USER MOD reduce.3.24.130724 H: found=0, std=0, add=1147, rem=0, adj=29 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 99 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 184 SER OG : rot -51:sc= 0.642 USER MOD Single : A 15 SER OG : rot 180:sc= -0.323 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.325 K(o=-0.33,f=-1.1) USER MOD Single : A 20 MET CE :methyl 172:sc=-0.00802 (180deg=-0.0624) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 92:sc= 1.16 USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=-0.0036) USER MOD Single : A 32 GLN : amide:sc= -0.0809 X(o=-0.081,f=-0.12) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0361 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ -137:sc= -0.33 (180deg=-2.81!) 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+ -165:sc= 0 (180deg=-0.221) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -0.756 K(o=-0.76,f=-4.3!) 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 -160:sc= -0.0786 (180deg=-0.895) USER MOD Single : A 115 TYR OH : rot 33:sc= 0.167 USER MOD Single : A 118 SER OG : rot -73:sc= 0.808 USER MOD Single : A 119 LYS NZ :NH3+ 126:sc= -0.173 (180deg=-0.718) USER MOD Single : A 123 LYS NZ :NH3+ 159:sc= -1.61 (180deg=-1.92) USER MOD Single : A 126 CYS SG : rot -58:sc= 0.756 USER MOD Single : A 127 THR OG1 : rot 53:sc= 0.0341 USER MOD Single : A 128 LYS NZ :NH3+ 156:sc= -0.138 (180deg=-1.02) USER MOD Single : A 135 THR OG1 : rot 88:sc= 0.669 USER MOD Single : A 137 MET CE :methyl -121:sc= 0 (180deg=-0.00846) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 153 GLN : amide:sc= -3.16 K(o=-3.2,f=-4.1!) USER MOD Single : A 155 GLN : amide:sc= -1.22 K(o=-1.2,f=-0.0032) USER MOD Single : A 163 SER OG : rot 70:sc= 0.846 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 87:sc= 1.12 USER MOD Single : A 182 THR OG1 : rot 96:sc= -0.195! USER MOD Single : A 186 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 176 N SER A 15 19.415 0.982 -2.824 1.00 1.07 N ATOM 177 CA SER A 15 19.590 2.286 -2.119 1.00 0.91 C ATOM 178 C SER A 15 18.234 2.734 -1.570 1.00 0.75 C ATOM 179 O SER A 15 17.233 2.702 -2.258 1.00 0.78 O ATOM 180 CB SER A 15 20.109 3.332 -3.106 1.00 0.99 C ATOM 181 OG SER A 15 19.056 3.720 -3.978 1.00 1.38 O ATOM 0 HA SER A 15 20.304 2.175 -1.303 1.00 0.91 H new ATOM 0 HB2 SER A 15 20.489 4.200 -2.567 1.00 0.99 H new ATOM 0 HB3 SER A 15 20.941 2.925 -3.681 1.00 0.99 H new ATOM 0 HG SER A 15 19.386 4.392 -4.611 1.00 1.38 H new ATOM 187 N SER A 16 18.192 3.140 -0.331 1.00 0.72 N ATOM 188 CA SER A 16 16.900 3.577 0.269 1.00 0.82 C ATOM 189 C SER A 16 16.287 4.703 -0.562 1.00 0.81 C ATOM 190 O SER A 16 15.081 4.845 -0.627 1.00 0.92 O ATOM 191 CB SER A 16 17.140 4.077 1.693 1.00 1.06 C ATOM 192 OG SER A 16 17.980 5.222 1.654 1.00 1.64 O ATOM 0 H SER A 16 18.998 3.188 0.293 1.00 0.72 H new ATOM 0 HA SER A 16 16.215 2.729 0.285 1.00 0.82 H new ATOM 0 HB2 SER A 16 16.191 4.324 2.169 1.00 1.06 H new ATOM 0 HB3 SER A 16 17.602 3.293 2.293 1.00 1.06 H new ATOM 0 HG SER A 16 18.134 5.546 2.566 1.00 1.64 H new ATOM 198 N GLU A 17 17.085 5.503 -1.210 1.00 0.80 N ATOM 199 CA GLU A 17 16.524 6.605 -2.040 1.00 0.94 C ATOM 200 C GLU A 17 15.779 6.025 -3.247 1.00 0.85 C ATOM 201 O GLU A 17 14.831 6.607 -3.733 1.00 0.89 O ATOM 202 CB GLU A 17 17.665 7.526 -2.496 1.00 1.13 C ATOM 203 CG GLU A 17 17.115 8.892 -2.913 1.00 1.71 C ATOM 204 CD GLU A 17 16.724 9.688 -1.667 1.00 2.26 C ATOM 205 OE1 GLU A 17 16.887 9.163 -0.578 1.00 2.90 O ATOM 206 OE2 GLU A 17 16.270 10.810 -1.822 1.00 2.68 O ATOM 0 H GLU A 17 18.103 5.442 -1.201 1.00 0.80 H new ATOM 0 HA GLU A 17 15.815 7.186 -1.450 1.00 0.94 H new ATOM 0 HB2 GLU A 17 18.386 7.649 -1.688 1.00 1.13 H new ATOM 0 HB3 GLU A 17 18.196 7.071 -3.332 1.00 1.13 H new ATOM 0 HG2 GLU A 17 17.865 9.438 -3.486 1.00 1.71 H new ATOM 0 HG3 GLU A 17 16.249 8.764 -3.562 1.00 1.71 H new ATOM 213 N GLN A 18 16.183 4.886 -3.737 1.00 0.80 N ATOM 214 CA GLN A 18 15.460 4.300 -4.902 1.00 0.83 C ATOM 215 C GLN A 18 14.065 3.839 -4.441 1.00 0.68 C ATOM 216 O GLN A 18 13.105 3.905 -5.182 1.00 0.69 O ATOM 217 CB GLN A 18 16.268 3.105 -5.463 1.00 0.96 C ATOM 218 CG GLN A 18 16.942 3.500 -6.785 1.00 1.53 C ATOM 219 CD GLN A 18 15.878 3.631 -7.877 1.00 2.23 C ATOM 220 OE1 GLN A 18 14.949 2.850 -7.933 1.00 2.69 O ATOM 221 NE2 GLN A 18 15.976 4.594 -8.752 1.00 3.07 N ATOM 0 H GLN A 18 16.971 4.341 -3.388 1.00 0.80 H new ATOM 0 HA GLN A 18 15.349 5.045 -5.690 1.00 0.83 H new ATOM 0 HB2 GLN A 18 17.022 2.794 -4.740 1.00 0.96 H new ATOM 0 HB3 GLN A 18 15.608 2.252 -5.622 1.00 0.96 H new ATOM 0 HG2 GLN A 18 17.476 4.443 -6.667 1.00 1.53 H new ATOM 0 HG3 GLN A 18 17.680 2.749 -7.069 1.00 1.53 H new ATOM 0 HE21 GLN A 18 16.756 5.249 -8.704 1.00 3.07 H new ATOM 0 HE22 GLN A 18 15.272 4.692 -9.484 1.00 3.07 H new ATOM 230 N ILE A 19 13.951 3.383 -3.220 1.00 0.59 N ATOM 231 CA ILE A 19 12.623 2.927 -2.706 1.00 0.58 C ATOM 232 C ILE A 19 11.694 4.132 -2.549 1.00 0.52 C ATOM 233 O ILE A 19 10.492 4.033 -2.696 1.00 0.59 O ATOM 234 CB ILE A 19 12.806 2.232 -1.357 1.00 0.64 C ATOM 235 CG1 ILE A 19 13.798 1.078 -1.519 1.00 0.74 C ATOM 236 CG2 ILE A 19 11.460 1.684 -0.873 1.00 0.73 C ATOM 237 CD1 ILE A 19 14.087 0.454 -0.154 1.00 0.81 C ATOM 0 H ILE A 19 14.721 3.306 -2.555 1.00 0.59 H new ATOM 0 HA ILE A 19 12.182 2.224 -3.413 1.00 0.58 H new ATOM 0 HB ILE A 19 13.186 2.946 -0.626 1.00 0.64 H new ATOM 0 HG12 ILE A 19 13.390 0.326 -2.194 1.00 0.74 H new ATOM 0 HG13 ILE A 19 14.723 1.441 -1.967 1.00 0.74 H new ATOM 0 HG21 ILE A 19 11.593 1.189 0.089 1.00 0.73 H new ATOM 0 HG22 ILE A 19 10.751 2.505 -0.764 1.00 0.73 H new ATOM 0 HG23 ILE A 19 11.076 0.968 -1.600 1.00 0.73 H new ATOM 0 HD11 ILE A 19 14.794 -0.368 -0.272 1.00 0.81 H new ATOM 0 HD12 ILE A 19 14.514 1.208 0.508 1.00 0.81 H new ATOM 0 HD13 ILE A 19 13.160 0.076 0.277 1.00 0.81 H new ATOM 249 N MET A 20 12.249 5.269 -2.260 1.00 0.51 N ATOM 250 CA MET A 20 11.438 6.503 -2.095 1.00 0.60 C ATOM 251 C MET A 20 10.898 6.984 -3.446 1.00 0.55 C ATOM 252 O MET A 20 9.722 7.226 -3.621 1.00 0.59 O ATOM 253 CB MET A 20 12.376 7.597 -1.513 1.00 0.82 C ATOM 254 CG MET A 20 12.177 7.701 0.017 1.00 1.07 C ATOM 255 SD MET A 20 10.527 8.389 0.372 1.00 1.43 S ATOM 256 CE MET A 20 9.913 7.081 1.472 1.00 0.93 C ATOM 0 H MET A 20 13.252 5.399 -2.128 1.00 0.51 H new ATOM 0 HA MET A 20 10.591 6.304 -1.438 1.00 0.60 H new ATOM 0 HB2 MET A 20 13.415 7.355 -1.738 1.00 0.82 H new ATOM 0 HB3 MET A 20 12.164 8.558 -1.982 1.00 0.82 H new ATOM 0 HG2 MET A 20 12.278 6.717 0.475 1.00 1.07 H new ATOM 0 HG3 MET A 20 12.949 8.336 0.452 1.00 1.07 H new ATOM 0 HE1 MET A 20 8.964 7.390 1.911 1.00 0.93 H new ATOM 0 HE2 MET A 20 9.767 6.164 0.901 1.00 0.93 H new ATOM 0 HE3 MET A 20 10.639 6.902 2.265 1.00 0.93 H new ATOM 266 N LYS A 21 11.788 7.127 -4.399 1.00 0.57 N ATOM 267 CA LYS A 21 11.395 7.596 -5.758 1.00 0.61 C ATOM 268 C LYS A 21 10.392 6.628 -6.388 1.00 0.53 C ATOM 269 O LYS A 21 9.359 7.028 -6.888 1.00 0.51 O ATOM 270 CB LYS A 21 12.641 7.653 -6.651 1.00 0.72 C ATOM 271 CG LYS A 21 13.636 8.683 -6.105 1.00 1.09 C ATOM 272 CD LYS A 21 14.811 8.840 -7.084 1.00 1.24 C ATOM 273 CE LYS A 21 15.738 7.620 -7.008 1.00 1.80 C ATOM 274 NZ LYS A 21 17.024 7.934 -7.694 1.00 2.40 N ATOM 0 H LYS A 21 12.783 6.935 -4.287 1.00 0.57 H new ATOM 0 HA LYS A 21 10.940 8.582 -5.669 1.00 0.61 H new ATOM 0 HB2 LYS A 21 13.111 6.670 -6.695 1.00 0.72 H new ATOM 0 HB3 LYS A 21 12.356 7.916 -7.670 1.00 0.72 H new ATOM 0 HG2 LYS A 21 13.139 9.642 -5.962 1.00 1.09 H new ATOM 0 HG3 LYS A 21 14.003 8.366 -5.129 1.00 1.09 H new ATOM 0 HD2 LYS A 21 14.433 8.955 -8.100 1.00 1.24 H new ATOM 0 HD3 LYS A 21 15.371 9.745 -6.848 1.00 1.24 H new ATOM 0 HE2 LYS A 21 15.923 7.354 -5.967 1.00 1.80 H new ATOM 0 HE3 LYS A 21 15.263 6.758 -7.477 1.00 1.80 H new ATOM 0 HZ1 LYS A 21 17.655 7.109 -7.644 1.00 2.40 H new ATOM 0 HZ2 LYS A 21 16.838 8.168 -8.690 1.00 2.40 H new ATOM 0 HZ3 LYS A 21 17.478 8.745 -7.227 1.00 2.40 H new ATOM 288 N THR A 22 10.691 5.355 -6.387 1.00 0.53 N ATOM 289 CA THR A 22 9.760 4.366 -7.005 1.00 0.52 C ATOM 290 C THR A 22 8.470 4.272 -6.179 1.00 0.45 C ATOM 291 O THR A 22 7.385 4.165 -6.714 1.00 0.48 O ATOM 292 CB THR A 22 10.458 2.992 -7.054 1.00 0.55 C ATOM 293 OG1 THR A 22 11.853 3.186 -7.243 1.00 0.64 O ATOM 294 CG2 THR A 22 9.903 2.155 -8.211 1.00 0.62 C ATOM 0 H THR A 22 11.540 4.958 -5.985 1.00 0.53 H new ATOM 0 HA THR A 22 9.501 4.684 -8.015 1.00 0.52 H new ATOM 0 HB THR A 22 10.276 2.466 -6.117 1.00 0.55 H new ATOM 0 HG1 THR A 22 12.299 3.228 -6.371 1.00 0.64 H new ATOM 0 HG21 THR A 22 10.405 1.188 -8.234 1.00 0.62 H new ATOM 0 HG22 THR A 22 8.832 2.005 -8.071 1.00 0.62 H new ATOM 0 HG23 THR A 22 10.076 2.676 -9.153 1.00 0.62 H new ATOM 302 N GLY A 23 8.583 4.305 -4.880 1.00 0.42 N ATOM 303 CA GLY A 23 7.370 4.211 -4.014 1.00 0.43 C ATOM 304 C GLY A 23 6.410 5.368 -4.315 1.00 0.41 C ATOM 305 O GLY A 23 5.317 5.162 -4.810 1.00 0.47 O ATOM 0 H GLY A 23 9.466 4.393 -4.377 1.00 0.42 H new ATOM 0 HA2 GLY A 23 6.867 3.259 -4.183 1.00 0.43 H new ATOM 0 HA3 GLY A 23 7.662 4.235 -2.964 1.00 0.43 H new ATOM 309 N ALA A 24 6.803 6.578 -4.032 1.00 0.40 N ATOM 310 CA ALA A 24 5.909 7.738 -4.316 1.00 0.41 C ATOM 311 C ALA A 24 5.430 7.690 -5.763 1.00 0.41 C ATOM 312 O ALA A 24 4.419 8.266 -6.112 1.00 0.41 O ATOM 313 CB ALA A 24 6.689 9.037 -4.118 1.00 0.42 C ATOM 0 H ALA A 24 7.704 6.815 -3.617 1.00 0.40 H new ATOM 0 HA ALA A 24 5.055 7.694 -3.641 1.00 0.41 H new ATOM 0 HB1 ALA A 24 6.039 9.887 -4.325 1.00 0.42 H new ATOM 0 HB2 ALA A 24 7.045 9.094 -3.089 1.00 0.42 H new ATOM 0 HB3 ALA A 24 7.540 9.058 -4.798 1.00 0.42 H new ATOM 319 N LEU A 25 6.159 7.013 -6.617 1.00 0.42 N ATOM 320 CA LEU A 25 5.741 6.946 -8.047 1.00 0.44 C ATOM 321 C LEU A 25 4.660 5.873 -8.186 1.00 0.44 C ATOM 322 O LEU A 25 3.657 6.084 -8.836 1.00 0.46 O ATOM 323 CB LEU A 25 6.958 6.628 -8.946 1.00 0.47 C ATOM 324 CG LEU A 25 7.541 7.912 -9.585 1.00 0.77 C ATOM 325 CD1 LEU A 25 6.667 8.355 -10.772 1.00 1.58 C ATOM 326 CD2 LEU A 25 7.639 9.050 -8.544 1.00 1.67 C ATOM 0 H LEU A 25 7.016 6.510 -6.387 1.00 0.42 H new ATOM 0 HA LEU A 25 5.339 7.907 -8.366 1.00 0.44 H new ATOM 0 HB2 LEU A 25 7.728 6.132 -8.356 1.00 0.47 H new ATOM 0 HB3 LEU A 25 6.660 5.932 -9.731 1.00 0.47 H new ATOM 0 HG LEU A 25 8.546 7.690 -9.944 1.00 0.77 H new ATOM 0 HD11 LEU A 25 7.085 9.259 -11.215 1.00 1.58 H new ATOM 0 HD12 LEU A 25 6.641 7.563 -11.520 1.00 1.58 H new ATOM 0 HD13 LEU A 25 5.654 8.557 -10.423 1.00 1.58 H new ATOM 0 HD21 LEU A 25 8.051 9.941 -9.017 1.00 1.67 H new ATOM 0 HD22 LEU A 25 6.646 9.273 -8.154 1.00 1.67 H new ATOM 0 HD23 LEU A 25 8.289 8.740 -7.726 1.00 1.67 H new ATOM 338 N LEU A 26 4.874 4.705 -7.623 1.00 0.45 N ATOM 339 CA LEU A 26 3.863 3.615 -7.779 1.00 0.47 C ATOM 340 C LEU A 26 2.468 4.194 -7.522 1.00 0.49 C ATOM 341 O LEU A 26 1.596 4.112 -8.363 1.00 0.52 O ATOM 342 CB LEU A 26 4.163 2.457 -6.792 1.00 0.51 C ATOM 343 CG LEU A 26 4.814 1.264 -7.503 1.00 0.69 C ATOM 344 CD1 LEU A 26 6.263 1.606 -7.857 1.00 1.17 C ATOM 345 CD2 LEU A 26 4.796 0.053 -6.562 1.00 1.35 C ATOM 0 H LEU A 26 5.696 4.464 -7.069 1.00 0.45 H new ATOM 0 HA LEU A 26 3.908 3.213 -8.791 1.00 0.47 H new ATOM 0 HB2 LEU A 26 4.822 2.814 -6.001 1.00 0.51 H new ATOM 0 HB3 LEU A 26 3.237 2.136 -6.315 1.00 0.51 H new ATOM 0 HG LEU A 26 4.263 1.036 -8.415 1.00 0.69 H new ATOM 0 HD11 LEU A 26 6.724 0.757 -8.362 1.00 1.17 H new ATOM 0 HD12 LEU A 26 6.281 2.474 -8.516 1.00 1.17 H new ATOM 0 HD13 LEU A 26 6.817 1.830 -6.946 1.00 1.17 H new ATOM 0 HD21 LEU A 26 5.257 -0.801 -7.059 1.00 1.35 H new ATOM 0 HD22 LEU A 26 5.352 0.289 -5.655 1.00 1.35 H new ATOM 0 HD23 LEU A 26 3.766 -0.191 -6.303 1.00 1.35 H new ATOM 357 N LEU A 27 2.238 4.758 -6.375 1.00 0.50 N ATOM 358 CA LEU A 27 0.877 5.301 -6.121 1.00 0.56 C ATOM 359 C LEU A 27 0.540 6.324 -7.212 1.00 0.56 C ATOM 360 O LEU A 27 -0.500 6.256 -7.829 1.00 0.60 O ATOM 361 CB LEU A 27 0.764 5.959 -4.724 1.00 0.64 C ATOM 362 CG LEU A 27 1.916 5.531 -3.816 1.00 0.95 C ATOM 363 CD1 LEU A 27 1.830 6.328 -2.516 1.00 1.66 C ATOM 364 CD2 LEU A 27 1.798 4.036 -3.505 1.00 1.42 C ATOM 0 H LEU A 27 2.913 4.866 -5.618 1.00 0.50 H new ATOM 0 HA LEU A 27 0.168 4.473 -6.144 1.00 0.56 H new ATOM 0 HB2 LEU A 27 0.764 7.044 -4.829 1.00 0.64 H new ATOM 0 HB3 LEU A 27 -0.186 5.684 -4.265 1.00 0.64 H new ATOM 0 HG LEU A 27 2.869 5.718 -4.310 1.00 0.95 H new ATOM 0 HD11 LEU A 27 2.646 6.035 -1.855 1.00 1.66 H new ATOM 0 HD12 LEU A 27 1.906 7.393 -2.736 1.00 1.66 H new ATOM 0 HD13 LEU A 27 0.877 6.126 -2.028 1.00 1.66 H new ATOM 0 HD21 LEU A 27 2.621 3.733 -2.857 1.00 1.42 H new ATOM 0 HD22 LEU A 27 0.850 3.843 -3.002 1.00 1.42 H new ATOM 0 HD23 LEU A 27 1.839 3.467 -4.434 1.00 1.42 H new ATOM 376 N GLN A 28 1.412 7.268 -7.454 1.00 0.55 N ATOM 377 CA GLN A 28 1.130 8.294 -8.500 1.00 0.58 C ATOM 378 C GLN A 28 0.598 7.618 -9.769 1.00 0.54 C ATOM 379 O GLN A 28 -0.309 8.104 -10.415 1.00 0.58 O ATOM 380 CB GLN A 28 2.420 9.046 -8.834 1.00 0.60 C ATOM 381 CG GLN A 28 2.096 10.210 -9.772 1.00 1.00 C ATOM 382 CD GLN A 28 3.314 11.126 -9.895 1.00 1.40 C ATOM 383 OE1 GLN A 28 4.227 10.845 -10.646 1.00 2.09 O ATOM 384 NE2 GLN A 28 3.367 12.220 -9.185 1.00 1.91 N ATOM 0 H GLN A 28 2.305 7.372 -6.973 1.00 0.55 H new ATOM 0 HA GLN A 28 0.381 8.990 -8.123 1.00 0.58 H new ATOM 0 HB2 GLN A 28 2.885 9.418 -7.921 1.00 0.60 H new ATOM 0 HB3 GLN A 28 3.136 8.372 -9.305 1.00 0.60 H new ATOM 0 HG2 GLN A 28 1.813 9.831 -10.754 1.00 1.00 H new ATOM 0 HG3 GLN A 28 1.244 10.772 -9.390 1.00 1.00 H new ATOM 0 HE21 GLN A 28 2.601 12.456 -8.554 1.00 1.91 H new ATOM 0 HE22 GLN A 28 4.175 12.839 -9.261 1.00 1.91 H new ATOM 393 N GLY A 29 1.176 6.503 -10.133 1.00 0.50 N ATOM 394 CA GLY A 29 0.732 5.786 -11.364 1.00 0.48 C ATOM 395 C GLY A 29 -0.492 4.922 -11.056 1.00 0.44 C ATOM 396 O GLY A 29 -1.548 5.101 -11.630 1.00 0.50 O ATOM 0 H GLY A 29 1.941 6.056 -9.627 1.00 0.50 H new ATOM 0 HA2 GLY A 29 0.491 6.506 -12.147 1.00 0.48 H new ATOM 0 HA3 GLY A 29 1.541 5.162 -11.743 1.00 0.48 H new ATOM 400 N PHE A 30 -0.363 3.979 -10.161 1.00 0.44 N ATOM 401 CA PHE A 30 -1.528 3.109 -9.836 1.00 0.43 C ATOM 402 C PHE A 30 -2.727 3.993 -9.472 1.00 0.40 C ATOM 403 O PHE A 30 -3.849 3.691 -9.826 1.00 0.43 O ATOM 404 CB PHE A 30 -1.168 2.164 -8.673 1.00 0.47 C ATOM 405 CG PHE A 30 -2.426 1.647 -8.002 1.00 0.47 C ATOM 406 CD1 PHE A 30 -3.389 0.965 -8.757 1.00 1.20 C ATOM 407 CD2 PHE A 30 -2.630 1.853 -6.631 1.00 1.39 C ATOM 408 CE1 PHE A 30 -4.554 0.491 -8.142 1.00 1.21 C ATOM 409 CE2 PHE A 30 -3.793 1.378 -6.018 1.00 1.42 C ATOM 410 CZ PHE A 30 -4.756 0.697 -6.772 1.00 0.58 C ATOM 0 H PHE A 30 0.493 3.775 -9.645 1.00 0.44 H new ATOM 0 HA PHE A 30 -1.789 2.498 -10.700 1.00 0.43 H new ATOM 0 HB2 PHE A 30 -0.577 1.327 -9.046 1.00 0.47 H new ATOM 0 HB3 PHE A 30 -0.551 2.691 -7.946 1.00 0.47 H new ATOM 0 HD1 PHE A 30 -3.233 0.805 -9.814 1.00 1.20 H new ATOM 0 HD2 PHE A 30 -1.889 2.379 -6.048 1.00 1.39 H new ATOM 0 HE1 PHE A 30 -5.297 -0.034 -8.724 1.00 1.21 H new ATOM 0 HE2 PHE A 30 -3.949 1.537 -4.961 1.00 1.42 H new ATOM 0 HZ PHE A 30 -5.654 0.331 -6.297 1.00 0.58 H new ATOM 420 N ILE A 31 -2.517 5.087 -8.791 1.00 0.40 N ATOM 421 CA ILE A 31 -3.679 5.956 -8.455 1.00 0.40 C ATOM 422 C ILE A 31 -4.159 6.621 -9.752 1.00 0.40 C ATOM 423 O ILE A 31 -5.320 6.552 -10.102 1.00 0.43 O ATOM 424 CB ILE A 31 -3.271 7.012 -7.414 1.00 0.41 C ATOM 425 CG1 ILE A 31 -2.944 6.319 -6.088 1.00 0.53 C ATOM 426 CG2 ILE A 31 -4.420 7.998 -7.214 1.00 0.72 C ATOM 427 CD1 ILE A 31 -2.331 7.330 -5.117 1.00 0.48 C ATOM 0 H ILE A 31 -1.609 5.412 -8.458 1.00 0.40 H new ATOM 0 HA ILE A 31 -4.486 5.365 -8.021 1.00 0.40 H new ATOM 0 HB ILE A 31 -2.391 7.552 -7.764 1.00 0.41 H new ATOM 0 HG12 ILE A 31 -3.849 5.889 -5.658 1.00 0.53 H new ATOM 0 HG13 ILE A 31 -2.250 5.496 -6.258 1.00 0.53 H new ATOM 0 HG21 ILE A 31 -4.132 8.747 -6.476 1.00 0.72 H new ATOM 0 HG22 ILE A 31 -4.647 8.489 -8.160 1.00 0.72 H new ATOM 0 HG23 ILE A 31 -5.302 7.463 -6.862 1.00 0.72 H new ATOM 0 HD11 ILE A 31 -2.099 6.835 -4.174 1.00 0.48 H new ATOM 0 HD12 ILE A 31 -1.416 7.739 -5.547 1.00 0.48 H new ATOM 0 HD13 ILE A 31 -3.040 8.138 -4.937 1.00 0.48 H new ATOM 439 N GLN A 32 -3.273 7.250 -10.476 1.00 0.42 N ATOM 440 CA GLN A 32 -3.673 7.902 -11.758 1.00 0.47 C ATOM 441 C GLN A 32 -4.442 6.910 -12.642 1.00 0.50 C ATOM 442 O GLN A 32 -5.533 7.195 -13.093 1.00 0.61 O ATOM 443 CB GLN A 32 -2.415 8.382 -12.496 1.00 0.57 C ATOM 444 CG GLN A 32 -1.955 9.725 -11.917 1.00 1.19 C ATOM 445 CD GLN A 32 -2.863 10.843 -12.433 1.00 1.59 C ATOM 446 OE1 GLN A 32 -3.729 11.316 -11.723 1.00 2.16 O ATOM 447 NE2 GLN A 32 -2.703 11.288 -13.650 1.00 2.21 N ATOM 0 H GLN A 32 -2.286 7.341 -10.235 1.00 0.42 H new ATOM 0 HA GLN A 32 -4.320 8.752 -11.540 1.00 0.47 H new ATOM 0 HB2 GLN A 32 -1.620 7.642 -12.399 1.00 0.57 H new ATOM 0 HB3 GLN A 32 -2.624 8.487 -13.561 1.00 0.57 H new ATOM 0 HG2 GLN A 32 -1.984 9.692 -10.828 1.00 1.19 H new ATOM 0 HG3 GLN A 32 -0.921 9.921 -12.202 1.00 1.19 H new ATOM 0 HE21 GLN A 32 -1.977 10.892 -14.247 1.00 2.21 H new ATOM 0 HE22 GLN A 32 -3.304 12.032 -14.004 1.00 2.21 H new ATOM 456 N ASP A 33 -3.896 5.751 -12.897 1.00 0.49 N ATOM 457 CA ASP A 33 -4.619 4.765 -13.754 1.00 0.58 C ATOM 458 C ASP A 33 -6.021 4.545 -13.191 1.00 0.61 C ATOM 459 O ASP A 33 -6.993 4.462 -13.915 1.00 0.70 O ATOM 460 CB ASP A 33 -3.857 3.438 -13.758 1.00 0.61 C ATOM 461 CG ASP A 33 -2.494 3.637 -14.423 1.00 1.10 C ATOM 462 OD1 ASP A 33 -1.816 4.586 -14.067 1.00 1.89 O ATOM 463 OD2 ASP A 33 -2.152 2.837 -15.279 1.00 1.78 O ATOM 0 H ASP A 33 -2.986 5.445 -12.552 1.00 0.49 H new ATOM 0 HA ASP A 33 -4.688 5.145 -14.773 1.00 0.58 H new ATOM 0 HB2 ASP A 33 -3.727 3.078 -12.738 1.00 0.61 H new ATOM 0 HB3 ASP A 33 -4.428 2.680 -14.294 1.00 0.61 H new ATOM 468 N ARG A 34 -6.127 4.464 -11.897 1.00 0.58 N ATOM 469 CA ARG A 34 -7.455 4.264 -11.257 1.00 0.71 C ATOM 470 C ARG A 34 -8.273 5.553 -11.365 1.00 0.65 C ATOM 471 O ARG A 34 -9.436 5.524 -11.719 1.00 0.85 O ATOM 472 CB ARG A 34 -7.250 3.890 -9.780 1.00 0.85 C ATOM 473 CG ARG A 34 -7.011 2.372 -9.655 1.00 1.25 C ATOM 474 CD ARG A 34 -8.321 1.579 -9.882 1.00 1.31 C ATOM 475 NE ARG A 34 -8.250 0.875 -11.194 1.00 1.58 N ATOM 476 CZ ARG A 34 -9.091 -0.086 -11.464 1.00 2.09 C ATOM 477 NH1 ARG A 34 -9.993 -0.429 -10.585 1.00 2.58 N ATOM 478 NH2 ARG A 34 -9.031 -0.705 -12.612 1.00 2.75 N ATOM 0 H ARG A 34 -5.343 4.528 -11.248 1.00 0.58 H new ATOM 0 HA ARG A 34 -7.993 3.461 -11.761 1.00 0.71 H new ATOM 0 HB2 ARG A 34 -6.400 4.436 -9.371 1.00 0.85 H new ATOM 0 HB3 ARG A 34 -8.125 4.179 -9.197 1.00 0.85 H new ATOM 0 HG2 ARG A 34 -6.262 2.058 -10.382 1.00 1.25 H new ATOM 0 HG3 ARG A 34 -6.611 2.144 -8.667 1.00 1.25 H new ATOM 0 HD2 ARG A 34 -8.468 0.859 -9.077 1.00 1.31 H new ATOM 0 HD3 ARG A 34 -9.176 2.255 -9.865 1.00 1.31 H new ATOM 0 HE ARG A 34 -7.545 1.144 -11.880 1.00 1.58 H new ATOM 0 HH11 ARG A 34 -10.040 0.054 -9.688 1.00 2.58 H new ATOM 0 HH12 ARG A 34 -10.651 -1.180 -10.795 1.00 2.58 H new ATOM 0 HH21 ARG A 34 -8.326 -0.438 -13.299 1.00 2.75 H new ATOM 0 HH22 ARG A 34 -9.689 -1.456 -12.822 1.00 2.75 H new ATOM 492 N ALA A 35 -7.699 6.686 -11.070 1.00 0.59 N ATOM 493 CA ALA A 35 -8.466 7.961 -11.164 1.00 0.66 C ATOM 494 C ALA A 35 -8.921 8.207 -12.603 1.00 0.80 C ATOM 495 O ALA A 35 -10.052 8.565 -12.865 1.00 0.88 O ATOM 496 CB ALA A 35 -7.541 9.104 -10.742 1.00 0.94 C ATOM 0 H ALA A 35 -6.730 6.785 -10.767 1.00 0.59 H new ATOM 0 HA ALA A 35 -9.344 7.905 -10.521 1.00 0.66 H new ATOM 0 HB1 ALA A 35 -8.080 10.049 -10.802 1.00 0.94 H new ATOM 0 HB2 ALA A 35 -7.206 8.942 -9.717 1.00 0.94 H new ATOM 0 HB3 ALA A 35 -6.677 9.136 -11.405 1.00 0.94 H new ATOM 751 N ALA A 54 9.836 1.282 -17.346 1.00 0.91 N ATOM 752 CA ALA A 54 9.469 -0.122 -17.682 1.00 0.84 C ATOM 753 C ALA A 54 9.362 -0.944 -16.398 1.00 0.76 C ATOM 754 O ALA A 54 8.559 -1.850 -16.293 1.00 0.75 O ATOM 755 CB ALA A 54 10.527 -0.730 -18.603 1.00 0.95 C ATOM 0 HA ALA A 54 8.507 -0.130 -18.195 1.00 0.84 H new ATOM 0 HB1 ALA A 54 10.252 -1.757 -18.845 1.00 0.95 H new ATOM 0 HB2 ALA A 54 10.590 -0.145 -19.521 1.00 0.95 H new ATOM 0 HB3 ALA A 54 11.494 -0.722 -18.101 1.00 0.95 H new ATOM 761 N SER A 55 10.156 -0.627 -15.414 1.00 0.75 N ATOM 762 CA SER A 55 10.092 -1.379 -14.132 1.00 0.71 C ATOM 763 C SER A 55 8.837 -0.963 -13.369 1.00 0.66 C ATOM 764 O SER A 55 8.130 -1.783 -12.818 1.00 0.66 O ATOM 765 CB SER A 55 11.322 -1.052 -13.285 1.00 0.76 C ATOM 766 OG SER A 55 12.491 -1.486 -13.967 1.00 1.37 O ATOM 0 H SER A 55 10.848 0.122 -15.443 1.00 0.75 H new ATOM 0 HA SER A 55 10.065 -2.449 -14.339 1.00 0.71 H new ATOM 0 HB2 SER A 55 11.374 0.020 -13.097 1.00 0.76 H new ATOM 0 HB3 SER A 55 11.250 -1.543 -12.314 1.00 0.76 H new ATOM 0 HG SER A 55 13.282 -1.276 -13.427 1.00 1.37 H new ATOM 772 N THR A 56 8.574 0.313 -13.306 1.00 0.65 N ATOM 773 CA THR A 56 7.385 0.794 -12.550 1.00 0.62 C ATOM 774 C THR A 56 6.110 0.536 -13.363 1.00 0.59 C ATOM 775 O THR A 56 5.040 0.346 -12.815 1.00 0.57 O ATOM 776 CB THR A 56 7.553 2.304 -12.276 1.00 0.67 C ATOM 777 OG1 THR A 56 8.936 2.624 -12.282 1.00 1.09 O ATOM 778 CG2 THR A 56 6.963 2.669 -10.914 1.00 1.06 C ATOM 0 H THR A 56 9.132 1.044 -13.746 1.00 0.65 H new ATOM 0 HA THR A 56 7.301 0.259 -11.604 1.00 0.62 H new ATOM 0 HB THR A 56 7.030 2.865 -13.050 1.00 0.67 H new ATOM 0 HG1 THR A 56 9.051 3.582 -12.110 1.00 1.09 H new ATOM 0 HG21 THR A 56 7.090 3.737 -10.737 1.00 1.06 H new ATOM 0 HG22 THR A 56 5.901 2.422 -10.899 1.00 1.06 H new ATOM 0 HG23 THR A 56 7.476 2.108 -10.133 1.00 1.06 H new ATOM 786 N LYS A 57 6.211 0.539 -14.662 1.00 0.61 N ATOM 787 CA LYS A 57 5.000 0.309 -15.497 1.00 0.59 C ATOM 788 C LYS A 57 4.464 -1.104 -15.253 1.00 0.54 C ATOM 789 O LYS A 57 3.269 -1.316 -15.145 1.00 0.52 O ATOM 790 CB LYS A 57 5.360 0.482 -16.973 1.00 0.65 C ATOM 791 CG LYS A 57 4.135 0.191 -17.841 1.00 1.20 C ATOM 792 CD LYS A 57 4.392 0.676 -19.271 1.00 1.33 C ATOM 793 CE LYS A 57 5.581 -0.084 -19.871 1.00 1.94 C ATOM 794 NZ LYS A 57 5.567 0.064 -21.353 1.00 2.73 N ATOM 0 H LYS A 57 7.076 0.690 -15.180 1.00 0.61 H new ATOM 0 HA LYS A 57 4.230 1.031 -15.227 1.00 0.59 H new ATOM 0 HB2 LYS A 57 5.713 1.497 -17.154 1.00 0.65 H new ATOM 0 HB3 LYS A 57 6.175 -0.191 -17.240 1.00 0.65 H new ATOM 0 HG2 LYS A 57 3.923 -0.878 -17.841 1.00 1.20 H new ATOM 0 HG3 LYS A 57 3.258 0.690 -17.429 1.00 1.20 H new ATOM 0 HD2 LYS A 57 3.503 0.521 -19.883 1.00 1.33 H new ATOM 0 HD3 LYS A 57 4.596 1.747 -19.271 1.00 1.33 H new ATOM 0 HE2 LYS A 57 6.516 0.302 -19.465 1.00 1.94 H new ATOM 0 HE3 LYS A 57 5.527 -1.138 -19.599 1.00 1.94 H new ATOM 0 HZ1 LYS A 57 6.373 -0.451 -21.761 1.00 2.73 H new ATOM 0 HZ2 LYS A 57 4.680 -0.325 -21.732 1.00 2.73 H new ATOM 0 HZ3 LYS A 57 5.638 1.071 -21.602 1.00 2.73 H new ATOM 808 N LYS A 58 5.327 -2.079 -15.161 1.00 0.55 N ATOM 809 CA LYS A 58 4.834 -3.463 -14.925 1.00 0.53 C ATOM 810 C LYS A 58 4.317 -3.571 -13.489 1.00 0.48 C ATOM 811 O LYS A 58 3.299 -4.184 -13.242 1.00 0.46 O ATOM 812 CB LYS A 58 5.959 -4.472 -15.160 1.00 0.56 C ATOM 813 CG LYS A 58 5.403 -5.891 -15.004 1.00 0.78 C ATOM 814 CD LYS A 58 6.393 -6.912 -15.574 1.00 0.96 C ATOM 815 CE LYS A 58 5.697 -8.267 -15.696 1.00 0.85 C ATOM 816 NZ LYS A 58 5.144 -8.662 -14.370 1.00 1.75 N ATOM 0 H LYS A 58 6.339 -1.979 -15.238 1.00 0.55 H new ATOM 0 HA LYS A 58 4.024 -3.685 -15.620 1.00 0.53 H new ATOM 0 HB2 LYS A 58 6.379 -4.341 -16.157 1.00 0.56 H new ATOM 0 HB3 LYS A 58 6.768 -4.305 -14.449 1.00 0.56 H new ATOM 0 HG2 LYS A 58 5.217 -6.103 -13.951 1.00 0.78 H new ATOM 0 HG3 LYS A 58 4.446 -5.974 -15.520 1.00 0.78 H new ATOM 0 HD2 LYS A 58 6.752 -6.584 -16.550 1.00 0.96 H new ATOM 0 HD3 LYS A 58 7.265 -6.994 -14.925 1.00 0.96 H new ATOM 0 HE2 LYS A 58 4.897 -8.212 -16.434 1.00 0.85 H new ATOM 0 HE3 LYS A 58 6.403 -9.020 -16.047 1.00 0.85 H new ATOM 0 HZ1 LYS A 58 5.337 -9.670 -14.199 1.00 1.75 H new ATOM 0 HZ2 LYS A 58 5.591 -8.092 -13.624 1.00 1.75 H new ATOM 0 HZ3 LYS A 58 4.117 -8.500 -14.360 1.00 1.75 H new ATOM 830 N LEU A 59 4.999 -3.013 -12.528 1.00 0.50 N ATOM 831 CA LEU A 59 4.489 -3.150 -11.137 1.00 0.47 C ATOM 832 C LEU A 59 3.089 -2.530 -11.059 1.00 0.43 C ATOM 833 O LEU A 59 2.329 -2.792 -10.148 1.00 0.42 O ATOM 834 CB LEU A 59 5.427 -2.471 -10.134 1.00 0.53 C ATOM 835 CG LEU A 59 6.791 -3.175 -10.113 1.00 0.71 C ATOM 836 CD1 LEU A 59 7.758 -2.351 -9.257 1.00 1.07 C ATOM 837 CD2 LEU A 59 6.655 -4.593 -9.523 1.00 1.34 C ATOM 0 H LEU A 59 5.863 -2.483 -12.639 1.00 0.50 H new ATOM 0 HA LEU A 59 4.442 -4.208 -10.879 1.00 0.47 H new ATOM 0 HB2 LEU A 59 5.556 -1.422 -10.401 1.00 0.53 H new ATOM 0 HB3 LEU A 59 4.983 -2.495 -9.139 1.00 0.53 H new ATOM 0 HG LEU A 59 7.170 -3.259 -11.131 1.00 0.71 H new ATOM 0 HD11 LEU A 59 8.731 -2.841 -9.234 1.00 1.07 H new ATOM 0 HD12 LEU A 59 7.863 -1.354 -9.685 1.00 1.07 H new ATOM 0 HD13 LEU A 59 7.368 -2.271 -8.242 1.00 1.07 H new ATOM 0 HD21 LEU A 59 7.631 -5.079 -9.515 1.00 1.34 H new ATOM 0 HD22 LEU A 59 6.274 -4.528 -8.504 1.00 1.34 H new ATOM 0 HD23 LEU A 59 5.964 -5.176 -10.132 1.00 1.34 H new ATOM 849 N SER A 60 2.733 -1.742 -12.041 1.00 0.43 N ATOM 850 CA SER A 60 1.369 -1.135 -12.066 1.00 0.42 C ATOM 851 C SER A 60 0.379 -2.216 -12.522 1.00 0.39 C ATOM 852 O SER A 60 -0.705 -2.350 -11.988 1.00 0.41 O ATOM 853 CB SER A 60 1.358 0.027 -13.062 1.00 0.47 C ATOM 854 OG SER A 60 0.174 0.792 -12.879 1.00 1.36 O ATOM 0 H SER A 60 3.331 -1.492 -12.829 1.00 0.43 H new ATOM 0 HA SER A 60 1.092 -0.763 -11.080 1.00 0.42 H new ATOM 0 HB2 SER A 60 2.237 0.655 -12.915 1.00 0.47 H new ATOM 0 HB3 SER A 60 1.405 -0.353 -14.082 1.00 0.47 H new ATOM 0 HG SER A 60 0.165 1.538 -13.515 1.00 1.36 H new ATOM 860 N GLU A 61 0.774 -3.010 -13.483 1.00 0.38 N ATOM 861 CA GLU A 61 -0.101 -4.123 -13.966 1.00 0.38 C ATOM 862 C GLU A 61 -0.510 -5.006 -12.783 1.00 0.38 C ATOM 863 O GLU A 61 -1.631 -5.463 -12.708 1.00 0.41 O ATOM 864 CB GLU A 61 0.675 -4.987 -14.978 1.00 0.39 C ATOM 865 CG GLU A 61 0.595 -4.361 -16.371 1.00 1.06 C ATOM 866 CD GLU A 61 1.180 -2.948 -16.332 1.00 1.67 C ATOM 867 OE1 GLU A 61 0.554 -2.085 -15.740 1.00 2.40 O ATOM 868 OE2 GLU A 61 2.244 -2.754 -16.896 1.00 2.25 O ATOM 0 H GLU A 61 1.673 -2.935 -13.959 1.00 0.38 H new ATOM 0 HA GLU A 61 -0.987 -3.699 -14.438 1.00 0.38 H new ATOM 0 HB2 GLU A 61 1.717 -5.075 -14.670 1.00 0.39 H new ATOM 0 HB3 GLU A 61 0.262 -5.996 -14.999 1.00 0.39 H new ATOM 0 HG2 GLU A 61 1.143 -4.973 -17.088 1.00 1.06 H new ATOM 0 HG3 GLU A 61 -0.441 -4.327 -16.707 1.00 1.06 H new ATOM 875 N CYS A 62 0.368 -5.248 -11.856 1.00 0.37 N ATOM 876 CA CYS A 62 -0.020 -6.102 -10.700 1.00 0.39 C ATOM 877 C CYS A 62 -1.045 -5.350 -9.851 1.00 0.38 C ATOM 878 O CYS A 62 -2.035 -5.905 -9.416 1.00 0.44 O ATOM 879 CB CYS A 62 1.214 -6.424 -9.856 1.00 0.41 C ATOM 880 SG CYS A 62 2.368 -7.419 -10.834 1.00 1.62 S ATOM 0 H CYS A 62 1.326 -4.898 -11.845 1.00 0.37 H new ATOM 0 HA CYS A 62 -0.453 -7.035 -11.061 1.00 0.39 H new ATOM 0 HB2 CYS A 62 1.696 -5.502 -9.531 1.00 0.41 H new ATOM 0 HB3 CYS A 62 0.922 -6.965 -8.956 1.00 0.41 H new ATOM 0 HG CYS A 62 3.419 -7.692 -10.119 1.00 1.62 H new ATOM 886 N LEU A 63 -0.829 -4.084 -9.637 1.00 0.35 N ATOM 887 CA LEU A 63 -1.797 -3.276 -8.844 1.00 0.36 C ATOM 888 C LEU A 63 -3.064 -3.049 -9.677 1.00 0.36 C ATOM 889 O LEU A 63 -4.127 -2.791 -9.147 1.00 0.41 O ATOM 890 CB LEU A 63 -1.150 -1.927 -8.494 1.00 0.38 C ATOM 891 CG LEU A 63 -0.185 -2.100 -7.298 1.00 0.69 C ATOM 892 CD1 LEU A 63 0.902 -1.022 -7.343 1.00 1.39 C ATOM 893 CD2 LEU A 63 -0.952 -1.971 -5.974 1.00 1.11 C ATOM 0 H LEU A 63 -0.018 -3.570 -9.980 1.00 0.35 H new ATOM 0 HA LEU A 63 -2.062 -3.800 -7.926 1.00 0.36 H new ATOM 0 HB2 LEU A 63 -0.608 -1.539 -9.357 1.00 0.38 H new ATOM 0 HB3 LEU A 63 -1.921 -1.197 -8.248 1.00 0.38 H new ATOM 0 HG LEU A 63 0.270 -3.089 -7.363 1.00 0.69 H new ATOM 0 HD11 LEU A 63 1.577 -1.151 -6.497 1.00 1.39 H new ATOM 0 HD12 LEU A 63 1.464 -1.110 -8.273 1.00 1.39 H new ATOM 0 HD13 LEU A 63 0.439 -0.036 -7.291 1.00 1.39 H new ATOM 0 HD21 LEU A 63 -0.261 -2.095 -5.140 1.00 1.11 H new ATOM 0 HD22 LEU A 63 -1.417 -0.987 -5.917 1.00 1.11 H new ATOM 0 HD23 LEU A 63 -1.723 -2.740 -5.924 1.00 1.11 H new ATOM 905 N LYS A 64 -2.958 -3.124 -10.979 1.00 0.35 N ATOM 906 CA LYS A 64 -4.154 -2.893 -11.842 1.00 0.37 C ATOM 907 C LYS A 64 -4.932 -4.203 -12.028 1.00 0.39 C ATOM 908 O LYS A 64 -6.139 -4.244 -11.896 1.00 0.43 O ATOM 909 CB LYS A 64 -3.692 -2.364 -13.201 1.00 0.38 C ATOM 910 CG LYS A 64 -4.908 -1.906 -14.013 1.00 0.82 C ATOM 911 CD LYS A 64 -4.459 -1.112 -15.255 1.00 1.35 C ATOM 912 CE LYS A 64 -5.580 -0.166 -15.693 1.00 1.38 C ATOM 913 NZ LYS A 64 -6.811 -0.953 -15.988 1.00 2.09 N ATOM 0 H LYS A 64 -2.095 -3.335 -11.481 1.00 0.35 H new ATOM 0 HA LYS A 64 -4.810 -2.164 -11.367 1.00 0.37 H new ATOM 0 HB2 LYS A 64 -3.000 -1.533 -13.063 1.00 0.38 H new ATOM 0 HB3 LYS A 64 -3.153 -3.142 -13.742 1.00 0.38 H new ATOM 0 HG2 LYS A 64 -5.495 -2.772 -14.320 1.00 0.82 H new ATOM 0 HG3 LYS A 64 -5.555 -1.286 -13.392 1.00 0.82 H new ATOM 0 HD2 LYS A 64 -3.557 -0.543 -15.029 1.00 1.35 H new ATOM 0 HD3 LYS A 64 -4.209 -1.796 -16.066 1.00 1.35 H new ATOM 0 HE2 LYS A 64 -5.782 0.563 -14.908 1.00 1.38 H new ATOM 0 HE3 LYS A 64 -5.273 0.393 -16.577 1.00 1.38 H new ATOM 0 HZ1 LYS A 64 -7.482 -0.362 -16.519 1.00 2.09 H new ATOM 0 HZ2 LYS A 64 -6.561 -1.788 -16.555 1.00 2.09 H new ATOM 0 HZ3 LYS A 64 -7.250 -1.258 -15.096 1.00 2.09 H new ATOM 927 N ARG A 65 -4.247 -5.269 -12.339 1.00 0.43 N ATOM 928 CA ARG A 65 -4.932 -6.582 -12.543 1.00 0.47 C ATOM 929 C ARG A 65 -5.598 -7.039 -11.237 1.00 0.50 C ATOM 930 O ARG A 65 -6.685 -7.582 -11.240 1.00 0.54 O ATOM 931 CB ARG A 65 -3.885 -7.627 -12.991 1.00 0.45 C ATOM 932 CG ARG A 65 -4.508 -8.604 -14.001 1.00 0.94 C ATOM 933 CD ARG A 65 -5.734 -9.294 -13.382 1.00 1.55 C ATOM 934 NE ARG A 65 -5.909 -10.654 -13.985 1.00 1.86 N ATOM 935 CZ ARG A 65 -5.894 -10.832 -15.282 1.00 2.39 C ATOM 936 NH1 ARG A 65 -5.910 -9.811 -16.094 1.00 2.94 N ATOM 937 NH2 ARG A 65 -5.924 -12.042 -15.768 1.00 2.92 N ATOM 0 H ARG A 65 -3.235 -5.289 -12.462 1.00 0.43 H new ATOM 0 HA ARG A 65 -5.702 -6.477 -13.308 1.00 0.47 H new ATOM 0 HB2 ARG A 65 -3.029 -7.125 -13.441 1.00 0.45 H new ATOM 0 HB3 ARG A 65 -3.514 -8.175 -12.125 1.00 0.45 H new ATOM 0 HG2 ARG A 65 -4.800 -8.068 -14.904 1.00 0.94 H new ATOM 0 HG3 ARG A 65 -3.772 -9.351 -14.298 1.00 0.94 H new ATOM 0 HD2 ARG A 65 -5.609 -9.378 -12.302 1.00 1.55 H new ATOM 0 HD3 ARG A 65 -6.627 -8.692 -13.554 1.00 1.55 H new ATOM 0 HE ARG A 65 -6.043 -11.458 -13.372 1.00 1.86 H new ATOM 0 HH11 ARG A 65 -5.934 -8.862 -15.720 1.00 2.94 H new ATOM 0 HH12 ARG A 65 -5.898 -9.961 -17.103 1.00 2.94 H new ATOM 0 HH21 ARG A 65 -5.959 -12.844 -15.138 1.00 2.92 H new ATOM 0 HH22 ARG A 65 -5.913 -12.186 -16.778 1.00 2.92 H new ATOM 951 N ILE A 66 -4.951 -6.826 -10.126 1.00 0.49 N ATOM 952 CA ILE A 66 -5.537 -7.247 -8.821 1.00 0.53 C ATOM 953 C ILE A 66 -6.656 -6.277 -8.430 1.00 0.54 C ATOM 954 O ILE A 66 -7.753 -6.680 -8.098 1.00 0.60 O ATOM 955 CB ILE A 66 -4.430 -7.231 -7.753 1.00 0.52 C ATOM 956 CG1 ILE A 66 -3.526 -8.453 -7.939 1.00 1.22 C ATOM 957 CG2 ILE A 66 -5.038 -7.255 -6.344 1.00 1.29 C ATOM 958 CD1 ILE A 66 -2.266 -8.286 -7.089 1.00 1.25 C ATOM 0 H ILE A 66 -4.037 -6.377 -10.064 1.00 0.49 H new ATOM 0 HA ILE A 66 -5.952 -8.252 -8.902 1.00 0.53 H new ATOM 0 HB ILE A 66 -3.847 -6.317 -7.866 1.00 0.52 H new ATOM 0 HG12 ILE A 66 -4.057 -9.360 -7.648 1.00 1.22 H new ATOM 0 HG13 ILE A 66 -3.257 -8.564 -8.990 1.00 1.22 H new ATOM 0 HG21 ILE A 66 -4.239 -7.243 -5.603 1.00 1.29 H new ATOM 0 HG22 ILE A 66 -5.673 -6.380 -6.207 1.00 1.29 H new ATOM 0 HG23 ILE A 66 -5.634 -8.159 -6.220 1.00 1.29 H new ATOM 0 HD11 ILE A 66 -1.621 -9.155 -7.220 1.00 1.25 H new ATOM 0 HD12 ILE A 66 -1.733 -7.388 -7.401 1.00 1.25 H new ATOM 0 HD13 ILE A 66 -2.545 -8.196 -6.039 1.00 1.25 H new ATOM 970 N GLY A 67 -6.397 -5.004 -8.494 1.00 0.52 N ATOM 971 CA GLY A 67 -7.448 -4.004 -8.153 1.00 0.55 C ATOM 972 C GLY A 67 -8.724 -4.293 -8.943 1.00 0.53 C ATOM 973 O GLY A 67 -9.804 -4.370 -8.385 1.00 0.63 O ATOM 0 H GLY A 67 -5.498 -4.609 -8.769 1.00 0.52 H new ATOM 0 HA2 GLY A 67 -7.658 -4.036 -7.084 1.00 0.55 H new ATOM 0 HA3 GLY A 67 -7.091 -2.999 -8.378 1.00 0.55 H new ATOM 977 N ASP A 68 -8.623 -4.459 -10.231 1.00 0.54 N ATOM 978 CA ASP A 68 -9.840 -4.743 -11.043 1.00 0.54 C ATOM 979 C ASP A 68 -10.381 -6.134 -10.710 1.00 0.52 C ATOM 980 O ASP A 68 -11.543 -6.421 -10.920 1.00 0.56 O ATOM 981 CB ASP A 68 -9.470 -4.690 -12.527 1.00 0.60 C ATOM 982 CG ASP A 68 -10.721 -4.928 -13.375 1.00 1.43 C ATOM 983 OD1 ASP A 68 -11.781 -4.481 -12.970 1.00 2.20 O ATOM 984 OD2 ASP A 68 -10.596 -5.553 -14.416 1.00 2.12 O ATOM 0 H ASP A 68 -7.751 -4.411 -10.758 1.00 0.54 H new ATOM 0 HA ASP A 68 -10.605 -4.000 -10.818 1.00 0.54 H new ATOM 0 HB2 ASP A 68 -9.033 -3.721 -12.769 1.00 0.60 H new ATOM 0 HB3 ASP A 68 -8.717 -5.445 -12.752 1.00 0.60 H new ATOM 989 N GLU A 69 -9.551 -7.008 -10.199 1.00 0.56 N ATOM 990 CA GLU A 69 -10.024 -8.388 -9.862 1.00 0.56 C ATOM 991 C GLU A 69 -10.438 -8.442 -8.389 1.00 0.55 C ATOM 992 O GLU A 69 -11.154 -9.338 -7.986 1.00 0.73 O ATOM 993 CB GLU A 69 -8.896 -9.390 -10.119 1.00 0.61 C ATOM 994 CG GLU A 69 -9.412 -10.819 -9.916 1.00 0.84 C ATOM 995 CD GLU A 69 -8.438 -11.811 -10.558 1.00 1.65 C ATOM 996 OE1 GLU A 69 -7.244 -11.638 -10.378 1.00 2.48 O ATOM 997 OE2 GLU A 69 -8.903 -12.726 -11.217 1.00 2.23 O ATOM 0 H GLU A 69 -8.567 -6.827 -10.000 1.00 0.56 H new ATOM 0 HA GLU A 69 -10.881 -8.642 -10.485 1.00 0.56 H new ATOM 0 HB2 GLU A 69 -8.517 -9.272 -11.134 1.00 0.61 H new ATOM 0 HB3 GLU A 69 -8.063 -9.195 -9.443 1.00 0.61 H new ATOM 0 HG2 GLU A 69 -9.515 -11.032 -8.852 1.00 0.84 H new ATOM 0 HG3 GLU A 69 -10.402 -10.926 -10.360 1.00 0.84 H new ATOM 1004 N LEU A 70 -9.996 -7.526 -7.566 1.00 0.53 N ATOM 1005 CA LEU A 70 -10.390 -7.604 -6.124 1.00 0.52 C ATOM 1006 C LEU A 70 -11.821 -7.073 -5.967 1.00 0.54 C ATOM 1007 O LEU A 70 -12.543 -7.458 -5.069 1.00 0.60 O ATOM 1008 CB LEU A 70 -9.396 -6.796 -5.262 1.00 0.61 C ATOM 1009 CG LEU A 70 -9.067 -7.545 -3.966 1.00 0.70 C ATOM 1010 CD1 LEU A 70 -8.010 -6.761 -3.187 1.00 1.38 C ATOM 1011 CD2 LEU A 70 -10.329 -7.679 -3.111 1.00 1.61 C ATOM 0 H LEU A 70 -9.393 -6.744 -7.820 1.00 0.53 H new ATOM 0 HA LEU A 70 -10.361 -8.639 -5.784 1.00 0.52 H new ATOM 0 HB2 LEU A 70 -8.481 -6.616 -5.826 1.00 0.61 H new ATOM 0 HB3 LEU A 70 -9.821 -5.821 -5.026 1.00 0.61 H new ATOM 0 HG LEU A 70 -8.689 -8.538 -4.208 1.00 0.70 H new ATOM 0 HD11 LEU A 70 -7.772 -7.289 -2.264 1.00 1.38 H new ATOM 0 HD12 LEU A 70 -7.109 -6.665 -3.793 1.00 1.38 H new ATOM 0 HD13 LEU A 70 -8.395 -5.769 -2.949 1.00 1.38 H new ATOM 0 HD21 LEU A 70 -10.090 -8.212 -2.191 1.00 1.61 H new ATOM 0 HD22 LEU A 70 -10.710 -6.687 -2.867 1.00 1.61 H new ATOM 0 HD23 LEU A 70 -11.087 -8.233 -3.665 1.00 1.61 H new ATOM 1023 N ASP A 71 -12.247 -6.224 -6.863 1.00 0.67 N ATOM 1024 CA ASP A 71 -13.643 -5.711 -6.791 1.00 0.91 C ATOM 1025 C ASP A 71 -14.583 -6.859 -7.159 1.00 1.02 C ATOM 1026 O ASP A 71 -15.792 -6.757 -7.096 1.00 1.29 O ATOM 1027 CB ASP A 71 -13.820 -4.567 -7.791 1.00 1.09 C ATOM 1028 CG ASP A 71 -12.891 -3.413 -7.412 1.00 1.66 C ATOM 1029 OD1 ASP A 71 -12.822 -3.095 -6.236 1.00 2.36 O ATOM 1030 OD2 ASP A 71 -12.264 -2.867 -8.305 1.00 2.25 O ATOM 0 H ASP A 71 -11.690 -5.865 -7.639 1.00 0.67 H new ATOM 0 HA ASP A 71 -13.863 -5.342 -5.789 1.00 0.91 H new ATOM 0 HB2 ASP A 71 -13.595 -4.913 -8.800 1.00 1.09 H new ATOM 0 HB3 ASP A 71 -14.856 -4.229 -7.794 1.00 1.09 H new ATOM 1035 N SER A 72 -13.995 -7.953 -7.558 1.00 0.90 N ATOM 1036 CA SER A 72 -14.763 -9.161 -7.966 1.00 1.20 C ATOM 1037 C SER A 72 -15.630 -9.694 -6.827 1.00 0.98 C ATOM 1038 O SER A 72 -16.585 -10.408 -7.065 1.00 1.02 O ATOM 1039 CB SER A 72 -13.765 -10.255 -8.347 1.00 1.57 C ATOM 1040 OG SER A 72 -14.477 -11.406 -8.786 1.00 2.09 O ATOM 0 H SER A 72 -12.983 -8.061 -7.619 1.00 0.90 H new ATOM 0 HA SER A 72 -15.412 -8.888 -8.798 1.00 1.20 H new ATOM 0 HB2 SER A 72 -13.102 -9.900 -9.136 1.00 1.57 H new ATOM 0 HB3 SER A 72 -13.137 -10.505 -7.492 1.00 1.57 H new ATOM 0 HG SER A 72 -13.841 -12.110 -9.033 1.00 2.09 H new ATOM 1046 N ASN A 73 -15.301 -9.394 -5.588 1.00 0.92 N ATOM 1047 CA ASN A 73 -16.111 -9.940 -4.446 1.00 0.83 C ATOM 1048 C ASN A 73 -17.054 -8.864 -3.897 1.00 0.75 C ATOM 1049 O ASN A 73 -16.620 -7.858 -3.374 1.00 1.07 O ATOM 1050 CB ASN A 73 -15.158 -10.384 -3.333 1.00 0.91 C ATOM 1051 CG ASN A 73 -14.238 -11.489 -3.857 1.00 1.43 C ATOM 1052 OD1 ASN A 73 -13.705 -11.388 -4.944 1.00 2.29 O ATOM 1053 ND2 ASN A 73 -14.026 -12.547 -3.123 1.00 1.90 N ATOM 0 H ASN A 73 -14.515 -8.801 -5.320 1.00 0.92 H new ATOM 0 HA ASN A 73 -16.705 -10.783 -4.800 1.00 0.83 H new ATOM 0 HB2 ASN A 73 -14.566 -9.537 -2.988 1.00 0.91 H new ATOM 0 HB3 ASN A 73 -15.726 -10.746 -2.476 1.00 0.91 H new ATOM 0 HD21 ASN A 73 -13.413 -13.288 -3.462 1.00 1.90 H new ATOM 0 HD22 ASN A 73 -14.473 -12.632 -2.210 1.00 1.90 H new ATOM 1060 N MET A 74 -18.340 -9.063 -4.014 1.00 0.71 N ATOM 1061 CA MET A 74 -19.298 -8.043 -3.497 1.00 0.67 C ATOM 1062 C MET A 74 -19.326 -8.097 -1.967 1.00 0.67 C ATOM 1063 O MET A 74 -19.860 -7.227 -1.308 1.00 0.71 O ATOM 1064 CB MET A 74 -20.694 -8.318 -4.056 1.00 0.75 C ATOM 1065 CG MET A 74 -20.637 -8.309 -5.585 1.00 1.20 C ATOM 1066 SD MET A 74 -20.284 -6.631 -6.166 1.00 1.92 S ATOM 1067 CE MET A 74 -20.410 -6.973 -7.939 1.00 1.96 C ATOM 0 H MET A 74 -18.767 -9.884 -4.443 1.00 0.71 H new ATOM 0 HA MET A 74 -18.978 -7.050 -3.814 1.00 0.67 H new ATOM 0 HB2 MET A 74 -21.058 -9.282 -3.700 1.00 0.75 H new ATOM 0 HB3 MET A 74 -21.395 -7.562 -3.702 1.00 0.75 H new ATOM 0 HG2 MET A 74 -19.867 -8.996 -5.935 1.00 1.20 H new ATOM 0 HG3 MET A 74 -21.585 -8.656 -5.997 1.00 1.20 H new ATOM 0 HE1 MET A 74 -20.224 -6.057 -8.500 1.00 1.96 H new ATOM 0 HE2 MET A 74 -19.672 -7.725 -8.218 1.00 1.96 H new ATOM 0 HE3 MET A 74 -21.409 -7.343 -8.168 1.00 1.96 H new ATOM 1077 N GLU A 75 -18.720 -9.102 -1.404 1.00 0.70 N ATOM 1078 CA GLU A 75 -18.655 -9.232 0.077 1.00 0.75 C ATOM 1079 C GLU A 75 -17.642 -8.230 0.636 1.00 0.73 C ATOM 1080 O GLU A 75 -17.852 -7.667 1.688 1.00 0.78 O ATOM 1081 CB GLU A 75 -18.209 -10.654 0.435 1.00 0.87 C ATOM 1082 CG GLU A 75 -18.403 -10.888 1.933 1.00 1.15 C ATOM 1083 CD GLU A 75 -17.948 -12.304 2.297 1.00 1.70 C ATOM 1084 OE1 GLU A 75 -18.738 -13.219 2.135 1.00 2.29 O ATOM 1085 OE2 GLU A 75 -16.818 -12.448 2.734 1.00 2.21 O ATOM 0 H GLU A 75 -18.258 -9.853 -1.917 1.00 0.70 H new ATOM 0 HA GLU A 75 -19.637 -9.031 0.505 1.00 0.75 H new ATOM 0 HB2 GLU A 75 -18.786 -11.382 -0.135 1.00 0.87 H new ATOM 0 HB3 GLU A 75 -17.162 -10.797 0.167 1.00 0.87 H new ATOM 0 HG2 GLU A 75 -17.832 -10.155 2.502 1.00 1.15 H new ATOM 0 HG3 GLU A 75 -19.451 -10.753 2.199 1.00 1.15 H new ATOM 1092 N LEU A 76 -16.554 -7.988 -0.038 1.00 0.74 N ATOM 1093 CA LEU A 76 -15.557 -7.010 0.499 1.00 0.80 C ATOM 1094 C LEU A 76 -15.980 -5.580 0.133 1.00 0.75 C ATOM 1095 O LEU A 76 -15.803 -4.654 0.893 1.00 0.81 O ATOM 1096 CB LEU A 76 -14.166 -7.317 -0.099 1.00 0.92 C ATOM 1097 CG LEU A 76 -13.302 -8.089 0.909 1.00 1.00 C ATOM 1098 CD1 LEU A 76 -14.017 -9.381 1.347 1.00 1.57 C ATOM 1099 CD2 LEU A 76 -11.961 -8.428 0.251 1.00 1.51 C ATOM 0 H LEU A 76 -16.309 -8.418 -0.930 1.00 0.74 H new ATOM 0 HA LEU A 76 -15.511 -7.097 1.585 1.00 0.80 H new ATOM 0 HB2 LEU A 76 -14.278 -7.901 -1.012 1.00 0.92 H new ATOM 0 HB3 LEU A 76 -13.669 -6.387 -0.374 1.00 0.92 H new ATOM 0 HG LEU A 76 -13.135 -7.474 1.793 1.00 1.00 H new ATOM 0 HD11 LEU A 76 -13.393 -9.918 2.061 1.00 1.57 H new ATOM 0 HD12 LEU A 76 -14.969 -9.129 1.814 1.00 1.57 H new ATOM 0 HD13 LEU A 76 -14.196 -10.011 0.476 1.00 1.57 H new ATOM 0 HD21 LEU A 76 -11.338 -8.977 0.957 1.00 1.51 H new ATOM 0 HD22 LEU A 76 -12.134 -9.042 -0.633 1.00 1.51 H new ATOM 0 HD23 LEU A 76 -11.455 -7.507 -0.040 1.00 1.51 H new ATOM 1111 N GLN A 77 -16.563 -5.415 -1.020 1.00 0.76 N ATOM 1112 CA GLN A 77 -17.019 -4.060 -1.437 1.00 0.74 C ATOM 1113 C GLN A 77 -18.177 -3.619 -0.544 1.00 0.71 C ATOM 1114 O GLN A 77 -18.211 -2.491 -0.092 1.00 0.72 O ATOM 1115 CB GLN A 77 -17.461 -4.079 -2.901 1.00 0.71 C ATOM 1116 CG GLN A 77 -17.834 -2.663 -3.345 1.00 1.26 C ATOM 1117 CD GLN A 77 -18.243 -2.684 -4.818 1.00 1.59 C ATOM 1118 OE1 GLN A 77 -19.415 -2.724 -5.135 1.00 2.35 O ATOM 1119 NE2 GLN A 77 -17.319 -2.660 -5.739 1.00 2.03 N ATOM 0 H GLN A 77 -16.744 -6.160 -1.693 1.00 0.76 H new ATOM 0 HA GLN A 77 -16.194 -3.355 -1.334 1.00 0.74 H new ATOM 0 HB2 GLN A 77 -16.659 -4.468 -3.528 1.00 0.71 H new ATOM 0 HB3 GLN A 77 -18.314 -4.746 -3.025 1.00 0.71 H new ATOM 0 HG2 GLN A 77 -18.653 -2.282 -2.734 1.00 1.26 H new ATOM 0 HG3 GLN A 77 -16.989 -1.990 -3.200 1.00 1.26 H new ATOM 0 HE21 GLN A 77 -16.335 -2.626 -5.473 1.00 2.03 H new ATOM 0 HE22 GLN A 77 -17.581 -2.675 -6.725 1.00 2.03 H new ATOM 1128 N ARG A 78 -19.116 -4.469 -0.261 1.00 0.72 N ATOM 1129 CA ARG A 78 -20.226 -4.028 0.621 1.00 0.73 C ATOM 1130 C ARG A 78 -19.672 -3.775 2.026 1.00 0.75 C ATOM 1131 O ARG A 78 -20.208 -2.997 2.787 1.00 0.79 O ATOM 1132 CB ARG A 78 -21.317 -5.112 0.675 1.00 0.74 C ATOM 1133 CG ARG A 78 -20.841 -6.334 1.494 1.00 0.94 C ATOM 1134 CD ARG A 78 -21.406 -6.286 2.923 1.00 1.23 C ATOM 1135 NE ARG A 78 -22.858 -6.618 2.895 1.00 1.80 N ATOM 1136 CZ ARG A 78 -23.480 -6.903 4.006 1.00 2.50 C ATOM 1137 NH1 ARG A 78 -22.829 -6.886 5.138 1.00 2.83 N ATOM 1138 NH2 ARG A 78 -24.750 -7.200 3.988 1.00 3.41 N ATOM 0 H ARG A 78 -19.166 -5.432 -0.594 1.00 0.72 H new ATOM 0 HA ARG A 78 -20.665 -3.111 0.228 1.00 0.73 H new ATOM 0 HB2 ARG A 78 -22.222 -4.700 1.121 1.00 0.74 H new ATOM 0 HB3 ARG A 78 -21.574 -5.425 -0.337 1.00 0.74 H new ATOM 0 HG2 ARG A 78 -21.160 -7.253 1.003 1.00 0.94 H new ATOM 0 HG3 ARG A 78 -19.752 -6.352 1.529 1.00 0.94 H new ATOM 0 HD2 ARG A 78 -20.873 -6.992 3.560 1.00 1.23 H new ATOM 0 HD3 ARG A 78 -21.257 -5.295 3.351 1.00 1.23 H new ATOM 0 HE ARG A 78 -23.365 -6.623 2.010 1.00 1.80 H new ATOM 0 HH11 ARG A 78 -21.837 -6.650 5.152 1.00 2.83 H new ATOM 0 HH12 ARG A 78 -23.313 -7.108 6.008 1.00 2.83 H new ATOM 0 HH21 ARG A 78 -25.259 -7.210 3.104 1.00 3.41 H new ATOM 0 HH22 ARG A 78 -25.234 -7.422 4.858 1.00 3.41 H new ATOM 1152 N MET A 79 -18.597 -4.445 2.380 1.00 0.75 N ATOM 1153 CA MET A 79 -18.002 -4.263 3.735 1.00 0.77 C ATOM 1154 C MET A 79 -17.267 -2.924 3.783 1.00 0.77 C ATOM 1155 O MET A 79 -17.526 -2.095 4.628 1.00 0.78 O ATOM 1156 CB MET A 79 -17.013 -5.419 4.000 1.00 0.81 C ATOM 1157 CG MET A 79 -17.257 -6.045 5.373 1.00 1.08 C ATOM 1158 SD MET A 79 -15.979 -7.296 5.667 1.00 1.07 S ATOM 1159 CE MET A 79 -15.777 -7.067 7.449 1.00 0.81 C ATOM 0 H MET A 79 -18.108 -5.111 1.782 1.00 0.75 H new ATOM 0 HA MET A 79 -18.782 -4.269 4.497 1.00 0.77 H new ATOM 0 HB2 MET A 79 -17.120 -6.179 3.226 1.00 0.81 H new ATOM 0 HB3 MET A 79 -15.990 -5.047 3.942 1.00 0.81 H new ATOM 0 HG2 MET A 79 -17.225 -5.281 6.149 1.00 1.08 H new ATOM 0 HG3 MET A 79 -18.248 -6.498 5.413 1.00 1.08 H new ATOM 0 HE1 MET A 79 -14.815 -7.473 7.761 1.00 0.81 H new ATOM 0 HE2 MET A 79 -15.816 -6.004 7.686 1.00 0.81 H new ATOM 0 HE3 MET A 79 -16.578 -7.586 7.976 1.00 0.81 H new ATOM 1169 N ILE A 80 -16.356 -2.704 2.871 1.00 0.77 N ATOM 1170 CA ILE A 80 -15.625 -1.408 2.859 1.00 0.80 C ATOM 1171 C ILE A 80 -16.658 -0.284 2.953 1.00 0.80 C ATOM 1172 O ILE A 80 -16.370 0.807 3.385 1.00 0.83 O ATOM 1173 CB ILE A 80 -14.798 -1.293 1.577 1.00 0.82 C ATOM 1174 CG1 ILE A 80 -13.725 -2.389 1.573 1.00 0.84 C ATOM 1175 CG2 ILE A 80 -14.118 0.074 1.524 1.00 0.89 C ATOM 1176 CD1 ILE A 80 -13.122 -2.515 0.173 1.00 1.10 C ATOM 0 H ILE A 80 -16.090 -3.363 2.139 1.00 0.77 H new ATOM 0 HA ILE A 80 -14.938 -1.341 3.702 1.00 0.80 H new ATOM 0 HB ILE A 80 -15.451 -1.407 0.712 1.00 0.82 H new ATOM 0 HG12 ILE A 80 -12.945 -2.150 2.295 1.00 0.84 H new ATOM 0 HG13 ILE A 80 -14.162 -3.340 1.878 1.00 0.84 H new ATOM 0 HG21 ILE A 80 -13.530 0.153 0.610 1.00 0.89 H new ATOM 0 HG22 ILE A 80 -14.875 0.858 1.537 1.00 0.89 H new ATOM 0 HG23 ILE A 80 -13.463 0.188 2.388 1.00 0.89 H new ATOM 0 HD11 ILE A 80 -12.360 -3.294 0.174 1.00 1.10 H new ATOM 0 HD12 ILE A 80 -13.906 -2.774 -0.539 1.00 1.10 H new ATOM 0 HD13 ILE A 80 -12.670 -1.566 -0.115 1.00 1.10 H new ATOM 1188 N ALA A 81 -17.866 -0.539 2.546 1.00 0.78 N ATOM 1189 CA ALA A 81 -18.910 0.516 2.630 1.00 0.80 C ATOM 1190 C ALA A 81 -19.419 0.616 4.080 1.00 0.81 C ATOM 1191 O ALA A 81 -20.049 1.584 4.457 1.00 0.85 O ATOM 1192 CB ALA A 81 -20.069 0.149 1.709 1.00 0.79 C ATOM 0 H ALA A 81 -18.176 -1.430 2.159 1.00 0.78 H new ATOM 0 HA ALA A 81 -18.490 1.475 2.326 1.00 0.80 H new ATOM 0 HB1 ALA A 81 -20.838 0.920 1.767 1.00 0.79 H new ATOM 0 HB2 ALA A 81 -19.708 0.072 0.683 1.00 0.79 H new ATOM 0 HB3 ALA A 81 -20.490 -0.808 2.018 1.00 0.79 H new ATOM 1198 N ALA A 82 -19.159 -0.378 4.893 1.00 0.78 N ATOM 1199 CA ALA A 82 -19.637 -0.343 6.314 1.00 0.80 C ATOM 1200 C ALA A 82 -18.587 0.286 7.236 1.00 0.79 C ATOM 1201 O ALA A 82 -18.854 0.551 8.392 1.00 0.83 O ATOM 1202 CB ALA A 82 -19.887 -1.765 6.820 1.00 0.87 C ATOM 0 H ALA A 82 -18.635 -1.215 4.635 1.00 0.78 H new ATOM 0 HA ALA A 82 -20.553 0.248 6.330 1.00 0.80 H new ATOM 0 HB1 ALA A 82 -20.234 -1.728 7.853 1.00 0.87 H new ATOM 0 HB2 ALA A 82 -20.645 -2.244 6.200 1.00 0.87 H new ATOM 0 HB3 ALA A 82 -18.961 -2.338 6.769 1.00 0.87 H new ATOM 1208 N VAL A 83 -17.387 0.493 6.761 1.00 0.80 N ATOM 1209 CA VAL A 83 -16.320 1.063 7.647 1.00 0.85 C ATOM 1210 C VAL A 83 -16.258 2.581 7.507 1.00 0.99 C ATOM 1211 O VAL A 83 -15.677 3.127 6.592 1.00 1.36 O ATOM 1212 CB VAL A 83 -14.955 0.451 7.274 1.00 0.97 C ATOM 1213 CG1 VAL A 83 -14.511 0.922 5.871 1.00 1.81 C ATOM 1214 CG2 VAL A 83 -13.905 0.873 8.313 1.00 1.40 C ATOM 0 H VAL A 83 -17.097 0.294 5.803 1.00 0.80 H new ATOM 0 HA VAL A 83 -16.560 0.819 8.682 1.00 0.85 H new ATOM 0 HB VAL A 83 -15.050 -0.635 7.263 1.00 0.97 H new ATOM 0 HG11 VAL A 83 -13.546 0.479 5.627 1.00 1.81 H new ATOM 0 HG12 VAL A 83 -15.250 0.612 5.132 1.00 1.81 H new ATOM 0 HG13 VAL A 83 -14.424 2.008 5.863 1.00 1.81 H new ATOM 0 HG21 VAL A 83 -12.939 0.441 8.051 1.00 1.40 H new ATOM 0 HG22 VAL A 83 -13.824 1.960 8.328 1.00 1.40 H new ATOM 0 HG23 VAL A 83 -14.205 0.518 9.299 1.00 1.40 H new ATOM 1273 N PRO A 88 -11.344 9.548 10.805 1.00 0.77 N ATOM 1274 CA PRO A 88 -10.675 8.531 9.955 1.00 0.83 C ATOM 1275 C PRO A 88 -9.220 8.317 10.414 1.00 0.73 C ATOM 1276 O PRO A 88 -8.628 7.285 10.166 1.00 0.72 O ATOM 1277 CB PRO A 88 -10.696 9.133 8.524 1.00 1.01 C ATOM 1278 CG PRO A 88 -11.367 10.530 8.605 1.00 1.07 C ATOM 1279 CD PRO A 88 -11.772 10.769 10.073 1.00 0.83 C ATOM 0 HA PRO A 88 -11.173 7.563 10.008 1.00 0.83 H new ATOM 0 HB2 PRO A 88 -9.683 9.218 8.131 1.00 1.01 H new ATOM 0 HB3 PRO A 88 -11.248 8.483 7.845 1.00 1.01 H new ATOM 0 HG2 PRO A 88 -10.679 11.305 8.267 1.00 1.07 H new ATOM 0 HG3 PRO A 88 -12.241 10.573 7.955 1.00 1.07 H new ATOM 0 HD2 PRO A 88 -11.286 11.658 10.475 1.00 0.83 H new ATOM 0 HD3 PRO A 88 -12.847 10.925 10.164 1.00 0.83 H new ATOM 1287 N ARG A 89 -8.636 9.295 11.053 1.00 0.75 N ATOM 1288 CA ARG A 89 -7.215 9.173 11.500 1.00 0.73 C ATOM 1289 C ARG A 89 -7.049 8.060 12.540 1.00 0.67 C ATOM 1290 O ARG A 89 -6.084 7.322 12.512 1.00 0.68 O ATOM 1291 CB ARG A 89 -6.776 10.502 12.113 1.00 0.79 C ATOM 1292 CG ARG A 89 -6.967 11.619 11.083 1.00 1.63 C ATOM 1293 CD ARG A 89 -6.305 12.905 11.582 1.00 1.65 C ATOM 1294 NE ARG A 89 -6.648 13.138 13.026 1.00 2.07 N ATOM 1295 CZ ARG A 89 -7.888 13.214 13.435 1.00 2.47 C ATOM 1296 NH1 ARG A 89 -8.870 13.263 12.577 1.00 2.69 N ATOM 1297 NH2 ARG A 89 -8.143 13.297 14.713 1.00 3.10 N ATOM 0 H ARG A 89 -9.085 10.181 11.287 1.00 0.75 H new ATOM 0 HA ARG A 89 -6.600 8.924 10.635 1.00 0.73 H new ATOM 0 HB2 ARG A 89 -7.360 10.713 13.009 1.00 0.79 H new ATOM 0 HB3 ARG A 89 -5.731 10.448 12.419 1.00 0.79 H new ATOM 0 HG2 ARG A 89 -6.533 11.323 10.128 1.00 1.63 H new ATOM 0 HG3 ARG A 89 -8.030 11.790 10.911 1.00 1.63 H new ATOM 0 HD2 ARG A 89 -5.224 12.835 11.464 1.00 1.65 H new ATOM 0 HD3 ARG A 89 -6.638 13.751 10.980 1.00 1.65 H new ATOM 0 HE ARG A 89 -5.894 13.240 13.705 1.00 2.07 H new ATOM 0 HH11 ARG A 89 -8.674 13.242 11.576 1.00 2.69 H new ATOM 0 HH12 ARG A 89 -9.833 13.322 12.907 1.00 2.69 H new ATOM 0 HH21 ARG A 89 -7.377 13.302 15.387 1.00 3.10 H new ATOM 0 HH22 ARG A 89 -9.108 13.357 15.038 1.00 3.10 H new ATOM 1311 N GLU A 90 -7.965 7.929 13.460 1.00 0.65 N ATOM 1312 CA GLU A 90 -7.816 6.857 14.485 1.00 0.65 C ATOM 1313 C GLU A 90 -8.051 5.499 13.813 1.00 0.64 C ATOM 1314 O GLU A 90 -7.533 4.487 14.244 1.00 0.67 O ATOM 1315 CB GLU A 90 -8.816 7.092 15.634 1.00 0.71 C ATOM 1316 CG GLU A 90 -10.197 6.522 15.285 1.00 1.32 C ATOM 1317 CD GLU A 90 -11.248 7.102 16.235 1.00 2.02 C ATOM 1318 OE1 GLU A 90 -10.895 7.408 17.362 1.00 2.78 O ATOM 1319 OE2 GLU A 90 -12.388 7.229 15.820 1.00 2.46 O ATOM 0 H GLU A 90 -8.800 8.509 13.547 1.00 0.65 H new ATOM 0 HA GLU A 90 -6.812 6.873 14.908 1.00 0.65 H new ATOM 0 HB2 GLU A 90 -8.445 6.624 16.546 1.00 0.71 H new ATOM 0 HB3 GLU A 90 -8.900 8.160 15.836 1.00 0.71 H new ATOM 0 HG2 GLU A 90 -10.451 6.765 14.253 1.00 1.32 H new ATOM 0 HG3 GLU A 90 -10.183 5.435 15.362 1.00 1.32 H new ATOM 1326 N VAL A 91 -8.831 5.467 12.769 1.00 0.64 N ATOM 1327 CA VAL A 91 -9.102 4.173 12.079 1.00 0.67 C ATOM 1328 C VAL A 91 -7.918 3.806 11.182 1.00 0.66 C ATOM 1329 O VAL A 91 -7.423 2.697 11.210 1.00 0.67 O ATOM 1330 CB VAL A 91 -10.359 4.316 11.218 1.00 0.71 C ATOM 1331 CG1 VAL A 91 -10.731 2.955 10.630 1.00 0.80 C ATOM 1332 CG2 VAL A 91 -11.514 4.830 12.083 1.00 0.75 C ATOM 0 H VAL A 91 -9.293 6.281 12.363 1.00 0.64 H new ATOM 0 HA VAL A 91 -9.248 3.390 12.824 1.00 0.67 H new ATOM 0 HB VAL A 91 -10.167 5.022 10.410 1.00 0.71 H new ATOM 0 HG11 VAL A 91 -11.626 3.056 10.017 1.00 0.80 H new ATOM 0 HG12 VAL A 91 -9.909 2.587 10.015 1.00 0.80 H new ATOM 0 HG13 VAL A 91 -10.923 2.250 11.438 1.00 0.80 H new ATOM 0 HG21 VAL A 91 -12.410 4.932 11.470 1.00 0.75 H new ATOM 0 HG22 VAL A 91 -11.706 4.124 12.891 1.00 0.75 H new ATOM 0 HG23 VAL A 91 -11.250 5.800 12.504 1.00 0.75 H new ATOM 1342 N PHE A 92 -7.469 4.732 10.381 1.00 0.64 N ATOM 1343 CA PHE A 92 -6.326 4.451 9.468 1.00 0.65 C ATOM 1344 C PHE A 92 -5.142 3.880 10.253 1.00 0.62 C ATOM 1345 O PHE A 92 -4.518 2.927 9.832 1.00 0.67 O ATOM 1346 CB PHE A 92 -5.895 5.747 8.780 1.00 0.65 C ATOM 1347 CG PHE A 92 -4.718 5.472 7.876 1.00 0.65 C ATOM 1348 CD1 PHE A 92 -3.414 5.546 8.380 1.00 1.31 C ATOM 1349 CD2 PHE A 92 -4.930 5.142 6.532 1.00 1.44 C ATOM 1350 CE1 PHE A 92 -2.322 5.292 7.540 1.00 1.31 C ATOM 1351 CE2 PHE A 92 -3.839 4.888 5.692 1.00 1.47 C ATOM 1352 CZ PHE A 92 -2.535 4.963 6.196 1.00 0.73 C ATOM 0 H PHE A 92 -7.847 5.677 10.319 1.00 0.64 H new ATOM 0 HA PHE A 92 -6.643 3.721 8.724 1.00 0.65 H new ATOM 0 HB2 PHE A 92 -6.723 6.156 8.201 1.00 0.65 H new ATOM 0 HB3 PHE A 92 -5.627 6.495 9.526 1.00 0.65 H new ATOM 0 HD1 PHE A 92 -3.250 5.799 9.417 1.00 1.31 H new ATOM 0 HD2 PHE A 92 -5.936 5.083 6.143 1.00 1.44 H new ATOM 0 HE1 PHE A 92 -1.316 5.350 7.929 1.00 1.31 H new ATOM 0 HE2 PHE A 92 -4.003 4.634 4.655 1.00 1.47 H new ATOM 0 HZ PHE A 92 -1.693 4.767 5.548 1.00 0.73 H new ATOM 1362 N PHE A 93 -4.810 4.455 11.378 1.00 0.58 N ATOM 1363 CA PHE A 93 -3.647 3.929 12.153 1.00 0.57 C ATOM 1364 C PHE A 93 -4.070 2.683 12.934 1.00 0.59 C ATOM 1365 O PHE A 93 -3.281 1.787 13.158 1.00 0.60 O ATOM 1366 CB PHE A 93 -3.142 5.005 13.117 1.00 0.57 C ATOM 1367 CG PHE A 93 -1.936 4.495 13.868 1.00 0.56 C ATOM 1368 CD1 PHE A 93 -0.655 4.657 13.327 1.00 1.47 C ATOM 1369 CD2 PHE A 93 -2.098 3.865 15.108 1.00 1.15 C ATOM 1370 CE1 PHE A 93 0.464 4.190 14.026 1.00 1.58 C ATOM 1371 CE2 PHE A 93 -0.978 3.397 15.806 1.00 1.07 C ATOM 1372 CZ PHE A 93 0.303 3.560 15.266 1.00 0.70 C ATOM 0 H PHE A 93 -5.287 5.257 11.791 1.00 0.58 H new ATOM 0 HA PHE A 93 -2.844 3.662 11.465 1.00 0.57 H new ATOM 0 HB2 PHE A 93 -2.882 5.908 12.565 1.00 0.57 H new ATOM 0 HB3 PHE A 93 -3.931 5.276 13.819 1.00 0.57 H new ATOM 0 HD1 PHE A 93 -0.530 5.142 12.370 1.00 1.47 H new ATOM 0 HD2 PHE A 93 -3.086 3.740 15.526 1.00 1.15 H new ATOM 0 HE1 PHE A 93 1.452 4.316 13.609 1.00 1.58 H new ATOM 0 HE2 PHE A 93 -1.103 2.910 16.762 1.00 1.07 H new ATOM 0 HZ PHE A 93 1.167 3.200 15.805 1.00 0.70 H new ATOM 1382 N ARG A 94 -5.304 2.612 13.352 1.00 0.62 N ATOM 1383 CA ARG A 94 -5.753 1.413 14.116 1.00 0.67 C ATOM 1384 C ARG A 94 -5.854 0.212 13.177 1.00 0.66 C ATOM 1385 O ARG A 94 -5.299 -0.836 13.449 1.00 0.67 O ATOM 1386 CB ARG A 94 -7.118 1.679 14.762 1.00 0.72 C ATOM 1387 CG ARG A 94 -7.603 0.435 15.530 1.00 0.89 C ATOM 1388 CD ARG A 94 -6.573 0.009 16.590 1.00 1.00 C ATOM 1389 NE ARG A 94 -5.944 1.213 17.204 1.00 1.95 N ATOM 1390 CZ ARG A 94 -5.270 1.103 18.316 1.00 2.64 C ATOM 1391 NH1 ARG A 94 -5.123 -0.065 18.880 1.00 2.76 N ATOM 1392 NH2 ARG A 94 -4.739 2.163 18.862 1.00 3.65 N ATOM 0 H ARG A 94 -6.016 3.326 13.199 1.00 0.62 H new ATOM 0 HA ARG A 94 -5.026 1.200 14.899 1.00 0.67 H new ATOM 0 HB2 ARG A 94 -7.046 2.528 15.442 1.00 0.72 H new ATOM 0 HB3 ARG A 94 -7.844 1.946 13.994 1.00 0.72 H new ATOM 0 HG2 ARG A 94 -8.558 0.648 16.010 1.00 0.89 H new ATOM 0 HG3 ARG A 94 -7.773 -0.385 14.832 1.00 0.89 H new ATOM 0 HD2 ARG A 94 -7.058 -0.590 17.360 1.00 1.00 H new ATOM 0 HD3 ARG A 94 -5.807 -0.618 16.133 1.00 1.00 H new ATOM 0 HE ARG A 94 -6.041 2.124 16.755 1.00 1.95 H new ATOM 0 HH11 ARG A 94 -5.535 -0.894 18.452 1.00 2.76 H new ATOM 0 HH12 ARG A 94 -4.596 -0.149 19.749 1.00 2.76 H new ATOM 0 HH21 ARG A 94 -4.851 3.075 18.420 1.00 3.65 H new ATOM 0 HH22 ARG A 94 -4.212 2.079 19.731 1.00 3.65 H new ATOM 1406 N VAL A 95 -6.547 0.327 12.079 1.00 0.65 N ATOM 1407 CA VAL A 95 -6.660 -0.833 11.152 1.00 0.66 C ATOM 1408 C VAL A 95 -5.271 -1.254 10.675 1.00 0.66 C ATOM 1409 O VAL A 95 -4.956 -2.425 10.605 1.00 0.67 O ATOM 1410 CB VAL A 95 -7.499 -0.416 9.940 1.00 0.64 C ATOM 1411 CG1 VAL A 95 -7.588 -1.575 8.945 1.00 1.27 C ATOM 1412 CG2 VAL A 95 -8.906 -0.033 10.402 1.00 1.08 C ATOM 0 H VAL A 95 -7.038 1.171 11.784 1.00 0.65 H new ATOM 0 HA VAL A 95 -7.131 -1.668 11.670 1.00 0.66 H new ATOM 0 HB VAL A 95 -7.027 0.438 9.454 1.00 0.64 H new ATOM 0 HG11 VAL A 95 -8.186 -1.272 8.086 1.00 1.27 H new ATOM 0 HG12 VAL A 95 -6.586 -1.847 8.612 1.00 1.27 H new ATOM 0 HG13 VAL A 95 -8.055 -2.434 9.427 1.00 1.27 H new ATOM 0 HG21 VAL A 95 -9.504 0.264 9.540 1.00 1.08 H new ATOM 0 HG22 VAL A 95 -9.374 -0.888 10.891 1.00 1.08 H new ATOM 0 HG23 VAL A 95 -8.845 0.798 11.105 1.00 1.08 H new ATOM 1422 N ALA A 96 -4.447 -0.311 10.315 1.00 0.65 N ATOM 1423 CA ALA A 96 -3.095 -0.668 9.810 1.00 0.68 C ATOM 1424 C ALA A 96 -2.336 -1.462 10.875 1.00 0.70 C ATOM 1425 O ALA A 96 -1.888 -2.566 10.657 1.00 0.76 O ATOM 1426 CB ALA A 96 -2.333 0.618 9.479 1.00 0.69 C ATOM 0 H ALA A 96 -4.651 0.688 10.349 1.00 0.65 H new ATOM 0 HA ALA A 96 -3.187 -1.282 8.914 1.00 0.68 H new ATOM 0 HB1 ALA A 96 -1.339 0.367 9.108 1.00 0.69 H new ATOM 0 HB2 ALA A 96 -2.875 1.176 8.716 1.00 0.69 H new ATOM 0 HB3 ALA A 96 -2.241 1.228 10.378 1.00 0.69 H new ATOM 1432 N ALA A 97 -2.214 -0.867 12.034 1.00 0.74 N ATOM 1433 CA ALA A 97 -1.500 -1.519 13.173 1.00 0.78 C ATOM 1434 C ALA A 97 -2.062 -2.923 13.401 1.00 0.79 C ATOM 1435 O ALA A 97 -1.342 -3.843 13.736 1.00 0.83 O ATOM 1436 CB ALA A 97 -1.699 -0.685 14.441 1.00 0.77 C ATOM 0 H ALA A 97 -2.586 0.060 12.242 1.00 0.74 H new ATOM 0 HA ALA A 97 -0.438 -1.588 12.939 1.00 0.78 H new ATOM 0 HB1 ALA A 97 -1.179 -1.159 15.274 1.00 0.77 H new ATOM 0 HB2 ALA A 97 -1.297 0.316 14.285 1.00 0.77 H new ATOM 0 HB3 ALA A 97 -2.763 -0.618 14.669 1.00 0.77 H new ATOM 1442 N ASP A 98 -3.341 -3.094 13.228 1.00 0.78 N ATOM 1443 CA ASP A 98 -3.946 -4.438 13.440 1.00 0.82 C ATOM 1444 C ASP A 98 -3.377 -5.441 12.432 1.00 0.83 C ATOM 1445 O ASP A 98 -3.228 -6.606 12.742 1.00 0.88 O ATOM 1446 CB ASP A 98 -5.466 -4.351 13.290 1.00 0.82 C ATOM 1447 CG ASP A 98 -6.021 -3.313 14.266 1.00 1.47 C ATOM 1448 OD1 ASP A 98 -5.234 -2.739 15.002 1.00 2.13 O ATOM 1449 OD2 ASP A 98 -7.224 -3.109 14.263 1.00 2.19 O ATOM 0 H ASP A 98 -3.994 -2.362 12.949 1.00 0.78 H new ATOM 0 HA ASP A 98 -3.704 -4.779 14.447 1.00 0.82 H new ATOM 0 HB2 ASP A 98 -5.725 -4.078 12.267 1.00 0.82 H new ATOM 0 HB3 ASP A 98 -5.917 -5.324 13.484 1.00 0.82 H new ATOM 1454 N MET A 99 -3.076 -5.035 11.228 1.00 0.81 N ATOM 1455 CA MET A 99 -2.546 -6.030 10.248 1.00 0.85 C ATOM 1456 C MET A 99 -1.206 -6.581 10.752 1.00 0.97 C ATOM 1457 O MET A 99 -0.612 -7.445 10.140 1.00 1.14 O ATOM 1458 CB MET A 99 -2.350 -5.370 8.881 1.00 0.79 C ATOM 1459 CG MET A 99 -3.698 -5.197 8.186 1.00 0.81 C ATOM 1460 SD MET A 99 -3.425 -4.523 6.529 1.00 0.97 S ATOM 1461 CE MET A 99 -5.120 -3.974 6.228 1.00 0.48 C ATOM 0 H MET A 99 -3.171 -4.079 10.884 1.00 0.81 H new ATOM 0 HA MET A 99 -3.261 -6.846 10.147 1.00 0.85 H new ATOM 0 HB2 MET A 99 -1.867 -4.400 9.002 1.00 0.79 H new ATOM 0 HB3 MET A 99 -1.690 -5.980 8.265 1.00 0.79 H new ATOM 0 HG2 MET A 99 -4.214 -6.155 8.122 1.00 0.81 H new ATOM 0 HG3 MET A 99 -4.336 -4.529 8.764 1.00 0.81 H new ATOM 0 HE1 MET A 99 -5.184 -3.517 5.241 1.00 0.48 H new ATOM 0 HE2 MET A 99 -5.794 -4.830 6.276 1.00 0.48 H new ATOM 0 HE3 MET A 99 -5.406 -3.244 6.985 1.00 0.48 H new ATOM 1600 N ARG A 109 0.995 -8.273 3.891 1.00 0.86 N ATOM 1601 CA ARG A 109 -0.077 -7.379 4.400 1.00 0.87 C ATOM 1602 C ARG A 109 0.077 -6.025 3.706 1.00 0.70 C ATOM 1603 O ARG A 109 -0.835 -5.223 3.664 1.00 0.81 O ATOM 1604 CB ARG A 109 -0.011 -7.218 5.943 1.00 1.08 C ATOM 1605 CG ARG A 109 0.953 -8.240 6.563 1.00 1.48 C ATOM 1606 CD ARG A 109 0.382 -9.659 6.422 1.00 1.96 C ATOM 1607 NE ARG A 109 -0.475 -9.950 7.605 1.00 2.74 N ATOM 1608 CZ ARG A 109 -1.296 -10.963 7.587 1.00 3.19 C ATOM 1609 NH1 ARG A 109 -1.376 -11.721 6.528 1.00 3.19 N ATOM 1610 NH2 ARG A 109 -2.039 -11.214 8.629 1.00 4.08 N ATOM 0 HA ARG A 109 -1.051 -7.815 4.178 1.00 0.87 H new ATOM 0 HB2 ARG A 109 0.314 -6.208 6.193 1.00 1.08 H new ATOM 0 HB3 ARG A 109 -1.006 -7.347 6.368 1.00 1.08 H new ATOM 0 HG2 ARG A 109 1.924 -8.180 6.071 1.00 1.48 H new ATOM 0 HG3 ARG A 109 1.114 -8.007 7.616 1.00 1.48 H new ATOM 0 HD2 ARG A 109 -0.200 -9.742 5.504 1.00 1.96 H new ATOM 0 HD3 ARG A 109 1.191 -10.386 6.354 1.00 1.96 H new ATOM 0 HE ARG A 109 -0.420 -9.355 8.432 1.00 2.74 H new ATOM 0 HH11 ARG A 109 -0.796 -11.522 5.713 1.00 3.19 H new ATOM 0 HH12 ARG A 109 -2.019 -12.513 6.515 1.00 3.19 H new ATOM 0 HH21 ARG A 109 -1.977 -10.619 9.455 1.00 4.08 H new ATOM 0 HH22 ARG A 109 -2.682 -12.006 8.618 1.00 4.08 H new ATOM 1624 N VAL A 110 1.239 -5.770 3.159 1.00 0.60 N ATOM 1625 CA VAL A 110 1.454 -4.475 2.472 1.00 0.68 C ATOM 1626 C VAL A 110 0.538 -4.394 1.258 1.00 0.56 C ATOM 1627 O VAL A 110 -0.067 -3.372 1.014 1.00 0.60 O ATOM 1628 CB VAL A 110 2.927 -4.299 2.061 1.00 0.88 C ATOM 1629 CG1 VAL A 110 3.828 -4.835 3.176 1.00 1.27 C ATOM 1630 CG2 VAL A 110 3.221 -5.041 0.742 1.00 1.73 C ATOM 0 H VAL A 110 2.039 -6.403 3.162 1.00 0.60 H new ATOM 0 HA VAL A 110 1.213 -3.665 3.160 1.00 0.68 H new ATOM 0 HB VAL A 110 3.126 -3.239 1.904 1.00 0.88 H new ATOM 0 HG11 VAL A 110 4.873 -4.713 2.890 1.00 1.27 H new ATOM 0 HG12 VAL A 110 3.637 -4.282 4.096 1.00 1.27 H new ATOM 0 HG13 VAL A 110 3.617 -5.892 3.337 1.00 1.27 H new ATOM 0 HG21 VAL A 110 4.268 -4.902 0.472 1.00 1.73 H new ATOM 0 HG22 VAL A 110 3.017 -6.104 0.869 1.00 1.73 H new ATOM 0 HG23 VAL A 110 2.586 -4.642 -0.049 1.00 1.73 H new ATOM 1640 N VAL A 111 0.404 -5.430 0.465 1.00 0.51 N ATOM 1641 CA VAL A 111 -0.496 -5.317 -0.708 1.00 0.50 C ATOM 1642 C VAL A 111 -1.848 -4.833 -0.193 1.00 0.46 C ATOM 1643 O VAL A 111 -2.450 -3.920 -0.720 1.00 0.47 O ATOM 1644 CB VAL A 111 -0.619 -6.703 -1.359 1.00 0.58 C ATOM 1645 CG1 VAL A 111 -1.292 -6.579 -2.726 1.00 1.41 C ATOM 1646 CG2 VAL A 111 0.783 -7.299 -1.547 1.00 1.36 C ATOM 0 H VAL A 111 0.872 -6.329 0.581 1.00 0.51 H new ATOM 0 HA VAL A 111 -0.116 -4.618 -1.453 1.00 0.50 H new ATOM 0 HB VAL A 111 -1.218 -7.348 -0.716 1.00 0.58 H new ATOM 0 HG11 VAL A 111 -1.376 -7.566 -3.181 1.00 1.41 H new ATOM 0 HG12 VAL A 111 -2.287 -6.150 -2.604 1.00 1.41 H new ATOM 0 HG13 VAL A 111 -0.694 -5.932 -3.369 1.00 1.41 H new ATOM 0 HG21 VAL A 111 0.701 -8.283 -2.009 1.00 1.36 H new ATOM 0 HG22 VAL A 111 1.373 -6.645 -2.189 1.00 1.36 H new ATOM 0 HG23 VAL A 111 1.271 -7.393 -0.577 1.00 1.36 H new ATOM 1656 N ALA A 112 -2.304 -5.452 0.871 1.00 0.45 N ATOM 1657 CA ALA A 112 -3.606 -5.044 1.486 1.00 0.47 C ATOM 1658 C ALA A 112 -3.490 -3.612 2.030 1.00 0.46 C ATOM 1659 O ALA A 112 -4.480 -2.975 2.323 1.00 0.54 O ATOM 1660 CB ALA A 112 -3.973 -6.007 2.621 1.00 0.53 C ATOM 0 H ALA A 112 -1.829 -6.223 1.340 1.00 0.45 H new ATOM 0 HA ALA A 112 -4.389 -5.079 0.728 1.00 0.47 H new ATOM 0 HB1 ALA A 112 -4.922 -5.703 3.063 1.00 0.53 H new ATOM 0 HB2 ALA A 112 -4.065 -7.018 2.225 1.00 0.53 H new ATOM 0 HB3 ALA A 112 -3.194 -5.985 3.383 1.00 0.53 H new ATOM 1666 N LEU A 113 -2.301 -3.086 2.134 1.00 0.43 N ATOM 1667 CA LEU A 113 -2.143 -1.679 2.616 1.00 0.43 C ATOM 1668 C LEU A 113 -2.278 -0.735 1.418 1.00 0.42 C ATOM 1669 O LEU A 113 -3.016 0.230 1.448 1.00 0.45 O ATOM 1670 CB LEU A 113 -0.750 -1.497 3.241 1.00 0.44 C ATOM 1671 CG LEU A 113 -0.603 -0.075 3.820 1.00 0.51 C ATOM 1672 CD1 LEU A 113 -1.676 0.201 4.893 1.00 1.45 C ATOM 1673 CD2 LEU A 113 0.791 0.061 4.444 1.00 1.27 C ATOM 0 H LEU A 113 -1.431 -3.567 1.907 1.00 0.43 H new ATOM 0 HA LEU A 113 -2.905 -1.459 3.363 1.00 0.43 H new ATOM 0 HB2 LEU A 113 -0.598 -2.235 4.029 1.00 0.44 H new ATOM 0 HB3 LEU A 113 0.019 -1.672 2.489 1.00 0.44 H new ATOM 0 HG LEU A 113 -0.734 0.649 3.016 1.00 0.51 H new ATOM 0 HD11 LEU A 113 -1.548 1.210 5.284 1.00 1.45 H new ATOM 0 HD12 LEU A 113 -2.667 0.106 4.449 1.00 1.45 H new ATOM 0 HD13 LEU A 113 -1.572 -0.518 5.705 1.00 1.45 H new ATOM 0 HD21 LEU A 113 0.908 1.063 4.858 1.00 1.27 H new ATOM 0 HD22 LEU A 113 0.907 -0.676 5.239 1.00 1.27 H new ATOM 0 HD23 LEU A 113 1.550 -0.107 3.680 1.00 1.27 H new ATOM 1685 N PHE A 114 -1.564 -1.019 0.360 1.00 0.40 N ATOM 1686 CA PHE A 114 -1.628 -0.164 -0.863 1.00 0.40 C ATOM 1687 C PHE A 114 -3.072 -0.051 -1.369 1.00 0.39 C ATOM 1688 O PHE A 114 -3.545 1.017 -1.702 1.00 0.41 O ATOM 1689 CB PHE A 114 -0.760 -0.792 -1.961 1.00 0.41 C ATOM 1690 CG PHE A 114 0.706 -0.567 -1.643 1.00 0.44 C ATOM 1691 CD1 PHE A 114 1.233 0.733 -1.642 1.00 1.29 C ATOM 1692 CD2 PHE A 114 1.539 -1.655 -1.351 1.00 1.27 C ATOM 1693 CE1 PHE A 114 2.586 0.940 -1.348 1.00 1.38 C ATOM 1694 CE2 PHE A 114 2.891 -1.445 -1.058 1.00 1.27 C ATOM 1695 CZ PHE A 114 3.415 -0.149 -1.055 1.00 0.68 C ATOM 0 H PHE A 114 -0.932 -1.816 0.290 1.00 0.40 H new ATOM 0 HA PHE A 114 -1.263 0.833 -0.614 1.00 0.40 H new ATOM 0 HB2 PHE A 114 -0.966 -1.860 -2.035 1.00 0.41 H new ATOM 0 HB3 PHE A 114 -1.004 -0.352 -2.928 1.00 0.41 H new ATOM 0 HD1 PHE A 114 0.595 1.574 -1.868 1.00 1.29 H new ATOM 0 HD2 PHE A 114 1.137 -2.657 -1.352 1.00 1.27 H new ATOM 0 HE1 PHE A 114 2.991 1.941 -1.347 1.00 1.38 H new ATOM 0 HE2 PHE A 114 3.531 -2.286 -0.834 1.00 1.27 H new ATOM 0 HZ PHE A 114 4.458 0.012 -0.827 1.00 0.68 H new ATOM 1705 N TYR A 115 -3.768 -1.156 -1.441 1.00 0.40 N ATOM 1706 CA TYR A 115 -5.175 -1.132 -1.938 1.00 0.41 C ATOM 1707 C TYR A 115 -6.085 -0.461 -0.907 1.00 0.41 C ATOM 1708 O TYR A 115 -7.008 0.255 -1.248 1.00 0.44 O ATOM 1709 CB TYR A 115 -5.656 -2.566 -2.183 1.00 0.44 C ATOM 1710 CG TYR A 115 -7.075 -2.541 -2.698 1.00 0.47 C ATOM 1711 CD1 TYR A 115 -7.319 -2.390 -4.068 1.00 1.28 C ATOM 1712 CD2 TYR A 115 -8.147 -2.665 -1.805 1.00 1.24 C ATOM 1713 CE1 TYR A 115 -8.635 -2.364 -4.546 1.00 1.32 C ATOM 1714 CE2 TYR A 115 -9.462 -2.639 -2.284 1.00 1.26 C ATOM 1715 CZ TYR A 115 -9.706 -2.488 -3.654 1.00 0.61 C ATOM 1716 OH TYR A 115 -11.003 -2.460 -4.125 1.00 0.70 O ATOM 0 H TYR A 115 -3.420 -2.077 -1.176 1.00 0.40 H new ATOM 0 HA TYR A 115 -5.213 -0.567 -2.870 1.00 0.41 H new ATOM 0 HB2 TYR A 115 -5.005 -3.061 -2.904 1.00 0.44 H new ATOM 0 HB3 TYR A 115 -5.604 -3.141 -1.259 1.00 0.44 H new ATOM 0 HD1 TYR A 115 -6.492 -2.294 -4.756 1.00 1.28 H new ATOM 0 HD2 TYR A 115 -7.959 -2.781 -0.748 1.00 1.24 H new ATOM 0 HE1 TYR A 115 -8.823 -2.248 -5.603 1.00 1.32 H new ATOM 0 HE2 TYR A 115 -10.289 -2.736 -1.596 1.00 1.26 H new ATOM 0 HH TYR A 115 -11.036 -2.867 -5.016 1.00 0.70 H new ATOM 1726 N PHE A 116 -5.825 -0.676 0.349 1.00 0.38 N ATOM 1727 CA PHE A 116 -6.668 -0.041 1.396 1.00 0.38 C ATOM 1728 C PHE A 116 -6.609 1.480 1.238 1.00 0.36 C ATOM 1729 O PHE A 116 -7.616 2.159 1.304 1.00 0.35 O ATOM 1730 CB PHE A 116 -6.143 -0.422 2.782 1.00 0.40 C ATOM 1731 CG PHE A 116 -6.983 0.250 3.844 1.00 0.37 C ATOM 1732 CD1 PHE A 116 -8.252 -0.255 4.152 1.00 1.35 C ATOM 1733 CD2 PHE A 116 -6.495 1.375 4.522 1.00 1.17 C ATOM 1734 CE1 PHE A 116 -9.033 0.364 5.135 1.00 1.37 C ATOM 1735 CE2 PHE A 116 -7.277 1.994 5.506 1.00 1.18 C ATOM 1736 CZ PHE A 116 -8.546 1.488 5.812 1.00 0.45 C ATOM 0 H PHE A 116 -5.067 -1.263 0.696 1.00 0.38 H new ATOM 0 HA PHE A 116 -7.697 -0.386 1.290 1.00 0.38 H new ATOM 0 HB2 PHE A 116 -6.175 -1.504 2.909 1.00 0.40 H new ATOM 0 HB3 PHE A 116 -5.101 -0.120 2.883 1.00 0.40 H new ATOM 0 HD1 PHE A 116 -8.629 -1.123 3.631 1.00 1.35 H new ATOM 0 HD2 PHE A 116 -5.516 1.765 4.286 1.00 1.17 H new ATOM 0 HE1 PHE A 116 -10.012 -0.026 5.371 1.00 1.37 H new ATOM 0 HE2 PHE A 116 -6.901 2.861 6.028 1.00 1.18 H new ATOM 0 HZ PHE A 116 -9.149 1.965 6.570 1.00 0.45 H new ATOM 1746 N ALA A 117 -5.444 2.024 1.019 1.00 0.35 N ATOM 1747 CA ALA A 117 -5.343 3.497 0.851 1.00 0.34 C ATOM 1748 C ALA A 117 -6.019 3.918 -0.457 1.00 0.34 C ATOM 1749 O ALA A 117 -6.574 4.992 -0.557 1.00 0.34 O ATOM 1750 CB ALA A 117 -3.871 3.917 0.822 1.00 0.37 C ATOM 0 H ALA A 117 -4.563 1.514 0.950 1.00 0.35 H new ATOM 0 HA ALA A 117 -5.841 3.984 1.689 1.00 0.34 H new ATOM 0 HB1 ALA A 117 -3.803 4.998 0.699 1.00 0.37 H new ATOM 0 HB2 ALA A 117 -3.392 3.628 1.757 1.00 0.37 H new ATOM 0 HB3 ALA A 117 -3.368 3.425 -0.011 1.00 0.37 H new ATOM 1756 N SER A 118 -5.982 3.083 -1.464 1.00 0.35 N ATOM 1757 CA SER A 118 -6.622 3.441 -2.763 1.00 0.37 C ATOM 1758 C SER A 118 -8.066 3.888 -2.547 1.00 0.36 C ATOM 1759 O SER A 118 -8.508 4.881 -3.086 1.00 0.36 O ATOM 1760 CB SER A 118 -6.616 2.213 -3.677 1.00 0.42 C ATOM 1761 OG SER A 118 -7.781 1.436 -3.427 1.00 1.25 O ATOM 0 H SER A 118 -5.535 2.167 -1.441 1.00 0.35 H new ATOM 0 HA SER A 118 -6.062 4.259 -3.216 1.00 0.37 H new ATOM 0 HB2 SER A 118 -6.589 2.523 -4.722 1.00 0.42 H new ATOM 0 HB3 SER A 118 -5.722 1.616 -3.498 1.00 0.42 H new ATOM 0 HG SER A 118 -7.693 0.983 -2.562 1.00 1.25 H new ATOM 1767 N LYS A 119 -8.794 3.172 -1.733 1.00 0.37 N ATOM 1768 CA LYS A 119 -10.203 3.567 -1.450 1.00 0.39 C ATOM 1769 C LYS A 119 -10.187 4.896 -0.694 1.00 0.36 C ATOM 1770 O LYS A 119 -10.935 5.802 -1.006 1.00 0.38 O ATOM 1771 CB LYS A 119 -10.884 2.488 -0.595 1.00 0.46 C ATOM 1772 CG LYS A 119 -12.416 2.674 -0.623 1.00 1.29 C ATOM 1773 CD LYS A 119 -13.024 1.894 -1.795 1.00 1.84 C ATOM 1774 CE LYS A 119 -14.507 2.250 -1.930 1.00 2.48 C ATOM 1775 NZ LYS A 119 -14.640 3.684 -2.310 1.00 3.36 N ATOM 0 H LYS A 119 -8.474 2.331 -1.252 1.00 0.37 H new ATOM 0 HA LYS A 119 -10.758 3.673 -2.382 1.00 0.39 H new ATOM 0 HB2 LYS A 119 -10.624 1.498 -0.970 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -10.522 2.545 0.432 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -12.849 2.329 0.316 1.00 1.29 H new ATOM 0 HG3 LYS A 119 -12.659 3.732 -0.716 1.00 1.29 H new ATOM 0 HD2 LYS A 119 -12.496 2.133 -2.718 1.00 1.84 H new ATOM 0 HD3 LYS A 119 -12.910 0.822 -1.631 1.00 1.84 H new ATOM 0 HE2 LYS A 119 -14.977 1.618 -2.684 1.00 2.48 H new ATOM 0 HE3 LYS A 119 -15.024 2.062 -0.989 1.00 2.48 H new ATOM 0 HZ1 LYS A 119 -15.223 3.763 -3.167 1.00 3.36 H new ATOM 0 HZ2 LYS A 119 -15.092 4.208 -1.534 1.00 3.36 H new ATOM 0 HZ3 LYS A 119 -13.698 4.083 -2.494 1.00 3.36 H new ATOM 1789 N LEU A 120 -9.326 5.040 0.274 1.00 0.36 N ATOM 1790 CA LEU A 120 -9.261 6.334 1.009 1.00 0.35 C ATOM 1791 C LEU A 120 -9.014 7.449 -0.014 1.00 0.33 C ATOM 1792 O LEU A 120 -9.655 8.481 -0.002 1.00 0.39 O ATOM 1793 CB LEU A 120 -8.112 6.283 2.019 1.00 0.36 C ATOM 1794 CG LEU A 120 -8.224 7.450 3.011 1.00 0.68 C ATOM 1795 CD1 LEU A 120 -9.456 7.279 3.925 1.00 1.69 C ATOM 1796 CD2 LEU A 120 -6.952 7.490 3.865 1.00 1.28 C ATOM 0 H LEU A 120 -8.670 4.325 0.586 1.00 0.36 H new ATOM 0 HA LEU A 120 -10.191 6.521 1.546 1.00 0.35 H new ATOM 0 HB2 LEU A 120 -8.134 5.335 2.557 1.00 0.36 H new ATOM 0 HB3 LEU A 120 -7.157 6.331 1.496 1.00 0.36 H new ATOM 0 HG LEU A 120 -8.339 8.381 2.456 1.00 0.68 H new ATOM 0 HD11 LEU A 120 -9.514 8.118 4.619 1.00 1.69 H new ATOM 0 HD12 LEU A 120 -10.359 7.249 3.316 1.00 1.69 H new ATOM 0 HD13 LEU A 120 -9.366 6.349 4.487 1.00 1.69 H new ATOM 0 HD21 LEU A 120 -7.016 8.314 4.575 1.00 1.28 H new ATOM 0 HD22 LEU A 120 -6.849 6.551 4.408 1.00 1.28 H new ATOM 0 HD23 LEU A 120 -6.085 7.634 3.220 1.00 1.28 H new ATOM 1808 N VAL A 121 -8.111 7.211 -0.926 1.00 0.33 N ATOM 1809 CA VAL A 121 -7.814 8.196 -2.006 1.00 0.39 C ATOM 1810 C VAL A 121 -9.009 8.290 -2.960 1.00 0.36 C ATOM 1811 O VAL A 121 -9.635 9.324 -3.083 1.00 0.39 O ATOM 1812 CB VAL A 121 -6.577 7.740 -2.781 1.00 0.54 C ATOM 1813 CG1 VAL A 121 -6.282 8.742 -3.901 1.00 0.95 C ATOM 1814 CG2 VAL A 121 -5.377 7.684 -1.831 1.00 1.18 C ATOM 0 H VAL A 121 -7.555 6.357 -0.969 1.00 0.33 H new ATOM 0 HA VAL A 121 -7.628 9.175 -1.564 1.00 0.39 H new ATOM 0 HB VAL A 121 -6.757 6.753 -3.207 1.00 0.54 H new ATOM 0 HG11 VAL A 121 -5.401 8.419 -4.455 1.00 0.95 H new ATOM 0 HG12 VAL A 121 -7.136 8.795 -4.576 1.00 0.95 H new ATOM 0 HG13 VAL A 121 -6.099 9.726 -3.470 1.00 0.95 H new ATOM 0 HG21 VAL A 121 -4.493 7.359 -2.380 1.00 1.18 H new ATOM 0 HG22 VAL A 121 -5.200 8.674 -1.410 1.00 1.18 H new ATOM 0 HG23 VAL A 121 -5.583 6.979 -1.026 1.00 1.18 H new ATOM 1824 N LEU A 122 -9.329 7.222 -3.642 1.00 0.37 N ATOM 1825 CA LEU A 122 -10.481 7.261 -4.589 1.00 0.39 C ATOM 1826 C LEU A 122 -11.706 7.851 -3.883 1.00 0.40 C ATOM 1827 O LEU A 122 -12.307 8.795 -4.354 1.00 0.40 O ATOM 1828 CB LEU A 122 -10.800 5.832 -5.086 1.00 0.42 C ATOM 1829 CG LEU A 122 -10.104 5.562 -6.425 1.00 0.72 C ATOM 1830 CD1 LEU A 122 -8.588 5.612 -6.238 1.00 1.15 C ATOM 1831 CD2 LEU A 122 -10.511 4.177 -6.933 1.00 1.24 C ATOM 0 H LEU A 122 -8.844 6.327 -3.584 1.00 0.37 H new ATOM 0 HA LEU A 122 -10.223 7.885 -5.444 1.00 0.39 H new ATOM 0 HB2 LEU A 122 -10.473 5.102 -4.346 1.00 0.42 H new ATOM 0 HB3 LEU A 122 -11.877 5.712 -5.199 1.00 0.42 H new ATOM 0 HG LEU A 122 -10.401 6.321 -7.149 1.00 0.72 H new ATOM 0 HD11 LEU A 122 -8.097 5.420 -7.192 1.00 1.15 H new ATOM 0 HD12 LEU A 122 -8.299 6.598 -5.873 1.00 1.15 H new ATOM 0 HD13 LEU A 122 -8.285 4.854 -5.515 1.00 1.15 H new ATOM 0 HD21 LEU A 122 -10.019 3.980 -7.885 1.00 1.24 H new ATOM 0 HD22 LEU A 122 -10.213 3.421 -6.207 1.00 1.24 H new ATOM 0 HD23 LEU A 122 -11.592 4.143 -7.069 1.00 1.24 H new ATOM 1843 N LYS A 123 -12.083 7.309 -2.759 1.00 0.51 N ATOM 1844 CA LYS A 123 -13.266 7.862 -2.047 1.00 0.55 C ATOM 1845 C LYS A 123 -13.084 9.372 -1.877 1.00 0.54 C ATOM 1846 O LYS A 123 -14.034 10.129 -1.917 1.00 0.55 O ATOM 1847 CB LYS A 123 -13.408 7.199 -0.675 1.00 0.59 C ATOM 1848 CG LYS A 123 -14.797 7.499 -0.105 1.00 0.97 C ATOM 1849 CD LYS A 123 -14.902 6.959 1.328 1.00 1.37 C ATOM 1850 CE LYS A 123 -14.710 5.432 1.343 1.00 1.74 C ATOM 1851 NZ LYS A 123 -13.270 5.115 1.565 1.00 2.32 N ATOM 0 H LYS A 123 -11.628 6.516 -2.307 1.00 0.51 H new ATOM 0 HA LYS A 123 -14.167 7.663 -2.627 1.00 0.55 H new ATOM 0 HB2 LYS A 123 -13.264 6.122 -0.763 1.00 0.59 H new ATOM 0 HB3 LYS A 123 -12.638 7.569 0.001 1.00 0.59 H new ATOM 0 HG2 LYS A 123 -14.978 8.574 -0.112 1.00 0.97 H new ATOM 0 HG3 LYS A 123 -15.563 7.043 -0.732 1.00 0.97 H new ATOM 0 HD2 LYS A 123 -14.149 7.433 1.958 1.00 1.37 H new ATOM 0 HD3 LYS A 123 -15.875 7.213 1.749 1.00 1.37 H new ATOM 0 HE2 LYS A 123 -15.317 4.986 2.131 1.00 1.74 H new ATOM 0 HE3 LYS A 123 -15.047 5.003 0.399 1.00 1.74 H new ATOM 0 HZ1 LYS A 123 -13.180 4.144 1.925 1.00 2.32 H new ATOM 0 HZ2 LYS A 123 -12.753 5.201 0.667 1.00 2.32 H new ATOM 0 HZ3 LYS A 123 -12.871 5.780 2.258 1.00 2.32 H new ATOM 1865 N ALA A 124 -11.869 9.817 -1.663 1.00 0.52 N ATOM 1866 CA ALA A 124 -11.638 11.278 -1.467 1.00 0.52 C ATOM 1867 C ALA A 124 -11.705 12.011 -2.810 1.00 0.51 C ATOM 1868 O ALA A 124 -12.086 13.161 -2.891 1.00 0.54 O ATOM 1869 CB ALA A 124 -10.280 11.514 -0.816 1.00 0.51 C ATOM 0 H ALA A 124 -11.034 9.234 -1.616 1.00 0.52 H new ATOM 0 HA ALA A 124 -12.418 11.667 -0.812 1.00 0.52 H new ATOM 0 HB1 ALA A 124 -10.123 12.584 -0.678 1.00 0.51 H new ATOM 0 HB2 ALA A 124 -10.249 11.015 0.153 1.00 0.51 H new ATOM 0 HB3 ALA A 124 -9.495 11.112 -1.456 1.00 0.51 H new ATOM 1875 N LEU A 125 -11.343 11.336 -3.868 1.00 0.47 N ATOM 1876 CA LEU A 125 -11.382 11.947 -5.218 1.00 0.47 C ATOM 1877 C LEU A 125 -12.832 12.280 -5.583 1.00 0.48 C ATOM 1878 O LEU A 125 -13.122 13.340 -6.104 1.00 0.48 O ATOM 1879 CB LEU A 125 -10.817 10.921 -6.215 1.00 0.51 C ATOM 1880 CG LEU A 125 -10.885 11.463 -7.648 1.00 0.49 C ATOM 1881 CD1 LEU A 125 -10.011 12.719 -7.789 1.00 1.10 C ATOM 1882 CD2 LEU A 125 -10.390 10.383 -8.620 1.00 1.21 C ATOM 0 H LEU A 125 -11.017 10.370 -3.848 1.00 0.47 H new ATOM 0 HA LEU A 125 -10.794 12.864 -5.244 1.00 0.47 H new ATOM 0 HB2 LEU A 125 -9.784 10.688 -5.958 1.00 0.51 H new ATOM 0 HB3 LEU A 125 -11.381 9.991 -6.146 1.00 0.51 H new ATOM 0 HG LEU A 125 -11.917 11.727 -7.879 1.00 0.49 H new ATOM 0 HD11 LEU A 125 -10.071 13.091 -8.812 1.00 1.10 H new ATOM 0 HD12 LEU A 125 -10.365 13.488 -7.102 1.00 1.10 H new ATOM 0 HD13 LEU A 125 -8.976 12.471 -7.553 1.00 1.10 H new ATOM 0 HD21 LEU A 125 -10.436 10.763 -9.641 1.00 1.21 H new ATOM 0 HD22 LEU A 125 -9.361 10.119 -8.377 1.00 1.21 H new ATOM 0 HD23 LEU A 125 -11.021 9.499 -8.533 1.00 1.21 H new ATOM 1894 N CYS A 126 -13.738 11.370 -5.351 1.00 0.52 N ATOM 1895 CA CYS A 126 -15.163 11.619 -5.724 1.00 0.57 C ATOM 1896 C CYS A 126 -15.794 12.675 -4.812 1.00 0.57 C ATOM 1897 O CYS A 126 -16.821 13.242 -5.126 1.00 0.68 O ATOM 1898 CB CYS A 126 -15.957 10.304 -5.604 1.00 0.66 C ATOM 1899 SG CYS A 126 -16.560 10.080 -3.904 1.00 1.67 S ATOM 0 H CYS A 126 -13.555 10.464 -4.919 1.00 0.52 H new ATOM 0 HA CYS A 126 -15.192 11.986 -6.750 1.00 0.57 H new ATOM 0 HB2 CYS A 126 -16.799 10.316 -6.296 1.00 0.66 H new ATOM 0 HB3 CYS A 126 -15.324 9.463 -5.886 1.00 0.66 H new ATOM 0 HG CYS A 126 -15.552 10.073 -3.083 1.00 1.67 H new ATOM 1905 N THR A 127 -15.179 12.957 -3.689 1.00 0.57 N ATOM 1906 CA THR A 127 -15.761 13.988 -2.778 1.00 0.60 C ATOM 1907 C THR A 127 -15.222 15.345 -3.208 1.00 0.62 C ATOM 1908 O THR A 127 -15.625 16.382 -2.727 1.00 0.70 O ATOM 1909 CB THR A 127 -15.371 13.678 -1.306 1.00 0.60 C ATOM 1910 OG1 THR A 127 -14.183 12.915 -1.296 1.00 1.14 O ATOM 1911 CG2 THR A 127 -16.510 12.864 -0.677 1.00 1.19 C ATOM 0 H THR A 127 -14.313 12.525 -3.368 1.00 0.57 H new ATOM 0 HA THR A 127 -16.849 13.986 -2.838 1.00 0.60 H new ATOM 0 HB THR A 127 -15.211 14.599 -0.745 1.00 0.60 H new ATOM 0 HG1 THR A 127 -13.497 13.371 -1.827 1.00 1.14 H new ATOM 0 HG21 THR A 127 -16.262 12.632 0.359 1.00 1.19 H new ATOM 0 HG22 THR A 127 -17.432 13.444 -0.708 1.00 1.19 H new ATOM 0 HG23 THR A 127 -16.645 11.937 -1.234 1.00 1.19 H new ATOM 1919 N LYS A 128 -14.290 15.310 -4.130 1.00 0.60 N ATOM 1920 CA LYS A 128 -13.668 16.559 -4.645 1.00 0.70 C ATOM 1921 C LYS A 128 -12.999 17.312 -3.499 1.00 0.61 C ATOM 1922 O LYS A 128 -13.416 18.399 -3.149 1.00 0.60 O ATOM 1923 CB LYS A 128 -14.725 17.445 -5.312 1.00 0.87 C ATOM 1924 CG LYS A 128 -15.523 16.630 -6.338 1.00 1.12 C ATOM 1925 CD LYS A 128 -14.622 16.244 -7.519 1.00 1.43 C ATOM 1926 CE LYS A 128 -15.487 15.815 -8.707 1.00 1.83 C ATOM 1927 NZ LYS A 128 -16.311 16.969 -9.165 1.00 2.47 N ATOM 0 H LYS A 128 -13.932 14.452 -4.551 1.00 0.60 H new ATOM 0 HA LYS A 128 -12.915 16.298 -5.389 1.00 0.70 H new ATOM 0 HB2 LYS A 128 -15.397 17.853 -4.558 1.00 0.87 H new ATOM 0 HB3 LYS A 128 -14.245 18.292 -5.802 1.00 0.87 H new ATOM 0 HG2 LYS A 128 -15.925 15.732 -5.868 1.00 1.12 H new ATOM 0 HG3 LYS A 128 -16.374 17.211 -6.694 1.00 1.12 H new ATOM 0 HD2 LYS A 128 -13.993 17.088 -7.801 1.00 1.43 H new ATOM 0 HD3 LYS A 128 -13.955 15.432 -7.230 1.00 1.43 H new ATOM 0 HE2 LYS A 128 -14.855 15.460 -9.521 1.00 1.83 H new ATOM 0 HE3 LYS A 128 -16.132 14.985 -8.419 1.00 1.83 H new ATOM 0 HZ1 LYS A 128 -16.574 16.834 -10.162 1.00 2.47 H new ATOM 0 HZ2 LYS A 128 -17.172 17.032 -8.586 1.00 2.47 H new ATOM 0 HZ3 LYS A 128 -15.763 17.847 -9.067 1.00 2.47 H new ATOM 1941 N VAL A 129 -11.956 16.764 -2.910 1.00 0.60 N ATOM 1942 CA VAL A 129 -11.257 17.477 -1.791 1.00 0.53 C ATOM 1943 C VAL A 129 -9.734 17.295 -1.967 1.00 0.53 C ATOM 1944 O VAL A 129 -9.143 16.478 -1.289 1.00 0.56 O ATOM 1945 CB VAL A 129 -11.687 16.857 -0.457 1.00 0.57 C ATOM 1946 CG1 VAL A 129 -11.051 17.626 0.700 1.00 1.40 C ATOM 1947 CG2 VAL A 129 -13.212 16.908 -0.335 1.00 1.22 C ATOM 0 H VAL A 129 -11.561 15.856 -3.157 1.00 0.60 H new ATOM 0 HA VAL A 129 -11.512 18.537 -1.802 1.00 0.53 H new ATOM 0 HB VAL A 129 -11.357 15.819 -0.420 1.00 0.57 H new ATOM 0 HG11 VAL A 129 -11.360 17.181 1.646 1.00 1.40 H new ATOM 0 HG12 VAL A 129 -9.965 17.580 0.615 1.00 1.40 H new ATOM 0 HG13 VAL A 129 -11.373 18.667 0.666 1.00 1.40 H new ATOM 0 HG21 VAL A 129 -13.516 16.467 0.614 1.00 1.22 H new ATOM 0 HG22 VAL A 129 -13.546 17.945 -0.377 1.00 1.22 H new ATOM 0 HG23 VAL A 129 -13.662 16.349 -1.156 1.00 1.22 H new ATOM 1957 N PRO A 130 -9.135 18.035 -2.885 1.00 0.62 N ATOM 1958 CA PRO A 130 -7.685 17.911 -3.151 1.00 0.73 C ATOM 1959 C PRO A 130 -6.872 18.188 -1.875 1.00 0.65 C ATOM 1960 O PRO A 130 -5.720 17.814 -1.769 1.00 0.64 O ATOM 1961 CB PRO A 130 -7.389 18.912 -4.287 1.00 1.00 C ATOM 1962 CG PRO A 130 -8.739 19.593 -4.667 1.00 1.00 C ATOM 1963 CD PRO A 130 -9.830 19.041 -3.717 1.00 0.75 C ATOM 0 HA PRO A 130 -7.398 16.903 -3.452 1.00 0.73 H new ATOM 0 HB2 PRO A 130 -6.661 19.656 -3.964 1.00 1.00 H new ATOM 0 HB3 PRO A 130 -6.961 18.400 -5.149 1.00 1.00 H new ATOM 0 HG2 PRO A 130 -8.661 20.676 -4.571 1.00 1.00 H new ATOM 0 HG3 PRO A 130 -8.994 19.382 -5.706 1.00 1.00 H new ATOM 0 HD2 PRO A 130 -10.258 19.834 -3.104 1.00 0.75 H new ATOM 0 HD3 PRO A 130 -10.651 18.592 -4.276 1.00 0.75 H new ATOM 1971 N GLU A 131 -7.476 18.790 -0.896 1.00 0.73 N ATOM 1972 CA GLU A 131 -6.766 19.037 0.388 1.00 0.82 C ATOM 1973 C GLU A 131 -6.478 17.701 1.077 1.00 0.72 C ATOM 1974 O GLU A 131 -5.468 17.511 1.728 1.00 0.73 O ATOM 1975 CB GLU A 131 -7.691 19.833 1.322 1.00 1.09 C ATOM 1976 CG GLU A 131 -6.883 20.289 2.551 1.00 1.55 C ATOM 1977 CD GLU A 131 -7.682 21.317 3.354 1.00 2.17 C ATOM 1978 OE1 GLU A 131 -8.772 20.986 3.787 1.00 2.52 O ATOM 1979 OE2 GLU A 131 -7.183 22.418 3.527 1.00 2.86 O ATOM 0 H GLU A 131 -8.439 19.125 -0.928 1.00 0.73 H new ATOM 0 HA GLU A 131 -5.841 19.578 0.186 1.00 0.82 H new ATOM 0 HB2 GLU A 131 -8.102 20.697 0.799 1.00 1.09 H new ATOM 0 HB3 GLU A 131 -8.535 19.217 1.633 1.00 1.09 H new ATOM 0 HG2 GLU A 131 -6.646 19.430 3.179 1.00 1.55 H new ATOM 0 HG3 GLU A 131 -5.935 20.722 2.232 1.00 1.55 H new ATOM 1986 N LEU A 132 -7.402 16.783 0.944 1.00 0.71 N ATOM 1987 CA LEU A 132 -7.282 15.441 1.578 1.00 0.69 C ATOM 1988 C LEU A 132 -6.438 14.499 0.711 1.00 0.58 C ATOM 1989 O LEU A 132 -5.691 13.693 1.229 1.00 0.59 O ATOM 1990 CB LEU A 132 -8.695 14.869 1.769 1.00 0.80 C ATOM 1991 CG LEU A 132 -8.660 13.618 2.657 1.00 0.60 C ATOM 1992 CD1 LEU A 132 -8.226 13.977 4.095 1.00 1.11 C ATOM 1993 CD2 LEU A 132 -10.060 12.988 2.682 1.00 0.77 C ATOM 0 H LEU A 132 -8.258 16.916 0.406 1.00 0.71 H new ATOM 0 HA LEU A 132 -6.782 15.536 2.542 1.00 0.69 H new ATOM 0 HB2 LEU A 132 -9.340 15.623 2.220 1.00 0.80 H new ATOM 0 HB3 LEU A 132 -9.126 14.620 0.799 1.00 0.80 H new ATOM 0 HG LEU A 132 -7.936 12.912 2.249 1.00 0.60 H new ATOM 0 HD11 LEU A 132 -8.209 13.074 4.706 1.00 1.11 H new ATOM 0 HD12 LEU A 132 -7.231 14.421 4.075 1.00 1.11 H new ATOM 0 HD13 LEU A 132 -8.932 14.690 4.521 1.00 1.11 H new ATOM 0 HD21 LEU A 132 -10.047 12.098 3.310 1.00 0.77 H new ATOM 0 HD22 LEU A 132 -10.775 13.706 3.084 1.00 0.77 H new ATOM 0 HD23 LEU A 132 -10.353 12.713 1.669 1.00 0.77 H new ATOM 2005 N ILE A 133 -6.529 14.571 -0.588 1.00 0.52 N ATOM 2006 CA ILE A 133 -5.699 13.651 -1.424 1.00 0.46 C ATOM 2007 C ILE A 133 -4.226 13.812 -1.037 1.00 0.43 C ATOM 2008 O ILE A 133 -3.520 12.850 -0.810 1.00 0.46 O ATOM 2009 CB ILE A 133 -5.885 13.987 -2.907 1.00 0.45 C ATOM 2010 CG1 ILE A 133 -7.377 13.886 -3.256 1.00 0.42 C ATOM 2011 CG2 ILE A 133 -5.079 12.999 -3.762 1.00 0.49 C ATOM 2012 CD1 ILE A 133 -7.604 14.254 -4.725 1.00 1.19 C ATOM 0 H ILE A 133 -7.130 15.214 -1.103 1.00 0.52 H new ATOM 0 HA ILE A 133 -6.011 12.621 -1.253 1.00 0.46 H new ATOM 0 HB ILE A 133 -5.531 14.998 -3.107 1.00 0.45 H new ATOM 0 HG12 ILE A 133 -7.734 12.873 -3.068 1.00 0.42 H new ATOM 0 HG13 ILE A 133 -7.954 14.552 -2.614 1.00 0.42 H new ATOM 0 HG21 ILE A 133 -5.212 13.238 -4.817 1.00 0.49 H new ATOM 0 HG22 ILE A 133 -4.023 13.072 -3.503 1.00 0.49 H new ATOM 0 HG23 ILE A 133 -5.430 11.984 -3.573 1.00 0.49 H new ATOM 0 HD11 ILE A 133 -8.666 14.178 -4.959 1.00 1.19 H new ATOM 0 HD12 ILE A 133 -7.266 15.275 -4.901 1.00 1.19 H new ATOM 0 HD13 ILE A 133 -7.042 13.571 -5.362 1.00 1.19 H new ATOM 2024 N ARG A 134 -3.764 15.030 -0.956 1.00 0.42 N ATOM 2025 CA ARG A 134 -2.343 15.283 -0.578 1.00 0.43 C ATOM 2026 C ARG A 134 -2.103 14.842 0.872 1.00 0.40 C ATOM 2027 O ARG A 134 -1.079 14.273 1.194 1.00 0.39 O ATOM 2028 CB ARG A 134 -2.068 16.785 -0.697 1.00 0.51 C ATOM 2029 CG ARG A 134 -0.574 17.060 -0.519 1.00 1.26 C ATOM 2030 CD ARG A 134 -0.328 18.571 -0.563 1.00 1.57 C ATOM 2031 NE ARG A 134 -0.792 19.110 -1.873 1.00 2.30 N ATOM 2032 CZ ARG A 134 -0.940 20.397 -2.035 1.00 2.86 C ATOM 2033 NH1 ARG A 134 -0.659 21.214 -1.057 1.00 2.98 N ATOM 2034 NH2 ARG A 134 -1.364 20.867 -3.176 1.00 3.71 N ATOM 0 H ARG A 134 -4.315 15.869 -1.137 1.00 0.42 H new ATOM 0 HA ARG A 134 -1.681 14.721 -1.237 1.00 0.43 H new ATOM 0 HB2 ARG A 134 -2.399 17.148 -1.670 1.00 0.51 H new ATOM 0 HB3 ARG A 134 -2.638 17.328 0.057 1.00 0.51 H new ATOM 0 HG2 ARG A 134 -0.228 16.651 0.430 1.00 1.26 H new ATOM 0 HG3 ARG A 134 -0.005 16.564 -1.306 1.00 1.26 H new ATOM 0 HD2 ARG A 134 -0.859 19.061 0.253 1.00 1.57 H new ATOM 0 HD3 ARG A 134 0.732 18.782 -0.425 1.00 1.57 H new ATOM 0 HE ARG A 134 -0.994 18.473 -2.643 1.00 2.30 H new ATOM 0 HH11 ARG A 134 -0.324 20.847 -0.166 1.00 2.98 H new ATOM 0 HH12 ARG A 134 -0.775 22.220 -1.183 1.00 2.98 H new ATOM 0 HH21 ARG A 134 -1.580 20.229 -3.942 1.00 3.71 H new ATOM 0 HH22 ARG A 134 -1.479 21.873 -3.302 1.00 3.71 H new ATOM 2048 N THR A 135 -3.028 15.122 1.752 1.00 0.41 N ATOM 2049 CA THR A 135 -2.826 14.737 3.179 1.00 0.41 C ATOM 2050 C THR A 135 -2.818 13.215 3.339 1.00 0.39 C ATOM 2051 O THR A 135 -2.188 12.672 4.226 1.00 0.52 O ATOM 2052 CB THR A 135 -3.925 15.335 4.059 1.00 0.42 C ATOM 2053 OG1 THR A 135 -3.831 16.752 4.025 1.00 0.89 O ATOM 2054 CG2 THR A 135 -3.748 14.848 5.501 1.00 0.88 C ATOM 0 H THR A 135 -3.907 15.597 1.547 1.00 0.41 H new ATOM 0 HA THR A 135 -1.860 15.130 3.494 1.00 0.41 H new ATOM 0 HB THR A 135 -4.901 15.022 3.688 1.00 0.42 H new ATOM 0 HG1 THR A 135 -4.357 17.097 3.273 1.00 0.89 H new ATOM 0 HG21 THR A 135 -4.531 15.274 6.128 1.00 0.88 H new ATOM 0 HG22 THR A 135 -3.813 13.760 5.528 1.00 0.88 H new ATOM 0 HG23 THR A 135 -2.773 15.162 5.874 1.00 0.88 H new ATOM 2062 N ILE A 136 -3.486 12.514 2.461 1.00 0.35 N ATOM 2063 CA ILE A 136 -3.487 11.030 2.542 1.00 0.36 C ATOM 2064 C ILE A 136 -2.091 10.548 2.144 1.00 0.35 C ATOM 2065 O ILE A 136 -1.344 10.072 2.976 1.00 0.51 O ATOM 2066 CB ILE A 136 -4.571 10.473 1.599 1.00 0.46 C ATOM 2067 CG1 ILE A 136 -5.954 10.682 2.249 1.00 0.60 C ATOM 2068 CG2 ILE A 136 -4.346 8.976 1.352 1.00 0.94 C ATOM 2069 CD1 ILE A 136 -7.053 10.625 1.184 1.00 0.64 C ATOM 0 H ILE A 136 -4.030 12.908 1.693 1.00 0.35 H new ATOM 0 HA ILE A 136 -3.715 10.680 3.549 1.00 0.36 H new ATOM 0 HB ILE A 136 -4.520 10.997 0.645 1.00 0.46 H new ATOM 0 HG12 ILE A 136 -6.129 9.915 3.004 1.00 0.60 H new ATOM 0 HG13 ILE A 136 -5.982 11.644 2.760 1.00 0.60 H new ATOM 0 HG21 ILE A 136 -5.120 8.597 0.684 1.00 0.94 H new ATOM 0 HG22 ILE A 136 -3.367 8.826 0.896 1.00 0.94 H new ATOM 0 HG23 ILE A 136 -4.391 8.440 2.300 1.00 0.94 H new ATOM 0 HD11 ILE A 136 -8.024 10.774 1.655 1.00 0.64 H new ATOM 0 HD12 ILE A 136 -6.884 11.408 0.445 1.00 0.64 H new ATOM 0 HD13 ILE A 136 -7.033 9.652 0.693 1.00 0.64 H new ATOM 2081 N MET A 137 -1.730 10.661 0.887 1.00 0.35 N ATOM 2082 CA MET A 137 -0.370 10.212 0.441 1.00 0.33 C ATOM 2083 C MET A 137 0.685 10.567 1.501 1.00 0.31 C ATOM 2084 O MET A 137 1.709 9.930 1.631 1.00 0.34 O ATOM 2085 CB MET A 137 -0.022 10.891 -0.890 1.00 0.36 C ATOM 2086 CG MET A 137 -1.006 10.439 -1.982 1.00 0.67 C ATOM 2087 SD MET A 137 -1.151 11.735 -3.239 1.00 1.13 S ATOM 2088 CE MET A 137 0.446 11.464 -4.045 1.00 0.67 C ATOM 0 H MET A 137 -2.319 11.046 0.149 1.00 0.35 H new ATOM 0 HA MET A 137 -0.377 9.130 0.308 1.00 0.33 H new ATOM 0 HB2 MET A 137 -0.063 11.974 -0.777 1.00 0.36 H new ATOM 0 HB3 MET A 137 0.998 10.639 -1.181 1.00 0.36 H new ATOM 0 HG2 MET A 137 -0.659 9.512 -2.438 1.00 0.67 H new ATOM 0 HG3 MET A 137 -1.982 10.232 -1.544 1.00 0.67 H new ATOM 0 HE1 MET A 137 1.038 12.378 -3.996 1.00 0.67 H new ATOM 0 HE2 MET A 137 0.978 10.659 -3.537 1.00 0.67 H new ATOM 0 HE3 MET A 137 0.286 11.191 -5.088 1.00 0.67 H new ATOM 2098 N GLY A 138 0.401 11.588 2.270 1.00 0.31 N ATOM 2099 CA GLY A 138 1.323 12.030 3.359 1.00 0.33 C ATOM 2100 C GLY A 138 1.460 10.905 4.387 1.00 0.33 C ATOM 2101 O GLY A 138 2.548 10.488 4.730 1.00 0.34 O ATOM 0 H GLY A 138 -0.449 12.145 2.186 1.00 0.31 H new ATOM 0 HA2 GLY A 138 2.299 12.282 2.946 1.00 0.33 H new ATOM 0 HA3 GLY A 138 0.937 12.930 3.836 1.00 0.33 H new ATOM 2105 N TRP A 139 0.355 10.403 4.866 1.00 0.34 N ATOM 2106 CA TRP A 139 0.415 9.290 5.857 1.00 0.37 C ATOM 2107 C TRP A 139 1.017 8.046 5.196 1.00 0.35 C ATOM 2108 O TRP A 139 1.470 7.138 5.863 1.00 0.39 O ATOM 2109 CB TRP A 139 -0.980 8.959 6.396 1.00 0.43 C ATOM 2110 CG TRP A 139 -1.603 10.154 7.058 1.00 0.46 C ATOM 2111 CD1 TRP A 139 -0.945 11.120 7.750 1.00 0.54 C ATOM 2112 CD2 TRP A 139 -3.014 10.509 7.112 1.00 0.53 C ATOM 2113 NE1 TRP A 139 -1.866 12.042 8.215 1.00 0.57 N ATOM 2114 CE2 TRP A 139 -3.154 11.709 7.848 1.00 0.56 C ATOM 2115 CE3 TRP A 139 -4.176 9.910 6.594 1.00 0.67 C ATOM 2116 CZ2 TRP A 139 -4.404 12.292 8.063 1.00 0.66 C ATOM 2117 CZ3 TRP A 139 -5.434 10.494 6.808 1.00 0.81 C ATOM 2118 CH2 TRP A 139 -5.547 11.683 7.542 1.00 0.78 C ATOM 0 H TRP A 139 -0.584 10.713 4.616 1.00 0.34 H new ATOM 0 HA TRP A 139 1.041 9.606 6.692 1.00 0.37 H new ATOM 0 HB2 TRP A 139 -1.617 8.619 5.580 1.00 0.43 H new ATOM 0 HB3 TRP A 139 -0.912 8.138 7.110 1.00 0.43 H new ATOM 0 HD1 TRP A 139 0.122 11.162 7.911 1.00 0.54 H new ATOM 0 HE1 TRP A 139 -1.623 12.867 8.762 1.00 0.57 H new ATOM 0 HE3 TRP A 139 -4.100 8.994 6.027 1.00 0.67 H new ATOM 0 HZ2 TRP A 139 -4.486 13.208 8.629 1.00 0.66 H new ATOM 0 HZ3 TRP A 139 -6.320 10.025 6.405 1.00 0.81 H new ATOM 0 HH2 TRP A 139 -6.518 12.128 7.704 1.00 0.78 H new ATOM 2129 N THR A 140 1.030 7.993 3.890 1.00 0.34 N ATOM 2130 CA THR A 140 1.610 6.804 3.202 1.00 0.36 C ATOM 2131 C THR A 140 3.140 6.875 3.260 1.00 0.34 C ATOM 2132 O THR A 140 3.783 6.090 3.927 1.00 0.39 O ATOM 2133 CB THR A 140 1.153 6.784 1.741 1.00 0.38 C ATOM 2134 OG1 THR A 140 -0.257 6.948 1.686 1.00 1.20 O ATOM 2135 CG2 THR A 140 1.539 5.449 1.103 1.00 1.17 C ATOM 0 H THR A 140 0.666 8.719 3.273 1.00 0.34 H new ATOM 0 HA THR A 140 1.270 5.896 3.700 1.00 0.36 H new ATOM 0 HB THR A 140 1.635 7.596 1.197 1.00 0.38 H new ATOM 0 HG1 THR A 140 -0.551 6.937 0.751 1.00 1.20 H new ATOM 0 HG21 THR A 140 1.213 5.435 0.063 1.00 1.17 H new ATOM 0 HG22 THR A 140 2.621 5.324 1.146 1.00 1.17 H new ATOM 0 HG23 THR A 140 1.058 4.634 1.645 1.00 1.17 H new ATOM 2143 N LEU A 141 3.728 7.816 2.569 1.00 0.33 N ATOM 2144 CA LEU A 141 5.216 7.944 2.587 1.00 0.34 C ATOM 2145 C LEU A 141 5.710 8.075 4.028 1.00 0.33 C ATOM 2146 O LEU A 141 6.788 7.629 4.365 1.00 0.33 O ATOM 2147 CB LEU A 141 5.643 9.169 1.778 1.00 0.35 C ATOM 2148 CG LEU A 141 5.093 9.064 0.352 1.00 0.41 C ATOM 2149 CD1 LEU A 141 5.297 10.398 -0.369 1.00 0.99 C ATOM 2150 CD2 LEU A 141 5.821 7.947 -0.412 1.00 0.80 C ATOM 0 H LEU A 141 3.242 8.502 1.992 1.00 0.33 H new ATOM 0 HA LEU A 141 5.655 7.052 2.140 1.00 0.34 H new ATOM 0 HB2 LEU A 141 5.274 10.078 2.254 1.00 0.35 H new ATOM 0 HB3 LEU A 141 6.730 9.240 1.754 1.00 0.35 H new ATOM 0 HG LEU A 141 4.029 8.829 0.393 1.00 0.41 H new ATOM 0 HD11 LEU A 141 4.907 10.326 -1.384 1.00 0.99 H new ATOM 0 HD12 LEU A 141 4.769 11.186 0.168 1.00 0.99 H new ATOM 0 HD13 LEU A 141 6.361 10.633 -0.405 1.00 0.99 H new ATOM 0 HD21 LEU A 141 5.423 7.880 -1.425 1.00 0.80 H new ATOM 0 HD22 LEU A 141 6.887 8.171 -0.455 1.00 0.80 H new ATOM 0 HD23 LEU A 141 5.670 6.997 0.101 1.00 0.80 H new ATOM 2162 N ASP A 142 4.933 8.674 4.883 1.00 0.36 N ATOM 2163 CA ASP A 142 5.366 8.818 6.300 1.00 0.37 C ATOM 2164 C ASP A 142 5.458 7.427 6.928 1.00 0.37 C ATOM 2165 O ASP A 142 6.515 6.978 7.325 1.00 0.42 O ATOM 2166 CB ASP A 142 4.337 9.656 7.063 1.00 0.37 C ATOM 2167 CG ASP A 142 4.838 9.912 8.485 1.00 0.78 C ATOM 2168 OD1 ASP A 142 6.019 10.177 8.637 1.00 1.59 O ATOM 2169 OD2 ASP A 142 4.033 9.838 9.398 1.00 1.32 O ATOM 0 H ASP A 142 4.019 9.070 4.664 1.00 0.36 H new ATOM 0 HA ASP A 142 6.337 9.312 6.346 1.00 0.37 H new ATOM 0 HB2 ASP A 142 4.171 10.603 6.549 1.00 0.37 H new ATOM 0 HB3 ASP A 142 3.379 9.137 7.092 1.00 0.37 H new ATOM 2174 N PHE A 143 4.354 6.739 7.007 1.00 0.41 N ATOM 2175 CA PHE A 143 4.359 5.369 7.591 1.00 0.43 C ATOM 2176 C PHE A 143 5.339 4.484 6.813 1.00 0.43 C ATOM 2177 O PHE A 143 5.985 3.626 7.380 1.00 0.45 O ATOM 2178 CB PHE A 143 2.946 4.784 7.507 1.00 0.44 C ATOM 2179 CG PHE A 143 2.877 3.500 8.299 1.00 0.47 C ATOM 2180 CD1 PHE A 143 2.584 3.535 9.669 1.00 1.29 C ATOM 2181 CD2 PHE A 143 3.100 2.275 7.662 1.00 1.16 C ATOM 2182 CE1 PHE A 143 2.517 2.342 10.400 1.00 1.35 C ATOM 2183 CE2 PHE A 143 3.033 1.083 8.393 1.00 1.22 C ATOM 2184 CZ PHE A 143 2.741 1.116 9.762 1.00 0.72 C ATOM 0 H PHE A 143 3.442 7.069 6.690 1.00 0.41 H new ATOM 0 HA PHE A 143 4.672 5.412 8.634 1.00 0.43 H new ATOM 0 HB2 PHE A 143 2.222 5.501 7.895 1.00 0.44 H new ATOM 0 HB3 PHE A 143 2.682 4.595 6.467 1.00 0.44 H new ATOM 0 HD1 PHE A 143 2.410 4.481 10.161 1.00 1.29 H new ATOM 0 HD2 PHE A 143 3.324 2.249 6.606 1.00 1.16 H new ATOM 0 HE1 PHE A 143 2.292 2.368 11.456 1.00 1.35 H new ATOM 0 HE2 PHE A 143 3.207 0.137 7.901 1.00 1.22 H new ATOM 0 HZ PHE A 143 2.689 0.196 10.326 1.00 0.72 H new ATOM 2194 N LEU A 144 5.466 4.675 5.528 1.00 0.45 N ATOM 2195 CA LEU A 144 6.420 3.828 4.748 1.00 0.47 C ATOM 2196 C LEU A 144 7.848 4.228 5.133 1.00 0.47 C ATOM 2197 O LEU A 144 8.652 3.392 5.498 1.00 0.49 O ATOM 2198 CB LEU A 144 6.165 4.042 3.250 1.00 0.49 C ATOM 2199 CG LEU A 144 6.635 2.843 2.401 1.00 0.64 C ATOM 2200 CD1 LEU A 144 5.543 1.762 2.408 1.00 1.31 C ATOM 2201 CD2 LEU A 144 6.868 3.353 0.972 1.00 1.01 C ATOM 0 H LEU A 144 4.957 5.373 4.986 1.00 0.45 H new ATOM 0 HA LEU A 144 6.280 2.770 4.970 1.00 0.47 H new ATOM 0 HB2 LEU A 144 5.100 4.207 3.085 1.00 0.49 H new ATOM 0 HB3 LEU A 144 6.682 4.943 2.920 1.00 0.49 H new ATOM 0 HG LEU A 144 7.553 2.411 2.801 1.00 0.64 H new ATOM 0 HD11 LEU A 144 5.869 0.911 1.809 1.00 1.31 H new ATOM 0 HD12 LEU A 144 5.360 1.436 3.432 1.00 1.31 H new ATOM 0 HD13 LEU A 144 4.624 2.170 1.988 1.00 1.31 H new ATOM 0 HD21 LEU A 144 7.202 2.529 0.342 1.00 1.01 H new ATOM 0 HD22 LEU A 144 5.938 3.760 0.575 1.00 1.01 H new ATOM 0 HD23 LEU A 144 7.629 4.133 0.984 1.00 1.01 H new ATOM 2213 N ARG A 145 8.169 5.479 5.078 1.00 0.47 N ATOM 2214 CA ARG A 145 9.540 5.904 5.466 1.00 0.48 C ATOM 2215 C ARG A 145 9.795 5.583 6.945 1.00 0.49 C ATOM 2216 O ARG A 145 10.907 5.284 7.335 1.00 0.50 O ATOM 2217 CB ARG A 145 9.691 7.407 5.239 1.00 0.49 C ATOM 2218 CG ARG A 145 11.137 7.814 5.526 1.00 0.69 C ATOM 2219 CD ARG A 145 11.352 9.280 5.144 1.00 0.68 C ATOM 2220 NE ARG A 145 11.542 9.387 3.670 1.00 1.56 N ATOM 2221 CZ ARG A 145 11.435 10.547 3.084 1.00 2.10 C ATOM 2222 NH1 ARG A 145 11.154 11.609 3.789 1.00 2.12 N ATOM 2223 NH2 ARG A 145 11.609 10.648 1.795 1.00 3.16 N ATOM 0 H ARG A 145 7.546 6.230 4.782 1.00 0.47 H new ATOM 0 HA ARG A 145 10.264 5.365 4.855 1.00 0.48 H new ATOM 0 HB2 ARG A 145 9.426 7.661 4.213 1.00 0.49 H new ATOM 0 HB3 ARG A 145 9.010 7.956 5.889 1.00 0.49 H new ATOM 0 HG2 ARG A 145 11.362 7.668 6.582 1.00 0.69 H new ATOM 0 HG3 ARG A 145 11.821 7.179 4.963 1.00 0.69 H new ATOM 0 HD2 ARG A 145 10.495 9.877 5.455 1.00 0.68 H new ATOM 0 HD3 ARG A 145 12.224 9.678 5.664 1.00 0.68 H new ATOM 0 HE ARG A 145 11.755 8.555 3.120 1.00 1.56 H new ATOM 0 HH11 ARG A 145 11.018 11.531 4.797 1.00 2.12 H new ATOM 0 HH12 ARG A 145 11.070 12.517 3.332 1.00 2.12 H new ATOM 0 HH21 ARG A 145 11.829 9.819 1.244 1.00 3.16 H new ATOM 0 HH22 ARG A 145 11.525 11.556 1.339 1.00 3.16 H new ATOM 2237 N GLU A 146 8.799 5.693 7.786 1.00 0.49 N ATOM 2238 CA GLU A 146 9.029 5.446 9.246 1.00 0.51 C ATOM 2239 C GLU A 146 8.960 3.955 9.620 1.00 0.53 C ATOM 2240 O GLU A 146 9.788 3.507 10.389 1.00 0.55 O ATOM 2241 CB GLU A 146 7.996 6.223 10.067 1.00 0.52 C ATOM 2242 CG GLU A 146 8.212 7.725 9.877 1.00 0.96 C ATOM 2243 CD GLU A 146 7.107 8.495 10.604 1.00 1.48 C ATOM 2244 OE1 GLU A 146 5.957 8.110 10.468 1.00 2.22 O ATOM 2245 OE2 GLU A 146 7.430 9.454 11.284 1.00 2.03 O ATOM 0 H GLU A 146 7.843 5.941 7.531 1.00 0.49 H new ATOM 0 HA GLU A 146 10.039 5.789 9.472 1.00 0.51 H new ATOM 0 HB2 GLU A 146 6.988 5.948 9.755 1.00 0.52 H new ATOM 0 HB3 GLU A 146 8.085 5.963 11.122 1.00 0.52 H new ATOM 0 HG2 GLU A 146 9.188 8.015 10.266 1.00 0.96 H new ATOM 0 HG3 GLU A 146 8.205 7.973 8.816 1.00 0.96 H new ATOM 2252 N ARG A 147 7.980 3.185 9.175 1.00 0.59 N ATOM 2253 CA ARG A 147 7.914 1.744 9.646 1.00 0.62 C ATOM 2254 C ARG A 147 8.239 0.732 8.538 1.00 0.58 C ATOM 2255 O ARG A 147 8.990 -0.203 8.731 1.00 0.62 O ATOM 2256 CB ARG A 147 6.496 1.472 10.167 1.00 0.63 C ATOM 2257 CG ARG A 147 6.153 2.452 11.311 1.00 0.73 C ATOM 2258 CD ARG A 147 6.672 1.919 12.655 1.00 1.11 C ATOM 2259 NE ARG A 147 6.705 3.034 13.646 1.00 1.75 N ATOM 2260 CZ ARG A 147 6.842 2.774 14.917 1.00 2.40 C ATOM 2261 NH1 ARG A 147 6.970 1.540 15.320 1.00 2.71 N ATOM 2262 NH2 ARG A 147 6.858 3.749 15.785 1.00 3.30 N ATOM 0 H ARG A 147 7.246 3.475 8.529 1.00 0.59 H new ATOM 0 HA ARG A 147 8.666 1.617 10.425 1.00 0.62 H new ATOM 0 HB2 ARG A 147 5.775 1.581 9.356 1.00 0.63 H new ATOM 0 HB3 ARG A 147 6.422 0.445 10.524 1.00 0.63 H new ATOM 0 HG2 ARG A 147 6.594 3.427 11.106 1.00 0.73 H new ATOM 0 HG3 ARG A 147 5.074 2.595 11.363 1.00 0.73 H new ATOM 0 HD2 ARG A 147 6.028 1.116 13.014 1.00 1.11 H new ATOM 0 HD3 ARG A 147 7.669 1.497 12.532 1.00 1.11 H new ATOM 0 HE ARG A 147 6.620 4.000 13.330 1.00 1.75 H new ATOM 0 HH11 ARG A 147 6.963 0.779 14.641 1.00 2.71 H new ATOM 0 HH12 ARG A 147 7.077 1.337 16.314 1.00 2.71 H new ATOM 0 HH21 ARG A 147 6.763 4.714 15.469 1.00 3.30 H new ATOM 0 HH22 ARG A 147 6.965 3.545 16.779 1.00 3.30 H new ATOM 2276 N LEU A 148 7.630 0.889 7.395 1.00 0.53 N ATOM 2277 CA LEU A 148 7.819 -0.065 6.257 1.00 0.57 C ATOM 2278 C LEU A 148 9.080 0.263 5.437 1.00 0.67 C ATOM 2279 O LEU A 148 9.110 0.048 4.241 1.00 1.61 O ATOM 2280 CB LEU A 148 6.555 0.057 5.355 1.00 0.59 C ATOM 2281 CG LEU A 148 5.840 -1.302 5.218 1.00 0.70 C ATOM 2282 CD1 LEU A 148 5.333 -1.780 6.600 1.00 1.29 C ATOM 2283 CD2 LEU A 148 4.660 -1.147 4.247 1.00 1.34 C ATOM 0 H LEU A 148 6.991 1.659 7.194 1.00 0.53 H new ATOM 0 HA LEU A 148 7.948 -1.077 6.640 1.00 0.57 H new ATOM 0 HB2 LEU A 148 5.870 0.791 5.780 1.00 0.59 H new ATOM 0 HB3 LEU A 148 6.842 0.422 4.369 1.00 0.59 H new ATOM 0 HG LEU A 148 6.538 -2.045 4.832 1.00 0.70 H new ATOM 0 HD11 LEU A 148 4.830 -2.741 6.491 1.00 1.29 H new ATOM 0 HD12 LEU A 148 6.178 -1.888 7.280 1.00 1.29 H new ATOM 0 HD13 LEU A 148 4.634 -1.048 7.004 1.00 1.29 H new ATOM 0 HD21 LEU A 148 4.147 -2.103 4.143 1.00 1.34 H new ATOM 0 HD22 LEU A 148 3.965 -0.402 4.635 1.00 1.34 H new ATOM 0 HD23 LEU A 148 5.030 -0.825 3.273 1.00 1.34 H new ATOM 2295 N LEU A 149 10.119 0.763 6.055 1.00 0.67 N ATOM 2296 CA LEU A 149 11.372 1.081 5.286 1.00 0.57 C ATOM 2297 C LEU A 149 12.448 0.038 5.611 1.00 0.56 C ATOM 2298 O LEU A 149 13.095 -0.486 4.726 1.00 0.58 O ATOM 2299 CB LEU A 149 11.864 2.486 5.654 1.00 0.54 C ATOM 2300 CG LEU A 149 12.955 2.944 4.670 1.00 0.59 C ATOM 2301 CD1 LEU A 149 12.347 3.281 3.293 1.00 0.83 C ATOM 2302 CD2 LEU A 149 13.645 4.188 5.242 1.00 1.21 C ATOM 0 H LEU A 149 10.160 0.966 7.054 1.00 0.67 H new ATOM 0 HA LEU A 149 11.162 1.054 4.217 1.00 0.57 H new ATOM 0 HB2 LEU A 149 11.030 3.187 5.635 1.00 0.54 H new ATOM 0 HB3 LEU A 149 12.258 2.486 6.670 1.00 0.54 H new ATOM 0 HG LEU A 149 13.675 2.137 4.538 1.00 0.59 H new ATOM 0 HD11 LEU A 149 13.138 3.602 2.615 1.00 0.83 H new ATOM 0 HD12 LEU A 149 11.856 2.397 2.886 1.00 0.83 H new ATOM 0 HD13 LEU A 149 11.617 4.082 3.404 1.00 0.83 H new ATOM 0 HD21 LEU A 149 14.421 4.523 4.553 1.00 1.21 H new ATOM 0 HD22 LEU A 149 12.911 4.982 5.375 1.00 1.21 H new ATOM 0 HD23 LEU A 149 14.095 3.944 6.205 1.00 1.21 H new ATOM 2314 N GLY A 150 12.659 -0.264 6.861 1.00 0.56 N ATOM 2315 CA GLY A 150 13.708 -1.267 7.217 1.00 0.58 C ATOM 2316 C GLY A 150 13.289 -2.674 6.762 1.00 0.62 C ATOM 2317 O GLY A 150 14.106 -3.460 6.326 1.00 0.70 O ATOM 0 H GLY A 150 12.154 0.137 7.651 1.00 0.56 H new ATOM 0 HA2 GLY A 150 14.653 -0.994 6.748 1.00 0.58 H new ATOM 0 HA3 GLY A 150 13.873 -1.262 8.294 1.00 0.58 H new ATOM 2321 N TRP A 151 12.032 -3.010 6.889 1.00 0.63 N ATOM 2322 CA TRP A 151 11.575 -4.380 6.497 1.00 0.69 C ATOM 2323 C TRP A 151 11.628 -4.567 4.977 1.00 0.70 C ATOM 2324 O TRP A 151 11.956 -5.630 4.488 1.00 0.72 O ATOM 2325 CB TRP A 151 10.138 -4.590 6.976 1.00 0.73 C ATOM 2326 CG TRP A 151 9.752 -6.020 6.777 1.00 1.25 C ATOM 2327 CD1 TRP A 151 9.089 -6.502 5.701 1.00 2.17 C ATOM 2328 CD2 TRP A 151 9.994 -7.158 7.653 1.00 1.86 C ATOM 2329 NE1 TRP A 151 8.908 -7.864 5.862 1.00 2.65 N ATOM 2330 CE2 TRP A 151 9.448 -8.316 7.049 1.00 2.43 C ATOM 2331 CE3 TRP A 151 10.627 -7.298 8.901 1.00 2.68 C ATOM 2332 CZ2 TRP A 151 9.527 -9.567 7.662 1.00 3.17 C ATOM 2333 CZ3 TRP A 151 10.709 -8.556 9.521 1.00 3.62 C ATOM 2334 CH2 TRP A 151 10.160 -9.688 8.902 1.00 3.67 C ATOM 0 H TRP A 151 11.300 -2.396 7.247 1.00 0.63 H new ATOM 0 HA TRP A 151 12.241 -5.108 6.960 1.00 0.69 H new ATOM 0 HB2 TRP A 151 10.051 -4.322 8.029 1.00 0.73 H new ATOM 0 HB3 TRP A 151 9.460 -3.939 6.424 1.00 0.73 H new ATOM 0 HD1 TRP A 151 8.756 -5.919 4.855 1.00 2.17 H new ATOM 0 HE1 TRP A 151 8.433 -8.462 5.186 1.00 2.65 H new ATOM 0 HE3 TRP A 151 11.053 -6.432 9.386 1.00 2.68 H new ATOM 0 HZ2 TRP A 151 9.102 -10.436 7.181 1.00 3.17 H new ATOM 0 HZ3 TRP A 151 11.197 -8.652 10.479 1.00 3.62 H new ATOM 0 HH2 TRP A 151 10.226 -10.653 9.383 1.00 3.67 H new ATOM 2345 N ILE A 152 11.306 -3.554 4.224 1.00 0.73 N ATOM 2346 CA ILE A 152 11.341 -3.699 2.741 1.00 0.76 C ATOM 2347 C ILE A 152 12.793 -3.798 2.271 1.00 0.79 C ATOM 2348 O ILE A 152 13.148 -4.681 1.516 1.00 0.89 O ATOM 2349 CB ILE A 152 10.660 -2.493 2.085 1.00 0.78 C ATOM 2350 CG1 ILE A 152 9.232 -2.375 2.627 1.00 0.83 C ATOM 2351 CG2 ILE A 152 10.615 -2.688 0.563 1.00 0.92 C ATOM 2352 CD1 ILE A 152 8.519 -1.189 1.971 1.00 0.94 C ATOM 0 H ILE A 152 11.022 -2.637 4.567 1.00 0.73 H new ATOM 0 HA ILE A 152 10.808 -4.606 2.454 1.00 0.76 H new ATOM 0 HB ILE A 152 11.220 -1.586 2.312 1.00 0.78 H new ATOM 0 HG12 ILE A 152 8.682 -3.295 2.429 1.00 0.83 H new ATOM 0 HG13 ILE A 152 9.255 -2.243 3.709 1.00 0.83 H new ATOM 0 HG21 ILE A 152 10.130 -1.828 0.100 1.00 0.92 H new ATOM 0 HG22 ILE A 152 11.630 -2.783 0.178 1.00 0.92 H new ATOM 0 HG23 ILE A 152 10.053 -3.592 0.328 1.00 0.92 H new ATOM 0 HD11 ILE A 152 7.504 -1.113 2.362 1.00 0.94 H new ATOM 0 HD12 ILE A 152 9.063 -0.270 2.191 1.00 0.94 H new ATOM 0 HD13 ILE A 152 8.481 -1.339 0.892 1.00 0.94 H new ATOM 2364 N GLN A 153 13.633 -2.898 2.697 1.00 0.77 N ATOM 2365 CA GLN A 153 15.053 -2.951 2.250 1.00 0.80 C ATOM 2366 C GLN A 153 15.610 -4.370 2.444 1.00 0.81 C ATOM 2367 O GLN A 153 16.362 -4.861 1.625 1.00 0.82 O ATOM 2368 CB GLN A 153 15.906 -1.937 3.048 1.00 0.82 C ATOM 2369 CG GLN A 153 17.108 -1.422 2.214 1.00 1.09 C ATOM 2370 CD GLN A 153 17.622 -2.505 1.252 1.00 1.98 C ATOM 2371 OE1 GLN A 153 18.330 -3.407 1.656 1.00 2.66 O ATOM 2372 NE2 GLN A 153 17.294 -2.448 -0.010 1.00 2.77 N ATOM 0 H GLN A 153 13.401 -2.133 3.331 1.00 0.77 H new ATOM 0 HA GLN A 153 15.097 -2.690 1.193 1.00 0.80 H new ATOM 0 HB2 GLN A 153 15.284 -1.094 3.349 1.00 0.82 H new ATOM 0 HB3 GLN A 153 16.271 -2.407 3.962 1.00 0.82 H new ATOM 0 HG2 GLN A 153 16.809 -0.540 1.647 1.00 1.09 H new ATOM 0 HG3 GLN A 153 17.912 -1.114 2.882 1.00 1.09 H new ATOM 0 HE21 GLN A 153 16.700 -1.691 -0.349 1.00 2.77 H new ATOM 0 HE22 GLN A 153 17.632 -3.160 -0.657 1.00 2.77 H new ATOM 2381 N ASP A 154 15.276 -5.028 3.522 1.00 0.83 N ATOM 2382 CA ASP A 154 15.828 -6.397 3.743 1.00 0.86 C ATOM 2383 C ASP A 154 15.541 -7.269 2.516 1.00 0.85 C ATOM 2384 O ASP A 154 16.316 -8.134 2.158 1.00 0.94 O ATOM 2385 CB ASP A 154 15.180 -7.018 4.985 1.00 0.90 C ATOM 2386 CG ASP A 154 15.760 -8.412 5.228 1.00 1.28 C ATOM 2387 OD1 ASP A 154 16.928 -8.606 4.937 1.00 1.99 O ATOM 2388 OD2 ASP A 154 15.025 -9.263 5.703 1.00 1.84 O ATOM 0 H ASP A 154 14.652 -4.682 4.251 1.00 0.83 H new ATOM 0 HA ASP A 154 16.906 -6.334 3.895 1.00 0.86 H new ATOM 0 HB2 ASP A 154 15.356 -6.384 5.854 1.00 0.90 H new ATOM 0 HB3 ASP A 154 14.100 -7.081 4.850 1.00 0.90 H new ATOM 2393 N GLN A 155 14.421 -7.053 1.882 1.00 0.79 N ATOM 2394 CA GLN A 155 14.068 -7.875 0.689 1.00 0.79 C ATOM 2395 C GLN A 155 15.175 -7.760 -0.364 1.00 0.72 C ATOM 2396 O GLN A 155 15.570 -8.735 -0.971 1.00 1.03 O ATOM 2397 CB GLN A 155 12.744 -7.394 0.096 1.00 0.90 C ATOM 2398 CG GLN A 155 11.630 -7.561 1.129 1.00 1.37 C ATOM 2399 CD GLN A 155 10.304 -7.094 0.527 1.00 2.01 C ATOM 2400 OE1 GLN A 155 9.342 -6.880 1.237 1.00 2.72 O ATOM 2401 NE2 GLN A 155 10.212 -6.927 -0.764 1.00 2.54 N ATOM 0 H GLN A 155 13.735 -6.343 2.138 1.00 0.79 H new ATOM 0 HA GLN A 155 13.965 -8.917 0.994 1.00 0.79 H new ATOM 0 HB2 GLN A 155 12.825 -6.348 -0.201 1.00 0.90 H new ATOM 0 HB3 GLN A 155 12.508 -7.963 -0.803 1.00 0.90 H new ATOM 0 HG2 GLN A 155 11.556 -8.605 1.434 1.00 1.37 H new ATOM 0 HG3 GLN A 155 11.859 -6.983 2.024 1.00 1.37 H new ATOM 0 HE21 GLN A 155 11.020 -7.107 -1.360 1.00 2.54 H new ATOM 0 HE22 GLN A 155 9.332 -6.617 -1.177 1.00 2.54 H new ATOM 2410 N GLY A 156 15.682 -6.568 -0.572 1.00 0.63 N ATOM 2411 CA GLY A 156 16.776 -6.355 -1.575 1.00 0.72 C ATOM 2412 C GLY A 156 16.293 -5.401 -2.671 1.00 0.87 C ATOM 2413 O GLY A 156 16.969 -5.190 -3.659 1.00 1.38 O ATOM 0 H GLY A 156 15.382 -5.724 -0.084 1.00 0.63 H new ATOM 0 HA2 GLY A 156 17.658 -5.943 -1.084 1.00 0.72 H new ATOM 0 HA3 GLY A 156 17.071 -7.308 -2.013 1.00 0.72 H new ATOM 2417 N GLY A 157 15.130 -4.819 -2.501 1.00 0.81 N ATOM 2418 CA GLY A 157 14.587 -3.865 -3.525 1.00 1.10 C ATOM 2419 C GLY A 157 13.194 -4.324 -3.964 1.00 0.84 C ATOM 2420 O GLY A 157 12.773 -5.430 -3.693 1.00 0.88 O ATOM 0 H GLY A 157 14.528 -4.964 -1.691 1.00 0.81 H new ATOM 0 HA2 GLY A 157 14.535 -2.859 -3.109 1.00 1.10 H new ATOM 0 HA3 GLY A 157 15.255 -3.820 -4.386 1.00 1.10 H new ATOM 2424 N TRP A 158 12.475 -3.464 -4.636 1.00 0.67 N ATOM 2425 CA TRP A 158 11.100 -3.816 -5.096 1.00 0.50 C ATOM 2426 C TRP A 158 11.147 -5.045 -6.007 1.00 0.51 C ATOM 2427 O TRP A 158 10.118 -5.567 -6.406 1.00 0.53 O ATOM 2428 CB TRP A 158 10.499 -2.636 -5.864 1.00 0.51 C ATOM 2429 CG TRP A 158 10.210 -1.507 -4.925 1.00 0.46 C ATOM 2430 CD1 TRP A 158 10.820 -0.299 -4.951 1.00 0.59 C ATOM 2431 CD2 TRP A 158 9.247 -1.455 -3.834 1.00 0.46 C ATOM 2432 NE1 TRP A 158 10.291 0.490 -3.945 1.00 0.55 N ATOM 2433 CE2 TRP A 158 9.318 -0.178 -3.229 1.00 0.47 C ATOM 2434 CE3 TRP A 158 8.328 -2.383 -3.317 1.00 0.65 C ATOM 2435 CZ2 TRP A 158 8.504 0.165 -2.148 1.00 0.58 C ATOM 2436 CZ3 TRP A 158 7.507 -2.042 -2.229 1.00 0.84 C ATOM 2437 CH2 TRP A 158 7.595 -0.770 -1.647 1.00 0.78 C ATOM 0 H TRP A 158 12.784 -2.525 -4.888 1.00 0.67 H new ATOM 0 HA TRP A 158 10.483 -4.041 -4.226 1.00 0.50 H new ATOM 0 HB2 TRP A 158 11.190 -2.307 -6.640 1.00 0.51 H new ATOM 0 HB3 TRP A 158 9.582 -2.947 -6.365 1.00 0.51 H new ATOM 0 HD1 TRP A 158 11.593 0.000 -5.643 1.00 0.59 H new ATOM 0 HE1 TRP A 158 10.584 1.448 -3.756 1.00 0.55 H new ATOM 0 HE3 TRP A 158 8.252 -3.366 -3.759 1.00 0.65 H new ATOM 0 HZ2 TRP A 158 8.576 1.146 -1.702 1.00 0.58 H new ATOM 0 HZ3 TRP A 158 6.804 -2.764 -1.839 1.00 0.84 H new ATOM 0 HH2 TRP A 158 6.960 -0.513 -0.812 1.00 0.78 H new ATOM 2448 N ASP A 159 12.307 -5.524 -6.357 1.00 0.50 N ATOM 2449 CA ASP A 159 12.349 -6.713 -7.249 1.00 0.51 C ATOM 2450 C ASP A 159 11.728 -7.903 -6.514 1.00 0.51 C ATOM 2451 O ASP A 159 11.089 -8.748 -7.109 1.00 0.51 O ATOM 2452 CB ASP A 159 13.799 -7.024 -7.625 1.00 0.54 C ATOM 2453 CG ASP A 159 14.413 -5.817 -8.338 1.00 1.66 C ATOM 2454 OD1 ASP A 159 14.833 -4.899 -7.652 1.00 2.46 O ATOM 2455 OD2 ASP A 159 14.454 -5.831 -9.557 1.00 2.37 O ATOM 0 H ASP A 159 13.212 -5.152 -6.070 1.00 0.50 H new ATOM 0 HA ASP A 159 11.787 -6.515 -8.162 1.00 0.51 H new ATOM 0 HB2 ASP A 159 14.374 -7.263 -6.730 1.00 0.54 H new ATOM 0 HB3 ASP A 159 13.838 -7.900 -8.272 1.00 0.54 H new ATOM 2460 N GLY A 160 11.900 -7.967 -5.220 1.00 0.52 N ATOM 2461 CA GLY A 160 11.307 -9.094 -4.443 1.00 0.54 C ATOM 2462 C GLY A 160 9.788 -9.071 -4.616 1.00 0.53 C ATOM 2463 O GLY A 160 9.132 -10.094 -4.582 1.00 0.54 O ATOM 0 H GLY A 160 12.425 -7.288 -4.668 1.00 0.52 H new ATOM 0 HA2 GLY A 160 11.711 -10.045 -4.790 1.00 0.54 H new ATOM 0 HA3 GLY A 160 11.568 -9.003 -3.389 1.00 0.54 H new ATOM 2467 N LEU A 161 9.226 -7.911 -4.817 1.00 0.54 N ATOM 2468 CA LEU A 161 7.752 -7.817 -5.010 1.00 0.56 C ATOM 2469 C LEU A 161 7.357 -8.570 -6.282 1.00 0.56 C ATOM 2470 O LEU A 161 6.451 -9.380 -6.296 1.00 0.62 O ATOM 2471 CB LEU A 161 7.355 -6.328 -5.163 1.00 0.58 C ATOM 2472 CG LEU A 161 5.930 -6.116 -4.606 1.00 0.74 C ATOM 2473 CD1 LEU A 161 5.503 -4.659 -4.782 1.00 1.63 C ATOM 2474 CD2 LEU A 161 4.947 -7.031 -5.346 1.00 1.56 C ATOM 0 H LEU A 161 9.725 -7.022 -4.856 1.00 0.54 H new ATOM 0 HA LEU A 161 7.242 -8.253 -4.151 1.00 0.56 H new ATOM 0 HB2 LEU A 161 8.064 -5.695 -4.629 1.00 0.58 H new ATOM 0 HB3 LEU A 161 7.394 -6.036 -6.212 1.00 0.58 H new ATOM 0 HG LEU A 161 5.928 -6.359 -3.543 1.00 0.74 H new ATOM 0 HD11 LEU A 161 4.497 -4.524 -4.385 1.00 1.63 H new ATOM 0 HD12 LEU A 161 6.195 -4.010 -4.245 1.00 1.63 H new ATOM 0 HD13 LEU A 161 5.512 -4.403 -5.841 1.00 1.63 H new ATOM 0 HD21 LEU A 161 3.942 -6.880 -4.952 1.00 1.56 H new ATOM 0 HD22 LEU A 161 4.959 -6.793 -6.410 1.00 1.56 H new ATOM 0 HD23 LEU A 161 5.240 -8.071 -5.203 1.00 1.56 H new ATOM 2486 N LEU A 162 8.041 -8.282 -7.364 1.00 0.53 N ATOM 2487 CA LEU A 162 7.733 -8.938 -8.670 1.00 0.56 C ATOM 2488 C LEU A 162 8.314 -10.355 -8.689 1.00 0.55 C ATOM 2489 O LEU A 162 7.692 -11.279 -9.175 1.00 0.57 O ATOM 2490 CB LEU A 162 8.357 -8.087 -9.793 1.00 0.61 C ATOM 2491 CG LEU A 162 8.244 -8.784 -11.157 1.00 0.80 C ATOM 2492 CD1 LEU A 162 6.772 -9.035 -11.498 1.00 1.56 C ATOM 2493 CD2 LEU A 162 8.871 -7.885 -12.230 1.00 1.33 C ATOM 0 H LEU A 162 8.809 -7.611 -7.395 1.00 0.53 H new ATOM 0 HA LEU A 162 6.655 -9.010 -8.815 1.00 0.56 H new ATOM 0 HB2 LEU A 162 7.859 -7.118 -9.836 1.00 0.61 H new ATOM 0 HB3 LEU A 162 9.406 -7.897 -9.566 1.00 0.61 H new ATOM 0 HG LEU A 162 8.766 -9.740 -11.120 1.00 0.80 H new ATOM 0 HD11 LEU A 162 6.702 -9.530 -12.467 1.00 1.56 H new ATOM 0 HD12 LEU A 162 6.325 -9.670 -10.733 1.00 1.56 H new ATOM 0 HD13 LEU A 162 6.240 -8.084 -11.537 1.00 1.56 H new ATOM 0 HD21 LEU A 162 8.795 -8.372 -13.202 1.00 1.33 H new ATOM 0 HD22 LEU A 162 8.343 -6.932 -12.260 1.00 1.33 H new ATOM 0 HD23 LEU A 162 9.920 -7.712 -11.992 1.00 1.33 H new ATOM 2505 N SER A 163 9.491 -10.541 -8.166 1.00 0.54 N ATOM 2506 CA SER A 163 10.086 -11.907 -8.162 1.00 0.56 C ATOM 2507 C SER A 163 9.105 -12.885 -7.509 1.00 0.53 C ATOM 2508 O SER A 163 9.148 -14.074 -7.753 1.00 0.60 O ATOM 2509 CB SER A 163 11.397 -11.895 -7.380 1.00 0.63 C ATOM 2510 OG SER A 163 12.226 -10.850 -7.872 1.00 1.32 O ATOM 0 H SER A 163 10.066 -9.812 -7.743 1.00 0.54 H new ATOM 0 HA SER A 163 10.284 -12.220 -9.187 1.00 0.56 H new ATOM 0 HB2 SER A 163 11.199 -11.749 -6.318 1.00 0.63 H new ATOM 0 HB3 SER A 163 11.903 -12.855 -7.481 1.00 0.63 H new ATOM 0 HG SER A 163 11.847 -9.983 -7.616 1.00 1.32 H new ATOM 2516 N TYR A 164 8.220 -12.396 -6.685 1.00 0.59 N ATOM 2517 CA TYR A 164 7.237 -13.304 -6.025 1.00 0.64 C ATOM 2518 C TYR A 164 6.097 -13.616 -6.999 1.00 0.63 C ATOM 2519 O TYR A 164 5.547 -14.699 -6.985 1.00 0.68 O ATOM 2520 CB TYR A 164 6.664 -12.614 -4.778 1.00 0.69 C ATOM 2521 CG TYR A 164 5.465 -13.385 -4.263 1.00 0.72 C ATOM 2522 CD1 TYR A 164 4.184 -13.088 -4.745 1.00 1.50 C ATOM 2523 CD2 TYR A 164 5.636 -14.398 -3.311 1.00 1.34 C ATOM 2524 CE1 TYR A 164 3.075 -13.802 -4.275 1.00 1.57 C ATOM 2525 CE2 TYR A 164 4.526 -15.112 -2.841 1.00 1.35 C ATOM 2526 CZ TYR A 164 3.246 -14.814 -3.323 1.00 0.87 C ATOM 2527 OH TYR A 164 2.154 -15.519 -2.861 1.00 0.97 O ATOM 0 H TYR A 164 8.134 -11.410 -6.440 1.00 0.59 H new ATOM 0 HA TYR A 164 7.734 -14.230 -5.736 1.00 0.64 H new ATOM 0 HB2 TYR A 164 7.428 -12.553 -4.003 1.00 0.69 H new ATOM 0 HB3 TYR A 164 6.373 -11.592 -5.019 1.00 0.69 H new ATOM 0 HD1 TYR A 164 4.051 -12.308 -5.480 1.00 1.50 H new ATOM 0 HD2 TYR A 164 6.623 -14.629 -2.939 1.00 1.34 H new ATOM 0 HE1 TYR A 164 2.088 -13.572 -4.647 1.00 1.57 H new ATOM 0 HE2 TYR A 164 4.658 -15.893 -2.106 1.00 1.35 H new ATOM 0 HH TYR A 164 2.448 -16.185 -2.206 1.00 0.97 H new ATOM 2537 N PHE A 165 5.731 -12.691 -7.839 1.00 0.64 N ATOM 2538 CA PHE A 165 4.622 -12.967 -8.793 1.00 0.72 C ATOM 2539 C PHE A 165 5.123 -13.864 -9.933 1.00 0.82 C ATOM 2540 O PHE A 165 5.149 -13.466 -11.080 1.00 1.56 O ATOM 2541 CB PHE A 165 4.090 -11.641 -9.366 1.00 0.74 C ATOM 2542 CG PHE A 165 3.063 -11.047 -8.424 1.00 0.84 C ATOM 2543 CD1 PHE A 165 1.757 -11.551 -8.409 1.00 1.65 C ATOM 2544 CD2 PHE A 165 3.417 -9.995 -7.570 1.00 1.42 C ATOM 2545 CE1 PHE A 165 0.805 -11.005 -7.540 1.00 1.96 C ATOM 2546 CE2 PHE A 165 2.464 -9.449 -6.701 1.00 1.71 C ATOM 2547 CZ PHE A 165 1.158 -9.954 -6.686 1.00 1.66 C ATOM 0 H PHE A 165 6.147 -11.762 -7.907 1.00 0.64 H new ATOM 0 HA PHE A 165 3.817 -13.480 -8.267 1.00 0.72 H new ATOM 0 HB2 PHE A 165 4.913 -10.941 -9.509 1.00 0.74 H new ATOM 0 HB3 PHE A 165 3.642 -11.811 -10.345 1.00 0.74 H new ATOM 0 HD1 PHE A 165 1.484 -12.362 -9.068 1.00 1.65 H new ATOM 0 HD2 PHE A 165 4.424 -9.605 -7.582 1.00 1.42 H new ATOM 0 HE1 PHE A 165 -0.202 -11.395 -7.529 1.00 1.96 H new ATOM 0 HE2 PHE A 165 2.737 -8.638 -6.042 1.00 1.71 H new ATOM 0 HZ PHE A 165 0.423 -9.533 -6.016 1.00 1.66 H new ATOM 2557 N GLY A 166 5.541 -15.067 -9.616 1.00 0.94 N ATOM 2558 CA GLY A 166 6.063 -15.999 -10.668 1.00 1.01 C ATOM 2559 C GLY A 166 5.473 -17.397 -10.461 1.00 1.23 C ATOM 2560 O GLY A 166 4.769 -17.914 -11.305 1.00 1.85 O ATOM 0 H GLY A 166 5.543 -15.446 -8.669 1.00 0.94 H new ATOM 0 HA2 GLY A 166 5.802 -15.627 -11.659 1.00 1.01 H new ATOM 0 HA3 GLY A 166 7.151 -16.043 -10.621 1.00 1.01 H new ATOM 2606 N TRP A 170 -2.796 -16.291 -9.566 1.00 1.04 N ATOM 2607 CA TRP A 170 -3.544 -15.060 -9.171 1.00 1.01 C ATOM 2608 C TRP A 170 -4.683 -15.433 -8.217 1.00 0.92 C ATOM 2609 O TRP A 170 -4.985 -14.714 -7.286 1.00 0.95 O ATOM 2610 CB TRP A 170 -4.125 -14.399 -10.422 1.00 1.32 C ATOM 2611 CG TRP A 170 -3.012 -13.884 -11.277 1.00 1.70 C ATOM 2612 CD1 TRP A 170 -2.212 -12.838 -10.965 1.00 2.30 C ATOM 2613 CD2 TRP A 170 -2.562 -14.370 -12.575 1.00 2.52 C ATOM 2614 NE1 TRP A 170 -1.300 -12.651 -11.988 1.00 3.04 N ATOM 2615 CE2 TRP A 170 -1.475 -13.570 -13.003 1.00 3.15 C ATOM 2616 CE3 TRP A 170 -2.986 -15.416 -13.414 1.00 3.32 C ATOM 2617 CZ2 TRP A 170 -0.833 -13.800 -14.221 1.00 4.11 C ATOM 2618 CZ3 TRP A 170 -2.342 -15.650 -14.640 1.00 4.37 C ATOM 2619 CH2 TRP A 170 -1.268 -14.844 -15.042 1.00 4.64 C ATOM 0 HA TRP A 170 -2.866 -14.368 -8.671 1.00 1.01 H new ATOM 0 HB2 TRP A 170 -4.724 -15.118 -10.981 1.00 1.32 H new ATOM 0 HB3 TRP A 170 -4.789 -13.582 -10.139 1.00 1.32 H new ATOM 0 HD1 TRP A 170 -2.275 -12.246 -10.064 1.00 2.30 H new ATOM 0 HE1 TRP A 170 -0.586 -11.923 -11.992 1.00 3.04 H new ATOM 0 HE3 TRP A 170 -3.812 -16.043 -13.114 1.00 3.32 H new ATOM 0 HZ2 TRP A 170 -0.006 -13.176 -14.527 1.00 4.11 H new ATOM 0 HZ3 TRP A 170 -2.676 -16.456 -15.277 1.00 4.37 H new ATOM 0 HH2 TRP A 170 -0.777 -15.030 -15.986 1.00 4.64 H new ATOM 2630 N GLN A 171 -5.321 -16.551 -8.443 1.00 0.88 N ATOM 2631 CA GLN A 171 -6.443 -16.963 -7.551 1.00 0.84 C ATOM 2632 C GLN A 171 -5.927 -17.145 -6.121 1.00 0.75 C ATOM 2633 O GLN A 171 -6.611 -16.832 -5.167 1.00 0.75 O ATOM 2634 CB GLN A 171 -7.049 -18.274 -8.054 1.00 0.88 C ATOM 2635 CG GLN A 171 -7.554 -18.088 -9.487 1.00 1.57 C ATOM 2636 CD GLN A 171 -8.140 -19.406 -9.996 1.00 1.93 C ATOM 2637 OE1 GLN A 171 -9.330 -19.630 -9.906 1.00 2.66 O ATOM 2638 NE2 GLN A 171 -7.348 -20.294 -10.532 1.00 2.34 N ATOM 0 H GLN A 171 -5.114 -17.196 -9.206 1.00 0.88 H new ATOM 0 HA GLN A 171 -7.210 -16.189 -7.559 1.00 0.84 H new ATOM 0 HB2 GLN A 171 -6.303 -19.068 -8.020 1.00 0.88 H new ATOM 0 HB3 GLN A 171 -7.870 -18.580 -7.405 1.00 0.88 H new ATOM 0 HG2 GLN A 171 -8.311 -17.305 -9.518 1.00 1.57 H new ATOM 0 HG3 GLN A 171 -6.737 -17.767 -10.133 1.00 1.57 H new ATOM 0 HE21 GLN A 171 -6.348 -20.106 -10.608 1.00 2.34 H new ATOM 0 HE22 GLN A 171 -7.729 -21.176 -10.875 1.00 2.34 H new ATOM 2647 N THR A 172 -4.727 -17.629 -5.953 1.00 0.67 N ATOM 2648 CA THR A 172 -4.195 -17.796 -4.570 1.00 0.60 C ATOM 2649 C THR A 172 -3.928 -16.399 -3.997 1.00 0.59 C ATOM 2650 O THR A 172 -4.389 -16.072 -2.921 1.00 0.74 O ATOM 2651 CB THR A 172 -2.913 -18.649 -4.615 1.00 0.59 C ATOM 2652 OG1 THR A 172 -3.277 -20.023 -4.598 1.00 0.81 O ATOM 2653 CG2 THR A 172 -2.016 -18.358 -3.406 1.00 0.92 C ATOM 0 H THR A 172 -4.098 -17.913 -6.704 1.00 0.67 H new ATOM 0 HA THR A 172 -4.909 -18.312 -3.929 1.00 0.60 H new ATOM 0 HB THR A 172 -2.362 -18.405 -5.523 1.00 0.59 H new ATOM 0 HG1 THR A 172 -2.468 -20.576 -4.628 1.00 0.81 H new ATOM 0 HG21 THR A 172 -1.118 -18.973 -3.463 1.00 0.92 H new ATOM 0 HG22 THR A 172 -1.735 -17.305 -3.407 1.00 0.92 H new ATOM 0 HG23 THR A 172 -2.557 -18.589 -2.488 1.00 0.92 H new ATOM 2661 N VAL A 173 -3.200 -15.567 -4.687 1.00 0.59 N ATOM 2662 CA VAL A 173 -2.930 -14.197 -4.158 1.00 0.58 C ATOM 2663 C VAL A 173 -4.253 -13.452 -3.952 1.00 0.57 C ATOM 2664 O VAL A 173 -4.364 -12.612 -3.080 1.00 0.60 O ATOM 2665 CB VAL A 173 -2.058 -13.446 -5.172 1.00 0.64 C ATOM 2666 CG1 VAL A 173 -1.984 -11.960 -4.810 1.00 1.13 C ATOM 2667 CG2 VAL A 173 -0.650 -14.045 -5.159 1.00 1.01 C ATOM 0 H VAL A 173 -2.780 -15.774 -5.593 1.00 0.59 H new ATOM 0 HA VAL A 173 -2.413 -14.260 -3.201 1.00 0.58 H new ATOM 0 HB VAL A 173 -2.496 -13.544 -6.165 1.00 0.64 H new ATOM 0 HG11 VAL A 173 -1.362 -11.439 -5.538 1.00 1.13 H new ATOM 0 HG12 VAL A 173 -2.987 -11.533 -4.818 1.00 1.13 H new ATOM 0 HG13 VAL A 173 -1.550 -11.849 -3.816 1.00 1.13 H new ATOM 0 HG21 VAL A 173 -0.023 -13.517 -5.877 1.00 1.01 H new ATOM 0 HG22 VAL A 173 -0.222 -13.946 -4.162 1.00 1.01 H new ATOM 0 HG23 VAL A 173 -0.701 -15.100 -5.429 1.00 1.01 H new ATOM 2677 N THR A 174 -5.259 -13.747 -4.721 1.00 0.55 N ATOM 2678 CA THR A 174 -6.557 -13.043 -4.524 1.00 0.56 C ATOM 2679 C THR A 174 -7.142 -13.451 -3.167 1.00 0.53 C ATOM 2680 O THR A 174 -7.698 -12.639 -2.454 1.00 0.55 O ATOM 2681 CB THR A 174 -7.526 -13.440 -5.643 1.00 0.59 C ATOM 2682 OG1 THR A 174 -6.903 -13.229 -6.902 1.00 1.37 O ATOM 2683 CG2 THR A 174 -8.795 -12.592 -5.550 1.00 1.27 C ATOM 0 H THR A 174 -5.243 -14.438 -5.471 1.00 0.55 H new ATOM 0 HA THR A 174 -6.403 -11.964 -4.549 1.00 0.56 H new ATOM 0 HB THR A 174 -7.790 -14.492 -5.539 1.00 0.59 H new ATOM 0 HG1 THR A 174 -6.388 -14.025 -7.150 1.00 1.37 H new ATOM 0 HG21 THR A 174 -9.482 -12.877 -6.347 1.00 1.27 H new ATOM 0 HG22 THR A 174 -9.272 -12.756 -4.584 1.00 1.27 H new ATOM 0 HG23 THR A 174 -8.537 -11.538 -5.653 1.00 1.27 H new ATOM 2691 N ILE A 175 -7.034 -14.702 -2.809 1.00 0.51 N ATOM 2692 CA ILE A 175 -7.599 -15.161 -1.503 1.00 0.50 C ATOM 2693 C ILE A 175 -6.622 -14.824 -0.369 1.00 0.49 C ATOM 2694 O ILE A 175 -6.994 -14.720 0.783 1.00 0.49 O ATOM 2695 CB ILE A 175 -7.783 -16.677 -1.567 1.00 0.52 C ATOM 2696 CG1 ILE A 175 -8.715 -17.035 -2.729 1.00 0.77 C ATOM 2697 CG2 ILE A 175 -8.384 -17.196 -0.260 1.00 0.87 C ATOM 2698 CD1 ILE A 175 -8.614 -18.534 -3.012 1.00 0.89 C ATOM 0 H ILE A 175 -6.579 -15.428 -3.363 1.00 0.51 H new ATOM 0 HA ILE A 175 -8.552 -14.665 -1.315 1.00 0.50 H new ATOM 0 HB ILE A 175 -6.808 -17.140 -1.720 1.00 0.52 H new ATOM 0 HG12 ILE A 175 -9.743 -16.768 -2.482 1.00 0.77 H new ATOM 0 HG13 ILE A 175 -8.443 -16.466 -3.618 1.00 0.77 H new ATOM 0 HG21 ILE A 175 -8.509 -18.277 -0.321 1.00 0.87 H new ATOM 0 HG22 ILE A 175 -7.718 -16.954 0.568 1.00 0.87 H new ATOM 0 HG23 ILE A 175 -9.354 -16.727 -0.094 1.00 0.87 H new ATOM 0 HD11 ILE A 175 -9.276 -18.794 -3.838 1.00 0.89 H new ATOM 0 HD12 ILE A 175 -7.587 -18.786 -3.276 1.00 0.89 H new ATOM 0 HD13 ILE A 175 -8.907 -19.093 -2.123 1.00 0.89 H new ATOM 2710 N PHE A 176 -5.373 -14.648 -0.703 1.00 0.48 N ATOM 2711 CA PHE A 176 -4.337 -14.311 0.319 1.00 0.49 C ATOM 2712 C PHE A 176 -4.502 -12.849 0.751 1.00 0.49 C ATOM 2713 O PHE A 176 -4.568 -12.542 1.926 1.00 0.56 O ATOM 2714 CB PHE A 176 -2.955 -14.486 -0.340 1.00 0.51 C ATOM 2715 CG PHE A 176 -1.884 -14.633 0.724 1.00 0.51 C ATOM 2716 CD1 PHE A 176 -1.897 -15.744 1.580 1.00 1.23 C ATOM 2717 CD2 PHE A 176 -0.882 -13.663 0.856 1.00 1.41 C ATOM 2718 CE1 PHE A 176 -0.910 -15.882 2.564 1.00 1.22 C ATOM 2719 CE2 PHE A 176 0.105 -13.803 1.840 1.00 1.52 C ATOM 2720 CZ PHE A 176 0.090 -14.912 2.694 1.00 0.76 C ATOM 0 H PHE A 176 -5.019 -14.724 -1.657 1.00 0.48 H new ATOM 0 HA PHE A 176 -4.438 -14.957 1.191 1.00 0.49 H new ATOM 0 HB2 PHE A 176 -2.960 -15.364 -0.985 1.00 0.51 H new ATOM 0 HB3 PHE A 176 -2.734 -13.627 -0.973 1.00 0.51 H new ATOM 0 HD1 PHE A 176 -2.668 -16.493 1.480 1.00 1.23 H new ATOM 0 HD2 PHE A 176 -0.870 -12.806 0.198 1.00 1.41 H new ATOM 0 HE1 PHE A 176 -0.921 -16.738 3.223 1.00 1.22 H new ATOM 0 HE2 PHE A 176 0.878 -13.055 1.940 1.00 1.52 H new ATOM 0 HZ PHE A 176 0.850 -15.019 3.453 1.00 0.76 H new ATOM 2730 N VAL A 177 -4.531 -11.947 -0.188 1.00 0.46 N ATOM 2731 CA VAL A 177 -4.649 -10.500 0.154 1.00 0.48 C ATOM 2732 C VAL A 177 -6.102 -10.143 0.484 1.00 0.44 C ATOM 2733 O VAL A 177 -6.360 -9.211 1.220 1.00 0.57 O ATOM 2734 CB VAL A 177 -4.172 -9.683 -1.053 1.00 0.56 C ATOM 2735 CG1 VAL A 177 -4.429 -8.191 -0.827 1.00 1.20 C ATOM 2736 CG2 VAL A 177 -2.671 -9.914 -1.249 1.00 1.24 C ATOM 0 H VAL A 177 -4.478 -12.150 -1.186 1.00 0.46 H new ATOM 0 HA VAL A 177 -4.039 -10.277 1.029 1.00 0.48 H new ATOM 0 HB VAL A 177 -4.722 -10.002 -1.938 1.00 0.56 H new ATOM 0 HG11 VAL A 177 -4.084 -7.627 -1.694 1.00 1.20 H new ATOM 0 HG12 VAL A 177 -5.497 -8.023 -0.686 1.00 1.20 H new ATOM 0 HG13 VAL A 177 -3.889 -7.859 0.060 1.00 1.20 H new ATOM 0 HG21 VAL A 177 -2.323 -9.337 -2.106 1.00 1.24 H new ATOM 0 HG22 VAL A 177 -2.134 -9.597 -0.355 1.00 1.24 H new ATOM 0 HG23 VAL A 177 -2.486 -10.973 -1.426 1.00 1.24 H new ATOM 2746 N ALA A 178 -7.053 -10.866 -0.032 1.00 0.45 N ATOM 2747 CA ALA A 178 -8.475 -10.541 0.285 1.00 0.43 C ATOM 2748 C ALA A 178 -8.827 -11.086 1.671 1.00 0.40 C ATOM 2749 O ALA A 178 -9.396 -10.396 2.494 1.00 0.40 O ATOM 2750 CB ALA A 178 -9.393 -11.175 -0.761 1.00 0.46 C ATOM 0 H ALA A 178 -6.913 -11.662 -0.655 1.00 0.45 H new ATOM 0 HA ALA A 178 -8.609 -9.459 0.275 1.00 0.43 H new ATOM 0 HB1 ALA A 178 -10.430 -10.936 -0.527 1.00 0.46 H new ATOM 0 HB2 ALA A 178 -9.144 -10.785 -1.748 1.00 0.46 H new ATOM 0 HB3 ALA A 178 -9.259 -12.257 -0.755 1.00 0.46 H new ATOM 2756 N GLY A 179 -8.498 -12.320 1.936 1.00 0.41 N ATOM 2757 CA GLY A 179 -8.821 -12.909 3.267 1.00 0.43 C ATOM 2758 C GLY A 179 -8.113 -12.125 4.375 1.00 0.43 C ATOM 2759 O GLY A 179 -8.656 -11.912 5.441 1.00 0.48 O ATOM 0 H GLY A 179 -8.019 -12.946 1.289 1.00 0.41 H new ATOM 0 HA2 GLY A 179 -9.899 -12.891 3.430 1.00 0.43 H new ATOM 0 HA3 GLY A 179 -8.512 -13.954 3.296 1.00 0.43 H new ATOM 2763 N VAL A 180 -6.898 -11.711 4.140 1.00 0.42 N ATOM 2764 CA VAL A 180 -6.149 -10.964 5.189 1.00 0.45 C ATOM 2765 C VAL A 180 -6.708 -9.550 5.362 1.00 0.45 C ATOM 2766 O VAL A 180 -6.904 -9.075 6.462 1.00 0.43 O ATOM 2767 CB VAL A 180 -4.665 -10.876 4.808 1.00 0.49 C ATOM 2768 CG1 VAL A 180 -3.924 -9.938 5.774 1.00 1.31 C ATOM 2769 CG2 VAL A 180 -4.037 -12.269 4.885 1.00 1.41 C ATOM 0 H VAL A 180 -6.392 -11.858 3.267 1.00 0.42 H new ATOM 0 HA VAL A 180 -6.260 -11.502 6.130 1.00 0.45 H new ATOM 0 HB VAL A 180 -4.584 -10.485 3.794 1.00 0.49 H new ATOM 0 HG11 VAL A 180 -2.872 -9.884 5.493 1.00 1.31 H new ATOM 0 HG12 VAL A 180 -4.365 -8.942 5.724 1.00 1.31 H new ATOM 0 HG13 VAL A 180 -4.009 -10.322 6.791 1.00 1.31 H new ATOM 0 HG21 VAL A 180 -2.983 -12.208 4.615 1.00 1.41 H new ATOM 0 HG22 VAL A 180 -4.130 -12.654 5.900 1.00 1.41 H new ATOM 0 HG23 VAL A 180 -4.551 -12.938 4.195 1.00 1.41 H new ATOM 2779 N LEU A 181 -6.953 -8.869 4.275 1.00 0.49 N ATOM 2780 CA LEU A 181 -7.480 -7.482 4.372 1.00 0.50 C ATOM 2781 C LEU A 181 -8.825 -7.514 5.102 1.00 0.49 C ATOM 2782 O LEU A 181 -9.172 -6.621 5.848 1.00 0.51 O ATOM 2783 CB LEU A 181 -7.655 -6.921 2.950 1.00 0.56 C ATOM 2784 CG LEU A 181 -8.480 -5.625 2.959 1.00 0.64 C ATOM 2785 CD1 LEU A 181 -7.817 -4.578 3.855 1.00 1.60 C ATOM 2786 CD2 LEU A 181 -8.569 -5.085 1.529 1.00 1.20 C ATOM 0 H LEU A 181 -6.810 -9.215 3.326 1.00 0.49 H new ATOM 0 HA LEU A 181 -6.790 -6.845 4.926 1.00 0.50 H new ATOM 0 HB2 LEU A 181 -6.677 -6.729 2.510 1.00 0.56 H new ATOM 0 HB3 LEU A 181 -8.147 -7.664 2.322 1.00 0.56 H new ATOM 0 HG LEU A 181 -9.477 -5.837 3.346 1.00 0.64 H new ATOM 0 HD11 LEU A 181 -8.413 -3.666 3.851 1.00 1.60 H new ATOM 0 HD12 LEU A 181 -7.748 -4.962 4.873 1.00 1.60 H new ATOM 0 HD13 LEU A 181 -6.817 -4.359 3.481 1.00 1.60 H new ATOM 0 HD21 LEU A 181 -9.153 -4.165 1.523 1.00 1.20 H new ATOM 0 HD22 LEU A 181 -7.566 -4.881 1.154 1.00 1.20 H new ATOM 0 HD23 LEU A 181 -9.052 -5.825 0.890 1.00 1.20 H new ATOM 2798 N THR A 182 -9.592 -8.546 4.857 1.00 0.49 N ATOM 2799 CA THR A 182 -10.934 -8.660 5.492 1.00 0.51 C ATOM 2800 C THR A 182 -10.802 -9.015 6.972 1.00 0.48 C ATOM 2801 O THR A 182 -11.531 -8.515 7.799 1.00 0.51 O ATOM 2802 CB THR A 182 -11.747 -9.745 4.781 1.00 0.54 C ATOM 2803 OG1 THR A 182 -11.743 -9.497 3.382 1.00 1.16 O ATOM 2804 CG2 THR A 182 -13.186 -9.729 5.299 1.00 1.07 C ATOM 0 H THR A 182 -9.342 -9.318 4.240 1.00 0.49 H new ATOM 0 HA THR A 182 -11.441 -7.699 5.405 1.00 0.51 H new ATOM 0 HB THR A 182 -11.303 -10.720 4.979 1.00 0.54 H new ATOM 0 HG1 THR A 182 -11.032 -10.023 2.959 1.00 1.16 H new ATOM 0 HG21 THR A 182 -13.764 -10.502 4.792 1.00 1.07 H new ATOM 0 HG22 THR A 182 -13.188 -9.919 6.372 1.00 1.07 H new ATOM 0 HG23 THR A 182 -13.633 -8.754 5.102 1.00 1.07 H new ATOM 2812 N ALA A 183 -9.874 -9.874 7.312 1.00 0.45 N ATOM 2813 CA ALA A 183 -9.699 -10.263 8.743 1.00 0.44 C ATOM 2814 C ALA A 183 -9.592 -8.999 9.598 1.00 0.44 C ATOM 2815 O ALA A 183 -10.315 -8.809 10.555 1.00 0.50 O ATOM 2816 CB ALA A 183 -8.417 -11.087 8.884 1.00 0.46 C ATOM 0 H ALA A 183 -9.230 -10.322 6.660 1.00 0.45 H new ATOM 0 HA ALA A 183 -10.552 -10.855 9.075 1.00 0.44 H new ATOM 0 HB1 ALA A 183 -8.282 -11.375 9.927 1.00 0.46 H new ATOM 0 HB2 ALA A 183 -8.490 -11.982 8.267 1.00 0.46 H new ATOM 0 HB3 ALA A 183 -7.564 -10.491 8.559 1.00 0.46 H new ATOM 2822 N SER A 184 -8.694 -8.130 9.229 1.00 0.47 N ATOM 2823 CA SER A 184 -8.509 -6.849 9.967 1.00 0.51 C ATOM 2824 C SER A 184 -9.820 -6.054 9.994 1.00 0.54 C ATOM 2825 O SER A 184 -10.171 -5.432 10.985 1.00 0.56 O ATOM 2826 CB SER A 184 -7.433 -6.018 9.269 1.00 0.62 C ATOM 2827 OG SER A 184 -7.907 -5.602 7.996 1.00 1.55 O ATOM 0 H SER A 184 -8.069 -8.255 8.433 1.00 0.47 H new ATOM 0 HA SER A 184 -8.208 -7.071 10.991 1.00 0.51 H new ATOM 0 HB2 SER A 184 -7.179 -5.149 9.876 1.00 0.62 H new ATOM 0 HB3 SER A 184 -6.522 -6.605 9.155 1.00 0.62 H new ATOM 0 HG SER A 184 -8.250 -6.378 7.505 1.00 1.55 H new ATOM 2833 N LEU A 185 -10.535 -6.053 8.909 1.00 0.58 N ATOM 2834 CA LEU A 185 -11.806 -5.278 8.835 1.00 0.69 C ATOM 2835 C LEU A 185 -12.887 -5.853 9.768 1.00 0.69 C ATOM 2836 O LEU A 185 -13.752 -5.133 10.227 1.00 0.79 O ATOM 2837 CB LEU A 185 -12.297 -5.321 7.380 1.00 0.71 C ATOM 2838 CG LEU A 185 -13.331 -4.213 7.087 1.00 0.79 C ATOM 2839 CD1 LEU A 185 -12.743 -2.811 7.354 1.00 1.62 C ATOM 2840 CD2 LEU A 185 -13.745 -4.348 5.617 1.00 1.18 C ATOM 0 H LEU A 185 -10.293 -6.561 8.058 1.00 0.58 H new ATOM 0 HA LEU A 185 -11.618 -4.254 9.159 1.00 0.69 H new ATOM 0 HB2 LEU A 185 -11.447 -5.211 6.707 1.00 0.71 H new ATOM 0 HB3 LEU A 185 -12.741 -6.295 7.176 1.00 0.71 H new ATOM 0 HG LEU A 185 -14.193 -4.326 7.745 1.00 0.79 H new ATOM 0 HD11 LEU A 185 -13.496 -2.053 7.138 1.00 1.62 H new ATOM 0 HD12 LEU A 185 -12.442 -2.736 8.399 1.00 1.62 H new ATOM 0 HD13 LEU A 185 -11.875 -2.652 6.714 1.00 1.62 H new ATOM 0 HD21 LEU A 185 -14.478 -3.579 5.373 1.00 1.18 H new ATOM 0 HD22 LEU A 185 -12.869 -4.230 4.980 1.00 1.18 H new ATOM 0 HD23 LEU A 185 -14.184 -5.332 5.451 1.00 1.18 H new ATOM 2852 N THR A 186 -12.874 -7.143 10.034 1.00 0.62 N ATOM 2853 CA THR A 186 -13.939 -7.742 10.916 1.00 0.68 C ATOM 2854 C THR A 186 -13.510 -7.806 12.383 1.00 0.62 C ATOM 2855 O THR A 186 -14.354 -7.902 13.252 1.00 0.64 O ATOM 2856 CB THR A 186 -14.337 -9.131 10.421 1.00 0.73 C ATOM 2857 OG1 THR A 186 -15.259 -9.710 11.334 1.00 0.89 O ATOM 2858 CG2 THR A 186 -13.100 -10.020 10.314 1.00 1.00 C ATOM 0 H THR A 186 -12.180 -7.803 9.683 1.00 0.62 H new ATOM 0 HA THR A 186 -14.805 -7.082 10.857 1.00 0.68 H new ATOM 0 HB THR A 186 -14.799 -9.043 9.438 1.00 0.73 H new ATOM 0 HG1 THR A 186 -15.517 -10.601 11.018 1.00 0.89 H new ATOM 0 HG21 THR A 186 -13.392 -11.009 9.960 1.00 1.00 H new ATOM 0 HG22 THR A 186 -12.394 -9.578 9.612 1.00 1.00 H new ATOM 0 HG23 THR A 186 -12.630 -10.109 11.293 1.00 1.00 H new ATOM 2866 N ILE A 187 -12.249 -7.741 12.710 1.00 0.64 N ATOM 2867 CA ILE A 187 -11.909 -7.786 14.169 1.00 0.66 C ATOM 2868 C ILE A 187 -12.268 -6.422 14.752 1.00 0.66 C ATOM 2869 O ILE A 187 -12.624 -6.315 15.909 1.00 0.75 O ATOM 2870 CB ILE A 187 -10.432 -8.106 14.386 1.00 0.72 C ATOM 2871 CG1 ILE A 187 -9.574 -7.161 13.554 1.00 0.88 C ATOM 2872 CG2 ILE A 187 -10.157 -9.548 13.951 1.00 1.57 C ATOM 2873 CD1 ILE A 187 -8.100 -7.289 13.971 1.00 0.87 C ATOM 0 H ILE A 187 -11.464 -7.662 12.064 1.00 0.64 H new ATOM 0 HA ILE A 187 -12.469 -8.577 14.667 1.00 0.66 H new ATOM 0 HB ILE A 187 -10.188 -7.984 15.441 1.00 0.72 H new ATOM 0 HG12 ILE A 187 -9.683 -7.394 12.495 1.00 0.88 H new ATOM 0 HG13 ILE A 187 -9.912 -6.134 13.691 1.00 0.88 H new ATOM 0 HG21 ILE A 187 -9.103 -9.780 14.105 1.00 1.57 H new ATOM 0 HG22 ILE A 187 -10.768 -10.229 14.543 1.00 1.57 H new ATOM 0 HG23 ILE A 187 -10.404 -9.663 12.895 1.00 1.57 H new ATOM 0 HD11 ILE A 187 -7.492 -6.611 13.372 1.00 0.87 H new ATOM 0 HD12 ILE A 187 -7.997 -7.034 15.026 1.00 0.87 H new ATOM 0 HD13 ILE A 187 -7.764 -8.314 13.811 1.00 0.87 H new ATOM 2885 N TRP A 188 -12.180 -5.372 13.973 1.00 0.64 N ATOM 2886 CA TRP A 188 -12.527 -4.020 14.506 1.00 0.70 C ATOM 2887 C TRP A 188 -13.857 -4.106 15.278 1.00 0.81 C ATOM 2888 O TRP A 188 -13.887 -3.907 16.477 1.00 1.06 O ATOM 2889 CB TRP A 188 -12.650 -3.036 13.316 1.00 0.85 C ATOM 2890 CG TRP A 188 -11.973 -1.737 13.636 1.00 0.92 C ATOM 2891 CD1 TRP A 188 -10.698 -1.426 13.312 1.00 1.76 C ATOM 2892 CD2 TRP A 188 -12.512 -0.582 14.336 1.00 1.04 C ATOM 2893 NE1 TRP A 188 -10.420 -0.150 13.769 1.00 2.01 N ATOM 2894 CE2 TRP A 188 -11.508 0.412 14.406 1.00 1.34 C ATOM 2895 CE3 TRP A 188 -13.762 -0.305 14.908 1.00 1.79 C ATOM 2896 CZ2 TRP A 188 -11.740 1.641 15.026 1.00 1.47 C ATOM 2897 CZ3 TRP A 188 -14.001 0.930 15.533 1.00 2.17 C ATOM 2898 CH2 TRP A 188 -12.991 1.901 15.591 1.00 1.71 C ATOM 0 H TRP A 188 -11.885 -5.393 12.997 1.00 0.64 H new ATOM 0 HA TRP A 188 -11.752 -3.665 15.186 1.00 0.70 H new ATOM 0 HB2 TRP A 188 -12.202 -3.476 12.425 1.00 0.85 H new ATOM 0 HB3 TRP A 188 -13.702 -2.859 13.090 1.00 0.85 H new ATOM 0 HD1 TRP A 188 -10.009 -2.068 12.783 1.00 1.76 H new ATOM 0 HE1 TRP A 188 -9.522 0.318 13.650 1.00 2.01 H new ATOM 0 HE3 TRP A 188 -14.546 -1.046 14.868 1.00 1.79 H new ATOM 0 HZ2 TRP A 188 -10.958 2.385 15.069 1.00 1.47 H new ATOM 0 HZ3 TRP A 188 -14.967 1.133 15.971 1.00 2.17 H new ATOM 0 HH2 TRP A 188 -13.180 2.849 16.072 1.00 1.71 H new