USER MOD reduce.3.24.130724 H: found=0, std=0, add=918, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 920 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 124 MET CE :methyl -129:sc= -2.58 (180deg=-5.53!) USER MOD Set 1.2: A 144 MET CE :methyl -115:sc= 0 (180deg=-0.0727) USER MOD Set 2.1: A 94 LYS NZ :NH3+ -132:sc= 0.0238 (180deg=0) USER MOD Set 2.2: A 107 HIS : no HD1:sc= -2.4! K(o=-2.4!,f=-1.3) USER MOD Set 3.1: A 60 ASN : amide:sc= -2.97 K(o=-3.5,f=-2.6!) USER MOD Set 3.2: A 62 THR OG1 : rot -168:sc= -0.553 USER MOD Set 4.1: A 36 MET CE :methyl 150:sc= -1.62 (180deg=-3.38!) USER MOD Set 4.2: A 51 MET CE :methyl -164:sc=-0.00958 (180deg=-0.178) USER MOD Single : A 13 LYS NZ :NH3+ -116:sc= -0.662 (180deg=-1.65!) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ -167:sc= 1.12 (180deg=0.507) USER MOD Single : A 26 THR OG1 : rot -75:sc= 1.14 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.215 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 93:sc= 0.142 USER MOD Single : A 41 GLN : amide:sc= -0.118 K(o=-0.12,f=-2!) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0.38) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.929 USER MOD Single : A 49 GLN : amide:sc= -1.16 K(o=-1.2,f=-0.098) USER MOD Single : A 53 ASN : amide:sc= 0.82 K(o=0.82,f=-0.25) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl -165:sc= -2.26! (180deg=-2.56!) USER MOD Single : A 72 MET CE :methyl -154:sc= -0.196 (180deg=-0.778) USER MOD Single : A 97 ASN : amide:sc= -2.12 K(o=-2.1,f=-3.6!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl -168:sc= -3.5! (180deg=-4.01!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 115 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00767) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 ASN : amide:sc= -1.99! C(o=-2!,f=-7.5!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 145 MET CE :methyl -163:sc= -0.12 (180deg=-0.658) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 120 N ILE A 9 -7.123 -2.620 -7.956 1.00 0.00 N ATOM 121 CA ILE A 9 -6.358 -3.854 -8.086 1.00 0.00 C ATOM 122 C ILE A 9 -5.877 -4.054 -9.519 1.00 0.00 C ATOM 123 O ILE A 9 -4.732 -4.439 -9.753 1.00 0.00 O ATOM 124 CB ILE A 9 -7.188 -5.079 -7.659 1.00 0.00 C ATOM 125 CG1 ILE A 9 -7.568 -4.975 -6.181 1.00 0.00 C ATOM 126 CG2 ILE A 9 -6.414 -6.361 -7.924 1.00 0.00 C ATOM 127 CD1 ILE A 9 -8.428 -6.121 -5.696 1.00 0.00 C ATOM 0 HA ILE A 9 -5.496 -3.762 -7.425 1.00 0.00 H new ATOM 0 HB ILE A 9 -8.104 -5.102 -8.249 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -6.658 -4.936 -5.582 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -8.099 -4.038 -6.016 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -7.014 -7.218 -7.617 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -6.190 -6.437 -8.988 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -5.483 -6.348 -7.357 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -8.659 -5.981 -4.640 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -9.355 -6.148 -6.269 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -7.891 -7.060 -5.829 1.00 0.00 H new ATOM 139 N ALA A 10 -6.760 -3.787 -10.476 1.00 0.00 N ATOM 140 CA ALA A 10 -6.425 -3.934 -11.887 1.00 0.00 C ATOM 141 C ALA A 10 -5.254 -3.035 -12.270 1.00 0.00 C ATOM 142 O ALA A 10 -4.353 -3.451 -12.998 1.00 0.00 O ATOM 143 CB ALA A 10 -7.637 -3.621 -12.753 1.00 0.00 C ATOM 0 H ALA A 10 -7.713 -3.468 -10.300 1.00 0.00 H new ATOM 0 HA ALA A 10 -6.127 -4.968 -12.058 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -7.372 -3.735 -13.804 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -8.447 -4.307 -12.507 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -7.961 -2.597 -12.569 1.00 0.00 H new ATOM 149 N GLU A 11 -5.274 -1.802 -11.774 1.00 0.00 N ATOM 150 CA GLU A 11 -4.213 -0.845 -12.066 1.00 0.00 C ATOM 151 C GLU A 11 -2.925 -1.222 -11.340 1.00 0.00 C ATOM 152 O GLU A 11 -1.840 -1.195 -11.921 1.00 0.00 O ATOM 153 CB GLU A 11 -4.644 0.567 -11.664 1.00 0.00 C ATOM 154 CG GLU A 11 -5.801 1.107 -12.487 1.00 0.00 C ATOM 155 CD GLU A 11 -5.340 1.842 -13.731 1.00 0.00 C ATOM 156 OE1 GLU A 11 -4.868 2.990 -13.600 1.00 0.00 O ATOM 157 OE2 GLU A 11 -5.452 1.269 -14.834 1.00 0.00 O ATOM 0 H GLU A 11 -6.012 -1.443 -11.169 1.00 0.00 H new ATOM 0 HA GLU A 11 -4.024 -0.867 -13.139 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -4.927 0.566 -10.611 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -3.793 1.240 -11.764 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -6.452 0.282 -12.777 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -6.396 1.781 -11.871 1.00 0.00 H new ATOM 164 N PHE A 12 -3.053 -1.572 -10.064 1.00 0.00 N ATOM 165 CA PHE A 12 -1.900 -1.953 -9.257 1.00 0.00 C ATOM 166 C PHE A 12 -1.259 -3.230 -9.792 1.00 0.00 C ATOM 167 O PHE A 12 -0.046 -3.419 -9.692 1.00 0.00 O ATOM 168 CB PHE A 12 -2.316 -2.152 -7.797 1.00 0.00 C ATOM 169 CG PHE A 12 -2.379 -0.872 -7.013 1.00 0.00 C ATOM 170 CD1 PHE A 12 -1.256 -0.386 -6.364 1.00 0.00 C ATOM 171 CD2 PHE A 12 -3.562 -0.156 -6.925 1.00 0.00 C ATOM 172 CE1 PHE A 12 -1.312 0.790 -5.641 1.00 0.00 C ATOM 173 CE2 PHE A 12 -3.624 1.021 -6.203 1.00 0.00 C ATOM 174 CZ PHE A 12 -2.497 1.496 -5.561 1.00 0.00 C ATOM 0 H PHE A 12 -3.943 -1.600 -9.567 1.00 0.00 H new ATOM 0 HA PHE A 12 -1.167 -1.148 -9.313 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -3.293 -2.635 -7.768 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -1.611 -2.830 -7.316 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -0.326 -0.932 -6.424 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -4.446 -0.522 -7.426 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -0.430 1.157 -5.138 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -4.553 1.569 -6.141 1.00 0.00 H new ATOM 0 HZ PHE A 12 -2.542 2.417 -4.998 1.00 0.00 H new ATOM 184 N LYS A 13 -2.081 -4.105 -10.361 1.00 0.00 N ATOM 185 CA LYS A 13 -1.597 -5.364 -10.914 1.00 0.00 C ATOM 186 C LYS A 13 -0.590 -5.115 -12.032 1.00 0.00 C ATOM 187 O LYS A 13 0.535 -5.612 -11.988 1.00 0.00 O ATOM 188 CB LYS A 13 -2.767 -6.196 -11.442 1.00 0.00 C ATOM 189 CG LYS A 13 -2.454 -7.678 -11.564 1.00 0.00 C ATOM 190 CD LYS A 13 -3.698 -8.528 -11.373 1.00 0.00 C ATOM 191 CE LYS A 13 -4.640 -8.413 -12.562 1.00 0.00 C ATOM 192 NZ LYS A 13 -5.670 -7.358 -12.354 1.00 0.00 N ATOM 0 H LYS A 13 -3.087 -3.965 -10.451 1.00 0.00 H new ATOM 0 HA LYS A 13 -1.099 -5.915 -10.116 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -3.622 -6.067 -10.778 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -3.062 -5.814 -12.419 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -2.021 -7.880 -12.544 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -1.705 -7.955 -10.822 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -3.410 -9.570 -11.235 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -4.216 -8.218 -10.466 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -4.065 -8.187 -13.460 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -5.131 -9.372 -12.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -6.613 -7.795 -12.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -5.488 -6.867 -11.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -5.629 -6.674 -13.137 1.00 0.00 H new ATOM 206 N GLU A 14 -1.002 -4.342 -13.032 1.00 0.00 N ATOM 207 CA GLU A 14 -0.134 -4.028 -14.161 1.00 0.00 C ATOM 208 C GLU A 14 1.226 -3.531 -13.681 1.00 0.00 C ATOM 209 O GLU A 14 2.260 -3.867 -14.256 1.00 0.00 O ATOM 210 CB GLU A 14 -0.788 -2.973 -15.057 1.00 0.00 C ATOM 211 CG GLU A 14 -2.136 -3.398 -15.613 1.00 0.00 C ATOM 212 CD GLU A 14 -2.011 -4.343 -16.792 1.00 0.00 C ATOM 213 OE1 GLU A 14 -0.984 -4.276 -17.499 1.00 0.00 O ATOM 214 OE2 GLU A 14 -2.940 -5.149 -17.007 1.00 0.00 O ATOM 0 H GLU A 14 -1.930 -3.922 -13.083 1.00 0.00 H new ATOM 0 HA GLU A 14 0.016 -4.942 -14.736 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -0.913 -2.052 -14.488 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -0.118 -2.746 -15.886 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -2.713 -3.881 -14.825 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -2.693 -2.513 -15.920 1.00 0.00 H new ATOM 221 N ALA A 15 1.215 -2.728 -12.622 1.00 0.00 N ATOM 222 CA ALA A 15 2.447 -2.185 -12.062 1.00 0.00 C ATOM 223 C ALA A 15 3.291 -3.284 -11.424 1.00 0.00 C ATOM 224 O ALA A 15 4.505 -3.140 -11.275 1.00 0.00 O ATOM 225 CB ALA A 15 2.131 -1.101 -11.042 1.00 0.00 C ATOM 0 H ALA A 15 0.367 -2.439 -12.135 1.00 0.00 H new ATOM 0 HA ALA A 15 3.024 -1.746 -12.876 1.00 0.00 H new ATOM 0 HB1 ALA A 15 3.060 -0.705 -10.632 1.00 0.00 H new ATOM 0 HB2 ALA A 15 1.576 -0.297 -11.525 1.00 0.00 H new ATOM 0 HB3 ALA A 15 1.530 -1.523 -10.236 1.00 0.00 H new ATOM 231 N PHE A 16 2.641 -4.381 -11.050 1.00 0.00 N ATOM 232 CA PHE A 16 3.332 -5.504 -10.427 1.00 0.00 C ATOM 233 C PHE A 16 3.511 -6.650 -11.418 1.00 0.00 C ATOM 234 O PHE A 16 4.112 -7.675 -11.096 1.00 0.00 O ATOM 235 CB PHE A 16 2.556 -5.991 -9.201 1.00 0.00 C ATOM 236 CG PHE A 16 3.219 -7.133 -8.487 1.00 0.00 C ATOM 237 CD1 PHE A 16 2.963 -8.443 -8.859 1.00 0.00 C ATOM 238 CD2 PHE A 16 4.099 -6.898 -7.443 1.00 0.00 C ATOM 239 CE1 PHE A 16 3.571 -9.497 -8.204 1.00 0.00 C ATOM 240 CE2 PHE A 16 4.712 -7.948 -6.785 1.00 0.00 C ATOM 241 CZ PHE A 16 4.446 -9.249 -7.165 1.00 0.00 C ATOM 0 H PHE A 16 1.637 -4.516 -11.167 1.00 0.00 H new ATOM 0 HA PHE A 16 4.318 -5.162 -10.112 1.00 0.00 H new ATOM 0 HB2 PHE A 16 2.433 -5.161 -8.506 1.00 0.00 H new ATOM 0 HB3 PHE A 16 1.557 -6.298 -9.511 1.00 0.00 H new ATOM 0 HD1 PHE A 16 2.280 -8.643 -9.671 1.00 0.00 H new ATOM 0 HD2 PHE A 16 4.309 -5.883 -7.140 1.00 0.00 H new ATOM 0 HE1 PHE A 16 3.362 -10.513 -8.504 1.00 0.00 H new ATOM 0 HE2 PHE A 16 5.398 -7.751 -5.975 1.00 0.00 H new ATOM 0 HZ PHE A 16 4.922 -10.071 -6.650 1.00 0.00 H new ATOM 251 N SER A 17 2.985 -6.468 -12.625 1.00 0.00 N ATOM 252 CA SER A 17 3.082 -7.488 -13.662 1.00 0.00 C ATOM 253 C SER A 17 4.282 -7.229 -14.568 1.00 0.00 C ATOM 254 O SER A 17 4.853 -8.157 -15.142 1.00 0.00 O ATOM 255 CB SER A 17 1.799 -7.524 -14.494 1.00 0.00 C ATOM 256 OG SER A 17 0.858 -8.428 -13.942 1.00 0.00 O ATOM 0 H SER A 17 2.487 -5.624 -12.909 1.00 0.00 H new ATOM 0 HA SER A 17 3.218 -8.454 -13.175 1.00 0.00 H new ATOM 0 HB2 SER A 17 1.364 -6.526 -14.541 1.00 0.00 H new ATOM 0 HB3 SER A 17 2.033 -7.818 -15.517 1.00 0.00 H new ATOM 0 HG SER A 17 0.046 -8.431 -14.491 1.00 0.00 H new ATOM 262 N LEU A 18 4.659 -5.961 -14.691 1.00 0.00 N ATOM 263 CA LEU A 18 5.791 -5.577 -15.527 1.00 0.00 C ATOM 264 C LEU A 18 7.112 -5.909 -14.841 1.00 0.00 C ATOM 265 O LEU A 18 8.089 -6.274 -15.495 1.00 0.00 O ATOM 266 CB LEU A 18 5.731 -4.083 -15.847 1.00 0.00 C ATOM 267 CG LEU A 18 6.311 -3.145 -14.787 1.00 0.00 C ATOM 268 CD1 LEU A 18 6.882 -1.894 -15.436 1.00 0.00 C ATOM 269 CD2 LEU A 18 5.249 -2.779 -13.761 1.00 0.00 C ATOM 0 H LEU A 18 4.197 -5.181 -14.222 1.00 0.00 H new ATOM 0 HA LEU A 18 5.733 -6.144 -16.456 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.260 -3.911 -16.784 1.00 0.00 H new ATOM 0 HB3 LEU A 18 4.689 -3.809 -16.015 1.00 0.00 H new ATOM 0 HG LEU A 18 7.120 -3.664 -14.273 1.00 0.00 H new ATOM 0 HD11 LEU A 18 7.290 -1.239 -14.666 1.00 0.00 H new ATOM 0 HD12 LEU A 18 7.673 -2.174 -16.131 1.00 0.00 H new ATOM 0 HD13 LEU A 18 6.092 -1.372 -15.976 1.00 0.00 H new ATOM 0 HD21 LEU A 18 5.679 -2.111 -13.015 1.00 0.00 H new ATOM 0 HD22 LEU A 18 4.418 -2.279 -14.259 1.00 0.00 H new ATOM 0 HD23 LEU A 18 4.887 -3.684 -13.273 1.00 0.00 H new ATOM 281 N PHE A 19 7.134 -5.782 -13.518 1.00 0.00 N ATOM 282 CA PHE A 19 8.334 -6.070 -12.742 1.00 0.00 C ATOM 283 C PHE A 19 8.655 -7.561 -12.769 1.00 0.00 C ATOM 284 O PHE A 19 9.818 -7.956 -12.850 1.00 0.00 O ATOM 285 CB PHE A 19 8.157 -5.600 -11.296 1.00 0.00 C ATOM 286 CG PHE A 19 8.608 -4.186 -11.066 1.00 0.00 C ATOM 287 CD1 PHE A 19 9.924 -3.911 -10.730 1.00 0.00 C ATOM 288 CD2 PHE A 19 7.716 -3.133 -11.184 1.00 0.00 C ATOM 289 CE1 PHE A 19 10.342 -2.611 -10.517 1.00 0.00 C ATOM 290 CE2 PHE A 19 8.129 -1.831 -10.973 1.00 0.00 C ATOM 291 CZ PHE A 19 9.443 -1.569 -10.638 1.00 0.00 C ATOM 0 H PHE A 19 6.334 -5.481 -12.961 1.00 0.00 H new ATOM 0 HA PHE A 19 9.166 -5.530 -13.193 1.00 0.00 H new ATOM 0 HB2 PHE A 19 7.106 -5.687 -11.020 1.00 0.00 H new ATOM 0 HB3 PHE A 19 8.716 -6.263 -10.636 1.00 0.00 H new ATOM 0 HD1 PHE A 19 10.631 -4.722 -10.633 1.00 0.00 H new ATOM 0 HD2 PHE A 19 6.687 -3.331 -11.444 1.00 0.00 H new ATOM 0 HE1 PHE A 19 11.371 -2.410 -10.256 1.00 0.00 H new ATOM 0 HE2 PHE A 19 7.424 -1.018 -11.070 1.00 0.00 H new ATOM 0 HZ PHE A 19 9.767 -0.552 -10.471 1.00 0.00 H new ATOM 301 N ASP A 20 7.615 -8.385 -12.700 1.00 0.00 N ATOM 302 CA ASP A 20 7.785 -9.833 -12.717 1.00 0.00 C ATOM 303 C ASP A 20 8.171 -10.319 -14.110 1.00 0.00 C ATOM 304 O ASP A 20 7.308 -10.587 -14.947 1.00 0.00 O ATOM 305 CB ASP A 20 6.499 -10.524 -12.260 1.00 0.00 C ATOM 306 CG ASP A 20 6.731 -11.962 -11.841 1.00 0.00 C ATOM 307 OD1 ASP A 20 6.635 -12.856 -12.708 1.00 0.00 O ATOM 308 OD2 ASP A 20 7.010 -12.194 -10.646 1.00 0.00 O ATOM 0 H ASP A 20 6.646 -8.075 -12.632 1.00 0.00 H new ATOM 0 HA ASP A 20 8.590 -10.088 -12.028 1.00 0.00 H new ATOM 0 HB2 ASP A 20 6.070 -9.970 -11.425 1.00 0.00 H new ATOM 0 HB3 ASP A 20 5.769 -10.498 -13.069 1.00 0.00 H new ATOM 313 N LYS A 21 9.472 -10.430 -14.353 1.00 0.00 N ATOM 314 CA LYS A 21 9.974 -10.883 -15.645 1.00 0.00 C ATOM 315 C LYS A 21 9.913 -12.404 -15.749 1.00 0.00 C ATOM 316 O LYS A 21 9.488 -12.949 -16.768 1.00 0.00 O ATOM 317 CB LYS A 21 11.412 -10.405 -15.853 1.00 0.00 C ATOM 318 CG LYS A 21 11.592 -8.910 -15.651 1.00 0.00 C ATOM 319 CD LYS A 21 10.901 -8.113 -16.744 1.00 0.00 C ATOM 320 CE LYS A 21 11.401 -6.677 -16.788 1.00 0.00 C ATOM 321 NZ LYS A 21 10.590 -5.780 -15.920 1.00 0.00 N ATOM 0 H LYS A 21 10.199 -10.212 -13.671 1.00 0.00 H new ATOM 0 HA LYS A 21 9.340 -10.457 -16.423 1.00 0.00 H new ATOM 0 HB2 LYS A 21 12.066 -10.938 -15.163 1.00 0.00 H new ATOM 0 HB3 LYS A 21 11.731 -10.668 -16.862 1.00 0.00 H new ATOM 0 HG2 LYS A 21 11.190 -8.622 -14.680 1.00 0.00 H new ATOM 0 HG3 LYS A 21 12.655 -8.669 -15.640 1.00 0.00 H new ATOM 0 HD2 LYS A 21 11.075 -8.590 -17.709 1.00 0.00 H new ATOM 0 HD3 LYS A 21 9.824 -8.119 -16.575 1.00 0.00 H new ATOM 0 HE2 LYS A 21 12.443 -6.645 -16.470 1.00 0.00 H new ATOM 0 HE3 LYS A 21 11.370 -6.313 -17.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 10.813 -4.789 -16.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 9.579 -5.953 -16.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 10.810 -5.971 -14.922 1.00 0.00 H new ATOM 335 N ASP A 22 10.337 -13.082 -14.689 1.00 0.00 N ATOM 336 CA ASP A 22 10.328 -14.540 -14.660 1.00 0.00 C ATOM 337 C ASP A 22 8.925 -15.080 -14.915 1.00 0.00 C ATOM 338 O ASP A 22 8.744 -16.041 -15.661 1.00 0.00 O ATOM 339 CB ASP A 22 10.847 -15.048 -13.314 1.00 0.00 C ATOM 340 CG ASP A 22 10.350 -14.215 -12.150 1.00 0.00 C ATOM 341 OD1 ASP A 22 9.410 -13.416 -12.350 1.00 0.00 O ATOM 342 OD2 ASP A 22 10.899 -14.362 -11.038 1.00 0.00 O ATOM 0 H ASP A 22 10.691 -12.646 -13.838 1.00 0.00 H new ATOM 0 HA ASP A 22 10.985 -14.898 -15.452 1.00 0.00 H new ATOM 0 HB2 ASP A 22 10.535 -16.083 -13.175 1.00 0.00 H new ATOM 0 HB3 ASP A 22 11.937 -15.041 -13.322 1.00 0.00 H new ATOM 347 N GLY A 23 7.933 -14.455 -14.288 1.00 0.00 N ATOM 348 CA GLY A 23 6.558 -14.887 -14.459 1.00 0.00 C ATOM 349 C GLY A 23 6.117 -15.857 -13.380 1.00 0.00 C ATOM 350 O GLY A 23 5.480 -16.870 -13.670 1.00 0.00 O ATOM 0 H GLY A 23 8.057 -13.657 -13.665 1.00 0.00 H new ATOM 0 HA2 GLY A 23 5.903 -14.016 -14.450 1.00 0.00 H new ATOM 0 HA3 GLY A 23 6.447 -15.359 -15.435 1.00 0.00 H new ATOM 354 N ASP A 24 6.459 -15.549 -12.134 1.00 0.00 N ATOM 355 CA ASP A 24 6.094 -16.401 -11.008 1.00 0.00 C ATOM 356 C ASP A 24 5.132 -15.680 -10.070 1.00 0.00 C ATOM 357 O ASP A 24 4.113 -16.237 -9.661 1.00 0.00 O ATOM 358 CB ASP A 24 7.346 -16.833 -10.242 1.00 0.00 C ATOM 359 CG ASP A 24 8.153 -15.652 -9.740 1.00 0.00 C ATOM 360 OD1 ASP A 24 8.021 -14.554 -10.319 1.00 0.00 O ATOM 361 OD2 ASP A 24 8.919 -15.827 -8.768 1.00 0.00 O ATOM 0 H ASP A 24 6.988 -14.716 -11.878 1.00 0.00 H new ATOM 0 HA ASP A 24 5.594 -17.286 -11.401 1.00 0.00 H new ATOM 0 HB2 ASP A 24 7.054 -17.456 -9.396 1.00 0.00 H new ATOM 0 HB3 ASP A 24 7.971 -17.447 -10.890 1.00 0.00 H new ATOM 366 N GLY A 25 5.463 -14.438 -9.730 1.00 0.00 N ATOM 367 CA GLY A 25 4.618 -13.662 -8.841 1.00 0.00 C ATOM 368 C GLY A 25 5.406 -12.990 -7.734 1.00 0.00 C ATOM 369 O GLY A 25 4.840 -12.577 -6.721 1.00 0.00 O ATOM 0 H GLY A 25 6.301 -13.955 -10.054 1.00 0.00 H new ATOM 0 HA2 GLY A 25 4.088 -12.904 -9.418 1.00 0.00 H new ATOM 0 HA3 GLY A 25 3.863 -14.314 -8.402 1.00 0.00 H new ATOM 373 N THR A 26 6.717 -12.879 -7.925 1.00 0.00 N ATOM 374 CA THR A 26 7.584 -12.255 -6.933 1.00 0.00 C ATOM 375 C THR A 26 8.569 -11.296 -7.591 1.00 0.00 C ATOM 376 O THR A 26 8.990 -11.507 -8.729 1.00 0.00 O ATOM 377 CB THR A 26 8.369 -13.310 -6.131 1.00 0.00 C ATOM 378 OG1 THR A 26 9.185 -14.089 -7.012 1.00 0.00 O ATOM 379 CG2 THR A 26 7.422 -14.223 -5.367 1.00 0.00 C ATOM 0 H THR A 26 7.202 -13.213 -8.758 1.00 0.00 H new ATOM 0 HA THR A 26 6.939 -11.699 -6.253 1.00 0.00 H new ATOM 0 HB THR A 26 9.005 -12.790 -5.414 1.00 0.00 H new ATOM 0 HG1 THR A 26 8.622 -14.719 -7.508 1.00 0.00 H new ATOM 0 HG21 THR A 26 7.999 -14.960 -4.808 1.00 0.00 H new ATOM 0 HG22 THR A 26 6.824 -13.630 -4.675 1.00 0.00 H new ATOM 0 HG23 THR A 26 6.764 -14.734 -6.069 1.00 0.00 H new ATOM 387 N ILE A 27 8.934 -10.243 -6.868 1.00 0.00 N ATOM 388 CA ILE A 27 9.872 -9.252 -7.381 1.00 0.00 C ATOM 389 C ILE A 27 11.157 -9.234 -6.559 1.00 0.00 C ATOM 390 O ILE A 27 11.191 -8.695 -5.452 1.00 0.00 O ATOM 391 CB ILE A 27 9.256 -7.841 -7.383 1.00 0.00 C ATOM 392 CG1 ILE A 27 7.990 -7.815 -8.241 1.00 0.00 C ATOM 393 CG2 ILE A 27 10.267 -6.822 -7.889 1.00 0.00 C ATOM 394 CD1 ILE A 27 7.161 -6.563 -8.056 1.00 0.00 C ATOM 0 H ILE A 27 8.594 -10.054 -5.925 1.00 0.00 H new ATOM 0 HA ILE A 27 10.104 -9.539 -8.407 1.00 0.00 H new ATOM 0 HB ILE A 27 8.985 -7.577 -6.361 1.00 0.00 H new ATOM 0 HG12 ILE A 27 8.270 -7.904 -9.291 1.00 0.00 H new ATOM 0 HG13 ILE A 27 7.379 -8.685 -7.999 1.00 0.00 H new ATOM 0 HG21 ILE A 27 9.817 -5.829 -7.885 1.00 0.00 H new ATOM 0 HG22 ILE A 27 11.143 -6.826 -7.241 1.00 0.00 H new ATOM 0 HG23 ILE A 27 10.566 -7.080 -8.905 1.00 0.00 H new ATOM 0 HD11 ILE A 27 6.279 -6.613 -8.695 1.00 0.00 H new ATOM 0 HD12 ILE A 27 6.850 -6.483 -7.014 1.00 0.00 H new ATOM 0 HD13 ILE A 27 7.755 -5.690 -8.326 1.00 0.00 H new ATOM 406 N THR A 28 12.213 -9.824 -7.108 1.00 0.00 N ATOM 407 CA THR A 28 13.501 -9.875 -6.427 1.00 0.00 C ATOM 408 C THR A 28 14.422 -8.761 -6.909 1.00 0.00 C ATOM 409 O THR A 28 14.178 -8.144 -7.946 1.00 0.00 O ATOM 410 CB THR A 28 14.197 -11.232 -6.643 1.00 0.00 C ATOM 411 OG1 THR A 28 15.429 -11.272 -5.913 1.00 0.00 O ATOM 412 CG2 THR A 28 14.469 -11.472 -8.120 1.00 0.00 C ATOM 0 H THR A 28 12.202 -10.274 -8.023 1.00 0.00 H new ATOM 0 HA THR A 28 13.302 -9.743 -5.364 1.00 0.00 H new ATOM 0 HB THR A 28 13.534 -12.017 -6.280 1.00 0.00 H new ATOM 0 HG1 THR A 28 15.865 -12.138 -6.054 1.00 0.00 H new ATOM 0 HG21 THR A 28 14.961 -12.436 -8.247 1.00 0.00 H new ATOM 0 HG22 THR A 28 13.527 -11.470 -8.668 1.00 0.00 H new ATOM 0 HG23 THR A 28 15.114 -10.682 -8.504 1.00 0.00 H new ATOM 420 N THR A 29 15.484 -8.507 -6.150 1.00 0.00 N ATOM 421 CA THR A 29 16.443 -7.467 -6.500 1.00 0.00 C ATOM 422 C THR A 29 16.837 -7.554 -7.969 1.00 0.00 C ATOM 423 O THR A 29 17.244 -6.562 -8.574 1.00 0.00 O ATOM 424 CB THR A 29 17.713 -7.559 -5.633 1.00 0.00 C ATOM 425 OG1 THR A 29 18.400 -8.786 -5.899 1.00 0.00 O ATOM 426 CG2 THR A 29 17.365 -7.476 -4.154 1.00 0.00 C ATOM 0 H THR A 29 15.701 -9.008 -5.288 1.00 0.00 H new ATOM 0 HA THR A 29 15.954 -6.511 -6.314 1.00 0.00 H new ATOM 0 HB THR A 29 18.361 -6.719 -5.885 1.00 0.00 H new ATOM 0 HG1 THR A 29 19.207 -8.836 -5.345 1.00 0.00 H new ATOM 0 HG21 THR A 29 18.277 -7.543 -3.561 1.00 0.00 H new ATOM 0 HG22 THR A 29 16.868 -6.527 -3.950 1.00 0.00 H new ATOM 0 HG23 THR A 29 16.700 -8.298 -3.890 1.00 0.00 H new ATOM 434 N LYS A 30 16.713 -8.748 -8.540 1.00 0.00 N ATOM 435 CA LYS A 30 17.055 -8.966 -9.941 1.00 0.00 C ATOM 436 C LYS A 30 15.991 -8.372 -10.859 1.00 0.00 C ATOM 437 O LYS A 30 16.302 -7.866 -11.937 1.00 0.00 O ATOM 438 CB LYS A 30 17.210 -10.462 -10.223 1.00 0.00 C ATOM 439 CG LYS A 30 17.609 -10.773 -11.655 1.00 0.00 C ATOM 440 CD LYS A 30 19.025 -10.308 -11.953 1.00 0.00 C ATOM 441 CE LYS A 30 20.057 -11.291 -11.423 1.00 0.00 C ATOM 442 NZ LYS A 30 20.389 -12.341 -12.425 1.00 0.00 N ATOM 0 H LYS A 30 16.378 -9.580 -8.054 1.00 0.00 H new ATOM 0 HA LYS A 30 18.003 -8.465 -10.140 1.00 0.00 H new ATOM 0 HB2 LYS A 30 17.960 -10.875 -9.548 1.00 0.00 H new ATOM 0 HB3 LYS A 30 16.269 -10.965 -10.000 1.00 0.00 H new ATOM 0 HG2 LYS A 30 17.533 -11.846 -11.830 1.00 0.00 H new ATOM 0 HG3 LYS A 30 16.914 -10.288 -12.341 1.00 0.00 H new ATOM 0 HD2 LYS A 30 19.152 -10.191 -13.029 1.00 0.00 H new ATOM 0 HD3 LYS A 30 19.190 -9.329 -11.504 1.00 0.00 H new ATOM 0 HE2 LYS A 30 20.964 -10.752 -11.148 1.00 0.00 H new ATOM 0 HE3 LYS A 30 19.678 -11.762 -10.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 21.096 -12.991 -12.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 19.529 -12.872 -12.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 20.775 -11.894 -13.281 1.00 0.00 H new ATOM 456 N GLU A 31 14.737 -8.436 -10.424 1.00 0.00 N ATOM 457 CA GLU A 31 13.629 -7.904 -11.207 1.00 0.00 C ATOM 458 C GLU A 31 13.392 -6.431 -10.885 1.00 0.00 C ATOM 459 O GLU A 31 12.963 -5.657 -11.742 1.00 0.00 O ATOM 460 CB GLU A 31 12.354 -8.707 -10.940 1.00 0.00 C ATOM 461 CG GLU A 31 12.376 -10.102 -11.542 1.00 0.00 C ATOM 462 CD GLU A 31 11.475 -11.071 -10.801 1.00 0.00 C ATOM 463 OE1 GLU A 31 10.242 -10.880 -10.836 1.00 0.00 O ATOM 464 OE2 GLU A 31 12.005 -12.021 -10.187 1.00 0.00 O ATOM 0 H GLU A 31 14.463 -8.851 -9.533 1.00 0.00 H new ATOM 0 HA GLU A 31 13.890 -7.990 -12.262 1.00 0.00 H new ATOM 0 HB2 GLU A 31 12.204 -8.787 -9.863 1.00 0.00 H new ATOM 0 HB3 GLU A 31 11.500 -8.161 -11.341 1.00 0.00 H new ATOM 0 HG2 GLU A 31 12.066 -10.048 -12.585 1.00 0.00 H new ATOM 0 HG3 GLU A 31 13.398 -10.482 -11.533 1.00 0.00 H new ATOM 471 N LEU A 32 13.674 -6.051 -9.644 1.00 0.00 N ATOM 472 CA LEU A 32 13.492 -4.672 -9.206 1.00 0.00 C ATOM 473 C LEU A 32 14.644 -3.793 -9.682 1.00 0.00 C ATOM 474 O LEU A 32 14.430 -2.755 -10.306 1.00 0.00 O ATOM 475 CB LEU A 32 13.384 -4.609 -7.681 1.00 0.00 C ATOM 476 CG LEU A 32 13.141 -3.224 -7.082 1.00 0.00 C ATOM 477 CD1 LEU A 32 11.756 -2.717 -7.454 1.00 0.00 C ATOM 478 CD2 LEU A 32 13.309 -3.260 -5.570 1.00 0.00 C ATOM 0 H LEU A 32 14.030 -6.679 -8.923 1.00 0.00 H new ATOM 0 HA LEU A 32 12.567 -4.297 -9.645 1.00 0.00 H new ATOM 0 HB2 LEU A 32 12.573 -5.266 -7.367 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.303 -5.011 -7.255 1.00 0.00 H new ATOM 0 HG LEU A 32 13.880 -2.537 -7.494 1.00 0.00 H new ATOM 0 HD11 LEU A 32 11.601 -1.730 -7.019 1.00 0.00 H new ATOM 0 HD12 LEU A 32 11.671 -2.653 -8.539 1.00 0.00 H new ATOM 0 HD13 LEU A 32 11.002 -3.405 -7.071 1.00 0.00 H new ATOM 0 HD21 LEU A 32 13.132 -2.265 -5.161 1.00 0.00 H new ATOM 0 HD22 LEU A 32 12.593 -3.961 -5.141 1.00 0.00 H new ATOM 0 HD23 LEU A 32 14.322 -3.579 -5.324 1.00 0.00 H new ATOM 490 N GLY A 33 15.869 -4.218 -9.384 1.00 0.00 N ATOM 491 CA GLY A 33 17.037 -3.459 -9.791 1.00 0.00 C ATOM 492 C GLY A 33 17.141 -3.317 -11.296 1.00 0.00 C ATOM 493 O GLY A 33 17.906 -2.494 -11.799 1.00 0.00 O ATOM 0 H GLY A 33 16.073 -5.074 -8.868 1.00 0.00 H new ATOM 0 HA2 GLY A 33 16.999 -2.469 -9.338 1.00 0.00 H new ATOM 0 HA3 GLY A 33 17.934 -3.948 -9.413 1.00 0.00 H new ATOM 497 N THR A 34 16.369 -4.123 -12.020 1.00 0.00 N ATOM 498 CA THR A 34 16.379 -4.085 -13.477 1.00 0.00 C ATOM 499 C THR A 34 15.475 -2.977 -14.005 1.00 0.00 C ATOM 500 O THR A 34 15.729 -2.408 -15.066 1.00 0.00 O ATOM 501 CB THR A 34 15.928 -5.430 -14.076 1.00 0.00 C ATOM 502 OG1 THR A 34 16.601 -5.663 -15.319 1.00 0.00 O ATOM 503 CG2 THR A 34 14.423 -5.446 -14.298 1.00 0.00 C ATOM 0 H THR A 34 15.729 -4.810 -11.620 1.00 0.00 H new ATOM 0 HA THR A 34 17.407 -3.886 -13.781 1.00 0.00 H new ATOM 0 HB THR A 34 16.184 -6.221 -13.371 1.00 0.00 H new ATOM 0 HG1 THR A 34 16.310 -6.521 -15.693 1.00 0.00 H new ATOM 0 HG21 THR A 34 14.128 -6.406 -14.722 1.00 0.00 H new ATOM 0 HG22 THR A 34 13.913 -5.297 -13.346 1.00 0.00 H new ATOM 0 HG23 THR A 34 14.148 -4.646 -14.986 1.00 0.00 H new ATOM 511 N VAL A 35 14.418 -2.676 -13.257 1.00 0.00 N ATOM 512 CA VAL A 35 13.477 -1.634 -13.649 1.00 0.00 C ATOM 513 C VAL A 35 13.831 -0.300 -13.001 1.00 0.00 C ATOM 514 O VAL A 35 13.613 0.762 -13.583 1.00 0.00 O ATOM 515 CB VAL A 35 12.033 -2.010 -13.267 1.00 0.00 C ATOM 516 CG1 VAL A 35 11.207 -0.760 -13.005 1.00 0.00 C ATOM 517 CG2 VAL A 35 11.398 -2.859 -14.358 1.00 0.00 C ATOM 0 H VAL A 35 14.192 -3.139 -12.377 1.00 0.00 H new ATOM 0 HA VAL A 35 13.546 -1.537 -14.733 1.00 0.00 H new ATOM 0 HB VAL A 35 12.060 -2.598 -12.349 1.00 0.00 H new ATOM 0 HG11 VAL A 35 10.190 -1.046 -12.737 1.00 0.00 H new ATOM 0 HG12 VAL A 35 11.653 -0.194 -12.187 1.00 0.00 H new ATOM 0 HG13 VAL A 35 11.185 -0.143 -13.903 1.00 0.00 H new ATOM 0 HG21 VAL A 35 10.378 -3.116 -14.072 1.00 0.00 H new ATOM 0 HG22 VAL A 35 11.382 -2.298 -15.293 1.00 0.00 H new ATOM 0 HG23 VAL A 35 11.978 -3.772 -14.492 1.00 0.00 H new ATOM 527 N MET A 36 14.380 -0.363 -11.792 1.00 0.00 N ATOM 528 CA MET A 36 14.767 0.840 -11.065 1.00 0.00 C ATOM 529 C MET A 36 15.804 1.639 -11.848 1.00 0.00 C ATOM 530 O MET A 36 15.706 2.861 -11.957 1.00 0.00 O ATOM 531 CB MET A 36 15.323 0.473 -9.688 1.00 0.00 C ATOM 532 CG MET A 36 14.266 -0.040 -8.723 1.00 0.00 C ATOM 533 SD MET A 36 14.733 0.188 -6.996 1.00 0.00 S ATOM 534 CE MET A 36 14.976 1.961 -6.943 1.00 0.00 C ATOM 0 H MET A 36 14.567 -1.234 -11.296 1.00 0.00 H new ATOM 0 HA MET A 36 13.878 1.458 -10.937 1.00 0.00 H new ATOM 0 HB2 MET A 36 16.094 -0.288 -9.808 1.00 0.00 H new ATOM 0 HB3 MET A 36 15.805 1.349 -9.254 1.00 0.00 H new ATOM 0 HG2 MET A 36 13.325 0.477 -8.912 1.00 0.00 H new ATOM 0 HG3 MET A 36 14.091 -1.099 -8.911 1.00 0.00 H new ATOM 0 HE1 MET A 36 14.743 2.331 -5.944 1.00 0.00 H new ATOM 0 HE2 MET A 36 16.014 2.193 -7.183 1.00 0.00 H new ATOM 0 HE3 MET A 36 14.320 2.440 -7.670 1.00 0.00 H new ATOM 544 N ARG A 37 16.795 0.941 -12.392 1.00 0.00 N ATOM 545 CA ARG A 37 17.851 1.586 -13.163 1.00 0.00 C ATOM 546 C ARG A 37 17.315 2.094 -14.499 1.00 0.00 C ATOM 547 O ARG A 37 17.986 2.850 -15.201 1.00 0.00 O ATOM 548 CB ARG A 37 19.005 0.611 -13.403 1.00 0.00 C ATOM 549 CG ARG A 37 18.578 -0.688 -14.066 1.00 0.00 C ATOM 550 CD ARG A 37 18.131 -0.460 -15.501 1.00 0.00 C ATOM 551 NE ARG A 37 18.386 -1.624 -16.345 1.00 0.00 N ATOM 552 CZ ARG A 37 19.564 -1.885 -16.902 1.00 0.00 C ATOM 553 NH1 ARG A 37 20.589 -1.067 -16.704 1.00 0.00 N ATOM 554 NH2 ARG A 37 19.718 -2.964 -17.658 1.00 0.00 N ATOM 0 H ARG A 37 16.889 -0.072 -12.313 1.00 0.00 H new ATOM 0 HA ARG A 37 18.217 2.438 -12.589 1.00 0.00 H new ATOM 0 HB2 ARG A 37 19.756 1.097 -14.026 1.00 0.00 H new ATOM 0 HB3 ARG A 37 19.481 0.383 -12.449 1.00 0.00 H new ATOM 0 HG2 ARG A 37 19.407 -1.396 -14.050 1.00 0.00 H new ATOM 0 HG3 ARG A 37 17.764 -1.138 -13.497 1.00 0.00 H new ATOM 0 HD2 ARG A 37 17.066 -0.227 -15.516 1.00 0.00 H new ATOM 0 HD3 ARG A 37 18.652 0.406 -15.910 1.00 0.00 H new ATOM 0 HE ARG A 37 17.618 -2.273 -16.516 1.00 0.00 H new ATOM 0 HH11 ARG A 37 20.474 -0.236 -16.124 1.00 0.00 H new ATOM 0 HH12 ARG A 37 21.493 -1.269 -17.132 1.00 0.00 H new ATOM 0 HH21 ARG A 37 18.932 -3.595 -17.813 1.00 0.00 H new ATOM 0 HH22 ARG A 37 20.623 -3.163 -18.085 1.00 0.00 H new ATOM 568 N SER A 38 16.102 1.672 -14.842 1.00 0.00 N ATOM 569 CA SER A 38 15.477 2.081 -16.095 1.00 0.00 C ATOM 570 C SER A 38 14.790 3.434 -15.944 1.00 0.00 C ATOM 571 O SER A 38 14.409 4.065 -16.931 1.00 0.00 O ATOM 572 CB SER A 38 14.464 1.029 -16.551 1.00 0.00 C ATOM 573 OG SER A 38 15.100 -0.205 -16.831 1.00 0.00 O ATOM 0 H SER A 38 15.533 1.048 -14.271 1.00 0.00 H new ATOM 0 HA SER A 38 16.259 2.173 -16.849 1.00 0.00 H new ATOM 0 HB2 SER A 38 13.711 0.886 -15.776 1.00 0.00 H new ATOM 0 HB3 SER A 38 13.943 1.383 -17.441 1.00 0.00 H new ATOM 0 HG SER A 38 15.079 -0.773 -16.032 1.00 0.00 H new ATOM 579 N LEU A 39 14.634 3.875 -14.700 1.00 0.00 N ATOM 580 CA LEU A 39 13.992 5.154 -14.417 1.00 0.00 C ATOM 581 C LEU A 39 15.017 6.189 -13.964 1.00 0.00 C ATOM 582 O LEU A 39 14.836 7.388 -14.169 1.00 0.00 O ATOM 583 CB LEU A 39 12.916 4.981 -13.343 1.00 0.00 C ATOM 584 CG LEU A 39 11.554 4.486 -13.831 1.00 0.00 C ATOM 585 CD1 LEU A 39 10.588 4.347 -12.665 1.00 0.00 C ATOM 586 CD2 LEU A 39 10.990 5.430 -14.884 1.00 0.00 C ATOM 0 H LEU A 39 14.943 3.366 -13.872 1.00 0.00 H new ATOM 0 HA LEU A 39 13.525 5.509 -15.336 1.00 0.00 H new ATOM 0 HB2 LEU A 39 13.288 4.281 -12.594 1.00 0.00 H new ATOM 0 HB3 LEU A 39 12.774 5.938 -12.842 1.00 0.00 H new ATOM 0 HG LEU A 39 11.687 3.504 -14.285 1.00 0.00 H new ATOM 0 HD11 LEU A 39 9.624 3.994 -13.031 1.00 0.00 H new ATOM 0 HD12 LEU A 39 10.987 3.632 -11.945 1.00 0.00 H new ATOM 0 HD13 LEU A 39 10.460 5.315 -12.181 1.00 0.00 H new ATOM 0 HD21 LEU A 39 10.020 5.063 -15.220 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.872 6.425 -14.455 1.00 0.00 H new ATOM 0 HD23 LEU A 39 11.673 5.479 -15.732 1.00 0.00 H new ATOM 598 N GLY A 40 16.095 5.716 -13.347 1.00 0.00 N ATOM 599 CA GLY A 40 17.135 6.613 -12.876 1.00 0.00 C ATOM 600 C GLY A 40 17.601 6.275 -11.474 1.00 0.00 C ATOM 601 O GLY A 40 17.849 7.168 -10.665 1.00 0.00 O ATOM 0 H GLY A 40 16.267 4.727 -13.165 1.00 0.00 H new ATOM 0 HA2 GLY A 40 17.984 6.570 -13.558 1.00 0.00 H new ATOM 0 HA3 GLY A 40 16.763 7.637 -12.895 1.00 0.00 H new ATOM 605 N GLN A 41 17.720 4.983 -11.187 1.00 0.00 N ATOM 606 CA GLN A 41 18.157 4.530 -9.872 1.00 0.00 C ATOM 607 C GLN A 41 19.077 3.319 -9.992 1.00 0.00 C ATOM 608 O GLN A 41 18.694 2.289 -10.545 1.00 0.00 O ATOM 609 CB GLN A 41 16.949 4.184 -9.000 1.00 0.00 C ATOM 610 CG GLN A 41 15.741 5.072 -9.254 1.00 0.00 C ATOM 611 CD GLN A 41 15.776 6.349 -8.438 1.00 0.00 C ATOM 612 OE1 GLN A 41 16.484 6.441 -7.436 1.00 0.00 O ATOM 613 NE2 GLN A 41 15.008 7.345 -8.866 1.00 0.00 N ATOM 0 H GLN A 41 17.520 4.232 -11.847 1.00 0.00 H new ATOM 0 HA GLN A 41 18.713 5.341 -9.402 1.00 0.00 H new ATOM 0 HB2 GLN A 41 16.670 3.145 -9.176 1.00 0.00 H new ATOM 0 HB3 GLN A 41 17.234 4.264 -7.951 1.00 0.00 H new ATOM 0 HG2 GLN A 41 15.695 5.323 -10.314 1.00 0.00 H new ATOM 0 HG3 GLN A 41 14.832 4.519 -9.018 1.00 0.00 H new ATOM 0 HE21 GLN A 41 14.436 7.225 -9.702 1.00 0.00 H new ATOM 0 HE22 GLN A 41 14.990 8.230 -8.358 1.00 0.00 H new ATOM 622 N ASN A 42 20.292 3.451 -9.469 1.00 0.00 N ATOM 623 CA ASN A 42 21.267 2.367 -9.518 1.00 0.00 C ATOM 624 C ASN A 42 21.521 1.801 -8.124 1.00 0.00 C ATOM 625 O ASN A 42 22.645 1.804 -7.622 1.00 0.00 O ATOM 626 CB ASN A 42 22.580 2.862 -10.127 1.00 0.00 C ATOM 627 CG ASN A 42 23.437 1.727 -10.652 1.00 0.00 C ATOM 628 OD1 ASN A 42 24.136 1.058 -9.890 1.00 0.00 O ATOM 629 ND2 ASN A 42 23.388 1.505 -11.961 1.00 0.00 N ATOM 0 H ASN A 42 20.625 4.297 -9.007 1.00 0.00 H new ATOM 0 HA ASN A 42 20.860 1.573 -10.144 1.00 0.00 H new ATOM 0 HB2 ASN A 42 22.362 3.555 -10.940 1.00 0.00 H new ATOM 0 HB3 ASN A 42 23.139 3.418 -9.375 1.00 0.00 H new ATOM 0 HD21 ASN A 42 23.944 0.755 -12.372 1.00 0.00 H new ATOM 0 HD22 ASN A 42 22.795 2.084 -12.555 1.00 0.00 H new ATOM 636 N PRO A 43 20.453 1.304 -7.483 1.00 0.00 N ATOM 637 CA PRO A 43 20.535 0.724 -6.139 1.00 0.00 C ATOM 638 C PRO A 43 21.285 -0.604 -6.126 1.00 0.00 C ATOM 639 O PRO A 43 21.010 -1.493 -6.933 1.00 0.00 O ATOM 640 CB PRO A 43 19.069 0.514 -5.753 1.00 0.00 C ATOM 641 CG PRO A 43 18.350 0.383 -7.051 1.00 0.00 C ATOM 642 CD PRO A 43 19.083 1.268 -8.022 1.00 0.00 C ATOM 0 HA PRO A 43 21.083 1.367 -5.450 1.00 0.00 H new ATOM 0 HB2 PRO A 43 18.945 -0.379 -5.140 1.00 0.00 H new ATOM 0 HB3 PRO A 43 18.688 1.354 -5.173 1.00 0.00 H new ATOM 0 HG2 PRO A 43 18.347 -0.652 -7.392 1.00 0.00 H new ATOM 0 HG3 PRO A 43 17.309 0.690 -6.953 1.00 0.00 H new ATOM 0 HD2 PRO A 43 19.059 0.861 -9.033 1.00 0.00 H new ATOM 0 HD3 PRO A 43 18.643 2.264 -8.069 1.00 0.00 H new ATOM 650 N THR A 44 22.234 -0.734 -5.204 1.00 0.00 N ATOM 651 CA THR A 44 23.024 -1.953 -5.086 1.00 0.00 C ATOM 652 C THR A 44 22.258 -3.033 -4.330 1.00 0.00 C ATOM 653 O THR A 44 21.262 -2.749 -3.665 1.00 0.00 O ATOM 654 CB THR A 44 24.361 -1.689 -4.368 1.00 0.00 C ATOM 655 OG1 THR A 44 24.127 -1.420 -2.981 1.00 0.00 O ATOM 656 CG2 THR A 44 25.092 -0.515 -5.002 1.00 0.00 C ATOM 0 H THR A 44 22.474 -0.009 -4.528 1.00 0.00 H new ATOM 0 HA THR A 44 23.227 -2.298 -6.100 1.00 0.00 H new ATOM 0 HB THR A 44 24.983 -2.579 -4.465 1.00 0.00 H new ATOM 0 HG1 THR A 44 24.982 -1.255 -2.531 1.00 0.00 H new ATOM 0 HG21 THR A 44 26.033 -0.347 -4.479 1.00 0.00 H new ATOM 0 HG22 THR A 44 25.294 -0.735 -6.050 1.00 0.00 H new ATOM 0 HG23 THR A 44 24.473 0.380 -4.932 1.00 0.00 H new ATOM 664 N GLU A 45 22.731 -4.271 -4.435 1.00 0.00 N ATOM 665 CA GLU A 45 22.089 -5.393 -3.760 1.00 0.00 C ATOM 666 C GLU A 45 21.638 -4.997 -2.356 1.00 0.00 C ATOM 667 O GLU A 45 20.493 -5.232 -1.972 1.00 0.00 O ATOM 668 CB GLU A 45 23.045 -6.585 -3.683 1.00 0.00 C ATOM 669 CG GLU A 45 22.947 -7.521 -4.876 1.00 0.00 C ATOM 670 CD GLU A 45 23.575 -8.875 -4.609 1.00 0.00 C ATOM 671 OE1 GLU A 45 23.081 -9.592 -3.714 1.00 0.00 O ATOM 672 OE2 GLU A 45 24.561 -9.217 -5.295 1.00 0.00 O ATOM 0 H GLU A 45 23.556 -4.522 -4.980 1.00 0.00 H new ATOM 0 HA GLU A 45 21.210 -5.678 -4.339 1.00 0.00 H new ATOM 0 HB2 GLU A 45 24.067 -6.216 -3.605 1.00 0.00 H new ATOM 0 HB3 GLU A 45 22.839 -7.147 -2.772 1.00 0.00 H new ATOM 0 HG2 GLU A 45 21.898 -7.657 -5.141 1.00 0.00 H new ATOM 0 HG3 GLU A 45 23.436 -7.061 -5.735 1.00 0.00 H new ATOM 679 N ALA A 46 22.548 -4.397 -1.596 1.00 0.00 N ATOM 680 CA ALA A 46 22.245 -3.968 -0.237 1.00 0.00 C ATOM 681 C ALA A 46 21.078 -2.987 -0.218 1.00 0.00 C ATOM 682 O ALA A 46 20.224 -3.041 0.666 1.00 0.00 O ATOM 683 CB ALA A 46 23.474 -3.341 0.405 1.00 0.00 C ATOM 0 H ALA A 46 23.501 -4.197 -1.899 1.00 0.00 H new ATOM 0 HA ALA A 46 21.956 -4.847 0.339 1.00 0.00 H new ATOM 0 HB1 ALA A 46 23.233 -3.025 1.420 1.00 0.00 H new ATOM 0 HB2 ALA A 46 24.282 -4.072 0.435 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.788 -2.476 -0.179 1.00 0.00 H new ATOM 689 N GLU A 47 21.049 -2.090 -1.199 1.00 0.00 N ATOM 690 CA GLU A 47 19.986 -1.096 -1.293 1.00 0.00 C ATOM 691 C GLU A 47 18.650 -1.756 -1.622 1.00 0.00 C ATOM 692 O GLU A 47 17.643 -1.510 -0.957 1.00 0.00 O ATOM 693 CB GLU A 47 20.327 -0.052 -2.359 1.00 0.00 C ATOM 694 CG GLU A 47 21.666 0.631 -2.136 1.00 0.00 C ATOM 695 CD GLU A 47 21.716 2.026 -2.729 1.00 0.00 C ATOM 696 OE1 GLU A 47 20.658 2.688 -2.775 1.00 0.00 O ATOM 697 OE2 GLU A 47 22.812 2.455 -3.147 1.00 0.00 O ATOM 0 H GLU A 47 21.749 -2.031 -1.939 1.00 0.00 H new ATOM 0 HA GLU A 47 19.899 -0.603 -0.325 1.00 0.00 H new ATOM 0 HB2 GLU A 47 20.332 -0.532 -3.337 1.00 0.00 H new ATOM 0 HB3 GLU A 47 19.542 0.704 -2.379 1.00 0.00 H new ATOM 0 HG2 GLU A 47 21.867 0.688 -1.066 1.00 0.00 H new ATOM 0 HG3 GLU A 47 22.457 0.024 -2.577 1.00 0.00 H new ATOM 704 N LEU A 48 18.650 -2.596 -2.651 1.00 0.00 N ATOM 705 CA LEU A 48 17.438 -3.292 -3.070 1.00 0.00 C ATOM 706 C LEU A 48 16.915 -4.193 -1.955 1.00 0.00 C ATOM 707 O LEU A 48 15.726 -4.177 -1.639 1.00 0.00 O ATOM 708 CB LEU A 48 17.711 -4.122 -4.326 1.00 0.00 C ATOM 709 CG LEU A 48 18.171 -3.343 -5.558 1.00 0.00 C ATOM 710 CD1 LEU A 48 18.889 -4.262 -6.534 1.00 0.00 C ATOM 711 CD2 LEU A 48 16.988 -2.666 -6.233 1.00 0.00 C ATOM 0 H LEU A 48 19.475 -2.812 -3.211 1.00 0.00 H new ATOM 0 HA LEU A 48 16.678 -2.544 -3.295 1.00 0.00 H new ATOM 0 HB2 LEU A 48 18.470 -4.867 -4.087 1.00 0.00 H new ATOM 0 HB3 LEU A 48 16.802 -4.665 -4.583 1.00 0.00 H new ATOM 0 HG LEU A 48 18.870 -2.572 -5.236 1.00 0.00 H new ATOM 0 HD11 LEU A 48 19.209 -3.689 -7.405 1.00 0.00 H new ATOM 0 HD12 LEU A 48 19.760 -4.700 -6.047 1.00 0.00 H new ATOM 0 HD13 LEU A 48 18.213 -5.056 -6.851 1.00 0.00 H new ATOM 0 HD21 LEU A 48 17.334 -2.116 -7.108 1.00 0.00 H new ATOM 0 HD22 LEU A 48 16.264 -3.421 -6.541 1.00 0.00 H new ATOM 0 HD23 LEU A 48 16.516 -1.976 -5.534 1.00 0.00 H new ATOM 723 N GLN A 49 17.813 -4.974 -1.363 1.00 0.00 N ATOM 724 CA GLN A 49 17.441 -5.880 -0.282 1.00 0.00 C ATOM 725 C GLN A 49 16.817 -5.114 0.879 1.00 0.00 C ATOM 726 O GLN A 49 15.822 -5.549 1.459 1.00 0.00 O ATOM 727 CB GLN A 49 18.666 -6.658 0.203 1.00 0.00 C ATOM 728 CG GLN A 49 18.886 -7.968 -0.535 1.00 0.00 C ATOM 729 CD GLN A 49 17.807 -8.991 -0.243 1.00 0.00 C ATOM 730 OE1 GLN A 49 17.790 -9.606 0.824 1.00 0.00 O ATOM 731 NE2 GLN A 49 16.897 -9.180 -1.192 1.00 0.00 N ATOM 0 H GLN A 49 18.802 -4.998 -1.613 1.00 0.00 H new ATOM 0 HA GLN A 49 16.702 -6.583 -0.668 1.00 0.00 H new ATOM 0 HB2 GLN A 49 19.552 -6.033 0.089 1.00 0.00 H new ATOM 0 HB3 GLN A 49 18.557 -6.864 1.268 1.00 0.00 H new ATOM 0 HG2 GLN A 49 18.918 -7.775 -1.607 1.00 0.00 H new ATOM 0 HG3 GLN A 49 19.856 -8.379 -0.256 1.00 0.00 H new ATOM 0 HE21 GLN A 49 16.949 -8.649 -2.061 1.00 0.00 H new ATOM 0 HE22 GLN A 49 16.146 -9.856 -1.051 1.00 0.00 H new ATOM 740 N ASP A 50 17.408 -3.973 1.214 1.00 0.00 N ATOM 741 CA ASP A 50 16.909 -3.145 2.307 1.00 0.00 C ATOM 742 C ASP A 50 15.472 -2.706 2.043 1.00 0.00 C ATOM 743 O ASP A 50 14.612 -2.803 2.918 1.00 0.00 O ATOM 744 CB ASP A 50 17.804 -1.920 2.497 1.00 0.00 C ATOM 745 CG ASP A 50 18.962 -2.189 3.437 1.00 0.00 C ATOM 746 OD1 ASP A 50 18.825 -3.071 4.311 1.00 0.00 O ATOM 747 OD2 ASP A 50 20.006 -1.518 3.299 1.00 0.00 O ATOM 0 H ASP A 50 18.233 -3.600 0.745 1.00 0.00 H new ATOM 0 HA ASP A 50 16.926 -3.741 3.219 1.00 0.00 H new ATOM 0 HB2 ASP A 50 18.192 -1.603 1.529 1.00 0.00 H new ATOM 0 HB3 ASP A 50 17.208 -1.095 2.887 1.00 0.00 H new ATOM 752 N MET A 51 15.220 -2.220 0.832 1.00 0.00 N ATOM 753 CA MET A 51 13.887 -1.765 0.454 1.00 0.00 C ATOM 754 C MET A 51 12.913 -2.937 0.381 1.00 0.00 C ATOM 755 O MET A 51 11.794 -2.858 0.888 1.00 0.00 O ATOM 756 CB MET A 51 13.935 -1.042 -0.894 1.00 0.00 C ATOM 757 CG MET A 51 14.762 0.233 -0.870 1.00 0.00 C ATOM 758 SD MET A 51 14.625 1.178 -2.399 1.00 0.00 S ATOM 759 CE MET A 51 16.093 0.631 -3.268 1.00 0.00 C ATOM 0 H MET A 51 15.921 -2.131 0.096 1.00 0.00 H new ATOM 0 HA MET A 51 13.537 -1.071 1.218 1.00 0.00 H new ATOM 0 HB2 MET A 51 14.345 -1.717 -1.645 1.00 0.00 H new ATOM 0 HB3 MET A 51 12.918 -0.800 -1.204 1.00 0.00 H new ATOM 0 HG2 MET A 51 14.441 0.854 -0.034 1.00 0.00 H new ATOM 0 HG3 MET A 51 15.808 -0.020 -0.696 1.00 0.00 H new ATOM 0 HE1 MET A 51 16.307 1.316 -4.088 1.00 0.00 H new ATOM 0 HE2 MET A 51 16.938 0.614 -2.580 1.00 0.00 H new ATOM 0 HE3 MET A 51 15.928 -0.370 -3.666 1.00 0.00 H new ATOM 769 N ILE A 52 13.346 -4.022 -0.253 1.00 0.00 N ATOM 770 CA ILE A 52 12.512 -5.209 -0.391 1.00 0.00 C ATOM 771 C ILE A 52 12.156 -5.792 0.973 1.00 0.00 C ATOM 772 O ILE A 52 11.017 -6.193 1.209 1.00 0.00 O ATOM 773 CB ILE A 52 13.210 -6.293 -1.233 1.00 0.00 C ATOM 774 CG1 ILE A 52 13.469 -5.780 -2.651 1.00 0.00 C ATOM 775 CG2 ILE A 52 12.369 -7.560 -1.268 1.00 0.00 C ATOM 776 CD1 ILE A 52 14.481 -6.602 -3.416 1.00 0.00 C ATOM 0 H ILE A 52 14.269 -4.103 -0.679 1.00 0.00 H new ATOM 0 HA ILE A 52 11.600 -4.896 -0.900 1.00 0.00 H new ATOM 0 HB ILE A 52 14.169 -6.529 -0.771 1.00 0.00 H new ATOM 0 HG12 ILE A 52 12.529 -5.771 -3.203 1.00 0.00 H new ATOM 0 HG13 ILE A 52 13.817 -4.748 -2.597 1.00 0.00 H new ATOM 0 HG21 ILE A 52 12.876 -8.317 -1.867 1.00 0.00 H new ATOM 0 HG22 ILE A 52 12.231 -7.933 -0.253 1.00 0.00 H new ATOM 0 HG23 ILE A 52 11.397 -7.339 -1.709 1.00 0.00 H new ATOM 0 HD11 ILE A 52 14.614 -6.180 -4.412 1.00 0.00 H new ATOM 0 HD12 ILE A 52 15.434 -6.591 -2.887 1.00 0.00 H new ATOM 0 HD13 ILE A 52 14.126 -7.629 -3.501 1.00 0.00 H new ATOM 788 N ASN A 53 13.138 -5.834 1.867 1.00 0.00 N ATOM 789 CA ASN A 53 12.928 -6.367 3.208 1.00 0.00 C ATOM 790 C ASN A 53 11.869 -5.560 3.954 1.00 0.00 C ATOM 791 O ASN A 53 11.092 -6.110 4.734 1.00 0.00 O ATOM 792 CB ASN A 53 14.241 -6.357 3.995 1.00 0.00 C ATOM 793 CG ASN A 53 15.019 -7.649 3.836 1.00 0.00 C ATOM 794 OD1 ASN A 53 14.624 -8.693 4.356 1.00 0.00 O ATOM 795 ND2 ASN A 53 16.133 -7.584 3.115 1.00 0.00 N ATOM 0 H ASN A 53 14.087 -5.505 1.687 1.00 0.00 H new ATOM 0 HA ASN A 53 12.577 -7.395 3.113 1.00 0.00 H new ATOM 0 HB2 ASN A 53 14.856 -5.522 3.660 1.00 0.00 H new ATOM 0 HB3 ASN A 53 14.027 -6.192 5.051 1.00 0.00 H new ATOM 0 HD21 ASN A 53 16.699 -8.421 2.974 1.00 0.00 H new ATOM 0 HD22 ASN A 53 16.422 -6.697 2.702 1.00 0.00 H new ATOM 802 N GLU A 54 11.846 -4.254 3.708 1.00 0.00 N ATOM 803 CA GLU A 54 10.883 -3.373 4.357 1.00 0.00 C ATOM 804 C GLU A 54 9.453 -3.794 4.029 1.00 0.00 C ATOM 805 O GLU A 54 8.607 -3.904 4.917 1.00 0.00 O ATOM 806 CB GLU A 54 11.111 -1.923 3.923 1.00 0.00 C ATOM 807 CG GLU A 54 12.098 -1.173 4.803 1.00 0.00 C ATOM 808 CD GLU A 54 11.542 -0.880 6.183 1.00 0.00 C ATOM 809 OE1 GLU A 54 10.611 -1.593 6.611 1.00 0.00 O ATOM 810 OE2 GLU A 54 12.039 0.063 6.835 1.00 0.00 O ATOM 0 H GLU A 54 12.482 -3.783 3.065 1.00 0.00 H new ATOM 0 HA GLU A 54 11.028 -3.450 5.435 1.00 0.00 H new ATOM 0 HB2 GLU A 54 11.473 -1.913 2.895 1.00 0.00 H new ATOM 0 HB3 GLU A 54 10.157 -1.396 3.930 1.00 0.00 H new ATOM 0 HG2 GLU A 54 13.011 -1.760 4.900 1.00 0.00 H new ATOM 0 HG3 GLU A 54 12.372 -0.236 4.319 1.00 0.00 H new ATOM 817 N VAL A 55 9.190 -4.026 2.747 1.00 0.00 N ATOM 818 CA VAL A 55 7.864 -4.435 2.301 1.00 0.00 C ATOM 819 C VAL A 55 7.625 -5.917 2.572 1.00 0.00 C ATOM 820 O VAL A 55 6.502 -6.334 2.853 1.00 0.00 O ATOM 821 CB VAL A 55 7.668 -4.162 0.798 1.00 0.00 C ATOM 822 CG1 VAL A 55 6.449 -4.905 0.274 1.00 0.00 C ATOM 823 CG2 VAL A 55 7.542 -2.668 0.541 1.00 0.00 C ATOM 0 H VAL A 55 9.878 -3.938 1.999 1.00 0.00 H new ATOM 0 HA VAL A 55 7.144 -3.844 2.867 1.00 0.00 H new ATOM 0 HB VAL A 55 8.544 -4.528 0.263 1.00 0.00 H new ATOM 0 HG11 VAL A 55 6.327 -4.700 -0.790 1.00 0.00 H new ATOM 0 HG12 VAL A 55 6.584 -5.976 0.424 1.00 0.00 H new ATOM 0 HG13 VAL A 55 5.561 -4.572 0.812 1.00 0.00 H new ATOM 0 HG21 VAL A 55 7.404 -2.493 -0.526 1.00 0.00 H new ATOM 0 HG22 VAL A 55 6.684 -2.276 1.087 1.00 0.00 H new ATOM 0 HG23 VAL A 55 8.448 -2.163 0.877 1.00 0.00 H new ATOM 833 N ASP A 56 8.690 -6.707 2.485 1.00 0.00 N ATOM 834 CA ASP A 56 8.597 -8.143 2.723 1.00 0.00 C ATOM 835 C ASP A 56 7.655 -8.442 3.884 1.00 0.00 C ATOM 836 O ASP A 56 7.970 -8.158 5.040 1.00 0.00 O ATOM 837 CB ASP A 56 9.983 -8.724 3.010 1.00 0.00 C ATOM 838 CG ASP A 56 10.034 -10.225 2.806 1.00 0.00 C ATOM 839 OD1 ASP A 56 9.485 -10.705 1.793 1.00 0.00 O ATOM 840 OD2 ASP A 56 10.624 -10.920 3.661 1.00 0.00 O ATOM 0 H ASP A 56 9.627 -6.378 2.252 1.00 0.00 H new ATOM 0 HA ASP A 56 8.195 -8.610 1.824 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.716 -8.247 2.360 1.00 0.00 H new ATOM 0 HB3 ASP A 56 10.267 -8.490 4.036 1.00 0.00 H new ATOM 845 N ALA A 57 6.499 -9.016 3.569 1.00 0.00 N ATOM 846 CA ALA A 57 5.511 -9.354 4.587 1.00 0.00 C ATOM 847 C ALA A 57 5.370 -10.865 4.733 1.00 0.00 C ATOM 848 O ALA A 57 5.606 -11.420 5.806 1.00 0.00 O ATOM 849 CB ALA A 57 4.168 -8.726 4.248 1.00 0.00 C ATOM 0 H ALA A 57 6.223 -9.257 2.617 1.00 0.00 H new ATOM 0 HA ALA A 57 5.855 -8.954 5.541 1.00 0.00 H new ATOM 0 HB1 ALA A 57 3.440 -8.987 5.016 1.00 0.00 H new ATOM 0 HB2 ALA A 57 4.274 -7.642 4.202 1.00 0.00 H new ATOM 0 HB3 ALA A 57 3.826 -9.098 3.283 1.00 0.00 H new ATOM 855 N ASP A 58 4.982 -11.526 3.648 1.00 0.00 N ATOM 856 CA ASP A 58 4.808 -12.974 3.655 1.00 0.00 C ATOM 857 C ASP A 58 5.852 -13.641 4.545 1.00 0.00 C ATOM 858 O ASP A 58 5.544 -14.570 5.291 1.00 0.00 O ATOM 859 CB ASP A 58 4.904 -13.528 2.233 1.00 0.00 C ATOM 860 CG ASP A 58 6.292 -13.373 1.643 1.00 0.00 C ATOM 861 OD1 ASP A 58 6.979 -12.391 1.994 1.00 0.00 O ATOM 862 OD2 ASP A 58 6.690 -14.232 0.829 1.00 0.00 O ATOM 0 H ASP A 58 4.782 -11.082 2.752 1.00 0.00 H new ATOM 0 HA ASP A 58 3.819 -13.195 4.056 1.00 0.00 H new ATOM 0 HB2 ASP A 58 4.630 -14.583 2.238 1.00 0.00 H new ATOM 0 HB3 ASP A 58 4.183 -13.015 1.597 1.00 0.00 H new ATOM 867 N GLY A 59 7.090 -13.162 4.459 1.00 0.00 N ATOM 868 CA GLY A 59 8.160 -13.725 5.261 1.00 0.00 C ATOM 869 C GLY A 59 9.035 -14.679 4.473 1.00 0.00 C ATOM 870 O GLY A 59 9.396 -15.749 4.962 1.00 0.00 O ATOM 0 H GLY A 59 7.370 -12.395 3.848 1.00 0.00 H new ATOM 0 HA2 GLY A 59 8.775 -12.918 5.659 1.00 0.00 H new ATOM 0 HA3 GLY A 59 7.732 -14.250 6.115 1.00 0.00 H new ATOM 874 N ASN A 60 9.375 -14.293 3.247 1.00 0.00 N ATOM 875 CA ASN A 60 10.211 -15.123 2.388 1.00 0.00 C ATOM 876 C ASN A 60 11.439 -14.353 1.915 1.00 0.00 C ATOM 877 O ASN A 60 12.549 -14.883 1.896 1.00 0.00 O ATOM 878 CB ASN A 60 9.408 -15.616 1.182 1.00 0.00 C ATOM 879 CG ASN A 60 9.508 -14.674 -0.002 1.00 0.00 C ATOM 880 OD1 ASN A 60 8.865 -13.625 -0.031 1.00 0.00 O ATOM 881 ND2 ASN A 60 10.317 -15.047 -0.987 1.00 0.00 N ATOM 0 H ASN A 60 9.084 -13.410 2.827 1.00 0.00 H new ATOM 0 HA ASN A 60 10.545 -15.982 2.969 1.00 0.00 H new ATOM 0 HB2 ASN A 60 9.766 -16.603 0.889 1.00 0.00 H new ATOM 0 HB3 ASN A 60 8.362 -15.728 1.467 1.00 0.00 H new ATOM 0 HD21 ASN A 60 10.425 -14.455 -1.810 1.00 0.00 H new ATOM 0 HD22 ASN A 60 10.831 -15.926 -0.920 1.00 0.00 H new ATOM 888 N GLY A 61 11.232 -13.096 1.533 1.00 0.00 N ATOM 889 CA GLY A 61 12.331 -12.272 1.066 1.00 0.00 C ATOM 890 C GLY A 61 11.949 -11.417 -0.126 1.00 0.00 C ATOM 891 O GLY A 61 12.126 -10.199 -0.110 1.00 0.00 O ATOM 0 H GLY A 61 10.323 -12.634 1.539 1.00 0.00 H new ATOM 0 HA2 GLY A 61 12.669 -11.628 1.878 1.00 0.00 H new ATOM 0 HA3 GLY A 61 13.171 -12.912 0.796 1.00 0.00 H new ATOM 895 N THR A 62 11.424 -12.057 -1.167 1.00 0.00 N ATOM 896 CA THR A 62 11.018 -11.348 -2.374 1.00 0.00 C ATOM 897 C THR A 62 9.629 -10.741 -2.215 1.00 0.00 C ATOM 898 O THR A 62 8.774 -11.296 -1.524 1.00 0.00 O ATOM 899 CB THR A 62 11.021 -12.280 -3.601 1.00 0.00 C ATOM 900 OG1 THR A 62 10.005 -13.279 -3.459 1.00 0.00 O ATOM 901 CG2 THR A 62 12.377 -12.949 -3.769 1.00 0.00 C ATOM 0 H THR A 62 11.270 -13.065 -1.198 1.00 0.00 H new ATOM 0 HA THR A 62 11.744 -10.550 -2.531 1.00 0.00 H new ATOM 0 HB THR A 62 10.818 -11.679 -4.487 1.00 0.00 H new ATOM 0 HG1 THR A 62 10.133 -13.974 -4.138 1.00 0.00 H new ATOM 0 HG21 THR A 62 12.355 -13.602 -4.641 1.00 0.00 H new ATOM 0 HG22 THR A 62 13.144 -12.187 -3.905 1.00 0.00 H new ATOM 0 HG23 THR A 62 12.605 -13.538 -2.881 1.00 0.00 H new ATOM 909 N ILE A 63 9.409 -9.600 -2.859 1.00 0.00 N ATOM 910 CA ILE A 63 8.122 -8.919 -2.789 1.00 0.00 C ATOM 911 C ILE A 63 7.060 -9.670 -3.584 1.00 0.00 C ATOM 912 O ILE A 63 7.363 -10.329 -4.579 1.00 0.00 O ATOM 913 CB ILE A 63 8.219 -7.476 -3.320 1.00 0.00 C ATOM 914 CG1 ILE A 63 9.112 -6.633 -2.407 1.00 0.00 C ATOM 915 CG2 ILE A 63 6.833 -6.859 -3.431 1.00 0.00 C ATOM 916 CD1 ILE A 63 9.564 -5.334 -3.037 1.00 0.00 C ATOM 0 H ILE A 63 10.105 -9.127 -3.435 1.00 0.00 H new ATOM 0 HA ILE A 63 7.835 -8.892 -1.738 1.00 0.00 H new ATOM 0 HB ILE A 63 8.666 -7.499 -4.314 1.00 0.00 H new ATOM 0 HG12 ILE A 63 8.572 -6.412 -1.486 1.00 0.00 H new ATOM 0 HG13 ILE A 63 9.989 -7.218 -2.129 1.00 0.00 H new ATOM 0 HG21 ILE A 63 6.918 -5.840 -3.807 1.00 0.00 H new ATOM 0 HG22 ILE A 63 6.226 -7.450 -4.117 1.00 0.00 H new ATOM 0 HG23 ILE A 63 6.361 -6.845 -2.448 1.00 0.00 H new ATOM 0 HD11 ILE A 63 10.193 -4.788 -2.334 1.00 0.00 H new ATOM 0 HD12 ILE A 63 10.132 -5.547 -3.942 1.00 0.00 H new ATOM 0 HD13 ILE A 63 8.693 -4.729 -3.289 1.00 0.00 H new ATOM 928 N ASP A 64 5.812 -9.566 -3.138 1.00 0.00 N ATOM 929 CA ASP A 64 4.703 -10.234 -3.809 1.00 0.00 C ATOM 930 C ASP A 64 3.708 -9.216 -4.358 1.00 0.00 C ATOM 931 O ASP A 64 3.939 -8.008 -4.291 1.00 0.00 O ATOM 932 CB ASP A 64 3.995 -11.187 -2.845 1.00 0.00 C ATOM 933 CG ASP A 64 4.967 -12.075 -2.092 1.00 0.00 C ATOM 934 OD1 ASP A 64 6.148 -12.136 -2.493 1.00 0.00 O ATOM 935 OD2 ASP A 64 4.546 -12.707 -1.101 1.00 0.00 O ATOM 0 H ASP A 64 5.544 -9.026 -2.315 1.00 0.00 H new ATOM 0 HA ASP A 64 5.108 -10.807 -4.643 1.00 0.00 H new ATOM 0 HB2 ASP A 64 3.408 -10.608 -2.132 1.00 0.00 H new ATOM 0 HB3 ASP A 64 3.295 -11.810 -3.402 1.00 0.00 H new ATOM 940 N PHE A 65 2.602 -9.711 -4.903 1.00 0.00 N ATOM 941 CA PHE A 65 1.573 -8.845 -5.466 1.00 0.00 C ATOM 942 C PHE A 65 0.953 -7.963 -4.385 1.00 0.00 C ATOM 943 O PHE A 65 0.831 -6.747 -4.535 1.00 0.00 O ATOM 944 CB PHE A 65 0.486 -9.682 -6.142 1.00 0.00 C ATOM 945 CG PHE A 65 -0.812 -8.947 -6.323 1.00 0.00 C ATOM 946 CD1 PHE A 65 -0.849 -7.735 -6.995 1.00 0.00 C ATOM 947 CD2 PHE A 65 -1.994 -9.467 -5.822 1.00 0.00 C ATOM 948 CE1 PHE A 65 -2.041 -7.056 -7.163 1.00 0.00 C ATOM 949 CE2 PHE A 65 -3.189 -8.793 -5.988 1.00 0.00 C ATOM 950 CZ PHE A 65 -3.212 -7.586 -6.658 1.00 0.00 C ATOM 0 H PHE A 65 2.395 -10.708 -4.967 1.00 0.00 H new ATOM 0 HA PHE A 65 2.042 -8.202 -6.210 1.00 0.00 H new ATOM 0 HB2 PHE A 65 0.846 -10.012 -7.116 1.00 0.00 H new ATOM 0 HB3 PHE A 65 0.307 -10.578 -5.548 1.00 0.00 H new ATOM 0 HD1 PHE A 65 0.064 -7.317 -7.392 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -1.982 -10.410 -5.296 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -2.057 -6.113 -7.688 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -4.104 -9.210 -5.594 1.00 0.00 H new ATOM 0 HZ PHE A 65 -4.145 -7.057 -6.787 1.00 0.00 H new ATOM 960 N PRO A 66 0.550 -8.590 -3.270 1.00 0.00 N ATOM 961 CA PRO A 66 -0.064 -7.883 -2.142 1.00 0.00 C ATOM 962 C PRO A 66 0.932 -6.997 -1.402 1.00 0.00 C ATOM 963 O PRO A 66 0.631 -5.850 -1.074 1.00 0.00 O ATOM 964 CB PRO A 66 -0.549 -9.016 -1.235 1.00 0.00 C ATOM 965 CG PRO A 66 0.337 -10.169 -1.562 1.00 0.00 C ATOM 966 CD PRO A 66 0.664 -10.037 -3.024 1.00 0.00 C ATOM 0 HA PRO A 66 -0.857 -7.209 -2.466 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -0.470 -8.742 -0.183 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -1.595 -9.255 -1.425 1.00 0.00 H new ATOM 0 HG2 PRO A 66 1.243 -10.149 -0.956 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -0.163 -11.116 -1.358 1.00 0.00 H new ATOM 0 HD2 PRO A 66 1.666 -10.405 -3.246 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -0.029 -10.606 -3.644 1.00 0.00 H new ATOM 974 N GLU A 67 2.119 -7.536 -1.143 1.00 0.00 N ATOM 975 CA GLU A 67 3.159 -6.793 -0.441 1.00 0.00 C ATOM 976 C GLU A 67 3.575 -5.559 -1.235 1.00 0.00 C ATOM 977 O GLU A 67 3.796 -4.488 -0.669 1.00 0.00 O ATOM 978 CB GLU A 67 4.375 -7.687 -0.190 1.00 0.00 C ATOM 979 CG GLU A 67 4.018 -9.067 0.337 1.00 0.00 C ATOM 980 CD GLU A 67 5.242 -9.900 0.666 1.00 0.00 C ATOM 981 OE1 GLU A 67 6.354 -9.333 0.695 1.00 0.00 O ATOM 982 OE2 GLU A 67 5.087 -11.117 0.894 1.00 0.00 O ATOM 0 H GLU A 67 2.384 -8.484 -1.409 1.00 0.00 H new ATOM 0 HA GLU A 67 2.754 -6.467 0.517 1.00 0.00 H new ATOM 0 HB2 GLU A 67 4.933 -7.796 -1.120 1.00 0.00 H new ATOM 0 HB3 GLU A 67 5.036 -7.195 0.523 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.403 -8.963 1.231 1.00 0.00 H new ATOM 0 HG3 GLU A 67 3.415 -9.591 -0.405 1.00 0.00 H new ATOM 989 N PHE A 68 3.682 -5.717 -2.550 1.00 0.00 N ATOM 990 CA PHE A 68 4.074 -4.617 -3.424 1.00 0.00 C ATOM 991 C PHE A 68 3.210 -3.385 -3.168 1.00 0.00 C ATOM 992 O PHE A 68 3.714 -2.263 -3.095 1.00 0.00 O ATOM 993 CB PHE A 68 3.961 -5.037 -4.891 1.00 0.00 C ATOM 994 CG PHE A 68 3.967 -3.879 -5.848 1.00 0.00 C ATOM 995 CD1 PHE A 68 5.131 -3.167 -6.086 1.00 0.00 C ATOM 996 CD2 PHE A 68 2.809 -3.504 -6.508 1.00 0.00 C ATOM 997 CE1 PHE A 68 5.140 -2.101 -6.967 1.00 0.00 C ATOM 998 CE2 PHE A 68 2.812 -2.439 -7.390 1.00 0.00 C ATOM 999 CZ PHE A 68 3.979 -1.736 -7.619 1.00 0.00 C ATOM 0 H PHE A 68 3.503 -6.597 -3.034 1.00 0.00 H new ATOM 0 HA PHE A 68 5.111 -4.364 -3.205 1.00 0.00 H new ATOM 0 HB2 PHE A 68 4.788 -5.704 -5.135 1.00 0.00 H new ATOM 0 HB3 PHE A 68 3.042 -5.606 -5.028 1.00 0.00 H new ATOM 0 HD1 PHE A 68 6.042 -3.447 -5.578 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.893 -4.049 -6.332 1.00 0.00 H new ATOM 0 HE1 PHE A 68 6.054 -1.555 -7.145 1.00 0.00 H new ATOM 0 HE2 PHE A 68 1.903 -2.157 -7.900 1.00 0.00 H new ATOM 0 HZ PHE A 68 3.983 -0.903 -8.306 1.00 0.00 H new ATOM 1009 N LEU A 69 1.907 -3.602 -3.032 1.00 0.00 N ATOM 1010 CA LEU A 69 0.971 -2.510 -2.784 1.00 0.00 C ATOM 1011 C LEU A 69 1.507 -1.567 -1.711 1.00 0.00 C ATOM 1012 O LEU A 69 1.346 -0.349 -1.803 1.00 0.00 O ATOM 1013 CB LEU A 69 -0.389 -3.065 -2.359 1.00 0.00 C ATOM 1014 CG LEU A 69 -1.369 -3.379 -3.490 1.00 0.00 C ATOM 1015 CD1 LEU A 69 -2.280 -4.533 -3.102 1.00 0.00 C ATOM 1016 CD2 LEU A 69 -2.189 -2.146 -3.842 1.00 0.00 C ATOM 0 H LEU A 69 1.474 -4.524 -3.089 1.00 0.00 H new ATOM 0 HA LEU A 69 0.853 -1.947 -3.710 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.224 -3.977 -1.785 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -0.859 -2.346 -1.687 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.797 -3.674 -4.369 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -2.970 -4.742 -3.919 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.679 -5.419 -2.899 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -2.845 -4.266 -2.209 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.881 -2.387 -4.649 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -2.751 -1.821 -2.967 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.523 -1.345 -4.163 1.00 0.00 H new ATOM 1028 N THR A 70 2.146 -2.137 -0.695 1.00 0.00 N ATOM 1029 CA THR A 70 2.707 -1.348 0.395 1.00 0.00 C ATOM 1030 C THR A 70 3.769 -0.382 -0.116 1.00 0.00 C ATOM 1031 O THR A 70 3.740 0.809 0.195 1.00 0.00 O ATOM 1032 CB THR A 70 3.327 -2.249 1.480 1.00 0.00 C ATOM 1033 OG1 THR A 70 2.309 -3.048 2.093 1.00 0.00 O ATOM 1034 CG2 THR A 70 4.031 -1.414 2.539 1.00 0.00 C ATOM 0 H THR A 70 2.288 -3.143 -0.604 1.00 0.00 H new ATOM 0 HA THR A 70 1.884 -0.781 0.831 1.00 0.00 H new ATOM 0 HB THR A 70 4.062 -2.899 1.006 1.00 0.00 H new ATOM 0 HG1 THR A 70 2.711 -3.619 2.780 1.00 0.00 H new ATOM 0 HG21 THR A 70 4.461 -2.072 3.294 1.00 0.00 H new ATOM 0 HG22 THR A 70 4.824 -0.829 2.073 1.00 0.00 H new ATOM 0 HG23 THR A 70 3.313 -0.742 3.009 1.00 0.00 H new ATOM 1042 N MET A 71 4.706 -0.902 -0.902 1.00 0.00 N ATOM 1043 CA MET A 71 5.778 -0.083 -1.457 1.00 0.00 C ATOM 1044 C MET A 71 5.211 1.102 -2.232 1.00 0.00 C ATOM 1045 O MET A 71 5.612 2.246 -2.016 1.00 0.00 O ATOM 1046 CB MET A 71 6.670 -0.925 -2.372 1.00 0.00 C ATOM 1047 CG MET A 71 7.852 -0.158 -2.941 1.00 0.00 C ATOM 1048 SD MET A 71 8.371 -0.777 -4.553 1.00 0.00 S ATOM 1049 CE MET A 71 8.592 -2.517 -4.192 1.00 0.00 C ATOM 0 H MET A 71 4.745 -1.886 -1.169 1.00 0.00 H new ATOM 0 HA MET A 71 6.376 0.299 -0.629 1.00 0.00 H new ATOM 0 HB2 MET A 71 7.040 -1.785 -1.814 1.00 0.00 H new ATOM 0 HB3 MET A 71 6.069 -1.313 -3.195 1.00 0.00 H new ATOM 0 HG2 MET A 71 7.588 0.896 -3.029 1.00 0.00 H new ATOM 0 HG3 MET A 71 8.689 -0.220 -2.246 1.00 0.00 H new ATOM 0 HE1 MET A 71 9.158 -2.986 -4.996 1.00 0.00 H new ATOM 0 HE2 MET A 71 9.135 -2.628 -3.253 1.00 0.00 H new ATOM 0 HE3 MET A 71 7.617 -2.997 -4.106 1.00 0.00 H new ATOM 1059 N MET A 72 4.276 0.822 -3.134 1.00 0.00 N ATOM 1060 CA MET A 72 3.654 1.866 -3.940 1.00 0.00 C ATOM 1061 C MET A 72 3.076 2.964 -3.053 1.00 0.00 C ATOM 1062 O MET A 72 3.130 4.145 -3.397 1.00 0.00 O ATOM 1063 CB MET A 72 2.552 1.272 -4.819 1.00 0.00 C ATOM 1064 CG MET A 72 3.080 0.478 -6.003 1.00 0.00 C ATOM 1065 SD MET A 72 3.386 1.509 -7.450 1.00 0.00 S ATOM 1066 CE MET A 72 1.714 1.978 -7.890 1.00 0.00 C ATOM 0 H MET A 72 3.932 -0.119 -3.325 1.00 0.00 H new ATOM 0 HA MET A 72 4.421 2.304 -4.578 1.00 0.00 H new ATOM 0 HB2 MET A 72 1.922 0.624 -4.209 1.00 0.00 H new ATOM 0 HB3 MET A 72 1.918 2.079 -5.187 1.00 0.00 H new ATOM 0 HG2 MET A 72 4.005 -0.023 -5.716 1.00 0.00 H new ATOM 0 HG3 MET A 72 2.363 -0.301 -6.262 1.00 0.00 H new ATOM 0 HE1 MET A 72 1.667 2.202 -8.956 1.00 0.00 H new ATOM 0 HE2 MET A 72 1.034 1.157 -7.661 1.00 0.00 H new ATOM 0 HE3 MET A 72 1.422 2.861 -7.321 1.00 0.00 H new ATOM 1284 N ARG A 86 5.268 15.218 -16.743 1.00 0.00 N ATOM 1285 CA ARG A 86 4.042 15.066 -17.519 1.00 0.00 C ATOM 1286 C ARG A 86 3.576 16.412 -18.067 1.00 0.00 C ATOM 1287 O ARG A 86 3.351 16.558 -19.268 1.00 0.00 O ATOM 1288 CB ARG A 86 2.941 14.446 -16.656 1.00 0.00 C ATOM 1289 CG ARG A 86 3.131 12.960 -16.403 1.00 0.00 C ATOM 1290 CD ARG A 86 2.502 12.122 -17.505 1.00 0.00 C ATOM 1291 NE ARG A 86 1.052 12.289 -17.559 1.00 0.00 N ATOM 1292 CZ ARG A 86 0.280 11.714 -18.474 1.00 0.00 C ATOM 1293 NH1 ARG A 86 0.816 10.939 -19.407 1.00 0.00 N ATOM 1294 NH2 ARG A 86 -1.032 11.914 -18.458 1.00 0.00 N ATOM 0 HA ARG A 86 4.252 14.404 -18.359 1.00 0.00 H new ATOM 0 HB2 ARG A 86 2.904 14.967 -15.699 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.978 14.603 -17.142 1.00 0.00 H new ATOM 0 HG2 ARG A 86 4.195 12.735 -16.336 1.00 0.00 H new ATOM 0 HG3 ARG A 86 2.687 12.694 -15.444 1.00 0.00 H new ATOM 0 HD2 ARG A 86 2.935 12.402 -18.465 1.00 0.00 H new ATOM 0 HD3 ARG A 86 2.740 11.071 -17.342 1.00 0.00 H new ATOM 0 HE ARG A 86 0.608 12.879 -16.856 1.00 0.00 H new ATOM 0 HH11 ARG A 86 1.824 10.783 -19.423 1.00 0.00 H new ATOM 0 HH12 ARG A 86 0.220 10.499 -20.108 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -1.448 12.510 -17.742 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -1.624 11.472 -19.161 1.00 0.00 H new ATOM 1308 N GLU A 87 3.433 17.390 -17.179 1.00 0.00 N ATOM 1309 CA GLU A 87 2.992 18.722 -17.575 1.00 0.00 C ATOM 1310 C GLU A 87 3.574 19.107 -18.932 1.00 0.00 C ATOM 1311 O GLU A 87 2.855 19.563 -19.820 1.00 0.00 O ATOM 1312 CB GLU A 87 3.402 19.754 -16.521 1.00 0.00 C ATOM 1313 CG GLU A 87 2.663 19.604 -15.202 1.00 0.00 C ATOM 1314 CD GLU A 87 1.226 20.082 -15.282 1.00 0.00 C ATOM 1315 OE1 GLU A 87 0.913 20.872 -16.196 1.00 0.00 O ATOM 1316 OE2 GLU A 87 0.415 19.664 -14.428 1.00 0.00 O ATOM 0 H GLU A 87 3.616 17.285 -16.181 1.00 0.00 H new ATOM 0 HA GLU A 87 1.905 18.707 -17.656 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.473 19.669 -16.339 1.00 0.00 H new ATOM 0 HB3 GLU A 87 3.224 20.754 -16.916 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.678 18.557 -14.898 1.00 0.00 H new ATOM 0 HG3 GLU A 87 3.187 20.167 -14.430 1.00 0.00 H new ATOM 1323 N ALA A 88 4.881 18.919 -19.084 1.00 0.00 N ATOM 1324 CA ALA A 88 5.560 19.244 -20.332 1.00 0.00 C ATOM 1325 C ALA A 88 5.039 18.386 -21.480 1.00 0.00 C ATOM 1326 O ALA A 88 4.751 18.891 -22.565 1.00 0.00 O ATOM 1327 CB ALA A 88 7.063 19.066 -20.177 1.00 0.00 C ATOM 0 H ALA A 88 5.491 18.543 -18.358 1.00 0.00 H new ATOM 0 HA ALA A 88 5.352 20.287 -20.569 1.00 0.00 H new ATOM 0 HB1 ALA A 88 7.557 19.312 -21.117 1.00 0.00 H new ATOM 0 HB2 ALA A 88 7.428 19.727 -19.391 1.00 0.00 H new ATOM 0 HB3 ALA A 88 7.281 18.031 -19.912 1.00 0.00 H new ATOM 1333 N PHE A 89 4.920 17.085 -21.233 1.00 0.00 N ATOM 1334 CA PHE A 89 4.435 16.156 -22.247 1.00 0.00 C ATOM 1335 C PHE A 89 3.033 16.541 -22.712 1.00 0.00 C ATOM 1336 O PHE A 89 2.723 16.481 -23.901 1.00 0.00 O ATOM 1337 CB PHE A 89 4.429 14.728 -21.699 1.00 0.00 C ATOM 1338 CG PHE A 89 3.457 13.821 -22.399 1.00 0.00 C ATOM 1339 CD1 PHE A 89 2.121 13.804 -22.036 1.00 0.00 C ATOM 1340 CD2 PHE A 89 3.881 12.986 -23.420 1.00 0.00 C ATOM 1341 CE1 PHE A 89 1.224 12.972 -22.679 1.00 0.00 C ATOM 1342 CE2 PHE A 89 2.989 12.151 -24.066 1.00 0.00 C ATOM 1343 CZ PHE A 89 1.659 12.143 -23.694 1.00 0.00 C ATOM 0 H PHE A 89 5.153 16.651 -20.340 1.00 0.00 H new ATOM 0 HA PHE A 89 5.109 16.207 -23.102 1.00 0.00 H new ATOM 0 HB2 PHE A 89 5.432 14.310 -21.787 1.00 0.00 H new ATOM 0 HB3 PHE A 89 4.187 14.756 -20.637 1.00 0.00 H new ATOM 0 HD1 PHE A 89 1.776 14.448 -21.241 1.00 0.00 H new ATOM 0 HD2 PHE A 89 4.920 12.988 -23.714 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.184 12.970 -22.388 1.00 0.00 H new ATOM 0 HE2 PHE A 89 3.332 11.505 -24.861 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.961 11.490 -24.196 1.00 0.00 H new ATOM 1353 N ARG A 90 2.190 16.935 -21.763 1.00 0.00 N ATOM 1354 CA ARG A 90 0.820 17.328 -22.073 1.00 0.00 C ATOM 1355 C ARG A 90 0.799 18.517 -23.030 1.00 0.00 C ATOM 1356 O ARG A 90 0.072 18.515 -24.023 1.00 0.00 O ATOM 1357 CB ARG A 90 0.064 17.678 -20.790 1.00 0.00 C ATOM 1358 CG ARG A 90 -0.242 16.473 -19.916 1.00 0.00 C ATOM 1359 CD ARG A 90 -0.962 16.879 -18.640 1.00 0.00 C ATOM 1360 NE ARG A 90 -1.532 15.729 -17.943 1.00 0.00 N ATOM 1361 CZ ARG A 90 -2.580 15.808 -17.131 1.00 0.00 C ATOM 1362 NH1 ARG A 90 -3.169 16.976 -16.915 1.00 0.00 N ATOM 1363 NH2 ARG A 90 -3.041 14.717 -16.533 1.00 0.00 N ATOM 0 H ARG A 90 2.431 16.991 -20.774 1.00 0.00 H new ATOM 0 HA ARG A 90 0.327 16.485 -22.558 1.00 0.00 H new ATOM 0 HB2 ARG A 90 0.652 18.393 -20.215 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -0.871 18.173 -21.053 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -0.857 15.765 -20.472 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.686 15.960 -19.664 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.265 17.394 -17.979 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -1.755 17.586 -18.881 1.00 0.00 H new ATOM 0 HE ARG A 90 -1.102 14.816 -18.088 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -2.817 17.817 -17.373 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -3.974 17.034 -16.291 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -2.590 13.817 -16.697 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -3.846 14.779 -15.910 1.00 0.00 H new ATOM 1377 N VAL A 91 1.601 19.531 -22.722 1.00 0.00 N ATOM 1378 CA VAL A 91 1.675 20.727 -23.554 1.00 0.00 C ATOM 1379 C VAL A 91 1.923 20.365 -25.014 1.00 0.00 C ATOM 1380 O VAL A 91 1.318 20.942 -25.919 1.00 0.00 O ATOM 1381 CB VAL A 91 2.790 21.676 -23.075 1.00 0.00 C ATOM 1382 CG1 VAL A 91 2.864 22.905 -23.967 1.00 0.00 C ATOM 1383 CG2 VAL A 91 2.563 22.073 -21.624 1.00 0.00 C ATOM 0 H VAL A 91 2.209 19.549 -21.903 1.00 0.00 H new ATOM 0 HA VAL A 91 0.714 21.234 -23.466 1.00 0.00 H new ATOM 0 HB VAL A 91 3.743 21.152 -23.140 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.657 23.564 -23.614 1.00 0.00 H new ATOM 0 HG12 VAL A 91 3.076 22.599 -24.991 1.00 0.00 H new ATOM 0 HG13 VAL A 91 1.912 23.435 -23.936 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.360 22.743 -21.301 1.00 0.00 H new ATOM 0 HG22 VAL A 91 1.602 22.580 -21.531 1.00 0.00 H new ATOM 0 HG23 VAL A 91 2.564 21.181 -20.998 1.00 0.00 H new ATOM 1393 N PHE A 92 2.817 19.408 -25.237 1.00 0.00 N ATOM 1394 CA PHE A 92 3.146 18.969 -26.589 1.00 0.00 C ATOM 1395 C PHE A 92 1.950 18.286 -27.245 1.00 0.00 C ATOM 1396 O PHE A 92 1.592 18.594 -28.382 1.00 0.00 O ATOM 1397 CB PHE A 92 4.341 18.014 -26.561 1.00 0.00 C ATOM 1398 CG PHE A 92 5.648 18.698 -26.276 1.00 0.00 C ATOM 1399 CD1 PHE A 92 6.076 19.758 -27.058 1.00 0.00 C ATOM 1400 CD2 PHE A 92 6.449 18.280 -25.225 1.00 0.00 C ATOM 1401 CE1 PHE A 92 7.278 20.389 -26.798 1.00 0.00 C ATOM 1402 CE2 PHE A 92 7.651 18.907 -24.960 1.00 0.00 C ATOM 1403 CZ PHE A 92 8.067 19.963 -25.748 1.00 0.00 C ATOM 0 H PHE A 92 3.327 18.921 -24.500 1.00 0.00 H new ATOM 0 HA PHE A 92 3.407 19.849 -27.177 1.00 0.00 H new ATOM 0 HB2 PHE A 92 4.167 17.249 -25.804 1.00 0.00 H new ATOM 0 HB3 PHE A 92 4.410 17.502 -27.521 1.00 0.00 H new ATOM 0 HD1 PHE A 92 5.463 20.096 -27.881 1.00 0.00 H new ATOM 0 HD2 PHE A 92 6.130 17.455 -24.606 1.00 0.00 H new ATOM 0 HE1 PHE A 92 7.600 21.215 -27.416 1.00 0.00 H new ATOM 0 HE2 PHE A 92 8.265 18.572 -24.137 1.00 0.00 H new ATOM 0 HZ PHE A 92 9.007 20.454 -25.543 1.00 0.00 H new ATOM 1413 N ASP A 93 1.337 17.356 -26.521 1.00 0.00 N ATOM 1414 CA ASP A 93 0.181 16.628 -27.032 1.00 0.00 C ATOM 1415 C ASP A 93 -1.037 17.542 -27.128 1.00 0.00 C ATOM 1416 O ASP A 93 -1.428 18.179 -26.150 1.00 0.00 O ATOM 1417 CB ASP A 93 -0.134 15.432 -26.132 1.00 0.00 C ATOM 1418 CG ASP A 93 -1.024 14.413 -26.815 1.00 0.00 C ATOM 1419 OD1 ASP A 93 -1.154 14.475 -28.055 1.00 0.00 O ATOM 1420 OD2 ASP A 93 -1.592 13.553 -26.109 1.00 0.00 O ATOM 0 H ASP A 93 1.621 17.088 -25.579 1.00 0.00 H new ATOM 0 HA ASP A 93 0.423 16.267 -28.032 1.00 0.00 H new ATOM 0 HB2 ASP A 93 0.797 14.953 -25.830 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -0.621 15.784 -25.222 1.00 0.00 H new ATOM 1425 N LYS A 94 -1.632 17.602 -28.315 1.00 0.00 N ATOM 1426 CA LYS A 94 -2.806 18.438 -28.541 1.00 0.00 C ATOM 1427 C LYS A 94 -4.089 17.625 -28.391 1.00 0.00 C ATOM 1428 O LYS A 94 -4.888 17.871 -27.488 1.00 0.00 O ATOM 1429 CB LYS A 94 -2.748 19.068 -29.934 1.00 0.00 C ATOM 1430 CG LYS A 94 -1.571 20.008 -30.128 1.00 0.00 C ATOM 1431 CD LYS A 94 -1.855 21.043 -31.203 1.00 0.00 C ATOM 1432 CE LYS A 94 -0.905 22.226 -31.103 1.00 0.00 C ATOM 1433 NZ LYS A 94 -1.362 23.221 -30.094 1.00 0.00 N ATOM 0 H LYS A 94 -1.321 17.082 -29.135 1.00 0.00 H new ATOM 0 HA LYS A 94 -2.808 19.229 -27.791 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.696 18.275 -30.680 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -3.673 19.615 -30.115 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.347 20.511 -29.187 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -0.686 19.433 -30.400 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.762 20.582 -32.187 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.883 21.392 -31.111 1.00 0.00 H new ATOM 0 HE2 LYS A 94 0.091 21.871 -30.837 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -0.822 22.708 -32.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -1.326 24.175 -30.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.339 23.004 -29.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -0.742 23.180 -29.260 1.00 0.00 H new ATOM 1447 N ASP A 95 -4.277 16.657 -29.281 1.00 0.00 N ATOM 1448 CA ASP A 95 -5.462 15.807 -29.247 1.00 0.00 C ATOM 1449 C ASP A 95 -5.693 15.254 -27.844 1.00 0.00 C ATOM 1450 O ASP A 95 -6.820 15.238 -27.350 1.00 0.00 O ATOM 1451 CB ASP A 95 -5.319 14.657 -30.245 1.00 0.00 C ATOM 1452 CG ASP A 95 -4.080 13.821 -29.992 1.00 0.00 C ATOM 1453 OD1 ASP A 95 -2.998 14.412 -29.790 1.00 0.00 O ATOM 1454 OD2 ASP A 95 -4.191 12.577 -29.997 1.00 0.00 O ATOM 0 H ASP A 95 -3.625 16.441 -30.035 1.00 0.00 H new ATOM 0 HA ASP A 95 -6.323 16.414 -29.525 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -6.201 14.020 -30.189 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -5.281 15.061 -31.257 1.00 0.00 H new ATOM 1459 N GLY A 96 -4.617 14.801 -27.207 1.00 0.00 N ATOM 1460 CA GLY A 96 -4.725 14.252 -25.868 1.00 0.00 C ATOM 1461 C GLY A 96 -5.009 12.763 -25.872 1.00 0.00 C ATOM 1462 O GLY A 96 -5.856 12.284 -25.120 1.00 0.00 O ATOM 0 H GLY A 96 -3.673 14.805 -27.594 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -3.798 14.440 -25.326 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -5.520 14.769 -25.330 1.00 0.00 H new ATOM 1466 N ASN A 97 -4.299 12.030 -26.723 1.00 0.00 N ATOM 1467 CA ASN A 97 -4.480 10.586 -26.824 1.00 0.00 C ATOM 1468 C ASN A 97 -3.346 9.845 -26.123 1.00 0.00 C ATOM 1469 O ASN A 97 -3.577 8.883 -25.392 1.00 0.00 O ATOM 1470 CB ASN A 97 -4.551 10.162 -28.292 1.00 0.00 C ATOM 1471 CG ASN A 97 -3.179 10.046 -28.928 1.00 0.00 C ATOM 1472 OD1 ASN A 97 -2.475 11.041 -29.097 1.00 0.00 O ATOM 1473 ND2 ASN A 97 -2.793 8.826 -29.283 1.00 0.00 N ATOM 0 H ASN A 97 -3.593 12.412 -27.353 1.00 0.00 H new ATOM 0 HA ASN A 97 -5.418 10.327 -26.332 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -5.065 9.204 -28.366 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -5.146 10.886 -28.848 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -1.880 8.686 -29.715 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -3.410 8.029 -29.124 1.00 0.00 H new ATOM 1480 N GLY A 98 -2.118 10.301 -26.351 1.00 0.00 N ATOM 1481 CA GLY A 98 -0.966 9.670 -25.734 1.00 0.00 C ATOM 1482 C GLY A 98 0.308 9.889 -26.526 1.00 0.00 C ATOM 1483 O GLY A 98 1.370 10.134 -25.952 1.00 0.00 O ATOM 0 H GLY A 98 -1.901 11.096 -26.952 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -0.836 10.064 -24.726 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.150 8.600 -25.637 1.00 0.00 H new ATOM 1487 N TYR A 99 0.204 9.800 -27.847 1.00 0.00 N ATOM 1488 CA TYR A 99 1.358 9.986 -28.719 1.00 0.00 C ATOM 1489 C TYR A 99 1.391 11.402 -29.284 1.00 0.00 C ATOM 1490 O TYR A 99 0.350 11.986 -29.586 1.00 0.00 O ATOM 1491 CB TYR A 99 1.330 8.969 -29.861 1.00 0.00 C ATOM 1492 CG TYR A 99 1.547 7.543 -29.409 1.00 0.00 C ATOM 1493 CD1 TYR A 99 0.529 6.827 -28.791 1.00 0.00 C ATOM 1494 CD2 TYR A 99 2.770 6.911 -29.599 1.00 0.00 C ATOM 1495 CE1 TYR A 99 0.723 5.524 -28.375 1.00 0.00 C ATOM 1496 CE2 TYR A 99 2.972 5.608 -29.188 1.00 0.00 C ATOM 1497 CZ TYR A 99 1.946 4.919 -28.576 1.00 0.00 C ATOM 1498 OH TYR A 99 2.143 3.620 -28.164 1.00 0.00 O ATOM 0 H TYR A 99 -0.668 9.600 -28.338 1.00 0.00 H new ATOM 0 HA TYR A 99 2.259 9.830 -28.125 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.370 9.037 -30.373 1.00 0.00 H new ATOM 0 HB3 TYR A 99 2.098 9.231 -30.588 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.430 7.297 -28.633 1.00 0.00 H new ATOM 0 HD2 TYR A 99 3.576 7.448 -30.076 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -0.079 4.982 -27.895 1.00 0.00 H new ATOM 0 HE2 TYR A 99 3.928 5.131 -29.345 1.00 0.00 H new ATOM 0 HH TYR A 99 3.058 3.343 -28.381 1.00 0.00 H new ATOM 1508 N ILE A 100 2.595 11.948 -29.424 1.00 0.00 N ATOM 1509 CA ILE A 100 2.765 13.295 -29.955 1.00 0.00 C ATOM 1510 C ILE A 100 3.302 13.260 -31.381 1.00 0.00 C ATOM 1511 O ILE A 100 4.499 13.075 -31.600 1.00 0.00 O ATOM 1512 CB ILE A 100 3.718 14.129 -29.079 1.00 0.00 C ATOM 1513 CG1 ILE A 100 3.174 14.237 -27.653 1.00 0.00 C ATOM 1514 CG2 ILE A 100 3.918 15.512 -29.681 1.00 0.00 C ATOM 1515 CD1 ILE A 100 4.217 14.645 -26.637 1.00 0.00 C ATOM 0 H ILE A 100 3.466 11.478 -29.177 1.00 0.00 H new ATOM 0 HA ILE A 100 1.780 13.762 -29.952 1.00 0.00 H new ATOM 0 HB ILE A 100 4.685 13.627 -29.042 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.360 14.962 -27.637 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.750 13.276 -27.361 1.00 0.00 H new ATOM 0 HG21 ILE A 100 4.594 16.089 -29.050 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.346 15.416 -30.679 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.957 16.023 -29.746 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.760 14.701 -25.649 1.00 0.00 H new ATOM 0 HD12 ILE A 100 5.020 13.908 -26.624 1.00 0.00 H new ATOM 0 HD13 ILE A 100 4.624 15.620 -26.905 1.00 0.00 H new ATOM 1527 N SER A 101 2.409 13.442 -32.349 1.00 0.00 N ATOM 1528 CA SER A 101 2.793 13.430 -33.756 1.00 0.00 C ATOM 1529 C SER A 101 3.719 14.599 -34.076 1.00 0.00 C ATOM 1530 O SER A 101 3.873 15.521 -33.276 1.00 0.00 O ATOM 1531 CB SER A 101 1.550 13.489 -34.646 1.00 0.00 C ATOM 1532 OG SER A 101 0.747 14.612 -34.326 1.00 0.00 O ATOM 0 H SER A 101 1.415 13.599 -32.185 1.00 0.00 H new ATOM 0 HA SER A 101 3.328 12.501 -33.954 1.00 0.00 H new ATOM 0 HB2 SER A 101 1.850 13.539 -35.693 1.00 0.00 H new ATOM 0 HB3 SER A 101 0.968 12.575 -34.525 1.00 0.00 H new ATOM 0 HG SER A 101 -0.040 14.628 -34.909 1.00 0.00 H new ATOM 1538 N ALA A 102 4.333 14.554 -35.254 1.00 0.00 N ATOM 1539 CA ALA A 102 5.242 15.610 -35.683 1.00 0.00 C ATOM 1540 C ALA A 102 4.539 16.963 -35.709 1.00 0.00 C ATOM 1541 O ALA A 102 5.052 17.950 -35.183 1.00 0.00 O ATOM 1542 CB ALA A 102 5.818 15.286 -37.053 1.00 0.00 C ATOM 0 H ALA A 102 4.217 13.797 -35.928 1.00 0.00 H new ATOM 0 HA ALA A 102 6.058 15.668 -34.962 1.00 0.00 H new ATOM 0 HB1 ALA A 102 6.495 16.083 -37.361 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.365 14.344 -37.004 1.00 0.00 H new ATOM 0 HB3 ALA A 102 5.008 15.198 -37.777 1.00 0.00 H new ATOM 1548 N ALA A 103 3.362 17.001 -36.325 1.00 0.00 N ATOM 1549 CA ALA A 103 2.588 18.233 -36.418 1.00 0.00 C ATOM 1550 C ALA A 103 2.299 18.805 -35.034 1.00 0.00 C ATOM 1551 O ALA A 103 2.560 19.978 -34.772 1.00 0.00 O ATOM 1552 CB ALA A 103 1.289 17.984 -37.171 1.00 0.00 C ATOM 0 H ALA A 103 2.924 16.193 -36.767 1.00 0.00 H new ATOM 0 HA ALA A 103 3.179 18.965 -36.968 1.00 0.00 H new ATOM 0 HB1 ALA A 103 0.721 18.912 -37.233 1.00 0.00 H new ATOM 0 HB2 ALA A 103 1.514 17.628 -38.176 1.00 0.00 H new ATOM 0 HB3 ALA A 103 0.701 17.233 -36.643 1.00 0.00 H new ATOM 1558 N GLU A 104 1.757 17.969 -34.154 1.00 0.00 N ATOM 1559 CA GLU A 104 1.431 18.394 -32.798 1.00 0.00 C ATOM 1560 C GLU A 104 2.599 19.147 -32.169 1.00 0.00 C ATOM 1561 O GLU A 104 2.474 20.318 -31.805 1.00 0.00 O ATOM 1562 CB GLU A 104 1.065 17.185 -31.935 1.00 0.00 C ATOM 1563 CG GLU A 104 -0.415 16.841 -31.964 1.00 0.00 C ATOM 1564 CD GLU A 104 -0.699 15.443 -31.450 1.00 0.00 C ATOM 1565 OE1 GLU A 104 -0.171 15.086 -30.376 1.00 0.00 O ATOM 1566 OE2 GLU A 104 -1.451 14.707 -32.122 1.00 0.00 O ATOM 0 H GLU A 104 1.535 16.994 -34.356 1.00 0.00 H new ATOM 0 HA GLU A 104 0.574 19.066 -32.851 1.00 0.00 H new ATOM 0 HB2 GLU A 104 1.637 16.321 -32.274 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.364 17.381 -30.905 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -0.964 17.564 -31.361 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -0.785 16.931 -32.985 1.00 0.00 H new ATOM 1573 N LEU A 105 3.734 18.469 -32.042 1.00 0.00 N ATOM 1574 CA LEU A 105 4.926 19.072 -31.456 1.00 0.00 C ATOM 1575 C LEU A 105 5.369 20.291 -32.259 1.00 0.00 C ATOM 1576 O LEU A 105 5.672 21.342 -31.694 1.00 0.00 O ATOM 1577 CB LEU A 105 6.061 18.049 -31.392 1.00 0.00 C ATOM 1578 CG LEU A 105 7.453 18.609 -31.099 1.00 0.00 C ATOM 1579 CD1 LEU A 105 8.320 17.558 -30.423 1.00 0.00 C ATOM 1580 CD2 LEU A 105 8.111 19.101 -32.380 1.00 0.00 C ATOM 0 H LEU A 105 3.854 17.500 -32.337 1.00 0.00 H new ATOM 0 HA LEU A 105 4.680 19.395 -30.444 1.00 0.00 H new ATOM 0 HB2 LEU A 105 5.818 17.314 -30.625 1.00 0.00 H new ATOM 0 HB3 LEU A 105 6.098 17.517 -32.343 1.00 0.00 H new ATOM 0 HG LEU A 105 7.347 19.455 -30.420 1.00 0.00 H new ATOM 0 HD11 LEU A 105 9.307 17.975 -30.222 1.00 0.00 H new ATOM 0 HD12 LEU A 105 7.857 17.253 -29.484 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.418 16.692 -31.077 1.00 0.00 H new ATOM 0 HD21 LEU A 105 9.101 19.496 -32.152 1.00 0.00 H new ATOM 0 HD22 LEU A 105 8.204 18.273 -33.083 1.00 0.00 H new ATOM 0 HD23 LEU A 105 7.500 19.887 -32.824 1.00 0.00 H new ATOM 1592 N ARG A 106 5.403 20.144 -33.579 1.00 0.00 N ATOM 1593 CA ARG A 106 5.809 21.233 -34.460 1.00 0.00 C ATOM 1594 C ARG A 106 5.193 22.554 -34.009 1.00 0.00 C ATOM 1595 O ARG A 106 5.903 23.529 -33.758 1.00 0.00 O ATOM 1596 CB ARG A 106 5.397 20.932 -35.902 1.00 0.00 C ATOM 1597 CG ARG A 106 5.578 22.109 -36.846 1.00 0.00 C ATOM 1598 CD ARG A 106 4.817 21.903 -38.146 1.00 0.00 C ATOM 1599 NE ARG A 106 5.332 22.747 -39.221 1.00 0.00 N ATOM 1600 CZ ARG A 106 5.192 22.461 -40.511 1.00 0.00 C ATOM 1601 NH1 ARG A 106 4.557 21.359 -40.884 1.00 0.00 N ATOM 1602 NH2 ARG A 106 5.689 23.279 -41.430 1.00 0.00 N ATOM 0 H ARG A 106 5.154 19.281 -34.063 1.00 0.00 H new ATOM 0 HA ARG A 106 6.894 21.322 -34.411 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.982 20.089 -36.270 1.00 0.00 H new ATOM 0 HB3 ARG A 106 4.351 20.624 -35.915 1.00 0.00 H new ATOM 0 HG2 ARG A 106 5.232 23.022 -36.361 1.00 0.00 H new ATOM 0 HG3 ARG A 106 6.638 22.244 -37.061 1.00 0.00 H new ATOM 0 HD2 ARG A 106 4.884 20.856 -38.443 1.00 0.00 H new ATOM 0 HD3 ARG A 106 3.761 22.123 -37.987 1.00 0.00 H new ATOM 0 HE ARG A 106 5.826 23.603 -38.968 1.00 0.00 H new ATOM 0 HH11 ARG A 106 4.174 20.728 -40.180 1.00 0.00 H new ATOM 0 HH12 ARG A 106 4.451 21.142 -41.875 1.00 0.00 H new ATOM 0 HH21 ARG A 106 6.179 24.128 -41.146 1.00 0.00 H new ATOM 0 HH22 ARG A 106 5.581 23.059 -42.420 1.00 0.00 H new ATOM 1616 N HIS A 107 3.868 22.580 -33.908 1.00 0.00 N ATOM 1617 CA HIS A 107 3.157 23.782 -33.487 1.00 0.00 C ATOM 1618 C HIS A 107 3.811 24.397 -32.253 1.00 0.00 C ATOM 1619 O HIS A 107 4.207 25.562 -32.264 1.00 0.00 O ATOM 1620 CB HIS A 107 1.692 23.456 -33.193 1.00 0.00 C ATOM 1621 CG HIS A 107 0.973 24.543 -32.455 1.00 0.00 C ATOM 1622 ND1 HIS A 107 -0.018 25.312 -33.026 1.00 0.00 N ATOM 1623 CD2 HIS A 107 1.105 24.987 -31.183 1.00 0.00 C ATOM 1624 CE1 HIS A 107 -0.463 26.184 -32.138 1.00 0.00 C ATOM 1625 NE2 HIS A 107 0.202 26.007 -31.011 1.00 0.00 N ATOM 0 H HIS A 107 3.265 21.783 -34.112 1.00 0.00 H new ATOM 0 HA HIS A 107 3.205 24.506 -34.300 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.175 23.263 -34.133 1.00 0.00 H new ATOM 0 HB3 HIS A 107 1.643 22.537 -32.608 1.00 0.00 H new ATOM 0 HD2 HIS A 107 1.793 24.609 -30.441 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -1.239 26.917 -32.306 1.00 0.00 H new ATOM 0 HE2 HIS A 107 0.067 26.541 -30.153 1.00 0.00 H new ATOM 1634 N VAL A 108 3.920 23.605 -31.191 1.00 0.00 N ATOM 1635 CA VAL A 108 4.527 24.072 -29.950 1.00 0.00 C ATOM 1636 C VAL A 108 5.817 24.837 -30.222 1.00 0.00 C ATOM 1637 O VAL A 108 5.966 25.988 -29.813 1.00 0.00 O ATOM 1638 CB VAL A 108 4.829 22.899 -28.998 1.00 0.00 C ATOM 1639 CG1 VAL A 108 5.553 23.393 -27.755 1.00 0.00 C ATOM 1640 CG2 VAL A 108 3.546 22.172 -28.624 1.00 0.00 C ATOM 0 H VAL A 108 3.596 22.638 -31.165 1.00 0.00 H new ATOM 0 HA VAL A 108 3.807 24.739 -29.477 1.00 0.00 H new ATOM 0 HB VAL A 108 5.482 22.194 -29.514 1.00 0.00 H new ATOM 0 HG11 VAL A 108 5.758 22.551 -27.094 1.00 0.00 H new ATOM 0 HG12 VAL A 108 6.492 23.864 -28.044 1.00 0.00 H new ATOM 0 HG13 VAL A 108 4.928 24.119 -27.234 1.00 0.00 H new ATOM 0 HG21 VAL A 108 3.778 21.347 -27.951 1.00 0.00 H new ATOM 0 HG22 VAL A 108 2.867 22.865 -28.127 1.00 0.00 H new ATOM 0 HG23 VAL A 108 3.072 21.783 -29.525 1.00 0.00 H new ATOM 1650 N MET A 109 6.748 24.189 -30.915 1.00 0.00 N ATOM 1651 CA MET A 109 8.026 24.810 -31.244 1.00 0.00 C ATOM 1652 C MET A 109 7.818 26.194 -31.849 1.00 0.00 C ATOM 1653 O MET A 109 8.409 27.176 -31.398 1.00 0.00 O ATOM 1654 CB MET A 109 8.810 23.928 -32.217 1.00 0.00 C ATOM 1655 CG MET A 109 9.216 22.586 -31.629 1.00 0.00 C ATOM 1656 SD MET A 109 10.664 22.705 -30.562 1.00 0.00 S ATOM 1657 CE MET A 109 9.890 22.763 -28.947 1.00 0.00 C ATOM 0 H MET A 109 6.641 23.235 -31.259 1.00 0.00 H new ATOM 0 HA MET A 109 8.597 24.918 -30.322 1.00 0.00 H new ATOM 0 HB2 MET A 109 8.205 23.757 -33.108 1.00 0.00 H new ATOM 0 HB3 MET A 109 9.705 24.461 -32.537 1.00 0.00 H new ATOM 0 HG2 MET A 109 8.382 22.176 -31.059 1.00 0.00 H new ATOM 0 HG3 MET A 109 9.423 21.886 -32.439 1.00 0.00 H new ATOM 0 HE1 MET A 109 10.630 23.049 -28.199 1.00 0.00 H new ATOM 0 HE2 MET A 109 9.082 23.494 -28.957 1.00 0.00 H new ATOM 0 HE3 MET A 109 9.487 21.781 -28.701 1.00 0.00 H new ATOM 1667 N THR A 110 6.974 26.267 -32.874 1.00 0.00 N ATOM 1668 CA THR A 110 6.689 27.531 -33.541 1.00 0.00 C ATOM 1669 C THR A 110 6.529 28.662 -32.532 1.00 0.00 C ATOM 1670 O THR A 110 7.174 29.703 -32.645 1.00 0.00 O ATOM 1671 CB THR A 110 5.413 27.439 -34.399 1.00 0.00 C ATOM 1672 OG1 THR A 110 5.553 26.400 -35.374 1.00 0.00 O ATOM 1673 CG2 THR A 110 5.133 28.761 -35.096 1.00 0.00 C ATOM 0 H THR A 110 6.476 25.465 -33.260 1.00 0.00 H new ATOM 0 HA THR A 110 7.539 27.744 -34.189 1.00 0.00 H new ATOM 0 HB THR A 110 4.575 27.209 -33.741 1.00 0.00 H new ATOM 0 HG1 THR A 110 4.737 26.346 -35.914 1.00 0.00 H new ATOM 0 HG21 THR A 110 4.227 28.671 -35.696 1.00 0.00 H new ATOM 0 HG22 THR A 110 4.998 29.544 -34.350 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.973 29.016 -35.743 1.00 0.00 H new ATOM 1681 N ASN A 111 5.665 28.450 -31.545 1.00 0.00 N ATOM 1682 CA ASN A 111 5.420 29.453 -30.515 1.00 0.00 C ATOM 1683 C ASN A 111 6.733 30.000 -29.965 1.00 0.00 C ATOM 1684 O ASN A 111 6.902 31.212 -29.823 1.00 0.00 O ATOM 1685 CB ASN A 111 4.588 28.854 -29.378 1.00 0.00 C ATOM 1686 CG ASN A 111 3.097 28.987 -29.620 1.00 0.00 C ATOM 1687 OD1 ASN A 111 2.639 28.973 -30.763 1.00 0.00 O ATOM 1688 ND2 ASN A 111 2.333 29.118 -28.543 1.00 0.00 N ATOM 0 H ASN A 111 5.123 27.593 -31.437 1.00 0.00 H new ATOM 0 HA ASN A 111 4.866 30.275 -30.968 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.842 27.800 -29.262 1.00 0.00 H new ATOM 0 HB3 ASN A 111 4.847 29.349 -28.442 1.00 0.00 H new ATOM 0 HD21 ASN A 111 1.322 29.212 -28.643 1.00 0.00 H new ATOM 0 HD22 ASN A 111 2.756 29.124 -27.615 1.00 0.00 H new ATOM 1695 N LEU A 112 7.661 29.100 -29.659 1.00 0.00 N ATOM 1696 CA LEU A 112 8.961 29.492 -29.125 1.00 0.00 C ATOM 1697 C LEU A 112 9.428 30.807 -29.740 1.00 0.00 C ATOM 1698 O LEU A 112 9.958 31.674 -29.047 1.00 0.00 O ATOM 1699 CB LEU A 112 9.995 28.396 -29.392 1.00 0.00 C ATOM 1700 CG LEU A 112 9.692 27.026 -28.785 1.00 0.00 C ATOM 1701 CD1 LEU A 112 10.660 25.980 -29.317 1.00 0.00 C ATOM 1702 CD2 LEU A 112 9.756 27.090 -27.265 1.00 0.00 C ATOM 0 H LEU A 112 7.538 28.094 -29.771 1.00 0.00 H new ATOM 0 HA LEU A 112 8.857 29.632 -28.049 1.00 0.00 H new ATOM 0 HB2 LEU A 112 10.100 28.278 -30.471 1.00 0.00 H new ATOM 0 HB3 LEU A 112 10.959 28.734 -29.013 1.00 0.00 H new ATOM 0 HG LEU A 112 8.682 26.737 -29.075 1.00 0.00 H new ATOM 0 HD11 LEU A 112 10.429 25.011 -28.874 1.00 0.00 H new ATOM 0 HD12 LEU A 112 10.566 25.915 -30.401 1.00 0.00 H new ATOM 0 HD13 LEU A 112 11.680 26.263 -29.058 1.00 0.00 H new ATOM 0 HD21 LEU A 112 9.538 26.106 -26.850 1.00 0.00 H new ATOM 0 HD22 LEU A 112 10.754 27.401 -26.956 1.00 0.00 H new ATOM 0 HD23 LEU A 112 9.022 27.809 -26.900 1.00 0.00 H new ATOM 1714 N GLY A 113 9.224 30.950 -31.046 1.00 0.00 N ATOM 1715 CA GLY A 113 9.628 32.163 -31.732 1.00 0.00 C ATOM 1716 C GLY A 113 10.235 31.885 -33.093 1.00 0.00 C ATOM 1717 O GLY A 113 9.961 32.598 -34.058 1.00 0.00 O ATOM 0 H GLY A 113 8.786 30.247 -31.641 1.00 0.00 H new ATOM 0 HA2 GLY A 113 8.763 32.815 -31.850 1.00 0.00 H new ATOM 0 HA3 GLY A 113 10.351 32.700 -31.118 1.00 0.00 H new ATOM 1721 N GLU A 114 11.062 30.847 -33.171 1.00 0.00 N ATOM 1722 CA GLU A 114 11.710 30.480 -34.424 1.00 0.00 C ATOM 1723 C GLU A 114 10.704 29.878 -35.401 1.00 0.00 C ATOM 1724 O GLU A 114 9.569 29.574 -35.033 1.00 0.00 O ATOM 1725 CB GLU A 114 12.844 29.485 -34.164 1.00 0.00 C ATOM 1726 CG GLU A 114 14.058 30.107 -33.495 1.00 0.00 C ATOM 1727 CD GLU A 114 14.518 31.377 -34.184 1.00 0.00 C ATOM 1728 OE1 GLU A 114 14.613 31.374 -35.429 1.00 0.00 O ATOM 1729 OE2 GLU A 114 14.783 32.372 -33.479 1.00 0.00 O ATOM 0 H GLU A 114 11.299 30.246 -32.382 1.00 0.00 H new ATOM 0 HA GLU A 114 12.124 31.385 -34.868 1.00 0.00 H new ATOM 0 HB2 GLU A 114 12.469 28.676 -33.537 1.00 0.00 H new ATOM 0 HB3 GLU A 114 13.150 29.040 -35.111 1.00 0.00 H new ATOM 0 HG2 GLU A 114 13.821 30.328 -32.454 1.00 0.00 H new ATOM 0 HG3 GLU A 114 14.875 29.385 -33.489 1.00 0.00 H new ATOM 1736 N LYS A 115 11.129 29.709 -36.648 1.00 0.00 N ATOM 1737 CA LYS A 115 10.268 29.144 -37.680 1.00 0.00 C ATOM 1738 C LYS A 115 10.819 27.811 -38.178 1.00 0.00 C ATOM 1739 O LYS A 115 11.821 27.770 -38.893 1.00 0.00 O ATOM 1740 CB LYS A 115 10.131 30.120 -38.851 1.00 0.00 C ATOM 1741 CG LYS A 115 9.151 31.251 -38.587 1.00 0.00 C ATOM 1742 CD LYS A 115 9.367 32.410 -39.546 1.00 0.00 C ATOM 1743 CE LYS A 115 8.123 33.278 -39.660 1.00 0.00 C ATOM 1744 NZ LYS A 115 7.091 32.655 -40.535 1.00 0.00 N ATOM 0 H LYS A 115 12.065 29.955 -36.969 1.00 0.00 H new ATOM 0 HA LYS A 115 9.285 28.971 -37.243 1.00 0.00 H new ATOM 0 HB2 LYS A 115 11.110 30.543 -39.077 1.00 0.00 H new ATOM 0 HB3 LYS A 115 9.809 29.571 -39.736 1.00 0.00 H new ATOM 0 HG2 LYS A 115 8.131 30.880 -38.686 1.00 0.00 H new ATOM 0 HG3 LYS A 115 9.265 31.600 -37.561 1.00 0.00 H new ATOM 0 HD2 LYS A 115 10.205 33.017 -39.203 1.00 0.00 H new ATOM 0 HD3 LYS A 115 9.635 32.025 -40.530 1.00 0.00 H new ATOM 0 HE2 LYS A 115 7.705 33.446 -38.667 1.00 0.00 H new ATOM 0 HE3 LYS A 115 8.397 34.254 -40.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 6.280 33.299 -40.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 7.497 32.471 -41.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 6.774 31.758 -40.114 1.00 0.00 H new ATOM 1758 N LEU A 116 10.157 26.724 -37.798 1.00 0.00 N ATOM 1759 CA LEU A 116 10.580 25.389 -38.208 1.00 0.00 C ATOM 1760 C LEU A 116 9.570 24.769 -39.169 1.00 0.00 C ATOM 1761 O LEU A 116 8.446 25.253 -39.304 1.00 0.00 O ATOM 1762 CB LEU A 116 10.753 24.489 -36.983 1.00 0.00 C ATOM 1763 CG LEU A 116 11.753 24.972 -35.932 1.00 0.00 C ATOM 1764 CD1 LEU A 116 11.674 24.108 -34.683 1.00 0.00 C ATOM 1765 CD2 LEU A 116 13.166 24.966 -36.498 1.00 0.00 C ATOM 0 H LEU A 116 9.326 26.740 -37.207 1.00 0.00 H new ATOM 0 HA LEU A 116 11.536 25.480 -38.723 1.00 0.00 H new ATOM 0 HB2 LEU A 116 9.781 24.371 -36.504 1.00 0.00 H new ATOM 0 HB3 LEU A 116 11.063 23.501 -37.324 1.00 0.00 H new ATOM 0 HG LEU A 116 11.497 25.995 -35.658 1.00 0.00 H new ATOM 0 HD11 LEU A 116 12.393 24.467 -33.946 1.00 0.00 H new ATOM 0 HD12 LEU A 116 10.669 24.163 -34.266 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.904 23.074 -34.941 1.00 0.00 H new ATOM 0 HD21 LEU A 116 13.864 25.313 -35.736 1.00 0.00 H new ATOM 0 HD22 LEU A 116 13.432 23.953 -36.801 1.00 0.00 H new ATOM 0 HD23 LEU A 116 13.214 25.628 -37.363 1.00 0.00 H new ATOM 1777 N THR A 117 9.979 23.694 -39.836 1.00 0.00 N ATOM 1778 CA THR A 117 9.110 23.007 -40.784 1.00 0.00 C ATOM 1779 C THR A 117 9.218 21.494 -40.631 1.00 0.00 C ATOM 1780 O THR A 117 10.152 20.988 -40.009 1.00 0.00 O ATOM 1781 CB THR A 117 9.450 23.391 -42.236 1.00 0.00 C ATOM 1782 OG1 THR A 117 10.848 23.199 -42.480 1.00 0.00 O ATOM 1783 CG2 THR A 117 9.075 24.838 -42.515 1.00 0.00 C ATOM 0 H THR A 117 10.906 23.280 -39.737 1.00 0.00 H new ATOM 0 HA THR A 117 8.089 23.320 -40.563 1.00 0.00 H new ATOM 0 HB THR A 117 8.874 22.748 -42.902 1.00 0.00 H new ATOM 0 HG1 THR A 117 11.055 23.444 -43.406 1.00 0.00 H new ATOM 0 HG21 THR A 117 9.325 25.086 -43.547 1.00 0.00 H new ATOM 0 HG22 THR A 117 8.005 24.973 -42.358 1.00 0.00 H new ATOM 0 HG23 THR A 117 9.626 25.493 -41.841 1.00 0.00 H new ATOM 1791 N ASP A 118 8.258 20.777 -41.204 1.00 0.00 N ATOM 1792 CA ASP A 118 8.246 19.320 -41.133 1.00 0.00 C ATOM 1793 C ASP A 118 9.666 18.763 -41.158 1.00 0.00 C ATOM 1794 O ASP A 118 9.995 17.844 -40.409 1.00 0.00 O ATOM 1795 CB ASP A 118 7.437 18.738 -42.294 1.00 0.00 C ATOM 1796 CG ASP A 118 6.862 17.373 -41.971 1.00 0.00 C ATOM 1797 OD1 ASP A 118 5.833 17.314 -41.265 1.00 0.00 O ATOM 1798 OD2 ASP A 118 7.439 16.364 -42.426 1.00 0.00 O ATOM 0 H ASP A 118 7.478 21.180 -41.723 1.00 0.00 H new ATOM 0 HA ASP A 118 7.777 19.031 -40.192 1.00 0.00 H new ATOM 0 HB2 ASP A 118 6.625 19.421 -42.546 1.00 0.00 H new ATOM 0 HB3 ASP A 118 8.074 18.662 -43.175 1.00 0.00 H new ATOM 1803 N GLU A 119 10.502 19.326 -42.025 1.00 0.00 N ATOM 1804 CA GLU A 119 11.887 18.884 -42.147 1.00 0.00 C ATOM 1805 C GLU A 119 12.638 19.075 -40.833 1.00 0.00 C ATOM 1806 O GLU A 119 13.241 18.139 -40.309 1.00 0.00 O ATOM 1807 CB GLU A 119 12.593 19.651 -43.267 1.00 0.00 C ATOM 1808 CG GLU A 119 11.980 19.427 -44.639 1.00 0.00 C ATOM 1809 CD GLU A 119 11.764 17.958 -44.948 1.00 0.00 C ATOM 1810 OE1 GLU A 119 10.798 17.376 -44.411 1.00 0.00 O ATOM 1811 OE2 GLU A 119 12.559 17.391 -45.726 1.00 0.00 O ATOM 0 H GLU A 119 10.245 20.088 -42.653 1.00 0.00 H new ATOM 0 HA GLU A 119 11.882 17.822 -42.390 1.00 0.00 H new ATOM 0 HB2 GLU A 119 12.569 20.716 -43.037 1.00 0.00 H new ATOM 0 HB3 GLU A 119 13.641 19.354 -43.294 1.00 0.00 H new ATOM 0 HG2 GLU A 119 11.026 19.951 -44.697 1.00 0.00 H new ATOM 0 HG3 GLU A 119 12.629 19.863 -45.399 1.00 0.00 H new ATOM 1818 N GLU A 120 12.595 20.295 -40.306 1.00 0.00 N ATOM 1819 CA GLU A 120 13.273 20.609 -39.053 1.00 0.00 C ATOM 1820 C GLU A 120 12.859 19.637 -37.952 1.00 0.00 C ATOM 1821 O GLU A 120 13.703 19.013 -37.310 1.00 0.00 O ATOM 1822 CB GLU A 120 12.961 22.045 -38.626 1.00 0.00 C ATOM 1823 CG GLU A 120 13.516 23.096 -39.572 1.00 0.00 C ATOM 1824 CD GLU A 120 15.018 22.985 -39.751 1.00 0.00 C ATOM 1825 OE1 GLU A 120 15.453 22.235 -40.651 1.00 0.00 O ATOM 1826 OE2 GLU A 120 15.757 23.646 -38.993 1.00 0.00 O ATOM 0 H GLU A 120 12.099 21.081 -40.726 1.00 0.00 H new ATOM 0 HA GLU A 120 14.346 20.511 -39.215 1.00 0.00 H new ATOM 0 HB2 GLU A 120 11.880 22.167 -38.555 1.00 0.00 H new ATOM 0 HB3 GLU A 120 13.367 22.215 -37.629 1.00 0.00 H new ATOM 0 HG2 GLU A 120 13.030 22.999 -40.543 1.00 0.00 H new ATOM 0 HG3 GLU A 120 13.272 24.088 -39.191 1.00 0.00 H new ATOM 1833 N VAL A 121 11.552 19.515 -37.739 1.00 0.00 N ATOM 1834 CA VAL A 121 11.025 18.620 -36.717 1.00 0.00 C ATOM 1835 C VAL A 121 11.407 17.172 -37.004 1.00 0.00 C ATOM 1836 O VAL A 121 11.757 16.420 -36.094 1.00 0.00 O ATOM 1837 CB VAL A 121 9.491 18.724 -36.617 1.00 0.00 C ATOM 1838 CG1 VAL A 121 8.952 17.712 -35.617 1.00 0.00 C ATOM 1839 CG2 VAL A 121 9.078 20.136 -36.233 1.00 0.00 C ATOM 0 H VAL A 121 10.839 20.025 -38.261 1.00 0.00 H new ATOM 0 HA VAL A 121 11.466 18.928 -35.769 1.00 0.00 H new ATOM 0 HB VAL A 121 9.064 18.497 -37.594 1.00 0.00 H new ATOM 0 HG11 VAL A 121 7.867 17.800 -35.559 1.00 0.00 H new ATOM 0 HG12 VAL A 121 9.218 16.705 -35.939 1.00 0.00 H new ATOM 0 HG13 VAL A 121 9.384 17.905 -34.635 1.00 0.00 H new ATOM 0 HG21 VAL A 121 7.991 20.192 -36.167 1.00 0.00 H new ATOM 0 HG22 VAL A 121 9.514 20.393 -35.268 1.00 0.00 H new ATOM 0 HG23 VAL A 121 9.432 20.837 -36.989 1.00 0.00 H new ATOM 1849 N ASP A 122 11.339 16.788 -38.274 1.00 0.00 N ATOM 1850 CA ASP A 122 11.680 15.430 -38.682 1.00 0.00 C ATOM 1851 C ASP A 122 13.006 14.995 -38.066 1.00 0.00 C ATOM 1852 O ASP A 122 13.115 13.900 -37.515 1.00 0.00 O ATOM 1853 CB ASP A 122 11.756 15.337 -40.206 1.00 0.00 C ATOM 1854 CG ASP A 122 10.422 14.977 -40.831 1.00 0.00 C ATOM 1855 OD1 ASP A 122 9.383 15.450 -40.325 1.00 0.00 O ATOM 1856 OD2 ASP A 122 10.417 14.222 -41.826 1.00 0.00 O ATOM 0 H ASP A 122 11.051 17.398 -39.039 1.00 0.00 H new ATOM 0 HA ASP A 122 10.897 14.761 -38.324 1.00 0.00 H new ATOM 0 HB2 ASP A 122 12.097 16.291 -40.609 1.00 0.00 H new ATOM 0 HB3 ASP A 122 12.498 14.589 -40.485 1.00 0.00 H new ATOM 1861 N GLU A 123 14.011 15.859 -38.166 1.00 0.00 N ATOM 1862 CA GLU A 123 15.331 15.562 -37.621 1.00 0.00 C ATOM 1863 C GLU A 123 15.246 15.251 -36.130 1.00 0.00 C ATOM 1864 O GLU A 123 16.021 14.451 -35.607 1.00 0.00 O ATOM 1865 CB GLU A 123 16.280 16.739 -37.855 1.00 0.00 C ATOM 1866 CG GLU A 123 16.651 16.942 -39.314 1.00 0.00 C ATOM 1867 CD GLU A 123 17.847 17.857 -39.490 1.00 0.00 C ATOM 1868 OE1 GLU A 123 18.050 18.741 -38.633 1.00 0.00 O ATOM 1869 OE2 GLU A 123 18.581 17.688 -40.487 1.00 0.00 O ATOM 0 H GLU A 123 13.937 16.770 -38.619 1.00 0.00 H new ATOM 0 HA GLU A 123 15.720 14.684 -38.136 1.00 0.00 H new ATOM 0 HB2 GLU A 123 15.815 17.650 -37.477 1.00 0.00 H new ATOM 0 HB3 GLU A 123 17.190 16.581 -37.276 1.00 0.00 H new ATOM 0 HG2 GLU A 123 16.868 15.975 -39.768 1.00 0.00 H new ATOM 0 HG3 GLU A 123 15.797 17.360 -39.847 1.00 0.00 H new ATOM 1876 N MET A 124 14.298 15.889 -35.451 1.00 0.00 N ATOM 1877 CA MET A 124 14.111 15.681 -34.020 1.00 0.00 C ATOM 1878 C MET A 124 13.389 14.364 -33.753 1.00 0.00 C ATOM 1879 O MET A 124 13.838 13.553 -32.942 1.00 0.00 O ATOM 1880 CB MET A 124 13.320 16.841 -33.413 1.00 0.00 C ATOM 1881 CG MET A 124 12.882 16.594 -31.979 1.00 0.00 C ATOM 1882 SD MET A 124 12.678 18.121 -31.041 1.00 0.00 S ATOM 1883 CE MET A 124 11.981 17.491 -29.516 1.00 0.00 C ATOM 0 H MET A 124 13.648 16.554 -35.869 1.00 0.00 H new ATOM 0 HA MET A 124 15.095 15.638 -33.553 1.00 0.00 H new ATOM 0 HB2 MET A 124 13.930 17.743 -33.447 1.00 0.00 H new ATOM 0 HB3 MET A 124 12.439 17.029 -34.026 1.00 0.00 H new ATOM 0 HG2 MET A 124 11.941 16.045 -31.980 1.00 0.00 H new ATOM 0 HG3 MET A 124 13.619 15.963 -31.482 1.00 0.00 H new ATOM 0 HE1 MET A 124 11.078 18.050 -29.270 1.00 0.00 H new ATOM 0 HE2 MET A 124 11.733 16.437 -29.638 1.00 0.00 H new ATOM 0 HE3 MET A 124 12.707 17.602 -28.711 1.00 0.00 H new ATOM 1893 N ILE A 125 12.270 14.157 -34.439 1.00 0.00 N ATOM 1894 CA ILE A 125 11.488 12.938 -34.275 1.00 0.00 C ATOM 1895 C ILE A 125 12.357 11.699 -34.460 1.00 0.00 C ATOM 1896 O ILE A 125 12.165 10.687 -33.786 1.00 0.00 O ATOM 1897 CB ILE A 125 10.315 12.883 -35.272 1.00 0.00 C ATOM 1898 CG1 ILE A 125 9.350 14.044 -35.022 1.00 0.00 C ATOM 1899 CG2 ILE A 125 9.590 11.551 -35.163 1.00 0.00 C ATOM 1900 CD1 ILE A 125 8.559 13.906 -33.740 1.00 0.00 C ATOM 0 H ILE A 125 11.885 14.818 -35.114 1.00 0.00 H new ATOM 0 HA ILE A 125 11.091 12.952 -33.260 1.00 0.00 H new ATOM 0 HB ILE A 125 10.711 12.977 -36.283 1.00 0.00 H new ATOM 0 HG12 ILE A 125 9.915 14.976 -34.992 1.00 0.00 H new ATOM 0 HG13 ILE A 125 8.658 14.118 -35.861 1.00 0.00 H new ATOM 0 HG21 ILE A 125 8.764 11.527 -35.874 1.00 0.00 H new ATOM 0 HG22 ILE A 125 10.283 10.740 -35.386 1.00 0.00 H new ATOM 0 HG23 ILE A 125 9.202 11.429 -34.152 1.00 0.00 H new ATOM 0 HD11 ILE A 125 7.896 14.764 -33.627 1.00 0.00 H new ATOM 0 HD12 ILE A 125 7.967 12.992 -33.775 1.00 0.00 H new ATOM 0 HD13 ILE A 125 9.244 13.863 -32.893 1.00 0.00 H new ATOM 1912 N ARG A 126 13.314 11.786 -35.378 1.00 0.00 N ATOM 1913 CA ARG A 126 14.214 10.672 -35.652 1.00 0.00 C ATOM 1914 C ARG A 126 15.263 10.537 -34.552 1.00 0.00 C ATOM 1915 O ARG A 126 16.229 9.788 -34.692 1.00 0.00 O ATOM 1916 CB ARG A 126 14.900 10.863 -37.006 1.00 0.00 C ATOM 1917 CG ARG A 126 15.946 11.966 -37.007 1.00 0.00 C ATOM 1918 CD ARG A 126 16.904 11.824 -38.179 1.00 0.00 C ATOM 1919 NE ARG A 126 17.693 10.598 -38.095 1.00 0.00 N ATOM 1920 CZ ARG A 126 18.391 10.102 -39.111 1.00 0.00 C ATOM 1921 NH1 ARG A 126 18.397 10.724 -40.282 1.00 0.00 N ATOM 1922 NH2 ARG A 126 19.084 8.981 -38.957 1.00 0.00 N ATOM 0 H ARG A 126 13.486 12.616 -35.945 1.00 0.00 H new ATOM 0 HA ARG A 126 13.621 9.758 -35.679 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.372 9.926 -37.300 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.144 11.089 -37.758 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.453 12.937 -37.055 1.00 0.00 H new ATOM 0 HG3 ARG A 126 16.506 11.939 -36.072 1.00 0.00 H new ATOM 0 HD2 ARG A 126 16.339 11.829 -39.111 1.00 0.00 H new ATOM 0 HD3 ARG A 126 17.573 12.684 -38.207 1.00 0.00 H new ATOM 0 HE ARG A 126 17.709 10.095 -37.208 1.00 0.00 H new ATOM 0 HH11 ARG A 126 17.865 11.586 -40.405 1.00 0.00 H new ATOM 0 HH12 ARG A 126 18.934 10.341 -41.060 1.00 0.00 H new ATOM 0 HH21 ARG A 126 19.081 8.499 -38.058 1.00 0.00 H new ATOM 0 HH22 ARG A 126 19.619 8.601 -39.738 1.00 0.00 H new ATOM 1936 N GLU A 127 15.065 11.267 -33.459 1.00 0.00 N ATOM 1937 CA GLU A 127 15.995 11.229 -32.337 1.00 0.00 C ATOM 1938 C GLU A 127 15.371 10.521 -31.137 1.00 0.00 C ATOM 1939 O GLU A 127 15.995 9.660 -30.518 1.00 0.00 O ATOM 1940 CB GLU A 127 16.413 12.648 -31.945 1.00 0.00 C ATOM 1941 CG GLU A 127 17.568 12.691 -30.958 1.00 0.00 C ATOM 1942 CD GLU A 127 17.101 12.707 -29.515 1.00 0.00 C ATOM 1943 OE1 GLU A 127 15.978 12.232 -29.248 1.00 0.00 O ATOM 1944 OE2 GLU A 127 17.861 13.195 -28.652 1.00 0.00 O ATOM 0 H GLU A 127 14.269 11.891 -33.327 1.00 0.00 H new ATOM 0 HA GLU A 127 16.878 10.670 -32.648 1.00 0.00 H new ATOM 0 HB2 GLU A 127 16.694 13.197 -32.844 1.00 0.00 H new ATOM 0 HB3 GLU A 127 15.556 13.164 -31.511 1.00 0.00 H new ATOM 0 HG2 GLU A 127 18.211 11.825 -31.119 1.00 0.00 H new ATOM 0 HG3 GLU A 127 18.173 13.577 -31.150 1.00 0.00 H new ATOM 1951 N ALA A 128 14.136 10.891 -30.816 1.00 0.00 N ATOM 1952 CA ALA A 128 13.427 10.292 -29.692 1.00 0.00 C ATOM 1953 C ALA A 128 12.525 9.153 -30.157 1.00 0.00 C ATOM 1954 O ALA A 128 12.326 8.174 -29.438 1.00 0.00 O ATOM 1955 CB ALA A 128 12.613 11.347 -28.958 1.00 0.00 C ATOM 0 H ALA A 128 13.606 11.603 -31.318 1.00 0.00 H new ATOM 0 HA ALA A 128 14.167 9.879 -29.006 1.00 0.00 H new ATOM 0 HB1 ALA A 128 12.089 10.885 -28.121 1.00 0.00 H new ATOM 0 HB2 ALA A 128 13.279 12.125 -28.584 1.00 0.00 H new ATOM 0 HB3 ALA A 128 11.887 11.788 -29.642 1.00 0.00 H new ATOM 1961 N ASP A 129 11.982 9.289 -31.361 1.00 0.00 N ATOM 1962 CA ASP A 129 11.101 8.271 -31.922 1.00 0.00 C ATOM 1963 C ASP A 129 11.810 6.923 -32.003 1.00 0.00 C ATOM 1964 O ASP A 129 12.643 6.701 -32.883 1.00 0.00 O ATOM 1965 CB ASP A 129 10.619 8.692 -33.311 1.00 0.00 C ATOM 1966 CG ASP A 129 9.492 7.817 -33.823 1.00 0.00 C ATOM 1967 OD1 ASP A 129 8.634 7.418 -33.008 1.00 0.00 O ATOM 1968 OD2 ASP A 129 9.468 7.531 -35.038 1.00 0.00 O ATOM 0 H ASP A 129 12.136 10.094 -31.968 1.00 0.00 H new ATOM 0 HA ASP A 129 10.239 8.169 -31.263 1.00 0.00 H new ATOM 0 HB2 ASP A 129 10.284 9.729 -33.277 1.00 0.00 H new ATOM 0 HB3 ASP A 129 11.454 8.650 -34.010 1.00 0.00 H new ATOM 1973 N ILE A 130 11.476 6.028 -31.080 1.00 0.00 N ATOM 1974 CA ILE A 130 12.082 4.703 -31.048 1.00 0.00 C ATOM 1975 C ILE A 130 11.306 3.723 -31.922 1.00 0.00 C ATOM 1976 O ILE A 130 11.838 3.186 -32.894 1.00 0.00 O ATOM 1977 CB ILE A 130 12.150 4.150 -29.612 1.00 0.00 C ATOM 1978 CG1 ILE A 130 12.389 5.286 -28.616 1.00 0.00 C ATOM 1979 CG2 ILE A 130 13.246 3.100 -29.500 1.00 0.00 C ATOM 1980 CD1 ILE A 130 12.533 4.815 -27.185 1.00 0.00 C ATOM 0 H ILE A 130 10.789 6.196 -30.345 1.00 0.00 H new ATOM 0 HA ILE A 130 13.095 4.809 -31.436 1.00 0.00 H new ATOM 0 HB ILE A 130 11.197 3.678 -29.374 1.00 0.00 H new ATOM 0 HG12 ILE A 130 13.290 5.827 -28.904 1.00 0.00 H new ATOM 0 HG13 ILE A 130 11.560 5.991 -28.676 1.00 0.00 H new ATOM 0 HG21 ILE A 130 13.282 2.719 -28.479 1.00 0.00 H new ATOM 0 HG22 ILE A 130 13.036 2.280 -30.187 1.00 0.00 H new ATOM 0 HG23 ILE A 130 14.207 3.548 -29.754 1.00 0.00 H new ATOM 0 HD11 ILE A 130 12.700 5.673 -26.534 1.00 0.00 H new ATOM 0 HD12 ILE A 130 11.623 4.299 -26.878 1.00 0.00 H new ATOM 0 HD13 ILE A 130 13.380 4.133 -27.110 1.00 0.00 H new ATOM 1992 N ASP A 131 10.045 3.495 -31.570 1.00 0.00 N ATOM 1993 CA ASP A 131 9.194 2.581 -32.324 1.00 0.00 C ATOM 1994 C ASP A 131 9.341 2.816 -33.824 1.00 0.00 C ATOM 1995 O ASP A 131 9.367 1.870 -34.610 1.00 0.00 O ATOM 1996 CB ASP A 131 7.732 2.753 -31.908 1.00 0.00 C ATOM 1997 CG ASP A 131 7.397 4.187 -31.549 1.00 0.00 C ATOM 1998 OD1 ASP A 131 7.270 5.016 -32.474 1.00 0.00 O ATOM 1999 OD2 ASP A 131 7.262 4.480 -30.342 1.00 0.00 O ATOM 0 H ASP A 131 9.590 3.930 -30.768 1.00 0.00 H new ATOM 0 HA ASP A 131 9.509 1.561 -32.102 1.00 0.00 H new ATOM 0 HB2 ASP A 131 7.085 2.425 -32.721 1.00 0.00 H new ATOM 0 HB3 ASP A 131 7.522 2.109 -31.054 1.00 0.00 H new ATOM 2004 N GLY A 132 9.434 4.083 -34.214 1.00 0.00 N ATOM 2005 CA GLY A 132 9.575 4.419 -35.619 1.00 0.00 C ATOM 2006 C GLY A 132 8.237 4.599 -36.309 1.00 0.00 C ATOM 2007 O GLY A 132 7.999 4.029 -37.374 1.00 0.00 O ATOM 0 H GLY A 132 9.414 4.883 -33.582 1.00 0.00 H new ATOM 0 HA2 GLY A 132 10.155 5.337 -35.713 1.00 0.00 H new ATOM 0 HA3 GLY A 132 10.137 3.633 -36.123 1.00 0.00 H new ATOM 2011 N ASP A 133 7.362 5.392 -35.701 1.00 0.00 N ATOM 2012 CA ASP A 133 6.041 5.645 -36.263 1.00 0.00 C ATOM 2013 C ASP A 133 5.802 7.142 -36.439 1.00 0.00 C ATOM 2014 O ASP A 133 4.683 7.575 -36.712 1.00 0.00 O ATOM 2015 CB ASP A 133 4.957 5.045 -35.366 1.00 0.00 C ATOM 2016 CG ASP A 133 5.131 5.433 -33.910 1.00 0.00 C ATOM 2017 OD1 ASP A 133 5.767 6.474 -33.646 1.00 0.00 O ATOM 2018 OD2 ASP A 133 4.632 4.694 -33.036 1.00 0.00 O ATOM 0 H ASP A 133 7.544 5.871 -34.819 1.00 0.00 H new ATOM 0 HA ASP A 133 5.994 5.170 -37.243 1.00 0.00 H new ATOM 0 HB2 ASP A 133 3.978 5.376 -35.713 1.00 0.00 H new ATOM 0 HB3 ASP A 133 4.976 3.959 -35.455 1.00 0.00 H new ATOM 2023 N GLY A 134 6.863 7.928 -36.279 1.00 0.00 N ATOM 2024 CA GLY A 134 6.747 9.367 -36.422 1.00 0.00 C ATOM 2025 C GLY A 134 6.031 10.011 -35.251 1.00 0.00 C ATOM 2026 O GLY A 134 5.432 11.076 -35.392 1.00 0.00 O ATOM 0 H GLY A 134 7.800 7.594 -36.053 1.00 0.00 H new ATOM 0 HA2 GLY A 134 7.742 9.801 -36.518 1.00 0.00 H new ATOM 0 HA3 GLY A 134 6.210 9.595 -37.342 1.00 0.00 H new ATOM 2030 N GLN A 135 6.093 9.362 -34.093 1.00 0.00 N ATOM 2031 CA GLN A 135 5.443 9.877 -32.894 1.00 0.00 C ATOM 2032 C GLN A 135 6.389 9.832 -31.699 1.00 0.00 C ATOM 2033 O GLN A 135 7.385 9.107 -31.709 1.00 0.00 O ATOM 2034 CB GLN A 135 4.178 9.073 -32.588 1.00 0.00 C ATOM 2035 CG GLN A 135 3.297 8.838 -33.805 1.00 0.00 C ATOM 2036 CD GLN A 135 1.832 8.689 -33.445 1.00 0.00 C ATOM 2037 OE1 GLN A 135 1.054 9.636 -33.561 1.00 0.00 O ATOM 2038 NE2 GLN A 135 1.448 7.497 -33.005 1.00 0.00 N ATOM 0 H GLN A 135 6.586 8.479 -33.960 1.00 0.00 H new ATOM 0 HA GLN A 135 5.169 10.916 -33.078 1.00 0.00 H new ATOM 0 HB2 GLN A 135 4.463 8.110 -32.165 1.00 0.00 H new ATOM 0 HB3 GLN A 135 3.600 9.597 -31.827 1.00 0.00 H new ATOM 0 HG2 GLN A 135 3.414 9.670 -34.499 1.00 0.00 H new ATOM 0 HG3 GLN A 135 3.633 7.940 -34.324 1.00 0.00 H new ATOM 0 HE21 GLN A 135 2.127 6.740 -32.925 1.00 0.00 H new ATOM 0 HE22 GLN A 135 0.474 7.338 -32.747 1.00 0.00 H new ATOM 2047 N VAL A 136 6.073 10.611 -30.669 1.00 0.00 N ATOM 2048 CA VAL A 136 6.895 10.660 -29.466 1.00 0.00 C ATOM 2049 C VAL A 136 6.034 10.602 -28.209 1.00 0.00 C ATOM 2050 O VAL A 136 5.847 11.608 -27.526 1.00 0.00 O ATOM 2051 CB VAL A 136 7.757 11.935 -29.426 1.00 0.00 C ATOM 2052 CG1 VAL A 136 8.534 12.015 -28.121 1.00 0.00 C ATOM 2053 CG2 VAL A 136 8.700 11.978 -30.620 1.00 0.00 C ATOM 0 H VAL A 136 5.253 11.217 -30.644 1.00 0.00 H new ATOM 0 HA VAL A 136 7.550 9.789 -29.495 1.00 0.00 H new ATOM 0 HB VAL A 136 7.096 12.800 -29.481 1.00 0.00 H new ATOM 0 HG11 VAL A 136 9.137 12.923 -28.112 1.00 0.00 H new ATOM 0 HG12 VAL A 136 7.837 12.034 -27.283 1.00 0.00 H new ATOM 0 HG13 VAL A 136 9.185 11.146 -28.032 1.00 0.00 H new ATOM 0 HG21 VAL A 136 9.302 12.886 -30.576 1.00 0.00 H new ATOM 0 HG22 VAL A 136 9.355 11.107 -30.598 1.00 0.00 H new ATOM 0 HG23 VAL A 136 8.119 11.972 -31.543 1.00 0.00 H new ATOM 2063 N ASN A 137 5.512 9.417 -27.910 1.00 0.00 N ATOM 2064 CA ASN A 137 4.670 9.228 -26.735 1.00 0.00 C ATOM 2065 C ASN A 137 5.411 9.631 -25.464 1.00 0.00 C ATOM 2066 O ASN A 137 6.541 10.116 -25.519 1.00 0.00 O ATOM 2067 CB ASN A 137 4.219 7.769 -26.634 1.00 0.00 C ATOM 2068 CG ASN A 137 5.195 6.915 -25.849 1.00 0.00 C ATOM 2069 OD1 ASN A 137 5.042 6.727 -24.643 1.00 0.00 O ATOM 2070 ND2 ASN A 137 6.207 6.393 -26.534 1.00 0.00 N ATOM 0 H ASN A 137 5.657 8.574 -28.465 1.00 0.00 H new ATOM 0 HA ASN A 137 3.793 9.866 -26.841 1.00 0.00 H new ATOM 0 HB2 ASN A 137 3.239 7.727 -26.158 1.00 0.00 H new ATOM 0 HB3 ASN A 137 4.105 7.357 -27.637 1.00 0.00 H new ATOM 0 HD21 ASN A 137 6.897 5.810 -26.060 1.00 0.00 H new ATOM 0 HD22 ASN A 137 6.294 6.576 -27.534 1.00 0.00 H new ATOM 2077 N TYR A 138 4.766 9.428 -24.320 1.00 0.00 N ATOM 2078 CA TYR A 138 5.363 9.772 -23.035 1.00 0.00 C ATOM 2079 C TYR A 138 6.758 9.169 -22.903 1.00 0.00 C ATOM 2080 O TYR A 138 7.732 9.879 -22.657 1.00 0.00 O ATOM 2081 CB TYR A 138 4.474 9.284 -21.889 1.00 0.00 C ATOM 2082 CG TYR A 138 4.937 9.746 -20.526 1.00 0.00 C ATOM 2083 CD1 TYR A 138 4.699 11.045 -20.093 1.00 0.00 C ATOM 2084 CD2 TYR A 138 5.613 8.884 -19.671 1.00 0.00 C ATOM 2085 CE1 TYR A 138 5.120 11.471 -18.848 1.00 0.00 C ATOM 2086 CE2 TYR A 138 6.036 9.301 -18.424 1.00 0.00 C ATOM 2087 CZ TYR A 138 5.788 10.596 -18.017 1.00 0.00 C ATOM 2088 OH TYR A 138 6.209 11.016 -16.776 1.00 0.00 O ATOM 0 H TYR A 138 3.830 9.027 -24.257 1.00 0.00 H new ATOM 0 HA TYR A 138 5.450 10.857 -22.983 1.00 0.00 H new ATOM 0 HB2 TYR A 138 3.455 9.634 -22.056 1.00 0.00 H new ATOM 0 HB3 TYR A 138 4.443 8.195 -21.903 1.00 0.00 H new ATOM 0 HD1 TYR A 138 4.176 11.733 -20.741 1.00 0.00 H new ATOM 0 HD2 TYR A 138 5.811 7.870 -19.987 1.00 0.00 H new ATOM 0 HE1 TYR A 138 4.927 12.484 -18.527 1.00 0.00 H new ATOM 0 HE2 TYR A 138 6.558 8.617 -17.771 1.00 0.00 H new ATOM 0 HH TYR A 138 6.662 10.278 -16.317 1.00 0.00 H new ATOM 2098 N GLU A 139 6.845 7.852 -23.070 1.00 0.00 N ATOM 2099 CA GLU A 139 8.121 7.153 -22.970 1.00 0.00 C ATOM 2100 C GLU A 139 9.148 7.755 -23.924 1.00 0.00 C ATOM 2101 O GLU A 139 10.247 8.125 -23.515 1.00 0.00 O ATOM 2102 CB GLU A 139 7.937 5.665 -23.274 1.00 0.00 C ATOM 2103 CG GLU A 139 9.185 4.834 -23.028 1.00 0.00 C ATOM 2104 CD GLU A 139 9.201 3.552 -23.837 1.00 0.00 C ATOM 2105 OE1 GLU A 139 8.734 3.575 -24.995 1.00 0.00 O ATOM 2106 OE2 GLU A 139 9.680 2.525 -23.312 1.00 0.00 O ATOM 0 H GLU A 139 6.048 7.249 -23.275 1.00 0.00 H new ATOM 0 HA GLU A 139 8.489 7.266 -21.950 1.00 0.00 H new ATOM 0 HB2 GLU A 139 7.125 5.275 -22.661 1.00 0.00 H new ATOM 0 HB3 GLU A 139 7.634 5.550 -24.315 1.00 0.00 H new ATOM 0 HG2 GLU A 139 10.066 5.426 -23.275 1.00 0.00 H new ATOM 0 HG3 GLU A 139 9.252 4.591 -21.968 1.00 0.00 H new ATOM 2113 N GLU A 140 8.780 7.848 -25.198 1.00 0.00 N ATOM 2114 CA GLU A 140 9.670 8.403 -26.211 1.00 0.00 C ATOM 2115 C GLU A 140 10.117 9.812 -25.829 1.00 0.00 C ATOM 2116 O GLU A 140 11.233 10.227 -26.141 1.00 0.00 O ATOM 2117 CB GLU A 140 8.975 8.428 -27.574 1.00 0.00 C ATOM 2118 CG GLU A 140 8.732 7.047 -28.158 1.00 0.00 C ATOM 2119 CD GLU A 140 7.815 7.078 -29.366 1.00 0.00 C ATOM 2120 OE1 GLU A 140 6.584 7.161 -29.176 1.00 0.00 O ATOM 2121 OE2 GLU A 140 8.331 7.019 -30.502 1.00 0.00 O ATOM 0 H GLU A 140 7.873 7.546 -25.553 1.00 0.00 H new ATOM 0 HA GLU A 140 10.552 7.765 -26.273 1.00 0.00 H new ATOM 0 HB2 GLU A 140 8.020 8.945 -27.476 1.00 0.00 H new ATOM 0 HB3 GLU A 140 9.581 9.007 -28.271 1.00 0.00 H new ATOM 0 HG2 GLU A 140 9.686 6.604 -28.442 1.00 0.00 H new ATOM 0 HG3 GLU A 140 8.297 6.404 -27.393 1.00 0.00 H new ATOM 2128 N PHE A 141 9.236 10.542 -25.153 1.00 0.00 N ATOM 2129 CA PHE A 141 9.538 11.905 -24.730 1.00 0.00 C ATOM 2130 C PHE A 141 10.491 11.906 -23.538 1.00 0.00 C ATOM 2131 O PHE A 141 11.454 12.672 -23.500 1.00 0.00 O ATOM 2132 CB PHE A 141 8.249 12.646 -24.367 1.00 0.00 C ATOM 2133 CG PHE A 141 8.462 13.788 -23.415 1.00 0.00 C ATOM 2134 CD1 PHE A 141 9.346 14.809 -23.725 1.00 0.00 C ATOM 2135 CD2 PHE A 141 7.778 13.841 -22.212 1.00 0.00 C ATOM 2136 CE1 PHE A 141 9.545 15.861 -22.850 1.00 0.00 C ATOM 2137 CE2 PHE A 141 7.972 14.891 -21.333 1.00 0.00 C ATOM 2138 CZ PHE A 141 8.856 15.902 -21.654 1.00 0.00 C ATOM 0 H PHE A 141 8.308 10.213 -24.886 1.00 0.00 H new ATOM 0 HA PHE A 141 10.023 12.418 -25.561 1.00 0.00 H new ATOM 0 HB2 PHE A 141 7.788 13.025 -25.279 1.00 0.00 H new ATOM 0 HB3 PHE A 141 7.546 11.940 -23.924 1.00 0.00 H new ATOM 0 HD1 PHE A 141 9.885 14.783 -24.660 1.00 0.00 H new ATOM 0 HD2 PHE A 141 7.085 13.053 -21.957 1.00 0.00 H new ATOM 0 HE1 PHE A 141 10.239 16.650 -23.102 1.00 0.00 H new ATOM 0 HE2 PHE A 141 7.433 14.920 -20.397 1.00 0.00 H new ATOM 0 HZ PHE A 141 9.008 16.724 -20.970 1.00 0.00 H new ATOM 2148 N VAL A 142 10.215 11.042 -22.566 1.00 0.00 N ATOM 2149 CA VAL A 142 11.047 10.942 -21.373 1.00 0.00 C ATOM 2150 C VAL A 142 12.506 10.696 -21.740 1.00 0.00 C ATOM 2151 O VAL A 142 13.401 11.398 -21.269 1.00 0.00 O ATOM 2152 CB VAL A 142 10.564 9.811 -20.446 1.00 0.00 C ATOM 2153 CG1 VAL A 142 11.509 9.649 -19.265 1.00 0.00 C ATOM 2154 CG2 VAL A 142 9.145 10.082 -19.970 1.00 0.00 C ATOM 0 H VAL A 142 9.422 10.401 -22.582 1.00 0.00 H new ATOM 0 HA VAL A 142 10.963 11.893 -20.847 1.00 0.00 H new ATOM 0 HB VAL A 142 10.562 8.878 -21.010 1.00 0.00 H new ATOM 0 HG11 VAL A 142 11.152 8.846 -18.621 1.00 0.00 H new ATOM 0 HG12 VAL A 142 12.507 9.406 -19.629 1.00 0.00 H new ATOM 0 HG13 VAL A 142 11.546 10.579 -18.698 1.00 0.00 H new ATOM 0 HG21 VAL A 142 8.820 9.273 -19.316 1.00 0.00 H new ATOM 0 HG22 VAL A 142 9.119 11.024 -19.422 1.00 0.00 H new ATOM 0 HG23 VAL A 142 8.478 10.144 -20.830 1.00 0.00 H new ATOM 2164 N GLN A 143 12.738 9.695 -22.584 1.00 0.00 N ATOM 2165 CA GLN A 143 14.089 9.357 -23.013 1.00 0.00 C ATOM 2166 C GLN A 143 14.864 10.609 -23.410 1.00 0.00 C ATOM 2167 O GLN A 143 15.956 10.862 -22.901 1.00 0.00 O ATOM 2168 CB GLN A 143 14.043 8.378 -24.188 1.00 0.00 C ATOM 2169 CG GLN A 143 13.422 7.035 -23.837 1.00 0.00 C ATOM 2170 CD GLN A 143 14.351 6.158 -23.022 1.00 0.00 C ATOM 2171 OE1 GLN A 143 15.382 5.698 -23.515 1.00 0.00 O ATOM 2172 NE2 GLN A 143 13.992 5.921 -21.766 1.00 0.00 N ATOM 0 H GLN A 143 12.008 9.105 -22.983 1.00 0.00 H new ATOM 0 HA GLN A 143 14.602 8.885 -22.175 1.00 0.00 H new ATOM 0 HB2 GLN A 143 13.477 8.828 -25.004 1.00 0.00 H new ATOM 0 HB3 GLN A 143 15.057 8.216 -24.555 1.00 0.00 H new ATOM 0 HG2 GLN A 143 12.501 7.200 -23.278 1.00 0.00 H new ATOM 0 HG3 GLN A 143 13.149 6.514 -24.755 1.00 0.00 H new ATOM 0 HE21 GLN A 143 13.129 6.322 -21.398 1.00 0.00 H new ATOM 0 HE22 GLN A 143 14.579 5.338 -21.169 1.00 0.00 H new ATOM 2181 N MET A 144 14.293 11.389 -24.322 1.00 0.00 N ATOM 2182 CA MET A 144 14.930 12.616 -24.786 1.00 0.00 C ATOM 2183 C MET A 144 15.343 13.493 -23.608 1.00 0.00 C ATOM 2184 O MET A 144 16.488 13.936 -23.524 1.00 0.00 O ATOM 2185 CB MET A 144 13.985 13.390 -25.707 1.00 0.00 C ATOM 2186 CG MET A 144 14.502 14.767 -26.088 1.00 0.00 C ATOM 2187 SD MET A 144 13.510 15.550 -27.374 1.00 0.00 S ATOM 2188 CE MET A 144 12.006 15.910 -26.469 1.00 0.00 C ATOM 0 H MET A 144 13.390 11.193 -24.754 1.00 0.00 H new ATOM 0 HA MET A 144 15.826 12.342 -25.344 1.00 0.00 H new ATOM 0 HB2 MET A 144 13.819 12.809 -26.614 1.00 0.00 H new ATOM 0 HB3 MET A 144 13.018 13.497 -25.215 1.00 0.00 H new ATOM 0 HG2 MET A 144 14.512 15.404 -25.204 1.00 0.00 H new ATOM 0 HG3 MET A 144 15.533 14.682 -26.431 1.00 0.00 H new ATOM 0 HE1 MET A 144 11.184 15.327 -26.884 1.00 0.00 H new ATOM 0 HE2 MET A 144 12.142 15.650 -25.419 1.00 0.00 H new ATOM 0 HE3 MET A 144 11.776 16.972 -26.553 1.00 0.00 H new ATOM 2198 N MET A 145 14.403 13.739 -22.702 1.00 0.00 N ATOM 2199 CA MET A 145 14.671 14.563 -21.528 1.00 0.00 C ATOM 2200 C MET A 145 15.862 14.022 -20.744 1.00 0.00 C ATOM 2201 O MET A 145 16.715 14.783 -20.286 1.00 0.00 O ATOM 2202 CB MET A 145 13.436 14.621 -20.627 1.00 0.00 C ATOM 2203 CG MET A 145 12.234 15.281 -21.284 1.00 0.00 C ATOM 2204 SD MET A 145 12.569 16.976 -21.800 1.00 0.00 S ATOM 2205 CE MET A 145 13.026 17.722 -20.237 1.00 0.00 C ATOM 0 H MET A 145 13.450 13.380 -22.757 1.00 0.00 H new ATOM 0 HA MET A 145 14.911 15.570 -21.869 1.00 0.00 H new ATOM 0 HB2 MET A 145 13.166 13.608 -20.329 1.00 0.00 H new ATOM 0 HB3 MET A 145 13.686 15.165 -19.716 1.00 0.00 H new ATOM 0 HG2 MET A 145 11.931 14.694 -22.151 1.00 0.00 H new ATOM 0 HG3 MET A 145 11.396 15.276 -20.587 1.00 0.00 H new ATOM 0 HE1 MET A 145 12.969 18.807 -20.321 1.00 0.00 H new ATOM 0 HE2 MET A 145 12.343 17.382 -19.458 1.00 0.00 H new ATOM 0 HE3 MET A 145 14.044 17.431 -19.979 1.00 0.00 H new ATOM 2215 N THR A 146 15.915 12.702 -20.593 1.00 0.00 N ATOM 2216 CA THR A 146 17.001 12.059 -19.863 1.00 0.00 C ATOM 2217 C THR A 146 17.954 11.343 -20.814 1.00 0.00 C ATOM 2218 O THR A 146 18.398 10.229 -20.539 1.00 0.00 O ATOM 2219 CB THR A 146 16.464 11.047 -18.834 1.00 0.00 C ATOM 2220 OG1 THR A 146 15.619 10.090 -19.482 1.00 0.00 O ATOM 2221 CG2 THR A 146 15.686 11.755 -17.734 1.00 0.00 C ATOM 0 H THR A 146 15.218 12.057 -20.967 1.00 0.00 H new ATOM 0 HA THR A 146 17.540 12.848 -19.338 1.00 0.00 H new ATOM 0 HB THR A 146 17.314 10.534 -18.384 1.00 0.00 H new ATOM 0 HG1 THR A 146 15.283 9.449 -18.821 1.00 0.00 H new ATOM 0 HG21 THR A 146 15.316 11.020 -17.019 1.00 0.00 H new ATOM 0 HG22 THR A 146 16.340 12.462 -17.223 1.00 0.00 H new ATOM 0 HG23 THR A 146 14.844 12.291 -18.171 1.00 0.00 H new