USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=22 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 12 LYS NZ :NH3+ -162:sc= 2.37 (180deg=0.452) USER MOD Set 1.2: A 167 SER OG : rot 156:sc= 1.81 USER MOD Set 2.1: A 161 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 163 SER OG : rot 180:sc= -0.0589 USER MOD Set 3.1: A 100 MET CE :methyl 168:sc= 0 (180deg=-0.0163) USER MOD Set 3.2: A 120 SER OG : rot -29:sc= 0.382 USER MOD Set 4.1: A 8 TYR OH : rot 180:sc= 0.639 USER MOD Set 4.2: A 44 GLN : amide:sc= 2.64 K(o=5.6,f=-2.5) USER MOD Set 4.3: A 82 LYS NZ :NH3+ -169:sc= 2.3 (180deg=1.54) USER MOD Single : A 5 ASN : amide:sc= 0.973 K(o=0.97,f=-3.4!) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 53:sc= 1.24 USER MOD Single : A 16 SER OG : rot -9:sc= 1.01 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 MET CE :methyl -175:sc= 0 (180deg=-0.0193) USER MOD Single : A 55 TYR OH : rot 63:sc= 0.502 USER MOD Single : A 78 GLN : amide:sc= -0.464 X(o=-0.46,f=-0.51) USER MOD Single : A 80 THR OG1 : rot 16:sc= 1.7 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 13:sc= 0.936 USER MOD Single : A 95 THR OG1 : rot 57:sc= 1.28 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 THR OG1 : rot -2:sc= 0.976 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= 0.574 K(o=0.57,f=-7.4!) USER MOD Single : A 168 TYR OH : rot -9:sc= 1.02 USER MOD ----------------------------------------------------------------- ATOM 59 N ASN A 5 -12.285 -15.546 -5.260 1.00 0.00 N ATOM 60 CA ASN A 5 -12.766 -14.946 -4.024 1.00 0.00 C ATOM 61 C ASN A 5 -11.670 -15.057 -2.962 1.00 0.00 C ATOM 62 O ASN A 5 -11.476 -16.112 -2.349 1.00 0.00 O ATOM 63 CB ASN A 5 -14.097 -15.578 -3.557 1.00 0.00 C ATOM 64 CG ASN A 5 -15.213 -14.540 -3.517 1.00 0.00 C ATOM 65 OD1 ASN A 5 -15.688 -14.155 -2.454 1.00 0.00 O ATOM 66 ND2 ASN A 5 -15.623 -14.042 -4.673 1.00 0.00 N ATOM 0 HA ASN A 5 -12.985 -13.892 -4.197 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -14.374 -16.389 -4.231 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -13.968 -16.016 -2.567 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -16.347 -13.324 -4.691 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -15.215 -14.376 -5.546 1.00 0.00 H new ATOM 73 N THR A 6 -10.939 -13.964 -2.744 1.00 0.00 N ATOM 74 CA THR A 6 -10.073 -13.779 -1.583 1.00 0.00 C ATOM 75 C THR A 6 -10.397 -12.410 -0.999 1.00 0.00 C ATOM 76 O THR A 6 -10.337 -11.415 -1.717 1.00 0.00 O ATOM 77 CB THR A 6 -8.589 -13.913 -1.965 1.00 0.00 C ATOM 78 OG1 THR A 6 -8.381 -15.116 -2.681 1.00 0.00 O ATOM 79 CG2 THR A 6 -7.705 -13.959 -0.715 1.00 0.00 C ATOM 0 H THR A 6 -10.933 -13.168 -3.382 1.00 0.00 H new ATOM 0 HA THR A 6 -10.253 -14.553 -0.837 1.00 0.00 H new ATOM 0 HB THR A 6 -8.327 -13.048 -2.574 1.00 0.00 H new ATOM 0 HG1 THR A 6 -7.434 -15.194 -2.922 1.00 0.00 H new ATOM 0 HG21 THR A 6 -6.660 -14.054 -1.011 1.00 0.00 H new ATOM 0 HG22 THR A 6 -7.838 -13.041 -0.142 1.00 0.00 H new ATOM 0 HG23 THR A 6 -7.987 -14.814 -0.101 1.00 0.00 H new ATOM 87 N TRP A 7 -10.794 -12.369 0.274 1.00 0.00 N ATOM 88 CA TRP A 7 -11.149 -11.143 0.977 1.00 0.00 C ATOM 89 C TRP A 7 -9.979 -10.743 1.879 1.00 0.00 C ATOM 90 O TRP A 7 -9.158 -11.585 2.253 1.00 0.00 O ATOM 91 CB TRP A 7 -12.431 -11.361 1.797 1.00 0.00 C ATOM 92 CG TRP A 7 -13.719 -11.563 1.047 1.00 0.00 C ATOM 93 CD1 TRP A 7 -13.911 -12.364 -0.027 1.00 0.00 C ATOM 94 CD2 TRP A 7 -15.036 -11.005 1.352 1.00 0.00 C ATOM 95 NE1 TRP A 7 -15.230 -12.324 -0.419 1.00 0.00 N ATOM 96 CE2 TRP A 7 -15.973 -11.492 0.392 1.00 0.00 C ATOM 97 CE3 TRP A 7 -15.536 -10.146 2.357 1.00 0.00 C ATOM 98 CZ2 TRP A 7 -17.328 -11.127 0.414 1.00 0.00 C ATOM 99 CZ3 TRP A 7 -16.896 -9.781 2.395 1.00 0.00 C ATOM 100 CH2 TRP A 7 -17.789 -10.264 1.422 1.00 0.00 C ATOM 0 H TRP A 7 -10.878 -13.205 0.853 1.00 0.00 H new ATOM 0 HA TRP A 7 -11.343 -10.341 0.265 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -12.276 -12.230 2.436 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -12.558 -10.501 2.455 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -13.141 -12.950 -0.507 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -15.610 -12.844 -1.210 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -14.863 -9.762 3.110 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -18.008 -11.505 -0.335 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -17.255 -9.127 3.176 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -18.828 -9.972 1.450 1.00 0.00 H new ATOM 111 N TYR A 8 -9.915 -9.462 2.242 1.00 0.00 N ATOM 112 CA TYR A 8 -8.873 -8.879 3.069 1.00 0.00 C ATOM 113 C TYR A 8 -9.477 -7.770 3.935 1.00 0.00 C ATOM 114 O TYR A 8 -10.497 -7.184 3.567 1.00 0.00 O ATOM 115 CB TYR A 8 -7.765 -8.261 2.192 1.00 0.00 C ATOM 116 CG TYR A 8 -7.069 -9.177 1.199 1.00 0.00 C ATOM 117 CD1 TYR A 8 -7.708 -9.527 -0.008 1.00 0.00 C ATOM 118 CD2 TYR A 8 -5.758 -9.630 1.448 1.00 0.00 C ATOM 119 CE1 TYR A 8 -7.059 -10.346 -0.944 1.00 0.00 C ATOM 120 CE2 TYR A 8 -5.084 -10.415 0.495 1.00 0.00 C ATOM 121 CZ TYR A 8 -5.735 -10.777 -0.708 1.00 0.00 C ATOM 122 OH TYR A 8 -5.098 -11.533 -1.648 1.00 0.00 O ATOM 0 H TYR A 8 -10.617 -8.781 1.954 1.00 0.00 H new ATOM 0 HA TYR A 8 -8.445 -9.665 3.691 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -8.199 -7.429 1.637 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -7.006 -7.842 2.853 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -8.704 -9.162 -0.213 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -5.268 -9.373 2.376 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -7.572 -10.647 -1.845 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -4.071 -10.741 0.681 1.00 0.00 H new ATOM 0 HH TYR A 8 -4.194 -11.748 -1.337 1.00 0.00 H new ATOM 132 N THR A 9 -8.804 -7.405 5.027 1.00 0.00 N ATOM 133 CA THR A 9 -8.990 -6.122 5.706 1.00 0.00 C ATOM 134 C THR A 9 -7.663 -5.727 6.358 1.00 0.00 C ATOM 135 O THR A 9 -6.793 -6.576 6.520 1.00 0.00 O ATOM 136 CB THR A 9 -10.183 -6.195 6.685 1.00 0.00 C ATOM 137 OG1 THR A 9 -10.431 -4.944 7.296 1.00 0.00 O ATOM 138 CG2 THR A 9 -10.000 -7.240 7.795 1.00 0.00 C ATOM 0 H THR A 9 -8.105 -8.000 5.471 1.00 0.00 H new ATOM 0 HA THR A 9 -9.253 -5.334 5.001 1.00 0.00 H new ATOM 0 HB THR A 9 -11.031 -6.493 6.068 1.00 0.00 H new ATOM 0 HG1 THR A 9 -10.524 -4.255 6.605 1.00 0.00 H new ATOM 0 HG21 THR A 9 -10.875 -7.237 8.445 1.00 0.00 H new ATOM 0 HG22 THR A 9 -9.883 -8.228 7.349 1.00 0.00 H new ATOM 0 HG23 THR A 9 -9.112 -6.998 8.380 1.00 0.00 H new ATOM 146 N GLY A 10 -7.463 -4.457 6.713 1.00 0.00 N ATOM 147 CA GLY A 10 -6.196 -4.001 7.268 1.00 0.00 C ATOM 148 C GLY A 10 -6.115 -2.484 7.246 1.00 0.00 C ATOM 149 O GLY A 10 -7.144 -1.815 7.310 1.00 0.00 O ATOM 0 H GLY A 10 -8.168 -3.726 6.624 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -6.091 -4.361 8.291 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -5.370 -4.423 6.696 1.00 0.00 H new ATOM 153 N ALA A 11 -4.898 -1.941 7.150 1.00 0.00 N ATOM 154 CA ALA A 11 -4.661 -0.502 7.148 1.00 0.00 C ATOM 155 C ALA A 11 -3.684 -0.122 6.040 1.00 0.00 C ATOM 156 O ALA A 11 -2.920 -0.965 5.553 1.00 0.00 O ATOM 157 CB ALA A 11 -4.143 -0.062 8.522 1.00 0.00 C ATOM 0 H ALA A 11 -4.046 -2.496 7.071 1.00 0.00 H new ATOM 0 HA ALA A 11 -5.599 0.016 6.951 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -3.967 1.014 8.517 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -4.883 -0.305 9.285 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -3.210 -0.581 8.743 1.00 0.00 H new ATOM 163 N LYS A 12 -3.716 1.151 5.643 1.00 0.00 N ATOM 164 CA LYS A 12 -2.747 1.753 4.741 1.00 0.00 C ATOM 165 C LYS A 12 -2.380 3.126 5.296 1.00 0.00 C ATOM 166 O LYS A 12 -3.190 3.765 5.970 1.00 0.00 O ATOM 167 CB LYS A 12 -3.277 1.834 3.293 1.00 0.00 C ATOM 168 CG LYS A 12 -3.342 0.470 2.576 1.00 0.00 C ATOM 169 CD LYS A 12 -4.686 -0.267 2.699 1.00 0.00 C ATOM 170 CE LYS A 12 -4.527 -1.770 2.427 1.00 0.00 C ATOM 171 NZ LYS A 12 -4.185 -2.544 3.643 1.00 0.00 N ATOM 0 H LYS A 12 -4.437 1.804 5.951 1.00 0.00 H new ATOM 0 HA LYS A 12 -1.855 1.129 4.687 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -4.274 2.275 3.305 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -2.638 2.505 2.719 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -3.124 0.622 1.519 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -2.556 -0.171 2.975 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -5.095 -0.118 3.698 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -5.402 0.158 1.995 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -5.454 -2.158 2.005 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -3.749 -1.918 1.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -3.796 -3.469 3.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -3.477 -2.022 4.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -5.041 -2.685 4.217 1.00 0.00 H new ATOM 185 N LEU A 13 -1.154 3.566 5.024 1.00 0.00 N ATOM 186 CA LEU A 13 -0.624 4.875 5.369 1.00 0.00 C ATOM 187 C LEU A 13 0.148 5.401 4.166 1.00 0.00 C ATOM 188 O LEU A 13 0.503 4.637 3.270 1.00 0.00 O ATOM 189 CB LEU A 13 0.271 4.834 6.625 1.00 0.00 C ATOM 190 CG LEU A 13 -0.475 4.501 7.936 1.00 0.00 C ATOM 191 CD1 LEU A 13 -0.422 2.999 8.264 1.00 0.00 C ATOM 192 CD2 LEU A 13 0.134 5.279 9.109 1.00 0.00 C ATOM 0 H LEU A 13 -0.472 2.988 4.533 1.00 0.00 H new ATOM 0 HA LEU A 13 -1.451 5.541 5.613 1.00 0.00 H new ATOM 0 HB2 LEU A 13 1.056 4.094 6.471 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.762 5.801 6.737 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.516 4.790 7.789 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -0.959 2.810 9.194 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -0.886 2.434 7.456 1.00 0.00 H new ATOM 0 HD13 LEU A 13 0.617 2.687 8.375 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -0.402 5.034 10.026 1.00 0.00 H new ATOM 0 HD22 LEU A 13 1.184 5.008 9.219 1.00 0.00 H new ATOM 0 HD23 LEU A 13 0.054 6.349 8.917 1.00 0.00 H new ATOM 204 N GLY A 14 0.407 6.703 4.146 1.00 0.00 N ATOM 205 CA GLY A 14 0.947 7.402 2.995 1.00 0.00 C ATOM 206 C GLY A 14 2.125 8.285 3.364 1.00 0.00 C ATOM 207 O GLY A 14 2.231 8.694 4.524 1.00 0.00 O ATOM 0 H GLY A 14 0.243 7.311 4.948 1.00 0.00 H new ATOM 0 HA2 GLY A 14 1.260 6.676 2.245 1.00 0.00 H new ATOM 0 HA3 GLY A 14 0.165 8.012 2.542 1.00 0.00 H new ATOM 211 N PHE A 15 2.976 8.603 2.382 1.00 0.00 N ATOM 212 CA PHE A 15 4.025 9.600 2.483 1.00 0.00 C ATOM 213 C PHE A 15 4.202 10.346 1.152 1.00 0.00 C ATOM 214 O PHE A 15 4.058 9.789 0.056 1.00 0.00 O ATOM 215 CB PHE A 15 5.335 8.929 2.925 1.00 0.00 C ATOM 216 CG PHE A 15 6.489 9.899 3.094 1.00 0.00 C ATOM 217 CD1 PHE A 15 6.453 10.859 4.124 1.00 0.00 C ATOM 218 CD2 PHE A 15 7.567 9.887 2.188 1.00 0.00 C ATOM 219 CE1 PHE A 15 7.485 11.805 4.243 1.00 0.00 C ATOM 220 CE2 PHE A 15 8.602 10.831 2.312 1.00 0.00 C ATOM 221 CZ PHE A 15 8.561 11.792 3.338 1.00 0.00 C ATOM 0 H PHE A 15 2.945 8.153 1.467 1.00 0.00 H new ATOM 0 HA PHE A 15 3.742 10.338 3.233 1.00 0.00 H new ATOM 0 HB2 PHE A 15 5.167 8.410 3.869 1.00 0.00 H new ATOM 0 HB3 PHE A 15 5.612 8.173 2.190 1.00 0.00 H new ATOM 0 HD1 PHE A 15 5.630 10.868 4.824 1.00 0.00 H new ATOM 0 HD2 PHE A 15 7.599 9.152 1.397 1.00 0.00 H new ATOM 0 HE1 PHE A 15 7.452 12.543 5.031 1.00 0.00 H new ATOM 0 HE2 PHE A 15 9.430 10.818 1.618 1.00 0.00 H new ATOM 0 HZ PHE A 15 9.355 12.519 3.431 1.00 0.00 H new ATOM 231 N SER A 16 4.669 11.594 1.254 1.00 0.00 N ATOM 232 CA SER A 16 5.050 12.494 0.172 1.00 0.00 C ATOM 233 C SER A 16 3.838 12.938 -0.662 1.00 0.00 C ATOM 234 O SER A 16 2.860 13.432 -0.100 1.00 0.00 O ATOM 235 CB SER A 16 6.261 11.938 -0.607 1.00 0.00 C ATOM 236 OG SER A 16 5.934 10.767 -1.324 1.00 0.00 O ATOM 0 H SER A 16 4.799 12.030 2.167 1.00 0.00 H new ATOM 0 HA SER A 16 5.412 13.434 0.589 1.00 0.00 H new ATOM 0 HB2 SER A 16 6.627 12.697 -1.299 1.00 0.00 H new ATOM 0 HB3 SER A 16 7.072 11.723 0.089 1.00 0.00 H new ATOM 0 HG SER A 16 5.039 10.464 -1.065 1.00 0.00 H new ATOM 509 N LEU A 35 1.730 13.082 4.151 1.00 0.00 N ATOM 510 CA LEU A 35 1.483 11.752 4.700 1.00 0.00 C ATOM 511 C LEU A 35 0.005 11.393 4.561 1.00 0.00 C ATOM 512 O LEU A 35 -0.807 12.280 4.313 1.00 0.00 O ATOM 513 CB LEU A 35 1.996 11.633 6.157 1.00 0.00 C ATOM 514 CG LEU A 35 1.241 12.325 7.320 1.00 0.00 C ATOM 515 CD1 LEU A 35 0.973 13.818 7.097 1.00 0.00 C ATOM 516 CD2 LEU A 35 -0.059 11.623 7.741 1.00 0.00 C ATOM 0 HA LEU A 35 2.052 11.023 4.124 1.00 0.00 H new ATOM 0 HB2 LEU A 35 2.045 10.570 6.394 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.019 12.010 6.169 1.00 0.00 H new ATOM 0 HG LEU A 35 1.948 12.232 8.144 1.00 0.00 H new ATOM 0 HD11 LEU A 35 0.441 14.225 7.957 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.920 14.343 6.974 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.367 13.949 6.201 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -0.521 12.174 8.560 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -0.744 11.588 6.894 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.165 10.608 8.068 1.00 0.00 H new ATOM 528 N GLY A 36 -0.356 10.125 4.784 1.00 0.00 N ATOM 529 CA GLY A 36 -1.745 9.665 4.771 1.00 0.00 C ATOM 530 C GLY A 36 -1.985 8.527 5.763 1.00 0.00 C ATOM 531 O GLY A 36 -1.023 7.931 6.255 1.00 0.00 O ATOM 0 H GLY A 36 0.316 9.383 4.980 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -2.405 10.499 5.011 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -2.006 9.331 3.767 1.00 0.00 H new ATOM 535 N ALA A 37 -3.258 8.195 6.022 1.00 0.00 N ATOM 536 CA ALA A 37 -3.695 7.043 6.811 1.00 0.00 C ATOM 537 C ALA A 37 -5.126 6.647 6.418 1.00 0.00 C ATOM 538 O ALA A 37 -5.902 7.511 6.006 1.00 0.00 O ATOM 539 CB ALA A 37 -3.643 7.390 8.305 1.00 0.00 C ATOM 0 H ALA A 37 -4.041 8.747 5.671 1.00 0.00 H new ATOM 0 HA ALA A 37 -3.029 6.203 6.613 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -3.969 6.530 8.890 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -2.622 7.651 8.582 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -4.301 8.235 8.505 1.00 0.00 H new ATOM 545 N GLY A 38 -5.481 5.367 6.600 1.00 0.00 N ATOM 546 CA GLY A 38 -6.845 4.851 6.526 1.00 0.00 C ATOM 547 C GLY A 38 -6.893 3.354 6.865 1.00 0.00 C ATOM 548 O GLY A 38 -5.870 2.665 6.819 1.00 0.00 O ATOM 0 H GLY A 38 -4.797 4.640 6.810 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -7.483 5.403 7.216 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -7.244 5.012 5.524 1.00 0.00 H new ATOM 552 N ALA A 39 -8.091 2.841 7.167 1.00 0.00 N ATOM 553 CA ALA A 39 -8.375 1.437 7.467 1.00 0.00 C ATOM 554 C ALA A 39 -9.294 0.882 6.377 1.00 0.00 C ATOM 555 O ALA A 39 -10.180 1.594 5.912 1.00 0.00 O ATOM 556 CB ALA A 39 -9.016 1.330 8.853 1.00 0.00 C ATOM 0 H ALA A 39 -8.927 3.423 7.210 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.456 0.851 7.480 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -9.227 0.284 9.076 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -8.332 1.730 9.602 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -9.945 1.900 8.869 1.00 0.00 H new ATOM 562 N PHE A 40 -9.069 -0.364 5.943 1.00 0.00 N ATOM 563 CA PHE A 40 -9.540 -0.875 4.656 1.00 0.00 C ATOM 564 C PHE A 40 -10.172 -2.267 4.750 1.00 0.00 C ATOM 565 O PHE A 40 -9.857 -3.059 5.644 1.00 0.00 O ATOM 566 CB PHE A 40 -8.358 -0.910 3.667 1.00 0.00 C ATOM 567 CG PHE A 40 -8.046 0.405 2.973 1.00 0.00 C ATOM 568 CD1 PHE A 40 -7.417 1.458 3.666 1.00 0.00 C ATOM 569 CD2 PHE A 40 -8.344 0.558 1.604 1.00 0.00 C ATOM 570 CE1 PHE A 40 -7.099 2.654 2.999 1.00 0.00 C ATOM 571 CE2 PHE A 40 -8.015 1.749 0.934 1.00 0.00 C ATOM 572 CZ PHE A 40 -7.389 2.795 1.632 1.00 0.00 C ATOM 0 H PHE A 40 -8.547 -1.053 6.485 1.00 0.00 H new ATOM 0 HA PHE A 40 -10.323 -0.201 4.309 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -7.468 -1.238 4.204 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -8.566 -1.662 2.906 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -7.178 1.346 4.713 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -8.828 -0.244 1.067 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -6.631 3.465 3.538 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -8.243 1.860 -0.116 1.00 0.00 H new ATOM 0 HZ PHE A 40 -7.130 3.708 1.117 1.00 0.00 H new ATOM 582 N GLY A 41 -10.990 -2.584 3.741 1.00 0.00 N ATOM 583 CA GLY A 41 -11.424 -3.915 3.342 1.00 0.00 C ATOM 584 C GLY A 41 -11.056 -4.105 1.870 1.00 0.00 C ATOM 585 O GLY A 41 -11.133 -3.148 1.095 1.00 0.00 O ATOM 0 H GLY A 41 -11.391 -1.862 3.143 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -10.942 -4.674 3.957 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -12.499 -4.025 3.484 1.00 0.00 H new ATOM 589 N GLY A 42 -10.650 -5.315 1.478 1.00 0.00 N ATOM 590 CA GLY A 42 -10.125 -5.609 0.149 1.00 0.00 C ATOM 591 C GLY A 42 -10.616 -6.951 -0.377 1.00 0.00 C ATOM 592 O GLY A 42 -11.075 -7.798 0.390 1.00 0.00 O ATOM 0 H GLY A 42 -10.679 -6.131 2.089 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -10.422 -4.819 -0.541 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -9.036 -5.610 0.182 1.00 0.00 H new ATOM 596 N TYR A 43 -10.512 -7.136 -1.695 1.00 0.00 N ATOM 597 CA TYR A 43 -11.070 -8.261 -2.427 1.00 0.00 C ATOM 598 C TYR A 43 -10.192 -8.577 -3.637 1.00 0.00 C ATOM 599 O TYR A 43 -9.714 -7.660 -4.305 1.00 0.00 O ATOM 600 CB TYR A 43 -12.478 -7.901 -2.939 1.00 0.00 C ATOM 601 CG TYR A 43 -13.413 -7.294 -1.908 1.00 0.00 C ATOM 602 CD1 TYR A 43 -14.234 -8.122 -1.119 1.00 0.00 C ATOM 603 CD2 TYR A 43 -13.436 -5.896 -1.721 1.00 0.00 C ATOM 604 CE1 TYR A 43 -15.077 -7.556 -0.147 1.00 0.00 C ATOM 605 CE2 TYR A 43 -14.262 -5.326 -0.738 1.00 0.00 C ATOM 606 CZ TYR A 43 -15.088 -6.155 0.053 1.00 0.00 C ATOM 607 OH TYR A 43 -15.890 -5.598 1.003 1.00 0.00 O ATOM 0 H TYR A 43 -10.018 -6.479 -2.298 1.00 0.00 H new ATOM 0 HA TYR A 43 -11.118 -9.122 -1.760 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -12.376 -7.201 -3.768 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -12.942 -8.803 -3.338 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -14.216 -9.193 -1.261 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -12.816 -5.261 -2.336 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -15.717 -8.191 0.448 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -14.265 -4.257 -0.587 1.00 0.00 H new ATOM 0 HH TYR A 43 -15.769 -4.625 1.004 1.00 0.00 H new ATOM 617 N GLN A 44 -10.055 -9.859 -3.970 1.00 0.00 N ATOM 618 CA GLN A 44 -9.659 -10.364 -5.279 1.00 0.00 C ATOM 619 C GLN A 44 -10.803 -11.270 -5.715 1.00 0.00 C ATOM 620 O GLN A 44 -11.206 -12.154 -4.951 1.00 0.00 O ATOM 621 CB GLN A 44 -8.293 -11.059 -5.250 1.00 0.00 C ATOM 622 CG GLN A 44 -7.200 -10.044 -4.895 1.00 0.00 C ATOM 623 CD GLN A 44 -5.818 -10.474 -5.365 1.00 0.00 C ATOM 624 OE1 GLN A 44 -5.511 -10.357 -6.546 1.00 0.00 O ATOM 625 NE2 GLN A 44 -4.923 -10.861 -4.473 1.00 0.00 N ATOM 0 H GLN A 44 -10.226 -10.609 -3.300 1.00 0.00 H new ATOM 0 HA GLN A 44 -9.508 -9.561 -6.000 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -8.302 -11.868 -4.519 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -8.083 -11.509 -6.221 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -7.447 -9.081 -5.341 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -7.182 -9.899 -3.815 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -5.188 -10.955 -3.493 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -3.967 -11.065 -4.765 1.00 0.00 H new ATOM 634 N VAL A 45 -11.383 -10.972 -6.883 1.00 0.00 N ATOM 635 CA VAL A 45 -12.734 -11.421 -7.231 1.00 0.00 C ATOM 636 C VAL A 45 -12.891 -11.780 -8.717 1.00 0.00 C ATOM 637 O VAL A 45 -13.963 -12.215 -9.136 1.00 0.00 O ATOM 638 CB VAL A 45 -13.723 -10.330 -6.750 1.00 0.00 C ATOM 639 CG1 VAL A 45 -13.666 -9.056 -7.609 1.00 0.00 C ATOM 640 CG2 VAL A 45 -15.173 -10.820 -6.640 1.00 0.00 C ATOM 0 H VAL A 45 -10.932 -10.416 -7.609 1.00 0.00 H new ATOM 0 HA VAL A 45 -12.953 -12.361 -6.724 1.00 0.00 H new ATOM 0 HB VAL A 45 -13.383 -10.084 -5.744 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -14.380 -8.327 -7.226 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -12.661 -8.636 -7.570 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -13.917 -9.301 -8.641 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -15.808 -10.003 -6.298 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -15.516 -11.162 -7.616 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -15.226 -11.643 -5.928 1.00 0.00 H new ATOM 699 N VAL A 49 -7.799 -9.673 -10.930 1.00 0.00 N ATOM 700 CA VAL A 49 -8.521 -8.420 -10.701 1.00 0.00 C ATOM 701 C VAL A 49 -9.116 -8.419 -9.287 1.00 0.00 C ATOM 702 O VAL A 49 -9.671 -9.417 -8.808 1.00 0.00 O ATOM 703 CB VAL A 49 -9.582 -8.198 -11.803 1.00 0.00 C ATOM 704 CG1 VAL A 49 -10.429 -6.935 -11.565 1.00 0.00 C ATOM 705 CG2 VAL A 49 -8.932 -8.065 -13.191 1.00 0.00 C ATOM 0 HA VAL A 49 -7.833 -7.577 -10.763 1.00 0.00 H new ATOM 0 HB VAL A 49 -10.225 -9.077 -11.763 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -11.157 -6.829 -12.369 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -10.951 -7.021 -10.612 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -9.780 -6.060 -11.546 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -9.707 -7.910 -13.942 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -8.249 -7.215 -13.193 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -8.379 -8.975 -13.423 1.00 0.00 H new ATOM 715 N GLY A 50 -9.012 -7.265 -8.622 1.00 0.00 N ATOM 716 CA GLY A 50 -9.475 -7.068 -7.261 1.00 0.00 C ATOM 717 C GLY A 50 -9.899 -5.628 -7.011 1.00 0.00 C ATOM 718 O GLY A 50 -9.840 -4.787 -7.906 1.00 0.00 O ATOM 0 H GLY A 50 -8.594 -6.429 -9.030 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -10.315 -7.734 -7.063 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -8.682 -7.340 -6.564 1.00 0.00 H new ATOM 722 N PHE A 51 -10.331 -5.353 -5.782 1.00 0.00 N ATOM 723 CA PHE A 51 -10.814 -4.058 -5.325 1.00 0.00 C ATOM 724 C PHE A 51 -10.405 -3.866 -3.870 1.00 0.00 C ATOM 725 O PHE A 51 -10.118 -4.842 -3.176 1.00 0.00 O ATOM 726 CB PHE A 51 -12.347 -3.992 -5.446 1.00 0.00 C ATOM 727 CG PHE A 51 -12.891 -4.116 -6.857 1.00 0.00 C ATOM 728 CD1 PHE A 51 -13.162 -5.386 -7.401 1.00 0.00 C ATOM 729 CD2 PHE A 51 -13.132 -2.962 -7.626 1.00 0.00 C ATOM 730 CE1 PHE A 51 -13.655 -5.505 -8.713 1.00 0.00 C ATOM 731 CE2 PHE A 51 -13.638 -3.081 -8.933 1.00 0.00 C ATOM 732 CZ PHE A 51 -13.895 -4.351 -9.479 1.00 0.00 C ATOM 0 H PHE A 51 -10.354 -6.060 -5.047 1.00 0.00 H new ATOM 0 HA PHE A 51 -10.381 -3.269 -5.940 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -12.778 -4.787 -4.837 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -12.688 -3.047 -5.024 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -12.991 -6.273 -6.808 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -12.928 -1.985 -7.213 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -13.849 -6.482 -9.131 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -13.830 -2.194 -9.519 1.00 0.00 H new ATOM 0 HZ PHE A 51 -14.276 -4.440 -10.486 1.00 0.00 H new ATOM 742 N GLU A 52 -10.451 -2.627 -3.382 1.00 0.00 N ATOM 743 CA GLU A 52 -10.449 -2.335 -1.956 1.00 0.00 C ATOM 744 C GLU A 52 -11.183 -1.018 -1.718 1.00 0.00 C ATOM 745 O GLU A 52 -11.344 -0.211 -2.634 1.00 0.00 O ATOM 746 CB GLU A 52 -9.017 -2.348 -1.369 1.00 0.00 C ATOM 747 CG GLU A 52 -8.084 -1.289 -1.975 1.00 0.00 C ATOM 748 CD GLU A 52 -6.632 -1.347 -1.492 1.00 0.00 C ATOM 749 OE1 GLU A 52 -6.298 -2.193 -0.631 1.00 0.00 O ATOM 750 OE2 GLU A 52 -5.807 -0.553 -2.012 1.00 0.00 O ATOM 0 H GLU A 52 -10.491 -1.795 -3.971 1.00 0.00 H new ATOM 0 HA GLU A 52 -10.982 -3.121 -1.421 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -9.075 -2.192 -0.292 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -8.580 -3.334 -1.525 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -8.094 -1.397 -3.060 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -8.486 -0.301 -1.749 1.00 0.00 H new ATOM 757 N MET A 53 -11.633 -0.805 -0.484 1.00 0.00 N ATOM 758 CA MET A 53 -12.238 0.435 -0.019 1.00 0.00 C ATOM 759 C MET A 53 -11.787 0.645 1.421 1.00 0.00 C ATOM 760 O MET A 53 -11.447 -0.324 2.106 1.00 0.00 O ATOM 761 CB MET A 53 -13.772 0.359 -0.100 1.00 0.00 C ATOM 762 CG MET A 53 -14.294 0.328 -1.542 1.00 0.00 C ATOM 763 SD MET A 53 -16.099 0.240 -1.699 1.00 0.00 S ATOM 764 CE MET A 53 -16.385 -1.484 -1.214 1.00 0.00 C ATOM 0 H MET A 53 -11.583 -1.518 0.244 1.00 0.00 H new ATOM 0 HA MET A 53 -11.925 1.270 -0.646 1.00 0.00 H new ATOM 0 HB2 MET A 53 -14.114 -0.533 0.424 1.00 0.00 H new ATOM 0 HB3 MET A 53 -14.201 1.217 0.418 1.00 0.00 H new ATOM 0 HG2 MET A 53 -13.942 1.220 -2.060 1.00 0.00 H new ATOM 0 HG3 MET A 53 -13.857 -0.530 -2.053 1.00 0.00 H new ATOM 0 HE1 MET A 53 -17.440 -1.728 -1.342 1.00 0.00 H new ATOM 0 HE2 MET A 53 -15.782 -2.143 -1.839 1.00 0.00 H new ATOM 0 HE3 MET A 53 -16.106 -1.619 -0.169 1.00 0.00 H new ATOM 774 N GLY A 54 -11.799 1.891 1.892 1.00 0.00 N ATOM 775 CA GLY A 54 -11.362 2.205 3.239 1.00 0.00 C ATOM 776 C GLY A 54 -11.982 3.483 3.770 1.00 0.00 C ATOM 777 O GLY A 54 -12.637 4.219 3.027 1.00 0.00 O ATOM 0 H GLY A 54 -12.109 2.699 1.352 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -11.618 1.379 3.902 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -10.276 2.300 3.252 1.00 0.00 H new ATOM 781 N TYR A 55 -11.774 3.723 5.066 1.00 0.00 N ATOM 782 CA TYR A 55 -12.205 4.921 5.758 1.00 0.00 C ATOM 783 C TYR A 55 -11.136 5.357 6.770 1.00 0.00 C ATOM 784 O TYR A 55 -10.316 4.554 7.218 1.00 0.00 O ATOM 785 CB TYR A 55 -13.580 4.691 6.420 1.00 0.00 C ATOM 786 CG TYR A 55 -14.500 5.896 6.326 1.00 0.00 C ATOM 787 CD1 TYR A 55 -14.340 6.986 7.203 1.00 0.00 C ATOM 788 CD2 TYR A 55 -15.486 5.954 5.323 1.00 0.00 C ATOM 789 CE1 TYR A 55 -15.083 8.162 7.018 1.00 0.00 C ATOM 790 CE2 TYR A 55 -16.279 7.106 5.170 1.00 0.00 C ATOM 791 CZ TYR A 55 -16.047 8.233 5.991 1.00 0.00 C ATOM 792 OH TYR A 55 -16.726 9.396 5.778 1.00 0.00 O ATOM 0 H TYR A 55 -11.286 3.065 5.673 1.00 0.00 H new ATOM 0 HA TYR A 55 -12.326 5.733 5.041 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -14.064 3.835 5.949 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -13.432 4.436 7.469 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -13.641 6.916 8.023 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -15.635 5.109 4.667 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -14.917 9.013 7.662 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -17.063 7.129 4.427 1.00 0.00 H new ATOM 0 HH TYR A 55 -16.096 10.099 5.515 1.00 0.00 H new ATOM 1108 N GLY A 76 -14.140 10.924 5.044 1.00 0.00 N ATOM 1109 CA GLY A 76 -12.821 10.321 4.884 1.00 0.00 C ATOM 1110 C GLY A 76 -12.847 8.928 4.279 1.00 0.00 C ATOM 1111 O GLY A 76 -12.298 8.025 4.905 1.00 0.00 O ATOM 0 HA2 GLY A 76 -12.211 10.968 4.254 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -12.334 10.274 5.858 1.00 0.00 H new ATOM 1115 N VAL A 77 -13.425 8.750 3.080 1.00 0.00 N ATOM 1116 CA VAL A 77 -13.490 7.450 2.398 1.00 0.00 C ATOM 1117 C VAL A 77 -12.382 7.330 1.336 1.00 0.00 C ATOM 1118 O VAL A 77 -11.876 8.338 0.826 1.00 0.00 O ATOM 1119 CB VAL A 77 -14.916 7.209 1.842 1.00 0.00 C ATOM 1120 CG1 VAL A 77 -15.301 8.123 0.675 1.00 0.00 C ATOM 1121 CG2 VAL A 77 -15.175 5.751 1.437 1.00 0.00 C ATOM 0 H VAL A 77 -13.862 9.508 2.555 1.00 0.00 H new ATOM 0 HA VAL A 77 -13.298 6.652 3.115 1.00 0.00 H new ATOM 0 HB VAL A 77 -15.552 7.460 2.691 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -16.313 7.887 0.347 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -15.257 9.163 0.998 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -14.607 7.970 -0.151 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -16.192 5.654 1.057 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -14.468 5.458 0.661 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -15.049 5.104 2.305 1.00 0.00 H new ATOM 1131 N GLN A 78 -11.999 6.090 1.015 1.00 0.00 N ATOM 1132 CA GLN A 78 -11.040 5.707 -0.016 1.00 0.00 C ATOM 1133 C GLN A 78 -11.643 4.552 -0.825 1.00 0.00 C ATOM 1134 O GLN A 78 -12.364 3.726 -0.258 1.00 0.00 O ATOM 1135 CB GLN A 78 -9.712 5.244 0.617 1.00 0.00 C ATOM 1136 CG GLN A 78 -8.973 6.285 1.477 1.00 0.00 C ATOM 1137 CD GLN A 78 -9.510 6.394 2.906 1.00 0.00 C ATOM 1138 OE1 GLN A 78 -9.400 5.467 3.700 1.00 0.00 O ATOM 1139 NE2 GLN A 78 -10.094 7.534 3.248 1.00 0.00 N ATOM 0 H GLN A 78 -12.377 5.278 1.502 1.00 0.00 H new ATOM 0 HA GLN A 78 -10.835 6.565 -0.656 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -9.913 4.369 1.235 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -9.044 4.923 -0.183 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -7.915 6.027 1.515 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -9.047 7.260 0.995 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -10.173 8.291 2.568 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -10.464 7.655 4.191 1.00 0.00 H new ATOM 1148 N LEU A 79 -11.323 4.457 -2.123 1.00 0.00 N ATOM 1149 CA LEU A 79 -11.775 3.377 -3.007 1.00 0.00 C ATOM 1150 C LEU A 79 -10.680 2.990 -4.002 1.00 0.00 C ATOM 1151 O LEU A 79 -9.810 3.806 -4.324 1.00 0.00 O ATOM 1152 CB LEU A 79 -13.085 3.786 -3.711 1.00 0.00 C ATOM 1153 CG LEU A 79 -12.950 4.939 -4.735 1.00 0.00 C ATOM 1154 CD1 LEU A 79 -12.760 4.421 -6.170 1.00 0.00 C ATOM 1155 CD2 LEU A 79 -14.198 5.830 -4.701 1.00 0.00 C ATOM 0 H LEU A 79 -10.732 5.141 -2.595 1.00 0.00 H new ATOM 0 HA LEU A 79 -11.982 2.490 -2.409 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -13.492 2.913 -4.222 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -13.811 4.078 -2.952 1.00 0.00 H new ATOM 0 HG LEU A 79 -12.065 5.509 -4.451 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -12.670 5.266 -6.853 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -11.855 3.815 -6.221 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -13.620 3.814 -6.455 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -14.089 6.637 -5.426 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -15.077 5.235 -4.949 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -14.316 6.253 -3.703 1.00 0.00 H new ATOM 1167 N THR A 80 -10.669 1.736 -4.465 1.00 0.00 N ATOM 1168 CA THR A 80 -9.734 1.227 -5.463 1.00 0.00 C ATOM 1169 C THR A 80 -10.292 0.012 -6.221 1.00 0.00 C ATOM 1170 O THR A 80 -11.015 -0.807 -5.650 1.00 0.00 O ATOM 1171 CB THR A 80 -8.432 0.905 -4.712 1.00 0.00 C ATOM 1172 OG1 THR A 80 -7.735 2.115 -4.504 1.00 0.00 O ATOM 1173 CG2 THR A 80 -7.490 -0.081 -5.405 1.00 0.00 C ATOM 0 H THR A 80 -11.331 1.030 -4.144 1.00 0.00 H new ATOM 0 HA THR A 80 -9.555 1.971 -6.239 1.00 0.00 H new ATOM 0 HB THR A 80 -8.737 0.414 -3.788 1.00 0.00 H new ATOM 0 HG1 THR A 80 -8.340 2.871 -4.655 1.00 0.00 H new ATOM 0 HG21 THR A 80 -6.605 -0.234 -4.787 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.001 -1.033 -5.549 1.00 0.00 H new ATOM 0 HG23 THR A 80 -7.191 0.321 -6.373 1.00 0.00 H new ATOM 1181 N ALA A 81 -9.830 -0.157 -7.466 1.00 0.00 N ATOM 1182 CA ALA A 81 -9.826 -1.381 -8.257 1.00 0.00 C ATOM 1183 C ALA A 81 -8.365 -1.664 -8.638 1.00 0.00 C ATOM 1184 O ALA A 81 -7.661 -0.734 -9.037 1.00 0.00 O ATOM 1185 CB ALA A 81 -10.689 -1.183 -9.507 1.00 0.00 C ATOM 0 H ALA A 81 -9.419 0.622 -7.981 1.00 0.00 H new ATOM 0 HA ALA A 81 -10.238 -2.222 -7.699 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -10.687 -2.098 -10.099 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -11.711 -0.946 -9.210 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -10.285 -0.364 -10.102 1.00 0.00 H new ATOM 1191 N LYS A 82 -7.902 -2.918 -8.534 1.00 0.00 N ATOM 1192 CA LYS A 82 -6.550 -3.327 -8.925 1.00 0.00 C ATOM 1193 C LYS A 82 -6.617 -4.363 -10.038 1.00 0.00 C ATOM 1194 O LYS A 82 -7.557 -5.161 -10.091 1.00 0.00 O ATOM 1195 CB LYS A 82 -5.704 -3.813 -7.722 1.00 0.00 C ATOM 1196 CG LYS A 82 -5.788 -5.324 -7.403 1.00 0.00 C ATOM 1197 CD LYS A 82 -4.900 -5.712 -6.209 1.00 0.00 C ATOM 1198 CE LYS A 82 -4.970 -7.218 -5.906 1.00 0.00 C ATOM 1199 NZ LYS A 82 -4.050 -8.054 -6.712 1.00 0.00 N ATOM 0 H LYS A 82 -8.466 -3.686 -8.170 1.00 0.00 H new ATOM 0 HA LYS A 82 -6.033 -2.447 -9.309 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -4.661 -3.559 -7.910 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -6.013 -3.257 -6.837 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -6.822 -5.592 -7.187 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -5.487 -5.897 -8.280 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.868 -5.432 -6.418 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -5.210 -5.150 -5.328 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -4.749 -7.373 -4.850 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -5.991 -7.561 -6.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.290 -9.058 -6.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -4.143 -7.803 -7.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -3.071 -7.889 -6.403 1.00 0.00 H new ATOM 1213 N LEU A 83 -5.553 -4.413 -10.841 1.00 0.00 N ATOM 1214 CA LEU A 83 -5.222 -5.537 -11.697 1.00 0.00 C ATOM 1215 C LEU A 83 -3.796 -5.956 -11.351 1.00 0.00 C ATOM 1216 O LEU A 83 -2.914 -5.112 -11.175 1.00 0.00 O ATOM 1217 CB LEU A 83 -5.465 -5.207 -13.181 1.00 0.00 C ATOM 1218 CG LEU A 83 -4.516 -4.158 -13.806 1.00 0.00 C ATOM 1219 CD1 LEU A 83 -3.313 -4.816 -14.500 1.00 0.00 C ATOM 1220 CD2 LEU A 83 -5.266 -3.311 -14.842 1.00 0.00 C ATOM 0 H LEU A 83 -4.883 -3.647 -10.911 1.00 0.00 H new ATOM 0 HA LEU A 83 -5.877 -6.390 -11.521 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -5.384 -6.129 -13.756 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -6.490 -4.852 -13.291 1.00 0.00 H new ATOM 0 HG LEU A 83 -4.155 -3.532 -12.990 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -2.672 -4.044 -14.926 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -2.747 -5.398 -13.773 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -3.666 -5.473 -15.295 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -4.585 -2.577 -15.273 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -5.650 -3.957 -15.631 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -6.096 -2.796 -14.359 1.00 0.00 H new ATOM 1232 N GLY A 84 -3.590 -7.259 -11.182 1.00 0.00 N ATOM 1233 CA GLY A 84 -2.389 -7.827 -10.596 1.00 0.00 C ATOM 1234 C GLY A 84 -2.743 -8.970 -9.658 1.00 0.00 C ATOM 1235 O GLY A 84 -3.910 -9.123 -9.289 1.00 0.00 O ATOM 0 H GLY A 84 -4.274 -7.964 -11.457 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -1.728 -8.187 -11.384 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -1.844 -7.057 -10.050 1.00 0.00 H new ATOM 1239 N TYR A 85 -1.747 -9.779 -9.291 1.00 0.00 N ATOM 1240 CA TYR A 85 -1.964 -11.100 -8.700 1.00 0.00 C ATOM 1241 C TYR A 85 -0.704 -11.594 -7.967 1.00 0.00 C ATOM 1242 O TYR A 85 0.362 -11.000 -8.170 1.00 0.00 O ATOM 1243 CB TYR A 85 -2.370 -12.061 -9.836 1.00 0.00 C ATOM 1244 CG TYR A 85 -1.251 -12.556 -10.737 1.00 0.00 C ATOM 1245 CD1 TYR A 85 -0.740 -11.741 -11.766 1.00 0.00 C ATOM 1246 CD2 TYR A 85 -0.755 -13.863 -10.573 1.00 0.00 C ATOM 1247 CE1 TYR A 85 0.264 -12.228 -12.622 1.00 0.00 C ATOM 1248 CE2 TYR A 85 0.243 -14.361 -11.427 1.00 0.00 C ATOM 1249 CZ TYR A 85 0.758 -13.542 -12.457 1.00 0.00 C ATOM 1250 OH TYR A 85 1.729 -14.013 -13.289 1.00 0.00 O ATOM 0 H TYR A 85 -0.762 -9.534 -9.396 1.00 0.00 H new ATOM 0 HA TYR A 85 -2.756 -11.054 -7.953 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -2.859 -12.928 -9.391 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -3.112 -11.560 -10.458 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -1.120 -10.739 -11.898 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -1.145 -14.488 -9.784 1.00 0.00 H new ATOM 0 HE1 TYR A 85 0.658 -11.598 -13.406 1.00 0.00 H new ATOM 0 HE2 TYR A 85 0.615 -15.366 -11.297 1.00 0.00 H new ATOM 0 HH TYR A 85 1.956 -14.933 -13.039 1.00 0.00 H new ATOM 1260 N PRO A 86 -0.782 -12.686 -7.170 1.00 0.00 N ATOM 1261 CA PRO A 86 0.379 -13.384 -6.617 1.00 0.00 C ATOM 1262 C PRO A 86 1.243 -13.973 -7.738 1.00 0.00 C ATOM 1263 O PRO A 86 0.948 -15.056 -8.244 1.00 0.00 O ATOM 1264 CB PRO A 86 -0.167 -14.436 -5.644 1.00 0.00 C ATOM 1265 CG PRO A 86 -1.576 -14.699 -6.163 1.00 0.00 C ATOM 1266 CD PRO A 86 -2.000 -13.327 -6.679 1.00 0.00 C ATOM 0 HA PRO A 86 1.045 -12.710 -6.078 1.00 0.00 H new ATOM 0 HB2 PRO A 86 0.439 -15.342 -5.650 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -0.179 -14.067 -4.618 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -1.584 -15.450 -6.953 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -2.238 -15.059 -5.375 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -2.739 -13.421 -7.475 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -2.459 -12.737 -5.886 1.00 0.00 H new ATOM 1274 N ILE A 87 2.285 -13.241 -8.151 1.00 0.00 N ATOM 1275 CA ILE A 87 3.103 -13.599 -9.310 1.00 0.00 C ATOM 1276 C ILE A 87 3.912 -14.872 -9.036 1.00 0.00 C ATOM 1277 O ILE A 87 3.974 -15.757 -9.886 1.00 0.00 O ATOM 1278 CB ILE A 87 3.957 -12.393 -9.771 1.00 0.00 C ATOM 1279 CG1 ILE A 87 4.613 -12.703 -11.133 1.00 0.00 C ATOM 1280 CG2 ILE A 87 5.011 -11.937 -8.742 1.00 0.00 C ATOM 1281 CD1 ILE A 87 5.179 -11.465 -11.840 1.00 0.00 C ATOM 0 H ILE A 87 2.583 -12.382 -7.688 1.00 0.00 H new ATOM 0 HA ILE A 87 2.453 -13.841 -10.151 1.00 0.00 H new ATOM 0 HB ILE A 87 3.272 -11.551 -9.873 1.00 0.00 H new ATOM 0 HG12 ILE A 87 5.416 -13.424 -10.984 1.00 0.00 H new ATOM 0 HG13 ILE A 87 3.876 -13.176 -11.782 1.00 0.00 H new ATOM 0 HG21 ILE A 87 5.566 -11.088 -9.142 1.00 0.00 H new ATOM 0 HG22 ILE A 87 4.514 -11.643 -7.818 1.00 0.00 H new ATOM 0 HG23 ILE A 87 5.699 -12.757 -8.538 1.00 0.00 H new ATOM 0 HD11 ILE A 87 5.624 -11.760 -12.790 1.00 0.00 H new ATOM 0 HD12 ILE A 87 4.376 -10.751 -12.022 1.00 0.00 H new ATOM 0 HD13 ILE A 87 5.940 -11.003 -11.211 1.00 0.00 H new ATOM 1331 N LEU A 91 4.311 -12.755 -3.314 1.00 0.00 N ATOM 1332 CA LEU A 91 4.221 -11.361 -3.737 1.00 0.00 C ATOM 1333 C LEU A 91 3.022 -11.194 -4.669 1.00 0.00 C ATOM 1334 O LEU A 91 3.060 -11.654 -5.812 1.00 0.00 O ATOM 1335 CB LEU A 91 5.519 -10.951 -4.459 1.00 0.00 C ATOM 1336 CG LEU A 91 6.565 -10.363 -3.499 1.00 0.00 C ATOM 1337 CD1 LEU A 91 7.959 -10.431 -4.134 1.00 0.00 C ATOM 1338 CD2 LEU A 91 6.229 -8.899 -3.169 1.00 0.00 C ATOM 0 HA LEU A 91 4.089 -10.720 -2.865 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.941 -11.821 -4.963 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.286 -10.217 -5.231 1.00 0.00 H new ATOM 0 HG LEU A 91 6.554 -10.949 -2.580 1.00 0.00 H new ATOM 0 HD11 LEU A 91 8.693 -10.012 -3.446 1.00 0.00 H new ATOM 0 HD12 LEU A 91 8.212 -11.470 -4.346 1.00 0.00 H new ATOM 0 HD13 LEU A 91 7.964 -9.860 -5.062 1.00 0.00 H new ATOM 0 HD21 LEU A 91 6.980 -8.498 -2.488 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.221 -8.312 -4.087 1.00 0.00 H new ATOM 0 HD23 LEU A 91 5.248 -8.848 -2.698 1.00 0.00 H new ATOM 1350 N ASP A 92 1.980 -10.499 -4.205 1.00 0.00 N ATOM 1351 CA ASP A 92 0.900 -10.023 -5.060 1.00 0.00 C ATOM 1352 C ASP A 92 1.338 -8.675 -5.610 1.00 0.00 C ATOM 1353 O ASP A 92 1.517 -7.722 -4.854 1.00 0.00 O ATOM 1354 CB ASP A 92 -0.435 -9.940 -4.310 1.00 0.00 C ATOM 1355 CG ASP A 92 -1.581 -9.479 -5.220 1.00 0.00 C ATOM 1356 OD1 ASP A 92 -1.601 -8.310 -5.670 1.00 0.00 O ATOM 1357 OD2 ASP A 92 -2.500 -10.292 -5.464 1.00 0.00 O ATOM 0 H ASP A 92 1.865 -10.252 -3.222 1.00 0.00 H new ATOM 0 HA ASP A 92 0.719 -10.724 -5.875 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.676 -10.917 -3.891 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -0.337 -9.249 -3.473 1.00 0.00 H new ATOM 1362 N ILE A 93 1.592 -8.627 -6.919 1.00 0.00 N ATOM 1363 CA ILE A 93 2.100 -7.443 -7.602 1.00 0.00 C ATOM 1364 C ILE A 93 0.962 -6.891 -8.450 1.00 0.00 C ATOM 1365 O ILE A 93 0.234 -7.673 -9.074 1.00 0.00 O ATOM 1366 CB ILE A 93 3.398 -7.756 -8.389 1.00 0.00 C ATOM 1367 CG1 ILE A 93 3.210 -8.606 -9.669 1.00 0.00 C ATOM 1368 CG2 ILE A 93 4.413 -8.460 -7.466 1.00 0.00 C ATOM 1369 CD1 ILE A 93 2.979 -7.774 -10.938 1.00 0.00 C ATOM 0 H ILE A 93 1.447 -9.423 -7.541 1.00 0.00 H new ATOM 0 HA ILE A 93 2.406 -6.671 -6.896 1.00 0.00 H new ATOM 0 HB ILE A 93 3.761 -6.785 -8.727 1.00 0.00 H new ATOM 0 HG12 ILE A 93 4.092 -9.231 -9.811 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.363 -9.277 -9.527 1.00 0.00 H new ATOM 0 HG21 ILE A 93 5.323 -8.677 -8.025 1.00 0.00 H new ATOM 0 HG22 ILE A 93 4.651 -7.810 -6.624 1.00 0.00 H new ATOM 0 HG23 ILE A 93 3.983 -9.391 -7.096 1.00 0.00 H new ATOM 0 HD11 ILE A 93 2.856 -8.440 -11.792 1.00 0.00 H new ATOM 0 HD12 ILE A 93 2.081 -7.169 -10.818 1.00 0.00 H new ATOM 0 HD13 ILE A 93 3.836 -7.122 -11.107 1.00 0.00 H new ATOM 1381 N TYR A 94 0.786 -5.562 -8.447 1.00 0.00 N ATOM 1382 CA TYR A 94 -0.378 -4.939 -9.057 1.00 0.00 C ATOM 1383 C TYR A 94 -0.135 -3.509 -9.526 1.00 0.00 C ATOM 1384 O TYR A 94 0.819 -2.834 -9.131 1.00 0.00 O ATOM 1385 CB TYR A 94 -1.549 -4.971 -8.051 1.00 0.00 C ATOM 1386 CG TYR A 94 -1.304 -4.228 -6.743 1.00 0.00 C ATOM 1387 CD1 TYR A 94 -1.586 -2.849 -6.628 1.00 0.00 C ATOM 1388 CD2 TYR A 94 -0.800 -4.927 -5.630 1.00 0.00 C ATOM 1389 CE1 TYR A 94 -1.354 -2.169 -5.415 1.00 0.00 C ATOM 1390 CE2 TYR A 94 -0.570 -4.255 -4.419 1.00 0.00 C ATOM 1391 CZ TYR A 94 -0.839 -2.874 -4.302 1.00 0.00 C ATOM 1392 OH TYR A 94 -0.578 -2.253 -3.118 1.00 0.00 O ATOM 0 H TYR A 94 1.441 -4.904 -8.026 1.00 0.00 H new ATOM 0 HA TYR A 94 -0.614 -5.513 -9.953 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -2.431 -4.547 -8.531 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -1.781 -6.011 -7.821 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -1.983 -2.311 -7.476 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -0.590 -5.983 -5.708 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -1.569 -1.114 -5.336 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -0.184 -4.799 -3.570 1.00 0.00 H new ATOM 0 HH TYR A 94 -0.987 -1.362 -3.119 1.00 0.00 H new ATOM 1402 N THR A 95 -1.089 -3.033 -10.325 1.00 0.00 N ATOM 1403 CA THR A 95 -1.352 -1.628 -10.561 1.00 0.00 C ATOM 1404 C THR A 95 -2.850 -1.421 -10.345 1.00 0.00 C ATOM 1405 O THR A 95 -3.641 -2.367 -10.421 1.00 0.00 O ATOM 1406 CB THR A 95 -0.804 -1.179 -11.929 1.00 0.00 C ATOM 1407 OG1 THR A 95 -1.021 0.202 -12.143 1.00 0.00 O ATOM 1408 CG2 THR A 95 -1.412 -1.938 -13.114 1.00 0.00 C ATOM 0 H THR A 95 -1.720 -3.645 -10.842 1.00 0.00 H new ATOM 0 HA THR A 95 -0.822 -0.979 -9.863 1.00 0.00 H new ATOM 0 HB THR A 95 0.262 -1.403 -11.886 1.00 0.00 H new ATOM 0 HG1 THR A 95 -0.610 0.714 -11.415 1.00 0.00 H new ATOM 0 HG21 THR A 95 -0.979 -1.569 -14.044 1.00 0.00 H new ATOM 0 HG22 THR A 95 -1.199 -3.002 -13.012 1.00 0.00 H new ATOM 0 HG23 THR A 95 -2.491 -1.784 -13.130 1.00 0.00 H new ATOM 1416 N ARG A 96 -3.240 -0.203 -9.972 1.00 0.00 N ATOM 1417 CA ARG A 96 -4.572 0.062 -9.460 1.00 0.00 C ATOM 1418 C ARG A 96 -5.013 1.463 -9.838 1.00 0.00 C ATOM 1419 O ARG A 96 -4.177 2.352 -10.014 1.00 0.00 O ATOM 1420 CB ARG A 96 -4.579 -0.184 -7.937 1.00 0.00 C ATOM 1421 CG ARG A 96 -3.822 0.869 -7.108 1.00 0.00 C ATOM 1422 CD ARG A 96 -4.704 2.030 -6.595 1.00 0.00 C ATOM 1423 NE ARG A 96 -5.006 1.891 -5.158 1.00 0.00 N ATOM 1424 CZ ARG A 96 -4.142 2.042 -4.148 1.00 0.00 C ATOM 1425 NH1 ARG A 96 -3.002 2.703 -4.324 1.00 0.00 N ATOM 1426 NH2 ARG A 96 -4.364 1.528 -2.941 1.00 0.00 N ATOM 0 H ARG A 96 -2.640 0.621 -10.018 1.00 0.00 H new ATOM 0 HA ARG A 96 -5.298 -0.616 -9.909 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -5.613 -0.221 -7.594 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -4.143 -1.163 -7.740 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -3.358 0.376 -6.254 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -3.016 1.281 -7.715 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -4.196 2.978 -6.770 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -5.635 2.058 -7.162 1.00 0.00 H new ATOM 0 HE ARG A 96 -5.967 1.657 -4.910 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -2.779 3.101 -5.236 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -2.351 2.812 -3.547 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -5.217 0.998 -2.761 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -3.682 1.664 -2.195 1.00 0.00 H new ATOM 1440 N LEU A 97 -6.329 1.652 -9.885 1.00 0.00 N ATOM 1441 CA LEU A 97 -6.985 2.928 -10.095 1.00 0.00 C ATOM 1442 C LEU A 97 -7.991 3.079 -8.962 1.00 0.00 C ATOM 1443 O LEU A 97 -8.641 2.107 -8.574 1.00 0.00 O ATOM 1444 CB LEU A 97 -7.607 2.963 -11.501 1.00 0.00 C ATOM 1445 CG LEU A 97 -8.184 4.341 -11.896 1.00 0.00 C ATOM 1446 CD1 LEU A 97 -8.021 4.566 -13.406 1.00 0.00 C ATOM 1447 CD2 LEU A 97 -9.673 4.478 -11.547 1.00 0.00 C ATOM 0 H LEU A 97 -6.991 0.884 -9.772 1.00 0.00 H new ATOM 0 HA LEU A 97 -6.300 3.775 -10.067 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -6.850 2.675 -12.230 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -8.401 2.218 -11.555 1.00 0.00 H new ATOM 0 HG LEU A 97 -7.627 5.086 -11.327 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -8.431 5.540 -13.675 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -6.963 4.533 -13.667 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -8.553 3.786 -13.950 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -10.027 5.465 -11.846 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -10.242 3.713 -12.075 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -9.808 4.354 -10.472 1.00 0.00 H new ATOM 1459 N GLY A 98 -8.091 4.273 -8.390 1.00 0.00 N ATOM 1460 CA GLY A 98 -8.853 4.501 -7.179 1.00 0.00 C ATOM 1461 C GLY A 98 -9.030 5.984 -6.921 1.00 0.00 C ATOM 1462 O GLY A 98 -8.893 6.796 -7.837 1.00 0.00 O ATOM 0 H GLY A 98 -7.642 5.111 -8.759 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -9.829 4.024 -7.264 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -8.345 4.039 -6.333 1.00 0.00 H new ATOM 1466 N GLY A 99 -9.337 6.337 -5.673 1.00 0.00 N ATOM 1467 CA GLY A 99 -9.383 7.721 -5.245 1.00 0.00 C ATOM 1468 C GLY A 99 -9.733 7.858 -3.771 1.00 0.00 C ATOM 1469 O GLY A 99 -10.040 6.874 -3.089 1.00 0.00 O ATOM 0 H GLY A 99 -9.559 5.667 -4.937 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -8.416 8.189 -5.432 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -10.119 8.260 -5.842 1.00 0.00 H new ATOM 1473 N MET A 100 -9.713 9.109 -3.313 1.00 0.00 N ATOM 1474 CA MET A 100 -10.122 9.545 -1.991 1.00 0.00 C ATOM 1475 C MET A 100 -11.323 10.472 -2.159 1.00 0.00 C ATOM 1476 O MET A 100 -11.365 11.271 -3.100 1.00 0.00 O ATOM 1477 CB MET A 100 -8.981 10.309 -1.291 1.00 0.00 C ATOM 1478 CG MET A 100 -7.756 9.452 -0.942 1.00 0.00 C ATOM 1479 SD MET A 100 -6.616 9.025 -2.289 1.00 0.00 S ATOM 1480 CE MET A 100 -5.822 10.627 -2.588 1.00 0.00 C ATOM 0 H MET A 100 -9.392 9.885 -3.892 1.00 0.00 H new ATOM 0 HA MET A 100 -10.376 8.679 -1.379 1.00 0.00 H new ATOM 0 HB2 MET A 100 -8.663 11.129 -1.935 1.00 0.00 H new ATOM 0 HB3 MET A 100 -9.369 10.755 -0.375 1.00 0.00 H new ATOM 0 HG2 MET A 100 -7.187 9.976 -0.174 1.00 0.00 H new ATOM 0 HG3 MET A 100 -8.112 8.523 -0.496 1.00 0.00 H new ATOM 0 HE1 MET A 100 -4.954 10.488 -3.232 1.00 0.00 H new ATOM 0 HE2 MET A 100 -6.530 11.299 -3.073 1.00 0.00 H new ATOM 0 HE3 MET A 100 -5.504 11.058 -1.639 1.00 0.00 H new ATOM 1490 N VAL A 101 -12.259 10.406 -1.208 1.00 0.00 N ATOM 1491 CA VAL A 101 -13.229 11.465 -0.967 1.00 0.00 C ATOM 1492 C VAL A 101 -13.147 11.739 0.532 1.00 0.00 C ATOM 1493 O VAL A 101 -13.743 11.040 1.354 1.00 0.00 O ATOM 1494 CB VAL A 101 -14.641 11.130 -1.492 1.00 0.00 C ATOM 1495 CG1 VAL A 101 -15.570 12.342 -1.309 1.00 0.00 C ATOM 1496 CG2 VAL A 101 -14.624 10.746 -2.979 1.00 0.00 C ATOM 0 H VAL A 101 -12.361 9.608 -0.582 1.00 0.00 H new ATOM 0 HA VAL A 101 -12.998 12.369 -1.530 1.00 0.00 H new ATOM 0 HB VAL A 101 -15.004 10.278 -0.918 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -16.565 12.098 -1.682 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -15.632 12.597 -0.251 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -15.173 13.192 -1.864 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -15.638 10.518 -3.308 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -14.231 11.577 -3.565 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -13.991 9.870 -3.121 1.00 0.00 H new ATOM 1506 N PHE A 102 -12.329 12.725 0.887 1.00 0.00 N ATOM 1507 CA PHE A 102 -11.923 13.017 2.249 1.00 0.00 C ATOM 1508 C PHE A 102 -12.185 14.505 2.448 1.00 0.00 C ATOM 1509 O PHE A 102 -12.030 15.292 1.514 1.00 0.00 O ATOM 1510 CB PHE A 102 -10.456 12.573 2.407 1.00 0.00 C ATOM 1511 CG PHE A 102 -9.887 12.501 3.819 1.00 0.00 C ATOM 1512 CD1 PHE A 102 -9.786 13.650 4.629 1.00 0.00 C ATOM 1513 CD2 PHE A 102 -9.397 11.272 4.312 1.00 0.00 C ATOM 1514 CE1 PHE A 102 -9.255 13.561 5.928 1.00 0.00 C ATOM 1515 CE2 PHE A 102 -8.845 11.189 5.601 1.00 0.00 C ATOM 1516 CZ PHE A 102 -8.791 12.329 6.419 1.00 0.00 C ATOM 0 H PHE A 102 -11.918 13.363 0.206 1.00 0.00 H new ATOM 0 HA PHE A 102 -12.472 12.482 3.024 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -10.353 11.587 1.953 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -9.834 13.257 1.829 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -10.119 14.605 4.250 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -9.447 10.388 3.693 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -9.204 14.442 6.550 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -8.461 10.247 5.964 1.00 0.00 H new ATOM 0 HZ PHE A 102 -8.395 12.259 7.421 1.00 0.00 H new ATOM 1526 N ARG A 103 -12.710 14.890 3.609 1.00 0.00 N ATOM 1527 CA ARG A 103 -13.119 16.257 3.874 1.00 0.00 C ATOM 1528 C ARG A 103 -12.823 16.641 5.314 1.00 0.00 C ATOM 1529 O ARG A 103 -13.172 15.893 6.230 1.00 0.00 O ATOM 1530 CB ARG A 103 -14.623 16.434 3.615 1.00 0.00 C ATOM 1531 CG ARG A 103 -15.017 16.720 2.164 1.00 0.00 C ATOM 1532 CD ARG A 103 -15.359 15.508 1.282 1.00 0.00 C ATOM 1533 NE ARG A 103 -15.821 15.952 -0.047 1.00 0.00 N ATOM 1534 CZ ARG A 103 -16.996 16.541 -0.326 1.00 0.00 C ATOM 1535 NH1 ARG A 103 -18.038 16.483 0.501 1.00 0.00 N ATOM 1536 NH2 ARG A 103 -17.131 17.227 -1.454 1.00 0.00 N ATOM 0 H ARG A 103 -12.862 14.255 4.393 1.00 0.00 H new ATOM 0 HA ARG A 103 -12.554 16.903 3.202 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -15.138 15.530 3.941 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -14.987 17.250 4.239 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -15.879 17.387 2.172 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -14.198 17.263 1.691 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -14.482 14.870 1.174 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -16.133 14.908 1.761 1.00 0.00 H new ATOM 0 HE ARG A 103 -15.187 15.797 -0.830 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -17.961 15.978 1.384 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -18.913 16.944 0.252 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -16.346 17.304 -2.101 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -18.019 17.677 -1.674 1.00 0.00 H new ATOM 1779 N SER A 120 -10.105 13.338 -5.034 1.00 0.00 N ATOM 1780 CA SER A 120 -8.851 13.170 -5.757 1.00 0.00 C ATOM 1781 C SER A 120 -8.699 11.712 -6.216 1.00 0.00 C ATOM 1782 O SER A 120 -8.861 10.806 -5.393 1.00 0.00 O ATOM 1783 CB SER A 120 -7.679 13.644 -4.876 1.00 0.00 C ATOM 1784 OG SER A 120 -7.884 13.430 -3.490 1.00 0.00 O ATOM 0 HA SER A 120 -8.850 13.786 -6.657 1.00 0.00 H new ATOM 0 HB2 SER A 120 -6.771 13.125 -5.184 1.00 0.00 H new ATOM 0 HB3 SER A 120 -7.513 14.707 -5.050 1.00 0.00 H new ATOM 0 HG SER A 120 -8.844 13.455 -3.294 1.00 0.00 H new ATOM 1790 N PRO A 121 -8.443 11.447 -7.515 1.00 0.00 N ATOM 1791 CA PRO A 121 -8.244 10.095 -8.024 1.00 0.00 C ATOM 1792 C PRO A 121 -6.824 9.603 -7.718 1.00 0.00 C ATOM 1793 O PRO A 121 -5.948 10.392 -7.369 1.00 0.00 O ATOM 1794 CB PRO A 121 -8.467 10.218 -9.534 1.00 0.00 C ATOM 1795 CG PRO A 121 -7.903 11.604 -9.843 1.00 0.00 C ATOM 1796 CD PRO A 121 -8.272 12.411 -8.597 1.00 0.00 C ATOM 0 HA PRO A 121 -8.920 9.374 -7.565 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -7.945 9.436 -10.086 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -9.523 10.142 -9.795 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -6.825 11.575 -10.000 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -8.346 12.028 -10.744 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -7.490 13.131 -8.355 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -9.188 12.978 -8.760 1.00 0.00 H new ATOM 1804 N VAL A 122 -6.578 8.308 -7.922 1.00 0.00 N ATOM 1805 CA VAL A 122 -5.263 7.685 -7.856 1.00 0.00 C ATOM 1806 C VAL A 122 -5.135 6.730 -9.046 1.00 0.00 C ATOM 1807 O VAL A 122 -6.074 5.992 -9.342 1.00 0.00 O ATOM 1808 CB VAL A 122 -5.086 6.950 -6.505 1.00 0.00 C ATOM 1809 CG1 VAL A 122 -3.774 6.148 -6.428 1.00 0.00 C ATOM 1810 CG2 VAL A 122 -5.108 7.926 -5.318 1.00 0.00 C ATOM 0 H VAL A 122 -7.319 7.643 -8.146 1.00 0.00 H new ATOM 0 HA VAL A 122 -4.474 8.435 -7.912 1.00 0.00 H new ATOM 0 HB VAL A 122 -5.930 6.263 -6.446 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -3.705 5.655 -5.458 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -3.759 5.398 -7.219 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -2.927 6.823 -6.552 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -4.981 7.371 -4.388 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -4.297 8.647 -5.424 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -6.062 8.453 -5.298 1.00 0.00 H new ATOM 1820 N PHE A 123 -3.956 6.695 -9.670 1.00 0.00 N ATOM 1821 CA PHE A 123 -3.459 5.633 -10.531 1.00 0.00 C ATOM 1822 C PHE A 123 -2.076 5.253 -9.991 1.00 0.00 C ATOM 1823 O PHE A 123 -1.194 6.102 -9.886 1.00 0.00 O ATOM 1824 CB PHE A 123 -3.446 6.069 -12.007 1.00 0.00 C ATOM 1825 CG PHE A 123 -2.670 7.337 -12.334 1.00 0.00 C ATOM 1826 CD1 PHE A 123 -1.295 7.278 -12.643 1.00 0.00 C ATOM 1827 CD2 PHE A 123 -3.325 8.584 -12.339 1.00 0.00 C ATOM 1828 CE1 PHE A 123 -0.579 8.455 -12.929 1.00 0.00 C ATOM 1829 CE2 PHE A 123 -2.613 9.756 -12.649 1.00 0.00 C ATOM 1830 CZ PHE A 123 -1.238 9.696 -12.936 1.00 0.00 C ATOM 0 H PHE A 123 -3.285 7.458 -9.578 1.00 0.00 H new ATOM 0 HA PHE A 123 -4.109 4.758 -10.514 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -3.032 5.253 -12.600 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -4.478 6.207 -12.331 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -0.789 6.324 -12.660 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -4.378 8.640 -12.104 1.00 0.00 H new ATOM 0 HE1 PHE A 123 0.478 8.405 -13.143 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -3.125 10.707 -12.667 1.00 0.00 H new ATOM 0 HZ PHE A 123 -0.691 10.600 -13.161 1.00 0.00 H new ATOM 1840 N ALA A 124 -1.899 4.001 -9.560 1.00 0.00 N ATOM 1841 CA ALA A 124 -0.715 3.595 -8.807 1.00 0.00 C ATOM 1842 C ALA A 124 -0.216 2.213 -9.230 1.00 0.00 C ATOM 1843 O ALA A 124 -0.927 1.451 -9.891 1.00 0.00 O ATOM 1844 CB ALA A 124 -1.044 3.655 -7.307 1.00 0.00 C ATOM 0 H ALA A 124 -2.568 3.248 -9.723 1.00 0.00 H new ATOM 0 HA ALA A 124 0.103 4.282 -9.022 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -0.169 3.354 -6.730 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -1.325 4.673 -7.037 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -1.872 2.980 -7.089 1.00 0.00 H new ATOM 1850 N GLY A 125 1.005 1.884 -8.805 1.00 0.00 N ATOM 1851 CA GLY A 125 1.584 0.546 -8.839 1.00 0.00 C ATOM 1852 C GLY A 125 1.942 0.139 -7.414 1.00 0.00 C ATOM 1853 O GLY A 125 2.114 1.014 -6.563 1.00 0.00 O ATOM 0 H GLY A 125 1.643 2.576 -8.411 1.00 0.00 H new ATOM 0 HA2 GLY A 125 0.876 -0.163 -9.269 1.00 0.00 H new ATOM 0 HA3 GLY A 125 2.472 0.533 -9.471 1.00 0.00 H new ATOM 1857 N GLY A 126 2.071 -1.162 -7.139 1.00 0.00 N ATOM 1858 CA GLY A 126 2.423 -1.619 -5.805 1.00 0.00 C ATOM 1859 C GLY A 126 2.574 -3.126 -5.704 1.00 0.00 C ATOM 1860 O GLY A 126 2.328 -3.860 -6.666 1.00 0.00 O ATOM 0 H GLY A 126 1.937 -1.908 -7.822 1.00 0.00 H new ATOM 0 HA2 GLY A 126 3.357 -1.147 -5.502 1.00 0.00 H new ATOM 0 HA3 GLY A 126 1.657 -1.290 -5.103 1.00 0.00 H new ATOM 1864 N VAL A 127 2.994 -3.569 -4.517 1.00 0.00 N ATOM 1865 CA VAL A 127 3.140 -4.974 -4.167 1.00 0.00 C ATOM 1866 C VAL A 127 2.632 -5.180 -2.736 1.00 0.00 C ATOM 1867 O VAL A 127 2.960 -4.386 -1.854 1.00 0.00 O ATOM 1868 CB VAL A 127 4.598 -5.459 -4.361 1.00 0.00 C ATOM 1869 CG1 VAL A 127 5.098 -5.247 -5.800 1.00 0.00 C ATOM 1870 CG2 VAL A 127 5.623 -4.795 -3.425 1.00 0.00 C ATOM 0 H VAL A 127 3.247 -2.939 -3.756 1.00 0.00 H new ATOM 0 HA VAL A 127 2.538 -5.586 -4.838 1.00 0.00 H new ATOM 0 HB VAL A 127 4.538 -6.520 -4.118 1.00 0.00 H new ATOM 0 HG11 VAL A 127 6.125 -5.603 -5.885 1.00 0.00 H new ATOM 0 HG12 VAL A 127 4.464 -5.802 -6.491 1.00 0.00 H new ATOM 0 HG13 VAL A 127 5.061 -4.186 -6.046 1.00 0.00 H new ATOM 0 HG21 VAL A 127 6.616 -5.195 -3.631 1.00 0.00 H new ATOM 0 HG22 VAL A 127 5.624 -3.718 -3.592 1.00 0.00 H new ATOM 0 HG23 VAL A 127 5.357 -5.002 -2.388 1.00 0.00 H new ATOM 1880 N GLU A 128 1.849 -6.241 -2.525 1.00 0.00 N ATOM 1881 CA GLU A 128 1.401 -6.803 -1.253 1.00 0.00 C ATOM 1882 C GLU A 128 2.220 -8.085 -1.065 1.00 0.00 C ATOM 1883 O GLU A 128 2.038 -9.045 -1.816 1.00 0.00 O ATOM 1884 CB GLU A 128 -0.108 -7.141 -1.319 1.00 0.00 C ATOM 1885 CG GLU A 128 -1.085 -6.013 -0.944 1.00 0.00 C ATOM 1886 CD GLU A 128 -1.404 -5.897 0.555 1.00 0.00 C ATOM 1887 OE1 GLU A 128 -0.618 -6.379 1.393 1.00 0.00 O ATOM 1888 OE2 GLU A 128 -2.422 -5.226 0.884 1.00 0.00 O ATOM 0 H GLU A 128 1.481 -6.775 -3.312 1.00 0.00 H new ATOM 0 HA GLU A 128 1.541 -6.104 -0.428 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -0.339 -7.469 -2.332 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -0.296 -7.988 -0.659 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -0.669 -5.065 -1.285 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -2.018 -6.166 -1.487 1.00 0.00 H new ATOM 1895 N TYR A 129 3.141 -8.110 -0.098 1.00 0.00 N ATOM 1896 CA TYR A 129 3.905 -9.306 0.233 1.00 0.00 C ATOM 1897 C TYR A 129 3.162 -10.005 1.369 1.00 0.00 C ATOM 1898 O TYR A 129 3.139 -9.485 2.489 1.00 0.00 O ATOM 1899 CB TYR A 129 5.356 -8.948 0.620 1.00 0.00 C ATOM 1900 CG TYR A 129 6.364 -10.073 0.408 1.00 0.00 C ATOM 1901 CD1 TYR A 129 6.011 -11.420 0.627 1.00 0.00 C ATOM 1902 CD2 TYR A 129 7.644 -9.777 -0.107 1.00 0.00 C ATOM 1903 CE1 TYR A 129 6.857 -12.456 0.216 1.00 0.00 C ATOM 1904 CE2 TYR A 129 8.506 -10.813 -0.514 1.00 0.00 C ATOM 1905 CZ TYR A 129 8.084 -12.157 -0.407 1.00 0.00 C ATOM 1906 OH TYR A 129 8.795 -13.162 -0.983 1.00 0.00 O ATOM 0 H TYR A 129 3.375 -7.299 0.475 1.00 0.00 H new ATOM 0 HA TYR A 129 3.985 -9.972 -0.626 1.00 0.00 H new ATOM 0 HB2 TYR A 129 5.670 -8.081 0.038 1.00 0.00 H new ATOM 0 HB3 TYR A 129 5.376 -8.652 1.669 1.00 0.00 H new ATOM 0 HD1 TYR A 129 5.078 -11.655 1.117 1.00 0.00 H new ATOM 0 HD2 TYR A 129 7.964 -8.749 -0.189 1.00 0.00 H new ATOM 0 HE1 TYR A 129 6.569 -13.484 0.377 1.00 0.00 H new ATOM 0 HE2 TYR A 129 9.485 -10.581 -0.906 1.00 0.00 H new ATOM 0 HH TYR A 129 9.618 -12.799 -1.373 1.00 0.00 H new ATOM 1916 N ALA A 130 2.558 -11.169 1.099 1.00 0.00 N ATOM 1917 CA ALA A 130 1.984 -12.021 2.134 1.00 0.00 C ATOM 1918 C ALA A 130 3.120 -12.714 2.893 1.00 0.00 C ATOM 1919 O ALA A 130 3.450 -13.871 2.645 1.00 0.00 O ATOM 1920 CB ALA A 130 0.990 -13.012 1.515 1.00 0.00 C ATOM 0 H ALA A 130 2.456 -11.542 0.155 1.00 0.00 H new ATOM 0 HA ALA A 130 1.419 -11.425 2.850 1.00 0.00 H new ATOM 0 HB1 ALA A 130 0.569 -13.642 2.298 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.189 -12.463 1.021 1.00 0.00 H new ATOM 0 HB3 ALA A 130 1.505 -13.636 0.785 1.00 0.00 H new ATOM 1926 N ILE A 131 3.717 -11.996 3.848 1.00 0.00 N ATOM 1927 CA ILE A 131 4.835 -12.478 4.661 1.00 0.00 C ATOM 1928 C ILE A 131 4.418 -13.590 5.643 1.00 0.00 C ATOM 1929 O ILE A 131 5.255 -14.143 6.357 1.00 0.00 O ATOM 1930 CB ILE A 131 5.551 -11.297 5.358 1.00 0.00 C ATOM 1931 CG1 ILE A 131 4.624 -10.544 6.337 1.00 0.00 C ATOM 1932 CG2 ILE A 131 6.154 -10.350 4.301 1.00 0.00 C ATOM 1933 CD1 ILE A 131 5.335 -9.459 7.154 1.00 0.00 C ATOM 0 H ILE A 131 3.431 -11.045 4.082 1.00 0.00 H new ATOM 0 HA ILE A 131 5.555 -12.946 3.990 1.00 0.00 H new ATOM 0 HB ILE A 131 6.361 -11.705 5.963 1.00 0.00 H new ATOM 0 HG12 ILE A 131 3.811 -10.087 5.773 1.00 0.00 H new ATOM 0 HG13 ILE A 131 4.173 -11.263 7.021 1.00 0.00 H new ATOM 0 HG21 ILE A 131 6.656 -9.521 4.800 1.00 0.00 H new ATOM 0 HG22 ILE A 131 6.873 -10.896 3.691 1.00 0.00 H new ATOM 0 HG23 ILE A 131 5.359 -9.962 3.664 1.00 0.00 H new ATOM 0 HD11 ILE A 131 4.619 -8.975 7.818 1.00 0.00 H new ATOM 0 HD12 ILE A 131 6.130 -9.912 7.746 1.00 0.00 H new ATOM 0 HD13 ILE A 131 5.763 -8.717 6.479 1.00 0.00 H new ATOM 1945 N THR A 132 3.132 -13.940 5.714 1.00 0.00 N ATOM 1946 CA THR A 132 2.597 -15.162 6.307 1.00 0.00 C ATOM 1947 C THR A 132 1.257 -15.397 5.586 1.00 0.00 C ATOM 1948 O THR A 132 0.619 -14.416 5.207 1.00 0.00 O ATOM 1949 CB THR A 132 2.455 -14.922 7.823 1.00 0.00 C ATOM 1950 OG1 THR A 132 3.741 -14.771 8.390 1.00 0.00 O ATOM 1951 CG2 THR A 132 1.734 -16.005 8.630 1.00 0.00 C ATOM 0 H THR A 132 2.396 -13.342 5.337 1.00 0.00 H new ATOM 0 HA THR A 132 3.224 -16.046 6.192 1.00 0.00 H new ATOM 0 HB THR A 132 1.830 -14.032 7.888 1.00 0.00 H new ATOM 0 HG1 THR A 132 4.421 -14.884 7.693 1.00 0.00 H new ATOM 0 HG21 THR A 132 1.702 -15.715 9.680 1.00 0.00 H new ATOM 0 HG22 THR A 132 0.718 -16.123 8.254 1.00 0.00 H new ATOM 0 HG23 THR A 132 2.269 -16.949 8.531 1.00 0.00 H new ATOM 1959 N PRO A 133 0.769 -16.637 5.393 1.00 0.00 N ATOM 1960 CA PRO A 133 -0.409 -16.895 4.556 1.00 0.00 C ATOM 1961 C PRO A 133 -1.722 -16.234 5.021 1.00 0.00 C ATOM 1962 O PRO A 133 -2.700 -16.271 4.270 1.00 0.00 O ATOM 1963 CB PRO A 133 -0.526 -18.423 4.451 1.00 0.00 C ATOM 1964 CG PRO A 133 0.332 -18.951 5.599 1.00 0.00 C ATOM 1965 CD PRO A 133 1.420 -17.892 5.729 1.00 0.00 C ATOM 0 HA PRO A 133 -0.258 -16.423 3.585 1.00 0.00 H new ATOM 0 HB2 PRO A 133 -1.562 -18.749 4.547 1.00 0.00 H new ATOM 0 HB3 PRO A 133 -0.166 -18.784 3.488 1.00 0.00 H new ATOM 0 HG2 PRO A 133 -0.244 -19.053 6.519 1.00 0.00 H new ATOM 0 HG3 PRO A 133 0.749 -19.932 5.373 1.00 0.00 H new ATOM 0 HD2 PRO A 133 1.827 -17.867 6.740 1.00 0.00 H new ATOM 0 HD3 PRO A 133 2.252 -18.097 5.056 1.00 0.00 H new ATOM 1973 N GLU A 134 -1.759 -15.615 6.208 1.00 0.00 N ATOM 1974 CA GLU A 134 -2.891 -14.849 6.722 1.00 0.00 C ATOM 1975 C GLU A 134 -2.618 -13.336 6.819 1.00 0.00 C ATOM 1976 O GLU A 134 -3.585 -12.595 6.978 1.00 0.00 O ATOM 1977 CB GLU A 134 -3.319 -15.415 8.090 1.00 0.00 C ATOM 1978 CG GLU A 134 -4.273 -16.612 7.949 1.00 0.00 C ATOM 1979 CD GLU A 134 -4.772 -17.141 9.302 1.00 0.00 C ATOM 1980 OE1 GLU A 134 -5.220 -16.327 10.151 1.00 0.00 O ATOM 1981 OE2 GLU A 134 -4.755 -18.380 9.482 1.00 0.00 O ATOM 0 H GLU A 134 -0.972 -15.637 6.856 1.00 0.00 H new ATOM 0 HA GLU A 134 -3.702 -14.958 6.002 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -2.434 -15.721 8.648 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -3.806 -14.631 8.670 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -5.129 -16.318 7.341 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -3.764 -17.415 7.416 1.00 0.00 H new ATOM 1988 N ILE A 135 -1.377 -12.831 6.697 1.00 0.00 N ATOM 1989 CA ILE A 135 -1.097 -11.390 6.818 1.00 0.00 C ATOM 1990 C ILE A 135 -0.073 -10.932 5.779 1.00 0.00 C ATOM 1991 O ILE A 135 0.827 -11.680 5.398 1.00 0.00 O ATOM 1992 CB ILE A 135 -0.712 -10.962 8.264 1.00 0.00 C ATOM 1993 CG1 ILE A 135 0.405 -11.764 8.971 1.00 0.00 C ATOM 1994 CG2 ILE A 135 -1.946 -10.992 9.177 1.00 0.00 C ATOM 1995 CD1 ILE A 135 1.823 -11.364 8.557 1.00 0.00 C ATOM 0 H ILE A 135 -0.551 -13.401 6.514 1.00 0.00 H new ATOM 0 HA ILE A 135 -2.031 -10.871 6.603 1.00 0.00 H new ATOM 0 HB ILE A 135 -0.307 -9.961 8.113 1.00 0.00 H new ATOM 0 HG12 ILE A 135 0.303 -11.635 10.049 1.00 0.00 H new ATOM 0 HG13 ILE A 135 0.263 -12.824 8.762 1.00 0.00 H new ATOM 0 HG21 ILE A 135 -1.660 -10.690 10.185 1.00 0.00 H new ATOM 0 HG22 ILE A 135 -2.700 -10.305 8.792 1.00 0.00 H new ATOM 0 HG23 ILE A 135 -2.355 -12.002 9.203 1.00 0.00 H new ATOM 0 HD11 ILE A 135 2.546 -11.974 9.099 1.00 0.00 H new ATOM 0 HD12 ILE A 135 1.947 -11.520 7.485 1.00 0.00 H new ATOM 0 HD13 ILE A 135 1.988 -10.312 8.792 1.00 0.00 H new ATOM 2007 N ALA A 136 -0.198 -9.683 5.322 1.00 0.00 N ATOM 2008 CA ALA A 136 0.634 -9.132 4.280 1.00 0.00 C ATOM 2009 C ALA A 136 1.031 -7.714 4.652 1.00 0.00 C ATOM 2010 O ALA A 136 0.368 -7.077 5.475 1.00 0.00 O ATOM 2011 CB ALA A 136 -0.129 -9.170 2.948 1.00 0.00 C ATOM 0 H ALA A 136 -0.893 -9.027 5.678 1.00 0.00 H new ATOM 0 HA ALA A 136 1.544 -9.722 4.168 1.00 0.00 H new ATOM 0 HB1 ALA A 136 0.497 -8.754 2.158 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -0.384 -10.201 2.704 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -1.042 -8.581 3.035 1.00 0.00 H new ATOM 2017 N THR A 137 2.087 -7.236 4.002 1.00 0.00 N ATOM 2018 CA THR A 137 2.619 -5.890 4.123 1.00 0.00 C ATOM 2019 C THR A 137 2.800 -5.384 2.698 1.00 0.00 C ATOM 2020 O THR A 137 3.310 -6.125 1.853 1.00 0.00 O ATOM 2021 CB THR A 137 3.945 -5.926 4.901 1.00 0.00 C ATOM 2022 OG1 THR A 137 3.748 -6.524 6.167 1.00 0.00 O ATOM 2023 CG2 THR A 137 4.532 -4.528 5.127 1.00 0.00 C ATOM 0 H THR A 137 2.619 -7.807 3.345 1.00 0.00 H new ATOM 0 HA THR A 137 1.956 -5.224 4.676 1.00 0.00 H new ATOM 0 HB THR A 137 4.643 -6.504 4.295 1.00 0.00 H new ATOM 0 HG1 THR A 137 4.598 -6.544 6.655 1.00 0.00 H new ATOM 0 HG21 THR A 137 5.467 -4.611 5.681 1.00 0.00 H new ATOM 0 HG22 THR A 137 4.721 -4.053 4.164 1.00 0.00 H new ATOM 0 HG23 THR A 137 3.826 -3.925 5.697 1.00 0.00 H new ATOM 2031 N ARG A 138 2.405 -4.136 2.422 1.00 0.00 N ATOM 2032 CA ARG A 138 2.504 -3.569 1.083 1.00 0.00 C ATOM 2033 C ARG A 138 3.337 -2.306 1.045 1.00 0.00 C ATOM 2034 O ARG A 138 3.428 -1.584 2.044 1.00 0.00 O ATOM 2035 CB ARG A 138 1.119 -3.320 0.460 1.00 0.00 C ATOM 2036 CG ARG A 138 0.320 -2.167 1.080 1.00 0.00 C ATOM 2037 CD ARG A 138 -0.787 -1.669 0.156 1.00 0.00 C ATOM 2038 NE ARG A 138 -1.842 -2.668 -0.027 1.00 0.00 N ATOM 2039 CZ ARG A 138 -3.043 -2.455 -0.566 1.00 0.00 C ATOM 2040 NH1 ARG A 138 -3.342 -1.332 -1.214 1.00 0.00 N ATOM 2041 NH2 ARG A 138 -3.963 -3.384 -0.364 1.00 0.00 N ATOM 0 H ARG A 138 2.012 -3.500 3.116 1.00 0.00 H new ATOM 0 HA ARG A 138 3.019 -4.318 0.481 1.00 0.00 H new ATOM 0 HB2 ARG A 138 1.248 -3.120 -0.604 1.00 0.00 H new ATOM 0 HB3 ARG A 138 0.531 -4.234 0.544 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -0.117 -2.496 2.023 1.00 0.00 H new ATOM 0 HG3 ARG A 138 0.995 -1.343 1.312 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -1.219 -0.757 0.568 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -0.361 -1.411 -0.813 1.00 0.00 H new ATOM 0 HE ARG A 138 -1.639 -3.617 0.288 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -2.641 -0.598 -1.312 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -4.272 -1.206 -1.613 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -3.737 -4.215 0.183 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -4.898 -3.269 -0.755 1.00 0.00 H new ATOM 2055 N LEU A 139 3.806 -2.003 -0.165 1.00 0.00 N ATOM 2056 CA LEU A 139 4.249 -0.684 -0.584 1.00 0.00 C ATOM 2057 C LEU A 139 3.655 -0.423 -1.964 1.00 0.00 C ATOM 2058 O LEU A 139 3.511 -1.348 -2.769 1.00 0.00 O ATOM 2059 CB LEU A 139 5.783 -0.561 -0.531 1.00 0.00 C ATOM 2060 CG LEU A 139 6.571 -1.467 -1.507 1.00 0.00 C ATOM 2061 CD1 LEU A 139 6.834 -0.795 -2.866 1.00 0.00 C ATOM 2062 CD2 LEU A 139 7.927 -1.841 -0.891 1.00 0.00 C ATOM 0 H LEU A 139 3.889 -2.700 -0.905 1.00 0.00 H new ATOM 0 HA LEU A 139 3.895 0.087 0.100 1.00 0.00 H new ATOM 0 HB2 LEU A 139 6.052 0.476 -0.732 1.00 0.00 H new ATOM 0 HB3 LEU A 139 6.110 -0.784 0.485 1.00 0.00 H new ATOM 0 HG LEU A 139 5.954 -2.349 -1.675 1.00 0.00 H new ATOM 0 HD11 LEU A 139 7.390 -1.478 -3.508 1.00 0.00 H new ATOM 0 HD12 LEU A 139 5.884 -0.545 -3.338 1.00 0.00 H new ATOM 0 HD13 LEU A 139 7.415 0.115 -2.716 1.00 0.00 H new ATOM 0 HD21 LEU A 139 8.477 -2.479 -1.583 1.00 0.00 H new ATOM 0 HD22 LEU A 139 8.501 -0.935 -0.698 1.00 0.00 H new ATOM 0 HD23 LEU A 139 7.766 -2.375 0.045 1.00 0.00 H new ATOM 2074 N GLU A 140 3.302 0.832 -2.232 1.00 0.00 N ATOM 2075 CA GLU A 140 2.683 1.275 -3.470 1.00 0.00 C ATOM 2076 C GLU A 140 3.031 2.744 -3.723 1.00 0.00 C ATOM 2077 O GLU A 140 3.499 3.441 -2.823 1.00 0.00 O ATOM 2078 CB GLU A 140 1.168 1.004 -3.429 1.00 0.00 C ATOM 2079 CG GLU A 140 0.430 1.529 -2.188 1.00 0.00 C ATOM 2080 CD GLU A 140 -1.054 1.156 -2.228 1.00 0.00 C ATOM 2081 OE1 GLU A 140 -1.387 -0.022 -2.507 1.00 0.00 O ATOM 2082 OE2 GLU A 140 -1.900 2.052 -2.006 1.00 0.00 O ATOM 0 H GLU A 140 3.446 1.592 -1.567 1.00 0.00 H new ATOM 0 HA GLU A 140 3.075 0.708 -4.315 1.00 0.00 H new ATOM 0 HB2 GLU A 140 0.714 1.449 -4.314 1.00 0.00 H new ATOM 0 HB3 GLU A 140 1.008 -0.072 -3.496 1.00 0.00 H new ATOM 0 HG2 GLU A 140 0.887 1.117 -1.288 1.00 0.00 H new ATOM 0 HG3 GLU A 140 0.534 2.613 -2.131 1.00 0.00 H new ATOM 2089 N TYR A 141 2.864 3.203 -4.964 1.00 0.00 N ATOM 2090 CA TYR A 141 3.427 4.464 -5.429 1.00 0.00 C ATOM 2091 C TYR A 141 2.614 5.035 -6.591 1.00 0.00 C ATOM 2092 O TYR A 141 1.985 4.291 -7.346 1.00 0.00 O ATOM 2093 CB TYR A 141 4.892 4.236 -5.850 1.00 0.00 C ATOM 2094 CG TYR A 141 5.108 2.993 -6.702 1.00 0.00 C ATOM 2095 CD1 TYR A 141 4.824 3.020 -8.081 1.00 0.00 C ATOM 2096 CD2 TYR A 141 5.513 1.786 -6.095 1.00 0.00 C ATOM 2097 CE1 TYR A 141 4.928 1.847 -8.848 1.00 0.00 C ATOM 2098 CE2 TYR A 141 5.610 0.605 -6.852 1.00 0.00 C ATOM 2099 CZ TYR A 141 5.310 0.632 -8.235 1.00 0.00 C ATOM 2100 OH TYR A 141 5.358 -0.507 -8.980 1.00 0.00 O ATOM 0 H TYR A 141 2.331 2.705 -5.676 1.00 0.00 H new ATOM 0 HA TYR A 141 3.390 5.191 -4.618 1.00 0.00 H new ATOM 0 HB2 TYR A 141 5.239 5.108 -6.404 1.00 0.00 H new ATOM 0 HB3 TYR A 141 5.509 4.161 -4.954 1.00 0.00 H new ATOM 0 HD1 TYR A 141 4.525 3.945 -8.551 1.00 0.00 H new ATOM 0 HD2 TYR A 141 5.750 1.769 -5.042 1.00 0.00 H new ATOM 0 HE1 TYR A 141 4.716 1.874 -9.907 1.00 0.00 H new ATOM 0 HE2 TYR A 141 5.912 -0.318 -6.380 1.00 0.00 H new ATOM 0 HH TYR A 141 5.639 -1.256 -8.414 1.00 0.00 H new ATOM 2110 N GLN A 142 2.686 6.359 -6.752 1.00 0.00 N ATOM 2111 CA GLN A 142 2.059 7.138 -7.823 1.00 0.00 C ATOM 2112 C GLN A 142 3.077 8.184 -8.280 1.00 0.00 C ATOM 2113 O GLN A 142 3.988 8.510 -7.520 1.00 0.00 O ATOM 2114 CB GLN A 142 0.744 7.770 -7.308 1.00 0.00 C ATOM 2115 CG GLN A 142 0.055 8.730 -8.290 1.00 0.00 C ATOM 2116 CD GLN A 142 -1.415 8.991 -7.961 1.00 0.00 C ATOM 2117 OE1 GLN A 142 -2.286 8.680 -8.758 1.00 0.00 O ATOM 2118 NE2 GLN A 142 -1.757 9.604 -6.837 1.00 0.00 N ATOM 0 H GLN A 142 3.211 6.947 -6.105 1.00 0.00 H new ATOM 0 HA GLN A 142 1.788 6.514 -8.674 1.00 0.00 H new ATOM 0 HB2 GLN A 142 0.048 6.970 -7.058 1.00 0.00 H new ATOM 0 HB3 GLN A 142 0.955 8.309 -6.385 1.00 0.00 H new ATOM 0 HG2 GLN A 142 0.592 9.679 -8.294 1.00 0.00 H new ATOM 0 HG3 GLN A 142 0.126 8.319 -9.297 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -1.040 9.869 -6.162 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -2.738 9.810 -6.647 1.00 0.00 H new ATOM 2127 N PHE A 143 2.906 8.733 -9.489 1.00 0.00 N ATOM 2128 CA PHE A 143 3.787 9.730 -10.086 1.00 0.00 C ATOM 2129 C PHE A 143 2.923 10.805 -10.749 1.00 0.00 C ATOM 2130 O PHE A 143 1.981 10.457 -11.461 1.00 0.00 O ATOM 2131 CB PHE A 143 4.705 9.065 -11.125 1.00 0.00 C ATOM 2132 CG PHE A 143 5.402 7.795 -10.662 1.00 0.00 C ATOM 2133 CD1 PHE A 143 6.321 7.835 -9.597 1.00 0.00 C ATOM 2134 CD2 PHE A 143 5.110 6.564 -11.283 1.00 0.00 C ATOM 2135 CE1 PHE A 143 6.940 6.653 -9.152 1.00 0.00 C ATOM 2136 CE2 PHE A 143 5.735 5.384 -10.844 1.00 0.00 C ATOM 2137 CZ PHE A 143 6.651 5.428 -9.778 1.00 0.00 C ATOM 0 H PHE A 143 2.123 8.484 -10.094 1.00 0.00 H new ATOM 0 HA PHE A 143 4.414 10.184 -9.319 1.00 0.00 H new ATOM 0 HB2 PHE A 143 4.114 8.833 -12.011 1.00 0.00 H new ATOM 0 HB3 PHE A 143 5.464 9.786 -11.428 1.00 0.00 H new ATOM 0 HD1 PHE A 143 6.552 8.776 -9.120 1.00 0.00 H new ATOM 0 HD2 PHE A 143 4.404 6.527 -12.099 1.00 0.00 H new ATOM 0 HE1 PHE A 143 7.638 6.687 -8.329 1.00 0.00 H new ATOM 0 HE2 PHE A 143 5.512 4.443 -11.325 1.00 0.00 H new ATOM 0 HZ PHE A 143 7.132 4.522 -9.441 1.00 0.00 H new ATOM 2372 N GLY A 160 3.719 12.810 -6.836 1.00 0.00 N ATOM 2373 CA GLY A 160 4.190 11.434 -6.792 1.00 0.00 C ATOM 2374 C GLY A 160 4.289 10.936 -5.354 1.00 0.00 C ATOM 2375 O GLY A 160 5.004 11.530 -4.547 1.00 0.00 O ATOM 0 HA2 GLY A 160 3.510 10.795 -7.356 1.00 0.00 H new ATOM 0 HA3 GLY A 160 5.166 11.364 -7.273 1.00 0.00 H new ATOM 2379 N MET A 161 3.537 9.880 -5.025 1.00 0.00 N ATOM 2380 CA MET A 161 3.377 9.383 -3.660 1.00 0.00 C ATOM 2381 C MET A 161 4.173 8.099 -3.476 1.00 0.00 C ATOM 2382 O MET A 161 4.412 7.369 -4.447 1.00 0.00 O ATOM 2383 CB MET A 161 1.886 9.154 -3.323 1.00 0.00 C ATOM 2384 CG MET A 161 1.365 7.758 -3.686 1.00 0.00 C ATOM 2385 SD MET A 161 -0.435 7.579 -3.777 1.00 0.00 S ATOM 2386 CE MET A 161 -0.518 5.785 -4.019 1.00 0.00 C ATOM 0 H MET A 161 3.015 9.339 -5.714 1.00 0.00 H new ATOM 0 HA MET A 161 3.761 10.136 -2.972 1.00 0.00 H new ATOM 0 HB2 MET A 161 1.737 9.319 -2.256 1.00 0.00 H new ATOM 0 HB3 MET A 161 1.288 9.900 -3.847 1.00 0.00 H new ATOM 0 HG2 MET A 161 1.787 7.474 -4.650 1.00 0.00 H new ATOM 0 HG3 MET A 161 1.744 7.048 -2.950 1.00 0.00 H new ATOM 0 HE1 MET A 161 -1.560 5.476 -4.099 1.00 0.00 H new ATOM 0 HE2 MET A 161 0.011 5.516 -4.933 1.00 0.00 H new ATOM 0 HE3 MET A 161 -0.055 5.282 -3.170 1.00 0.00 H new ATOM 2396 N LEU A 162 4.463 7.786 -2.211 1.00 0.00 N ATOM 2397 CA LEU A 162 4.917 6.485 -1.758 1.00 0.00 C ATOM 2398 C LEU A 162 4.065 6.164 -0.537 1.00 0.00 C ATOM 2399 O LEU A 162 4.112 6.894 0.450 1.00 0.00 O ATOM 2400 CB LEU A 162 6.414 6.484 -1.399 1.00 0.00 C ATOM 2401 CG LEU A 162 7.368 6.588 -2.609 1.00 0.00 C ATOM 2402 CD1 LEU A 162 7.724 8.041 -2.960 1.00 0.00 C ATOM 2403 CD2 LEU A 162 8.674 5.838 -2.310 1.00 0.00 C ATOM 0 H LEU A 162 4.382 8.462 -1.452 1.00 0.00 H new ATOM 0 HA LEU A 162 4.808 5.739 -2.545 1.00 0.00 H new ATOM 0 HB2 LEU A 162 6.612 7.317 -0.725 1.00 0.00 H new ATOM 0 HB3 LEU A 162 6.642 5.569 -0.852 1.00 0.00 H new ATOM 0 HG LEU A 162 6.843 6.147 -3.457 1.00 0.00 H new ATOM 0 HD11 LEU A 162 8.397 8.054 -3.818 1.00 0.00 H new ATOM 0 HD12 LEU A 162 6.814 8.590 -3.204 1.00 0.00 H new ATOM 0 HD13 LEU A 162 8.214 8.512 -2.108 1.00 0.00 H new ATOM 0 HD21 LEU A 162 9.342 5.915 -3.168 1.00 0.00 H new ATOM 0 HD22 LEU A 162 9.154 6.277 -1.435 1.00 0.00 H new ATOM 0 HD23 LEU A 162 8.454 4.788 -2.115 1.00 0.00 H new ATOM 2415 N SER A 163 3.271 5.101 -0.602 1.00 0.00 N ATOM 2416 CA SER A 163 2.332 4.726 0.446 1.00 0.00 C ATOM 2417 C SER A 163 2.557 3.244 0.780 1.00 0.00 C ATOM 2418 O SER A 163 3.190 2.510 0.017 1.00 0.00 O ATOM 2419 CB SER A 163 0.892 5.079 0.007 1.00 0.00 C ATOM 2420 OG SER A 163 0.810 6.267 -0.778 1.00 0.00 O ATOM 0 H SER A 163 3.263 4.465 -1.399 1.00 0.00 H new ATOM 0 HA SER A 163 2.496 5.287 1.366 1.00 0.00 H new ATOM 0 HB2 SER A 163 0.481 4.247 -0.564 1.00 0.00 H new ATOM 0 HB3 SER A 163 0.269 5.196 0.894 1.00 0.00 H new ATOM 0 HG SER A 163 -0.124 6.433 -1.024 1.00 0.00 H new ATOM 2426 N LEU A 164 2.097 2.798 1.949 1.00 0.00 N ATOM 2427 CA LEU A 164 2.388 1.484 2.516 1.00 0.00 C ATOM 2428 C LEU A 164 1.175 0.952 3.265 1.00 0.00 C ATOM 2429 O LEU A 164 0.223 1.689 3.514 1.00 0.00 O ATOM 2430 CB LEU A 164 3.651 1.554 3.400 1.00 0.00 C ATOM 2431 CG LEU A 164 3.586 2.487 4.635 1.00 0.00 C ATOM 2432 CD1 LEU A 164 2.854 1.868 5.839 1.00 0.00 C ATOM 2433 CD2 LEU A 164 5.015 2.833 5.078 1.00 0.00 C ATOM 0 H LEU A 164 1.492 3.361 2.546 1.00 0.00 H new ATOM 0 HA LEU A 164 2.599 0.778 1.713 1.00 0.00 H new ATOM 0 HB2 LEU A 164 3.880 0.546 3.747 1.00 0.00 H new ATOM 0 HB3 LEU A 164 4.486 1.873 2.776 1.00 0.00 H new ATOM 0 HG LEU A 164 3.024 3.368 4.326 1.00 0.00 H new ATOM 0 HD11 LEU A 164 2.848 2.578 6.666 1.00 0.00 H new ATOM 0 HD12 LEU A 164 1.828 1.630 5.558 1.00 0.00 H new ATOM 0 HD13 LEU A 164 3.367 0.957 6.147 1.00 0.00 H new ATOM 0 HD21 LEU A 164 4.978 3.490 5.947 1.00 0.00 H new ATOM 0 HD22 LEU A 164 5.547 1.918 5.337 1.00 0.00 H new ATOM 0 HD23 LEU A 164 5.536 3.337 4.264 1.00 0.00 H new ATOM 2445 N GLY A 165 1.181 -0.334 3.614 1.00 0.00 N ATOM 2446 CA GLY A 165 0.070 -0.913 4.356 1.00 0.00 C ATOM 2447 C GLY A 165 0.387 -2.255 4.984 1.00 0.00 C ATOM 2448 O GLY A 165 1.437 -2.836 4.715 1.00 0.00 O ATOM 0 H GLY A 165 1.935 -0.986 3.396 1.00 0.00 H new ATOM 0 HA2 GLY A 165 -0.233 -0.218 5.139 1.00 0.00 H new ATOM 0 HA3 GLY A 165 -0.782 -1.028 3.686 1.00 0.00 H new ATOM 2452 N VAL A 166 -0.580 -2.763 5.753 1.00 0.00 N ATOM 2453 CA VAL A 166 -0.659 -4.160 6.171 1.00 0.00 C ATOM 2454 C VAL A 166 -2.078 -4.668 5.901 1.00 0.00 C ATOM 2455 O VAL A 166 -3.030 -3.878 5.962 1.00 0.00 O ATOM 2456 CB VAL A 166 -0.235 -4.344 7.645 1.00 0.00 C ATOM 2457 CG1 VAL A 166 1.272 -4.115 7.821 1.00 0.00 C ATOM 2458 CG2 VAL A 166 -1.006 -3.434 8.619 1.00 0.00 C ATOM 0 H VAL A 166 -1.349 -2.196 6.110 1.00 0.00 H new ATOM 0 HA VAL A 166 0.046 -4.756 5.592 1.00 0.00 H new ATOM 0 HB VAL A 166 -0.484 -5.376 7.894 1.00 0.00 H new ATOM 0 HG11 VAL A 166 1.541 -4.251 8.868 1.00 0.00 H new ATOM 0 HG12 VAL A 166 1.823 -4.830 7.209 1.00 0.00 H new ATOM 0 HG13 VAL A 166 1.525 -3.101 7.511 1.00 0.00 H new ATOM 0 HG21 VAL A 166 -0.659 -3.614 9.637 1.00 0.00 H new ATOM 0 HG22 VAL A 166 -0.833 -2.390 8.356 1.00 0.00 H new ATOM 0 HG23 VAL A 166 -2.072 -3.653 8.555 1.00 0.00 H new ATOM 2468 N SER A 167 -2.230 -5.963 5.597 1.00 0.00 N ATOM 2469 CA SER A 167 -3.485 -6.521 5.113 1.00 0.00 C ATOM 2470 C SER A 167 -3.613 -7.940 5.663 1.00 0.00 C ATOM 2471 O SER A 167 -2.773 -8.784 5.372 1.00 0.00 O ATOM 2472 CB SER A 167 -3.490 -6.503 3.574 1.00 0.00 C ATOM 2473 OG SER A 167 -3.418 -5.181 3.055 1.00 0.00 O ATOM 0 H SER A 167 -1.480 -6.649 5.682 1.00 0.00 H new ATOM 0 HA SER A 167 -4.338 -5.933 5.451 1.00 0.00 H new ATOM 0 HB2 SER A 167 -2.646 -7.085 3.202 1.00 0.00 H new ATOM 0 HB3 SER A 167 -4.396 -6.987 3.209 1.00 0.00 H new ATOM 0 HG SER A 167 -3.052 -5.206 2.146 1.00 0.00 H new ATOM 2479 N TYR A 168 -4.648 -8.209 6.459 1.00 0.00 N ATOM 2480 CA TYR A 168 -5.014 -9.540 6.912 1.00 0.00 C ATOM 2481 C TYR A 168 -5.829 -10.166 5.785 1.00 0.00 C ATOM 2482 O TYR A 168 -6.813 -9.581 5.331 1.00 0.00 O ATOM 2483 CB TYR A 168 -5.826 -9.467 8.221 1.00 0.00 C ATOM 2484 CG TYR A 168 -5.713 -10.717 9.084 1.00 0.00 C ATOM 2485 CD1 TYR A 168 -6.238 -11.951 8.647 1.00 0.00 C ATOM 2486 CD2 TYR A 168 -5.018 -10.655 10.308 1.00 0.00 C ATOM 2487 CE1 TYR A 168 -6.000 -13.128 9.382 1.00 0.00 C ATOM 2488 CE2 TYR A 168 -4.779 -11.826 11.049 1.00 0.00 C ATOM 2489 CZ TYR A 168 -5.237 -13.074 10.571 1.00 0.00 C ATOM 2490 OH TYR A 168 -4.918 -14.202 11.267 1.00 0.00 O ATOM 0 H TYR A 168 -5.269 -7.482 6.814 1.00 0.00 H new ATOM 0 HA TYR A 168 -4.133 -10.142 7.132 1.00 0.00 H new ATOM 0 HB2 TYR A 168 -5.490 -8.606 8.799 1.00 0.00 H new ATOM 0 HB3 TYR A 168 -6.875 -9.298 7.978 1.00 0.00 H new ATOM 0 HD1 TYR A 168 -6.827 -11.993 7.742 1.00 0.00 H new ATOM 0 HD2 TYR A 168 -4.667 -9.703 10.679 1.00 0.00 H new ATOM 0 HE1 TYR A 168 -6.400 -14.071 9.038 1.00 0.00 H new ATOM 0 HE2 TYR A 168 -4.244 -11.771 11.986 1.00 0.00 H new ATOM 0 HH TYR A 168 -5.410 -14.965 10.898 1.00 0.00 H new ATOM 2500 N ARG A 169 -5.387 -11.328 5.306 1.00 0.00 N ATOM 2501 CA ARG A 169 -6.006 -12.100 4.240 1.00 0.00 C ATOM 2502 C ARG A 169 -6.998 -13.049 4.904 1.00 0.00 C ATOM 2503 O ARG A 169 -6.619 -13.796 5.804 1.00 0.00 O ATOM 2504 CB ARG A 169 -4.886 -12.831 3.478 1.00 0.00 C ATOM 2505 CG ARG A 169 -5.333 -13.548 2.194 1.00 0.00 C ATOM 2506 CD ARG A 169 -6.083 -14.870 2.401 1.00 0.00 C ATOM 2507 NE ARG A 169 -5.285 -15.872 3.120 1.00 0.00 N ATOM 2508 CZ ARG A 169 -5.659 -17.134 3.354 1.00 0.00 C ATOM 2509 NH1 ARG A 169 -6.926 -17.524 3.237 1.00 0.00 N ATOM 2510 NH2 ARG A 169 -4.728 -18.008 3.700 1.00 0.00 N ATOM 0 H ARG A 169 -4.546 -11.775 5.672 1.00 0.00 H new ATOM 0 HA ARG A 169 -6.547 -11.491 3.516 1.00 0.00 H new ATOM 0 HB2 ARG A 169 -4.111 -12.109 3.222 1.00 0.00 H new ATOM 0 HB3 ARG A 169 -4.431 -13.563 4.145 1.00 0.00 H new ATOM 0 HG2 ARG A 169 -5.973 -12.873 1.626 1.00 0.00 H new ATOM 0 HG3 ARG A 169 -4.452 -13.742 1.582 1.00 0.00 H new ATOM 0 HD2 ARG A 169 -7.002 -14.678 2.956 1.00 0.00 H new ATOM 0 HD3 ARG A 169 -6.374 -15.273 1.431 1.00 0.00 H new ATOM 0 HE ARG A 169 -4.372 -15.581 3.469 1.00 0.00 H new ATOM 0 HH11 ARG A 169 -7.643 -16.853 2.962 1.00 0.00 H new ATOM 0 HH12 ARG A 169 -7.180 -18.494 3.422 1.00 0.00 H new ATOM 0 HH21 ARG A 169 -3.755 -17.712 3.782 1.00 0.00 H new ATOM 0 HH22 ARG A 169 -4.983 -18.978 3.885 1.00 0.00 H new ATOM 2524 N PHE A 170 -8.265 -13.010 4.482 1.00 0.00 N ATOM 2525 CA PHE A 170 -9.339 -13.786 5.085 1.00 0.00 C ATOM 2526 C PHE A 170 -9.034 -15.286 5.015 1.00 0.00 C ATOM 2527 O PHE A 170 -8.960 -15.867 3.928 1.00 0.00 O ATOM 2528 CB PHE A 170 -10.666 -13.448 4.397 1.00 0.00 C ATOM 2529 CG PHE A 170 -11.870 -14.143 5.003 1.00 0.00 C ATOM 2530 CD1 PHE A 170 -12.544 -13.563 6.095 1.00 0.00 C ATOM 2531 CD2 PHE A 170 -12.312 -15.375 4.484 1.00 0.00 C ATOM 2532 CE1 PHE A 170 -13.657 -14.210 6.661 1.00 0.00 C ATOM 2533 CE2 PHE A 170 -13.424 -16.022 5.051 1.00 0.00 C ATOM 2534 CZ PHE A 170 -14.098 -15.439 6.139 1.00 0.00 C ATOM 0 H PHE A 170 -8.572 -12.429 3.702 1.00 0.00 H new ATOM 0 HA PHE A 170 -9.421 -13.524 6.140 1.00 0.00 H new ATOM 0 HB2 PHE A 170 -10.822 -12.370 4.441 1.00 0.00 H new ATOM 0 HB3 PHE A 170 -10.596 -13.718 3.343 1.00 0.00 H new ATOM 0 HD1 PHE A 170 -12.206 -12.620 6.498 1.00 0.00 H new ATOM 0 HD2 PHE A 170 -11.796 -15.824 3.648 1.00 0.00 H new ATOM 0 HE1 PHE A 170 -14.174 -13.763 7.497 1.00 0.00 H new ATOM 0 HE2 PHE A 170 -13.761 -16.967 4.651 1.00 0.00 H new ATOM 0 HZ PHE A 170 -14.954 -15.935 6.573 1.00 0.00 H new