 142 2.064 6.419 -6.079 1.00 0.00 N ATOM 2111 CA GLN A 142 1.397 7.233 -7.089 1.00 0.00 C ATOM 2112 C GLN A 142 2.125 8.575 -7.205 1.00 0.00 C ATOM 2113 O GLN A 142 3.016 8.863 -6.408 1.00 0.00 O ATOM 2114 CB GLN A 142 -0.088 7.442 -6.745 1.00 0.00 C ATOM 2115 CG GLN A 142 -0.341 8.204 -5.435 1.00 0.00 C ATOM 2116 CD GLN A 142 -1.768 8.742 -5.384 1.00 0.00 C ATOM 2117 OE1 GLN A 142 -2.683 8.081 -4.908 1.00 0.00 O ATOM 2118 NE2 GLN A 142 -1.990 9.951 -5.887 1.00 0.00 N ATOM 0 H GLN A 142 2.245 6.939 -5.221 1.00 0.00 H new ATOM 0 HA GLN A 142 1.434 6.715 -8.047 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -0.564 7.984 -7.563 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -0.573 6.468 -6.683 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -0.167 7.543 -4.586 1.00 0.00 H new ATOM 0 HG3 GLN A 142 0.366 9.029 -5.347 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -1.218 10.490 -6.280 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -2.932 10.341 -5.880 1.00 0.00 H new ATOM 2127 N PHE A 143 1.702 9.418 -8.151 1.00 0.00 N ATOM 2128 CA PHE A 143 2.130 10.809 -8.262 1.00 0.00 C ATOM 2129 C PHE A 143 1.156 11.736 -7.519 1.00 0.00 C ATOM 2130 O PHE A 143 0.029 11.341 -7.204 1.00 0.00 O ATOM 2131 CB PHE A 143 2.269 11.188 -9.742 1.00 0.00 C ATOM 2132 CG PHE A 143 3.357 10.406 -10.456 1.00 0.00 C ATOM 2133 CD1 PHE A 143 4.710 10.661 -10.157 1.00 0.00 C ATOM 2134 CD2 PHE A 143 3.027 9.406 -11.393 1.00 0.00 C ATOM 2135 CE1 PHE A 143 5.725 9.926 -10.792 1.00 0.00 C ATOM 2136 CE2 PHE A 143 4.044 8.671 -12.027 1.00 0.00 C ATOM 2137 CZ PHE A 143 5.394 8.930 -11.727 1.00 0.00 C ATOM 0 H PHE A 143 1.038 9.143 -8.875 1.00 0.00 H new ATOM 0 HA PHE A 143 3.105 10.929 -7.790 1.00 0.00 H new ATOM 0 HB2 PHE A 143 1.317 11.018 -10.246 1.00 0.00 H new ATOM 0 HB3 PHE A 143 2.485 12.254 -9.820 1.00 0.00 H new ATOM 0 HD1 PHE A 143 4.968 11.424 -9.437 1.00 0.00 H new ATOM 0 HD2 PHE A 143 1.992 9.204 -11.624 1.00 0.00 H new ATOM 0 HE1 PHE A 143 6.761 10.126 -10.561 1.00 0.00 H new ATOM 0 HE2 PHE A 143 3.789 7.906 -12.746 1.00 0.00 H new ATOM 0 HZ PHE A 143 6.175 8.365 -12.214 1.00 0.00 H new ATOM 2372 N GLY A 160 5.670 12.056 -5.121 1.00 0.00 N ATOM 2373 CA GLY A 160 4.316 11.644 -5.422 1.00 0.00 C ATOM 2374 C GLY A 160 3.519 11.409 -4.150 1.00 0.00 C ATOM 2375 O GLY A 160 3.279 12.347 -3.385 1.00 0.00 O ATOM 0 HA2 GLY A 160 3.826 12.408 -6.026 1.00 0.00 H new ATOM 0 HA3 GLY A 160 4.334 10.731 -6.017 1.00 0.00 H new ATOM 2379 N MET A 161 3.109 10.164 -3.933 1.00 0.00 N ATOM 2380 CA MET A 161 2.745 9.645 -2.632 1.00 0.00 C ATOM 2381 C MET A 161 3.108 8.166 -2.656 1.00 0.00 C ATOM 2382 O MET A 161 2.590 7.412 -3.481 1.00 0.00 O ATOM 2383 CB MET A 161 1.271 9.914 -2.292 1.00 0.00 C ATOM 2384 CG MET A 161 0.924 9.356 -0.905 1.00 0.00 C ATOM 2385 SD MET A 161 -0.398 10.220 -0.014 1.00 0.00 S ATOM 2386 CE MET A 161 0.501 11.702 0.530 1.00 0.00 C ATOM 0 H MET A 161 3.021 9.475 -4.680 1.00 0.00 H new ATOM 0 HA MET A 161 3.287 10.150 -1.832 1.00 0.00 H new ATOM 0 HB2 MET A 161 1.077 10.986 -2.317 1.00 0.00 H new ATOM 0 HB3 MET A 161 0.629 9.456 -3.045 1.00 0.00 H new ATOM 0 HG2 MET A 161 0.638 8.310 -1.016 1.00 0.00 H new ATOM 0 HG3 MET A 161 1.824 9.377 -0.290 1.00 0.00 H new ATOM 0 HE1 MET A 161 -0.170 12.347 1.097 1.00 0.00 H new ATOM 0 HE2 MET A 161 1.340 11.408 1.160 1.00 0.00 H new ATOM 0 HE3 MET A 161 0.873 12.242 -0.341 1.00 0.00 H new ATOM 2396 N LEU A 162 4.027 7.768 -1.775 1.00 0.00 N ATOM 2397 CA LEU A 162 4.264 6.369 -1.448 1.00 0.00 C ATOM 2398 C LEU A 162 3.147 5.946 -0.496 1.00 0.00 C ATOM 2399 O LEU A 162 2.662 6.786 0.257 1.00 0.00 O ATOM 2400 CB LEU A 162 5.660 6.264 -0.795 1.00 0.00 C ATOM 2401 CG LEU A 162 6.024 4.874 -0.222 1.00 0.00 C ATOM 2402 CD1 LEU A 162 7.499 4.545 -0.489 1.00 0.00 C ATOM 2403 CD2 LEU A 162 5.779 4.797 1.294 1.00 0.00 C ATOM 0 H LEU A 162 4.630 8.415 -1.267 1.00 0.00 H new ATOM 0 HA LEU A 162 4.254 5.715 -2.320 1.00 0.00 H new ATOM 0 HB2 LEU A 162 6.410 6.540 -1.536 1.00 0.00 H new ATOM 0 HB3 LEU A 162 5.722 6.997 0.009 1.00 0.00 H new ATOM 0 HG LEU A 162 5.380 4.153 -0.724 1.00 0.00 H new ATOM 0 HD11 LEU A 162 7.733 3.563 -0.078 1.00 0.00 H new ATOM 0 HD12 LEU A 162 7.682 4.541 -1.563 1.00 0.00 H new ATOM 0 HD13 LEU A 162 8.131 5.297 -0.016 1.00 0.00 H new ATOM 0 HD21 LEU A 162 6.047 3.804 1.656 1.00 0.00 H new ATOM 0 HD22 LEU A 162 6.390 5.545 1.800 1.00 0.00 H new ATOM 0 HD23 LEU A 162 4.726 4.987 1.503 1.00 0.00 H new ATOM 2415 N SER A 163 2.800 4.659 -0.441 1.00 0.00 N ATOM 2416 CA SER A 163 2.093 4.123 0.720 1.00 0.00 C ATOM 2417 C SER A 163 2.726 2.809 1.146 1.00 0.00 C ATOM 2418 O SER A 163 3.302 2.092 0.326 1.00 0.00 O ATOM 2419 CB SER A 163 0.580 3.933 0.498 1.00 0.00 C ATOM 2420 OG SER A 163 -0.018 4.895 -0.349 1.00 0.00 O ATOM 0 H SER A 163 2.994 3.978 -1.176 1.00 0.00 H new ATOM 0 HA SER A 163 2.191 4.868 1.510 1.00 0.00 H new ATOM 0 HB2 SER A 163 0.410 2.942 0.077 1.00 0.00 H new ATOM 0 HB3 SER A 163 0.078 3.959 1.465 1.00 0.00 H new ATOM 0 HG SER A 163 -0.264 4.474 -1.199 1.00 0.00 H new ATOM 2426 N LEU A 164 2.557 2.477 2.425 1.00 0.00 N ATOM 2427 CA LEU A 164 2.859 1.180 3.015 1.00 0.00 C ATOM 2428 C LEU A 164 1.659 0.772 3.865 1.00 0.00 C ATOM 2429 O LEU A 164 0.917 1.637 4.322 1.00 0.00 O ATOM 2430 CB LEU A 164 4.183 1.246 3.802 1.00 0.00 C ATOM 2431 CG LEU A 164 4.212 2.222 5.005 1.00 0.00 C ATOM 2432 CD1 LEU A 164 3.740 1.571 6.315 1.00 0.00 C ATOM 2433 CD2 LEU A 164 5.642 2.737 5.217 1.00 0.00 C ATOM 0 H LEU A 164 2.188 3.139 3.108 1.00 0.00 H new ATOM 0 HA LEU A 164 3.014 0.415 2.254 1.00 0.00 H new ATOM 0 HB2 LEU A 164 4.416 0.245 4.166 1.00 0.00 H new ATOM 0 HB3 LEU A 164 4.979 1.528 3.112 1.00 0.00 H new ATOM 0 HG LEU A 164 3.526 3.034 4.763 1.00 0.00 H new ATOM 0 HD11 LEU A 164 3.782 2.303 7.121 1.00 0.00 H new ATOM 0 HD12 LEU A 164 2.715 1.219 6.198 1.00 0.00 H new ATOM 0 HD13 LEU A 164 4.387 0.728 6.556 1.00 0.00 H new ATOM 0 HD21 LEU A 164 5.660 3.423 6.064 1.00 0.00 H new ATOM 0 HD22 LEU A 164 6.306 1.896 5.418 1.00 0.00 H new ATOM 0 HD23 LEU A 164 5.978 3.258 4.320 1.00 0.00 H new ATOM 2445 N GLY A 165 1.431 -0.524 4.069 1.00 0.00 N ATOM 2446 CA GLY A 165 0.238 -1.012 4.742 1.00 0.00 C ATOM 2447 C GLY A 165 0.366 -2.456 5.196 1.00 0.00 C ATOM 2448 O GLY A 165 1.354 -3.131 4.893 1.00 0.00 O ATOM 0 H GLY A 165 2.070 -1.261 3.771 1.00 0.00 H new ATOM 0 HA2 GLY A 165 0.031 -0.381 5.607 1.00 0.00 H new ATOM 0 HA3 GLY A 165 -0.615 -0.922 4.070 1.00 0.00 H new ATOM 2452 N VAL A 166 -0.666 -2.925 5.903 1.00 0.00 N ATOM 2453 CA VAL A 166 -0.760 -4.288 6.426 1.00 0.00 C ATOM 2454 C VAL A 166 -2.196 -4.798 6.298 1.00 0.00 C ATOM 2455 O VAL A 166 -3.128 -4.007 6.108 1.00 0.00 O ATOM 2456 CB VAL A 166 -0.275 -4.355 7.894 1.00 0.00 C ATOM 2457 CG1 VAL A 166 1.235 -4.103 8.011 1.00 0.00 C ATOM 2458 CG2 VAL A 166 -1.024 -3.382 8.823 1.00 0.00 C ATOM 0 H VAL A 166 -1.478 -2.352 6.132 1.00 0.00 H new ATOM 0 HA VAL A 166 -0.108 -4.933 5.837 1.00 0.00 H new ATOM 0 HB VAL A 166 -0.497 -5.371 8.220 1.00 0.00 H new ATOM 0 HG11 VAL A 166 1.533 -4.159 9.058 1.00 0.00 H new ATOM 0 HG12 VAL A 166 1.775 -4.857 7.439 1.00 0.00 H new ATOM 0 HG13 VAL A 166 1.470 -3.113 7.619 1.00 0.00 H new ATOM 0 HG21 VAL A 166 -0.638 -3.478 9.838 1.00 0.00 H new ATOM 0 HG22 VAL A 166 -0.878 -2.360 8.474 1.00 0.00 H new ATOM 0 HG23 VAL A 166 -2.088 -3.619 8.816 1.00 0.00 H new ATOM 2468 N SER A 167 -2.415 -6.111 6.415 1.00 0.00 N ATOM 2469 CA SER A 167 -3.736 -6.693 6.596 1.00 0.00 C ATOM 2470 C SER A 167 -3.639 -8.059 7.270 1.00 0.00 C ATOM 2471 O SER A 167 -2.582 -8.685 7.237 1.00 0.00 O ATOM 2472 CB SER A 167 -4.431 -6.799 5.233 1.00 0.00 C ATOM 2473 OG SER A 167 -4.734 -5.508 4.739 1.00 0.00 O ATOM 0 H SER A 167 -1.666 -6.803 6.386 1.00 0.00 H new ATOM 0 HA SER A 167 -4.327 -6.050 7.248 1.00 0.00 H new ATOM 0 HB2 SER A 167 -3.787 -7.325 4.528 1.00 0.00 H new ATOM 0 HB3 SER A 167 -5.346 -7.385 5.327 1.00 0.00 H new ATOM 0 HG SER A 167 -4.479 -4.835 5.404 1.00 0.00 H new ATOM 2479 N TYR A 168 -4.754 -8.523 7.839 1.00 0.00 N ATOM 2480 CA TYR A 168 -5.030 -9.917 8.153 1.00 0.00 C ATOM 2481 C TYR A 168 -5.952 -10.458 7.050 1.00 0.00 C ATOM 2482 O TYR A 168 -6.647 -9.688 6.376 1.00 0.00 O ATOM 2483 CB TYR A 168 -5.656 -10.024 9.555 1.00 0.00 C ATOM 2484 CG TYR A 168 -5.972 -11.448 9.985 1.00 0.00 C ATOM 2485 CD1 TYR A 168 -4.946 -12.300 10.440 1.00 0.00 C ATOM 2486 CD2 TYR A 168 -7.281 -11.949 9.853 1.00 0.00 C ATOM 2487 CE1 TYR A 168 -5.212 -13.659 10.690 1.00 0.00 C ATOM 2488 CE2 TYR A 168 -7.550 -13.309 10.092 1.00 0.00 C ATOM 2489 CZ TYR A 168 -6.507 -14.179 10.473 1.00 0.00 C ATOM 2490 OH TYR A 168 -6.733 -15.518 10.591 1.00 0.00 O ATOM 0 H TYR A 168 -5.521 -7.905 8.103 1.00 0.00 H new ATOM 0 HA TYR A 168 -4.119 -10.515 8.179 1.00 0.00 H new ATOM 0 HB2 TYR A 168 -4.975 -9.579 10.281 1.00 0.00 H new ATOM 0 HB3 TYR A 168 -6.574 -9.437 9.577 1.00 0.00 H new ATOM 0 HD1 TYR A 168 -3.952 -11.909 10.597 1.00 0.00 H new ATOM 0 HD2 TYR A 168 -8.083 -11.285 9.567 1.00 0.00 H new ATOM 0 HE1 TYR A 168 -4.425 -14.305 11.048 1.00 0.00 H new ATOM 0 HE2 TYR A 168 -8.556 -13.687 9.984 1.00 0.00 H new ATOM 0 HH TYR A 168 -7.677 -15.708 10.410 1.00 0.00 H new ATOM 2500 N ARG A 169 -5.936 -11.775 6.840 1.00 0.00 N ATOM 2501 CA ARG A 169 -6.646 -12.431 5.748 1.00 0.00 C ATOM 2502 C ARG A 169 -8.067 -12.848 6.115 1.00 0.00 C ATOM 2503 O ARG A 169 -8.373 -13.050 7.286 1.00 0.00 O ATOM 2504 CB ARG A 169 -5.864 -13.679 5.302 1.00 0.00 C ATOM 2505 CG ARG A 169 -6.005 -14.929 6.217 1.00 0.00 C ATOM 2506 CD ARG A 169 -5.575 -16.251 5.565 1.00 0.00 C ATOM 2507 NE ARG A 169 -6.237 -16.441 4.264 1.00 0.00 N ATOM 2508 CZ ARG A 169 -5.741 -16.092 3.067 1.00 0.00 C ATOM 2509 NH1 ARG A 169 -4.482 -15.679 2.910 1.00 0.00 N ATOM 2510 NH2 ARG A 169 -6.556 -16.105 2.015 1.00 0.00 N ATOM 0 H ARG A 169 -5.420 -12.424 7.435 1.00 0.00 H new ATOM 0 HA ARG A 169 -6.719 -11.700 4.943 1.00 0.00 H new ATOM 0 HB2 ARG A 169 -6.190 -13.949 4.297 1.00 0.00 H new ATOM 0 HB3 ARG A 169 -4.808 -13.418 5.235 1.00 0.00 H new ATOM 0 HG2 ARG A 169 -5.410 -14.773 7.117 1.00 0.00 H new ATOM 0 HG3 ARG A 169 -7.045 -15.016 6.533 1.00 0.00 H new ATOM 0 HD2 ARG A 169 -4.493 -16.259 5.431 1.00 0.00 H new ATOM 0 HD3 ARG A 169 -5.820 -17.082 6.226 1.00 0.00 H new ATOM 0 HE ARG A 169 -7.158 -16.879 4.273 1.00 0.00 H new ATOM 0 HH11 ARG A 169 -3.860 -15.620 3.716 1.00 0.00 H new ATOM 0 HH12 ARG A 169 -4.141 -15.422 1.984 1.00 0.00 H new ATOM 0 HH21 ARG A 169 -7.533 -16.376 2.130 1.00 0.00 H new ATOM 0 HH22 ARG A 169 -6.204 -15.844 1.094 1.00 0.00 H new ATOM 2524 N PHE A 170 -8.936 -13.047 5.120 1.00 0.00 N ATOM 2525 CA PHE A 170 -10.100 -13.885 5.378 1.00 0.00 C ATOM 2526 C PHE A 170 -9.561 -15.321 5.433 1.00 0.00 C ATOM 2527 O PHE A 170 -9.011 -15.827 4.445 1.00 0.00 O ATOM 2528 CB PHE A 170 -11.188 -13.729 4.317 1.00 0.00 C ATOM 2529 CG PHE A 170 -12.389 -14.620 4.587 1.00 0.00 C ATOM 2530 CD1 PHE A 170 -12.384 -15.967 4.171 1.00 0.00 C ATOM 2531 CD2 PHE A 170 -13.478 -14.127 5.331 1.00 0.00 C ATOM 2532 CE1 PHE A 170 -13.447 -16.818 4.521 1.00 0.00 C ATOM 2533 CE2 PHE A 170 -14.549 -14.975 5.666 1.00 0.00 C ATOM 2534 CZ PHE A 170 -14.529 -16.323 5.268 1.00 0.00 C ATOM 0 H PHE A 170 -8.862 -12.661 4.179 1.00 0.00 H new ATOM 0 HA PHE A 170 -10.588 -13.597 6.309 1.00 0.00 H new ATOM 0 HB2 PHE A 170 -11.511 -12.689 4.281 1.00 0.00 H new ATOM 0 HB3 PHE A 170 -10.774 -13.968 3.337 1.00 0.00 H new ATOM 0 HD1 PHE A 170 -11.562 -16.346 3.582 1.00 0.00 H new ATOM 0 HD2 PHE A 170 -13.491 -13.094 5.646 1.00 0.00 H new ATOM 0 HE1 PHE A 170 -13.432 -17.854 4.215 1.00 0.00 H new ATOM 0 HE2 PHE A 170 -15.387 -14.590 6.229 1.00 0.00 H new ATOM 0 HZ PHE A 170 -15.345 -16.978 5.536 1.00 0.00 H new