USER MOD reduce.3.24.130724 H: found=0, std=0, add=1147, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1151 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 16 SER OG : rot -27:sc= -0.0307 USER MOD Set 1.2: A 153 GLN : amide:sc= -1.48! C(o=-1.5!,f=-3.7!) USER MOD Set 2.1: A 115 TYR OH : rot 57:sc= 0.708 USER MOD Set 2.2: A 119 LYS NZ :NH3+ -142:sc= -1.91 (180deg=-1.77) USER MOD Single : A 15 SER OG : rot -69:sc= -1.93 USER MOD Single : A 18 GLN : amide:sc= -0.16 X(o=-0.16,f=-0.15) USER MOD Single : A 20 MET CE :methyl 144:sc= -0.914 (180deg=-4!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 84:sc= 1.2 USER MOD Single : A 28 GLN : amide:sc= -0.299 X(o=-0.3,f=0) USER MOD Single : A 32 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ -153:sc= -0.124 (180deg=-0.653) USER MOD Single : A 58 LYS NZ :NH3+ -173:sc= 0.513 (180deg=0.48) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 CYS SG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 155:sc= -0.0367 (180deg=-0.513) USER MOD Single : A 72 SER OG : rot -30:sc= 0.0861 USER MOD Single : A 73 ASN : amide:sc= -0.469 K(o=-0.47,f=-5.8!) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 MET CE :methyl -149:sc= -0.0334 (180deg=-1.97) USER MOD Single : A 99 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot -100:sc= 0.955 USER MOD Single : A 123 LYS NZ :NH3+ -162:sc= -0.0334 (180deg=-0.496) USER MOD Single : A 126 CYS SG : rot -79:sc= -0.938 USER MOD Single : A 127 THR OG1 : rot -19:sc= 0.307 USER MOD Single : A 128 LYS NZ :NH3+ 160:sc= -0.0674 (180deg=-0.545) USER MOD Single : A 135 THR OG1 : rot 89:sc= 1.17 USER MOD Single : A 137 MET CE :methyl -156:sc= -0.0185 (180deg=-0.363) USER MOD Single : A 140 THR OG1 : rot -23:sc= -1.02 USER MOD Single : A 155 GLN : amide:sc= 0.866 K(o=0.87,f=-0.88) USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 171 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD Single : A 174 THR OG1 : rot 160:sc= -0.325 USER MOD Single : A 182 THR OG1 : rot 106:sc= 1.16 USER MOD Single : A 184 SER OG : rot -32:sc= 0.117 USER MOD Single : A 186 THR OG1 : rot 17:sc= 1.1 USER MOD ----------------------------------------------------------------- ATOM 176 N SER A 15 20.225 1.538 -1.580 1.00 1.07 N ATOM 177 CA SER A 15 20.097 2.741 -0.707 1.00 0.91 C ATOM 178 C SER A 15 18.672 2.774 -0.146 1.00 0.75 C ATOM 179 O SER A 15 17.706 2.734 -0.882 1.00 0.78 O ATOM 180 CB SER A 15 20.354 4.008 -1.522 1.00 0.99 C ATOM 181 OG SER A 15 19.338 4.149 -2.505 1.00 1.38 O ATOM 0 HA SER A 15 20.825 2.693 0.103 1.00 0.91 H new ATOM 0 HB2 SER A 15 20.366 4.879 -0.867 1.00 0.99 H new ATOM 0 HB3 SER A 15 21.333 3.955 -1.999 1.00 0.99 H new ATOM 0 HG SER A 15 19.439 3.448 -3.183 1.00 1.38 H new ATOM 187 N SER A 16 18.529 2.837 1.149 1.00 0.72 N ATOM 188 CA SER A 16 17.163 2.858 1.749 1.00 0.82 C ATOM 189 C SER A 16 16.384 4.067 1.229 1.00 0.81 C ATOM 190 O SER A 16 15.171 4.043 1.142 1.00 0.92 O ATOM 191 CB SER A 16 17.276 2.949 3.271 1.00 1.06 C ATOM 192 OG SER A 16 18.005 1.830 3.757 1.00 1.64 O ATOM 0 H SER A 16 19.298 2.875 1.818 1.00 0.72 H new ATOM 0 HA SER A 16 16.638 1.944 1.472 1.00 0.82 H new ATOM 0 HB2 SER A 16 17.777 3.875 3.555 1.00 1.06 H new ATOM 0 HB3 SER A 16 16.283 2.973 3.720 1.00 1.06 H new ATOM 0 HG SER A 16 17.898 1.076 3.140 1.00 1.64 H new ATOM 198 N GLU A 17 17.063 5.124 0.880 1.00 0.80 N ATOM 199 CA GLU A 17 16.349 6.327 0.368 1.00 0.94 C ATOM 200 C GLU A 17 15.727 6.017 -0.997 1.00 0.85 C ATOM 201 O GLU A 17 14.727 6.597 -1.373 1.00 0.89 O ATOM 202 CB GLU A 17 17.333 7.495 0.244 1.00 1.13 C ATOM 203 CG GLU A 17 16.568 8.810 0.078 1.00 1.71 C ATOM 204 CD GLU A 17 15.979 9.237 1.424 1.00 2.26 C ATOM 205 OE1 GLU A 17 16.721 9.777 2.228 1.00 2.90 O ATOM 206 OE2 GLU A 17 14.797 9.017 1.628 1.00 2.68 O ATOM 0 H GLU A 17 18.079 5.207 0.927 1.00 0.80 H new ATOM 0 HA GLU A 17 15.556 6.601 1.064 1.00 0.94 H new ATOM 0 HB2 GLU A 17 17.967 7.543 1.130 1.00 1.13 H new ATOM 0 HB3 GLU A 17 17.991 7.337 -0.611 1.00 1.13 H new ATOM 0 HG2 GLU A 17 17.235 9.585 -0.300 1.00 1.71 H new ATOM 0 HG3 GLU A 17 15.772 8.689 -0.656 1.00 1.71 H new ATOM 213 N GLN A 18 16.293 5.106 -1.742 1.00 0.80 N ATOM 214 CA GLN A 18 15.706 4.773 -3.072 1.00 0.83 C ATOM 215 C GLN A 18 14.453 3.918 -2.868 1.00 0.68 C ATOM 216 O GLN A 18 13.522 3.971 -3.647 1.00 0.69 O ATOM 217 CB GLN A 18 16.729 3.991 -3.909 1.00 0.96 C ATOM 218 CG GLN A 18 17.716 4.963 -4.562 1.00 1.53 C ATOM 219 CD GLN A 18 17.037 5.675 -5.734 1.00 2.23 C ATOM 220 OE1 GLN A 18 16.882 6.880 -5.720 1.00 2.69 O ATOM 221 NE2 GLN A 18 16.624 4.977 -6.756 1.00 3.07 N ATOM 0 H GLN A 18 17.130 4.581 -1.490 1.00 0.80 H new ATOM 0 HA GLN A 18 15.443 5.693 -3.595 1.00 0.83 H new ATOM 0 HB2 GLN A 18 17.265 3.284 -3.277 1.00 0.96 H new ATOM 0 HB3 GLN A 18 16.217 3.409 -4.675 1.00 0.96 H new ATOM 0 HG2 GLN A 18 18.060 5.694 -3.830 1.00 1.53 H new ATOM 0 HG3 GLN A 18 18.596 4.423 -4.912 1.00 1.53 H new ATOM 0 HE21 GLN A 18 16.754 3.965 -6.769 1.00 3.07 H new ATOM 0 HE22 GLN A 18 16.171 5.443 -7.542 1.00 3.07 H new ATOM 230 N ILE A 19 14.415 3.139 -1.821 1.00 0.59 N ATOM 231 CA ILE A 19 13.211 2.301 -1.577 1.00 0.58 C ATOM 232 C ILE A 19 12.023 3.233 -1.331 1.00 0.52 C ATOM 233 O ILE A 19 10.917 2.957 -1.755 1.00 0.59 O ATOM 234 CB ILE A 19 13.447 1.359 -0.382 1.00 0.64 C ATOM 235 CG1 ILE A 19 14.421 0.250 -0.795 1.00 0.74 C ATOM 236 CG2 ILE A 19 12.124 0.738 0.084 1.00 0.73 C ATOM 237 CD1 ILE A 19 14.827 -0.566 0.436 1.00 0.81 C ATOM 0 H ILE A 19 15.160 3.048 -1.130 1.00 0.59 H new ATOM 0 HA ILE A 19 13.002 1.673 -2.443 1.00 0.58 H new ATOM 0 HB ILE A 19 13.870 1.933 0.442 1.00 0.64 H new ATOM 0 HG12 ILE A 19 13.955 -0.399 -1.536 1.00 0.74 H new ATOM 0 HG13 ILE A 19 15.305 0.684 -1.263 1.00 0.74 H new ATOM 0 HG21 ILE A 19 12.311 0.075 0.929 1.00 0.73 H new ATOM 0 HG22 ILE A 19 11.438 1.529 0.388 1.00 0.73 H new ATOM 0 HG23 ILE A 19 11.682 0.168 -0.733 1.00 0.73 H new ATOM 0 HD11 ILE A 19 15.519 -1.353 0.138 1.00 0.81 H new ATOM 0 HD12 ILE A 19 15.311 0.087 1.162 1.00 0.81 H new ATOM 0 HD13 ILE A 19 13.940 -1.013 0.885 1.00 0.81 H new ATOM 249 N MET A 20 12.223 4.325 -0.634 1.00 0.51 N ATOM 250 CA MET A 20 11.054 5.228 -0.375 1.00 0.60 C ATOM 251 C MET A 20 10.703 5.954 -1.682 1.00 0.55 C ATOM 252 O MET A 20 9.544 6.113 -2.014 1.00 0.59 O ATOM 253 CB MET A 20 11.356 6.232 0.728 1.00 0.82 C ATOM 254 CG MET A 20 11.337 5.561 2.093 1.00 1.07 C ATOM 255 SD MET A 20 11.646 6.811 3.368 1.00 1.43 S ATOM 256 CE MET A 20 10.145 7.798 3.118 1.00 0.93 C ATOM 0 H MET A 20 13.116 4.626 -0.243 1.00 0.51 H new ATOM 0 HA MET A 20 10.208 4.629 -0.038 1.00 0.60 H new ATOM 0 HB2 MET A 20 12.332 6.686 0.555 1.00 0.82 H new ATOM 0 HB3 MET A 20 10.621 7.037 0.704 1.00 0.82 H new ATOM 0 HG2 MET A 20 10.374 5.080 2.263 1.00 1.07 H new ATOM 0 HG3 MET A 20 12.096 4.780 2.139 1.00 1.07 H new ATOM 0 HE1 MET A 20 9.791 8.172 4.079 1.00 0.93 H new ATOM 0 HE2 MET A 20 10.368 8.639 2.461 1.00 0.93 H new ATOM 0 HE3 MET A 20 9.373 7.177 2.663 1.00 0.93 H new ATOM 266 N LYS A 21 11.679 6.361 -2.441 1.00 0.57 N ATOM 267 CA LYS A 21 11.377 7.038 -3.736 1.00 0.61 C ATOM 268 C LYS A 21 10.681 6.057 -4.679 1.00 0.53 C ATOM 269 O LYS A 21 9.636 6.349 -5.227 1.00 0.51 O ATOM 270 CB LYS A 21 12.673 7.518 -4.386 1.00 0.72 C ATOM 271 CG LYS A 21 13.264 8.662 -3.562 1.00 1.09 C ATOM 272 CD LYS A 21 14.644 9.023 -4.113 1.00 1.24 C ATOM 273 CE LYS A 21 15.174 10.266 -3.397 1.00 1.80 C ATOM 274 NZ LYS A 21 16.629 10.419 -3.680 1.00 2.40 N ATOM 0 H LYS A 21 12.670 6.256 -2.224 1.00 0.57 H new ATOM 0 HA LYS A 21 10.726 7.891 -3.545 1.00 0.61 H new ATOM 0 HB2 LYS A 21 13.386 6.696 -4.450 1.00 0.72 H new ATOM 0 HB3 LYS A 21 12.479 7.852 -5.405 1.00 0.72 H new ATOM 0 HG2 LYS A 21 12.606 9.530 -3.600 1.00 1.09 H new ATOM 0 HG3 LYS A 21 13.343 8.368 -2.515 1.00 1.09 H new ATOM 0 HD2 LYS A 21 15.332 8.189 -3.973 1.00 1.24 H new ATOM 0 HD3 LYS A 21 14.581 9.208 -5.185 1.00 1.24 H new ATOM 0 HE2 LYS A 21 14.632 11.151 -3.732 1.00 1.80 H new ATOM 0 HE3 LYS A 21 15.009 10.179 -2.323 1.00 1.80 H new ATOM 0 HZ1 LYS A 21 16.990 11.264 -3.193 1.00 2.40 H new ATOM 0 HZ2 LYS A 21 17.139 9.579 -3.340 1.00 2.40 H new ATOM 0 HZ3 LYS A 21 16.775 10.521 -4.705 1.00 2.40 H new ATOM 288 N THR A 22 11.234 4.889 -4.866 1.00 0.53 N ATOM 289 CA THR A 22 10.586 3.892 -5.767 1.00 0.52 C ATOM 290 C THR A 22 9.167 3.598 -5.276 1.00 0.45 C ATOM 291 O THR A 22 8.223 3.592 -6.040 1.00 0.48 O ATOM 292 CB THR A 22 11.406 2.596 -5.744 1.00 0.55 C ATOM 293 OG1 THR A 22 12.781 2.906 -5.922 1.00 0.64 O ATOM 294 CG2 THR A 22 10.943 1.670 -6.872 1.00 0.62 C ATOM 0 H THR A 22 12.106 4.582 -4.434 1.00 0.53 H new ATOM 0 HA THR A 22 10.541 4.290 -6.781 1.00 0.52 H new ATOM 0 HB THR A 22 11.263 2.095 -4.786 1.00 0.55 H new ATOM 0 HG1 THR A 22 13.176 3.149 -5.059 1.00 0.64 H new ATOM 0 HG21 THR A 22 11.528 0.751 -6.852 1.00 0.62 H new ATOM 0 HG22 THR A 22 9.888 1.431 -6.737 1.00 0.62 H new ATOM 0 HG23 THR A 22 11.082 2.168 -7.832 1.00 0.62 H new ATOM 302 N GLY A 23 9.011 3.372 -4.000 1.00 0.42 N ATOM 303 CA GLY A 23 7.656 3.088 -3.441 1.00 0.43 C ATOM 304 C GLY A 23 6.720 4.264 -3.716 1.00 0.41 C ATOM 305 O GLY A 23 5.649 4.088 -4.262 1.00 0.47 O ATOM 0 H GLY A 23 9.768 3.372 -3.316 1.00 0.42 H new ATOM 0 HA2 GLY A 23 7.252 2.179 -3.888 1.00 0.43 H new ATOM 0 HA3 GLY A 23 7.726 2.912 -2.368 1.00 0.43 H new ATOM 309 N ALA A 24 7.109 5.463 -3.387 1.00 0.40 N ATOM 310 CA ALA A 24 6.232 6.630 -3.685 1.00 0.41 C ATOM 311 C ALA A 24 5.810 6.582 -5.156 1.00 0.41 C ATOM 312 O ALA A 24 4.797 7.125 -5.549 1.00 0.41 O ATOM 313 CB ALA A 24 7.029 7.916 -3.450 1.00 0.42 C ATOM 0 H ALA A 24 7.992 5.686 -2.927 1.00 0.40 H new ATOM 0 HA ALA A 24 5.351 6.603 -3.043 1.00 0.41 H new ATOM 0 HB1 ALA A 24 6.399 8.779 -3.665 1.00 0.42 H new ATOM 0 HB2 ALA A 24 7.358 7.956 -2.411 1.00 0.42 H new ATOM 0 HB3 ALA A 24 7.899 7.930 -4.106 1.00 0.42 H new ATOM 319 N LEU A 25 6.604 5.928 -5.972 1.00 0.42 N ATOM 320 CA LEU A 25 6.286 5.831 -7.425 1.00 0.44 C ATOM 321 C LEU A 25 5.223 4.743 -7.619 1.00 0.44 C ATOM 322 O LEU A 25 4.183 4.967 -8.205 1.00 0.46 O ATOM 323 CB LEU A 25 7.580 5.490 -8.194 1.00 0.47 C ATOM 324 CG LEU A 25 7.639 6.250 -9.524 1.00 0.77 C ATOM 325 CD1 LEU A 25 9.037 6.110 -10.126 1.00 1.58 C ATOM 326 CD2 LEU A 25 6.604 5.667 -10.490 1.00 1.67 C ATOM 0 H LEU A 25 7.462 5.456 -5.688 1.00 0.42 H new ATOM 0 HA LEU A 25 5.895 6.774 -7.807 1.00 0.44 H new ATOM 0 HB2 LEU A 25 8.448 5.745 -7.586 1.00 0.47 H new ATOM 0 HB3 LEU A 25 7.625 4.417 -8.381 1.00 0.47 H new ATOM 0 HG LEU A 25 7.421 7.304 -9.353 1.00 0.77 H new ATOM 0 HD11 LEU A 25 9.081 6.650 -11.072 1.00 1.58 H new ATOM 0 HD12 LEU A 25 9.773 6.524 -9.437 1.00 1.58 H new ATOM 0 HD13 LEU A 25 9.255 5.056 -10.299 1.00 1.58 H new ATOM 0 HD21 LEU A 25 6.645 6.207 -11.436 1.00 1.67 H new ATOM 0 HD22 LEU A 25 6.821 4.613 -10.664 1.00 1.67 H new ATOM 0 HD23 LEU A 25 5.608 5.766 -10.059 1.00 1.67 H new ATOM 338 N LEU A 26 5.498 3.558 -7.140 1.00 0.45 N ATOM 339 CA LEU A 26 4.529 2.436 -7.292 1.00 0.47 C ATOM 340 C LEU A 26 3.133 2.906 -6.887 1.00 0.49 C ATOM 341 O LEU A 26 2.177 2.752 -7.622 1.00 0.52 O ATOM 342 CB LEU A 26 4.957 1.270 -6.375 1.00 0.51 C ATOM 343 CG LEU A 26 5.895 0.314 -7.128 1.00 0.69 C ATOM 344 CD1 LEU A 26 7.198 1.032 -7.457 1.00 1.17 C ATOM 345 CD2 LEU A 26 6.192 -0.899 -6.246 1.00 1.35 C ATOM 0 H LEU A 26 6.358 3.319 -6.647 1.00 0.45 H new ATOM 0 HA LEU A 26 4.514 2.106 -8.331 1.00 0.47 H new ATOM 0 HB2 LEU A 26 5.459 1.660 -5.490 1.00 0.51 H new ATOM 0 HB3 LEU A 26 4.076 0.729 -6.029 1.00 0.51 H new ATOM 0 HG LEU A 26 5.418 -0.012 -8.052 1.00 0.69 H new ATOM 0 HD11 LEU A 26 7.863 0.353 -7.991 1.00 1.17 H new ATOM 0 HD12 LEU A 26 6.987 1.900 -8.082 1.00 1.17 H new ATOM 0 HD13 LEU A 26 7.677 1.357 -6.534 1.00 1.17 H new ATOM 0 HD21 LEU A 26 6.857 -1.580 -6.776 1.00 1.35 H new ATOM 0 HD22 LEU A 26 6.670 -0.570 -5.323 1.00 1.35 H new ATOM 0 HD23 LEU A 26 5.261 -1.413 -6.009 1.00 1.35 H new ATOM 357 N LEU A 27 3.004 3.460 -5.712 1.00 0.50 N ATOM 358 CA LEU A 27 1.663 3.913 -5.262 1.00 0.56 C ATOM 359 C LEU A 27 1.165 4.986 -6.231 1.00 0.56 C ATOM 360 O LEU A 27 0.042 4.938 -6.692 1.00 0.60 O ATOM 361 CB LEU A 27 1.763 4.447 -3.824 1.00 0.64 C ATOM 362 CG LEU A 27 0.449 5.097 -3.377 1.00 0.95 C ATOM 363 CD1 LEU A 27 -0.679 4.061 -3.387 1.00 1.66 C ATOM 364 CD2 LEU A 27 0.625 5.647 -1.958 1.00 1.42 C ATOM 0 H LEU A 27 3.765 3.616 -5.051 1.00 0.50 H new ATOM 0 HA LEU A 27 0.951 3.088 -5.261 1.00 0.56 H new ATOM 0 HB2 LEU A 27 2.015 3.630 -3.148 1.00 0.64 H new ATOM 0 HB3 LEU A 27 2.571 5.175 -3.760 1.00 0.64 H new ATOM 0 HG LEU A 27 0.192 5.905 -4.062 1.00 0.95 H new ATOM 0 HD11 LEU A 27 -1.609 4.532 -3.068 1.00 1.66 H new ATOM 0 HD12 LEU A 27 -0.800 3.665 -4.395 1.00 1.66 H new ATOM 0 HD13 LEU A 27 -0.432 3.247 -2.705 1.00 1.66 H new ATOM 0 HD21 LEU A 27 -0.305 6.112 -1.630 1.00 1.42 H new ATOM 0 HD22 LEU A 27 0.882 4.832 -1.281 1.00 1.42 H new ATOM 0 HD23 LEU A 27 1.424 6.389 -1.952 1.00 1.42 H new ATOM 376 N GLN A 28 1.975 5.963 -6.539 1.00 0.55 N ATOM 377 CA GLN A 28 1.523 7.030 -7.475 1.00 0.58 C ATOM 378 C GLN A 28 1.113 6.404 -8.811 1.00 0.54 C ATOM 379 O GLN A 28 0.180 6.841 -9.455 1.00 0.58 O ATOM 380 CB GLN A 28 2.677 8.009 -7.712 1.00 0.60 C ATOM 381 CG GLN A 28 2.178 9.195 -8.540 1.00 1.00 C ATOM 382 CD GLN A 28 3.260 10.276 -8.594 1.00 1.40 C ATOM 383 OE1 GLN A 28 2.963 11.453 -8.527 1.00 2.09 O ATOM 384 NE2 GLN A 28 4.511 9.925 -8.713 1.00 1.91 N ATOM 0 H GLN A 28 2.926 6.068 -6.184 1.00 0.55 H new ATOM 0 HA GLN A 28 0.670 7.555 -7.044 1.00 0.58 H new ATOM 0 HB2 GLN A 28 3.073 8.358 -6.759 1.00 0.60 H new ATOM 0 HB3 GLN A 28 3.493 7.507 -8.231 1.00 0.60 H new ATOM 0 HG2 GLN A 28 1.927 8.867 -9.549 1.00 1.00 H new ATOM 0 HG3 GLN A 28 1.267 9.600 -8.100 1.00 1.00 H new ATOM 0 HE21 GLN A 28 4.761 8.938 -8.769 1.00 1.91 H new ATOM 0 HE22 GLN A 28 5.239 10.638 -8.750 1.00 1.91 H new ATOM 393 N GLY A 29 1.822 5.392 -9.238 1.00 0.50 N ATOM 394 CA GLY A 29 1.499 4.739 -10.540 1.00 0.48 C ATOM 395 C GLY A 29 0.217 3.912 -10.417 1.00 0.44 C ATOM 396 O GLY A 29 -0.732 4.113 -11.148 1.00 0.50 O ATOM 0 H GLY A 29 2.614 4.988 -8.738 1.00 0.50 H new ATOM 0 HA2 GLY A 29 1.378 5.497 -11.314 1.00 0.48 H new ATOM 0 HA3 GLY A 29 2.325 4.098 -10.848 1.00 0.48 H new ATOM 400 N PHE A 30 0.182 2.976 -9.508 1.00 0.44 N ATOM 401 CA PHE A 30 -1.041 2.134 -9.357 1.00 0.43 C ATOM 402 C PHE A 30 -2.257 3.041 -9.142 1.00 0.40 C ATOM 403 O PHE A 30 -3.387 2.611 -9.260 1.00 0.43 O ATOM 404 CB PHE A 30 -0.865 1.186 -8.162 1.00 0.47 C ATOM 405 CG PHE A 30 -2.172 0.481 -7.858 1.00 0.47 C ATOM 406 CD1 PHE A 30 -2.775 -0.324 -8.832 1.00 1.39 C ATOM 407 CD2 PHE A 30 -2.778 0.627 -6.600 1.00 1.20 C ATOM 408 CE1 PHE A 30 -3.980 -0.980 -8.552 1.00 1.42 C ATOM 409 CE2 PHE A 30 -3.982 -0.031 -6.323 1.00 1.21 C ATOM 410 CZ PHE A 30 -4.583 -0.833 -7.298 1.00 0.58 C ATOM 0 H PHE A 30 0.943 2.758 -8.865 1.00 0.44 H new ATOM 0 HA PHE A 30 -1.196 1.540 -10.258 1.00 0.43 H new ATOM 0 HB2 PHE A 30 -0.090 0.452 -8.382 1.00 0.47 H new ATOM 0 HB3 PHE A 30 -0.534 1.748 -7.288 1.00 0.47 H new ATOM 0 HD1 PHE A 30 -2.310 -0.439 -9.800 1.00 1.39 H new ATOM 0 HD2 PHE A 30 -2.315 1.247 -5.846 1.00 1.20 H new ATOM 0 HE1 PHE A 30 -4.444 -1.600 -9.305 1.00 1.42 H new ATOM 0 HE2 PHE A 30 -4.447 0.081 -5.355 1.00 1.21 H new ATOM 0 HZ PHE A 30 -5.513 -1.339 -7.083 1.00 0.58 H new ATOM 420 N ILE A 31 -2.039 4.296 -8.852 1.00 0.40 N ATOM 421 CA ILE A 31 -3.190 5.230 -8.657 1.00 0.40 C ATOM 422 C ILE A 31 -3.616 5.768 -10.031 1.00 0.40 C ATOM 423 O ILE A 31 -4.772 5.699 -10.401 1.00 0.43 O ATOM 424 CB ILE A 31 -2.760 6.384 -7.731 1.00 0.41 C ATOM 425 CG1 ILE A 31 -2.829 5.917 -6.274 1.00 0.53 C ATOM 426 CG2 ILE A 31 -3.676 7.602 -7.920 1.00 0.72 C ATOM 427 CD1 ILE A 31 -2.134 6.941 -5.374 1.00 0.48 C ATOM 0 H ILE A 31 -1.116 4.716 -8.742 1.00 0.40 H new ATOM 0 HA ILE A 31 -4.031 4.713 -8.195 1.00 0.40 H new ATOM 0 HB ILE A 31 -1.740 6.673 -7.983 1.00 0.41 H new ATOM 0 HG12 ILE A 31 -3.868 5.796 -5.969 1.00 0.53 H new ATOM 0 HG13 ILE A 31 -2.351 4.943 -6.171 1.00 0.53 H new ATOM 0 HG21 ILE A 31 -3.355 8.405 -7.257 1.00 0.72 H new ATOM 0 HG22 ILE A 31 -3.621 7.942 -8.954 1.00 0.72 H new ATOM 0 HG23 ILE A 31 -4.703 7.325 -7.683 1.00 0.72 H new ATOM 0 HD11 ILE A 31 -2.184 6.608 -4.337 1.00 0.48 H new ATOM 0 HD12 ILE A 31 -1.091 7.040 -5.674 1.00 0.48 H new ATOM 0 HD13 ILE A 31 -2.632 7.906 -5.469 1.00 0.48 H new ATOM 439 N GLN A 32 -2.699 6.311 -10.781 1.00 0.42 N ATOM 440 CA GLN A 32 -3.059 6.859 -12.120 1.00 0.47 C ATOM 441 C GLN A 32 -3.816 5.805 -12.932 1.00 0.50 C ATOM 442 O GLN A 32 -4.801 6.100 -13.580 1.00 0.61 O ATOM 443 CB GLN A 32 -1.784 7.261 -12.863 1.00 0.57 C ATOM 444 CG GLN A 32 -1.137 8.453 -12.154 1.00 1.19 C ATOM 445 CD GLN A 32 0.191 8.793 -12.833 1.00 1.59 C ATOM 446 OE1 GLN A 32 0.644 8.074 -13.701 1.00 2.16 O ATOM 447 NE2 GLN A 32 0.838 9.867 -12.471 1.00 2.21 N ATOM 0 H GLN A 32 -1.715 6.400 -10.526 1.00 0.42 H new ATOM 0 HA GLN A 32 -3.698 7.732 -11.990 1.00 0.47 H new ATOM 0 HB2 GLN A 32 -1.089 6.422 -12.895 1.00 0.57 H new ATOM 0 HB3 GLN A 32 -2.018 7.521 -13.895 1.00 0.57 H new ATOM 0 HG2 GLN A 32 -1.804 9.314 -12.186 1.00 1.19 H new ATOM 0 HG3 GLN A 32 -0.970 8.217 -11.103 1.00 1.19 H new ATOM 0 HE21 GLN A 32 0.457 10.470 -11.742 1.00 2.21 H new ATOM 0 HE22 GLN A 32 1.724 10.103 -12.917 1.00 2.21 H new ATOM 456 N ASP A 33 -3.365 4.580 -12.912 1.00 0.49 N ATOM 457 CA ASP A 33 -4.060 3.514 -13.692 1.00 0.58 C ATOM 458 C ASP A 33 -5.443 3.255 -13.092 1.00 0.61 C ATOM 459 O ASP A 33 -6.421 3.110 -13.797 1.00 0.70 O ATOM 460 CB ASP A 33 -3.235 2.226 -13.637 1.00 0.61 C ATOM 461 CG ASP A 33 -1.873 2.462 -14.293 1.00 1.10 C ATOM 462 OD1 ASP A 33 -1.220 3.426 -13.926 1.00 1.89 O ATOM 463 OD2 ASP A 33 -1.506 1.675 -15.149 1.00 1.78 O ATOM 0 H ASP A 33 -2.545 4.271 -12.390 1.00 0.49 H new ATOM 0 HA ASP A 33 -4.169 3.837 -14.727 1.00 0.58 H new ATOM 0 HB2 ASP A 33 -3.102 1.911 -12.602 1.00 0.61 H new ATOM 0 HB3 ASP A 33 -3.763 1.422 -14.150 1.00 0.61 H new ATOM 468 N ARG A 34 -5.529 3.196 -11.794 1.00 0.58 N ATOM 469 CA ARG A 34 -6.842 2.950 -11.138 1.00 0.71 C ATOM 470 C ARG A 34 -7.759 4.155 -11.334 1.00 0.65 C ATOM 471 O ARG A 34 -8.943 4.008 -11.570 1.00 0.85 O ATOM 472 CB ARG A 34 -6.624 2.722 -9.634 1.00 0.85 C ATOM 473 CG ARG A 34 -6.000 1.328 -9.392 1.00 1.25 C ATOM 474 CD ARG A 34 -7.095 0.295 -9.081 1.00 1.31 C ATOM 475 NE ARG A 34 -8.285 0.538 -9.947 1.00 1.58 N ATOM 476 CZ ARG A 34 -9.187 -0.394 -10.095 1.00 2.09 C ATOM 477 NH1 ARG A 34 -9.056 -1.536 -9.477 1.00 2.58 N ATOM 478 NH2 ARG A 34 -10.224 -0.181 -10.860 1.00 2.75 N ATOM 0 H ARG A 34 -4.742 3.308 -11.155 1.00 0.58 H new ATOM 0 HA ARG A 34 -7.304 2.070 -11.585 1.00 0.71 H new ATOM 0 HB2 ARG A 34 -5.970 3.496 -9.232 1.00 0.85 H new ATOM 0 HB3 ARG A 34 -7.574 2.800 -9.105 1.00 0.85 H new ATOM 0 HG2 ARG A 34 -5.438 1.017 -10.272 1.00 1.25 H new ATOM 0 HG3 ARG A 34 -5.293 1.378 -8.564 1.00 1.25 H new ATOM 0 HD2 ARG A 34 -6.714 -0.713 -9.247 1.00 1.31 H new ATOM 0 HD3 ARG A 34 -7.380 0.359 -8.031 1.00 1.31 H new ATOM 0 HE ARG A 34 -8.394 1.433 -10.424 1.00 1.58 H new ATOM 0 HH11 ARG A 34 -8.248 -1.701 -8.877 1.00 2.58 H new ATOM 0 HH12 ARG A 34 -9.762 -2.263 -9.594 1.00 2.58 H new ATOM 0 HH21 ARG A 34 -10.328 0.713 -11.341 1.00 2.75 H new ATOM 0 HH22 ARG A 34 -10.930 -0.908 -10.977 1.00 2.75 H new ATOM 492 N ALA A 35 -7.241 5.346 -11.227 1.00 0.59 N ATOM 493 CA ALA A 35 -8.112 6.540 -11.396 1.00 0.66 C ATOM 494 C ALA A 35 -8.709 6.560 -12.805 1.00 0.80 C ATOM 495 O ALA A 35 -9.473 7.437 -13.153 1.00 0.88 O ATOM 496 CB ALA A 35 -7.300 7.816 -11.160 1.00 0.94 C ATOM 0 H ALA A 35 -6.260 5.543 -11.031 1.00 0.59 H new ATOM 0 HA ALA A 35 -8.922 6.491 -10.668 1.00 0.66 H new ATOM 0 HB1 ALA A 35 -7.945 8.686 -11.286 1.00 0.94 H new ATOM 0 HB2 ALA A 35 -6.895 7.808 -10.148 1.00 0.94 H new ATOM 0 HB3 ALA A 35 -6.481 7.864 -11.878 1.00 0.94 H new ATOM 751 N ALA A 54 10.625 0.268 -16.539 1.00 0.91 N ATOM 752 CA ALA A 54 10.329 -1.131 -16.965 1.00 0.84 C ATOM 753 C ALA A 54 10.190 -2.018 -15.724 1.00 0.76 C ATOM 754 O ALA A 54 9.310 -2.852 -15.638 1.00 0.75 O ATOM 755 CB ALA A 54 11.451 -1.660 -17.863 1.00 0.95 C ATOM 0 HA ALA A 54 9.397 -1.146 -17.530 1.00 0.84 H new ATOM 0 HB1 ALA A 54 11.223 -2.682 -18.167 1.00 0.95 H new ATOM 0 HB2 ALA A 54 11.537 -1.029 -18.748 1.00 0.95 H new ATOM 0 HB3 ALA A 54 12.393 -1.646 -17.315 1.00 0.95 H new ATOM 761 N SER A 55 11.036 -1.820 -14.753 1.00 0.75 N ATOM 762 CA SER A 55 10.951 -2.619 -13.495 1.00 0.71 C ATOM 763 C SER A 55 9.613 -2.338 -12.807 1.00 0.66 C ATOM 764 O SER A 55 8.943 -3.233 -12.332 1.00 0.66 O ATOM 765 CB SER A 55 12.090 -2.197 -12.562 1.00 0.76 C ATOM 766 OG SER A 55 12.269 -3.194 -11.564 1.00 1.37 O ATOM 0 H SER A 55 11.790 -1.133 -14.775 1.00 0.75 H new ATOM 0 HA SER A 55 11.030 -3.681 -13.726 1.00 0.71 H new ATOM 0 HB2 SER A 55 13.011 -2.064 -13.130 1.00 0.76 H new ATOM 0 HB3 SER A 55 11.860 -1.238 -12.098 1.00 0.76 H new ATOM 0 HG SER A 55 12.998 -2.930 -10.965 1.00 1.37 H new ATOM 772 N THR A 56 9.234 -1.093 -12.744 1.00 0.65 N ATOM 773 CA THR A 56 7.954 -0.723 -12.080 1.00 0.62 C ATOM 774 C THR A 56 6.768 -0.993 -13.009 1.00 0.59 C ATOM 775 O THR A 56 5.652 -1.162 -12.559 1.00 0.57 O ATOM 776 CB THR A 56 7.988 0.768 -11.733 1.00 0.67 C ATOM 777 OG1 THR A 56 9.138 1.042 -10.945 1.00 1.09 O ATOM 778 CG2 THR A 56 6.731 1.145 -10.947 1.00 1.06 C ATOM 0 H THR A 56 9.761 -0.309 -13.128 1.00 0.65 H new ATOM 0 HA THR A 56 7.837 -1.323 -11.177 1.00 0.62 H new ATOM 0 HB THR A 56 8.026 1.352 -12.653 1.00 0.67 H new ATOM 0 HG1 THR A 56 9.163 1.996 -10.723 1.00 1.09 H new ATOM 0 HG21 THR A 56 6.760 2.207 -10.702 1.00 1.06 H new ATOM 0 HG22 THR A 56 5.848 0.935 -11.551 1.00 1.06 H new ATOM 0 HG23 THR A 56 6.688 0.562 -10.027 1.00 1.06 H new ATOM 786 N LYS A 57 6.983 -1.024 -14.297 1.00 0.61 N ATOM 787 CA LYS A 57 5.837 -1.270 -15.218 1.00 0.59 C ATOM 788 C LYS A 57 5.299 -2.683 -14.983 1.00 0.54 C ATOM 789 O LYS A 57 4.104 -2.903 -14.944 1.00 0.52 O ATOM 790 CB LYS A 57 6.294 -1.105 -16.673 1.00 0.65 C ATOM 791 CG LYS A 57 5.193 -1.576 -17.634 1.00 1.20 C ATOM 792 CD LYS A 57 5.543 -1.166 -19.081 1.00 1.33 C ATOM 793 CE LYS A 57 5.006 0.239 -19.379 1.00 1.94 C ATOM 794 NZ LYS A 57 3.516 0.201 -19.409 1.00 2.73 N ATOM 0 H LYS A 57 7.889 -0.892 -14.746 1.00 0.61 H new ATOM 0 HA LYS A 57 5.044 -0.548 -15.022 1.00 0.59 H new ATOM 0 HB2 LYS A 57 6.535 -0.060 -16.869 1.00 0.65 H new ATOM 0 HB3 LYS A 57 7.205 -1.680 -16.843 1.00 0.65 H new ATOM 0 HG2 LYS A 57 5.083 -2.659 -17.571 1.00 1.20 H new ATOM 0 HG3 LYS A 57 4.236 -1.141 -17.345 1.00 1.20 H new ATOM 0 HD2 LYS A 57 6.624 -1.187 -19.221 1.00 1.33 H new ATOM 0 HD3 LYS A 57 5.116 -1.883 -19.783 1.00 1.33 H new ATOM 0 HE2 LYS A 57 5.348 0.940 -18.618 1.00 1.94 H new ATOM 0 HE3 LYS A 57 5.392 0.593 -20.335 1.00 1.94 H new ATOM 0 HZ1 LYS A 57 3.162 0.960 -20.026 1.00 2.73 H new ATOM 0 HZ2 LYS A 57 3.200 -0.719 -19.775 1.00 2.73 H new ATOM 0 HZ3 LYS A 57 3.146 0.336 -18.447 1.00 2.73 H new ATOM 808 N LYS A 58 6.167 -3.645 -14.816 1.00 0.55 N ATOM 809 CA LYS A 58 5.689 -5.035 -14.575 1.00 0.53 C ATOM 810 C LYS A 58 5.142 -5.112 -13.147 1.00 0.48 C ATOM 811 O LYS A 58 4.111 -5.709 -12.898 1.00 0.46 O ATOM 812 CB LYS A 58 6.862 -6.015 -14.766 1.00 0.56 C ATOM 813 CG LYS A 58 6.484 -7.439 -14.320 1.00 0.78 C ATOM 814 CD LYS A 58 5.433 -8.028 -15.266 1.00 0.96 C ATOM 815 CE LYS A 58 5.157 -9.478 -14.875 1.00 0.85 C ATOM 816 NZ LYS A 58 4.208 -10.082 -15.853 1.00 1.75 N ATOM 0 H LYS A 58 7.180 -3.529 -14.836 1.00 0.55 H new ATOM 0 HA LYS A 58 4.901 -5.303 -15.278 1.00 0.53 H new ATOM 0 HB2 LYS A 58 7.160 -6.028 -15.814 1.00 0.56 H new ATOM 0 HB3 LYS A 58 7.723 -5.670 -14.194 1.00 0.56 H new ATOM 0 HG2 LYS A 58 7.371 -8.072 -14.310 1.00 0.78 H new ATOM 0 HG3 LYS A 58 6.096 -7.418 -13.302 1.00 0.78 H new ATOM 0 HD2 LYS A 58 4.514 -7.444 -15.215 1.00 0.96 H new ATOM 0 HD3 LYS A 58 5.786 -7.978 -16.296 1.00 0.96 H new ATOM 0 HE2 LYS A 58 6.088 -10.045 -14.857 1.00 0.85 H new ATOM 0 HE3 LYS A 58 4.738 -9.522 -13.870 1.00 0.85 H new ATOM 0 HZ1 LYS A 58 3.926 -11.028 -15.525 1.00 1.75 H new ATOM 0 HZ2 LYS A 58 3.365 -9.479 -15.936 1.00 1.75 H new ATOM 0 HZ3 LYS A 58 4.670 -10.161 -16.781 1.00 1.75 H new ATOM 830 N LEU A 59 5.829 -4.532 -12.205 1.00 0.50 N ATOM 831 CA LEU A 59 5.347 -4.593 -10.797 1.00 0.47 C ATOM 832 C LEU A 59 4.011 -3.842 -10.699 1.00 0.43 C ATOM 833 O LEU A 59 3.190 -4.107 -9.841 1.00 0.42 O ATOM 834 CB LEU A 59 6.409 -3.945 -9.876 1.00 0.53 C ATOM 835 CG LEU A 59 6.800 -4.883 -8.721 1.00 0.71 C ATOM 836 CD1 LEU A 59 8.077 -4.350 -8.065 1.00 1.07 C ATOM 837 CD2 LEU A 59 5.682 -4.892 -7.674 1.00 1.34 C ATOM 0 H LEU A 59 6.700 -4.020 -12.347 1.00 0.50 H new ATOM 0 HA LEU A 59 5.195 -5.626 -10.485 1.00 0.47 H new ATOM 0 HB2 LEU A 59 7.295 -3.696 -10.460 1.00 0.53 H new ATOM 0 HB3 LEU A 59 6.020 -3.010 -9.472 1.00 0.53 H new ATOM 0 HG LEU A 59 6.959 -5.891 -9.104 1.00 0.71 H new ATOM 0 HD11 LEU A 59 8.365 -5.006 -7.244 1.00 1.07 H new ATOM 0 HD12 LEU A 59 8.879 -4.318 -8.803 1.00 1.07 H new ATOM 0 HD13 LEU A 59 7.897 -3.346 -7.681 1.00 1.07 H new ATOM 0 HD21 LEU A 59 5.956 -5.556 -6.854 1.00 1.34 H new ATOM 0 HD22 LEU A 59 5.535 -3.883 -7.290 1.00 1.34 H new ATOM 0 HD23 LEU A 59 4.758 -5.244 -8.132 1.00 1.34 H new ATOM 849 N SER A 60 3.780 -2.934 -11.607 1.00 0.43 N ATOM 850 CA SER A 60 2.494 -2.185 -11.608 1.00 0.42 C ATOM 851 C SER A 60 1.389 -3.127 -12.089 1.00 0.39 C ATOM 852 O SER A 60 0.252 -3.031 -11.670 1.00 0.41 O ATOM 853 CB SER A 60 2.601 -1.003 -12.573 1.00 0.47 C ATOM 854 OG SER A 60 1.352 -0.325 -12.621 1.00 1.36 O ATOM 0 H SER A 60 4.430 -2.678 -12.351 1.00 0.43 H new ATOM 0 HA SER A 60 2.270 -1.818 -10.607 1.00 0.42 H new ATOM 0 HB2 SER A 60 3.386 -0.321 -12.246 1.00 0.47 H new ATOM 0 HB3 SER A 60 2.877 -1.354 -13.568 1.00 0.47 H new ATOM 0 HG SER A 60 1.416 0.435 -13.237 1.00 1.36 H new ATOM 860 N GLU A 61 1.718 -4.038 -12.965 1.00 0.38 N ATOM 861 CA GLU A 61 0.689 -4.988 -13.477 1.00 0.38 C ATOM 862 C GLU A 61 0.247 -5.909 -12.337 1.00 0.38 C ATOM 863 O GLU A 61 -0.892 -6.328 -12.278 1.00 0.41 O ATOM 864 CB GLU A 61 1.274 -5.809 -14.628 1.00 0.39 C ATOM 865 CG GLU A 61 0.276 -6.875 -15.081 1.00 1.06 C ATOM 866 CD GLU A 61 0.805 -7.559 -16.343 1.00 1.67 C ATOM 867 OE1 GLU A 61 1.742 -8.332 -16.224 1.00 2.25 O ATOM 868 OE2 GLU A 61 0.267 -7.297 -17.405 1.00 2.40 O ATOM 0 H GLU A 61 2.655 -4.165 -13.348 1.00 0.38 H new ATOM 0 HA GLU A 61 -0.175 -4.436 -13.847 1.00 0.38 H new ATOM 0 HB2 GLU A 61 1.520 -5.153 -15.463 1.00 0.39 H new ATOM 0 HB3 GLU A 61 2.203 -6.283 -14.310 1.00 0.39 H new ATOM 0 HG2 GLU A 61 0.128 -7.610 -14.290 1.00 1.06 H new ATOM 0 HG3 GLU A 61 -0.694 -6.420 -15.280 1.00 1.06 H new ATOM 875 N CYS A 62 1.114 -6.195 -11.409 1.00 0.37 N ATOM 876 CA CYS A 62 0.702 -7.054 -10.263 1.00 0.39 C ATOM 877 C CYS A 62 -0.353 -6.298 -9.452 1.00 0.38 C ATOM 878 O CYS A 62 -1.365 -6.848 -9.062 1.00 0.44 O ATOM 879 CB CYS A 62 1.914 -7.349 -9.378 1.00 0.41 C ATOM 880 SG CYS A 62 3.144 -8.271 -10.333 1.00 1.62 S ATOM 0 H CYS A 62 2.082 -5.875 -11.392 1.00 0.37 H new ATOM 0 HA CYS A 62 0.294 -7.997 -10.628 1.00 0.39 H new ATOM 0 HB2 CYS A 62 2.346 -6.418 -9.011 1.00 0.41 H new ATOM 0 HB3 CYS A 62 1.609 -7.925 -8.504 1.00 0.41 H new ATOM 0 HG CYS A 62 4.177 -8.521 -9.584 1.00 1.62 H new ATOM 886 N LEU A 63 -0.137 -5.033 -9.222 1.00 0.35 N ATOM 887 CA LEU A 63 -1.134 -4.218 -8.468 1.00 0.36 C ATOM 888 C LEU A 63 -2.385 -4.013 -9.331 1.00 0.36 C ATOM 889 O LEU A 63 -3.477 -3.849 -8.824 1.00 0.41 O ATOM 890 CB LEU A 63 -0.516 -2.858 -8.129 1.00 0.38 C ATOM 891 CG LEU A 63 0.767 -3.056 -7.308 1.00 0.69 C ATOM 892 CD1 LEU A 63 1.500 -1.717 -7.185 1.00 1.39 C ATOM 893 CD2 LEU A 63 0.422 -3.563 -5.898 1.00 1.11 C ATOM 0 H LEU A 63 0.693 -4.524 -9.526 1.00 0.35 H new ATOM 0 HA LEU A 63 -1.412 -4.734 -7.549 1.00 0.36 H new ATOM 0 HB2 LEU A 63 -0.291 -2.313 -9.046 1.00 0.38 H new ATOM 0 HB3 LEU A 63 -1.229 -2.255 -7.566 1.00 0.38 H new ATOM 0 HG LEU A 63 1.399 -3.788 -7.811 1.00 0.69 H new ATOM 0 HD11 LEU A 63 2.411 -1.853 -6.603 1.00 1.39 H new ATOM 0 HD12 LEU A 63 1.756 -1.350 -8.179 1.00 1.39 H new ATOM 0 HD13 LEU A 63 0.855 -0.994 -6.686 1.00 1.39 H new ATOM 0 HD21 LEU A 63 1.340 -3.699 -5.326 1.00 1.11 H new ATOM 0 HD22 LEU A 63 -0.214 -2.835 -5.395 1.00 1.11 H new ATOM 0 HD23 LEU A 63 -0.104 -4.515 -5.972 1.00 1.11 H new ATOM 905 N LYS A 64 -2.235 -4.010 -10.628 1.00 0.35 N ATOM 906 CA LYS A 64 -3.416 -3.804 -11.516 1.00 0.37 C ATOM 907 C LYS A 64 -4.218 -5.108 -11.625 1.00 0.39 C ATOM 908 O LYS A 64 -5.421 -5.125 -11.453 1.00 0.43 O ATOM 909 CB LYS A 64 -2.924 -3.370 -12.912 1.00 0.38 C ATOM 910 CG LYS A 64 -3.908 -2.373 -13.538 1.00 0.82 C ATOM 911 CD LYS A 64 -5.288 -3.022 -13.674 1.00 1.35 C ATOM 912 CE LYS A 64 -6.182 -2.133 -14.538 1.00 1.38 C ATOM 913 NZ LYS A 64 -5.708 -2.173 -15.950 1.00 2.09 N ATOM 0 H LYS A 64 -1.346 -4.141 -11.111 1.00 0.35 H new ATOM 0 HA LYS A 64 -4.060 -3.030 -11.099 1.00 0.37 H new ATOM 0 HB2 LYS A 64 -1.937 -2.915 -12.832 1.00 0.38 H new ATOM 0 HB3 LYS A 64 -2.821 -4.243 -13.556 1.00 0.38 H new ATOM 0 HG2 LYS A 64 -3.976 -1.478 -12.919 1.00 0.82 H new ATOM 0 HG3 LYS A 64 -3.547 -2.057 -14.517 1.00 0.82 H new ATOM 0 HD2 LYS A 64 -5.195 -4.010 -14.124 1.00 1.35 H new ATOM 0 HD3 LYS A 64 -5.736 -3.161 -12.690 1.00 1.35 H new ATOM 0 HE2 LYS A 64 -7.216 -2.474 -14.481 1.00 1.38 H new ATOM 0 HE3 LYS A 64 -6.163 -1.109 -14.166 1.00 1.38 H new ATOM 0 HZ1 LYS A 64 -6.498 -1.948 -16.588 1.00 2.09 H new ATOM 0 HZ2 LYS A 64 -4.948 -1.475 -16.081 1.00 2.09 H new ATOM 0 HZ3 LYS A 64 -5.347 -3.123 -16.168 1.00 2.09 H new ATOM 927 N ARG A 65 -3.559 -6.196 -11.907 1.00 0.43 N ATOM 928 CA ARG A 65 -4.273 -7.498 -12.030 1.00 0.47 C ATOM 929 C ARG A 65 -4.962 -7.849 -10.708 1.00 0.50 C ATOM 930 O ARG A 65 -6.043 -8.405 -10.691 1.00 0.54 O ATOM 931 CB ARG A 65 -3.259 -8.597 -12.378 1.00 0.45 C ATOM 932 CG ARG A 65 -2.812 -8.463 -13.847 1.00 0.94 C ATOM 933 CD ARG A 65 -3.833 -9.126 -14.785 1.00 1.55 C ATOM 934 NE ARG A 65 -3.284 -9.156 -16.170 1.00 1.86 N ATOM 935 CZ ARG A 65 -3.836 -9.915 -17.076 1.00 2.39 C ATOM 936 NH1 ARG A 65 -4.872 -10.650 -16.771 1.00 2.94 N ATOM 937 NH2 ARG A 65 -3.355 -9.939 -18.289 1.00 2.92 N ATOM 0 H ARG A 65 -2.551 -6.240 -12.058 1.00 0.43 H new ATOM 0 HA ARG A 65 -5.026 -7.420 -12.815 1.00 0.47 H new ATOM 0 HB2 ARG A 65 -2.394 -8.525 -11.719 1.00 0.45 H new ATOM 0 HB3 ARG A 65 -3.704 -9.578 -12.214 1.00 0.45 H new ATOM 0 HG2 ARG A 65 -2.703 -7.410 -14.105 1.00 0.94 H new ATOM 0 HG3 ARG A 65 -1.834 -8.926 -13.979 1.00 0.94 H new ATOM 0 HD2 ARG A 65 -4.051 -10.139 -14.446 1.00 1.55 H new ATOM 0 HD3 ARG A 65 -4.773 -8.574 -14.766 1.00 1.55 H new ATOM 0 HE ARG A 65 -2.475 -8.582 -16.410 1.00 1.86 H new ATOM 0 HH11 ARG A 65 -5.250 -10.631 -15.824 1.00 2.94 H new ATOM 0 HH12 ARG A 65 -5.303 -11.243 -17.480 1.00 2.94 H new ATOM 0 HH21 ARG A 65 -2.547 -9.364 -18.529 1.00 2.92 H new ATOM 0 HH22 ARG A 65 -3.787 -10.533 -18.997 1.00 2.92 H new ATOM 951 N ILE A 66 -4.348 -7.535 -9.599 1.00 0.49 N ATOM 952 CA ILE A 66 -4.974 -7.864 -8.285 1.00 0.53 C ATOM 953 C ILE A 66 -6.051 -6.819 -7.963 1.00 0.54 C ATOM 954 O ILE A 66 -7.019 -7.095 -7.283 1.00 0.60 O ATOM 955 CB ILE A 66 -3.882 -7.864 -7.204 1.00 0.52 C ATOM 956 CG1 ILE A 66 -2.996 -9.101 -7.379 1.00 1.22 C ATOM 957 CG2 ILE A 66 -4.510 -7.860 -5.805 1.00 1.29 C ATOM 958 CD1 ILE A 66 -1.756 -8.981 -6.488 1.00 1.25 C ATOM 0 H ILE A 66 -3.443 -7.067 -9.545 1.00 0.49 H new ATOM 0 HA ILE A 66 -5.442 -8.848 -8.321 1.00 0.53 H new ATOM 0 HB ILE A 66 -3.276 -6.964 -7.310 1.00 0.52 H new ATOM 0 HG12 ILE A 66 -3.555 -10.000 -7.120 1.00 1.22 H new ATOM 0 HG13 ILE A 66 -2.697 -9.201 -8.422 1.00 1.22 H new ATOM 0 HG21 ILE A 66 -3.722 -7.860 -5.052 1.00 1.29 H new ATOM 0 HG22 ILE A 66 -5.126 -6.969 -5.685 1.00 1.29 H new ATOM 0 HG23 ILE A 66 -5.129 -8.748 -5.682 1.00 1.29 H new ATOM 0 HD11 ILE A 66 -1.129 -9.863 -6.616 1.00 1.25 H new ATOM 0 HD12 ILE A 66 -1.192 -8.091 -6.768 1.00 1.25 H new ATOM 0 HD13 ILE A 66 -2.063 -8.903 -5.445 1.00 1.25 H new ATOM 970 N GLY A 67 -5.889 -5.626 -8.462 1.00 0.52 N ATOM 971 CA GLY A 67 -6.896 -4.551 -8.212 1.00 0.55 C ATOM 972 C GLY A 67 -8.204 -4.882 -8.932 1.00 0.53 C ATOM 973 O GLY A 67 -9.249 -4.993 -8.321 1.00 0.63 O ATOM 0 H GLY A 67 -5.096 -5.345 -9.038 1.00 0.52 H new ATOM 0 HA2 GLY A 67 -7.076 -4.451 -7.142 1.00 0.55 H new ATOM 0 HA3 GLY A 67 -6.511 -3.593 -8.561 1.00 0.55 H new ATOM 977 N ASP A 68 -8.159 -5.040 -10.224 1.00 0.54 N ATOM 978 CA ASP A 68 -9.398 -5.363 -10.985 1.00 0.54 C ATOM 979 C ASP A 68 -9.973 -6.706 -10.529 1.00 0.52 C ATOM 980 O ASP A 68 -11.151 -6.961 -10.681 1.00 0.56 O ATOM 981 CB ASP A 68 -9.061 -5.449 -12.477 1.00 0.60 C ATOM 982 CG ASP A 68 -8.099 -6.612 -12.726 1.00 1.43 C ATOM 983 OD1 ASP A 68 -7.133 -6.724 -11.991 1.00 2.20 O ATOM 984 OD2 ASP A 68 -8.346 -7.370 -13.650 1.00 2.12 O ATOM 0 H ASP A 68 -7.314 -4.959 -10.789 1.00 0.54 H new ATOM 0 HA ASP A 68 -10.136 -4.581 -10.805 1.00 0.54 H new ATOM 0 HB2 ASP A 68 -9.973 -5.589 -13.057 1.00 0.60 H new ATOM 0 HB3 ASP A 68 -8.610 -4.515 -12.812 1.00 0.60 H new ATOM 989 N GLU A 69 -9.158 -7.584 -9.993 1.00 0.56 N ATOM 990 CA GLU A 69 -9.688 -8.918 -9.563 1.00 0.56 C ATOM 991 C GLU A 69 -10.244 -8.832 -8.137 1.00 0.55 C ATOM 992 O GLU A 69 -11.203 -9.504 -7.813 1.00 0.73 O ATOM 993 CB GLU A 69 -8.568 -9.962 -9.637 1.00 0.61 C ATOM 994 CG GLU A 69 -9.132 -11.367 -9.402 1.00 0.84 C ATOM 995 CD GLU A 69 -9.879 -11.837 -10.651 1.00 1.65 C ATOM 996 OE1 GLU A 69 -9.220 -12.233 -11.598 1.00 2.48 O ATOM 997 OE2 GLU A 69 -11.098 -11.795 -10.639 1.00 2.23 O ATOM 0 H GLU A 69 -8.161 -7.438 -9.836 1.00 0.56 H new ATOM 0 HA GLU A 69 -10.497 -9.215 -10.230 1.00 0.56 H new ATOM 0 HB2 GLU A 69 -8.083 -9.916 -10.612 1.00 0.61 H new ATOM 0 HB3 GLU A 69 -7.805 -9.740 -8.891 1.00 0.61 H new ATOM 0 HG2 GLU A 69 -8.324 -12.060 -9.168 1.00 0.84 H new ATOM 0 HG3 GLU A 69 -9.805 -11.361 -8.545 1.00 0.84 H new ATOM 1004 N LEU A 70 -9.673 -8.041 -7.272 1.00 0.53 N ATOM 1005 CA LEU A 70 -10.230 -7.988 -5.889 1.00 0.52 C ATOM 1006 C LEU A 70 -11.637 -7.381 -5.951 1.00 0.54 C ATOM 1007 O LEU A 70 -12.477 -7.645 -5.114 1.00 0.60 O ATOM 1008 CB LEU A 70 -9.307 -7.151 -4.967 1.00 0.61 C ATOM 1009 CG LEU A 70 -8.489 -8.041 -4.009 1.00 0.70 C ATOM 1010 CD1 LEU A 70 -9.387 -8.563 -2.878 1.00 1.38 C ATOM 1011 CD2 LEU A 70 -7.847 -9.222 -4.766 1.00 1.61 C ATOM 0 H LEU A 70 -8.867 -7.443 -7.453 1.00 0.53 H new ATOM 0 HA LEU A 70 -10.287 -8.994 -5.473 1.00 0.52 H new ATOM 0 HB2 LEU A 70 -8.628 -6.555 -5.577 1.00 0.61 H new ATOM 0 HB3 LEU A 70 -9.910 -6.453 -4.387 1.00 0.61 H new ATOM 0 HG LEU A 70 -7.690 -7.437 -3.580 1.00 0.70 H new ATOM 0 HD11 LEU A 70 -8.800 -9.190 -2.207 1.00 1.38 H new ATOM 0 HD12 LEU A 70 -9.797 -7.721 -2.321 1.00 1.38 H new ATOM 0 HD13 LEU A 70 -10.202 -9.149 -3.302 1.00 1.38 H new ATOM 0 HD21 LEU A 70 -7.276 -9.834 -4.068 1.00 1.61 H new ATOM 0 HD22 LEU A 70 -8.628 -9.828 -5.225 1.00 1.61 H new ATOM 0 HD23 LEU A 70 -7.183 -8.839 -5.541 1.00 1.61 H new ATOM 1023 N ASP A 71 -11.903 -6.589 -6.954 1.00 0.67 N ATOM 1024 CA ASP A 71 -13.259 -5.990 -7.089 1.00 0.91 C ATOM 1025 C ASP A 71 -14.230 -7.079 -7.553 1.00 1.02 C ATOM 1026 O ASP A 71 -15.435 -6.935 -7.500 1.00 1.29 O ATOM 1027 CB ASP A 71 -13.216 -4.867 -8.127 1.00 1.09 C ATOM 1028 CG ASP A 71 -12.319 -3.738 -7.616 1.00 1.66 C ATOM 1029 OD1 ASP A 71 -11.249 -4.040 -7.112 1.00 2.36 O ATOM 1030 OD2 ASP A 71 -12.717 -2.591 -7.736 1.00 2.25 O ATOM 0 H ASP A 71 -11.240 -6.332 -7.685 1.00 0.67 H new ATOM 0 HA ASP A 71 -13.586 -5.582 -6.133 1.00 0.91 H new ATOM 0 HB2 ASP A 71 -12.836 -5.247 -9.075 1.00 1.09 H new ATOM 0 HB3 ASP A 71 -14.222 -4.491 -8.314 1.00 1.09 H new ATOM 1035 N SER A 72 -13.683 -8.172 -8.013 1.00 0.90 N ATOM 1036 CA SER A 72 -14.507 -9.313 -8.500 1.00 1.20 C ATOM 1037 C SER A 72 -15.558 -9.722 -7.470 1.00 0.98 C ATOM 1038 O SER A 72 -16.529 -10.371 -7.807 1.00 1.02 O ATOM 1039 CB SER A 72 -13.587 -10.514 -8.730 1.00 1.57 C ATOM 1040 OG SER A 72 -14.339 -11.570 -9.316 1.00 2.09 O ATOM 0 H SER A 72 -12.676 -8.324 -8.072 1.00 0.90 H new ATOM 0 HA SER A 72 -15.009 -9.004 -9.417 1.00 1.20 H new ATOM 0 HB2 SER A 72 -12.760 -10.235 -9.382 1.00 1.57 H new ATOM 0 HB3 SER A 72 -13.152 -10.841 -7.786 1.00 1.57 H new ATOM 0 HG SER A 72 -15.270 -11.515 -9.015 1.00 2.09 H new ATOM 1046 N ASN A 73 -15.374 -9.377 -6.212 1.00 0.92 N ATOM 1047 CA ASN A 73 -16.371 -9.795 -5.169 1.00 0.83 C ATOM 1048 C ASN A 73 -17.268 -8.615 -4.780 1.00 0.75 C ATOM 1049 O ASN A 73 -16.800 -7.599 -4.305 1.00 1.07 O ATOM 1050 CB ASN A 73 -15.611 -10.275 -3.928 1.00 0.91 C ATOM 1051 CG ASN A 73 -14.717 -11.460 -4.302 1.00 1.43 C ATOM 1052 OD1 ASN A 73 -14.604 -11.809 -5.461 1.00 2.29 O ATOM 1053 ND2 ASN A 73 -14.072 -12.099 -3.364 1.00 1.90 N ATOM 0 H ASN A 73 -14.585 -8.830 -5.866 1.00 0.92 H new ATOM 0 HA ASN A 73 -16.995 -10.594 -5.570 1.00 0.83 H new ATOM 0 HB2 ASN A 73 -15.006 -9.464 -3.523 1.00 0.91 H new ATOM 0 HB3 ASN A 73 -16.314 -10.568 -3.149 1.00 0.91 H new ATOM 0 HD21 ASN A 73 -13.474 -12.890 -3.604 1.00 1.90 H new ATOM 0 HD22 ASN A 73 -14.166 -11.807 -2.391 1.00 1.90 H new ATOM 1060 N MET A 74 -18.550 -8.735 -4.992 1.00 0.71 N ATOM 1061 CA MET A 74 -19.474 -7.614 -4.644 1.00 0.67 C ATOM 1062 C MET A 74 -19.634 -7.533 -3.122 1.00 0.67 C ATOM 1063 O MET A 74 -20.059 -6.529 -2.586 1.00 0.71 O ATOM 1064 CB MET A 74 -20.837 -7.847 -5.299 1.00 0.75 C ATOM 1065 CG MET A 74 -20.663 -8.080 -6.805 1.00 1.20 C ATOM 1066 SD MET A 74 -20.167 -9.796 -7.100 1.00 1.92 S ATOM 1067 CE MET A 74 -19.585 -9.578 -8.800 1.00 1.96 C ATOM 0 H MET A 74 -18.999 -9.559 -5.391 1.00 0.71 H new ATOM 0 HA MET A 74 -19.058 -6.676 -5.011 1.00 0.67 H new ATOM 0 HB2 MET A 74 -21.326 -8.708 -4.844 1.00 0.75 H new ATOM 0 HB3 MET A 74 -21.484 -6.986 -5.128 1.00 0.75 H new ATOM 0 HG2 MET A 74 -21.596 -7.866 -7.327 1.00 1.20 H new ATOM 0 HG3 MET A 74 -19.911 -7.400 -7.204 1.00 1.20 H new ATOM 0 HE1 MET A 74 -19.227 -10.532 -9.187 1.00 1.96 H new ATOM 0 HE2 MET A 74 -20.405 -9.219 -9.422 1.00 1.96 H new ATOM 0 HE3 MET A 74 -18.773 -8.852 -8.816 1.00 1.96 H new ATOM 1077 N GLU A 75 -19.253 -8.562 -2.421 1.00 0.70 N ATOM 1078 CA GLU A 75 -19.326 -8.547 -0.932 1.00 0.75 C ATOM 1079 C GLU A 75 -18.235 -7.629 -0.378 1.00 0.73 C ATOM 1080 O GLU A 75 -18.489 -6.823 0.496 1.00 0.78 O ATOM 1081 CB GLU A 75 -19.102 -9.966 -0.404 1.00 0.87 C ATOM 1082 CG GLU A 75 -19.345 -9.989 1.105 1.00 1.15 C ATOM 1083 CD GLU A 75 -19.205 -11.421 1.627 1.00 1.70 C ATOM 1084 OE1 GLU A 75 -20.063 -12.230 1.314 1.00 2.29 O ATOM 1085 OE2 GLU A 75 -18.244 -11.683 2.331 1.00 2.21 O ATOM 0 H GLU A 75 -18.888 -9.426 -2.821 1.00 0.70 H new ATOM 0 HA GLU A 75 -20.305 -8.184 -0.618 1.00 0.75 H new ATOM 0 HB2 GLU A 75 -19.776 -10.662 -0.903 1.00 0.87 H new ATOM 0 HB3 GLU A 75 -18.086 -10.292 -0.625 1.00 0.87 H new ATOM 0 HG2 GLU A 75 -18.631 -9.337 1.608 1.00 1.15 H new ATOM 0 HG3 GLU A 75 -20.340 -9.605 1.329 1.00 1.15 H new ATOM 1092 N LEU A 76 -17.033 -7.728 -0.861 1.00 0.74 N ATOM 1093 CA LEU A 76 -15.958 -6.841 -0.331 1.00 0.80 C ATOM 1094 C LEU A 76 -16.243 -5.385 -0.716 1.00 0.75 C ATOM 1095 O LEU A 76 -15.875 -4.466 -0.012 1.00 0.81 O ATOM 1096 CB LEU A 76 -14.600 -7.276 -0.893 1.00 0.92 C ATOM 1097 CG LEU A 76 -13.458 -6.678 -0.048 1.00 1.00 C ATOM 1098 CD1 LEU A 76 -13.181 -7.567 1.171 1.00 1.57 C ATOM 1099 CD2 LEU A 76 -12.186 -6.589 -0.898 1.00 1.51 C ATOM 0 H LEU A 76 -16.746 -8.377 -1.593 1.00 0.74 H new ATOM 0 HA LEU A 76 -15.935 -6.921 0.756 1.00 0.80 H new ATOM 0 HB2 LEU A 76 -14.530 -8.364 -0.894 1.00 0.92 H new ATOM 0 HB3 LEU A 76 -14.505 -6.949 -1.929 1.00 0.92 H new ATOM 0 HG LEU A 76 -13.753 -5.684 0.289 1.00 1.00 H new ATOM 0 HD11 LEU A 76 -12.372 -7.135 1.760 1.00 1.57 H new ATOM 0 HD12 LEU A 76 -14.080 -7.635 1.783 1.00 1.57 H new ATOM 0 HD13 LEU A 76 -12.893 -8.564 0.837 1.00 1.57 H new ATOM 0 HD21 LEU A 76 -11.378 -6.166 -0.301 1.00 1.51 H new ATOM 0 HD22 LEU A 76 -11.904 -7.586 -1.236 1.00 1.51 H new ATOM 0 HD23 LEU A 76 -12.370 -5.951 -1.763 1.00 1.51 H new ATOM 1111 N GLN A 77 -16.923 -5.166 -1.806 1.00 0.76 N ATOM 1112 CA GLN A 77 -17.256 -3.769 -2.209 1.00 0.74 C ATOM 1113 C GLN A 77 -18.476 -3.302 -1.410 1.00 0.71 C ATOM 1114 O GLN A 77 -18.570 -2.152 -1.020 1.00 0.72 O ATOM 1115 CB GLN A 77 -17.568 -3.724 -3.708 1.00 0.71 C ATOM 1116 CG GLN A 77 -17.847 -2.282 -4.136 1.00 1.26 C ATOM 1117 CD GLN A 77 -18.025 -2.225 -5.655 1.00 1.59 C ATOM 1118 OE1 GLN A 77 -17.066 -2.328 -6.394 1.00 2.35 O ATOM 1119 NE2 GLN A 77 -19.220 -2.066 -6.155 1.00 2.03 N ATOM 0 H GLN A 77 -17.263 -5.893 -2.436 1.00 0.76 H new ATOM 0 HA GLN A 77 -16.410 -3.113 -2.006 1.00 0.74 H new ATOM 0 HB2 GLN A 77 -16.729 -4.126 -4.276 1.00 0.71 H new ATOM 0 HB3 GLN A 77 -18.431 -4.352 -3.928 1.00 0.71 H new ATOM 0 HG2 GLN A 77 -18.744 -1.911 -3.640 1.00 1.26 H new ATOM 0 HG3 GLN A 77 -17.024 -1.635 -3.831 1.00 1.26 H new ATOM 0 HE21 GLN A 77 -20.025 -1.980 -5.535 1.00 2.03 H new ATOM 0 HE22 GLN A 77 -19.349 -2.028 -7.166 1.00 2.03 H new ATOM 1128 N ARG A 78 -19.402 -4.178 -1.144 1.00 0.72 N ATOM 1129 CA ARG A 78 -20.598 -3.766 -0.359 1.00 0.73 C ATOM 1130 C ARG A 78 -20.187 -3.493 1.090 1.00 0.75 C ATOM 1131 O ARG A 78 -20.780 -2.684 1.775 1.00 0.79 O ATOM 1132 CB ARG A 78 -21.636 -4.890 -0.385 1.00 0.74 C ATOM 1133 CG ARG A 78 -22.944 -4.385 0.230 1.00 0.94 C ATOM 1134 CD ARG A 78 -24.030 -5.452 0.077 1.00 1.23 C ATOM 1135 NE ARG A 78 -24.266 -5.716 -1.370 1.00 1.80 N ATOM 1136 CZ ARG A 78 -24.929 -6.776 -1.742 1.00 2.50 C ATOM 1137 NH1 ARG A 78 -25.391 -7.606 -0.846 1.00 2.83 N ATOM 1138 NH2 ARG A 78 -25.133 -7.007 -3.011 1.00 3.41 N ATOM 0 H ARG A 78 -19.384 -5.156 -1.434 1.00 0.72 H new ATOM 0 HA ARG A 78 -21.025 -2.863 -0.795 1.00 0.73 H new ATOM 0 HB2 ARG A 78 -21.806 -5.220 -1.410 1.00 0.74 H new ATOM 0 HB3 ARG A 78 -21.269 -5.753 0.171 1.00 0.74 H new ATOM 0 HG2 ARG A 78 -22.795 -4.152 1.284 1.00 0.94 H new ATOM 0 HG3 ARG A 78 -23.255 -3.462 -0.260 1.00 0.94 H new ATOM 0 HD2 ARG A 78 -23.726 -6.370 0.580 1.00 1.23 H new ATOM 0 HD3 ARG A 78 -24.952 -5.118 0.552 1.00 1.23 H new ATOM 0 HE ARG A 78 -23.909 -5.067 -2.071 1.00 1.80 H new ATOM 0 HH11 ARG A 78 -25.234 -7.426 0.146 1.00 2.83 H new ATOM 0 HH12 ARG A 78 -25.909 -8.435 -1.138 1.00 2.83 H new ATOM 0 HH21 ARG A 78 -24.774 -6.358 -3.712 1.00 3.41 H new ATOM 0 HH22 ARG A 78 -25.651 -7.836 -3.302 1.00 3.41 H new ATOM 1152 N MET A 79 -19.175 -4.176 1.562 1.00 0.75 N ATOM 1153 CA MET A 79 -18.722 -3.974 2.969 1.00 0.77 C ATOM 1154 C MET A 79 -18.075 -2.591 3.101 1.00 0.77 C ATOM 1155 O MET A 79 -18.446 -1.801 3.946 1.00 0.78 O ATOM 1156 CB MET A 79 -17.694 -5.069 3.329 1.00 0.81 C ATOM 1157 CG MET A 79 -18.376 -6.218 4.082 1.00 1.08 C ATOM 1158 SD MET A 79 -17.128 -7.431 4.580 1.00 1.07 S ATOM 1159 CE MET A 79 -16.651 -6.651 6.143 1.00 0.81 C ATOM 0 H MET A 79 -18.643 -4.866 1.032 1.00 0.75 H new ATOM 0 HA MET A 79 -19.574 -4.037 3.647 1.00 0.77 H new ATOM 0 HB2 MET A 79 -17.225 -5.449 2.421 1.00 0.81 H new ATOM 0 HB3 MET A 79 -16.901 -4.644 3.944 1.00 0.81 H new ATOM 0 HG2 MET A 79 -18.897 -5.834 4.959 1.00 1.08 H new ATOM 0 HG3 MET A 79 -19.126 -6.690 3.447 1.00 1.08 H new ATOM 0 HE1 MET A 79 -15.601 -6.860 6.349 1.00 0.81 H new ATOM 0 HE2 MET A 79 -16.799 -5.573 6.072 1.00 0.81 H new ATOM 0 HE3 MET A 79 -17.265 -7.049 6.951 1.00 0.81 H new ATOM 1169 N ILE A 80 -17.120 -2.292 2.265 1.00 0.77 N ATOM 1170 CA ILE A 80 -16.460 -0.959 2.338 1.00 0.80 C ATOM 1171 C ILE A 80 -17.535 0.128 2.327 1.00 0.80 C ATOM 1172 O ILE A 80 -17.357 1.198 2.875 1.00 0.83 O ATOM 1173 CB ILE A 80 -15.523 -0.783 1.142 1.00 0.82 C ATOM 1174 CG1 ILE A 80 -14.422 -1.847 1.201 1.00 0.84 C ATOM 1175 CG2 ILE A 80 -14.890 0.609 1.185 1.00 0.89 C ATOM 1176 CD1 ILE A 80 -13.663 -1.875 -0.126 1.00 1.10 C ATOM 0 H ILE A 80 -16.769 -2.912 1.535 1.00 0.77 H new ATOM 0 HA ILE A 80 -15.876 -0.883 3.255 1.00 0.80 H new ATOM 0 HB ILE A 80 -16.089 -0.892 0.217 1.00 0.82 H new ATOM 0 HG12 ILE A 80 -13.736 -1.629 2.019 1.00 0.84 H new ATOM 0 HG13 ILE A 80 -14.858 -2.825 1.403 1.00 0.84 H new ATOM 0 HG21 ILE A 80 -14.223 0.732 0.332 1.00 0.89 H new ATOM 0 HG22 ILE A 80 -15.673 1.366 1.145 1.00 0.89 H new ATOM 0 HG23 ILE A 80 -14.322 0.722 2.109 1.00 0.89 H new ATOM 0 HD11 ILE A 80 -12.880 -2.632 -0.082 1.00 1.10 H new ATOM 0 HD12 ILE A 80 -14.353 -2.113 -0.935 1.00 1.10 H new ATOM 0 HD13 ILE A 80 -13.213 -0.899 -0.309 1.00 1.10 H new ATOM 1188 N ALA A 81 -18.662 -0.148 1.728 1.00 0.78 N ATOM 1189 CA ALA A 81 -19.757 0.861 1.705 1.00 0.80 C ATOM 1190 C ALA A 81 -20.384 0.949 3.099 1.00 0.81 C ATOM 1191 O ALA A 81 -21.020 1.924 3.448 1.00 0.85 O ATOM 1192 CB ALA A 81 -20.826 0.428 0.706 1.00 0.79 C ATOM 0 H ALA A 81 -18.871 -1.027 1.255 1.00 0.78 H new ATOM 0 HA ALA A 81 -19.355 1.831 1.414 1.00 0.80 H new ATOM 0 HB1 ALA A 81 -21.628 1.166 0.689 1.00 0.79 H new ATOM 0 HB2 ALA A 81 -20.385 0.348 -0.287 1.00 0.79 H new ATOM 0 HB3 ALA A 81 -21.230 -0.540 1.002 1.00 0.79 H new ATOM 1198 N ALA A 82 -20.201 -0.068 3.897 1.00 0.78 N ATOM 1199 CA ALA A 82 -20.774 -0.065 5.273 1.00 0.80 C ATOM 1200 C ALA A 82 -19.803 0.597 6.245 1.00 0.79 C ATOM 1201 O ALA A 82 -20.185 1.044 7.309 1.00 0.83 O ATOM 1202 CB ALA A 82 -20.964 -1.494 5.766 1.00 0.87 C ATOM 0 H ALA A 82 -19.675 -0.907 3.652 1.00 0.78 H new ATOM 0 HA ALA A 82 -21.723 0.470 5.233 1.00 0.80 H new ATOM 0 HB1 ALA A 82 -21.383 -1.479 6.772 1.00 0.87 H new ATOM 0 HB2 ALA A 82 -21.644 -2.022 5.097 1.00 0.87 H new ATOM 0 HB3 ALA A 82 -20.001 -2.005 5.782 1.00 0.87 H new ATOM 1208 N VAL A 83 -18.550 0.670 5.897 1.00 0.80 N ATOM 1209 CA VAL A 83 -17.561 1.301 6.816 1.00 0.85 C ATOM 1210 C VAL A 83 -17.569 2.818 6.584 1.00 0.99 C ATOM 1211 O VAL A 83 -18.566 3.486 6.763 1.00 1.36 O ATOM 1212 CB VAL A 83 -16.165 0.717 6.517 1.00 0.97 C ATOM 1213 CG1 VAL A 83 -15.186 1.073 7.643 1.00 1.81 C ATOM 1214 CG2 VAL A 83 -16.261 -0.808 6.414 1.00 1.40 C ATOM 0 H VAL A 83 -18.167 0.321 5.018 1.00 0.80 H new ATOM 0 HA VAL A 83 -17.816 1.099 7.856 1.00 0.85 H new ATOM 0 HB VAL A 83 -15.805 1.137 5.578 1.00 0.97 H new ATOM 0 HG11 VAL A 83 -14.205 0.654 7.418 1.00 1.81 H new ATOM 0 HG12 VAL A 83 -15.107 2.157 7.727 1.00 1.81 H new ATOM 0 HG13 VAL A 83 -15.549 0.661 8.585 1.00 1.81 H new ATOM 0 HG21 VAL A 83 -15.275 -1.221 6.203 1.00 1.40 H new ATOM 0 HG22 VAL A 83 -16.630 -1.214 7.356 1.00 1.40 H new ATOM 0 HG23 VAL A 83 -16.946 -1.076 5.610 1.00 1.40 H new ATOM 1273 N PRO A 88 -10.875 9.826 9.765 1.00 0.77 N ATOM 1274 CA PRO A 88 -10.083 8.957 8.866 1.00 0.83 C ATOM 1275 C PRO A 88 -8.709 8.658 9.478 1.00 0.73 C ATOM 1276 O PRO A 88 -8.136 7.612 9.256 1.00 0.72 O ATOM 1277 CB PRO A 88 -9.945 9.767 7.551 1.00 1.01 C ATOM 1278 CG PRO A 88 -10.682 11.122 7.750 1.00 1.07 C ATOM 1279 CD PRO A 88 -11.219 11.152 9.191 1.00 0.83 C ATOM 0 HA PRO A 88 -10.558 7.991 8.699 1.00 0.83 H new ATOM 0 HB2 PRO A 88 -8.894 9.934 7.314 1.00 1.01 H new ATOM 0 HB3 PRO A 88 -10.377 9.216 6.715 1.00 1.01 H new ATOM 0 HG2 PRO A 88 -10.002 11.957 7.577 1.00 1.07 H new ATOM 0 HG3 PRO A 88 -11.498 11.222 7.035 1.00 1.07 H new ATOM 0 HD2 PRO A 88 -10.763 11.959 9.764 1.00 0.83 H new ATOM 0 HD3 PRO A 88 -12.296 11.320 9.206 1.00 0.83 H new ATOM 1287 N ARG A 89 -8.182 9.574 10.232 1.00 0.75 N ATOM 1288 CA ARG A 89 -6.845 9.354 10.849 1.00 0.73 C ATOM 1289 C ARG A 89 -6.988 8.264 11.909 1.00 0.67 C ATOM 1290 O ARG A 89 -6.166 7.380 12.041 1.00 0.68 O ATOM 1291 CB ARG A 89 -6.352 10.673 11.481 1.00 0.79 C ATOM 1292 CG ARG A 89 -7.042 11.863 10.791 1.00 1.63 C ATOM 1293 CD ARG A 89 -6.297 13.175 11.103 1.00 1.65 C ATOM 1294 NE ARG A 89 -7.285 14.278 11.333 1.00 2.07 N ATOM 1295 CZ ARG A 89 -8.307 14.456 10.533 1.00 2.47 C ATOM 1296 NH1 ARG A 89 -8.429 13.749 9.443 1.00 2.69 N ATOM 1297 NH2 ARG A 89 -9.191 15.376 10.808 1.00 3.10 N ATOM 0 H ARG A 89 -8.618 10.470 10.450 1.00 0.75 H new ATOM 0 HA ARG A 89 -6.116 9.041 10.102 1.00 0.73 H new ATOM 0 HB2 ARG A 89 -6.571 10.681 12.549 1.00 0.79 H new ATOM 0 HB3 ARG A 89 -5.270 10.756 11.377 1.00 0.79 H new ATOM 0 HG2 ARG A 89 -7.068 11.701 9.714 1.00 1.63 H new ATOM 0 HG3 ARG A 89 -8.076 11.936 11.128 1.00 1.63 H new ATOM 0 HD2 ARG A 89 -5.670 13.047 11.985 1.00 1.65 H new ATOM 0 HD3 ARG A 89 -5.635 13.434 10.276 1.00 1.65 H new ATOM 0 HE ARG A 89 -7.159 14.903 12.129 1.00 2.07 H new ATOM 0 HH11 ARG A 89 -7.725 13.050 9.207 1.00 2.69 H new ATOM 0 HH12 ARG A 89 -9.229 13.895 8.827 1.00 2.69 H new ATOM 0 HH21 ARG A 89 -9.084 15.953 11.643 1.00 3.10 H new ATOM 0 HH22 ARG A 89 -9.988 15.518 10.188 1.00 3.10 H new ATOM 1311 N GLU A 90 -8.038 8.348 12.666 1.00 0.65 N ATOM 1312 CA GLU A 90 -8.306 7.359 13.742 1.00 0.65 C ATOM 1313 C GLU A 90 -8.505 5.962 13.133 1.00 0.64 C ATOM 1314 O GLU A 90 -7.875 5.008 13.546 1.00 0.67 O ATOM 1315 CB GLU A 90 -9.583 7.814 14.439 1.00 0.71 C ATOM 1316 CG GLU A 90 -9.730 7.181 15.811 1.00 1.32 C ATOM 1317 CD GLU A 90 -10.002 5.685 15.653 1.00 2.02 C ATOM 1318 OE1 GLU A 90 -11.030 5.344 15.094 1.00 2.78 O ATOM 1319 OE2 GLU A 90 -9.176 4.904 16.099 1.00 2.46 O ATOM 0 H GLU A 90 -8.742 9.081 12.583 1.00 0.65 H new ATOM 0 HA GLU A 90 -7.474 7.301 14.443 1.00 0.65 H new ATOM 0 HB2 GLU A 90 -9.577 8.899 14.538 1.00 0.71 H new ATOM 0 HB3 GLU A 90 -10.445 7.555 13.824 1.00 0.71 H new ATOM 0 HG2 GLU A 90 -8.823 7.337 16.395 1.00 1.32 H new ATOM 0 HG3 GLU A 90 -10.546 7.655 16.357 1.00 1.32 H new ATOM 1326 N VAL A 91 -9.383 5.825 12.177 1.00 0.64 N ATOM 1327 CA VAL A 91 -9.621 4.478 11.575 1.00 0.67 C ATOM 1328 C VAL A 91 -8.399 4.043 10.764 1.00 0.66 C ATOM 1329 O VAL A 91 -7.950 2.917 10.856 1.00 0.67 O ATOM 1330 CB VAL A 91 -10.844 4.539 10.655 1.00 0.71 C ATOM 1331 CG1 VAL A 91 -11.182 3.131 10.161 1.00 0.80 C ATOM 1332 CG2 VAL A 91 -12.038 5.108 11.426 1.00 0.75 C ATOM 0 H VAL A 91 -9.944 6.582 11.787 1.00 0.64 H new ATOM 0 HA VAL A 91 -9.796 3.757 12.374 1.00 0.67 H new ATOM 0 HB VAL A 91 -10.623 5.181 9.802 1.00 0.71 H new ATOM 0 HG11 VAL A 91 -12.052 3.174 9.506 1.00 0.80 H new ATOM 0 HG12 VAL A 91 -10.333 2.725 9.610 1.00 0.80 H new ATOM 0 HG13 VAL A 91 -11.401 2.489 11.014 1.00 0.80 H new ATOM 0 HG21 VAL A 91 -12.908 5.151 10.770 1.00 0.75 H new ATOM 0 HG22 VAL A 91 -12.259 4.467 12.280 1.00 0.75 H new ATOM 0 HG23 VAL A 91 -11.799 6.112 11.778 1.00 0.75 H new ATOM 1342 N PHE A 92 -7.865 4.920 9.963 1.00 0.64 N ATOM 1343 CA PHE A 92 -6.680 4.557 9.135 1.00 0.65 C ATOM 1344 C PHE A 92 -5.554 4.017 10.022 1.00 0.62 C ATOM 1345 O PHE A 92 -4.901 3.051 9.679 1.00 0.67 O ATOM 1346 CB PHE A 92 -6.185 5.800 8.386 1.00 0.65 C ATOM 1347 CG PHE A 92 -4.891 5.486 7.668 1.00 0.65 C ATOM 1348 CD1 PHE A 92 -4.917 4.878 6.407 1.00 1.31 C ATOM 1349 CD2 PHE A 92 -3.664 5.805 8.265 1.00 1.44 C ATOM 1350 CE1 PHE A 92 -3.718 4.589 5.743 1.00 1.31 C ATOM 1351 CE2 PHE A 92 -2.466 5.516 7.602 1.00 1.47 C ATOM 1352 CZ PHE A 92 -2.492 4.908 6.341 1.00 0.73 C ATOM 0 H PHE A 92 -8.198 5.877 9.845 1.00 0.64 H new ATOM 0 HA PHE A 92 -6.970 3.784 8.423 1.00 0.65 H new ATOM 0 HB2 PHE A 92 -6.938 6.128 7.670 1.00 0.65 H new ATOM 0 HB3 PHE A 92 -6.033 6.621 9.087 1.00 0.65 H new ATOM 0 HD1 PHE A 92 -5.862 4.632 5.946 1.00 1.31 H new ATOM 0 HD2 PHE A 92 -3.643 6.274 9.238 1.00 1.44 H new ATOM 0 HE1 PHE A 92 -3.739 4.120 4.770 1.00 1.31 H new ATOM 0 HE2 PHE A 92 -1.521 5.762 8.063 1.00 1.47 H new ATOM 0 HZ PHE A 92 -1.567 4.685 5.830 1.00 0.73 H new ATOM 1362 N PHE A 93 -5.294 4.638 11.144 1.00 0.58 N ATOM 1363 CA PHE A 93 -4.176 4.149 12.010 1.00 0.57 C ATOM 1364 C PHE A 93 -4.631 2.917 12.799 1.00 0.59 C ATOM 1365 O PHE A 93 -3.852 2.022 13.063 1.00 0.60 O ATOM 1366 CB PHE A 93 -3.740 5.266 12.959 1.00 0.57 C ATOM 1367 CG PHE A 93 -2.592 4.798 13.818 1.00 0.56 C ATOM 1368 CD1 PHE A 93 -1.288 4.833 13.315 1.00 1.47 C ATOM 1369 CD2 PHE A 93 -2.829 4.339 15.120 1.00 1.15 C ATOM 1370 CE1 PHE A 93 -0.219 4.408 14.112 1.00 1.58 C ATOM 1371 CE2 PHE A 93 -1.760 3.912 15.917 1.00 1.07 C ATOM 1372 CZ PHE A 93 -0.455 3.947 15.413 1.00 0.70 C ATOM 0 H PHE A 93 -5.799 5.452 11.496 1.00 0.58 H new ATOM 0 HA PHE A 93 -3.327 3.866 11.387 1.00 0.57 H new ATOM 0 HB2 PHE A 93 -3.441 6.144 12.387 1.00 0.57 H new ATOM 0 HB3 PHE A 93 -4.577 5.566 13.589 1.00 0.57 H new ATOM 0 HD1 PHE A 93 -1.106 5.188 12.311 1.00 1.47 H new ATOM 0 HD2 PHE A 93 -3.836 4.314 15.509 1.00 1.15 H new ATOM 0 HE1 PHE A 93 0.788 4.436 13.723 1.00 1.58 H new ATOM 0 HE2 PHE A 93 -1.942 3.556 16.920 1.00 1.07 H new ATOM 0 HZ PHE A 93 0.370 3.618 16.027 1.00 0.70 H new ATOM 1382 N ARG A 94 -5.881 2.846 13.160 1.00 0.62 N ATOM 1383 CA ARG A 94 -6.365 1.653 13.909 1.00 0.67 C ATOM 1384 C ARG A 94 -6.347 0.443 12.974 1.00 0.66 C ATOM 1385 O ARG A 94 -5.676 -0.536 13.239 1.00 0.67 O ATOM 1386 CB ARG A 94 -7.792 1.910 14.432 1.00 0.72 C ATOM 1387 CG ARG A 94 -8.474 0.594 14.872 1.00 0.89 C ATOM 1388 CD ARG A 94 -7.714 -0.046 16.060 1.00 1.00 C ATOM 1389 NE ARG A 94 -8.681 -0.494 17.117 1.00 1.95 N ATOM 1390 CZ ARG A 94 -9.561 0.326 17.631 1.00 2.64 C ATOM 1391 NH1 ARG A 94 -9.563 1.588 17.293 1.00 2.76 N ATOM 1392 NH2 ARG A 94 -10.425 -0.114 18.501 1.00 3.65 N ATOM 0 H ARG A 94 -6.586 3.558 12.970 1.00 0.62 H new ATOM 0 HA ARG A 94 -5.716 1.459 14.763 1.00 0.67 H new ATOM 0 HB2 ARG A 94 -7.754 2.602 15.274 1.00 0.72 H new ATOM 0 HB3 ARG A 94 -8.387 2.388 13.653 1.00 0.72 H new ATOM 0 HG2 ARG A 94 -9.507 0.792 15.159 1.00 0.89 H new ATOM 0 HG3 ARG A 94 -8.504 -0.103 14.035 1.00 0.89 H new ATOM 0 HD2 ARG A 94 -7.128 -0.896 15.710 1.00 1.00 H new ATOM 0 HD3 ARG A 94 -7.012 0.674 16.481 1.00 1.00 H new ATOM 0 HE ARG A 94 -8.651 -1.460 17.442 1.00 1.95 H new ATOM 0 HH11 ARG A 94 -8.876 1.938 16.625 1.00 2.76 H new ATOM 0 HH12 ARG A 94 -10.251 2.223 17.697 1.00 2.76 H new ATOM 0 HH21 ARG A 94 -10.414 -1.095 18.779 1.00 3.65 H new ATOM 0 HH22 ARG A 94 -11.113 0.523 18.904 1.00 3.65 H new ATOM 1406 N VAL A 95 -7.070 0.481 11.891 1.00 0.65 N ATOM 1407 CA VAL A 95 -7.073 -0.685 10.967 1.00 0.66 C ATOM 1408 C VAL A 95 -5.639 -1.021 10.560 1.00 0.66 C ATOM 1409 O VAL A 95 -5.247 -2.170 10.521 1.00 0.67 O ATOM 1410 CB VAL A 95 -7.892 -0.326 9.722 1.00 0.64 C ATOM 1411 CG1 VAL A 95 -7.913 -1.513 8.757 1.00 1.27 C ATOM 1412 CG2 VAL A 95 -9.326 0.013 10.140 1.00 1.08 C ATOM 0 H VAL A 95 -7.657 1.265 11.607 1.00 0.65 H new ATOM 0 HA VAL A 95 -7.513 -1.550 11.463 1.00 0.66 H new ATOM 0 HB VAL A 95 -7.439 0.533 9.227 1.00 0.64 H new ATOM 0 HG11 VAL A 95 -8.496 -1.253 7.874 1.00 1.27 H new ATOM 0 HG12 VAL A 95 -6.893 -1.758 8.460 1.00 1.27 H new ATOM 0 HG13 VAL A 95 -8.364 -2.374 9.249 1.00 1.27 H new ATOM 0 HG21 VAL A 95 -9.912 0.269 9.257 1.00 1.08 H new ATOM 0 HG22 VAL A 95 -9.774 -0.848 10.635 1.00 1.08 H new ATOM 0 HG23 VAL A 95 -9.314 0.860 10.826 1.00 1.08 H new ATOM 1422 N ALA A 96 -4.857 -0.027 10.238 1.00 0.65 N ATOM 1423 CA ALA A 96 -3.456 -0.292 9.815 1.00 0.68 C ATOM 1424 C ALA A 96 -2.702 -1.042 10.909 1.00 0.70 C ATOM 1425 O ALA A 96 -1.877 -1.892 10.648 1.00 0.76 O ATOM 1426 CB ALA A 96 -2.767 1.041 9.504 1.00 0.69 C ATOM 0 H ALA A 96 -5.129 0.956 10.250 1.00 0.65 H new ATOM 0 HA ALA A 96 -3.458 -0.915 8.921 1.00 0.68 H new ATOM 0 HB1 ALA A 96 -1.739 0.855 9.193 1.00 0.69 H new ATOM 0 HB2 ALA A 96 -3.303 1.549 8.702 1.00 0.69 H new ATOM 0 HB3 ALA A 96 -2.769 1.668 10.396 1.00 0.69 H new ATOM 1432 N ALA A 97 -2.983 -0.713 12.142 1.00 0.74 N ATOM 1433 CA ALA A 97 -2.298 -1.376 13.290 1.00 0.78 C ATOM 1434 C ALA A 97 -2.926 -2.743 13.572 1.00 0.79 C ATOM 1435 O ALA A 97 -2.249 -3.678 13.950 1.00 0.83 O ATOM 1436 CB ALA A 97 -2.455 -0.499 14.533 1.00 0.77 C ATOM 0 H ALA A 97 -3.667 -0.004 12.406 1.00 0.74 H new ATOM 0 HA ALA A 97 -1.245 -1.511 13.043 1.00 0.78 H new ATOM 0 HB1 ALA A 97 -1.958 -0.974 15.379 1.00 0.77 H new ATOM 0 HB2 ALA A 97 -2.005 0.477 14.349 1.00 0.77 H new ATOM 0 HB3 ALA A 97 -3.514 -0.374 14.758 1.00 0.77 H new ATOM 1442 N ASP A 98 -4.211 -2.869 13.395 1.00 0.78 N ATOM 1443 CA ASP A 98 -4.874 -4.179 13.659 1.00 0.82 C ATOM 1444 C ASP A 98 -4.293 -5.260 12.744 1.00 0.83 C ATOM 1445 O ASP A 98 -4.245 -6.415 13.120 1.00 0.88 O ATOM 1446 CB ASP A 98 -6.384 -4.054 13.443 1.00 0.82 C ATOM 1447 CG ASP A 98 -7.074 -5.353 13.862 1.00 1.47 C ATOM 1448 OD1 ASP A 98 -7.282 -5.534 15.050 1.00 2.19 O ATOM 1449 OD2 ASP A 98 -7.385 -6.144 12.986 1.00 2.13 O ATOM 0 H ASP A 98 -4.832 -2.124 13.079 1.00 0.78 H new ATOM 0 HA ASP A 98 -4.690 -4.466 14.694 1.00 0.82 H new ATOM 0 HB2 ASP A 98 -6.776 -3.219 14.024 1.00 0.82 H new ATOM 0 HB3 ASP A 98 -6.595 -3.841 12.395 1.00 0.82 H new ATOM 1454 N MET A 99 -3.863 -4.939 11.556 1.00 0.81 N ATOM 1455 CA MET A 99 -3.314 -6.018 10.686 1.00 0.85 C ATOM 1456 C MET A 99 -2.051 -6.599 11.330 1.00 0.97 C ATOM 1457 O MET A 99 -1.654 -7.711 11.039 1.00 1.14 O ATOM 1458 CB MET A 99 -2.957 -5.466 9.305 1.00 0.79 C ATOM 1459 CG MET A 99 -4.215 -5.005 8.568 1.00 0.81 C ATOM 1460 SD MET A 99 -3.852 -4.903 6.797 1.00 0.97 S ATOM 1461 CE MET A 99 -5.259 -3.869 6.329 1.00 0.48 C ATOM 0 H MET A 99 -3.866 -4.001 11.156 1.00 0.81 H new ATOM 0 HA MET A 99 -4.072 -6.793 10.575 1.00 0.85 H new ATOM 0 HB2 MET A 99 -2.264 -4.631 9.409 1.00 0.79 H new ATOM 0 HB3 MET A 99 -2.448 -6.233 8.721 1.00 0.79 H new ATOM 0 HG2 MET A 99 -5.033 -5.703 8.746 1.00 0.81 H new ATOM 0 HG3 MET A 99 -4.537 -4.034 8.943 1.00 0.81 H new ATOM 0 HE1 MET A 99 -5.230 -3.679 5.256 1.00 0.48 H new ATOM 0 HE2 MET A 99 -6.187 -4.381 6.582 1.00 0.48 H new ATOM 0 HE3 MET A 99 -5.209 -2.922 6.866 1.00 0.48 H new ATOM 1600 N ARG A 109 -0.182 -8.888 3.942 1.00 0.86 N ATOM 1601 CA ARG A 109 -1.252 -7.923 4.309 1.00 0.87 C ATOM 1602 C ARG A 109 -0.910 -6.596 3.631 1.00 0.70 C ATOM 1603 O ARG A 109 -1.754 -5.754 3.395 1.00 0.81 O ATOM 1604 CB ARG A 109 -1.324 -7.759 5.833 1.00 1.08 C ATOM 1605 CG ARG A 109 0.104 -7.832 6.423 1.00 1.48 C ATOM 1606 CD ARG A 109 0.211 -7.013 7.722 1.00 1.96 C ATOM 1607 NE ARG A 109 -0.399 -5.650 7.561 1.00 2.74 N ATOM 1608 CZ ARG A 109 -0.093 -4.870 6.555 1.00 3.19 C ATOM 1609 NH1 ARG A 109 0.901 -5.158 5.765 1.00 3.19 N ATOM 1610 NH2 ARG A 109 -0.749 -3.756 6.384 1.00 4.08 N ATOM 0 HA ARG A 109 -2.228 -8.278 3.979 1.00 0.87 H new ATOM 0 HB2 ARG A 109 -1.786 -6.805 6.086 1.00 1.08 H new ATOM 0 HB3 ARG A 109 -1.949 -8.540 6.265 1.00 1.08 H new ATOM 0 HG2 ARG A 109 0.365 -8.871 6.622 1.00 1.48 H new ATOM 0 HG3 ARG A 109 0.822 -7.457 5.693 1.00 1.48 H new ATOM 0 HD2 ARG A 109 -0.290 -7.544 8.531 1.00 1.96 H new ATOM 0 HD3 ARG A 109 1.259 -6.913 8.006 1.00 1.96 H new ATOM 0 HE ARG A 109 -1.071 -5.323 8.255 1.00 2.74 H new ATOM 0 HH11 ARG A 109 1.453 -6.001 5.926 1.00 3.19 H new ATOM 0 HH12 ARG A 109 1.128 -4.541 4.985 1.00 3.19 H new ATOM 0 HH21 ARG A 109 -1.494 -3.498 7.031 1.00 4.08 H new ATOM 0 HH22 ARG A 109 -0.517 -3.142 5.603 1.00 4.08 H new ATOM 1624 N VAL A 110 0.352 -6.431 3.308 1.00 0.60 N ATOM 1625 CA VAL A 110 0.806 -5.192 2.628 1.00 0.68 C ATOM 1626 C VAL A 110 0.034 -5.046 1.324 1.00 0.56 C ATOM 1627 O VAL A 110 -0.463 -3.977 1.021 1.00 0.60 O ATOM 1628 CB VAL A 110 2.306 -5.258 2.341 1.00 0.88 C ATOM 1629 CG1 VAL A 110 2.801 -3.891 1.863 1.00 1.27 C ATOM 1630 CG2 VAL A 110 3.055 -5.653 3.615 1.00 1.73 C ATOM 0 H VAL A 110 1.088 -7.113 3.492 1.00 0.60 H new ATOM 0 HA VAL A 110 0.621 -4.333 3.272 1.00 0.68 H new ATOM 0 HB VAL A 110 2.490 -6.001 1.565 1.00 0.88 H new ATOM 0 HG11 VAL A 110 3.871 -3.942 1.659 1.00 1.27 H new ATOM 0 HG12 VAL A 110 2.271 -3.610 0.953 1.00 1.27 H new ATOM 0 HG13 VAL A 110 2.614 -3.146 2.636 1.00 1.27 H new ATOM 0 HG21 VAL A 110 4.124 -5.700 3.409 1.00 1.73 H new ATOM 0 HG22 VAL A 110 2.867 -4.912 4.392 1.00 1.73 H new ATOM 0 HG23 VAL A 110 2.708 -6.629 3.953 1.00 1.73 H new ATOM 1640 N VAL A 111 -0.110 -6.084 0.542 1.00 0.51 N ATOM 1641 CA VAL A 111 -0.888 -5.944 -0.717 1.00 0.50 C ATOM 1642 C VAL A 111 -2.258 -5.368 -0.366 1.00 0.46 C ATOM 1643 O VAL A 111 -2.763 -4.482 -1.026 1.00 0.47 O ATOM 1644 CB VAL A 111 -1.037 -7.325 -1.363 1.00 0.58 C ATOM 1645 CG1 VAL A 111 -1.688 -7.185 -2.738 1.00 1.41 C ATOM 1646 CG2 VAL A 111 0.350 -7.959 -1.521 1.00 1.36 C ATOM 0 H VAL A 111 0.274 -7.012 0.721 1.00 0.51 H new ATOM 0 HA VAL A 111 -0.383 -5.281 -1.419 1.00 0.50 H new ATOM 0 HB VAL A 111 -1.663 -7.955 -0.731 1.00 0.58 H new ATOM 0 HG11 VAL A 111 -1.792 -8.170 -3.193 1.00 1.41 H new ATOM 0 HG12 VAL A 111 -2.672 -6.730 -2.630 1.00 1.41 H new ATOM 0 HG13 VAL A 111 -1.065 -6.555 -3.373 1.00 1.41 H new ATOM 0 HG21 VAL A 111 0.250 -8.942 -1.980 1.00 1.36 H new ATOM 0 HG22 VAL A 111 0.970 -7.324 -2.154 1.00 1.36 H new ATOM 0 HG23 VAL A 111 0.817 -8.062 -0.541 1.00 1.36 H new ATOM 1656 N ALA A 112 -2.860 -5.870 0.678 1.00 0.45 N ATOM 1657 CA ALA A 112 -4.200 -5.348 1.096 1.00 0.47 C ATOM 1658 C ALA A 112 -4.063 -3.891 1.562 1.00 0.46 C ATOM 1659 O ALA A 112 -5.035 -3.164 1.624 1.00 0.54 O ATOM 1660 CB ALA A 112 -4.761 -6.222 2.231 1.00 0.53 C ATOM 0 H ALA A 112 -2.485 -6.618 1.261 1.00 0.45 H new ATOM 0 HA ALA A 112 -4.887 -5.384 0.251 1.00 0.47 H new ATOM 0 HB1 ALA A 112 -5.736 -5.842 2.535 1.00 0.53 H new ATOM 0 HB2 ALA A 112 -4.865 -7.249 1.882 1.00 0.53 H new ATOM 0 HB3 ALA A 112 -4.080 -6.195 3.082 1.00 0.53 H new ATOM 1666 N LEU A 113 -2.881 -3.446 1.861 1.00 0.43 N ATOM 1667 CA LEU A 113 -2.711 -2.027 2.286 1.00 0.43 C ATOM 1668 C LEU A 113 -2.749 -1.128 1.044 1.00 0.42 C ATOM 1669 O LEU A 113 -3.465 -0.147 0.994 1.00 0.45 O ATOM 1670 CB LEU A 113 -1.354 -1.867 3.002 1.00 0.44 C ATOM 1671 CG LEU A 113 -1.458 -0.781 4.088 1.00 0.51 C ATOM 1672 CD1 LEU A 113 -0.106 -0.610 4.778 1.00 1.45 C ATOM 1673 CD2 LEU A 113 -1.885 0.549 3.455 1.00 1.27 C ATOM 0 H LEU A 113 -2.024 -3.998 1.831 1.00 0.43 H new ATOM 0 HA LEU A 113 -3.512 -1.744 2.968 1.00 0.43 H new ATOM 0 HB2 LEU A 113 -1.056 -2.815 3.451 1.00 0.44 H new ATOM 0 HB3 LEU A 113 -0.582 -1.599 2.281 1.00 0.44 H new ATOM 0 HG LEU A 113 -2.203 -1.083 4.824 1.00 0.51 H new ATOM 0 HD11 LEU A 113 -0.184 0.160 5.546 1.00 1.45 H new ATOM 0 HD12 LEU A 113 0.190 -1.553 5.238 1.00 1.45 H new ATOM 0 HD13 LEU A 113 0.643 -0.314 4.043 1.00 1.45 H new ATOM 0 HD21 LEU A 113 -1.957 1.314 4.229 1.00 1.27 H new ATOM 0 HD22 LEU A 113 -1.147 0.852 2.713 1.00 1.27 H new ATOM 0 HD23 LEU A 113 -2.855 0.428 2.973 1.00 1.27 H new ATOM 1685 N PHE A 114 -1.980 -1.462 0.042 1.00 0.40 N ATOM 1686 CA PHE A 114 -1.962 -0.642 -1.202 1.00 0.40 C ATOM 1687 C PHE A 114 -3.390 -0.456 -1.727 1.00 0.39 C ATOM 1688 O PHE A 114 -3.765 0.607 -2.177 1.00 0.41 O ATOM 1689 CB PHE A 114 -1.120 -1.350 -2.276 1.00 0.41 C ATOM 1690 CG PHE A 114 0.360 -1.195 -1.969 1.00 0.44 C ATOM 1691 CD1 PHE A 114 0.949 0.078 -1.960 1.00 1.29 C ATOM 1692 CD2 PHE A 114 1.147 -2.325 -1.702 1.00 1.27 C ATOM 1693 CE1 PHE A 114 2.315 0.217 -1.683 1.00 1.38 C ATOM 1694 CE2 PHE A 114 2.512 -2.185 -1.426 1.00 1.27 C ATOM 1695 CZ PHE A 114 3.095 -0.914 -1.415 1.00 0.68 C ATOM 0 H PHE A 114 -1.361 -2.272 0.033 1.00 0.40 H new ATOM 0 HA PHE A 114 -1.528 0.332 -0.976 1.00 0.40 H new ATOM 0 HB2 PHE A 114 -1.382 -2.407 -2.315 1.00 0.41 H new ATOM 0 HB3 PHE A 114 -1.341 -0.930 -3.257 1.00 0.41 H new ATOM 0 HD1 PHE A 114 0.349 0.952 -2.167 1.00 1.29 H new ATOM 0 HD2 PHE A 114 0.698 -3.307 -1.709 1.00 1.27 H new ATOM 0 HE1 PHE A 114 2.767 1.198 -1.676 1.00 1.38 H new ATOM 0 HE2 PHE A 114 3.114 -3.058 -1.222 1.00 1.27 H new ATOM 0 HZ PHE A 114 4.148 -0.805 -1.200 1.00 0.68 H new ATOM 1705 N TYR A 115 -4.183 -1.493 -1.685 1.00 0.40 N ATOM 1706 CA TYR A 115 -5.579 -1.389 -2.195 1.00 0.41 C ATOM 1707 C TYR A 115 -6.465 -0.657 -1.186 1.00 0.41 C ATOM 1708 O TYR A 115 -7.318 0.127 -1.553 1.00 0.44 O ATOM 1709 CB TYR A 115 -6.147 -2.792 -2.434 1.00 0.44 C ATOM 1710 CG TYR A 115 -7.550 -2.680 -2.990 1.00 0.47 C ATOM 1711 CD1 TYR A 115 -7.742 -2.309 -4.325 1.00 1.24 C ATOM 1712 CD2 TYR A 115 -8.657 -2.946 -2.172 1.00 1.28 C ATOM 1713 CE1 TYR A 115 -9.038 -2.203 -4.844 1.00 1.26 C ATOM 1714 CE2 TYR A 115 -9.954 -2.840 -2.692 1.00 1.32 C ATOM 1715 CZ TYR A 115 -10.144 -2.468 -4.028 1.00 0.61 C ATOM 1716 OH TYR A 115 -11.421 -2.362 -4.540 1.00 0.70 O ATOM 0 H TYR A 115 -3.923 -2.409 -1.319 1.00 0.40 H new ATOM 0 HA TYR A 115 -5.565 -0.829 -3.130 1.00 0.41 H new ATOM 0 HB2 TYR A 115 -5.511 -3.340 -3.130 1.00 0.44 H new ATOM 0 HB3 TYR A 115 -6.158 -3.355 -1.501 1.00 0.44 H new ATOM 0 HD1 TYR A 115 -6.890 -2.104 -4.956 1.00 1.24 H new ATOM 0 HD2 TYR A 115 -8.510 -3.233 -1.141 1.00 1.28 H new ATOM 0 HE1 TYR A 115 -9.185 -1.916 -5.875 1.00 1.26 H new ATOM 0 HE2 TYR A 115 -10.807 -3.045 -2.062 1.00 1.32 H new ATOM 0 HH TYR A 115 -11.509 -2.944 -5.324 1.00 0.70 H new ATOM 1726 N PHE A 116 -6.281 -0.905 0.081 1.00 0.38 N ATOM 1727 CA PHE A 116 -7.133 -0.219 1.092 1.00 0.38 C ATOM 1728 C PHE A 116 -6.985 1.297 0.937 1.00 0.36 C ATOM 1729 O PHE A 116 -7.953 2.036 0.913 1.00 0.35 O ATOM 1730 CB PHE A 116 -6.685 -0.629 2.499 1.00 0.40 C ATOM 1731 CG PHE A 116 -7.569 0.044 3.530 1.00 0.37 C ATOM 1732 CD1 PHE A 116 -8.905 -0.356 3.676 1.00 1.35 C ATOM 1733 CD2 PHE A 116 -7.055 1.066 4.340 1.00 1.17 C ATOM 1734 CE1 PHE A 116 -9.722 0.264 4.628 1.00 1.37 C ATOM 1735 CE2 PHE A 116 -7.874 1.685 5.293 1.00 1.18 C ATOM 1736 CZ PHE A 116 -9.207 1.284 5.436 1.00 0.45 C ATOM 0 H PHE A 116 -5.584 -1.547 0.458 1.00 0.38 H new ATOM 0 HA PHE A 116 -8.175 -0.503 0.942 1.00 0.38 H new ATOM 0 HB2 PHE A 116 -6.741 -1.712 2.608 1.00 0.40 H new ATOM 0 HB3 PHE A 116 -5.644 -0.346 2.657 1.00 0.40 H new ATOM 0 HD1 PHE A 116 -9.304 -1.143 3.053 1.00 1.35 H new ATOM 0 HD2 PHE A 116 -6.027 1.376 4.229 1.00 1.17 H new ATOM 0 HE1 PHE A 116 -10.751 -0.045 4.739 1.00 1.37 H new ATOM 0 HE2 PHE A 116 -7.477 2.472 5.917 1.00 1.18 H new ATOM 0 HZ PHE A 116 -9.839 1.762 6.170 1.00 0.45 H new ATOM 1746 N ALA A 117 -5.769 1.766 0.826 1.00 0.35 N ATOM 1747 CA ALA A 117 -5.543 3.226 0.671 1.00 0.34 C ATOM 1748 C ALA A 117 -6.077 3.681 -0.687 1.00 0.34 C ATOM 1749 O ALA A 117 -6.638 4.749 -0.813 1.00 0.34 O ATOM 1750 CB ALA A 117 -4.045 3.529 0.766 1.00 0.37 C ATOM 0 H ALA A 117 -4.923 1.196 0.837 1.00 0.35 H new ATOM 0 HA ALA A 117 -6.066 3.761 1.464 1.00 0.34 H new ATOM 0 HB1 ALA A 117 -3.883 4.601 0.652 1.00 0.37 H new ATOM 0 HB2 ALA A 117 -3.669 3.206 1.737 1.00 0.37 H new ATOM 0 HB3 ALA A 117 -3.515 2.996 -0.023 1.00 0.37 H new ATOM 1756 N SER A 118 -5.920 2.878 -1.705 1.00 0.35 N ATOM 1757 CA SER A 118 -6.427 3.271 -3.050 1.00 0.37 C ATOM 1758 C SER A 118 -7.870 3.771 -2.938 1.00 0.36 C ATOM 1759 O SER A 118 -8.244 4.765 -3.524 1.00 0.36 O ATOM 1760 CB SER A 118 -6.379 2.060 -3.985 1.00 0.42 C ATOM 1761 OG SER A 118 -7.529 1.254 -3.768 1.00 1.25 O ATOM 0 H SER A 118 -5.463 1.967 -1.663 1.00 0.35 H new ATOM 0 HA SER A 118 -5.802 4.069 -3.450 1.00 0.37 H new ATOM 0 HB2 SER A 118 -6.342 2.389 -5.023 1.00 0.42 H new ATOM 0 HB3 SER A 118 -5.474 1.480 -3.802 1.00 0.42 H new ATOM 0 HG SER A 118 -7.292 0.493 -3.198 1.00 1.25 H new ATOM 1767 N LYS A 119 -8.670 3.111 -2.146 1.00 0.37 N ATOM 1768 CA LYS A 119 -10.075 3.571 -1.952 1.00 0.39 C ATOM 1769 C LYS A 119 -10.043 4.951 -1.289 1.00 0.36 C ATOM 1770 O LYS A 119 -10.677 5.877 -1.755 1.00 0.38 O ATOM 1771 CB LYS A 119 -10.830 2.568 -1.064 1.00 0.46 C ATOM 1772 CG LYS A 119 -11.350 1.391 -1.912 1.00 1.29 C ATOM 1773 CD LYS A 119 -12.722 1.736 -2.504 1.00 1.84 C ATOM 1774 CE LYS A 119 -13.113 0.681 -3.540 1.00 2.48 C ATOM 1775 NZ LYS A 119 -13.182 -0.656 -2.885 1.00 3.36 N ATOM 0 H LYS A 119 -8.412 2.273 -1.625 1.00 0.37 H new ATOM 0 HA LYS A 119 -10.589 3.636 -2.911 1.00 0.39 H new ATOM 0 HB2 LYS A 119 -10.170 2.197 -0.280 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -11.664 3.066 -0.569 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -10.645 1.170 -2.713 1.00 1.29 H new ATOM 0 HG3 LYS A 119 -11.425 0.494 -1.297 1.00 1.29 H new ATOM 0 HD2 LYS A 119 -13.471 1.778 -1.713 1.00 1.84 H new ATOM 0 HD3 LYS A 119 -12.692 2.722 -2.968 1.00 1.84 H new ATOM 0 HE2 LYS A 119 -14.077 0.931 -3.983 1.00 2.48 H new ATOM 0 HE3 LYS A 119 -12.384 0.664 -4.350 1.00 2.48 H new ATOM 0 HZ1 LYS A 119 -12.812 -1.380 -3.534 1.00 3.36 H new ATOM 0 HZ2 LYS A 119 -12.612 -0.646 -2.015 1.00 3.36 H new ATOM 0 HZ3 LYS A 119 -14.171 -0.876 -2.649 1.00 3.36 H new ATOM 1789 N LEU A 120 -9.293 5.121 -0.237 1.00 0.36 N ATOM 1790 CA LEU A 120 -9.218 6.472 0.395 1.00 0.35 C ATOM 1791 C LEU A 120 -8.841 7.496 -0.681 1.00 0.33 C ATOM 1792 O LEU A 120 -9.394 8.575 -0.755 1.00 0.39 O ATOM 1793 CB LEU A 120 -8.152 6.461 1.496 1.00 0.36 C ATOM 1794 CG LEU A 120 -8.552 5.471 2.603 1.00 0.68 C ATOM 1795 CD1 LEU A 120 -7.473 5.467 3.690 1.00 1.69 C ATOM 1796 CD2 LEU A 120 -9.904 5.874 3.228 1.00 1.28 C ATOM 0 H LEU A 120 -8.734 4.394 0.210 1.00 0.36 H new ATOM 0 HA LEU A 120 -10.180 6.735 0.834 1.00 0.35 H new ATOM 0 HB2 LEU A 120 -7.186 6.180 1.076 1.00 0.36 H new ATOM 0 HB3 LEU A 120 -8.039 7.461 1.914 1.00 0.36 H new ATOM 0 HG LEU A 120 -8.649 4.476 2.168 1.00 0.68 H new ATOM 0 HD11 LEU A 120 -7.752 4.767 4.477 1.00 1.69 H new ATOM 0 HD12 LEU A 120 -6.520 5.164 3.256 1.00 1.69 H new ATOM 0 HD13 LEU A 120 -7.378 6.468 4.112 1.00 1.69 H new ATOM 0 HD21 LEU A 120 -10.170 5.162 4.009 1.00 1.28 H new ATOM 0 HD22 LEU A 120 -9.823 6.872 3.659 1.00 1.28 H new ATOM 0 HD23 LEU A 120 -10.675 5.873 2.458 1.00 1.28 H new ATOM 1808 N VAL A 121 -7.918 7.141 -1.531 1.00 0.33 N ATOM 1809 CA VAL A 121 -7.503 8.049 -2.639 1.00 0.39 C ATOM 1810 C VAL A 121 -8.618 8.125 -3.687 1.00 0.36 C ATOM 1811 O VAL A 121 -9.220 9.159 -3.890 1.00 0.39 O ATOM 1812 CB VAL A 121 -6.224 7.516 -3.287 1.00 0.54 C ATOM 1813 CG1 VAL A 121 -5.730 8.519 -4.333 1.00 0.95 C ATOM 1814 CG2 VAL A 121 -5.145 7.339 -2.214 1.00 1.18 C ATOM 0 H VAL A 121 -7.426 6.248 -1.505 1.00 0.33 H new ATOM 0 HA VAL A 121 -7.316 9.045 -2.239 1.00 0.39 H new ATOM 0 HB VAL A 121 -6.430 6.557 -3.763 1.00 0.54 H new ATOM 0 HG11 VAL A 121 -4.818 8.142 -4.797 1.00 0.95 H new ATOM 0 HG12 VAL A 121 -6.496 8.655 -5.097 1.00 0.95 H new ATOM 0 HG13 VAL A 121 -5.524 9.475 -3.852 1.00 0.95 H new ATOM 0 HG21 VAL A 121 -4.233 6.959 -2.674 1.00 1.18 H new ATOM 0 HG22 VAL A 121 -4.940 8.300 -1.742 1.00 1.18 H new ATOM 0 HG23 VAL A 121 -5.493 6.632 -1.461 1.00 1.18 H new ATOM 1824 N LEU A 122 -8.894 7.040 -4.363 1.00 0.37 N ATOM 1825 CA LEU A 122 -9.967 7.061 -5.400 1.00 0.39 C ATOM 1826 C LEU A 122 -11.255 7.647 -4.812 1.00 0.40 C ATOM 1827 O LEU A 122 -11.818 8.586 -5.346 1.00 0.40 O ATOM 1828 CB LEU A 122 -10.244 5.637 -5.899 1.00 0.42 C ATOM 1829 CG LEU A 122 -8.955 4.997 -6.440 1.00 0.72 C ATOM 1830 CD1 LEU A 122 -9.118 3.474 -6.482 1.00 1.15 C ATOM 1831 CD2 LEU A 122 -8.675 5.487 -7.866 1.00 1.24 C ATOM 0 H LEU A 122 -8.424 6.143 -4.242 1.00 0.37 H new ATOM 0 HA LEU A 122 -9.633 7.680 -6.233 1.00 0.39 H new ATOM 0 HB2 LEU A 122 -10.644 5.032 -5.086 1.00 0.42 H new ATOM 0 HB3 LEU A 122 -11.002 5.660 -6.682 1.00 0.42 H new ATOM 0 HG LEU A 122 -8.130 5.276 -5.785 1.00 0.72 H new ATOM 0 HD11 LEU A 122 -8.204 3.021 -6.866 1.00 1.15 H new ATOM 0 HD12 LEU A 122 -9.314 3.101 -5.477 1.00 1.15 H new ATOM 0 HD13 LEU A 122 -9.953 3.215 -7.134 1.00 1.15 H new ATOM 0 HD21 LEU A 122 -7.759 5.026 -8.236 1.00 1.24 H new ATOM 0 HD22 LEU A 122 -9.507 5.213 -8.515 1.00 1.24 H new ATOM 0 HD23 LEU A 122 -8.559 6.571 -7.862 1.00 1.24 H new ATOM 1843 N LYS A 123 -11.727 7.116 -3.719 1.00 0.51 N ATOM 1844 CA LYS A 123 -12.974 7.664 -3.113 1.00 0.55 C ATOM 1845 C LYS A 123 -12.842 9.181 -2.967 1.00 0.54 C ATOM 1846 O LYS A 123 -13.808 9.903 -3.085 1.00 0.55 O ATOM 1847 CB LYS A 123 -13.208 7.031 -1.739 1.00 0.59 C ATOM 1848 CG LYS A 123 -14.600 7.418 -1.232 1.00 0.97 C ATOM 1849 CD LYS A 123 -14.858 6.749 0.120 1.00 1.37 C ATOM 1850 CE LYS A 123 -16.286 7.053 0.577 1.00 1.74 C ATOM 1851 NZ LYS A 123 -16.462 8.527 0.714 1.00 2.32 N ATOM 0 H LYS A 123 -11.307 6.331 -3.221 1.00 0.51 H new ATOM 0 HA LYS A 123 -13.821 7.432 -3.758 1.00 0.55 H new ATOM 0 HB2 LYS A 123 -13.122 5.947 -1.806 1.00 0.59 H new ATOM 0 HB3 LYS A 123 -12.446 7.368 -1.036 1.00 0.59 H new ATOM 0 HG2 LYS A 123 -14.674 8.501 -1.133 1.00 0.97 H new ATOM 0 HG3 LYS A 123 -15.359 7.111 -1.952 1.00 0.97 H new ATOM 0 HD2 LYS A 123 -14.713 5.672 0.038 1.00 1.37 H new ATOM 0 HD3 LYS A 123 -14.144 7.112 0.859 1.00 1.37 H new ATOM 0 HE2 LYS A 123 -17.002 6.656 -0.143 1.00 1.74 H new ATOM 0 HE3 LYS A 123 -16.486 6.562 1.529 1.00 1.74 H new ATOM 0 HZ1 LYS A 123 -17.298 8.724 1.300 1.00 2.32 H new ATOM 0 HZ2 LYS A 123 -15.619 8.937 1.165 1.00 2.32 H new ATOM 0 HZ3 LYS A 123 -16.592 8.950 -0.227 1.00 2.32 H new ATOM 1865 N ALA A 124 -11.659 9.670 -2.710 1.00 0.52 N ATOM 1866 CA ALA A 124 -11.479 11.142 -2.556 1.00 0.52 C ATOM 1867 C ALA A 124 -11.492 11.818 -3.929 1.00 0.51 C ATOM 1868 O ALA A 124 -11.823 12.977 -4.066 1.00 0.54 O ATOM 1869 CB ALA A 124 -10.151 11.428 -1.855 1.00 0.51 C ATOM 0 H ALA A 124 -10.811 9.115 -2.600 1.00 0.52 H new ATOM 0 HA ALA A 124 -12.298 11.539 -1.956 1.00 0.52 H new ATOM 0 HB1 ALA A 124 -10.023 12.505 -1.744 1.00 0.51 H new ATOM 0 HB2 ALA A 124 -10.151 10.959 -0.871 1.00 0.51 H new ATOM 0 HB3 ALA A 124 -9.331 11.024 -2.449 1.00 0.51 H new ATOM 1875 N LEU A 125 -11.122 11.093 -4.951 1.00 0.47 N ATOM 1876 CA LEU A 125 -11.106 11.684 -6.320 1.00 0.47 C ATOM 1877 C LEU A 125 -12.515 12.189 -6.660 1.00 0.48 C ATOM 1878 O LEU A 125 -12.687 13.255 -7.217 1.00 0.48 O ATOM 1879 CB LEU A 125 -10.669 10.605 -7.329 1.00 0.51 C ATOM 1880 CG LEU A 125 -9.932 11.241 -8.516 1.00 0.49 C ATOM 1881 CD1 LEU A 125 -9.623 10.159 -9.553 1.00 1.10 C ATOM 1882 CD2 LEU A 125 -10.807 12.329 -9.154 1.00 1.21 C ATOM 0 H LEU A 125 -10.830 10.117 -4.897 1.00 0.47 H new ATOM 0 HA LEU A 125 -10.405 12.518 -6.365 1.00 0.47 H new ATOM 0 HB2 LEU A 125 -10.020 9.881 -6.837 1.00 0.51 H new ATOM 0 HB3 LEU A 125 -11.542 10.059 -7.686 1.00 0.51 H new ATOM 0 HG LEU A 125 -9.004 11.693 -8.166 1.00 0.49 H new ATOM 0 HD11 LEU A 125 -9.099 10.605 -10.399 1.00 1.10 H new ATOM 0 HD12 LEU A 125 -8.995 9.391 -9.101 1.00 1.10 H new ATOM 0 HD13 LEU A 125 -10.554 9.710 -9.899 1.00 1.10 H new ATOM 0 HD21 LEU A 125 -10.277 12.775 -9.995 1.00 1.21 H new ATOM 0 HD22 LEU A 125 -11.739 11.887 -9.506 1.00 1.21 H new ATOM 0 HD23 LEU A 125 -11.027 13.099 -8.414 1.00 1.21 H new ATOM 1894 N CYS A 126 -13.524 11.432 -6.324 1.00 0.52 N ATOM 1895 CA CYS A 126 -14.921 11.872 -6.627 1.00 0.57 C ATOM 1896 C CYS A 126 -15.260 13.116 -5.787 1.00 0.57 C ATOM 1897 O CYS A 126 -15.927 14.027 -6.231 1.00 0.68 O ATOM 1898 CB CYS A 126 -15.898 10.722 -6.320 1.00 0.66 C ATOM 1899 SG CYS A 126 -16.380 10.754 -4.571 1.00 1.67 S ATOM 0 H CYS A 126 -13.445 10.530 -5.854 1.00 0.52 H new ATOM 0 HA CYS A 126 -15.009 12.131 -7.682 1.00 0.57 H new ATOM 0 HB2 CYS A 126 -16.783 10.810 -6.950 1.00 0.66 H new ATOM 0 HB3 CYS A 126 -15.431 9.766 -6.558 1.00 0.66 H new ATOM 0 HG CYS A 126 -15.434 10.228 -3.851 1.00 1.67 H new ATOM 1905 N THR A 127 -14.776 13.142 -4.578 1.00 0.57 N ATOM 1906 CA THR A 127 -15.017 14.306 -3.675 1.00 0.60 C ATOM 1907 C THR A 127 -14.260 15.525 -4.198 1.00 0.62 C ATOM 1908 O THR A 127 -14.521 16.650 -3.823 1.00 0.70 O ATOM 1909 CB THR A 127 -14.523 13.936 -2.259 1.00 0.60 C ATOM 1910 OG1 THR A 127 -13.118 13.751 -2.263 1.00 1.14 O ATOM 1911 CG2 THR A 127 -15.241 12.635 -1.905 1.00 1.19 C ATOM 0 H THR A 127 -14.214 12.395 -4.169 1.00 0.57 H new ATOM 0 HA THR A 127 -16.080 14.547 -3.642 1.00 0.60 H new ATOM 0 HB THR A 127 -14.736 14.720 -1.533 1.00 0.60 H new ATOM 0 HG1 THR A 127 -12.812 13.590 -3.180 1.00 1.14 H new ATOM 0 HG21 THR A 127 -14.938 12.311 -0.909 1.00 1.19 H new ATOM 0 HG22 THR A 127 -16.319 12.798 -1.921 1.00 1.19 H new ATOM 0 HG23 THR A 127 -14.980 11.866 -2.632 1.00 1.19 H new ATOM 1919 N LYS A 128 -13.305 15.292 -5.068 1.00 0.60 N ATOM 1920 CA LYS A 128 -12.499 16.412 -5.632 1.00 0.70 C ATOM 1921 C LYS A 128 -11.890 17.213 -4.486 1.00 0.61 C ATOM 1922 O LYS A 128 -12.313 18.319 -4.211 1.00 0.60 O ATOM 1923 CB LYS A 128 -13.377 17.325 -6.491 1.00 0.87 C ATOM 1924 CG LYS A 128 -13.998 16.523 -7.636 1.00 1.12 C ATOM 1925 CD LYS A 128 -14.891 17.442 -8.472 1.00 1.43 C ATOM 1926 CE LYS A 128 -15.488 16.656 -9.641 1.00 1.83 C ATOM 1927 NZ LYS A 128 -16.317 15.536 -9.115 1.00 2.47 N ATOM 0 H LYS A 128 -13.051 14.366 -5.411 1.00 0.60 H new ATOM 0 HA LYS A 128 -11.708 16.002 -6.261 1.00 0.70 H new ATOM 0 HB2 LYS A 128 -14.162 17.770 -5.879 1.00 0.87 H new ATOM 0 HB3 LYS A 128 -12.781 18.145 -6.891 1.00 0.87 H new ATOM 0 HG2 LYS A 128 -13.215 16.092 -8.260 1.00 1.12 H new ATOM 0 HG3 LYS A 128 -14.582 15.693 -7.239 1.00 1.12 H new ATOM 0 HD2 LYS A 128 -15.688 17.853 -7.852 1.00 1.43 H new ATOM 0 HD3 LYS A 128 -14.312 18.286 -8.847 1.00 1.43 H new ATOM 0 HE2 LYS A 128 -16.097 17.313 -10.261 1.00 1.83 H new ATOM 0 HE3 LYS A 128 -14.692 16.266 -10.275 1.00 1.83 H new ATOM 0 HZ1 LYS A 128 -16.979 15.218 -9.852 1.00 2.47 H new ATOM 0 HZ2 LYS A 128 -15.699 14.746 -8.841 1.00 2.47 H new ATOM 0 HZ3 LYS A 128 -16.853 15.861 -8.285 1.00 2.47 H new ATOM 1941 N VAL A 129 -10.903 16.673 -3.809 1.00 0.60 N ATOM 1942 CA VAL A 129 -10.270 17.416 -2.675 1.00 0.53 C ATOM 1943 C VAL A 129 -8.743 17.223 -2.743 1.00 0.53 C ATOM 1944 O VAL A 129 -8.211 16.388 -2.040 1.00 0.56 O ATOM 1945 CB VAL A 129 -10.789 16.843 -1.356 1.00 0.57 C ATOM 1946 CG1 VAL A 129 -10.281 17.690 -0.190 1.00 1.40 C ATOM 1947 CG2 VAL A 129 -12.319 16.846 -1.366 1.00 1.22 C ATOM 0 H VAL A 129 -10.510 15.750 -3.994 1.00 0.60 H new ATOM 0 HA VAL A 129 -10.513 18.477 -2.740 1.00 0.53 H new ATOM 0 HB VAL A 129 -10.429 15.821 -1.239 1.00 0.57 H new ATOM 0 HG11 VAL A 129 -10.653 17.278 0.748 1.00 1.40 H new ATOM 0 HG12 VAL A 129 -9.191 17.682 -0.183 1.00 1.40 H new ATOM 0 HG13 VAL A 129 -10.636 18.714 -0.303 1.00 1.40 H new ATOM 0 HG21 VAL A 129 -12.690 16.438 -0.426 1.00 1.22 H new ATOM 0 HG22 VAL A 129 -12.680 17.868 -1.485 1.00 1.22 H new ATOM 0 HG23 VAL A 129 -12.679 16.235 -2.194 1.00 1.22 H new ATOM 1957 N PRO A 130 -8.073 17.979 -3.594 1.00 0.62 N ATOM 1958 CA PRO A 130 -6.610 17.854 -3.742 1.00 0.73 C ATOM 1959 C PRO A 130 -5.913 18.123 -2.403 1.00 0.65 C ATOM 1960 O PRO A 130 -4.753 17.801 -2.223 1.00 0.64 O ATOM 1961 CB PRO A 130 -6.217 18.873 -4.831 1.00 1.00 C ATOM 1962 CG PRO A 130 -7.524 19.593 -5.282 1.00 1.00 C ATOM 1963 CD PRO A 130 -8.694 19.005 -4.460 1.00 0.75 C ATOM 0 HA PRO A 130 -6.302 16.850 -4.034 1.00 0.73 H new ATOM 0 HB2 PRO A 130 -5.496 19.592 -4.443 1.00 1.00 H new ATOM 0 HB3 PRO A 130 -5.744 18.371 -5.675 1.00 1.00 H new ATOM 0 HG2 PRO A 130 -7.444 20.668 -5.118 1.00 1.00 H new ATOM 0 HG3 PRO A 130 -7.694 19.445 -6.348 1.00 1.00 H new ATOM 0 HD2 PRO A 130 -9.187 19.776 -3.868 1.00 0.75 H new ATOM 0 HD3 PRO A 130 -9.452 18.568 -5.109 1.00 0.75 H new ATOM 1971 N GLU A 131 -6.615 18.652 -1.450 1.00 0.73 N ATOM 1972 CA GLU A 131 -5.999 18.876 -0.120 1.00 0.82 C ATOM 1973 C GLU A 131 -5.868 17.538 0.606 1.00 0.72 C ATOM 1974 O GLU A 131 -4.961 17.305 1.383 1.00 0.73 O ATOM 1975 CB GLU A 131 -6.925 19.774 0.723 1.00 1.09 C ATOM 1976 CG GLU A 131 -6.149 20.251 1.968 1.00 1.55 C ATOM 1977 CD GLU A 131 -7.008 21.210 2.789 1.00 2.17 C ATOM 1978 OE1 GLU A 131 -7.715 22.002 2.190 1.00 2.86 O ATOM 1979 OE2 GLU A 131 -6.936 21.142 4.005 1.00 2.52 O ATOM 0 H GLU A 131 -7.590 18.940 -1.533 1.00 0.73 H new ATOM 0 HA GLU A 131 -5.022 19.342 -0.251 1.00 0.82 H new ATOM 0 HB2 GLU A 131 -7.260 20.629 0.136 1.00 1.09 H new ATOM 0 HB3 GLU A 131 -7.817 19.223 1.021 1.00 1.09 H new ATOM 0 HG2 GLU A 131 -5.863 19.394 2.578 1.00 1.55 H new ATOM 0 HG3 GLU A 131 -5.227 20.747 1.663 1.00 1.55 H new ATOM 1986 N LEU A 132 -6.804 16.654 0.345 1.00 0.71 N ATOM 1987 CA LEU A 132 -6.813 15.314 0.991 1.00 0.69 C ATOM 1988 C LEU A 132 -5.944 14.331 0.200 1.00 0.58 C ATOM 1989 O LEU A 132 -5.225 13.540 0.777 1.00 0.59 O ATOM 1990 CB LEU A 132 -8.262 14.807 1.048 1.00 0.80 C ATOM 1991 CG LEU A 132 -8.361 13.548 1.922 1.00 0.60 C ATOM 1992 CD1 LEU A 132 -8.145 13.897 3.407 1.00 1.11 C ATOM 1993 CD2 LEU A 132 -9.752 12.927 1.745 1.00 0.77 C ATOM 0 H LEU A 132 -7.575 16.815 -0.303 1.00 0.71 H new ATOM 0 HA LEU A 132 -6.405 15.392 1.999 1.00 0.69 H new ATOM 0 HB2 LEU A 132 -8.910 15.586 1.449 1.00 0.80 H new ATOM 0 HB3 LEU A 132 -8.615 14.586 0.041 1.00 0.80 H new ATOM 0 HG LEU A 132 -7.589 12.843 1.615 1.00 0.60 H new ATOM 0 HD11 LEU A 132 -8.219 12.991 4.008 1.00 1.11 H new ATOM 0 HD12 LEU A 132 -7.157 14.339 3.537 1.00 1.11 H new ATOM 0 HD13 LEU A 132 -8.906 14.609 3.728 1.00 1.11 H new ATOM 0 HD21 LEU A 132 -9.832 12.032 2.362 1.00 0.77 H new ATOM 0 HD22 LEU A 132 -10.513 13.646 2.048 1.00 0.77 H new ATOM 0 HD23 LEU A 132 -9.901 12.661 0.699 1.00 0.77 H new ATOM 2005 N ILE A 133 -5.996 14.354 -1.106 1.00 0.52 N ATOM 2006 CA ILE A 133 -5.153 13.397 -1.888 1.00 0.46 C ATOM 2007 C ILE A 133 -3.704 13.523 -1.410 1.00 0.43 C ATOM 2008 O ILE A 133 -3.046 12.543 -1.123 1.00 0.46 O ATOM 2009 CB ILE A 133 -5.255 13.724 -3.384 1.00 0.45 C ATOM 2010 CG1 ILE A 133 -6.731 13.759 -3.791 1.00 0.42 C ATOM 2011 CG2 ILE A 133 -4.522 12.671 -4.217 1.00 0.49 C ATOM 2012 CD1 ILE A 133 -6.851 14.100 -5.278 1.00 1.19 C ATOM 0 H ILE A 133 -6.576 14.984 -1.660 1.00 0.52 H new ATOM 0 HA ILE A 133 -5.499 12.375 -1.735 1.00 0.46 H new ATOM 0 HB ILE A 133 -4.793 14.694 -3.566 1.00 0.45 H new ATOM 0 HG12 ILE A 133 -7.196 12.793 -3.591 1.00 0.42 H new ATOM 0 HG13 ILE A 133 -7.265 14.499 -3.195 1.00 0.42 H new ATOM 0 HG21 ILE A 133 -4.606 12.921 -5.275 1.00 0.49 H new ATOM 0 HG22 ILE A 133 -3.470 12.649 -3.932 1.00 0.49 H new ATOM 0 HG23 ILE A 133 -4.967 11.692 -4.039 1.00 0.49 H new ATOM 0 HD11 ILE A 133 -7.903 14.124 -5.562 1.00 1.19 H new ATOM 0 HD12 ILE A 133 -6.403 15.076 -5.465 1.00 1.19 H new ATOM 0 HD13 ILE A 133 -6.333 13.344 -5.868 1.00 1.19 H new ATOM 2024 N ARG A 134 -3.207 14.724 -1.314 1.00 0.42 N ATOM 2025 CA ARG A 134 -1.805 14.916 -0.840 1.00 0.43 C ATOM 2026 C ARG A 134 -1.681 14.456 0.619 1.00 0.40 C ATOM 2027 O ARG A 134 -0.701 13.849 1.003 1.00 0.39 O ATOM 2028 CB ARG A 134 -1.444 16.403 -0.925 1.00 0.51 C ATOM 2029 CG ARG A 134 0.066 16.590 -0.694 1.00 1.26 C ATOM 2030 CD ARG A 134 0.348 18.023 -0.233 1.00 1.57 C ATOM 2031 NE ARG A 134 1.815 18.196 -0.033 1.00 2.30 N ATOM 2032 CZ ARG A 134 2.321 19.391 0.103 1.00 2.86 C ATOM 2033 NH1 ARG A 134 1.541 20.437 0.080 1.00 2.98 N ATOM 2034 NH2 ARG A 134 3.607 19.539 0.266 1.00 3.71 N ATOM 0 H ARG A 134 -3.709 15.582 -1.543 1.00 0.42 H new ATOM 0 HA ARG A 134 -1.131 14.330 -1.465 1.00 0.43 H new ATOM 0 HB2 ARG A 134 -1.723 16.799 -1.902 1.00 0.51 H new ATOM 0 HB3 ARG A 134 -2.007 16.966 -0.180 1.00 0.51 H new ATOM 0 HG2 ARG A 134 0.419 15.881 0.055 1.00 1.26 H new ATOM 0 HG3 ARG A 134 0.612 16.380 -1.614 1.00 1.26 H new ATOM 0 HD2 ARG A 134 -0.016 18.734 -0.975 1.00 1.57 H new ATOM 0 HD3 ARG A 134 -0.184 18.230 0.695 1.00 1.57 H new ATOM 0 HE ARG A 134 2.424 17.379 -0.002 1.00 2.30 H new ATOM 0 HH11 ARG A 134 0.535 20.321 -0.044 1.00 2.98 H new ATOM 0 HH12 ARG A 134 1.937 21.371 0.186 1.00 2.98 H new ATOM 0 HH21 ARG A 134 4.216 18.721 0.287 1.00 3.71 H new ATOM 0 HH22 ARG A 134 4.003 20.473 0.372 1.00 3.71 H new ATOM 2048 N THR A 135 -2.652 14.755 1.436 1.00 0.41 N ATOM 2049 CA THR A 135 -2.566 14.351 2.870 1.00 0.41 C ATOM 2050 C THR A 135 -2.591 12.827 3.024 1.00 0.39 C ATOM 2051 O THR A 135 -2.017 12.277 3.942 1.00 0.52 O ATOM 2052 CB THR A 135 -3.733 14.954 3.652 1.00 0.42 C ATOM 2053 OG1 THR A 135 -3.627 16.370 3.634 1.00 0.89 O ATOM 2054 CG2 THR A 135 -3.704 14.460 5.102 1.00 0.88 C ATOM 0 H THR A 135 -3.499 15.260 1.176 1.00 0.41 H new ATOM 0 HA THR A 135 -1.620 14.723 3.264 1.00 0.41 H new ATOM 0 HB THR A 135 -4.671 14.647 3.190 1.00 0.42 H new ATOM 0 HG1 THR A 135 -4.090 16.723 2.846 1.00 0.89 H new ATOM 0 HG21 THR A 135 -4.539 14.895 5.651 1.00 0.88 H new ATOM 0 HG22 THR A 135 -3.786 13.373 5.118 1.00 0.88 H new ATOM 0 HG23 THR A 135 -2.766 14.760 5.570 1.00 0.88 H new ATOM 2062 N ILE A 136 -3.233 12.133 2.118 1.00 0.35 N ATOM 2063 CA ILE A 136 -3.274 10.646 2.211 1.00 0.36 C ATOM 2064 C ILE A 136 -1.890 10.099 1.854 1.00 0.35 C ATOM 2065 O ILE A 136 -1.241 9.470 2.667 1.00 0.51 O ATOM 2066 CB ILE A 136 -4.350 10.106 1.252 1.00 0.46 C ATOM 2067 CG1 ILE A 136 -5.739 10.416 1.837 1.00 0.60 C ATOM 2068 CG2 ILE A 136 -4.197 8.590 1.084 1.00 0.94 C ATOM 2069 CD1 ILE A 136 -6.808 10.308 0.747 1.00 0.64 C ATOM 0 H ILE A 136 -3.728 12.533 1.321 1.00 0.35 H new ATOM 0 HA ILE A 136 -3.530 10.328 3.222 1.00 0.36 H new ATOM 0 HB ILE A 136 -4.237 10.582 0.278 1.00 0.46 H new ATOM 0 HG12 ILE A 136 -5.964 9.722 2.647 1.00 0.60 H new ATOM 0 HG13 ILE A 136 -5.746 11.418 2.265 1.00 0.60 H new ATOM 0 HG21 ILE A 136 -4.964 8.220 0.403 1.00 0.94 H new ATOM 0 HG22 ILE A 136 -3.211 8.367 0.676 1.00 0.94 H new ATOM 0 HG23 ILE A 136 -4.307 8.104 2.053 1.00 0.94 H new ATOM 0 HD11 ILE A 136 -7.786 10.530 1.174 1.00 0.64 H new ATOM 0 HD12 ILE A 136 -6.589 11.020 -0.049 1.00 0.64 H new ATOM 0 HD13 ILE A 136 -6.811 9.297 0.339 1.00 0.64 H new ATOM 2081 N MET A 137 -1.435 10.300 0.646 1.00 0.35 N ATOM 2082 CA MET A 137 -0.095 9.767 0.259 1.00 0.33 C ATOM 2083 C MET A 137 0.932 10.122 1.337 1.00 0.31 C ATOM 2084 O MET A 137 1.967 9.502 1.472 1.00 0.34 O ATOM 2085 CB MET A 137 0.322 10.371 -1.090 1.00 0.36 C ATOM 2086 CG MET A 137 -0.805 10.171 -2.138 1.00 0.67 C ATOM 2087 SD MET A 137 -0.180 9.234 -3.561 1.00 1.13 S ATOM 2088 CE MET A 137 1.009 10.461 -4.164 1.00 0.67 C ATOM 0 H MET A 137 -1.930 10.808 -0.087 1.00 0.35 H new ATOM 0 HA MET A 137 -0.145 8.682 0.165 1.00 0.33 H new ATOM 0 HB2 MET A 137 0.534 11.434 -0.971 1.00 0.36 H new ATOM 0 HB3 MET A 137 1.241 9.900 -1.439 1.00 0.36 H new ATOM 0 HG2 MET A 137 -1.643 9.642 -1.685 1.00 0.67 H new ATOM 0 HG3 MET A 137 -1.181 11.140 -2.468 1.00 0.67 H new ATOM 0 HE1 MET A 137 1.192 10.299 -5.226 1.00 0.67 H new ATOM 0 HE2 MET A 137 0.606 11.463 -4.014 1.00 0.67 H new ATOM 0 HE3 MET A 137 1.945 10.361 -3.615 1.00 0.67 H new ATOM 2098 N GLY A 138 0.629 11.132 2.102 1.00 0.31 N ATOM 2099 CA GLY A 138 1.542 11.576 3.194 1.00 0.33 C ATOM 2100 C GLY A 138 1.514 10.543 4.324 1.00 0.33 C ATOM 2101 O GLY A 138 2.537 10.161 4.858 1.00 0.34 O ATOM 0 H GLY A 138 -0.228 11.679 2.016 1.00 0.31 H new ATOM 0 HA2 GLY A 138 2.557 11.688 2.813 1.00 0.33 H new ATOM 0 HA3 GLY A 138 1.233 12.552 3.569 1.00 0.33 H new ATOM 2105 N TRP A 139 0.346 10.091 4.691 1.00 0.34 N ATOM 2106 CA TRP A 139 0.245 9.083 5.783 1.00 0.37 C ATOM 2107 C TRP A 139 0.732 7.716 5.291 1.00 0.35 C ATOM 2108 O TRP A 139 1.080 6.854 6.073 1.00 0.39 O ATOM 2109 CB TRP A 139 -1.204 8.980 6.268 1.00 0.43 C ATOM 2110 CG TRP A 139 -1.688 10.313 6.767 1.00 0.46 C ATOM 2111 CD1 TRP A 139 -0.905 11.348 7.170 1.00 0.54 C ATOM 2112 CD2 TRP A 139 -3.065 10.766 6.926 1.00 0.53 C ATOM 2113 NE1 TRP A 139 -1.715 12.396 7.563 1.00 0.57 N ATOM 2114 CE2 TRP A 139 -3.052 12.087 7.431 1.00 0.56 C ATOM 2115 CE3 TRP A 139 -4.312 10.163 6.683 1.00 0.67 C ATOM 2116 CZ2 TRP A 139 -4.232 12.785 7.686 1.00 0.66 C ATOM 2117 CZ3 TRP A 139 -5.503 10.863 6.938 1.00 0.81 C ATOM 2118 CH2 TRP A 139 -5.462 12.172 7.439 1.00 0.78 C ATOM 0 H TRP A 139 -0.543 10.377 4.281 1.00 0.34 H new ATOM 0 HA TRP A 139 0.876 9.401 6.613 1.00 0.37 H new ATOM 0 HB2 TRP A 139 -1.842 8.636 5.454 1.00 0.43 H new ATOM 0 HB3 TRP A 139 -1.275 8.239 7.064 1.00 0.43 H new ATOM 0 HD1 TRP A 139 0.175 11.351 7.181 1.00 0.54 H new ATOM 0 HE1 TRP A 139 -1.366 13.290 7.909 1.00 0.57 H new ATOM 0 HE3 TRP A 139 -4.354 9.155 6.298 1.00 0.67 H new ATOM 0 HZ2 TRP A 139 -4.195 13.793 8.072 1.00 0.66 H new ATOM 0 HZ3 TRP A 139 -6.455 10.390 6.747 1.00 0.81 H new ATOM 0 HH2 TRP A 139 -6.381 12.705 7.634 1.00 0.78 H new ATOM 2129 N THR A 140 0.763 7.505 4.001 1.00 0.34 N ATOM 2130 CA THR A 140 1.234 6.189 3.476 1.00 0.36 C ATOM 2131 C THR A 140 2.750 6.081 3.676 1.00 0.34 C ATOM 2132 O THR A 140 3.229 5.238 4.408 1.00 0.39 O ATOM 2133 CB THR A 140 0.898 6.081 1.986 1.00 0.38 C ATOM 2134 OG1 THR A 140 1.455 7.189 1.294 1.00 1.20 O ATOM 2135 CG2 THR A 140 -0.620 6.073 1.803 1.00 1.17 C ATOM 0 H THR A 140 0.484 8.183 3.292 1.00 0.34 H new ATOM 0 HA THR A 140 0.738 5.380 4.012 1.00 0.36 H new ATOM 0 HB THR A 140 1.315 5.157 1.586 1.00 0.38 H new ATOM 0 HG1 THR A 140 1.601 7.927 1.922 1.00 1.20 H new ATOM 0 HG21 THR A 140 -0.858 5.996 0.742 1.00 1.17 H new ATOM 0 HG22 THR A 140 -1.046 5.221 2.333 1.00 1.17 H new ATOM 0 HG23 THR A 140 -1.040 6.996 2.203 1.00 1.17 H new ATOM 2143 N LEU A 141 3.505 6.939 3.043 1.00 0.33 N ATOM 2144 CA LEU A 141 4.990 6.903 3.210 1.00 0.34 C ATOM 2145 C LEU A 141 5.348 7.019 4.694 1.00 0.33 C ATOM 2146 O LEU A 141 6.394 6.576 5.115 1.00 0.33 O ATOM 2147 CB LEU A 141 5.633 8.056 2.437 1.00 0.35 C ATOM 2148 CG LEU A 141 5.229 7.993 0.959 1.00 0.41 C ATOM 2149 CD1 LEU A 141 5.639 9.296 0.268 1.00 0.99 C ATOM 2150 CD2 LEU A 141 5.920 6.807 0.273 1.00 0.80 C ATOM 0 H LEU A 141 3.158 7.665 2.416 1.00 0.33 H new ATOM 0 HA LEU A 141 5.366 5.957 2.820 1.00 0.34 H new ATOM 0 HB2 LEU A 141 5.323 9.009 2.866 1.00 0.35 H new ATOM 0 HB3 LEU A 141 6.718 8.004 2.528 1.00 0.35 H new ATOM 0 HG LEU A 141 4.149 7.862 0.887 1.00 0.41 H new ATOM 0 HD11 LEU A 141 5.354 9.256 -0.783 1.00 0.99 H new ATOM 0 HD12 LEU A 141 5.137 10.136 0.748 1.00 0.99 H new ATOM 0 HD13 LEU A 141 6.718 9.425 0.346 1.00 0.99 H new ATOM 0 HD21 LEU A 141 5.626 6.772 -0.776 1.00 0.80 H new ATOM 0 HD22 LEU A 141 7.001 6.926 0.343 1.00 0.80 H new ATOM 0 HD23 LEU A 141 5.624 5.880 0.764 1.00 0.80 H new ATOM 2162 N ASP A 142 4.487 7.579 5.494 1.00 0.36 N ATOM 2163 CA ASP A 142 4.784 7.684 6.953 1.00 0.37 C ATOM 2164 C ASP A 142 4.693 6.297 7.584 1.00 0.37 C ATOM 2165 O ASP A 142 5.469 5.933 8.429 1.00 0.42 O ATOM 2166 CB ASP A 142 3.742 8.590 7.609 1.00 0.37 C ATOM 2167 CG ASP A 142 3.940 10.029 7.121 1.00 0.78 C ATOM 2168 OD1 ASP A 142 5.022 10.327 6.641 1.00 1.59 O ATOM 2169 OD2 ASP A 142 3.009 10.808 7.239 1.00 1.32 O ATOM 0 H ASP A 142 3.590 7.969 5.204 1.00 0.36 H new ATOM 0 HA ASP A 142 5.783 8.095 7.096 1.00 0.37 H new ATOM 0 HB2 ASP A 142 2.738 8.246 7.363 1.00 0.37 H new ATOM 0 HB3 ASP A 142 3.837 8.546 8.694 1.00 0.37 H new ATOM 2174 N PHE A 143 3.727 5.523 7.176 1.00 0.41 N ATOM 2175 CA PHE A 143 3.557 4.157 7.747 1.00 0.43 C ATOM 2176 C PHE A 143 4.552 3.188 7.101 1.00 0.43 C ATOM 2177 O PHE A 143 5.038 2.278 7.743 1.00 0.45 O ATOM 2178 CB PHE A 143 2.124 3.684 7.481 1.00 0.44 C ATOM 2179 CG PHE A 143 1.831 2.441 8.288 1.00 0.47 C ATOM 2180 CD1 PHE A 143 2.089 1.177 7.744 1.00 1.16 C ATOM 2181 CD2 PHE A 143 1.293 2.551 9.576 1.00 1.29 C ATOM 2182 CE1 PHE A 143 1.810 0.024 8.487 1.00 1.22 C ATOM 2183 CE2 PHE A 143 1.015 1.398 10.320 1.00 1.35 C ATOM 2184 CZ PHE A 143 1.273 0.135 9.776 1.00 0.72 C ATOM 0 H PHE A 143 3.042 5.780 6.465 1.00 0.41 H new ATOM 0 HA PHE A 143 3.745 4.184 8.820 1.00 0.43 H new ATOM 0 HB2 PHE A 143 1.418 4.472 7.743 1.00 0.44 H new ATOM 0 HB3 PHE A 143 1.992 3.477 6.419 1.00 0.44 H new ATOM 0 HD1 PHE A 143 2.504 1.092 6.750 1.00 1.16 H new ATOM 0 HD2 PHE A 143 1.092 3.526 9.996 1.00 1.29 H new ATOM 0 HE1 PHE A 143 2.009 -0.951 8.067 1.00 1.22 H new ATOM 0 HE2 PHE A 143 0.601 1.484 11.314 1.00 1.35 H new ATOM 0 HZ PHE A 143 1.058 -0.754 10.350 1.00 0.72 H new ATOM 2194 N LEU A 144 4.851 3.347 5.839 1.00 0.45 N ATOM 2195 CA LEU A 144 5.806 2.401 5.184 1.00 0.47 C ATOM 2196 C LEU A 144 7.236 2.738 5.639 1.00 0.47 C ATOM 2197 O LEU A 144 7.991 1.867 6.026 1.00 0.49 O ATOM 2198 CB LEU A 144 5.624 2.498 3.640 1.00 0.49 C ATOM 2199 CG LEU A 144 6.970 2.492 2.859 1.00 0.64 C ATOM 2200 CD1 LEU A 144 7.495 1.063 2.710 1.00 1.31 C ATOM 2201 CD2 LEU A 144 6.756 3.097 1.471 1.00 1.01 C ATOM 0 H LEU A 144 4.481 4.083 5.237 1.00 0.45 H new ATOM 0 HA LEU A 144 5.609 1.369 5.475 1.00 0.47 H new ATOM 0 HB2 LEU A 144 5.011 1.663 3.300 1.00 0.49 H new ATOM 0 HB3 LEU A 144 5.078 3.411 3.402 1.00 0.49 H new ATOM 0 HG LEU A 144 7.700 3.082 3.414 1.00 0.64 H new ATOM 0 HD11 LEU A 144 8.437 1.077 2.162 1.00 1.31 H new ATOM 0 HD12 LEU A 144 7.656 0.630 3.697 1.00 1.31 H new ATOM 0 HD13 LEU A 144 6.767 0.463 2.165 1.00 1.31 H new ATOM 0 HD21 LEU A 144 7.698 3.093 0.923 1.00 1.01 H new ATOM 0 HD22 LEU A 144 6.018 2.508 0.927 1.00 1.01 H new ATOM 0 HD23 LEU A 144 6.399 4.122 1.572 1.00 1.01 H new ATOM 2213 N ARG A 145 7.621 3.975 5.569 1.00 0.47 N ATOM 2214 CA ARG A 145 9.004 4.354 5.976 1.00 0.48 C ATOM 2215 C ARG A 145 9.203 4.143 7.484 1.00 0.49 C ATOM 2216 O ARG A 145 10.306 3.920 7.941 1.00 0.50 O ATOM 2217 CB ARG A 145 9.261 5.817 5.597 1.00 0.49 C ATOM 2218 CG ARG A 145 8.633 6.770 6.638 1.00 0.69 C ATOM 2219 CD ARG A 145 9.596 7.026 7.823 1.00 0.68 C ATOM 2220 NE ARG A 145 9.743 8.496 8.012 1.00 1.56 N ATOM 2221 CZ ARG A 145 10.256 8.962 9.116 1.00 2.10 C ATOM 2222 NH1 ARG A 145 10.651 8.141 10.050 1.00 2.12 N ATOM 2223 NH2 ARG A 145 10.376 10.250 9.285 1.00 3.16 N ATOM 0 H ARG A 145 7.038 4.747 5.246 1.00 0.47 H new ATOM 0 HA ARG A 145 9.718 3.717 5.453 1.00 0.48 H new ATOM 0 HB2 ARG A 145 10.334 5.998 5.532 1.00 0.49 H new ATOM 0 HB3 ARG A 145 8.843 6.021 4.611 1.00 0.49 H new ATOM 0 HG2 ARG A 145 8.381 7.717 6.161 1.00 0.69 H new ATOM 0 HG3 ARG A 145 7.702 6.342 7.010 1.00 0.69 H new ATOM 0 HD2 ARG A 145 9.208 6.566 8.731 1.00 0.68 H new ATOM 0 HD3 ARG A 145 10.567 6.572 7.625 1.00 0.68 H new ATOM 0 HE ARG A 145 9.443 9.138 7.278 1.00 1.56 H new ATOM 0 HH11 ARG A 145 10.558 7.134 9.916 1.00 2.12 H new ATOM 0 HH12 ARG A 145 11.052 8.506 10.914 1.00 2.12 H new ATOM 0 HH21 ARG A 145 10.069 10.891 8.554 1.00 3.16 H new ATOM 0 HH22 ARG A 145 10.777 10.616 10.148 1.00 3.16 H new ATOM 2237 N GLU A 146 8.168 4.269 8.268 1.00 0.49 N ATOM 2238 CA GLU A 146 8.339 4.130 9.751 1.00 0.51 C ATOM 2239 C GLU A 146 8.230 2.663 10.195 1.00 0.53 C ATOM 2240 O GLU A 146 8.915 2.262 11.117 1.00 0.55 O ATOM 2241 CB GLU A 146 7.268 4.976 10.452 1.00 0.52 C ATOM 2242 CG GLU A 146 7.718 5.348 11.860 1.00 0.96 C ATOM 2243 CD GLU A 146 6.535 5.931 12.638 1.00 1.48 C ATOM 2244 OE1 GLU A 146 5.745 5.153 13.148 1.00 2.22 O ATOM 2245 OE2 GLU A 146 6.440 7.145 12.711 1.00 2.03 O ATOM 0 H GLU A 146 7.217 4.461 7.954 1.00 0.49 H new ATOM 0 HA GLU A 146 9.334 4.480 10.025 1.00 0.51 H new ATOM 0 HB2 GLU A 146 7.075 5.880 9.875 1.00 0.52 H new ATOM 0 HB3 GLU A 146 6.331 4.421 10.498 1.00 0.52 H new ATOM 0 HG2 GLU A 146 8.106 4.468 12.373 1.00 0.96 H new ATOM 0 HG3 GLU A 146 8.530 6.074 11.814 1.00 0.96 H new ATOM 2252 N ARG A 147 7.354 1.873 9.617 1.00 0.59 N ATOM 2253 CA ARG A 147 7.199 0.452 10.101 1.00 0.62 C ATOM 2254 C ARG A 147 7.680 -0.577 9.064 1.00 0.58 C ATOM 2255 O ARG A 147 8.364 -1.527 9.385 1.00 0.62 O ATOM 2256 CB ARG A 147 5.717 0.211 10.401 1.00 0.63 C ATOM 2257 CG ARG A 147 5.571 -0.974 11.361 1.00 0.73 C ATOM 2258 CD ARG A 147 4.083 -1.332 11.539 1.00 1.11 C ATOM 2259 NE ARG A 147 3.815 -1.695 12.967 1.00 1.75 N ATOM 2260 CZ ARG A 147 4.598 -2.517 13.616 1.00 2.40 C ATOM 2261 NH1 ARG A 147 5.568 -3.134 13.001 1.00 2.71 N ATOM 2262 NH2 ARG A 147 4.381 -2.752 14.882 1.00 3.30 N ATOM 0 H ARG A 147 6.746 2.140 8.843 1.00 0.59 H new ATOM 0 HA ARG A 147 7.815 0.324 10.991 1.00 0.62 H new ATOM 0 HB2 ARG A 147 5.275 1.105 10.841 1.00 0.63 H new ATOM 0 HB3 ARG A 147 5.177 0.011 9.476 1.00 0.63 H new ATOM 0 HG2 ARG A 147 6.116 -1.835 10.974 1.00 0.73 H new ATOM 0 HG3 ARG A 147 6.011 -0.726 12.327 1.00 0.73 H new ATOM 0 HD2 ARG A 147 3.459 -0.488 11.246 1.00 1.11 H new ATOM 0 HD3 ARG A 147 3.820 -2.165 10.887 1.00 1.11 H new ATOM 0 HE ARG A 147 3.007 -1.294 13.442 1.00 1.75 H new ATOM 0 HH11 ARG A 147 5.722 -2.977 12.005 1.00 2.71 H new ATOM 0 HH12 ARG A 147 6.173 -3.773 13.516 1.00 2.71 H new ATOM 0 HH21 ARG A 147 3.604 -2.295 15.360 1.00 3.30 H new ATOM 0 HH22 ARG A 147 4.988 -3.392 15.393 1.00 3.30 H new ATOM 2276 N LEU A 148 7.283 -0.412 7.837 1.00 0.53 N ATOM 2277 CA LEU A 148 7.652 -1.386 6.764 1.00 0.57 C ATOM 2278 C LEU A 148 8.966 -1.010 6.071 1.00 0.67 C ATOM 2279 O LEU A 148 9.099 -1.185 4.877 1.00 1.61 O ATOM 2280 CB LEU A 148 6.529 -1.388 5.716 1.00 0.59 C ATOM 2281 CG LEU A 148 5.165 -1.394 6.417 1.00 0.70 C ATOM 2282 CD1 LEU A 148 4.057 -1.496 5.367 1.00 1.29 C ATOM 2283 CD2 LEU A 148 5.076 -2.595 7.367 1.00 1.34 C ATOM 0 H LEU A 148 6.708 0.369 7.522 1.00 0.53 H new ATOM 0 HA LEU A 148 7.784 -2.367 7.221 1.00 0.57 H new ATOM 0 HB2 LEU A 148 6.615 -0.510 5.075 1.00 0.59 H new ATOM 0 HB3 LEU A 148 6.621 -2.263 5.072 1.00 0.59 H new ATOM 0 HG LEU A 148 5.048 -0.473 6.988 1.00 0.70 H new ATOM 0 HD11 LEU A 148 3.086 -1.501 5.862 1.00 1.29 H new ATOM 0 HD12 LEU A 148 4.116 -0.642 4.692 1.00 1.29 H new ATOM 0 HD13 LEU A 148 4.179 -2.418 4.798 1.00 1.29 H new ATOM 0 HD21 LEU A 148 4.105 -2.595 7.863 1.00 1.34 H new ATOM 0 HD22 LEU A 148 5.194 -3.518 6.799 1.00 1.34 H new ATOM 0 HD23 LEU A 148 5.866 -2.526 8.115 1.00 1.34 H new ATOM 2295 N LEU A 149 9.930 -0.481 6.785 1.00 0.67 N ATOM 2296 CA LEU A 149 11.226 -0.089 6.132 1.00 0.57 C ATOM 2297 C LEU A 149 12.340 -1.049 6.555 1.00 0.56 C ATOM 2298 O LEU A 149 12.994 -1.650 5.727 1.00 0.58 O ATOM 2299 CB LEU A 149 11.590 1.336 6.549 1.00 0.54 C ATOM 2300 CG LEU A 149 12.772 1.858 5.717 1.00 0.59 C ATOM 2301 CD1 LEU A 149 12.376 2.005 4.236 1.00 0.83 C ATOM 2302 CD2 LEU A 149 13.203 3.220 6.276 1.00 1.21 C ATOM 0 H LEU A 149 9.879 -0.303 7.788 1.00 0.67 H new ATOM 0 HA LEU A 149 11.112 -0.137 5.049 1.00 0.57 H new ATOM 0 HB2 LEU A 149 10.728 1.991 6.417 1.00 0.54 H new ATOM 0 HB3 LEU A 149 11.847 1.356 7.608 1.00 0.54 H new ATOM 0 HG LEU A 149 13.596 1.147 5.779 1.00 0.59 H new ATOM 0 HD11 LEU A 149 13.228 2.376 3.667 1.00 0.83 H new ATOM 0 HD12 LEU A 149 12.071 1.035 3.843 1.00 0.83 H new ATOM 0 HD13 LEU A 149 11.548 2.708 4.149 1.00 0.83 H new ATOM 0 HD21 LEU A 149 14.042 3.603 5.695 1.00 1.21 H new ATOM 0 HD22 LEU A 149 12.369 3.919 6.214 1.00 1.21 H new ATOM 0 HD23 LEU A 149 13.505 3.107 7.317 1.00 1.21 H new ATOM 2314 N GLY A 150 12.570 -1.196 7.825 1.00 0.56 N ATOM 2315 CA GLY A 150 13.652 -2.115 8.280 1.00 0.58 C ATOM 2316 C GLY A 150 13.364 -3.539 7.794 1.00 0.62 C ATOM 2317 O GLY A 150 14.263 -4.337 7.610 1.00 0.70 O ATOM 0 H GLY A 150 12.059 -0.722 8.570 1.00 0.56 H new ATOM 0 HA2 GLY A 150 14.614 -1.777 7.895 1.00 0.58 H new ATOM 0 HA3 GLY A 150 13.721 -2.099 9.368 1.00 0.58 H new ATOM 2321 N TRP A 151 12.115 -3.869 7.594 1.00 0.63 N ATOM 2322 CA TRP A 151 11.768 -5.247 7.136 1.00 0.69 C ATOM 2323 C TRP A 151 11.854 -5.345 5.608 1.00 0.70 C ATOM 2324 O TRP A 151 12.323 -6.331 5.074 1.00 0.72 O ATOM 2325 CB TRP A 151 10.340 -5.584 7.582 1.00 0.73 C ATOM 2326 CG TRP A 151 10.318 -5.848 9.054 1.00 1.25 C ATOM 2327 CD1 TRP A 151 10.308 -7.076 9.622 1.00 2.17 C ATOM 2328 CD2 TRP A 151 10.300 -4.890 10.151 1.00 1.86 C ATOM 2329 NE1 TRP A 151 10.285 -6.933 10.998 1.00 2.65 N ATOM 2330 CE2 TRP A 151 10.280 -5.604 11.373 1.00 2.43 C ATOM 2331 CE3 TRP A 151 10.299 -3.485 10.204 1.00 2.68 C ATOM 2332 CZ2 TRP A 151 10.259 -4.947 12.604 1.00 3.17 C ATOM 2333 CZ3 TRP A 151 10.279 -2.820 11.441 1.00 3.62 C ATOM 2334 CH2 TRP A 151 10.259 -3.550 12.638 1.00 3.67 C ATOM 0 H TRP A 151 11.320 -3.244 7.728 1.00 0.63 H new ATOM 0 HA TRP A 151 12.475 -5.951 7.575 1.00 0.69 H new ATOM 0 HB2 TRP A 151 9.670 -4.759 7.341 1.00 0.73 H new ATOM 0 HB3 TRP A 151 9.977 -6.458 7.041 1.00 0.73 H new ATOM 0 HD1 TRP A 151 10.317 -8.015 9.088 1.00 2.17 H new ATOM 0 HE1 TRP A 151 10.273 -7.713 11.655 1.00 2.65 H new ATOM 0 HE3 TRP A 151 10.314 -2.913 9.288 1.00 2.68 H new ATOM 0 HZ2 TRP A 151 10.243 -5.514 13.523 1.00 3.17 H new ATOM 0 HZ3 TRP A 151 10.279 -1.740 11.470 1.00 3.62 H new ATOM 0 HH2 TRP A 151 10.244 -3.033 13.586 1.00 3.67 H new ATOM 2345 N ILE A 152 11.400 -4.348 4.895 1.00 0.73 N ATOM 2346 CA ILE A 152 11.461 -4.436 3.407 1.00 0.76 C ATOM 2347 C ILE A 152 12.927 -4.472 2.972 1.00 0.79 C ATOM 2348 O ILE A 152 13.258 -4.920 1.893 1.00 0.89 O ATOM 2349 CB ILE A 152 10.741 -3.235 2.776 1.00 0.78 C ATOM 2350 CG1 ILE A 152 9.232 -3.369 3.036 1.00 0.83 C ATOM 2351 CG2 ILE A 152 11.004 -3.207 1.260 1.00 0.92 C ATOM 2352 CD1 ILE A 152 8.475 -2.180 2.428 1.00 0.94 C ATOM 0 H ILE A 152 10.996 -3.490 5.271 1.00 0.73 H new ATOM 0 HA ILE A 152 10.962 -5.345 3.071 1.00 0.76 H new ATOM 0 HB ILE A 152 11.113 -2.310 3.216 1.00 0.78 H new ATOM 0 HG12 ILE A 152 8.864 -4.301 2.606 1.00 0.83 H new ATOM 0 HG13 ILE A 152 9.044 -3.417 4.109 1.00 0.83 H new ATOM 0 HG21 ILE A 152 10.491 -2.353 0.817 1.00 0.92 H new ATOM 0 HG22 ILE A 152 12.075 -3.121 1.078 1.00 0.92 H new ATOM 0 HG23 ILE A 152 10.632 -4.127 0.809 1.00 0.92 H new ATOM 0 HD11 ILE A 152 7.408 -2.291 2.621 1.00 0.94 H new ATOM 0 HD12 ILE A 152 8.831 -1.253 2.878 1.00 0.94 H new ATOM 0 HD13 ILE A 152 8.648 -2.150 1.352 1.00 0.94 H new ATOM 2364 N GLN A 153 13.808 -3.985 3.805 1.00 0.77 N ATOM 2365 CA GLN A 153 15.255 -3.977 3.451 1.00 0.80 C ATOM 2366 C GLN A 153 15.845 -5.367 3.719 1.00 0.81 C ATOM 2367 O GLN A 153 16.633 -5.872 2.943 1.00 0.82 O ATOM 2368 CB GLN A 153 15.974 -2.906 4.293 1.00 0.82 C ATOM 2369 CG GLN A 153 17.173 -2.335 3.529 1.00 1.09 C ATOM 2370 CD GLN A 153 17.818 -1.224 4.361 1.00 1.98 C ATOM 2371 OE1 GLN A 153 18.726 -0.558 3.905 1.00 2.66 O ATOM 2372 NE2 GLN A 153 17.386 -0.994 5.571 1.00 2.77 N ATOM 0 H GLN A 153 13.585 -3.591 4.719 1.00 0.77 H new ATOM 0 HA GLN A 153 15.387 -3.739 2.396 1.00 0.80 H new ATOM 0 HB2 GLN A 153 15.279 -2.104 4.542 1.00 0.82 H new ATOM 0 HB3 GLN A 153 16.309 -3.341 5.235 1.00 0.82 H new ATOM 0 HG2 GLN A 153 17.899 -3.122 3.327 1.00 1.09 H new ATOM 0 HG3 GLN A 153 16.851 -1.943 2.564 1.00 1.09 H new ATOM 0 HE21 GLN A 153 16.624 -1.552 5.955 1.00 2.77 H new ATOM 0 HE22 GLN A 153 17.811 -0.256 6.132 1.00 2.77 H new ATOM 2381 N ASP A 154 15.488 -5.986 4.813 1.00 0.83 N ATOM 2382 CA ASP A 154 16.052 -7.335 5.114 1.00 0.86 C ATOM 2383 C ASP A 154 15.875 -8.248 3.893 1.00 0.85 C ATOM 2384 O ASP A 154 16.822 -8.820 3.390 1.00 0.94 O ATOM 2385 CB ASP A 154 15.326 -7.934 6.320 1.00 0.90 C ATOM 2386 CG ASP A 154 15.523 -7.026 7.536 1.00 1.28 C ATOM 2387 OD1 ASP A 154 16.581 -6.426 7.638 1.00 1.84 O ATOM 2388 OD2 ASP A 154 14.613 -6.946 8.345 1.00 1.99 O ATOM 0 H ASP A 154 14.836 -5.620 5.506 1.00 0.83 H new ATOM 0 HA ASP A 154 17.114 -7.244 5.343 1.00 0.86 H new ATOM 0 HB2 ASP A 154 14.264 -8.042 6.102 1.00 0.90 H new ATOM 0 HB3 ASP A 154 15.711 -8.932 6.531 1.00 0.90 H new ATOM 2393 N GLN A 155 14.668 -8.376 3.408 1.00 0.79 N ATOM 2394 CA GLN A 155 14.423 -9.236 2.215 1.00 0.79 C ATOM 2395 C GLN A 155 15.403 -8.860 1.102 1.00 0.72 C ATOM 2396 O GLN A 155 15.928 -9.710 0.411 1.00 1.03 O ATOM 2397 CB GLN A 155 12.984 -9.041 1.721 1.00 0.90 C ATOM 2398 CG GLN A 155 12.648 -7.553 1.636 1.00 1.37 C ATOM 2399 CD GLN A 155 11.200 -7.388 1.169 1.00 2.01 C ATOM 2400 OE1 GLN A 155 10.282 -7.464 1.961 1.00 2.72 O ATOM 2401 NE2 GLN A 155 10.956 -7.165 -0.094 1.00 2.54 N ATOM 0 H GLN A 155 13.839 -7.920 3.789 1.00 0.79 H new ATOM 0 HA GLN A 155 14.570 -10.281 2.489 1.00 0.79 H new ATOM 0 HB2 GLN A 155 12.863 -9.504 0.742 1.00 0.90 H new ATOM 0 HB3 GLN A 155 12.290 -9.539 2.398 1.00 0.90 H new ATOM 0 HG2 GLN A 155 12.784 -7.081 2.609 1.00 1.37 H new ATOM 0 HG3 GLN A 155 13.325 -7.054 0.942 1.00 1.37 H new ATOM 0 HE21 GLN A 155 11.727 -7.101 -0.759 1.00 2.54 H new ATOM 0 HE22 GLN A 155 9.994 -7.055 -0.416 1.00 2.54 H new ATOM 2410 N GLY A 156 15.651 -7.588 0.923 1.00 0.63 N ATOM 2411 CA GLY A 156 16.596 -7.137 -0.146 1.00 0.72 C ATOM 2412 C GLY A 156 16.025 -5.895 -0.829 1.00 0.87 C ATOM 2413 O GLY A 156 16.715 -4.920 -1.049 1.00 1.38 O ATOM 0 H GLY A 156 15.237 -6.836 1.475 1.00 0.63 H new ATOM 0 HA2 GLY A 156 17.572 -6.914 0.285 1.00 0.72 H new ATOM 0 HA3 GLY A 156 16.745 -7.933 -0.876 1.00 0.72 H new ATOM 2417 N GLY A 157 14.766 -5.929 -1.175 1.00 0.81 N ATOM 2418 CA GLY A 157 14.146 -4.754 -1.854 1.00 1.10 C ATOM 2419 C GLY A 157 12.798 -5.166 -2.453 1.00 0.84 C ATOM 2420 O GLY A 157 12.257 -6.208 -2.142 1.00 0.88 O ATOM 0 H GLY A 157 14.140 -6.719 -1.017 1.00 0.81 H new ATOM 0 HA2 GLY A 157 14.007 -3.940 -1.142 1.00 1.10 H new ATOM 0 HA3 GLY A 157 14.806 -4.383 -2.638 1.00 1.10 H new ATOM 2424 N TRP A 158 12.249 -4.340 -3.303 1.00 0.67 N ATOM 2425 CA TRP A 158 10.930 -4.658 -3.923 1.00 0.50 C ATOM 2426 C TRP A 158 11.032 -5.937 -4.759 1.00 0.51 C ATOM 2427 O TRP A 158 10.025 -6.488 -5.177 1.00 0.53 O ATOM 2428 CB TRP A 158 10.491 -3.502 -4.824 1.00 0.51 C ATOM 2429 CG TRP A 158 10.268 -2.272 -4.005 1.00 0.46 C ATOM 2430 CD1 TRP A 158 11.075 -1.186 -3.998 1.00 0.59 C ATOM 2431 CD2 TRP A 158 9.180 -1.980 -3.082 1.00 0.46 C ATOM 2432 NE1 TRP A 158 10.550 -0.246 -3.129 1.00 0.55 N ATOM 2433 CE2 TRP A 158 9.383 -0.689 -2.540 1.00 0.47 C ATOM 2434 CE3 TRP A 158 8.048 -2.704 -2.667 1.00 0.65 C ATOM 2435 CZ2 TRP A 158 8.493 -0.135 -1.619 1.00 0.58 C ATOM 2436 CZ3 TRP A 158 7.151 -2.150 -1.740 1.00 0.84 C ATOM 2437 CH2 TRP A 158 7.373 -0.868 -1.217 1.00 0.78 C ATOM 0 H TRP A 158 12.660 -3.454 -3.596 1.00 0.67 H new ATOM 0 HA TRP A 158 10.197 -4.805 -3.129 1.00 0.50 H new ATOM 0 HB2 TRP A 158 11.251 -3.312 -5.582 1.00 0.51 H new ATOM 0 HB3 TRP A 158 9.575 -3.769 -5.351 1.00 0.51 H new ATOM 0 HD1 TRP A 158 11.980 -1.072 -4.576 1.00 0.59 H new ATOM 0 HE1 TRP A 158 10.974 0.664 -2.946 1.00 0.55 H new ATOM 0 HE3 TRP A 158 7.868 -3.692 -3.064 1.00 0.65 H new ATOM 0 HZ2 TRP A 158 8.668 0.853 -1.220 1.00 0.58 H new ATOM 0 HZ3 TRP A 158 6.285 -2.715 -1.428 1.00 0.84 H new ATOM 0 HH2 TRP A 158 6.679 -0.447 -0.504 1.00 0.78 H new ATOM 2448 N ASP A 159 12.210 -6.428 -5.028 1.00 0.50 N ATOM 2449 CA ASP A 159 12.290 -7.663 -5.853 1.00 0.51 C ATOM 2450 C ASP A 159 11.653 -8.812 -5.069 1.00 0.51 C ATOM 2451 O ASP A 159 11.084 -9.726 -5.632 1.00 0.51 O ATOM 2452 CB ASP A 159 13.754 -7.980 -6.173 1.00 0.54 C ATOM 2453 CG ASP A 159 13.831 -9.209 -7.079 1.00 1.66 C ATOM 2454 OD1 ASP A 159 13.591 -10.299 -6.588 1.00 2.37 O ATOM 2455 OD2 ASP A 159 14.132 -9.039 -8.249 1.00 2.46 O ATOM 0 H ASP A 159 13.101 -6.038 -4.720 1.00 0.50 H new ATOM 0 HA ASP A 159 11.758 -7.523 -6.794 1.00 0.51 H new ATOM 0 HB2 ASP A 159 14.222 -7.126 -6.663 1.00 0.54 H new ATOM 0 HB3 ASP A 159 14.306 -8.161 -5.251 1.00 0.54 H new ATOM 2460 N GLY A 160 11.746 -8.763 -3.766 1.00 0.52 N ATOM 2461 CA GLY A 160 11.143 -9.839 -2.929 1.00 0.54 C ATOM 2462 C GLY A 160 9.635 -9.874 -3.178 1.00 0.53 C ATOM 2463 O GLY A 160 9.016 -10.920 -3.148 1.00 0.54 O ATOM 0 H GLY A 160 12.215 -8.022 -3.245 1.00 0.52 H new ATOM 0 HA2 GLY A 160 11.588 -10.803 -3.176 1.00 0.54 H new ATOM 0 HA3 GLY A 160 11.347 -9.655 -1.874 1.00 0.54 H new ATOM 2467 N LEU A 161 9.042 -8.745 -3.450 1.00 0.54 N ATOM 2468 CA LEU A 161 7.581 -8.722 -3.726 1.00 0.56 C ATOM 2469 C LEU A 161 7.301 -9.580 -4.957 1.00 0.56 C ATOM 2470 O LEU A 161 6.445 -10.442 -4.953 1.00 0.62 O ATOM 2471 CB LEU A 161 7.140 -7.255 -3.992 1.00 0.58 C ATOM 2472 CG LEU A 161 5.900 -6.905 -3.132 1.00 0.74 C ATOM 2473 CD1 LEU A 161 6.325 -6.630 -1.682 1.00 1.63 C ATOM 2474 CD2 LEU A 161 5.213 -5.661 -3.693 1.00 1.56 C ATOM 0 H LEU A 161 9.507 -7.838 -3.493 1.00 0.54 H new ATOM 0 HA LEU A 161 7.027 -9.116 -2.874 1.00 0.56 H new ATOM 0 HB2 LEU A 161 7.958 -6.574 -3.758 1.00 0.58 H new ATOM 0 HB3 LEU A 161 6.908 -7.123 -5.049 1.00 0.58 H new ATOM 0 HG LEU A 161 5.210 -7.749 -3.156 1.00 0.74 H new ATOM 0 HD11 LEU A 161 5.446 -6.385 -1.086 1.00 1.63 H new ATOM 0 HD12 LEU A 161 6.808 -7.516 -1.270 1.00 1.63 H new ATOM 0 HD13 LEU A 161 7.023 -5.793 -1.660 1.00 1.63 H new ATOM 0 HD21 LEU A 161 4.342 -5.420 -3.084 1.00 1.56 H new ATOM 0 HD22 LEU A 161 5.909 -4.823 -3.678 1.00 1.56 H new ATOM 0 HD23 LEU A 161 4.897 -5.851 -4.719 1.00 1.56 H new ATOM 2486 N LEU A 162 8.034 -9.346 -6.016 1.00 0.53 N ATOM 2487 CA LEU A 162 7.836 -10.144 -7.261 1.00 0.56 C ATOM 2488 C LEU A 162 8.337 -11.573 -7.017 1.00 0.55 C ATOM 2489 O LEU A 162 7.783 -12.524 -7.532 1.00 0.57 O ATOM 2490 CB LEU A 162 8.632 -9.491 -8.422 1.00 0.61 C ATOM 2491 CG LEU A 162 7.689 -8.817 -9.433 1.00 0.80 C ATOM 2492 CD1 LEU A 162 8.487 -7.838 -10.302 1.00 1.56 C ATOM 2493 CD2 LEU A 162 7.052 -9.879 -10.338 1.00 1.33 C ATOM 0 H LEU A 162 8.763 -8.634 -6.071 1.00 0.53 H new ATOM 0 HA LEU A 162 6.779 -10.170 -7.528 1.00 0.56 H new ATOM 0 HB2 LEU A 162 9.326 -8.753 -8.020 1.00 0.61 H new ATOM 0 HB3 LEU A 162 9.230 -10.249 -8.928 1.00 0.61 H new ATOM 0 HG LEU A 162 6.909 -8.283 -8.891 1.00 0.80 H new ATOM 0 HD11 LEU A 162 7.819 -7.360 -11.019 1.00 1.56 H new ATOM 0 HD12 LEU A 162 8.943 -7.078 -9.668 1.00 1.56 H new ATOM 0 HD13 LEU A 162 9.267 -8.379 -10.838 1.00 1.56 H new ATOM 0 HD21 LEU A 162 6.385 -9.396 -11.052 1.00 1.33 H new ATOM 0 HD22 LEU A 162 7.834 -10.414 -10.877 1.00 1.33 H new ATOM 0 HD23 LEU A 162 6.484 -10.582 -9.729 1.00 1.33 H new ATOM 2505 N SER A 163 9.385 -11.736 -6.262 1.00 0.54 N ATOM 2506 CA SER A 163 9.911 -13.108 -6.020 1.00 0.56 C ATOM 2507 C SER A 163 8.810 -13.994 -5.427 1.00 0.53 C ATOM 2508 O SER A 163 8.793 -15.194 -5.616 1.00 0.60 O ATOM 2509 CB SER A 163 11.082 -13.034 -5.040 1.00 0.63 C ATOM 2510 OG SER A 163 11.767 -14.280 -5.035 1.00 1.32 O ATOM 0 H SER A 163 9.899 -10.983 -5.804 1.00 0.54 H new ATOM 0 HA SER A 163 10.245 -13.536 -6.965 1.00 0.56 H new ATOM 0 HB2 SER A 163 11.762 -12.233 -5.328 1.00 0.63 H new ATOM 0 HB3 SER A 163 10.720 -12.801 -4.039 1.00 0.63 H new ATOM 0 HG SER A 163 12.520 -14.237 -4.409 1.00 1.32 H new ATOM 2516 N TYR A 164 7.894 -13.405 -4.702 1.00 0.59 N ATOM 2517 CA TYR A 164 6.794 -14.201 -4.080 1.00 0.64 C ATOM 2518 C TYR A 164 5.675 -14.428 -5.098 1.00 0.63 C ATOM 2519 O TYR A 164 5.018 -15.450 -5.090 1.00 0.68 O ATOM 2520 CB TYR A 164 6.238 -13.435 -2.872 1.00 0.69 C ATOM 2521 CG TYR A 164 5.027 -14.157 -2.315 1.00 0.72 C ATOM 2522 CD1 TYR A 164 5.188 -15.380 -1.653 1.00 1.34 C ATOM 2523 CD2 TYR A 164 3.746 -13.603 -2.457 1.00 1.50 C ATOM 2524 CE1 TYR A 164 4.072 -16.049 -1.135 1.00 1.35 C ATOM 2525 CE2 TYR A 164 2.631 -14.274 -1.938 1.00 1.57 C ATOM 2526 CZ TYR A 164 2.795 -15.496 -1.277 1.00 0.87 C ATOM 2527 OH TYR A 164 1.696 -16.157 -0.767 1.00 0.97 O ATOM 0 H TYR A 164 7.861 -12.403 -4.513 1.00 0.59 H new ATOM 0 HA TYR A 164 7.184 -15.166 -3.758 1.00 0.64 H new ATOM 0 HB2 TYR A 164 7.005 -13.346 -2.103 1.00 0.69 H new ATOM 0 HB3 TYR A 164 5.964 -12.422 -3.167 1.00 0.69 H new ATOM 0 HD1 TYR A 164 6.173 -15.808 -1.542 1.00 1.34 H new ATOM 0 HD2 TYR A 164 3.619 -12.659 -2.966 1.00 1.50 H new ATOM 0 HE1 TYR A 164 4.197 -16.993 -0.625 1.00 1.35 H new ATOM 0 HE2 TYR A 164 1.645 -13.848 -2.048 1.00 1.57 H new ATOM 0 HH TYR A 164 0.887 -15.636 -0.951 1.00 0.97 H new ATOM 2537 N PHE A 165 5.445 -13.488 -5.972 1.00 0.64 N ATOM 2538 CA PHE A 165 4.361 -13.665 -6.975 1.00 0.72 C ATOM 2539 C PHE A 165 4.778 -14.703 -8.023 1.00 0.82 C ATOM 2540 O PHE A 165 4.716 -14.462 -9.212 1.00 1.56 O ATOM 2541 CB PHE A 165 4.064 -12.323 -7.666 1.00 0.74 C ATOM 2542 CG PHE A 165 3.189 -11.463 -6.773 1.00 0.84 C ATOM 2543 CD1 PHE A 165 1.887 -11.880 -6.461 1.00 1.65 C ATOM 2544 CD2 PHE A 165 3.675 -10.251 -6.261 1.00 1.42 C ATOM 2545 CE1 PHE A 165 1.075 -11.088 -5.640 1.00 1.96 C ATOM 2546 CE2 PHE A 165 2.860 -9.461 -5.440 1.00 1.71 C ATOM 2547 CZ PHE A 165 1.562 -9.880 -5.130 1.00 1.66 C ATOM 0 H PHE A 165 5.959 -12.609 -6.034 1.00 0.64 H new ATOM 0 HA PHE A 165 3.463 -14.014 -6.465 1.00 0.72 H new ATOM 0 HB2 PHE A 165 4.997 -11.803 -7.885 1.00 0.74 H new ATOM 0 HB3 PHE A 165 3.565 -12.498 -8.619 1.00 0.74 H new ATOM 0 HD1 PHE A 165 1.510 -12.813 -6.854 1.00 1.65 H new ATOM 0 HD2 PHE A 165 4.677 -9.927 -6.500 1.00 1.42 H new ATOM 0 HE1 PHE A 165 0.072 -11.410 -5.400 1.00 1.96 H new ATOM 0 HE2 PHE A 165 3.234 -8.528 -5.046 1.00 1.71 H new ATOM 0 HZ PHE A 165 0.935 -9.270 -4.496 1.00 1.66 H new ATOM 2557 N GLY A 166 5.200 -15.861 -7.589 1.00 0.94 N ATOM 2558 CA GLY A 166 5.612 -16.915 -8.560 1.00 1.01 C ATOM 2559 C GLY A 166 4.356 -17.537 -9.170 1.00 1.23 C ATOM 2560 O GLY A 166 4.380 -18.632 -9.697 1.00 1.85 O ATOM 0 H GLY A 166 5.277 -16.122 -6.606 1.00 0.94 H new ATOM 0 HA2 GLY A 166 6.238 -16.485 -9.341 1.00 1.01 H new ATOM 0 HA3 GLY A 166 6.207 -17.679 -8.059 1.00 1.01 H new ATOM 2606 N TRP A 170 -4.056 -18.604 -7.949 1.00 1.04 N ATOM 2607 CA TRP A 170 -4.833 -17.333 -8.017 1.00 1.01 C ATOM 2608 C TRP A 170 -5.933 -17.333 -6.948 1.00 0.92 C ATOM 2609 O TRP A 170 -5.991 -16.459 -6.106 1.00 0.95 O ATOM 2610 CB TRP A 170 -5.460 -17.203 -9.416 1.00 1.32 C ATOM 2611 CG TRP A 170 -5.708 -15.760 -9.735 1.00 1.70 C ATOM 2612 CD1 TRP A 170 -6.927 -15.196 -9.896 1.00 2.30 C ATOM 2613 CD2 TRP A 170 -4.734 -14.696 -9.933 1.00 2.52 C ATOM 2614 NE1 TRP A 170 -6.762 -13.852 -10.182 1.00 3.04 N ATOM 2615 CE2 TRP A 170 -5.428 -13.496 -10.215 1.00 3.15 C ATOM 2616 CE3 TRP A 170 -3.328 -14.655 -9.896 1.00 3.32 C ATOM 2617 CZ2 TRP A 170 -4.752 -12.298 -10.452 1.00 4.11 C ATOM 2618 CZ3 TRP A 170 -2.645 -13.452 -10.134 1.00 4.37 C ATOM 2619 CH2 TRP A 170 -3.355 -12.276 -10.411 1.00 4.64 C ATOM 0 HA TRP A 170 -4.169 -16.488 -7.834 1.00 1.01 H new ATOM 0 HB2 TRP A 170 -4.797 -17.640 -10.163 1.00 1.32 H new ATOM 0 HB3 TRP A 170 -6.397 -17.759 -9.457 1.00 1.32 H new ATOM 0 HD1 TRP A 170 -7.873 -15.710 -9.815 1.00 2.30 H new ATOM 0 HE1 TRP A 170 -7.532 -13.204 -10.348 1.00 3.04 H new ATOM 0 HE3 TRP A 170 -2.771 -15.555 -9.683 1.00 3.32 H new ATOM 0 HZ2 TRP A 170 -5.304 -11.395 -10.665 1.00 4.11 H new ATOM 0 HZ3 TRP A 170 -1.566 -13.433 -10.103 1.00 4.37 H new ATOM 0 HH2 TRP A 170 -2.823 -11.354 -10.593 1.00 4.64 H new ATOM 2630 N GLN A 171 -6.808 -18.302 -6.978 1.00 0.88 N ATOM 2631 CA GLN A 171 -7.904 -18.351 -5.966 1.00 0.84 C ATOM 2632 C GLN A 171 -7.312 -18.307 -4.556 1.00 0.75 C ATOM 2633 O GLN A 171 -8.003 -17.998 -3.604 1.00 0.75 O ATOM 2634 CB GLN A 171 -8.714 -19.638 -6.139 1.00 0.88 C ATOM 2635 CG GLN A 171 -9.358 -19.661 -7.526 1.00 1.57 C ATOM 2636 CD GLN A 171 -10.097 -20.986 -7.720 1.00 1.93 C ATOM 2637 OE1 GLN A 171 -9.480 -22.026 -7.848 1.00 2.66 O ATOM 2638 NE2 GLN A 171 -11.401 -20.994 -7.746 1.00 2.34 N ATOM 0 H GLN A 171 -6.812 -19.062 -7.659 1.00 0.88 H new ATOM 0 HA GLN A 171 -8.558 -17.491 -6.110 1.00 0.84 H new ATOM 0 HB2 GLN A 171 -8.066 -20.506 -6.014 1.00 0.88 H new ATOM 0 HB3 GLN A 171 -9.483 -19.701 -5.369 1.00 0.88 H new ATOM 0 HG2 GLN A 171 -10.051 -18.826 -7.631 1.00 1.57 H new ATOM 0 HG3 GLN A 171 -8.595 -19.541 -8.295 1.00 1.57 H new ATOM 0 HE21 GLN A 171 -11.919 -20.122 -7.639 1.00 2.34 H new ATOM 0 HE22 GLN A 171 -11.903 -21.873 -7.874 1.00 2.34 H new ATOM 2647 N THR A 172 -6.047 -18.573 -4.400 1.00 0.67 N ATOM 2648 CA THR A 172 -5.449 -18.497 -3.035 1.00 0.60 C ATOM 2649 C THR A 172 -5.133 -17.029 -2.741 1.00 0.59 C ATOM 2650 O THR A 172 -5.756 -16.420 -1.892 1.00 0.74 O ATOM 2651 CB THR A 172 -4.183 -19.355 -2.979 1.00 0.59 C ATOM 2652 OG1 THR A 172 -4.565 -20.723 -2.980 1.00 0.81 O ATOM 2653 CG2 THR A 172 -3.391 -19.057 -1.704 1.00 0.92 C ATOM 0 H THR A 172 -5.405 -18.837 -5.148 1.00 0.67 H new ATOM 0 HA THR A 172 -6.142 -18.878 -2.284 1.00 0.60 H new ATOM 0 HB THR A 172 -3.556 -19.130 -3.842 1.00 0.59 H new ATOM 0 HG1 THR A 172 -3.764 -21.286 -2.946 1.00 0.81 H new ATOM 0 HG21 THR A 172 -2.494 -19.676 -1.680 1.00 0.92 H new ATOM 0 HG22 THR A 172 -3.107 -18.005 -1.690 1.00 0.92 H new ATOM 0 HG23 THR A 172 -4.008 -19.278 -0.833 1.00 0.92 H new ATOM 2661 N VAL A 173 -4.158 -16.461 -3.404 1.00 0.59 N ATOM 2662 CA VAL A 173 -3.789 -15.032 -3.145 1.00 0.58 C ATOM 2663 C VAL A 173 -5.053 -14.181 -2.963 1.00 0.57 C ATOM 2664 O VAL A 173 -5.046 -13.195 -2.253 1.00 0.60 O ATOM 2665 CB VAL A 173 -2.983 -14.510 -4.342 1.00 0.64 C ATOM 2666 CG1 VAL A 173 -2.717 -13.010 -4.189 1.00 1.13 C ATOM 2667 CG2 VAL A 173 -1.649 -15.256 -4.415 1.00 1.01 C ATOM 0 H VAL A 173 -3.597 -16.926 -4.118 1.00 0.59 H new ATOM 0 HA VAL A 173 -3.194 -14.968 -2.234 1.00 0.58 H new ATOM 0 HB VAL A 173 -3.554 -14.677 -5.255 1.00 0.64 H new ATOM 0 HG11 VAL A 173 -2.144 -12.653 -5.045 1.00 1.13 H new ATOM 0 HG12 VAL A 173 -3.666 -12.476 -4.138 1.00 1.13 H new ATOM 0 HG13 VAL A 173 -2.151 -12.832 -3.274 1.00 1.13 H new ATOM 0 HG21 VAL A 173 -1.073 -14.889 -5.264 1.00 1.01 H new ATOM 0 HG22 VAL A 173 -1.088 -15.089 -3.496 1.00 1.01 H new ATOM 0 HG23 VAL A 173 -1.835 -16.323 -4.537 1.00 1.01 H new ATOM 2677 N THR A 174 -6.135 -14.549 -3.592 1.00 0.55 N ATOM 2678 CA THR A 174 -7.389 -13.753 -3.445 1.00 0.56 C ATOM 2679 C THR A 174 -8.025 -14.038 -2.080 1.00 0.53 C ATOM 2680 O THR A 174 -8.536 -13.145 -1.433 1.00 0.55 O ATOM 2681 CB THR A 174 -8.376 -14.152 -4.546 1.00 0.59 C ATOM 2682 OG1 THR A 174 -8.552 -15.563 -4.534 1.00 1.37 O ATOM 2683 CG2 THR A 174 -7.834 -13.716 -5.907 1.00 1.27 C ATOM 0 H THR A 174 -6.206 -15.365 -4.200 1.00 0.55 H new ATOM 0 HA THR A 174 -7.152 -12.692 -3.524 1.00 0.56 H new ATOM 0 HB THR A 174 -9.334 -13.663 -4.368 1.00 0.59 H new ATOM 0 HG1 THR A 174 -9.388 -15.792 -4.991 1.00 1.37 H new ATOM 0 HG21 THR A 174 -8.539 -14.002 -6.688 1.00 1.27 H new ATOM 0 HG22 THR A 174 -7.701 -12.634 -5.916 1.00 1.27 H new ATOM 0 HG23 THR A 174 -6.875 -14.201 -6.089 1.00 1.27 H new ATOM 2691 N ILE A 175 -8.003 -15.263 -1.634 1.00 0.51 N ATOM 2692 CA ILE A 175 -8.617 -15.584 -0.310 1.00 0.50 C ATOM 2693 C ILE A 175 -7.638 -15.191 0.800 1.00 0.49 C ATOM 2694 O ILE A 175 -8.000 -15.050 1.951 1.00 0.49 O ATOM 2695 CB ILE A 175 -8.869 -17.090 -0.255 1.00 0.52 C ATOM 2696 CG1 ILE A 175 -9.904 -17.476 -1.317 1.00 0.77 C ATOM 2697 CG2 ILE A 175 -9.374 -17.518 1.126 1.00 0.87 C ATOM 2698 CD1 ILE A 175 -9.887 -18.994 -1.523 1.00 0.89 C ATOM 0 H ILE A 175 -7.589 -16.055 -2.125 1.00 0.51 H new ATOM 0 HA ILE A 175 -9.553 -15.041 -0.178 1.00 0.50 H new ATOM 0 HB ILE A 175 -7.925 -17.600 -0.449 1.00 0.52 H new ATOM 0 HG12 ILE A 175 -10.897 -17.152 -1.006 1.00 0.77 H new ATOM 0 HG13 ILE A 175 -9.683 -16.969 -2.256 1.00 0.77 H new ATOM 0 HG21 ILE A 175 -9.544 -18.595 1.134 1.00 0.87 H new ATOM 0 HG22 ILE A 175 -8.630 -17.263 1.881 1.00 0.87 H new ATOM 0 HG23 ILE A 175 -10.308 -17.002 1.348 1.00 0.87 H new ATOM 0 HD11 ILE A 175 -10.624 -19.267 -2.279 1.00 0.89 H new ATOM 0 HD12 ILE A 175 -8.896 -19.305 -1.853 1.00 0.89 H new ATOM 0 HD13 ILE A 175 -10.129 -19.491 -0.584 1.00 0.89 H new ATOM 2710 N PHE A 176 -6.398 -15.007 0.443 1.00 0.48 N ATOM 2711 CA PHE A 176 -5.360 -14.615 1.438 1.00 0.49 C ATOM 2712 C PHE A 176 -5.464 -13.116 1.727 1.00 0.49 C ATOM 2713 O PHE A 176 -5.633 -12.692 2.853 1.00 0.56 O ATOM 2714 CB PHE A 176 -3.982 -14.888 0.818 1.00 0.51 C ATOM 2715 CG PHE A 176 -2.924 -14.761 1.893 1.00 0.51 C ATOM 2716 CD1 PHE A 176 -2.387 -13.506 2.198 1.00 1.23 C ATOM 2717 CD2 PHE A 176 -2.487 -15.896 2.590 1.00 1.41 C ATOM 2718 CE1 PHE A 176 -1.415 -13.383 3.198 1.00 1.22 C ATOM 2719 CE2 PHE A 176 -1.514 -15.774 3.589 1.00 1.52 C ATOM 2720 CZ PHE A 176 -0.978 -14.517 3.894 1.00 0.76 C ATOM 0 H PHE A 176 -6.054 -15.113 -0.511 1.00 0.48 H new ATOM 0 HA PHE A 176 -5.499 -15.178 2.361 1.00 0.49 H new ATOM 0 HB2 PHE A 176 -3.957 -15.886 0.381 1.00 0.51 H new ATOM 0 HB3 PHE A 176 -3.786 -14.182 0.011 1.00 0.51 H new ATOM 0 HD1 PHE A 176 -2.723 -12.631 1.661 1.00 1.23 H new ATOM 0 HD2 PHE A 176 -2.901 -16.866 2.356 1.00 1.41 H new ATOM 0 HE1 PHE A 176 -1.002 -12.413 3.433 1.00 1.22 H new ATOM 0 HE2 PHE A 176 -1.177 -16.649 4.124 1.00 1.52 H new ATOM 0 HZ PHE A 176 -0.228 -14.422 4.665 1.00 0.76 H new ATOM 2730 N VAL A 177 -5.326 -12.317 0.704 1.00 0.46 N ATOM 2731 CA VAL A 177 -5.372 -10.835 0.867 1.00 0.48 C ATOM 2732 C VAL A 177 -6.808 -10.372 1.141 1.00 0.44 C ATOM 2733 O VAL A 177 -7.023 -9.315 1.701 1.00 0.57 O ATOM 2734 CB VAL A 177 -4.856 -10.203 -0.435 1.00 0.56 C ATOM 2735 CG1 VAL A 177 -4.929 -8.677 -0.368 1.00 1.20 C ATOM 2736 CG2 VAL A 177 -3.401 -10.625 -0.648 1.00 1.24 C ATOM 0 H VAL A 177 -5.181 -12.634 -0.254 1.00 0.46 H new ATOM 0 HA VAL A 177 -4.754 -10.531 1.711 1.00 0.48 H new ATOM 0 HB VAL A 177 -5.480 -10.544 -1.261 1.00 0.56 H new ATOM 0 HG11 VAL A 177 -4.558 -8.254 -1.301 1.00 1.20 H new ATOM 0 HG12 VAL A 177 -5.963 -8.369 -0.215 1.00 1.20 H new ATOM 0 HG13 VAL A 177 -4.318 -8.320 0.461 1.00 1.20 H new ATOM 0 HG21 VAL A 177 -3.025 -10.182 -1.570 1.00 1.24 H new ATOM 0 HG22 VAL A 177 -2.796 -10.283 0.192 1.00 1.24 H new ATOM 0 HG23 VAL A 177 -3.344 -11.711 -0.718 1.00 1.24 H new ATOM 2746 N ALA A 178 -7.791 -11.143 0.768 1.00 0.45 N ATOM 2747 CA ALA A 178 -9.202 -10.726 1.029 1.00 0.43 C ATOM 2748 C ALA A 178 -9.628 -11.190 2.425 1.00 0.40 C ATOM 2749 O ALA A 178 -10.232 -10.452 3.177 1.00 0.40 O ATOM 2750 CB ALA A 178 -10.123 -11.360 -0.014 1.00 0.46 C ATOM 0 H ALA A 178 -7.682 -12.040 0.296 1.00 0.45 H new ATOM 0 HA ALA A 178 -9.272 -9.640 0.969 1.00 0.43 H new ATOM 0 HB1 ALA A 178 -11.152 -11.056 0.176 1.00 0.46 H new ATOM 0 HB2 ALA A 178 -9.826 -11.031 -1.010 1.00 0.46 H new ATOM 0 HB3 ALA A 178 -10.048 -12.446 0.047 1.00 0.46 H new ATOM 2756 N GLY A 179 -9.330 -12.412 2.771 1.00 0.41 N ATOM 2757 CA GLY A 179 -9.730 -12.929 4.112 1.00 0.43 C ATOM 2758 C GLY A 179 -9.039 -12.128 5.218 1.00 0.43 C ATOM 2759 O GLY A 179 -9.558 -11.985 6.307 1.00 0.48 O ATOM 0 H GLY A 179 -8.826 -13.076 2.183 1.00 0.41 H new ATOM 0 HA2 GLY A 179 -10.812 -12.862 4.227 1.00 0.43 H new ATOM 0 HA3 GLY A 179 -9.465 -13.983 4.197 1.00 0.43 H new ATOM 2763 N VAL A 180 -7.866 -11.620 4.956 1.00 0.42 N ATOM 2764 CA VAL A 180 -7.137 -10.849 6.003 1.00 0.45 C ATOM 2765 C VAL A 180 -7.674 -9.418 6.101 1.00 0.45 C ATOM 2766 O VAL A 180 -7.942 -8.911 7.171 1.00 0.43 O ATOM 2767 CB VAL A 180 -5.640 -10.806 5.660 1.00 0.49 C ATOM 2768 CG1 VAL A 180 -4.908 -9.833 6.598 1.00 1.31 C ATOM 2769 CG2 VAL A 180 -5.043 -12.206 5.819 1.00 1.41 C ATOM 0 H VAL A 180 -7.381 -11.705 4.063 1.00 0.42 H new ATOM 0 HA VAL A 180 -7.287 -11.345 6.962 1.00 0.45 H new ATOM 0 HB VAL A 180 -5.521 -10.466 4.631 1.00 0.49 H new ATOM 0 HG11 VAL A 180 -3.848 -9.812 6.345 1.00 1.31 H new ATOM 0 HG12 VAL A 180 -5.328 -8.834 6.485 1.00 1.31 H new ATOM 0 HG13 VAL A 180 -5.028 -10.163 7.630 1.00 1.31 H new ATOM 0 HG21 VAL A 180 -3.981 -12.178 5.576 1.00 1.41 H new ATOM 0 HG22 VAL A 180 -5.171 -12.542 6.848 1.00 1.41 H new ATOM 0 HG23 VAL A 180 -5.551 -12.897 5.146 1.00 1.41 H new ATOM 2779 N LEU A 181 -7.816 -8.759 4.981 1.00 0.49 N ATOM 2780 CA LEU A 181 -8.308 -7.354 5.001 1.00 0.50 C ATOM 2781 C LEU A 181 -9.726 -7.321 5.573 1.00 0.49 C ATOM 2782 O LEU A 181 -10.104 -6.423 6.298 1.00 0.51 O ATOM 2783 CB LEU A 181 -8.298 -6.814 3.568 1.00 0.56 C ATOM 2784 CG LEU A 181 -8.939 -5.423 3.487 1.00 0.64 C ATOM 2785 CD1 LEU A 181 -8.214 -4.440 4.411 1.00 1.60 C ATOM 2786 CD2 LEU A 181 -8.843 -4.940 2.037 1.00 1.20 C ATOM 0 H LEU A 181 -7.612 -9.135 4.055 1.00 0.49 H new ATOM 0 HA LEU A 181 -7.666 -6.734 5.627 1.00 0.50 H new ATOM 0 HB2 LEU A 181 -7.272 -6.765 3.204 1.00 0.56 H new ATOM 0 HB3 LEU A 181 -8.835 -7.502 2.915 1.00 0.56 H new ATOM 0 HG LEU A 181 -9.980 -5.478 3.804 1.00 0.64 H new ATOM 0 HD11 LEU A 181 -8.684 -3.459 4.339 1.00 1.60 H new ATOM 0 HD12 LEU A 181 -8.273 -4.796 5.439 1.00 1.60 H new ATOM 0 HD13 LEU A 181 -7.168 -4.364 4.113 1.00 1.60 H new ATOM 0 HD21 LEU A 181 -9.293 -3.951 1.952 1.00 1.20 H new ATOM 0 HD22 LEU A 181 -7.796 -4.889 1.739 1.00 1.20 H new ATOM 0 HD23 LEU A 181 -9.372 -5.636 1.386 1.00 1.20 H new ATOM 2798 N THR A 182 -10.516 -8.304 5.226 1.00 0.49 N ATOM 2799 CA THR A 182 -11.922 -8.359 5.713 1.00 0.51 C ATOM 2800 C THR A 182 -11.944 -8.633 7.219 1.00 0.48 C ATOM 2801 O THR A 182 -12.749 -8.090 7.948 1.00 0.51 O ATOM 2802 CB THR A 182 -12.661 -9.481 4.974 1.00 0.54 C ATOM 2803 OG1 THR A 182 -12.475 -9.324 3.574 1.00 1.16 O ATOM 2804 CG2 THR A 182 -14.154 -9.422 5.300 1.00 1.07 C ATOM 0 H THR A 182 -10.242 -9.077 4.620 1.00 0.49 H new ATOM 0 HA THR A 182 -12.412 -7.404 5.522 1.00 0.51 H new ATOM 0 HB THR A 182 -12.263 -10.445 5.291 1.00 0.54 H new ATOM 0 HG1 THR A 182 -11.843 -9.999 3.250 1.00 1.16 H new ATOM 0 HG21 THR A 182 -14.674 -10.222 4.772 1.00 1.07 H new ATOM 0 HG22 THR A 182 -14.297 -9.543 6.374 1.00 1.07 H new ATOM 0 HG23 THR A 182 -14.557 -8.459 4.987 1.00 1.07 H new ATOM 2812 N ALA A 183 -11.076 -9.488 7.685 1.00 0.45 N ATOM 2813 CA ALA A 183 -11.055 -9.818 9.139 1.00 0.44 C ATOM 2814 C ALA A 183 -10.929 -8.537 9.971 1.00 0.44 C ATOM 2815 O ALA A 183 -11.758 -8.239 10.807 1.00 0.50 O ATOM 2816 CB ALA A 183 -9.859 -10.729 9.429 1.00 0.46 C ATOM 0 H ALA A 183 -10.379 -9.974 7.121 1.00 0.45 H new ATOM 0 HA ALA A 183 -11.984 -10.323 9.405 1.00 0.44 H new ATOM 0 HB1 ALA A 183 -9.838 -10.974 10.491 1.00 0.46 H new ATOM 0 HB2 ALA A 183 -9.950 -11.646 8.847 1.00 0.46 H new ATOM 0 HB3 ALA A 183 -8.937 -10.216 9.156 1.00 0.46 H new ATOM 2822 N SER A 184 -9.897 -7.775 9.731 1.00 0.47 N ATOM 2823 CA SER A 184 -9.710 -6.506 10.490 1.00 0.51 C ATOM 2824 C SER A 184 -10.920 -5.598 10.259 1.00 0.54 C ATOM 2825 O SER A 184 -11.360 -4.878 11.133 1.00 0.56 O ATOM 2826 CB SER A 184 -8.440 -5.802 10.018 1.00 0.62 C ATOM 2827 OG SER A 184 -8.582 -5.442 8.651 1.00 1.55 O ATOM 0 H SER A 184 -9.174 -7.977 9.041 1.00 0.47 H new ATOM 0 HA SER A 184 -9.617 -6.729 11.553 1.00 0.51 H new ATOM 0 HB2 SER A 184 -8.257 -4.914 10.623 1.00 0.62 H new ATOM 0 HB3 SER A 184 -7.578 -6.457 10.146 1.00 0.62 H new ATOM 0 HG SER A 184 -9.144 -6.103 8.195 1.00 1.55 H new ATOM 2833 N LEU A 185 -11.475 -5.637 9.086 1.00 0.58 N ATOM 2834 CA LEU A 185 -12.660 -4.789 8.800 1.00 0.69 C ATOM 2835 C LEU A 185 -13.829 -5.266 9.672 1.00 0.69 C ATOM 2836 O LEU A 185 -14.691 -4.499 10.054 1.00 0.79 O ATOM 2837 CB LEU A 185 -12.999 -4.921 7.303 1.00 0.71 C ATOM 2838 CG LEU A 185 -13.705 -3.662 6.758 1.00 0.79 C ATOM 2839 CD1 LEU A 185 -12.835 -2.401 6.965 1.00 1.62 C ATOM 2840 CD2 LEU A 185 -13.965 -3.891 5.264 1.00 1.18 C ATOM 0 H LEU A 185 -11.160 -6.220 8.311 1.00 0.58 H new ATOM 0 HA LEU A 185 -12.461 -3.742 9.028 1.00 0.69 H new ATOM 0 HB2 LEU A 185 -12.084 -5.097 6.738 1.00 0.71 H new ATOM 0 HB3 LEU A 185 -13.639 -5.790 7.151 1.00 0.71 H new ATOM 0 HG LEU A 185 -14.640 -3.498 7.293 1.00 0.79 H new ATOM 0 HD11 LEU A 185 -13.358 -1.529 6.571 1.00 1.62 H new ATOM 0 HD12 LEU A 185 -12.645 -2.260 8.029 1.00 1.62 H new ATOM 0 HD13 LEU A 185 -11.887 -2.523 6.441 1.00 1.62 H new ATOM 0 HD21 LEU A 185 -14.465 -3.018 4.844 1.00 1.18 H new ATOM 0 HD22 LEU A 185 -13.017 -4.049 4.750 1.00 1.18 H new ATOM 0 HD23 LEU A 185 -14.598 -4.769 5.135 1.00 1.18 H new ATOM 2852 N THR A 186 -13.859 -6.538 9.978 1.00 0.62 N ATOM 2853 CA THR A 186 -14.960 -7.100 10.820 1.00 0.68 C ATOM 2854 C THR A 186 -14.561 -7.099 12.299 1.00 0.62 C ATOM 2855 O THR A 186 -15.406 -7.256 13.156 1.00 0.64 O ATOM 2856 CB THR A 186 -15.284 -8.526 10.376 1.00 0.73 C ATOM 2857 OG1 THR A 186 -14.076 -9.271 10.309 1.00 0.89 O ATOM 2858 CG2 THR A 186 -15.938 -8.508 9.000 1.00 1.00 C ATOM 0 H THR A 186 -13.161 -7.218 9.678 1.00 0.62 H new ATOM 0 HA THR A 186 -15.843 -6.473 10.694 1.00 0.68 H new ATOM 0 HB THR A 186 -15.970 -8.982 11.091 1.00 0.73 H new ATOM 0 HG1 THR A 186 -13.375 -8.804 10.810 1.00 0.89 H new ATOM 0 HG21 THR A 186 -16.165 -9.529 8.692 1.00 1.00 H new ATOM 0 HG22 THR A 186 -16.860 -7.928 9.043 1.00 1.00 H new ATOM 0 HG23 THR A 186 -15.257 -8.055 8.280 1.00 1.00 H new ATOM 2866 N ILE A 187 -13.309 -6.928 12.639 1.00 0.64 N ATOM 2867 CA ILE A 187 -12.970 -6.934 14.098 1.00 0.66 C ATOM 2868 C ILE A 187 -13.483 -5.620 14.695 1.00 0.66 C ATOM 2869 O ILE A 187 -13.784 -5.535 15.869 1.00 0.75 O ATOM 2870 CB ILE A 187 -11.449 -7.074 14.296 1.00 0.72 C ATOM 2871 CG1 ILE A 187 -11.168 -7.621 15.700 1.00 0.88 C ATOM 2872 CG2 ILE A 187 -10.758 -5.709 14.132 1.00 1.57 C ATOM 2873 CD1 ILE A 187 -9.658 -7.650 15.948 1.00 0.87 C ATOM 0 H ILE A 187 -12.529 -6.789 11.997 1.00 0.64 H new ATOM 0 HA ILE A 187 -13.438 -7.781 14.599 1.00 0.66 H new ATOM 0 HB ILE A 187 -11.057 -7.759 13.545 1.00 0.72 H new ATOM 0 HG12 ILE A 187 -11.658 -6.998 16.449 1.00 0.88 H new ATOM 0 HG13 ILE A 187 -11.582 -8.624 15.800 1.00 0.88 H new ATOM 0 HG21 ILE A 187 -9.684 -5.826 14.275 1.00 1.57 H new ATOM 0 HG22 ILE A 187 -10.951 -5.321 13.132 1.00 1.57 H new ATOM 0 HG23 ILE A 187 -11.149 -5.012 14.873 1.00 1.57 H new ATOM 0 HD11 ILE A 187 -9.461 -8.039 16.947 1.00 0.87 H new ATOM 0 HD12 ILE A 187 -9.180 -8.291 15.208 1.00 0.87 H new ATOM 0 HD13 ILE A 187 -9.256 -6.640 15.866 1.00 0.87 H new ATOM 2885 N TRP A 188 -13.552 -4.590 13.898 1.00 0.64 N ATOM 2886 CA TRP A 188 -14.013 -3.274 14.425 1.00 0.70 C ATOM 2887 C TRP A 188 -15.466 -3.390 14.916 1.00 0.81 C ATOM 2888 O TRP A 188 -15.743 -3.279 16.094 1.00 1.06 O ATOM 2889 CB TRP A 188 -13.912 -2.221 13.297 1.00 0.85 C ATOM 2890 CG TRP A 188 -13.384 -0.925 13.833 1.00 0.92 C ATOM 2891 CD1 TRP A 188 -12.152 -0.430 13.583 1.00 1.76 C ATOM 2892 CD2 TRP A 188 -14.048 0.041 14.698 1.00 1.04 C ATOM 2893 NE1 TRP A 188 -12.014 0.778 14.242 1.00 2.01 N ATOM 2894 CE2 TRP A 188 -13.156 1.112 14.942 1.00 1.34 C ATOM 2895 CE3 TRP A 188 -15.323 0.091 15.288 1.00 1.79 C ATOM 2896 CZ2 TRP A 188 -13.518 2.195 15.744 1.00 1.47 C ATOM 2897 CZ3 TRP A 188 -15.690 1.180 16.095 1.00 2.17 C ATOM 2898 CH2 TRP A 188 -14.789 2.230 16.323 1.00 1.71 C ATOM 0 H TRP A 188 -13.310 -4.602 12.907 1.00 0.64 H new ATOM 0 HA TRP A 188 -13.387 -2.969 15.264 1.00 0.70 H new ATOM 0 HB2 TRP A 188 -13.257 -2.588 12.507 1.00 0.85 H new ATOM 0 HB3 TRP A 188 -14.894 -2.063 12.850 1.00 0.85 H new ATOM 0 HD1 TRP A 188 -11.398 -0.901 12.969 1.00 1.76 H new ATOM 0 HE1 TRP A 188 -11.171 1.352 14.214 1.00 2.01 H new ATOM 0 HE3 TRP A 188 -16.024 -0.713 15.120 1.00 1.79 H new ATOM 0 HZ2 TRP A 188 -12.820 3.001 15.916 1.00 1.47 H new ATOM 0 HZ3 TRP A 188 -16.672 1.209 16.543 1.00 2.17 H new ATOM 0 HH2 TRP A 188 -15.077 3.064 16.945 1.00 1.71 H new