USER MOD reduce.3.24.130724 H: found=0, std=0, add=1147, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1151 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 79 MET CE :methyl -135:sc= -0.231 (180deg=0) USER MOD Set 1.2: A 186 THR OG1 : rot 87:sc= 0.952 USER MOD Set 2.1: A 74 MET CE :methyl 170:sc= -0.23 (180deg=-0.163) USER MOD Set 2.2: A 77 GLN : amide:sc= -0.229 X(o=-0.46,f=-0.065) USER MOD Set 3.1: A 18 GLN : amide:sc= -3.19! C(o=-3.2!,f=-3.5!) USER MOD Set 3.2: A 22 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 16 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 153 GLN : amide:sc= -0.028 X(o=-0.028,f=-0.21) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 20 MET CE :methyl 155:sc= -0.145 (180deg=-1.92) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0443 USER MOD Single : A 57 LYS NZ :NH3+ -151:sc= -0.293 (180deg=-1.42!) USER MOD Single : A 58 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0364) USER MOD Single : A 60 SER OG : rot -96:sc= 0.774 USER MOD Single : A 62 CYS SG : rot -162:sc= -5.89! USER MOD Single : A 64 LYS NZ :NH3+ -161:sc= -0.0192 (180deg=-0.359) USER MOD Single : A 72 SER OG : rot -39:sc= 1.35 USER MOD Single : A 73 ASN : amide:sc= -0.392 K(o=-0.39,f=-2.8!) USER MOD Single : A 99 MET CE :methyl -120:sc= 0 (180deg=-2.52!) USER MOD Single : A 115 TYR OH : rot 165:sc= -0.232 USER MOD Single : A 118 SER OG : rot -58:sc= 0.779 USER MOD Single : A 119 LYS NZ :NH3+ 164:sc= -0.633 (180deg=-1.08) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 CYS SG : rot 82:sc= 0.0487 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot 81:sc= 0.393 USER MOD Single : A 137 MET CE :methyl -122:sc= 0 (180deg=-0.0562) USER MOD Single : A 140 THR OG1 : rot 72:sc= 0.114 USER MOD Single : A 155 GLN : amide:sc= -0.26 X(o=-0.26,f=-0.26) USER MOD Single : A 163 SER OG : rot -50:sc= 0.111 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= 0.0566 USER MOD Single : A 174 THR OG1 : rot -107:sc= 0.786 USER MOD Single : A 182 THR OG1 : rot 91:sc= 1.19 USER MOD Single : A 184 SER OG : rot 170:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 176 N SER A 15 19.460 1.475 -1.208 1.00 1.07 N ATOM 177 CA SER A 15 19.452 2.765 -0.463 1.00 0.91 C ATOM 178 C SER A 15 18.071 2.963 0.171 1.00 0.75 C ATOM 179 O SER A 15 17.053 2.859 -0.484 1.00 0.78 O ATOM 180 CB SER A 15 19.730 3.903 -1.457 1.00 0.99 C ATOM 181 OG SER A 15 21.139 4.056 -1.579 1.00 1.38 O ATOM 0 HA SER A 15 20.213 2.761 0.318 1.00 0.91 H new ATOM 0 HB2 SER A 15 19.287 3.676 -2.427 1.00 0.99 H new ATOM 0 HB3 SER A 15 19.276 4.831 -1.109 1.00 0.99 H new ATOM 0 HG SER A 15 21.336 4.778 -2.212 1.00 1.38 H new ATOM 187 N SER A 16 18.034 3.243 1.443 1.00 0.72 N ATOM 188 CA SER A 16 16.726 3.443 2.127 1.00 0.82 C ATOM 189 C SER A 16 15.992 4.640 1.517 1.00 0.81 C ATOM 190 O SER A 16 14.818 4.566 1.213 1.00 0.92 O ATOM 191 CB SER A 16 16.967 3.706 3.614 1.00 1.06 C ATOM 192 OG SER A 16 17.653 2.599 4.182 1.00 1.64 O ATOM 0 H SER A 16 18.855 3.342 2.040 1.00 0.72 H new ATOM 0 HA SER A 16 16.118 2.547 2.002 1.00 0.82 H new ATOM 0 HB2 SER A 16 17.552 4.616 3.744 1.00 1.06 H new ATOM 0 HB3 SER A 16 16.017 3.862 4.126 1.00 1.06 H new ATOM 0 HG SER A 16 17.810 2.765 5.135 1.00 1.64 H new ATOM 198 N GLU A 17 16.664 5.745 1.341 1.00 0.80 N ATOM 199 CA GLU A 17 15.988 6.941 0.760 1.00 0.94 C ATOM 200 C GLU A 17 15.517 6.646 -0.666 1.00 0.85 C ATOM 201 O GLU A 17 14.476 7.105 -1.095 1.00 0.89 O ATOM 202 CB GLU A 17 16.968 8.120 0.735 1.00 1.13 C ATOM 203 CG GLU A 17 18.104 7.832 -0.252 1.00 1.71 C ATOM 204 CD GLU A 17 19.223 8.858 -0.057 1.00 2.26 C ATOM 205 OE1 GLU A 17 18.914 9.979 0.314 1.00 2.68 O ATOM 206 OE2 GLU A 17 20.369 8.506 -0.283 1.00 2.90 O ATOM 0 H GLU A 17 17.649 5.872 1.573 1.00 0.80 H new ATOM 0 HA GLU A 17 15.123 7.190 1.375 1.00 0.94 H new ATOM 0 HB2 GLU A 17 16.446 9.032 0.446 1.00 1.13 H new ATOM 0 HB3 GLU A 17 17.375 8.288 1.732 1.00 1.13 H new ATOM 0 HG2 GLU A 17 18.489 6.824 -0.096 1.00 1.71 H new ATOM 0 HG3 GLU A 17 17.731 7.875 -1.275 1.00 1.71 H new ATOM 213 N GLN A 18 16.275 5.883 -1.405 1.00 0.80 N ATOM 214 CA GLN A 18 15.870 5.565 -2.803 1.00 0.83 C ATOM 215 C GLN A 18 14.674 4.612 -2.779 1.00 0.68 C ATOM 216 O GLN A 18 13.809 4.663 -3.632 1.00 0.69 O ATOM 217 CB GLN A 18 17.048 4.912 -3.543 1.00 0.96 C ATOM 218 CG GLN A 18 16.886 5.100 -5.056 1.00 1.53 C ATOM 219 CD GLN A 18 15.608 4.405 -5.529 1.00 2.23 C ATOM 220 OE1 GLN A 18 14.716 5.041 -6.054 1.00 2.69 O ATOM 221 NE2 GLN A 18 15.481 3.116 -5.366 1.00 3.07 N ATOM 0 H GLN A 18 17.156 5.467 -1.102 1.00 0.80 H new ATOM 0 HA GLN A 18 15.588 6.481 -3.322 1.00 0.83 H new ATOM 0 HB2 GLN A 18 17.987 5.355 -3.212 1.00 0.96 H new ATOM 0 HB3 GLN A 18 17.095 3.850 -3.303 1.00 0.96 H new ATOM 0 HG2 GLN A 18 16.844 6.162 -5.298 1.00 1.53 H new ATOM 0 HG3 GLN A 18 17.750 4.688 -5.578 1.00 1.53 H new ATOM 0 HE21 GLN A 18 16.230 2.581 -4.925 1.00 3.07 H new ATOM 0 HE22 GLN A 18 14.633 2.643 -5.679 1.00 3.07 H new ATOM 230 N ILE A 19 14.612 3.746 -1.805 1.00 0.59 N ATOM 231 CA ILE A 19 13.466 2.801 -1.737 1.00 0.58 C ATOM 232 C ILE A 19 12.179 3.606 -1.510 1.00 0.52 C ATOM 233 O ILE A 19 11.193 3.418 -2.193 1.00 0.59 O ATOM 234 CB ILE A 19 13.699 1.779 -0.610 1.00 0.64 C ATOM 235 CG1 ILE A 19 14.721 0.736 -1.075 1.00 0.74 C ATOM 236 CG2 ILE A 19 12.388 1.076 -0.240 1.00 0.73 C ATOM 237 CD1 ILE A 19 15.195 -0.092 0.123 1.00 0.81 C ATOM 0 H ILE A 19 15.301 3.653 -1.059 1.00 0.59 H new ATOM 0 HA ILE A 19 13.372 2.246 -2.671 1.00 0.58 H new ATOM 0 HB ILE A 19 14.075 2.304 0.268 1.00 0.64 H new ATOM 0 HG12 ILE A 19 14.274 0.084 -1.826 1.00 0.74 H new ATOM 0 HG13 ILE A 19 15.570 1.230 -1.547 1.00 0.74 H new ATOM 0 HG21 ILE A 19 12.573 0.357 0.558 1.00 0.73 H new ATOM 0 HG22 ILE A 19 11.662 1.815 0.098 1.00 0.73 H new ATOM 0 HG23 ILE A 19 11.995 0.555 -1.113 1.00 0.73 H new ATOM 0 HD11 ILE A 19 15.922 -0.833 -0.211 1.00 0.81 H new ATOM 0 HD12 ILE A 19 15.659 0.565 0.859 1.00 0.81 H new ATOM 0 HD13 ILE A 19 14.342 -0.599 0.575 1.00 0.81 H new ATOM 249 N MET A 20 12.170 4.480 -0.539 1.00 0.51 N ATOM 250 CA MET A 20 10.919 5.253 -0.279 1.00 0.60 C ATOM 251 C MET A 20 10.536 6.003 -1.562 1.00 0.55 C ATOM 252 O MET A 20 9.372 6.221 -1.835 1.00 0.59 O ATOM 253 CB MET A 20 11.111 6.205 0.911 1.00 0.82 C ATOM 254 CG MET A 20 9.964 7.219 0.996 1.00 1.07 C ATOM 255 SD MET A 20 8.398 6.340 1.202 1.00 1.43 S ATOM 256 CE MET A 20 8.672 5.760 2.896 1.00 0.93 C ATOM 0 H MET A 20 12.957 4.690 0.075 1.00 0.51 H new ATOM 0 HA MET A 20 10.106 4.579 -0.011 1.00 0.60 H new ATOM 0 HB2 MET A 20 11.162 5.631 1.836 1.00 0.82 H new ATOM 0 HB3 MET A 20 12.060 6.732 0.810 1.00 0.82 H new ATOM 0 HG2 MET A 20 10.125 7.898 1.834 1.00 1.07 H new ATOM 0 HG3 MET A 20 9.935 7.829 0.093 1.00 1.07 H new ATOM 0 HE1 MET A 20 7.711 5.589 3.382 1.00 0.93 H new ATOM 0 HE2 MET A 20 9.239 4.829 2.875 1.00 0.93 H new ATOM 0 HE3 MET A 20 9.231 6.513 3.452 1.00 0.93 H new ATOM 266 N LYS A 21 11.489 6.334 -2.380 1.00 0.57 N ATOM 267 CA LYS A 21 11.164 6.996 -3.675 1.00 0.61 C ATOM 268 C LYS A 21 10.446 5.983 -4.580 1.00 0.53 C ATOM 269 O LYS A 21 9.520 6.327 -5.290 1.00 0.51 O ATOM 270 CB LYS A 21 12.459 7.478 -4.352 1.00 0.72 C ATOM 271 CG LYS A 21 12.164 8.680 -5.258 1.00 1.09 C ATOM 272 CD LYS A 21 13.384 8.978 -6.132 1.00 1.24 C ATOM 273 CE LYS A 21 14.582 9.347 -5.249 1.00 1.80 C ATOM 274 NZ LYS A 21 15.600 10.058 -6.073 1.00 2.40 N ATOM 0 H LYS A 21 12.482 6.176 -2.211 1.00 0.57 H new ATOM 0 HA LYS A 21 10.519 7.857 -3.501 1.00 0.61 H new ATOM 0 HB2 LYS A 21 13.193 7.755 -3.595 1.00 0.72 H new ATOM 0 HB3 LYS A 21 12.895 6.669 -4.938 1.00 0.72 H new ATOM 0 HG2 LYS A 21 11.297 8.471 -5.885 1.00 1.09 H new ATOM 0 HG3 LYS A 21 11.916 9.552 -4.653 1.00 1.09 H new ATOM 0 HD2 LYS A 21 13.626 8.108 -6.743 1.00 1.24 H new ATOM 0 HD3 LYS A 21 13.160 9.796 -6.817 1.00 1.24 H new ATOM 0 HE2 LYS A 21 14.258 9.981 -4.423 1.00 1.80 H new ATOM 0 HE3 LYS A 21 15.016 8.448 -4.810 1.00 1.80 H new ATOM 0 HZ1 LYS A 21 16.414 10.310 -5.477 1.00 2.40 H new ATOM 0 HZ2 LYS A 21 15.915 9.438 -6.846 1.00 2.40 H new ATOM 0 HZ3 LYS A 21 15.182 10.923 -6.471 1.00 2.40 H new ATOM 288 N THR A 22 10.842 4.739 -4.557 1.00 0.53 N ATOM 289 CA THR A 22 10.161 3.726 -5.414 1.00 0.52 C ATOM 290 C THR A 22 8.730 3.504 -4.915 1.00 0.45 C ATOM 291 O THR A 22 7.793 3.455 -5.686 1.00 0.48 O ATOM 292 CB THR A 22 10.932 2.406 -5.333 1.00 0.55 C ATOM 293 OG1 THR A 22 12.231 2.586 -5.879 1.00 0.64 O ATOM 294 CG2 THR A 22 10.190 1.324 -6.122 1.00 0.62 C ATOM 0 H THR A 22 11.606 4.381 -3.983 1.00 0.53 H new ATOM 0 HA THR A 22 10.133 4.081 -6.444 1.00 0.52 H new ATOM 0 HB THR A 22 11.013 2.097 -4.291 1.00 0.55 H new ATOM 0 HG1 THR A 22 12.728 1.743 -5.827 1.00 0.64 H new ATOM 0 HG21 THR A 22 10.742 0.386 -6.062 1.00 0.62 H new ATOM 0 HG22 THR A 22 9.194 1.186 -5.702 1.00 0.62 H new ATOM 0 HG23 THR A 22 10.105 1.628 -7.165 1.00 0.62 H new ATOM 302 N GLY A 23 8.558 3.379 -3.628 1.00 0.42 N ATOM 303 CA GLY A 23 7.191 3.168 -3.067 1.00 0.43 C ATOM 304 C GLY A 23 6.298 4.351 -3.435 1.00 0.41 C ATOM 305 O GLY A 23 5.264 4.180 -4.052 1.00 0.47 O ATOM 0 H GLY A 23 9.307 3.414 -2.937 1.00 0.42 H new ATOM 0 HA2 GLY A 23 6.766 2.243 -3.457 1.00 0.43 H new ATOM 0 HA3 GLY A 23 7.244 3.063 -1.983 1.00 0.43 H new ATOM 309 N ALA A 24 6.687 5.549 -3.103 1.00 0.40 N ATOM 310 CA ALA A 24 5.859 6.727 -3.482 1.00 0.41 C ATOM 311 C ALA A 24 5.544 6.657 -4.981 1.00 0.41 C ATOM 312 O ALA A 24 4.606 7.257 -5.468 1.00 0.41 O ATOM 313 CB ALA A 24 6.672 7.996 -3.214 1.00 0.42 C ATOM 0 H ALA A 24 7.540 5.764 -2.587 1.00 0.40 H new ATOM 0 HA ALA A 24 4.933 6.735 -2.907 1.00 0.41 H new ATOM 0 HB1 ALA A 24 6.081 8.871 -3.486 1.00 0.42 H new ATOM 0 HB2 ALA A 24 6.929 8.047 -2.156 1.00 0.42 H new ATOM 0 HB3 ALA A 24 7.585 7.976 -3.809 1.00 0.42 H new ATOM 319 N LEU A 25 6.354 5.930 -5.711 1.00 0.42 N ATOM 320 CA LEU A 25 6.155 5.809 -7.187 1.00 0.44 C ATOM 321 C LEU A 25 5.032 4.801 -7.477 1.00 0.44 C ATOM 322 O LEU A 25 4.126 5.063 -8.242 1.00 0.46 O ATOM 323 CB LEU A 25 7.484 5.340 -7.820 1.00 0.47 C ATOM 324 CG LEU A 25 7.776 6.100 -9.122 1.00 0.77 C ATOM 325 CD1 LEU A 25 9.196 5.760 -9.602 1.00 1.58 C ATOM 326 CD2 LEU A 25 6.753 5.693 -10.187 1.00 1.67 C ATOM 0 H LEU A 25 7.151 5.411 -5.343 1.00 0.42 H new ATOM 0 HA LEU A 25 5.868 6.770 -7.613 1.00 0.44 H new ATOM 0 HB2 LEU A 25 8.301 5.494 -7.115 1.00 0.47 H new ATOM 0 HB3 LEU A 25 7.436 4.270 -8.023 1.00 0.47 H new ATOM 0 HG LEU A 25 7.704 7.174 -8.947 1.00 0.77 H new ATOM 0 HD11 LEU A 25 9.406 6.298 -10.526 1.00 1.58 H new ATOM 0 HD12 LEU A 25 9.918 6.053 -8.839 1.00 1.58 H new ATOM 0 HD13 LEU A 25 9.272 4.688 -9.781 1.00 1.58 H new ATOM 0 HD21 LEU A 25 6.958 6.231 -11.113 1.00 1.67 H new ATOM 0 HD22 LEU A 25 6.823 4.620 -10.368 1.00 1.67 H new ATOM 0 HD23 LEU A 25 5.749 5.938 -9.840 1.00 1.67 H new ATOM 338 N LEU A 26 5.121 3.633 -6.899 1.00 0.45 N ATOM 339 CA LEU A 26 4.097 2.582 -7.163 1.00 0.47 C ATOM 340 C LEU A 26 2.690 3.170 -7.018 1.00 0.49 C ATOM 341 O LEU A 26 1.879 3.073 -7.918 1.00 0.52 O ATOM 342 CB LEU A 26 4.287 1.410 -6.176 1.00 0.51 C ATOM 343 CG LEU A 26 5.217 0.345 -6.778 1.00 0.69 C ATOM 344 CD1 LEU A 26 6.618 0.928 -6.965 1.00 1.17 C ATOM 345 CD2 LEU A 26 5.288 -0.856 -5.832 1.00 1.35 C ATOM 0 H LEU A 26 5.862 3.361 -6.253 1.00 0.45 H new ATOM 0 HA LEU A 26 4.218 2.213 -8.182 1.00 0.47 H new ATOM 0 HB2 LEU A 26 4.705 1.779 -5.240 1.00 0.51 H new ATOM 0 HB3 LEU A 26 3.320 0.965 -5.940 1.00 0.51 H new ATOM 0 HG LEU A 26 4.827 0.029 -7.746 1.00 0.69 H new ATOM 0 HD11 LEU A 26 7.274 0.169 -7.392 1.00 1.17 H new ATOM 0 HD12 LEU A 26 6.569 1.785 -7.637 1.00 1.17 H new ATOM 0 HD13 LEU A 26 7.012 1.246 -6.000 1.00 1.17 H new ATOM 0 HD21 LEU A 26 5.947 -1.614 -6.255 1.00 1.35 H new ATOM 0 HD22 LEU A 26 5.677 -0.535 -4.866 1.00 1.35 H new ATOM 0 HD23 LEU A 26 4.290 -1.275 -5.700 1.00 1.35 H new ATOM 357 N LEU A 27 2.377 3.759 -5.898 1.00 0.50 N ATOM 358 CA LEU A 27 1.004 4.315 -5.736 1.00 0.56 C ATOM 359 C LEU A 27 0.757 5.373 -6.812 1.00 0.56 C ATOM 360 O LEU A 27 -0.219 5.317 -7.533 1.00 0.60 O ATOM 361 CB LEU A 27 0.838 4.934 -4.346 1.00 0.64 C ATOM 362 CG LEU A 27 1.258 3.930 -3.271 1.00 0.95 C ATOM 363 CD1 LEU A 27 1.192 4.603 -1.898 1.00 1.66 C ATOM 364 CD2 LEU A 27 0.320 2.713 -3.294 1.00 1.42 C ATOM 0 H LEU A 27 3.000 3.879 -5.100 1.00 0.50 H new ATOM 0 HA LEU A 27 0.278 3.509 -5.843 1.00 0.56 H new ATOM 0 HB2 LEU A 27 1.442 5.838 -4.267 1.00 0.64 H new ATOM 0 HB3 LEU A 27 -0.200 5.230 -4.193 1.00 0.64 H new ATOM 0 HG LEU A 27 2.277 3.596 -3.468 1.00 0.95 H new ATOM 0 HD11 LEU A 27 1.491 3.891 -1.129 1.00 1.66 H new ATOM 0 HD12 LEU A 27 1.865 5.460 -1.880 1.00 1.66 H new ATOM 0 HD13 LEU A 27 0.173 4.938 -1.706 1.00 1.66 H new ATOM 0 HD21 LEU A 27 0.626 2.003 -2.526 1.00 1.42 H new ATOM 0 HD22 LEU A 27 -0.702 3.038 -3.101 1.00 1.42 H new ATOM 0 HD23 LEU A 27 0.370 2.233 -4.272 1.00 1.42 H new ATOM 376 N GLN A 28 1.625 6.342 -6.924 1.00 0.55 N ATOM 377 CA GLN A 28 1.429 7.403 -7.954 1.00 0.58 C ATOM 378 C GLN A 28 1.079 6.760 -9.302 1.00 0.54 C ATOM 379 O GLN A 28 0.306 7.290 -10.075 1.00 0.58 O ATOM 380 CB GLN A 28 2.726 8.207 -8.091 1.00 0.60 C ATOM 381 CG GLN A 28 2.566 9.265 -9.190 1.00 1.00 C ATOM 382 CD GLN A 28 3.655 10.332 -9.040 1.00 1.40 C ATOM 383 OE1 GLN A 28 3.468 11.313 -8.348 1.00 2.09 O ATOM 384 NE2 GLN A 28 4.792 10.181 -9.663 1.00 1.91 N ATOM 0 H GLN A 28 2.460 6.445 -6.348 1.00 0.55 H new ATOM 0 HA GLN A 28 0.614 8.061 -7.652 1.00 0.58 H new ATOM 0 HB2 GLN A 28 2.969 8.687 -7.143 1.00 0.60 H new ATOM 0 HB3 GLN A 28 3.554 7.541 -8.332 1.00 0.60 H new ATOM 0 HG2 GLN A 28 2.634 8.797 -10.172 1.00 1.00 H new ATOM 0 HG3 GLN A 28 1.580 9.726 -9.124 1.00 1.00 H new ATOM 0 HE21 GLN A 28 4.950 9.358 -10.244 1.00 1.91 H new ATOM 0 HE22 GLN A 28 5.523 10.886 -9.569 1.00 1.91 H new ATOM 393 N GLY A 29 1.667 5.629 -9.592 1.00 0.50 N ATOM 394 CA GLY A 29 1.397 4.946 -10.893 1.00 0.48 C ATOM 395 C GLY A 29 0.133 4.086 -10.792 1.00 0.44 C ATOM 396 O GLY A 29 -0.820 4.284 -11.519 1.00 0.50 O ATOM 0 H GLY A 29 2.326 5.146 -8.981 1.00 0.50 H new ATOM 0 HA2 GLY A 29 1.278 5.688 -11.683 1.00 0.48 H new ATOM 0 HA3 GLY A 29 2.248 4.322 -11.167 1.00 0.48 H new ATOM 400 N PHE A 30 0.122 3.122 -9.912 1.00 0.44 N ATOM 401 CA PHE A 30 -1.078 2.244 -9.787 1.00 0.43 C ATOM 402 C PHE A 30 -2.331 3.107 -9.608 1.00 0.40 C ATOM 403 O PHE A 30 -3.374 2.809 -10.156 1.00 0.43 O ATOM 404 CB PHE A 30 -0.904 1.299 -8.586 1.00 0.47 C ATOM 405 CG PHE A 30 -2.225 0.638 -8.234 1.00 0.47 C ATOM 406 CD1 PHE A 30 -2.938 -0.072 -9.211 1.00 1.39 C ATOM 407 CD2 PHE A 30 -2.736 0.734 -6.931 1.00 1.20 C ATOM 408 CE1 PHE A 30 -4.156 -0.682 -8.885 1.00 1.42 C ATOM 409 CE2 PHE A 30 -3.953 0.123 -6.608 1.00 1.21 C ATOM 410 CZ PHE A 30 -4.663 -0.584 -7.585 1.00 0.58 C ATOM 0 H PHE A 30 0.889 2.904 -9.276 1.00 0.44 H new ATOM 0 HA PHE A 30 -1.189 1.647 -10.692 1.00 0.43 H new ATOM 0 HB2 PHE A 30 -0.160 0.537 -8.820 1.00 0.47 H new ATOM 0 HB3 PHE A 30 -0.530 1.857 -7.728 1.00 0.47 H new ATOM 0 HD1 PHE A 30 -2.548 -0.148 -10.215 1.00 1.39 H new ATOM 0 HD2 PHE A 30 -2.190 1.280 -6.176 1.00 1.20 H new ATOM 0 HE1 PHE A 30 -4.704 -1.229 -9.638 1.00 1.42 H new ATOM 0 HE2 PHE A 30 -4.344 0.197 -5.604 1.00 1.21 H new ATOM 0 HZ PHE A 30 -5.603 -1.054 -7.335 1.00 0.58 H new ATOM 420 N ILE A 31 -2.250 4.175 -8.864 1.00 0.40 N ATOM 421 CA ILE A 31 -3.456 5.032 -8.689 1.00 0.40 C ATOM 422 C ILE A 31 -3.764 5.725 -10.022 1.00 0.40 C ATOM 423 O ILE A 31 -4.855 5.627 -10.548 1.00 0.43 O ATOM 424 CB ILE A 31 -3.202 6.082 -7.599 1.00 0.41 C ATOM 425 CG1 ILE A 31 -3.009 5.383 -6.251 1.00 0.53 C ATOM 426 CG2 ILE A 31 -4.406 7.022 -7.534 1.00 0.72 C ATOM 427 CD1 ILE A 31 -2.448 6.378 -5.233 1.00 0.48 C ATOM 0 H ILE A 31 -1.412 4.489 -8.375 1.00 0.40 H new ATOM 0 HA ILE A 31 -4.304 4.418 -8.386 1.00 0.40 H new ATOM 0 HB ILE A 31 -2.303 6.654 -7.830 1.00 0.41 H new ATOM 0 HG12 ILE A 31 -3.959 4.983 -5.898 1.00 0.53 H new ATOM 0 HG13 ILE A 31 -2.329 4.538 -6.362 1.00 0.53 H new ATOM 0 HG21 ILE A 31 -4.239 7.774 -6.763 1.00 0.72 H new ATOM 0 HG22 ILE A 31 -4.536 7.514 -8.498 1.00 0.72 H new ATOM 0 HG23 ILE A 31 -5.302 6.449 -7.295 1.00 0.72 H new ATOM 0 HD11 ILE A 31 -2.311 5.879 -4.274 1.00 0.48 H new ATOM 0 HD12 ILE A 31 -1.489 6.757 -5.585 1.00 0.48 H new ATOM 0 HD13 ILE A 31 -3.144 7.208 -5.114 1.00 0.48 H new ATOM 439 N GLN A 32 -2.803 6.413 -10.574 1.00 0.42 N ATOM 440 CA GLN A 32 -3.020 7.105 -11.877 1.00 0.47 C ATOM 441 C GLN A 32 -3.614 6.132 -12.902 1.00 0.50 C ATOM 442 O GLN A 32 -4.235 6.542 -13.862 1.00 0.61 O ATOM 443 CB GLN A 32 -1.684 7.644 -12.395 1.00 0.57 C ATOM 444 CG GLN A 32 -1.916 8.448 -13.676 1.00 1.19 C ATOM 445 CD GLN A 32 -0.612 9.131 -14.092 1.00 1.59 C ATOM 446 OE1 GLN A 32 0.349 8.472 -14.436 1.00 2.16 O ATOM 447 NE2 GLN A 32 -0.536 10.434 -14.074 1.00 2.21 N ATOM 0 H GLN A 32 -1.871 6.527 -10.176 1.00 0.42 H new ATOM 0 HA GLN A 32 -3.717 7.930 -11.730 1.00 0.47 H new ATOM 0 HB2 GLN A 32 -1.217 8.274 -11.638 1.00 0.57 H new ATOM 0 HB3 GLN A 32 -0.999 6.819 -12.591 1.00 0.57 H new ATOM 0 HG2 GLN A 32 -2.265 7.791 -14.472 1.00 1.19 H new ATOM 0 HG3 GLN A 32 -2.694 9.194 -13.514 1.00 1.19 H new ATOM 0 HE21 GLN A 32 -1.342 10.988 -13.785 1.00 2.21 H new ATOM 0 HE22 GLN A 32 0.330 10.898 -14.349 1.00 2.21 H new ATOM 456 N ASP A 33 -3.434 4.852 -12.718 1.00 0.49 N ATOM 457 CA ASP A 33 -4.001 3.878 -13.699 1.00 0.58 C ATOM 458 C ASP A 33 -5.497 3.691 -13.425 1.00 0.61 C ATOM 459 O ASP A 33 -6.301 3.618 -14.334 1.00 0.70 O ATOM 460 CB ASP A 33 -3.279 2.535 -13.560 1.00 0.61 C ATOM 461 CG ASP A 33 -1.778 2.737 -13.779 1.00 1.10 C ATOM 462 OD1 ASP A 33 -1.426 3.567 -14.601 1.00 1.78 O ATOM 463 OD2 ASP A 33 -1.007 2.060 -13.120 1.00 1.89 O ATOM 0 H ASP A 33 -2.923 4.439 -11.938 1.00 0.49 H new ATOM 0 HA ASP A 33 -3.864 4.258 -14.712 1.00 0.58 H new ATOM 0 HB2 ASP A 33 -3.459 2.114 -12.571 1.00 0.61 H new ATOM 0 HB3 ASP A 33 -3.671 1.823 -14.286 1.00 0.61 H new ATOM 468 N ARG A 34 -5.875 3.623 -12.178 1.00 0.58 N ATOM 469 CA ARG A 34 -7.317 3.452 -11.829 1.00 0.71 C ATOM 470 C ARG A 34 -8.039 4.798 -11.922 1.00 0.65 C ATOM 471 O ARG A 34 -9.252 4.848 -11.960 1.00 0.85 O ATOM 472 CB ARG A 34 -7.444 2.917 -10.401 1.00 0.85 C ATOM 473 CG ARG A 34 -7.052 1.440 -10.359 1.00 1.25 C ATOM 474 CD ARG A 34 -7.383 0.872 -8.978 1.00 1.31 C ATOM 475 NE ARG A 34 -8.843 1.028 -8.717 1.00 1.58 N ATOM 476 CZ ARG A 34 -9.406 0.375 -7.738 1.00 2.09 C ATOM 477 NH1 ARG A 34 -8.690 -0.410 -6.981 1.00 2.58 N ATOM 478 NH2 ARG A 34 -10.685 0.509 -7.513 1.00 2.75 N ATOM 0 H ARG A 34 -5.243 3.679 -11.379 1.00 0.58 H new ATOM 0 HA ARG A 34 -7.766 2.747 -12.528 1.00 0.71 H new ATOM 0 HB2 ARG A 34 -6.804 3.491 -9.731 1.00 0.85 H new ATOM 0 HB3 ARG A 34 -8.468 3.040 -10.047 1.00 0.85 H new ATOM 0 HG2 ARG A 34 -7.587 0.887 -11.131 1.00 1.25 H new ATOM 0 HG3 ARG A 34 -5.988 1.328 -10.566 1.00 1.25 H new ATOM 0 HD2 ARG A 34 -7.104 -0.180 -8.929 1.00 1.31 H new ATOM 0 HD3 ARG A 34 -6.808 1.391 -8.211 1.00 1.31 H new ATOM 0 HE ARG A 34 -9.402 1.646 -9.305 1.00 1.58 H new ATOM 0 HH11 ARG A 34 -7.690 -0.513 -7.155 1.00 2.58 H new ATOM 0 HH12 ARG A 34 -9.130 -0.921 -6.215 1.00 2.58 H new ATOM 0 HH21 ARG A 34 -11.245 1.125 -8.103 1.00 2.75 H new ATOM 0 HH22 ARG A 34 -11.124 -0.002 -6.747 1.00 2.75 H new ATOM 492 N ALA A 35 -7.326 5.888 -11.995 1.00 0.59 N ATOM 493 CA ALA A 35 -8.015 7.204 -12.121 1.00 0.66 C ATOM 494 C ALA A 35 -8.390 7.410 -13.590 1.00 0.80 C ATOM 495 O ALA A 35 -9.086 8.336 -13.953 1.00 0.88 O ATOM 496 CB ALA A 35 -7.080 8.325 -11.660 1.00 0.94 C ATOM 0 H ALA A 35 -6.307 5.926 -11.973 1.00 0.59 H new ATOM 0 HA ALA A 35 -8.910 7.221 -11.500 1.00 0.66 H new ATOM 0 HB1 ALA A 35 -7.588 9.285 -11.754 1.00 0.94 H new ATOM 0 HB2 ALA A 35 -6.802 8.162 -10.619 1.00 0.94 H new ATOM 0 HB3 ALA A 35 -6.183 8.328 -12.279 1.00 0.94 H new ATOM 751 N ALA A 54 10.760 0.881 -16.622 1.00 0.91 N ATOM 752 CA ALA A 54 10.411 -0.527 -17.000 1.00 0.84 C ATOM 753 C ALA A 54 10.136 -1.364 -15.743 1.00 0.76 C ATOM 754 O ALA A 54 9.237 -2.182 -15.716 1.00 0.75 O ATOM 755 CB ALA A 54 11.573 -1.149 -17.776 1.00 0.95 C ATOM 0 HA ALA A 54 9.515 -0.513 -17.621 1.00 0.84 H new ATOM 0 HB1 ALA A 54 11.320 -2.173 -18.051 1.00 0.95 H new ATOM 0 HB2 ALA A 54 11.761 -0.567 -18.678 1.00 0.95 H new ATOM 0 HB3 ALA A 54 12.467 -1.151 -17.153 1.00 0.95 H new ATOM 761 N SER A 55 10.896 -1.159 -14.703 1.00 0.75 N ATOM 762 CA SER A 55 10.685 -1.932 -13.442 1.00 0.71 C ATOM 763 C SER A 55 9.306 -1.619 -12.858 1.00 0.66 C ATOM 764 O SER A 55 8.587 -2.499 -12.427 1.00 0.66 O ATOM 765 CB SER A 55 11.752 -1.522 -12.427 1.00 0.76 C ATOM 766 OG SER A 55 13.036 -1.863 -12.932 1.00 1.37 O ATOM 0 H SER A 55 11.660 -0.484 -14.670 1.00 0.75 H new ATOM 0 HA SER A 55 10.752 -2.998 -13.659 1.00 0.71 H new ATOM 0 HB2 SER A 55 11.696 -0.450 -12.236 1.00 0.76 H new ATOM 0 HB3 SER A 55 11.577 -2.024 -11.476 1.00 0.76 H new ATOM 0 HG SER A 55 13.723 -1.600 -12.284 1.00 1.37 H new ATOM 772 N THR A 56 8.942 -0.370 -12.827 1.00 0.65 N ATOM 773 CA THR A 56 7.623 0.019 -12.256 1.00 0.62 C ATOM 774 C THR A 56 6.497 -0.274 -13.251 1.00 0.59 C ATOM 775 O THR A 56 5.335 -0.273 -12.894 1.00 0.57 O ATOM 776 CB THR A 56 7.638 1.524 -11.948 1.00 0.67 C ATOM 777 OG1 THR A 56 8.309 2.212 -12.994 1.00 1.09 O ATOM 778 CG2 THR A 56 8.361 1.778 -10.624 1.00 1.06 C ATOM 0 H THR A 56 9.506 0.405 -13.175 1.00 0.65 H new ATOM 0 HA THR A 56 7.448 -0.556 -11.347 1.00 0.62 H new ATOM 0 HB THR A 56 6.613 1.885 -11.870 1.00 0.67 H new ATOM 0 HG1 THR A 56 8.318 3.173 -12.800 1.00 1.09 H new ATOM 0 HG21 THR A 56 8.368 2.847 -10.412 1.00 1.06 H new ATOM 0 HG22 THR A 56 7.845 1.252 -9.821 1.00 1.06 H new ATOM 0 HG23 THR A 56 9.387 1.416 -10.694 1.00 1.06 H new ATOM 786 N LYS A 57 6.812 -0.505 -14.497 1.00 0.61 N ATOM 787 CA LYS A 57 5.722 -0.767 -15.480 1.00 0.59 C ATOM 788 C LYS A 57 5.144 -2.164 -15.239 1.00 0.54 C ATOM 789 O LYS A 57 3.942 -2.352 -15.217 1.00 0.52 O ATOM 790 CB LYS A 57 6.275 -0.656 -16.903 1.00 0.65 C ATOM 791 CG LYS A 57 5.169 -0.947 -17.925 1.00 1.20 C ATOM 792 CD LYS A 57 5.699 -0.733 -19.354 1.00 1.33 C ATOM 793 CE LYS A 57 5.668 0.758 -19.727 1.00 1.94 C ATOM 794 NZ LYS A 57 4.289 1.294 -19.548 1.00 2.73 N ATOM 0 H LYS A 57 7.760 -0.524 -14.872 1.00 0.61 H new ATOM 0 HA LYS A 57 4.929 -0.030 -15.355 1.00 0.59 H new ATOM 0 HB2 LYS A 57 6.678 0.343 -17.067 1.00 0.65 H new ATOM 0 HB3 LYS A 57 7.098 -1.358 -17.037 1.00 0.65 H new ATOM 0 HG2 LYS A 57 4.817 -1.972 -17.809 1.00 1.20 H new ATOM 0 HG3 LYS A 57 4.315 -0.294 -17.744 1.00 1.20 H new ATOM 0 HD2 LYS A 57 6.719 -1.111 -19.429 1.00 1.33 H new ATOM 0 HD3 LYS A 57 5.095 -1.302 -20.060 1.00 1.33 H new ATOM 0 HE2 LYS A 57 6.368 1.313 -19.102 1.00 1.94 H new ATOM 0 HE3 LYS A 57 5.988 0.891 -20.760 1.00 1.94 H new ATOM 0 HZ1 LYS A 57 4.132 2.077 -20.214 1.00 2.73 H new ATOM 0 HZ2 LYS A 57 3.597 0.540 -19.731 1.00 2.73 H new ATOM 0 HZ3 LYS A 57 4.175 1.640 -18.574 1.00 2.73 H new ATOM 808 N LYS A 58 5.981 -3.148 -15.050 1.00 0.55 N ATOM 809 CA LYS A 58 5.455 -4.519 -14.806 1.00 0.53 C ATOM 810 C LYS A 58 4.832 -4.577 -13.408 1.00 0.48 C ATOM 811 O LYS A 58 3.778 -5.153 -13.220 1.00 0.46 O ATOM 812 CB LYS A 58 6.589 -5.546 -14.916 1.00 0.56 C ATOM 813 CG LYS A 58 5.983 -6.943 -15.086 1.00 0.78 C ATOM 814 CD LYS A 58 7.088 -8.001 -15.075 1.00 0.96 C ATOM 815 CE LYS A 58 6.478 -9.379 -15.351 1.00 0.85 C ATOM 816 NZ LYS A 58 6.215 -9.523 -16.811 1.00 1.75 N ATOM 0 H LYS A 58 6.997 -3.062 -15.054 1.00 0.55 H new ATOM 0 HA LYS A 58 4.698 -4.755 -15.554 1.00 0.53 H new ATOM 0 HB2 LYS A 58 7.231 -5.308 -15.764 1.00 0.56 H new ATOM 0 HB3 LYS A 58 7.214 -5.513 -14.024 1.00 0.56 H new ATOM 0 HG2 LYS A 58 5.273 -7.140 -14.283 1.00 0.78 H new ATOM 0 HG3 LYS A 58 5.428 -6.996 -16.023 1.00 0.78 H new ATOM 0 HD2 LYS A 58 7.839 -7.766 -15.829 1.00 0.96 H new ATOM 0 HD3 LYS A 58 7.595 -8.003 -14.110 1.00 0.96 H new ATOM 0 HE2 LYS A 58 7.156 -10.163 -15.014 1.00 0.85 H new ATOM 0 HE3 LYS A 58 5.551 -9.497 -14.790 1.00 0.85 H new ATOM 0 HZ1 LYS A 58 5.946 -10.506 -17.020 1.00 1.75 H new ATOM 0 HZ2 LYS A 58 5.442 -8.886 -17.089 1.00 1.75 H new ATOM 0 HZ3 LYS A 58 7.074 -9.279 -17.344 1.00 1.75 H new ATOM 830 N LEU A 59 5.470 -4.012 -12.416 1.00 0.50 N ATOM 831 CA LEU A 59 4.880 -4.083 -11.048 1.00 0.47 C ATOM 832 C LEU A 59 3.503 -3.409 -11.071 1.00 0.43 C ATOM 833 O LEU A 59 2.648 -3.688 -10.254 1.00 0.42 O ATOM 834 CB LEU A 59 5.807 -3.391 -10.028 1.00 0.53 C ATOM 835 CG LEU A 59 6.741 -4.414 -9.364 1.00 0.71 C ATOM 836 CD1 LEU A 59 7.521 -5.201 -10.434 1.00 1.07 C ATOM 837 CD2 LEU A 59 7.715 -3.671 -8.441 1.00 1.34 C ATOM 0 H LEU A 59 6.357 -3.514 -12.491 1.00 0.50 H new ATOM 0 HA LEU A 59 4.770 -5.125 -10.747 1.00 0.47 H new ATOM 0 HB2 LEU A 59 6.397 -2.623 -10.528 1.00 0.53 H new ATOM 0 HB3 LEU A 59 5.209 -2.889 -9.267 1.00 0.53 H new ATOM 0 HG LEU A 59 6.150 -5.122 -8.783 1.00 0.71 H new ATOM 0 HD11 LEU A 59 8.179 -5.922 -9.948 1.00 1.07 H new ATOM 0 HD12 LEU A 59 6.820 -5.728 -11.081 1.00 1.07 H new ATOM 0 HD13 LEU A 59 8.117 -4.511 -11.031 1.00 1.07 H new ATOM 0 HD21 LEU A 59 8.383 -4.388 -7.964 1.00 1.34 H new ATOM 0 HD22 LEU A 59 8.301 -2.962 -9.026 1.00 1.34 H new ATOM 0 HD23 LEU A 59 7.154 -3.134 -7.676 1.00 1.34 H new ATOM 849 N SER A 60 3.269 -2.564 -12.039 1.00 0.43 N ATOM 850 CA SER A 60 1.931 -1.915 -12.158 1.00 0.42 C ATOM 851 C SER A 60 0.945 -2.973 -12.667 1.00 0.39 C ATOM 852 O SER A 60 -0.195 -3.036 -12.253 1.00 0.41 O ATOM 853 CB SER A 60 2.013 -0.771 -13.169 1.00 0.47 C ATOM 854 OG SER A 60 1.943 -1.300 -14.486 1.00 1.36 O ATOM 0 H SER A 60 3.946 -2.295 -12.753 1.00 0.43 H new ATOM 0 HA SER A 60 1.607 -1.518 -11.196 1.00 0.42 H new ATOM 0 HB2 SER A 60 1.198 -0.066 -13.004 1.00 0.47 H new ATOM 0 HB3 SER A 60 2.943 -0.219 -13.036 1.00 0.47 H new ATOM 0 HG SER A 60 2.849 -1.407 -14.844 1.00 1.36 H new ATOM 860 N GLU A 61 1.409 -3.824 -13.541 1.00 0.38 N ATOM 861 CA GLU A 61 0.554 -4.925 -14.081 1.00 0.38 C ATOM 862 C GLU A 61 0.021 -5.783 -12.930 1.00 0.38 C ATOM 863 O GLU A 61 -1.103 -6.242 -12.968 1.00 0.41 O ATOM 864 CB GLU A 61 1.400 -5.803 -15.011 1.00 0.39 C ATOM 865 CG GLU A 61 0.505 -6.815 -15.734 1.00 1.06 C ATOM 866 CD GLU A 61 -0.387 -6.086 -16.742 1.00 1.67 C ATOM 867 OE1 GLU A 61 0.143 -5.584 -17.719 1.00 2.25 O ATOM 868 OE2 GLU A 61 -1.586 -6.044 -16.519 1.00 2.40 O ATOM 0 H GLU A 61 2.359 -3.804 -13.911 1.00 0.38 H new ATOM 0 HA GLU A 61 -0.285 -4.496 -14.629 1.00 0.38 H new ATOM 0 HB2 GLU A 61 1.920 -5.180 -15.739 1.00 0.39 H new ATOM 0 HB3 GLU A 61 2.164 -6.326 -14.435 1.00 0.39 H new ATOM 0 HG2 GLU A 61 1.118 -7.557 -16.246 1.00 1.06 H new ATOM 0 HG3 GLU A 61 -0.110 -7.353 -15.012 1.00 1.06 H new ATOM 875 N CYS A 62 0.793 -5.996 -11.904 1.00 0.37 N ATOM 876 CA CYS A 62 0.286 -6.818 -10.768 1.00 0.39 C ATOM 877 C CYS A 62 -0.816 -6.039 -10.042 1.00 0.38 C ATOM 878 O CYS A 62 -1.910 -6.531 -9.845 1.00 0.44 O ATOM 879 CB CYS A 62 1.435 -7.123 -9.802 1.00 0.41 C ATOM 880 SG CYS A 62 1.019 -8.582 -8.814 1.00 1.62 S ATOM 0 H CYS A 62 1.744 -5.642 -11.801 1.00 0.37 H new ATOM 0 HA CYS A 62 -0.119 -7.758 -11.142 1.00 0.39 H new ATOM 0 HB2 CYS A 62 2.356 -7.298 -10.358 1.00 0.41 H new ATOM 0 HB3 CYS A 62 1.614 -6.268 -9.150 1.00 0.41 H new ATOM 0 HG CYS A 62 1.782 -8.626 -7.763 1.00 1.62 H new ATOM 886 N LEU A 63 -0.547 -4.819 -9.674 1.00 0.35 N ATOM 887 CA LEU A 63 -1.581 -3.987 -8.994 1.00 0.36 C ATOM 888 C LEU A 63 -2.742 -3.732 -9.961 1.00 0.36 C ATOM 889 O LEU A 63 -3.866 -3.520 -9.551 1.00 0.41 O ATOM 890 CB LEU A 63 -0.948 -2.654 -8.581 1.00 0.38 C ATOM 891 CG LEU A 63 0.271 -2.916 -7.681 1.00 0.69 C ATOM 892 CD1 LEU A 63 1.010 -1.597 -7.435 1.00 1.39 C ATOM 893 CD2 LEU A 63 -0.184 -3.490 -6.329 1.00 1.11 C ATOM 0 H LEU A 63 0.352 -4.357 -9.816 1.00 0.35 H new ATOM 0 HA LEU A 63 -1.958 -4.504 -8.111 1.00 0.36 H new ATOM 0 HB2 LEU A 63 -0.645 -2.094 -9.466 1.00 0.38 H new ATOM 0 HB3 LEU A 63 -1.678 -2.042 -8.052 1.00 0.38 H new ATOM 0 HG LEU A 63 0.929 -3.631 -8.175 1.00 0.69 H new ATOM 0 HD11 LEU A 63 1.875 -1.778 -6.797 1.00 1.39 H new ATOM 0 HD12 LEU A 63 1.341 -1.183 -8.387 1.00 1.39 H new ATOM 0 HD13 LEU A 63 0.340 -0.890 -6.945 1.00 1.39 H new ATOM 0 HD21 LEU A 63 0.687 -3.672 -5.699 1.00 1.11 H new ATOM 0 HD22 LEU A 63 -0.846 -2.778 -5.836 1.00 1.11 H new ATOM 0 HD23 LEU A 63 -0.716 -4.427 -6.492 1.00 1.11 H new ATOM 905 N LYS A 64 -2.481 -3.745 -11.239 1.00 0.35 N ATOM 906 CA LYS A 64 -3.572 -3.500 -12.227 1.00 0.37 C ATOM 907 C LYS A 64 -4.395 -4.778 -12.416 1.00 0.39 C ATOM 908 O LYS A 64 -5.609 -4.762 -12.351 1.00 0.43 O ATOM 909 CB LYS A 64 -2.958 -3.086 -13.570 1.00 0.38 C ATOM 910 CG LYS A 64 -4.049 -2.531 -14.506 1.00 0.82 C ATOM 911 CD LYS A 64 -4.248 -1.030 -14.255 1.00 1.35 C ATOM 912 CE LYS A 64 -5.337 -0.500 -15.188 1.00 1.38 C ATOM 913 NZ LYS A 64 -4.852 -0.551 -16.597 1.00 2.09 N ATOM 0 H LYS A 64 -1.560 -3.915 -11.643 1.00 0.35 H new ATOM 0 HA LYS A 64 -4.221 -2.705 -11.859 1.00 0.37 H new ATOM 0 HB2 LYS A 64 -2.188 -2.331 -13.409 1.00 0.38 H new ATOM 0 HB3 LYS A 64 -2.471 -3.943 -14.035 1.00 0.38 H new ATOM 0 HG2 LYS A 64 -3.767 -2.699 -15.545 1.00 0.82 H new ATOM 0 HG3 LYS A 64 -4.986 -3.062 -14.340 1.00 0.82 H new ATOM 0 HD2 LYS A 64 -4.528 -0.858 -13.216 1.00 1.35 H new ATOM 0 HD3 LYS A 64 -3.314 -0.494 -14.426 1.00 1.35 H new ATOM 0 HE2 LYS A 64 -6.243 -1.096 -15.082 1.00 1.38 H new ATOM 0 HE3 LYS A 64 -5.596 0.524 -14.918 1.00 1.38 H new ATOM 0 HZ1 LYS A 64 -5.428 0.084 -17.186 1.00 2.09 H new ATOM 0 HZ2 LYS A 64 -3.857 -0.249 -16.633 1.00 2.09 H new ATOM 0 HZ3 LYS A 64 -4.932 -1.524 -16.957 1.00 2.09 H new ATOM 927 N ARG A 65 -3.744 -5.883 -12.649 1.00 0.43 N ATOM 928 CA ARG A 65 -4.479 -7.166 -12.844 1.00 0.47 C ATOM 929 C ARG A 65 -5.301 -7.500 -11.596 1.00 0.50 C ATOM 930 O ARG A 65 -6.402 -8.006 -11.684 1.00 0.54 O ATOM 931 CB ARG A 65 -3.473 -8.292 -13.092 1.00 0.45 C ATOM 932 CG ARG A 65 -4.212 -9.524 -13.635 1.00 0.94 C ATOM 933 CD ARG A 65 -3.231 -10.698 -13.832 1.00 1.55 C ATOM 934 NE ARG A 65 -3.526 -11.398 -15.123 1.00 1.86 N ATOM 935 CZ ARG A 65 -4.750 -11.720 -15.458 1.00 2.39 C ATOM 936 NH1 ARG A 65 -5.736 -11.538 -14.623 1.00 2.94 N ATOM 937 NH2 ARG A 65 -4.981 -12.261 -16.623 1.00 2.92 N ATOM 0 H ARG A 65 -2.729 -5.954 -12.713 1.00 0.43 H new ATOM 0 HA ARG A 65 -5.148 -7.064 -13.699 1.00 0.47 H new ATOM 0 HB2 ARG A 65 -2.714 -7.967 -13.803 1.00 0.45 H new ATOM 0 HB3 ARG A 65 -2.956 -8.543 -12.166 1.00 0.45 H new ATOM 0 HG2 ARG A 65 -5.003 -9.815 -12.944 1.00 0.94 H new ATOM 0 HG3 ARG A 65 -4.691 -9.280 -14.583 1.00 0.94 H new ATOM 0 HD2 ARG A 65 -2.205 -10.330 -13.834 1.00 1.55 H new ATOM 0 HD3 ARG A 65 -3.316 -11.398 -13.001 1.00 1.55 H new ATOM 0 HE ARG A 65 -2.758 -11.628 -15.754 1.00 1.86 H new ATOM 0 HH11 ARG A 65 -5.556 -11.142 -13.700 1.00 2.94 H new ATOM 0 HH12 ARG A 65 -6.686 -11.792 -14.893 1.00 2.94 H new ATOM 0 HH21 ARG A 65 -4.210 -12.431 -17.268 1.00 2.92 H new ATOM 0 HH22 ARG A 65 -5.933 -12.514 -16.888 1.00 2.92 H new ATOM 951 N ILE A 66 -4.779 -7.216 -10.433 1.00 0.49 N ATOM 952 CA ILE A 66 -5.532 -7.514 -9.180 1.00 0.53 C ATOM 953 C ILE A 66 -6.545 -6.390 -8.937 1.00 0.54 C ATOM 954 O ILE A 66 -7.621 -6.607 -8.416 1.00 0.60 O ATOM 955 CB ILE A 66 -4.539 -7.596 -8.010 1.00 0.52 C ATOM 956 CG1 ILE A 66 -3.732 -8.892 -8.116 1.00 1.22 C ATOM 957 CG2 ILE A 66 -5.283 -7.563 -6.669 1.00 1.29 C ATOM 958 CD1 ILE A 66 -2.552 -8.841 -7.143 1.00 1.25 C ATOM 0 H ILE A 66 -3.862 -6.790 -10.296 1.00 0.49 H new ATOM 0 HA ILE A 66 -6.061 -8.463 -9.266 1.00 0.53 H new ATOM 0 HB ILE A 66 -3.868 -6.738 -8.058 1.00 0.52 H new ATOM 0 HG12 ILE A 66 -4.367 -9.748 -7.889 1.00 1.22 H new ATOM 0 HG13 ILE A 66 -3.371 -9.025 -9.136 1.00 1.22 H new ATOM 0 HG21 ILE A 66 -4.564 -7.622 -5.852 1.00 1.29 H new ATOM 0 HG22 ILE A 66 -5.848 -6.634 -6.589 1.00 1.29 H new ATOM 0 HG23 ILE A 66 -5.967 -8.409 -6.612 1.00 1.29 H new ATOM 0 HD11 ILE A 66 -1.978 -9.764 -7.219 1.00 1.25 H new ATOM 0 HD12 ILE A 66 -1.912 -7.994 -7.391 1.00 1.25 H new ATOM 0 HD13 ILE A 66 -2.925 -8.728 -6.125 1.00 1.25 H new ATOM 970 N GLY A 67 -6.206 -5.194 -9.330 1.00 0.52 N ATOM 971 CA GLY A 67 -7.139 -4.045 -9.148 1.00 0.55 C ATOM 972 C GLY A 67 -8.419 -4.290 -9.949 1.00 0.53 C ATOM 973 O GLY A 67 -9.490 -3.874 -9.558 1.00 0.63 O ATOM 0 H GLY A 67 -5.317 -4.961 -9.772 1.00 0.52 H new ATOM 0 HA2 GLY A 67 -7.377 -3.921 -8.092 1.00 0.55 H new ATOM 0 HA3 GLY A 67 -6.663 -3.122 -9.478 1.00 0.55 H new ATOM 977 N ASP A 68 -8.321 -4.952 -11.069 1.00 0.54 N ATOM 978 CA ASP A 68 -9.539 -5.208 -11.892 1.00 0.54 C ATOM 979 C ASP A 68 -10.294 -6.424 -11.347 1.00 0.52 C ATOM 980 O ASP A 68 -11.508 -6.440 -11.292 1.00 0.56 O ATOM 981 CB ASP A 68 -9.119 -5.479 -13.339 1.00 0.60 C ATOM 982 CG ASP A 68 -8.314 -4.290 -13.867 1.00 1.43 C ATOM 983 OD1 ASP A 68 -8.751 -3.169 -13.667 1.00 2.20 O ATOM 984 OD2 ASP A 68 -7.275 -4.522 -14.462 1.00 2.12 O ATOM 0 H ASP A 68 -7.452 -5.327 -11.450 1.00 0.54 H new ATOM 0 HA ASP A 68 -10.191 -4.336 -11.851 1.00 0.54 H new ATOM 0 HB2 ASP A 68 -8.521 -6.389 -13.391 1.00 0.60 H new ATOM 0 HB3 ASP A 68 -10.000 -5.640 -13.961 1.00 0.60 H new ATOM 989 N GLU A 69 -9.586 -7.446 -10.952 1.00 0.56 N ATOM 990 CA GLU A 69 -10.260 -8.666 -10.419 1.00 0.56 C ATOM 991 C GLU A 69 -10.806 -8.388 -9.015 1.00 0.55 C ATOM 992 O GLU A 69 -11.980 -8.553 -8.749 1.00 0.73 O ATOM 993 CB GLU A 69 -9.242 -9.807 -10.350 1.00 0.61 C ATOM 994 CG GLU A 69 -9.969 -11.131 -10.105 1.00 0.84 C ATOM 995 CD GLU A 69 -10.716 -11.547 -11.374 1.00 1.65 C ATOM 996 OE1 GLU A 69 -10.091 -12.137 -12.240 1.00 2.48 O ATOM 997 OE2 GLU A 69 -11.902 -11.270 -11.457 1.00 2.23 O ATOM 0 H GLU A 69 -8.567 -7.490 -10.975 1.00 0.56 H new ATOM 0 HA GLU A 69 -11.086 -8.941 -11.075 1.00 0.56 H new ATOM 0 HB2 GLU A 69 -8.675 -9.859 -11.280 1.00 0.61 H new ATOM 0 HB3 GLU A 69 -8.526 -9.621 -9.550 1.00 0.61 H new ATOM 0 HG2 GLU A 69 -9.254 -11.903 -9.822 1.00 0.84 H new ATOM 0 HG3 GLU A 69 -10.669 -11.025 -9.276 1.00 0.84 H new ATOM 1004 N LEU A 70 -9.956 -7.992 -8.112 1.00 0.53 N ATOM 1005 CA LEU A 70 -10.404 -7.727 -6.714 1.00 0.52 C ATOM 1006 C LEU A 70 -11.525 -6.679 -6.696 1.00 0.54 C ATOM 1007 O LEU A 70 -12.528 -6.839 -6.030 1.00 0.60 O ATOM 1008 CB LEU A 70 -9.199 -7.209 -5.902 1.00 0.61 C ATOM 1009 CG LEU A 70 -9.297 -7.647 -4.434 1.00 0.70 C ATOM 1010 CD1 LEU A 70 -8.169 -6.980 -3.641 1.00 1.38 C ATOM 1011 CD2 LEU A 70 -10.638 -7.203 -3.834 1.00 1.61 C ATOM 0 H LEU A 70 -8.962 -7.839 -8.282 1.00 0.53 H new ATOM 0 HA LEU A 70 -10.789 -8.648 -6.277 1.00 0.52 H new ATOM 0 HB2 LEU A 70 -8.273 -7.586 -6.337 1.00 0.61 H new ATOM 0 HB3 LEU A 70 -9.158 -6.121 -5.959 1.00 0.61 H new ATOM 0 HG LEU A 70 -9.218 -8.733 -4.383 1.00 0.70 H new ATOM 0 HD11 LEU A 70 -8.229 -7.285 -2.596 1.00 1.38 H new ATOM 0 HD12 LEU A 70 -7.206 -7.283 -4.052 1.00 1.38 H new ATOM 0 HD13 LEU A 70 -8.267 -5.897 -3.709 1.00 1.38 H new ATOM 0 HD21 LEU A 70 -10.694 -7.520 -2.793 1.00 1.61 H new ATOM 0 HD22 LEU A 70 -10.719 -6.117 -3.887 1.00 1.61 H new ATOM 0 HD23 LEU A 70 -11.455 -7.656 -4.395 1.00 1.61 H new ATOM 1023 N ASP A 71 -11.351 -5.600 -7.409 1.00 0.67 N ATOM 1024 CA ASP A 71 -12.391 -4.532 -7.417 1.00 0.91 C ATOM 1025 C ASP A 71 -13.738 -5.096 -7.870 1.00 1.02 C ATOM 1026 O ASP A 71 -14.724 -4.384 -7.872 1.00 1.29 O ATOM 1027 CB ASP A 71 -11.971 -3.408 -8.366 1.00 1.09 C ATOM 1028 CG ASP A 71 -13.058 -2.332 -8.394 1.00 1.66 C ATOM 1029 OD1 ASP A 71 -13.347 -1.782 -7.343 1.00 2.36 O ATOM 1030 OD2 ASP A 71 -13.583 -2.075 -9.465 1.00 2.25 O ATOM 0 H ASP A 71 -10.532 -5.412 -7.987 1.00 0.67 H new ATOM 0 HA ASP A 71 -12.492 -4.142 -6.404 1.00 0.91 H new ATOM 0 HB2 ASP A 71 -11.025 -2.976 -8.039 1.00 1.09 H new ATOM 0 HB3 ASP A 71 -11.811 -3.805 -9.369 1.00 1.09 H new ATOM 1035 N SER A 72 -13.812 -6.357 -8.242 1.00 0.90 N ATOM 1036 CA SER A 72 -15.135 -6.927 -8.681 1.00 1.20 C ATOM 1037 C SER A 72 -15.714 -7.791 -7.558 1.00 0.98 C ATOM 1038 O SER A 72 -16.646 -8.544 -7.757 1.00 1.02 O ATOM 1039 CB SER A 72 -14.974 -7.740 -9.964 1.00 1.57 C ATOM 1040 OG SER A 72 -14.291 -8.952 -9.665 1.00 2.09 O ATOM 0 H SER A 72 -13.027 -7.008 -8.261 1.00 0.90 H new ATOM 0 HA SER A 72 -15.824 -6.109 -8.892 1.00 1.20 H new ATOM 0 HB2 SER A 72 -15.951 -7.956 -10.397 1.00 1.57 H new ATOM 0 HB3 SER A 72 -14.416 -7.167 -10.705 1.00 1.57 H new ATOM 0 HG SER A 72 -13.581 -8.775 -9.013 1.00 2.09 H new ATOM 1046 N ASN A 73 -15.196 -7.650 -6.368 1.00 0.92 N ATOM 1047 CA ASN A 73 -15.742 -8.417 -5.212 1.00 0.83 C ATOM 1048 C ASN A 73 -16.864 -7.577 -4.593 1.00 0.75 C ATOM 1049 O ASN A 73 -16.638 -6.490 -4.101 1.00 1.07 O ATOM 1050 CB ASN A 73 -14.633 -8.650 -4.177 1.00 0.91 C ATOM 1051 CG ASN A 73 -13.755 -9.825 -4.620 1.00 1.43 C ATOM 1052 OD1 ASN A 73 -12.679 -9.629 -5.149 1.00 2.29 O ATOM 1053 ND2 ASN A 73 -14.174 -11.046 -4.425 1.00 1.90 N ATOM 0 H ASN A 73 -14.414 -7.034 -6.146 1.00 0.92 H new ATOM 0 HA ASN A 73 -16.122 -9.387 -5.535 1.00 0.83 H new ATOM 0 HB2 ASN A 73 -14.027 -7.750 -4.070 1.00 0.91 H new ATOM 0 HB3 ASN A 73 -15.071 -8.858 -3.201 1.00 0.91 H new ATOM 0 HD21 ASN A 73 -13.598 -11.836 -4.717 1.00 1.90 H new ATOM 0 HD22 ASN A 73 -15.077 -11.210 -3.981 1.00 1.90 H new ATOM 1060 N MET A 74 -18.077 -8.064 -4.632 1.00 0.71 N ATOM 1061 CA MET A 74 -19.216 -7.282 -4.069 1.00 0.67 C ATOM 1062 C MET A 74 -19.268 -7.435 -2.549 1.00 0.67 C ATOM 1063 O MET A 74 -19.966 -6.718 -1.861 1.00 0.71 O ATOM 1064 CB MET A 74 -20.532 -7.780 -4.681 1.00 0.75 C ATOM 1065 CG MET A 74 -20.489 -7.671 -6.228 1.00 1.20 C ATOM 1066 SD MET A 74 -21.681 -6.427 -6.801 1.00 1.92 S ATOM 1067 CE MET A 74 -20.681 -4.954 -6.470 1.00 1.96 C ATOM 0 H MET A 74 -18.327 -8.969 -5.029 1.00 0.71 H new ATOM 0 HA MET A 74 -19.074 -6.229 -4.311 1.00 0.67 H new ATOM 0 HB2 MET A 74 -20.707 -8.815 -4.388 1.00 0.75 H new ATOM 0 HB3 MET A 74 -21.365 -7.194 -4.293 1.00 0.75 H new ATOM 0 HG2 MET A 74 -19.485 -7.400 -6.553 1.00 1.20 H new ATOM 0 HG3 MET A 74 -20.719 -8.638 -6.675 1.00 1.20 H new ATOM 0 HE1 MET A 74 -21.159 -4.082 -6.916 1.00 1.96 H new ATOM 0 HE2 MET A 74 -20.593 -4.809 -5.393 1.00 1.96 H new ATOM 0 HE3 MET A 74 -19.688 -5.084 -6.901 1.00 1.96 H new ATOM 1077 N GLU A 75 -18.522 -8.365 -2.021 1.00 0.70 N ATOM 1078 CA GLU A 75 -18.503 -8.578 -0.550 1.00 0.75 C ATOM 1079 C GLU A 75 -17.574 -7.551 0.100 1.00 0.73 C ATOM 1080 O GLU A 75 -17.915 -6.937 1.091 1.00 0.78 O ATOM 1081 CB GLU A 75 -17.993 -9.991 -0.255 1.00 0.87 C ATOM 1082 CG GLU A 75 -18.257 -10.332 1.210 1.00 1.15 C ATOM 1083 CD GLU A 75 -17.722 -11.733 1.514 1.00 1.70 C ATOM 1084 OE1 GLU A 75 -17.753 -12.565 0.621 1.00 2.21 O ATOM 1085 OE2 GLU A 75 -17.290 -11.951 2.634 1.00 2.29 O ATOM 0 H GLU A 75 -17.919 -8.992 -2.553 1.00 0.70 H new ATOM 0 HA GLU A 75 -19.509 -8.461 -0.147 1.00 0.75 H new ATOM 0 HB2 GLU A 75 -18.492 -10.712 -0.903 1.00 0.87 H new ATOM 0 HB3 GLU A 75 -16.926 -10.056 -0.468 1.00 0.87 H new ATOM 0 HG2 GLU A 75 -17.775 -9.599 1.857 1.00 1.15 H new ATOM 0 HG3 GLU A 75 -19.326 -10.287 1.418 1.00 1.15 H new ATOM 1092 N LEU A 76 -16.406 -7.356 -0.444 1.00 0.74 N ATOM 1093 CA LEU A 76 -15.463 -6.365 0.152 1.00 0.80 C ATOM 1094 C LEU A 76 -15.833 -4.947 -0.298 1.00 0.75 C ATOM 1095 O LEU A 76 -15.779 -4.005 0.466 1.00 0.81 O ATOM 1096 CB LEU A 76 -14.034 -6.679 -0.301 1.00 0.92 C ATOM 1097 CG LEU A 76 -13.021 -5.890 0.559 1.00 1.00 C ATOM 1098 CD1 LEU A 76 -12.638 -6.704 1.799 1.00 1.57 C ATOM 1099 CD2 LEU A 76 -11.758 -5.604 -0.263 1.00 1.51 C ATOM 0 H LEU A 76 -16.062 -7.838 -1.274 1.00 0.74 H new ATOM 0 HA LEU A 76 -15.529 -6.426 1.238 1.00 0.80 H new ATOM 0 HB2 LEU A 76 -13.843 -7.748 -0.213 1.00 0.92 H new ATOM 0 HB3 LEU A 76 -13.912 -6.419 -1.352 1.00 0.92 H new ATOM 0 HG LEU A 76 -13.480 -4.951 0.870 1.00 1.00 H new ATOM 0 HD11 LEU A 76 -11.924 -6.140 2.398 1.00 1.57 H new ATOM 0 HD12 LEU A 76 -13.530 -6.905 2.392 1.00 1.57 H new ATOM 0 HD13 LEU A 76 -12.187 -7.647 1.490 1.00 1.57 H new ATOM 0 HD21 LEU A 76 -11.046 -5.048 0.346 1.00 1.51 H new ATOM 0 HD22 LEU A 76 -11.308 -6.545 -0.578 1.00 1.51 H new ATOM 0 HD23 LEU A 76 -12.021 -5.015 -1.142 1.00 1.51 H new ATOM 1111 N GLN A 77 -16.236 -4.800 -1.529 1.00 0.76 N ATOM 1112 CA GLN A 77 -16.633 -3.453 -2.028 1.00 0.74 C ATOM 1113 C GLN A 77 -17.897 -2.999 -1.294 1.00 0.71 C ATOM 1114 O GLN A 77 -18.062 -1.832 -0.990 1.00 0.72 O ATOM 1115 CB GLN A 77 -16.897 -3.509 -3.534 1.00 0.71 C ATOM 1116 CG GLN A 77 -17.169 -2.099 -4.061 1.00 1.26 C ATOM 1117 CD GLN A 77 -17.330 -2.145 -5.581 1.00 1.59 C ATOM 1118 OE1 GLN A 77 -16.646 -1.440 -6.297 1.00 2.35 O ATOM 1119 NE2 GLN A 77 -18.211 -2.950 -6.109 1.00 2.03 N ATOM 0 H GLN A 77 -16.308 -5.554 -2.212 1.00 0.76 H new ATOM 0 HA GLN A 77 -15.827 -2.744 -1.841 1.00 0.74 H new ATOM 0 HB2 GLN A 77 -16.038 -3.941 -4.048 1.00 0.71 H new ATOM 0 HB3 GLN A 77 -17.750 -4.156 -3.740 1.00 0.71 H new ATOM 0 HG2 GLN A 77 -18.071 -1.695 -3.601 1.00 1.26 H new ATOM 0 HG3 GLN A 77 -16.349 -1.434 -3.791 1.00 1.26 H new ATOM 0 HE21 GLN A 77 -18.785 -3.542 -5.509 1.00 2.03 H new ATOM 0 HE22 GLN A 77 -18.325 -2.987 -7.122 1.00 2.03 H new ATOM 1128 N ARG A 78 -18.784 -3.902 -0.989 1.00 0.72 N ATOM 1129 CA ARG A 78 -20.020 -3.499 -0.262 1.00 0.73 C ATOM 1130 C ARG A 78 -19.666 -3.160 1.186 1.00 0.75 C ATOM 1131 O ARG A 78 -20.240 -2.270 1.782 1.00 0.79 O ATOM 1132 CB ARG A 78 -21.033 -4.651 -0.293 1.00 0.74 C ATOM 1133 CG ARG A 78 -22.295 -4.283 0.530 1.00 0.94 C ATOM 1134 CD ARG A 78 -22.274 -4.994 1.890 1.00 1.23 C ATOM 1135 NE ARG A 78 -23.375 -4.463 2.741 1.00 1.80 N ATOM 1136 CZ ARG A 78 -23.750 -5.116 3.807 1.00 2.50 C ATOM 1137 NH1 ARG A 78 -23.161 -6.236 4.128 1.00 2.83 N ATOM 1138 NH2 ARG A 78 -24.715 -4.649 4.551 1.00 3.41 N ATOM 0 H ARG A 78 -18.709 -4.895 -1.209 1.00 0.72 H new ATOM 0 HA ARG A 78 -20.459 -2.624 -0.742 1.00 0.73 H new ATOM 0 HB2 ARG A 78 -21.314 -4.869 -1.323 1.00 0.74 H new ATOM 0 HB3 ARG A 78 -20.578 -5.555 0.112 1.00 0.74 H new ATOM 0 HG2 ARG A 78 -22.339 -3.204 0.677 1.00 0.94 H new ATOM 0 HG3 ARG A 78 -23.192 -4.566 -0.021 1.00 0.94 H new ATOM 0 HD2 ARG A 78 -22.391 -6.069 1.753 1.00 1.23 H new ATOM 0 HD3 ARG A 78 -21.313 -4.838 2.380 1.00 1.23 H new ATOM 0 HE ARG A 78 -23.836 -3.588 2.491 1.00 1.80 H new ATOM 0 HH11 ARG A 78 -22.407 -6.601 3.546 1.00 2.83 H new ATOM 0 HH12 ARG A 78 -23.454 -6.746 4.961 1.00 2.83 H new ATOM 0 HH21 ARG A 78 -25.176 -3.774 4.299 1.00 3.41 H new ATOM 0 HH22 ARG A 78 -25.009 -5.159 5.384 1.00 3.41 H new ATOM 1152 N MET A 79 -18.716 -3.851 1.757 1.00 0.75 N ATOM 1153 CA MET A 79 -18.323 -3.552 3.163 1.00 0.77 C ATOM 1154 C MET A 79 -17.670 -2.168 3.211 1.00 0.77 C ATOM 1155 O MET A 79 -18.016 -1.335 4.026 1.00 0.78 O ATOM 1156 CB MET A 79 -17.325 -4.612 3.652 1.00 0.81 C ATOM 1157 CG MET A 79 -18.078 -5.870 4.098 1.00 1.08 C ATOM 1158 SD MET A 79 -16.890 -7.121 4.652 1.00 1.07 S ATOM 1159 CE MET A 79 -16.714 -6.554 6.364 1.00 0.81 C ATOM 0 H MET A 79 -18.197 -4.607 1.311 1.00 0.75 H new ATOM 0 HA MET A 79 -19.203 -3.566 3.806 1.00 0.77 H new ATOM 0 HB2 MET A 79 -16.625 -4.860 2.854 1.00 0.81 H new ATOM 0 HB3 MET A 79 -16.737 -4.216 4.480 1.00 0.81 H new ATOM 0 HG2 MET A 79 -18.769 -5.626 4.905 1.00 1.08 H new ATOM 0 HG3 MET A 79 -18.676 -6.260 3.274 1.00 1.08 H new ATOM 0 HE1 MET A 79 -15.659 -6.545 6.638 1.00 0.81 H new ATOM 0 HE2 MET A 79 -17.122 -5.547 6.458 1.00 0.81 H new ATOM 0 HE3 MET A 79 -17.255 -7.228 7.028 1.00 0.81 H new ATOM 1169 N ILE A 80 -16.731 -1.913 2.339 1.00 0.77 N ATOM 1170 CA ILE A 80 -16.065 -0.581 2.333 1.00 0.80 C ATOM 1171 C ILE A 80 -17.136 0.510 2.275 1.00 0.80 C ATOM 1172 O ILE A 80 -16.962 1.592 2.800 1.00 0.83 O ATOM 1173 CB ILE A 80 -15.135 -0.478 1.121 1.00 0.82 C ATOM 1174 CG1 ILE A 80 -13.984 -1.476 1.284 1.00 0.84 C ATOM 1175 CG2 ILE A 80 -14.565 0.940 1.024 1.00 0.89 C ATOM 1176 CD1 ILE A 80 -13.201 -1.580 -0.026 1.00 1.10 C ATOM 0 H ILE A 80 -16.398 -2.569 1.633 1.00 0.77 H new ATOM 0 HA ILE A 80 -15.472 -0.456 3.239 1.00 0.80 H new ATOM 0 HB ILE A 80 -15.696 -0.703 0.214 1.00 0.82 H new ATOM 0 HG12 ILE A 80 -13.323 -1.155 2.089 1.00 0.84 H new ATOM 0 HG13 ILE A 80 -14.375 -2.454 1.564 1.00 0.84 H new ATOM 0 HG21 ILE A 80 -13.904 1.008 0.160 1.00 0.89 H new ATOM 0 HG22 ILE A 80 -15.381 1.654 0.913 1.00 0.89 H new ATOM 0 HG23 ILE A 80 -14.003 1.169 1.930 1.00 0.89 H new ATOM 0 HD11 ILE A 80 -12.383 -2.291 0.094 1.00 1.10 H new ATOM 0 HD12 ILE A 80 -13.865 -1.921 -0.820 1.00 1.10 H new ATOM 0 HD13 ILE A 80 -12.796 -0.602 -0.287 1.00 1.10 H new ATOM 1188 N ALA A 81 -18.252 0.231 1.654 1.00 0.78 N ATOM 1189 CA ALA A 81 -19.336 1.253 1.585 1.00 0.80 C ATOM 1190 C ALA A 81 -19.991 1.374 2.965 1.00 0.81 C ATOM 1191 O ALA A 81 -20.663 2.342 3.263 1.00 0.85 O ATOM 1192 CB ALA A 81 -20.381 0.830 0.551 1.00 0.79 C ATOM 0 H ALA A 81 -18.459 -0.656 1.194 1.00 0.78 H new ATOM 0 HA ALA A 81 -18.918 2.215 1.290 1.00 0.80 H new ATOM 0 HB1 ALA A 81 -21.171 1.580 0.504 1.00 0.79 H new ATOM 0 HB2 ALA A 81 -19.909 0.739 -0.427 1.00 0.79 H new ATOM 0 HB3 ALA A 81 -20.809 -0.130 0.838 1.00 0.79 H new ATOM 1198 N ALA A 82 -19.785 0.403 3.811 1.00 0.78 N ATOM 1199 CA ALA A 82 -20.374 0.452 5.182 1.00 0.80 C ATOM 1200 C ALA A 82 -19.539 1.384 6.065 1.00 0.79 C ATOM 1201 O ALA A 82 -19.939 1.739 7.156 1.00 0.83 O ATOM 1202 CB ALA A 82 -20.367 -0.952 5.787 1.00 0.87 C ATOM 0 H ALA A 82 -19.230 -0.429 3.611 1.00 0.78 H new ATOM 0 HA ALA A 82 -21.397 0.823 5.124 1.00 0.80 H new ATOM 0 HB1 ALA A 82 -20.797 -0.919 6.788 1.00 0.87 H new ATOM 0 HB2 ALA A 82 -20.957 -1.621 5.161 1.00 0.87 H new ATOM 0 HB3 ALA A 82 -19.342 -1.319 5.844 1.00 0.87 H new ATOM 1208 N VAL A 83 -18.394 1.799 5.597 1.00 0.80 N ATOM 1209 CA VAL A 83 -17.543 2.725 6.403 1.00 0.85 C ATOM 1210 C VAL A 83 -17.956 4.169 6.111 1.00 0.99 C ATOM 1211 O VAL A 83 -17.420 4.826 5.241 1.00 1.36 O ATOM 1212 CB VAL A 83 -16.067 2.530 6.039 1.00 0.97 C ATOM 1213 CG1 VAL A 83 -15.188 3.329 7.002 1.00 1.81 C ATOM 1214 CG2 VAL A 83 -15.701 1.046 6.129 1.00 1.40 C ATOM 0 H VAL A 83 -18.009 1.537 4.690 1.00 0.80 H new ATOM 0 HA VAL A 83 -17.678 2.510 7.463 1.00 0.85 H new ATOM 0 HB VAL A 83 -15.903 2.881 5.020 1.00 0.97 H new ATOM 0 HG11 VAL A 83 -14.139 3.188 6.740 1.00 1.81 H new ATOM 0 HG12 VAL A 83 -15.440 4.387 6.932 1.00 1.81 H new ATOM 0 HG13 VAL A 83 -15.357 2.982 8.022 1.00 1.81 H new ATOM 0 HG21 VAL A 83 -14.651 0.914 5.869 1.00 1.40 H new ATOM 0 HG22 VAL A 83 -15.871 0.690 7.145 1.00 1.40 H new ATOM 0 HG23 VAL A 83 -16.321 0.476 5.437 1.00 1.40 H new ATOM 1273 N PRO A 88 -10.574 9.495 9.616 1.00 0.77 N ATOM 1274 CA PRO A 88 -9.630 8.641 8.873 1.00 0.83 C ATOM 1275 C PRO A 88 -8.273 8.577 9.582 1.00 0.73 C ATOM 1276 O PRO A 88 -7.524 7.636 9.404 1.00 0.72 O ATOM 1277 CB PRO A 88 -9.512 9.293 7.473 1.00 1.01 C ATOM 1278 CG PRO A 88 -10.395 10.573 7.479 1.00 1.07 C ATOM 1279 CD PRO A 88 -11.029 10.697 8.880 1.00 0.83 C ATOM 0 HA PRO A 88 -9.976 7.609 8.805 1.00 0.83 H new ATOM 0 HB2 PRO A 88 -8.474 9.544 7.253 1.00 1.01 H new ATOM 0 HB3 PRO A 88 -9.844 8.602 6.699 1.00 1.01 H new ATOM 0 HG2 PRO A 88 -9.794 11.454 7.252 1.00 1.07 H new ATOM 0 HG3 PRO A 88 -11.168 10.508 6.713 1.00 1.07 H new ATOM 0 HD2 PRO A 88 -10.707 11.611 9.379 1.00 0.83 H new ATOM 0 HD3 PRO A 88 -12.117 10.734 8.819 1.00 0.83 H new ATOM 1287 N ARG A 89 -7.937 9.555 10.381 1.00 0.75 N ATOM 1288 CA ARG A 89 -6.620 9.499 11.071 1.00 0.73 C ATOM 1289 C ARG A 89 -6.689 8.454 12.186 1.00 0.67 C ATOM 1290 O ARG A 89 -5.809 7.629 12.333 1.00 0.68 O ATOM 1291 CB ARG A 89 -6.284 10.865 11.667 1.00 0.79 C ATOM 1292 CG ARG A 89 -5.981 11.870 10.544 1.00 1.63 C ATOM 1293 CD ARG A 89 -5.716 13.281 11.132 1.00 1.65 C ATOM 1294 NE ARG A 89 -4.386 13.806 10.668 1.00 2.07 N ATOM 1295 CZ ARG A 89 -3.284 13.112 10.807 1.00 2.47 C ATOM 1296 NH1 ARG A 89 -3.299 11.968 11.428 1.00 2.69 N ATOM 1297 NH2 ARG A 89 -2.159 13.582 10.346 1.00 3.10 N ATOM 0 H ARG A 89 -8.508 10.376 10.582 1.00 0.75 H new ATOM 0 HA ARG A 89 -5.844 9.227 10.355 1.00 0.73 H new ATOM 0 HB2 ARG A 89 -7.118 11.223 12.270 1.00 0.79 H new ATOM 0 HB3 ARG A 89 -5.424 10.779 12.331 1.00 0.79 H new ATOM 0 HG2 ARG A 89 -5.112 11.538 9.976 1.00 1.63 H new ATOM 0 HG3 ARG A 89 -6.820 11.911 9.849 1.00 1.63 H new ATOM 0 HD2 ARG A 89 -6.509 13.963 10.826 1.00 1.65 H new ATOM 0 HD3 ARG A 89 -5.736 13.237 12.221 1.00 1.65 H new ATOM 0 HE ARG A 89 -4.341 14.728 10.233 1.00 2.07 H new ATOM 0 HH11 ARG A 89 -4.173 11.607 11.810 1.00 2.69 H new ATOM 0 HH12 ARG A 89 -2.437 11.433 11.532 1.00 2.69 H new ATOM 0 HH21 ARG A 89 -2.138 14.488 9.878 1.00 3.10 H new ATOM 0 HH22 ARG A 89 -1.299 13.044 10.453 1.00 3.10 H new ATOM 1311 N GLU A 90 -7.729 8.486 12.975 1.00 0.65 N ATOM 1312 CA GLU A 90 -7.858 7.496 14.082 1.00 0.65 C ATOM 1313 C GLU A 90 -8.064 6.099 13.486 1.00 0.64 C ATOM 1314 O GLU A 90 -7.450 5.140 13.909 1.00 0.67 O ATOM 1315 CB GLU A 90 -9.067 7.868 14.949 1.00 0.71 C ATOM 1316 CG GLU A 90 -8.700 9.029 15.880 1.00 1.32 C ATOM 1317 CD GLU A 90 -8.165 10.202 15.056 1.00 2.02 C ATOM 1318 OE1 GLU A 90 -7.022 10.132 14.635 1.00 2.46 O ATOM 1319 OE2 GLU A 90 -8.906 11.152 14.864 1.00 2.78 O ATOM 0 H GLU A 90 -8.495 9.155 12.900 1.00 0.65 H new ATOM 0 HA GLU A 90 -6.955 7.501 14.693 1.00 0.65 H new ATOM 0 HB2 GLU A 90 -9.908 8.150 14.315 1.00 0.71 H new ATOM 0 HB3 GLU A 90 -9.385 7.006 15.535 1.00 0.71 H new ATOM 0 HG2 GLU A 90 -9.575 9.342 16.450 1.00 1.32 H new ATOM 0 HG3 GLU A 90 -7.949 8.706 16.601 1.00 1.32 H new ATOM 1326 N VAL A 91 -8.932 5.971 12.517 1.00 0.64 N ATOM 1327 CA VAL A 91 -9.186 4.632 11.910 1.00 0.67 C ATOM 1328 C VAL A 91 -7.928 4.145 11.188 1.00 0.66 C ATOM 1329 O VAL A 91 -7.517 3.011 11.337 1.00 0.67 O ATOM 1330 CB VAL A 91 -10.348 4.743 10.916 1.00 0.71 C ATOM 1331 CG1 VAL A 91 -10.619 3.382 10.271 1.00 0.80 C ATOM 1332 CG2 VAL A 91 -11.604 5.209 11.656 1.00 0.75 C ATOM 0 H VAL A 91 -9.476 6.737 12.120 1.00 0.64 H new ATOM 0 HA VAL A 91 -9.443 3.918 12.692 1.00 0.67 H new ATOM 0 HB VAL A 91 -10.086 5.462 10.139 1.00 0.71 H new ATOM 0 HG11 VAL A 91 -11.446 3.471 9.567 1.00 0.80 H new ATOM 0 HG12 VAL A 91 -9.727 3.046 9.742 1.00 0.80 H new ATOM 0 HG13 VAL A 91 -10.877 2.658 11.044 1.00 0.80 H new ATOM 0 HG21 VAL A 91 -12.432 5.289 10.952 1.00 0.75 H new ATOM 0 HG22 VAL A 91 -11.857 4.488 12.433 1.00 0.75 H new ATOM 0 HG23 VAL A 91 -11.419 6.182 12.110 1.00 0.75 H new ATOM 1342 N PHE A 92 -7.313 4.987 10.410 1.00 0.64 N ATOM 1343 CA PHE A 92 -6.082 4.570 9.682 1.00 0.65 C ATOM 1344 C PHE A 92 -5.052 4.001 10.664 1.00 0.62 C ATOM 1345 O PHE A 92 -4.457 2.971 10.414 1.00 0.67 O ATOM 1346 CB PHE A 92 -5.483 5.780 8.958 1.00 0.65 C ATOM 1347 CG PHE A 92 -4.169 5.389 8.319 1.00 0.65 C ATOM 1348 CD1 PHE A 92 -4.160 4.722 7.088 1.00 1.44 C ATOM 1349 CD2 PHE A 92 -2.960 5.691 8.960 1.00 1.31 C ATOM 1350 CE1 PHE A 92 -2.944 4.357 6.498 1.00 1.47 C ATOM 1351 CE2 PHE A 92 -1.744 5.326 8.368 1.00 1.31 C ATOM 1352 CZ PHE A 92 -1.736 4.659 7.137 1.00 0.73 C ATOM 0 H PHE A 92 -7.609 5.949 10.245 1.00 0.64 H new ATOM 0 HA PHE A 92 -6.343 3.799 8.957 1.00 0.65 H new ATOM 0 HB2 PHE A 92 -6.176 6.141 8.198 1.00 0.65 H new ATOM 0 HB3 PHE A 92 -5.328 6.598 9.662 1.00 0.65 H new ATOM 0 HD1 PHE A 92 -5.091 4.489 6.593 1.00 1.44 H new ATOM 0 HD2 PHE A 92 -2.966 6.205 9.910 1.00 1.31 H new ATOM 0 HE1 PHE A 92 -2.938 3.842 5.549 1.00 1.47 H new ATOM 0 HE2 PHE A 92 -0.812 5.559 8.861 1.00 1.31 H new ATOM 0 HZ PHE A 92 -0.798 4.378 6.681 1.00 0.73 H new ATOM 1362 N PHE A 93 -4.815 4.659 11.768 1.00 0.58 N ATOM 1363 CA PHE A 93 -3.799 4.135 12.731 1.00 0.57 C ATOM 1364 C PHE A 93 -4.387 2.965 13.528 1.00 0.59 C ATOM 1365 O PHE A 93 -3.690 2.034 13.879 1.00 0.60 O ATOM 1366 CB PHE A 93 -3.367 5.254 13.682 1.00 0.57 C ATOM 1367 CG PHE A 93 -2.279 4.751 14.602 1.00 0.56 C ATOM 1368 CD1 PHE A 93 -0.977 4.583 14.116 1.00 1.15 C ATOM 1369 CD2 PHE A 93 -2.569 4.456 15.941 1.00 1.47 C ATOM 1370 CE1 PHE A 93 0.034 4.120 14.966 1.00 1.07 C ATOM 1371 CE2 PHE A 93 -1.557 3.994 16.791 1.00 1.58 C ATOM 1372 CZ PHE A 93 -0.256 3.826 16.304 1.00 0.70 C ATOM 0 H PHE A 93 -5.274 5.527 12.044 1.00 0.58 H new ATOM 0 HA PHE A 93 -2.929 3.781 12.178 1.00 0.57 H new ATOM 0 HB2 PHE A 93 -3.007 6.110 13.111 1.00 0.57 H new ATOM 0 HB3 PHE A 93 -4.221 5.597 14.267 1.00 0.57 H new ATOM 0 HD1 PHE A 93 -0.752 4.811 13.084 1.00 1.15 H new ATOM 0 HD2 PHE A 93 -3.573 4.585 16.317 1.00 1.47 H new ATOM 0 HE1 PHE A 93 1.038 3.989 14.590 1.00 1.07 H new ATOM 0 HE2 PHE A 93 -1.781 3.767 17.823 1.00 1.58 H new ATOM 0 HZ PHE A 93 0.524 3.470 16.960 1.00 0.70 H new ATOM 1382 N ARG A 94 -5.661 2.995 13.811 1.00 0.62 N ATOM 1383 CA ARG A 94 -6.275 1.872 14.577 1.00 0.67 C ATOM 1384 C ARG A 94 -6.311 0.623 13.695 1.00 0.66 C ATOM 1385 O ARG A 94 -5.810 -0.418 14.073 1.00 0.67 O ATOM 1386 CB ARG A 94 -7.698 2.252 15.004 1.00 0.72 C ATOM 1387 CG ARG A 94 -8.422 1.047 15.629 1.00 0.89 C ATOM 1388 CD ARG A 94 -7.594 0.460 16.776 1.00 1.00 C ATOM 1389 NE ARG A 94 -7.003 1.565 17.586 1.00 1.95 N ATOM 1390 CZ ARG A 94 -6.523 1.322 18.774 1.00 2.64 C ATOM 1391 NH1 ARG A 94 -6.550 0.110 19.255 1.00 2.76 N ATOM 1392 NH2 ARG A 94 -6.015 2.294 19.481 1.00 3.65 N ATOM 0 H ARG A 94 -6.301 3.744 13.547 1.00 0.62 H new ATOM 0 HA ARG A 94 -5.682 1.670 15.469 1.00 0.67 H new ATOM 0 HB2 ARG A 94 -7.660 3.071 15.722 1.00 0.72 H new ATOM 0 HB3 ARG A 94 -8.258 2.610 14.140 1.00 0.72 H new ATOM 0 HG2 ARG A 94 -9.400 1.355 15.999 1.00 0.89 H new ATOM 0 HG3 ARG A 94 -8.594 0.284 14.869 1.00 0.89 H new ATOM 0 HD2 ARG A 94 -8.222 -0.170 17.406 1.00 1.00 H new ATOM 0 HD3 ARG A 94 -6.803 -0.176 16.378 1.00 1.00 H new ATOM 0 HE ARG A 94 -6.974 2.513 17.210 1.00 1.95 H new ATOM 0 HH11 ARG A 94 -6.947 -0.649 18.702 1.00 2.76 H new ATOM 0 HH12 ARG A 94 -6.174 -0.078 20.184 1.00 2.76 H new ATOM 0 HH21 ARG A 94 -5.994 3.242 19.104 1.00 3.65 H new ATOM 0 HH22 ARG A 94 -5.639 2.106 20.410 1.00 3.65 H new ATOM 1406 N VAL A 95 -6.884 0.700 12.525 1.00 0.65 N ATOM 1407 CA VAL A 95 -6.930 -0.496 11.640 1.00 0.66 C ATOM 1408 C VAL A 95 -5.510 -0.937 11.280 1.00 0.66 C ATOM 1409 O VAL A 95 -5.188 -2.108 11.305 1.00 0.67 O ATOM 1410 CB VAL A 95 -7.679 -0.123 10.356 1.00 0.64 C ATOM 1411 CG1 VAL A 95 -7.758 -1.340 9.433 1.00 1.27 C ATOM 1412 CG2 VAL A 95 -9.095 0.336 10.712 1.00 1.08 C ATOM 0 H VAL A 95 -7.322 1.539 12.145 1.00 0.65 H new ATOM 0 HA VAL A 95 -7.436 -1.312 12.155 1.00 0.66 H new ATOM 0 HB VAL A 95 -7.148 0.682 9.848 1.00 0.64 H new ATOM 0 HG11 VAL A 95 -8.291 -1.071 8.521 1.00 1.27 H new ATOM 0 HG12 VAL A 95 -6.751 -1.671 9.180 1.00 1.27 H new ATOM 0 HG13 VAL A 95 -8.289 -2.147 9.939 1.00 1.27 H new ATOM 0 HG21 VAL A 95 -9.631 0.602 9.801 1.00 1.08 H new ATOM 0 HG22 VAL A 95 -9.622 -0.471 11.220 1.00 1.08 H new ATOM 0 HG23 VAL A 95 -9.042 1.204 11.369 1.00 1.08 H new ATOM 1422 N ALA A 96 -4.664 -0.007 10.923 1.00 0.65 N ATOM 1423 CA ALA A 96 -3.273 -0.373 10.537 1.00 0.68 C ATOM 1424 C ALA A 96 -2.594 -1.113 11.689 1.00 0.70 C ATOM 1425 O ALA A 96 -1.942 -2.124 11.519 1.00 0.76 O ATOM 1426 CB ALA A 96 -2.495 0.910 10.231 1.00 0.69 C ATOM 0 H ALA A 96 -4.878 0.990 10.883 1.00 0.65 H new ATOM 0 HA ALA A 96 -3.293 -1.020 9.660 1.00 0.68 H new ATOM 0 HB1 ALA A 96 -1.474 0.657 9.947 1.00 0.69 H new ATOM 0 HB2 ALA A 96 -2.979 1.442 9.412 1.00 0.69 H new ATOM 0 HB3 ALA A 96 -2.478 1.545 11.117 1.00 0.69 H new ATOM 1432 N ALA A 97 -2.756 -0.577 12.869 1.00 0.74 N ATOM 1433 CA ALA A 97 -2.146 -1.175 14.091 1.00 0.78 C ATOM 1434 C ALA A 97 -2.731 -2.562 14.363 1.00 0.79 C ATOM 1435 O ALA A 97 -2.037 -3.456 14.804 1.00 0.83 O ATOM 1436 CB ALA A 97 -2.446 -0.269 15.287 1.00 0.77 C ATOM 0 H ALA A 97 -3.298 0.270 13.040 1.00 0.74 H new ATOM 0 HA ALA A 97 -1.071 -1.269 13.939 1.00 0.78 H new ATOM 0 HB1 ALA A 97 -2.004 -0.697 16.187 1.00 0.77 H new ATOM 0 HB2 ALA A 97 -2.023 0.720 15.110 1.00 0.77 H new ATOM 0 HB3 ALA A 97 -3.525 -0.184 15.417 1.00 0.77 H new ATOM 1442 N ASP A 98 -3.999 -2.751 14.129 1.00 0.78 N ATOM 1443 CA ASP A 98 -4.606 -4.083 14.409 1.00 0.82 C ATOM 1444 C ASP A 98 -4.083 -5.115 13.408 1.00 0.83 C ATOM 1445 O ASP A 98 -3.650 -6.192 13.766 1.00 0.88 O ATOM 1446 CB ASP A 98 -6.128 -3.978 14.286 1.00 0.82 C ATOM 1447 CG ASP A 98 -6.763 -5.331 14.612 1.00 1.47 C ATOM 1448 OD1 ASP A 98 -6.846 -5.657 15.785 1.00 2.19 O ATOM 1449 OD2 ASP A 98 -7.155 -6.018 13.683 1.00 2.13 O ATOM 0 H ASP A 98 -4.638 -2.047 13.759 1.00 0.78 H new ATOM 0 HA ASP A 98 -4.338 -4.398 15.418 1.00 0.82 H new ATOM 0 HB2 ASP A 98 -6.506 -3.214 14.965 1.00 0.82 H new ATOM 0 HB3 ASP A 98 -6.401 -3.670 13.277 1.00 0.82 H new ATOM 1454 N MET A 99 -4.118 -4.774 12.150 1.00 0.81 N ATOM 1455 CA MET A 99 -3.621 -5.706 11.100 1.00 0.85 C ATOM 1456 C MET A 99 -2.162 -6.042 11.387 1.00 0.97 C ATOM 1457 O MET A 99 -1.678 -7.108 11.062 1.00 1.14 O ATOM 1458 CB MET A 99 -3.728 -5.030 9.727 1.00 0.79 C ATOM 1459 CG MET A 99 -5.205 -4.678 9.415 1.00 0.81 C ATOM 1460 SD MET A 99 -5.646 -5.260 7.756 1.00 0.97 S ATOM 1461 CE MET A 99 -4.802 -3.960 6.823 1.00 0.48 C ATOM 0 H MET A 99 -4.472 -3.883 11.802 1.00 0.81 H new ATOM 0 HA MET A 99 -4.218 -6.618 11.102 1.00 0.85 H new ATOM 0 HB2 MET A 99 -3.120 -4.125 9.711 1.00 0.79 H new ATOM 0 HB3 MET A 99 -3.334 -5.692 8.956 1.00 0.79 H new ATOM 0 HG2 MET A 99 -5.861 -5.136 10.156 1.00 0.81 H new ATOM 0 HG3 MET A 99 -5.352 -3.600 9.482 1.00 0.81 H new ATOM 0 HE1 MET A 99 -5.528 -3.417 6.218 1.00 0.48 H new ATOM 0 HE2 MET A 99 -4.318 -3.271 7.515 1.00 0.48 H new ATOM 0 HE3 MET A 99 -4.051 -4.408 6.173 1.00 0.48 H new ATOM 1600 N ARG A 109 0.478 -8.656 3.339 1.00 0.86 N ATOM 1601 CA ARG A 109 0.575 -7.336 4.024 1.00 0.87 C ATOM 1602 C ARG A 109 0.995 -6.232 3.055 1.00 0.70 C ATOM 1603 O ARG A 109 0.343 -5.215 2.934 1.00 0.81 O ATOM 1604 CB ARG A 109 1.661 -7.458 5.106 1.00 1.08 C ATOM 1605 CG ARG A 109 1.180 -8.398 6.241 1.00 1.48 C ATOM 1606 CD ARG A 109 0.626 -7.574 7.414 1.00 1.96 C ATOM 1607 NE ARG A 109 -0.109 -6.391 6.882 1.00 2.74 N ATOM 1608 CZ ARG A 109 -0.871 -5.684 7.668 1.00 3.19 C ATOM 1609 NH1 ARG A 109 -0.944 -5.973 8.937 1.00 3.19 N ATOM 1610 NH2 ARG A 109 -1.548 -4.678 7.188 1.00 4.08 N ATOM 0 HA ARG A 109 -0.399 -7.078 4.439 1.00 0.87 H new ATOM 0 HB2 ARG A 109 2.580 -7.846 4.667 1.00 1.08 H new ATOM 0 HB3 ARG A 109 1.892 -6.473 5.512 1.00 1.08 H new ATOM 0 HG2 ARG A 109 0.410 -9.071 5.864 1.00 1.48 H new ATOM 0 HG3 ARG A 109 2.007 -9.020 6.583 1.00 1.48 H new ATOM 0 HD2 ARG A 109 -0.040 -8.187 8.022 1.00 1.96 H new ATOM 0 HD3 ARG A 109 1.440 -7.249 8.062 1.00 1.96 H new ATOM 0 HE ARG A 109 -0.015 -6.134 5.899 1.00 2.74 H new ATOM 0 HH11 ARG A 109 -0.405 -6.752 9.314 1.00 3.19 H new ATOM 0 HH12 ARG A 109 -1.540 -5.420 9.553 1.00 3.19 H new ATOM 0 HH21 ARG A 109 -1.481 -4.445 6.197 1.00 4.08 H new ATOM 0 HH22 ARG A 109 -2.144 -4.125 7.803 1.00 4.08 H new ATOM 1624 N VAL A 110 2.097 -6.416 2.388 1.00 0.60 N ATOM 1625 CA VAL A 110 2.589 -5.375 1.446 1.00 0.68 C ATOM 1626 C VAL A 110 1.506 -4.977 0.444 1.00 0.56 C ATOM 1627 O VAL A 110 1.364 -3.811 0.122 1.00 0.60 O ATOM 1628 CB VAL A 110 3.800 -5.911 0.678 1.00 0.88 C ATOM 1629 CG1 VAL A 110 4.456 -4.765 -0.099 1.00 1.27 C ATOM 1630 CG2 VAL A 110 4.813 -6.492 1.666 1.00 1.73 C ATOM 0 H VAL A 110 2.683 -7.248 2.455 1.00 0.60 H new ATOM 0 HA VAL A 110 2.865 -4.497 2.029 1.00 0.68 H new ATOM 0 HB VAL A 110 3.476 -6.688 -0.015 1.00 0.88 H new ATOM 0 HG11 VAL A 110 5.319 -5.144 -0.647 1.00 1.27 H new ATOM 0 HG12 VAL A 110 3.737 -4.343 -0.801 1.00 1.27 H new ATOM 0 HG13 VAL A 110 4.780 -3.992 0.598 1.00 1.27 H new ATOM 0 HG21 VAL A 110 5.676 -6.874 1.120 1.00 1.73 H new ATOM 0 HG22 VAL A 110 5.136 -5.713 2.356 1.00 1.73 H new ATOM 0 HG23 VAL A 110 4.350 -7.304 2.227 1.00 1.73 H new ATOM 1640 N VAL A 111 0.752 -5.922 -0.086 1.00 0.51 N ATOM 1641 CA VAL A 111 -0.285 -5.543 -1.107 1.00 0.50 C ATOM 1642 C VAL A 111 -1.618 -5.222 -0.421 1.00 0.46 C ATOM 1643 O VAL A 111 -2.373 -4.389 -0.880 1.00 0.47 O ATOM 1644 CB VAL A 111 -0.472 -6.686 -2.106 1.00 0.58 C ATOM 1645 CG1 VAL A 111 -1.393 -6.239 -3.240 1.00 1.41 C ATOM 1646 CG2 VAL A 111 0.885 -7.101 -2.677 1.00 1.36 C ATOM 0 H VAL A 111 0.808 -6.915 0.138 1.00 0.51 H new ATOM 0 HA VAL A 111 0.055 -4.655 -1.639 1.00 0.50 H new ATOM 0 HB VAL A 111 -0.922 -7.537 -1.594 1.00 0.58 H new ATOM 0 HG11 VAL A 111 -1.522 -7.058 -3.948 1.00 1.41 H new ATOM 0 HG12 VAL A 111 -2.363 -5.957 -2.831 1.00 1.41 H new ATOM 0 HG13 VAL A 111 -0.952 -5.383 -3.751 1.00 1.41 H new ATOM 0 HG21 VAL A 111 0.747 -7.915 -3.388 1.00 1.36 H new ATOM 0 HG22 VAL A 111 1.342 -6.251 -3.183 1.00 1.36 H new ATOM 0 HG23 VAL A 111 1.534 -7.433 -1.867 1.00 1.36 H new ATOM 1656 N ALA A 112 -1.907 -5.859 0.682 1.00 0.45 N ATOM 1657 CA ALA A 112 -3.187 -5.566 1.392 1.00 0.47 C ATOM 1658 C ALA A 112 -3.159 -4.124 1.911 1.00 0.46 C ATOM 1659 O ALA A 112 -4.178 -3.469 1.996 1.00 0.54 O ATOM 1660 CB ALA A 112 -3.370 -6.538 2.560 1.00 0.53 C ATOM 0 H ALA A 112 -1.316 -6.566 1.121 1.00 0.45 H new ATOM 0 HA ALA A 112 -4.021 -5.687 0.701 1.00 0.47 H new ATOM 0 HB1 ALA A 112 -4.306 -6.318 3.073 1.00 0.53 H new ATOM 0 HB2 ALA A 112 -3.395 -7.560 2.182 1.00 0.53 H new ATOM 0 HB3 ALA A 112 -2.540 -6.429 3.258 1.00 0.53 H new ATOM 1666 N LEU A 113 -2.004 -3.615 2.229 1.00 0.43 N ATOM 1667 CA LEU A 113 -1.918 -2.205 2.708 1.00 0.43 C ATOM 1668 C LEU A 113 -2.055 -1.278 1.499 1.00 0.42 C ATOM 1669 O LEU A 113 -2.874 -0.380 1.471 1.00 0.45 O ATOM 1670 CB LEU A 113 -0.549 -1.983 3.368 1.00 0.44 C ATOM 1671 CG LEU A 113 -0.366 -0.505 3.758 1.00 0.51 C ATOM 1672 CD1 LEU A 113 -1.543 -0.030 4.624 1.00 1.45 C ATOM 1673 CD2 LEU A 113 0.942 -0.363 4.543 1.00 1.27 C ATOM 0 H LEU A 113 -1.115 -4.112 2.179 1.00 0.43 H new ATOM 0 HA LEU A 113 -2.707 -1.999 3.431 1.00 0.43 H new ATOM 0 HB2 LEU A 113 -0.461 -2.612 4.254 1.00 0.44 H new ATOM 0 HB3 LEU A 113 0.244 -2.284 2.683 1.00 0.44 H new ATOM 0 HG LEU A 113 -0.332 0.107 2.856 1.00 0.51 H new ATOM 0 HD11 LEU A 113 -1.399 1.017 4.891 1.00 1.45 H new ATOM 0 HD12 LEU A 113 -2.473 -0.137 4.065 1.00 1.45 H new ATOM 0 HD13 LEU A 113 -1.594 -0.632 5.531 1.00 1.45 H new ATOM 0 HD21 LEU A 113 1.085 0.680 4.826 1.00 1.27 H new ATOM 0 HD22 LEU A 113 0.896 -0.980 5.441 1.00 1.27 H new ATOM 0 HD23 LEU A 113 1.776 -0.688 3.921 1.00 1.27 H new ATOM 1685 N PHE A 114 -1.248 -1.498 0.503 1.00 0.40 N ATOM 1686 CA PHE A 114 -1.292 -0.655 -0.725 1.00 0.40 C ATOM 1687 C PHE A 114 -2.721 -0.584 -1.276 1.00 0.39 C ATOM 1688 O PHE A 114 -3.170 0.445 -1.738 1.00 0.41 O ATOM 1689 CB PHE A 114 -0.369 -1.274 -1.779 1.00 0.41 C ATOM 1690 CG PHE A 114 1.104 -1.196 -1.366 1.00 0.44 C ATOM 1691 CD1 PHE A 114 1.511 -0.781 -0.072 1.00 1.27 C ATOM 1692 CD2 PHE A 114 2.081 -1.558 -2.305 1.00 1.29 C ATOM 1693 CE1 PHE A 114 2.871 -0.737 0.253 1.00 1.27 C ATOM 1694 CE2 PHE A 114 3.440 -1.508 -1.968 1.00 1.38 C ATOM 1695 CZ PHE A 114 3.833 -1.099 -0.691 1.00 0.68 C ATOM 0 H PHE A 114 -0.547 -2.239 0.486 1.00 0.40 H new ATOM 0 HA PHE A 114 -0.964 0.355 -0.481 1.00 0.40 H new ATOM 0 HB2 PHE A 114 -0.647 -2.316 -1.938 1.00 0.41 H new ATOM 0 HB3 PHE A 114 -0.507 -0.759 -2.730 1.00 0.41 H new ATOM 0 HD1 PHE A 114 0.771 -0.499 0.662 1.00 1.27 H new ATOM 0 HD2 PHE A 114 1.784 -1.877 -3.293 1.00 1.29 H new ATOM 0 HE1 PHE A 114 3.178 -0.421 1.239 1.00 1.27 H new ATOM 0 HE2 PHE A 114 4.186 -1.786 -2.697 1.00 1.38 H new ATOM 0 HZ PHE A 114 4.881 -1.063 -0.434 1.00 0.68 H new ATOM 1705 N TYR A 115 -3.427 -1.684 -1.257 1.00 0.40 N ATOM 1706 CA TYR A 115 -4.815 -1.699 -1.807 1.00 0.41 C ATOM 1707 C TYR A 115 -5.793 -0.963 -0.884 1.00 0.41 C ATOM 1708 O TYR A 115 -6.567 -0.138 -1.327 1.00 0.44 O ATOM 1709 CB TYR A 115 -5.276 -3.151 -1.971 1.00 0.44 C ATOM 1710 CG TYR A 115 -6.646 -3.183 -2.609 1.00 0.47 C ATOM 1711 CD1 TYR A 115 -6.774 -3.034 -3.995 1.00 1.24 C ATOM 1712 CD2 TYR A 115 -7.788 -3.363 -1.817 1.00 1.28 C ATOM 1713 CE1 TYR A 115 -8.042 -3.066 -4.589 1.00 1.26 C ATOM 1714 CE2 TYR A 115 -9.056 -3.395 -2.411 1.00 1.32 C ATOM 1715 CZ TYR A 115 -9.182 -3.246 -3.798 1.00 0.61 C ATOM 1716 OH TYR A 115 -10.431 -3.278 -4.384 1.00 0.70 O ATOM 0 H TYR A 115 -3.101 -2.575 -0.883 1.00 0.40 H new ATOM 0 HA TYR A 115 -4.805 -1.189 -2.770 1.00 0.41 H new ATOM 0 HB2 TYR A 115 -4.565 -3.701 -2.587 1.00 0.44 H new ATOM 0 HB3 TYR A 115 -5.305 -3.645 -1.000 1.00 0.44 H new ATOM 0 HD1 TYR A 115 -5.895 -2.894 -4.606 1.00 1.24 H new ATOM 0 HD2 TYR A 115 -7.690 -3.477 -0.748 1.00 1.28 H new ATOM 0 HE1 TYR A 115 -8.140 -2.952 -5.658 1.00 1.26 H new ATOM 0 HE2 TYR A 115 -9.936 -3.534 -1.800 1.00 1.32 H new ATOM 0 HH TYR A 115 -11.081 -3.644 -3.749 1.00 0.70 H new ATOM 1726 N PHE A 116 -5.786 -1.257 0.387 1.00 0.38 N ATOM 1727 CA PHE A 116 -6.742 -0.570 1.304 1.00 0.38 C ATOM 1728 C PHE A 116 -6.592 0.951 1.171 1.00 0.36 C ATOM 1729 O PHE A 116 -7.563 1.678 1.073 1.00 0.35 O ATOM 1730 CB PHE A 116 -6.450 -0.986 2.755 1.00 0.40 C ATOM 1731 CG PHE A 116 -7.255 -0.126 3.714 1.00 0.37 C ATOM 1732 CD1 PHE A 116 -8.649 -0.265 3.786 1.00 1.35 C ATOM 1733 CD2 PHE A 116 -6.606 0.813 4.529 1.00 1.17 C ATOM 1734 CE1 PHE A 116 -9.388 0.530 4.669 1.00 1.37 C ATOM 1735 CE2 PHE A 116 -7.348 1.608 5.411 1.00 1.18 C ATOM 1736 CZ PHE A 116 -8.739 1.466 5.481 1.00 0.45 C ATOM 0 H PHE A 116 -5.166 -1.936 0.828 1.00 0.38 H new ATOM 0 HA PHE A 116 -7.760 -0.856 1.038 1.00 0.38 H new ATOM 0 HB2 PHE A 116 -6.701 -2.037 2.898 1.00 0.40 H new ATOM 0 HB3 PHE A 116 -5.386 -0.881 2.965 1.00 0.40 H new ATOM 0 HD1 PHE A 116 -9.152 -0.986 3.159 1.00 1.35 H new ATOM 0 HD2 PHE A 116 -5.533 0.923 4.476 1.00 1.17 H new ATOM 0 HE1 PHE A 116 -10.461 0.421 4.724 1.00 1.37 H new ATOM 0 HE2 PHE A 116 -6.847 2.331 6.038 1.00 1.18 H new ATOM 0 HZ PHE A 116 -9.311 2.079 6.162 1.00 0.45 H new ATOM 1746 N ALA A 117 -5.380 1.435 1.167 1.00 0.35 N ATOM 1747 CA ALA A 117 -5.163 2.903 1.045 1.00 0.34 C ATOM 1748 C ALA A 117 -5.604 3.380 -0.341 1.00 0.34 C ATOM 1749 O ALA A 117 -6.111 4.472 -0.499 1.00 0.34 O ATOM 1750 CB ALA A 117 -3.679 3.216 1.242 1.00 0.37 C ATOM 0 H ALA A 117 -4.530 0.876 1.243 1.00 0.35 H new ATOM 0 HA ALA A 117 -5.750 3.417 1.806 1.00 0.34 H new ATOM 0 HB1 ALA A 117 -3.519 4.290 1.153 1.00 0.37 H new ATOM 0 HB2 ALA A 117 -3.365 2.883 2.231 1.00 0.37 H new ATOM 0 HB3 ALA A 117 -3.094 2.698 0.482 1.00 0.37 H new ATOM 1756 N SER A 118 -5.409 2.573 -1.347 1.00 0.35 N ATOM 1757 CA SER A 118 -5.806 2.983 -2.723 1.00 0.37 C ATOM 1758 C SER A 118 -7.270 3.431 -2.751 1.00 0.36 C ATOM 1759 O SER A 118 -7.624 4.389 -3.406 1.00 0.36 O ATOM 1760 CB SER A 118 -5.625 1.800 -3.676 1.00 0.42 C ATOM 1761 OG SER A 118 -6.707 0.893 -3.506 1.00 1.25 O ATOM 0 H SER A 118 -4.991 1.645 -1.275 1.00 0.35 H new ATOM 0 HA SER A 118 -5.176 3.816 -3.034 1.00 0.37 H new ATOM 0 HB2 SER A 118 -5.587 2.151 -4.707 1.00 0.42 H new ATOM 0 HB3 SER A 118 -4.679 1.298 -3.476 1.00 0.42 H new ATOM 0 HG SER A 118 -6.742 0.596 -2.573 1.00 1.25 H new ATOM 1767 N LYS A 119 -8.122 2.751 -2.030 1.00 0.37 N ATOM 1768 CA LYS A 119 -9.562 3.143 -2.005 1.00 0.39 C ATOM 1769 C LYS A 119 -9.719 4.446 -1.216 1.00 0.36 C ATOM 1770 O LYS A 119 -10.516 5.297 -1.557 1.00 0.38 O ATOM 1771 CB LYS A 119 -10.380 2.035 -1.329 1.00 0.46 C ATOM 1772 CG LYS A 119 -10.354 0.755 -2.187 1.00 1.29 C ATOM 1773 CD LYS A 119 -11.462 0.804 -3.246 1.00 1.84 C ATOM 1774 CE LYS A 119 -11.438 -0.484 -4.069 1.00 2.48 C ATOM 1775 NZ LYS A 119 -12.485 -0.416 -5.128 1.00 3.36 N ATOM 0 H LYS A 119 -7.883 1.941 -1.457 1.00 0.37 H new ATOM 0 HA LYS A 119 -9.919 3.288 -3.024 1.00 0.39 H new ATOM 0 HB2 LYS A 119 -9.975 1.826 -0.339 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -11.409 2.367 -1.189 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -9.383 0.653 -2.671 1.00 1.29 H new ATOM 0 HG3 LYS A 119 -10.487 -0.120 -1.551 1.00 1.29 H new ATOM 0 HD2 LYS A 119 -12.433 0.923 -2.766 1.00 1.84 H new ATOM 0 HD3 LYS A 119 -11.320 1.667 -3.897 1.00 1.84 H new ATOM 0 HE2 LYS A 119 -10.456 -0.621 -4.522 1.00 2.48 H new ATOM 0 HE3 LYS A 119 -11.614 -1.344 -3.423 1.00 2.48 H new ATOM 0 HZ1 LYS A 119 -12.301 -1.146 -5.846 1.00 3.36 H new ATOM 0 HZ2 LYS A 119 -13.420 -0.577 -4.702 1.00 3.36 H new ATOM 0 HZ3 LYS A 119 -12.465 0.522 -5.576 1.00 3.36 H new ATOM 1789 N LEU A 120 -8.959 4.612 -0.172 1.00 0.36 N ATOM 1790 CA LEU A 120 -9.052 5.864 0.635 1.00 0.35 C ATOM 1791 C LEU A 120 -8.774 7.083 -0.260 1.00 0.33 C ATOM 1792 O LEU A 120 -9.539 8.027 -0.296 1.00 0.39 O ATOM 1793 CB LEU A 120 -8.008 5.788 1.779 1.00 0.36 C ATOM 1794 CG LEU A 120 -8.629 6.188 3.141 1.00 0.68 C ATOM 1795 CD1 LEU A 120 -9.362 7.541 3.032 1.00 1.69 C ATOM 1796 CD2 LEU A 120 -9.605 5.096 3.623 1.00 1.28 C ATOM 0 H LEU A 120 -8.274 3.933 0.161 1.00 0.36 H new ATOM 0 HA LEU A 120 -10.052 5.968 1.055 1.00 0.35 H new ATOM 0 HB2 LEU A 120 -7.610 4.775 1.843 1.00 0.36 H new ATOM 0 HB3 LEU A 120 -7.170 6.447 1.552 1.00 0.36 H new ATOM 0 HG LEU A 120 -7.823 6.290 3.867 1.00 0.68 H new ATOM 0 HD11 LEU A 120 -9.790 7.802 4.000 1.00 1.69 H new ATOM 0 HD12 LEU A 120 -8.656 8.314 2.727 1.00 1.69 H new ATOM 0 HD13 LEU A 120 -10.158 7.465 2.292 1.00 1.69 H new ATOM 0 HD21 LEU A 120 -10.035 5.389 4.581 1.00 1.28 H new ATOM 0 HD22 LEU A 120 -10.403 4.972 2.890 1.00 1.28 H new ATOM 0 HD23 LEU A 120 -9.069 4.154 3.739 1.00 1.28 H new ATOM 1808 N VAL A 121 -7.694 7.055 -0.991 1.00 0.33 N ATOM 1809 CA VAL A 121 -7.362 8.190 -1.901 1.00 0.39 C ATOM 1810 C VAL A 121 -8.274 8.139 -3.137 1.00 0.36 C ATOM 1811 O VAL A 121 -8.963 9.097 -3.424 1.00 0.39 O ATOM 1812 CB VAL A 121 -5.856 8.177 -2.267 1.00 0.54 C ATOM 1813 CG1 VAL A 121 -5.280 6.778 -2.037 1.00 0.95 C ATOM 1814 CG2 VAL A 121 -5.633 8.581 -3.733 1.00 1.18 C ATOM 0 H VAL A 121 -7.021 6.288 -0.998 1.00 0.33 H new ATOM 0 HA VAL A 121 -7.546 9.137 -1.393 1.00 0.39 H new ATOM 0 HB VAL A 121 -5.349 8.901 -1.628 1.00 0.54 H new ATOM 0 HG11 VAL A 121 -4.221 6.773 -2.296 1.00 0.95 H new ATOM 0 HG12 VAL A 121 -5.399 6.503 -0.989 1.00 0.95 H new ATOM 0 HG13 VAL A 121 -5.809 6.059 -2.663 1.00 0.95 H new ATOM 0 HG21 VAL A 121 -4.567 8.562 -3.957 1.00 1.18 H new ATOM 0 HG22 VAL A 121 -6.154 7.881 -4.387 1.00 1.18 H new ATOM 0 HG23 VAL A 121 -6.020 9.587 -3.896 1.00 1.18 H new ATOM 1824 N LEU A 122 -8.303 7.061 -3.876 1.00 0.37 N ATOM 1825 CA LEU A 122 -9.200 7.017 -5.072 1.00 0.39 C ATOM 1826 C LEU A 122 -10.602 7.513 -4.688 1.00 0.40 C ATOM 1827 O LEU A 122 -11.333 8.046 -5.507 1.00 0.40 O ATOM 1828 CB LEU A 122 -9.288 5.571 -5.586 1.00 0.42 C ATOM 1829 CG LEU A 122 -9.798 5.550 -7.042 1.00 0.72 C ATOM 1830 CD1 LEU A 122 -8.619 5.688 -8.012 1.00 1.15 C ATOM 1831 CD2 LEU A 122 -10.517 4.223 -7.319 1.00 1.24 C ATOM 0 H LEU A 122 -7.753 6.219 -3.708 1.00 0.37 H new ATOM 0 HA LEU A 122 -8.795 7.660 -5.854 1.00 0.39 H new ATOM 0 HB2 LEU A 122 -8.308 5.098 -5.530 1.00 0.42 H new ATOM 0 HB3 LEU A 122 -9.958 4.992 -4.950 1.00 0.42 H new ATOM 0 HG LEU A 122 -10.488 6.382 -7.185 1.00 0.72 H new ATOM 0 HD11 LEU A 122 -8.988 5.672 -9.038 1.00 1.15 H new ATOM 0 HD12 LEU A 122 -8.103 6.630 -7.826 1.00 1.15 H new ATOM 0 HD13 LEU A 122 -7.926 4.860 -7.863 1.00 1.15 H new ATOM 0 HD21 LEU A 122 -10.876 4.212 -8.348 1.00 1.24 H new ATOM 0 HD22 LEU A 122 -9.824 3.395 -7.167 1.00 1.24 H new ATOM 0 HD23 LEU A 122 -11.362 4.118 -6.639 1.00 1.24 H new ATOM 1843 N LYS A 123 -10.964 7.395 -3.443 1.00 0.51 N ATOM 1844 CA LYS A 123 -12.292 7.900 -3.005 1.00 0.55 C ATOM 1845 C LYS A 123 -12.201 9.413 -2.809 1.00 0.54 C ATOM 1846 O LYS A 123 -13.164 10.120 -3.004 1.00 0.55 O ATOM 1847 CB LYS A 123 -12.706 7.225 -1.689 1.00 0.59 C ATOM 1848 CG LYS A 123 -13.212 5.793 -1.965 1.00 0.97 C ATOM 1849 CD LYS A 123 -14.716 5.807 -2.312 1.00 1.37 C ATOM 1850 CE LYS A 123 -15.555 5.735 -1.030 1.00 1.74 C ATOM 1851 NZ LYS A 123 -16.990 5.966 -1.360 1.00 2.32 N ATOM 0 H LYS A 123 -10.397 6.970 -2.709 1.00 0.51 H new ATOM 0 HA LYS A 123 -13.041 7.669 -3.762 1.00 0.55 H new ATOM 0 HB2 LYS A 123 -11.858 7.194 -1.004 1.00 0.59 H new ATOM 0 HB3 LYS A 123 -13.488 7.808 -1.202 1.00 0.59 H new ATOM 0 HG2 LYS A 123 -12.647 5.354 -2.788 1.00 0.97 H new ATOM 0 HG3 LYS A 123 -13.041 5.166 -1.090 1.00 0.97 H new ATOM 0 HD2 LYS A 123 -14.961 6.714 -2.865 1.00 1.37 H new ATOM 0 HD3 LYS A 123 -14.955 4.964 -2.960 1.00 1.37 H new ATOM 0 HE2 LYS A 123 -15.432 4.761 -0.557 1.00 1.74 H new ATOM 0 HE3 LYS A 123 -15.211 6.482 -0.315 1.00 1.74 H new ATOM 0 HZ1 LYS A 123 -17.558 5.917 -0.490 1.00 2.32 H new ATOM 0 HZ2 LYS A 123 -17.100 6.905 -1.793 1.00 2.32 H new ATOM 0 HZ3 LYS A 123 -17.314 5.237 -2.027 1.00 2.32 H new ATOM 1865 N ALA A 124 -11.057 9.923 -2.434 1.00 0.52 N ATOM 1866 CA ALA A 124 -10.946 11.398 -2.239 1.00 0.52 C ATOM 1867 C ALA A 124 -11.003 12.092 -3.599 1.00 0.51 C ATOM 1868 O ALA A 124 -11.453 13.213 -3.724 1.00 0.54 O ATOM 1869 CB ALA A 124 -9.643 11.741 -1.525 1.00 0.51 C ATOM 0 H ALA A 124 -10.206 9.390 -2.256 1.00 0.52 H new ATOM 0 HA ALA A 124 -11.775 11.744 -1.622 1.00 0.52 H new ATOM 0 HB1 ALA A 124 -9.576 12.820 -1.390 1.00 0.51 H new ATOM 0 HB2 ALA A 124 -9.622 11.251 -0.552 1.00 0.51 H new ATOM 0 HB3 ALA A 124 -8.799 11.397 -2.123 1.00 0.51 H new ATOM 1875 N LEU A 125 -10.571 11.412 -4.625 1.00 0.47 N ATOM 1876 CA LEU A 125 -10.620 11.992 -5.987 1.00 0.47 C ATOM 1877 C LEU A 125 -12.087 12.207 -6.361 1.00 0.48 C ATOM 1878 O LEU A 125 -12.470 13.251 -6.851 1.00 0.48 O ATOM 1879 CB LEU A 125 -9.968 11.000 -6.962 1.00 0.51 C ATOM 1880 CG LEU A 125 -10.221 11.424 -8.413 1.00 0.49 C ATOM 1881 CD1 LEU A 125 -9.765 12.873 -8.629 1.00 1.10 C ATOM 1882 CD2 LEU A 125 -9.439 10.498 -9.350 1.00 1.21 C ATOM 0 H LEU A 125 -10.183 10.470 -4.572 1.00 0.47 H new ATOM 0 HA LEU A 125 -10.088 12.942 -6.030 1.00 0.47 H new ATOM 0 HB2 LEU A 125 -8.896 10.949 -6.774 1.00 0.51 H new ATOM 0 HB3 LEU A 125 -10.369 10.000 -6.794 1.00 0.51 H new ATOM 0 HG LEU A 125 -11.288 11.355 -8.626 1.00 0.49 H new ATOM 0 HD11 LEU A 125 -9.950 13.162 -9.664 1.00 1.10 H new ATOM 0 HD12 LEU A 125 -10.321 13.533 -7.963 1.00 1.10 H new ATOM 0 HD13 LEU A 125 -8.699 12.955 -8.414 1.00 1.10 H new ATOM 0 HD21 LEU A 125 -9.615 10.794 -10.384 1.00 1.21 H new ATOM 0 HD22 LEU A 125 -8.374 10.570 -9.128 1.00 1.21 H new ATOM 0 HD23 LEU A 125 -9.771 9.470 -9.206 1.00 1.21 H new ATOM 1894 N CYS A 126 -12.907 11.214 -6.146 1.00 0.52 N ATOM 1895 CA CYS A 126 -14.354 11.340 -6.502 1.00 0.57 C ATOM 1896 C CYS A 126 -15.030 12.403 -5.623 1.00 0.57 C ATOM 1897 O CYS A 126 -15.882 13.157 -6.047 1.00 0.68 O ATOM 1898 CB CYS A 126 -15.031 9.991 -6.248 1.00 0.66 C ATOM 1899 SG CYS A 126 -14.296 8.737 -7.327 1.00 1.67 S ATOM 0 H CYS A 126 -12.639 10.318 -5.738 1.00 0.52 H new ATOM 0 HA CYS A 126 -14.445 11.633 -7.548 1.00 0.57 H new ATOM 0 HB2 CYS A 126 -14.912 9.703 -5.204 1.00 0.66 H new ATOM 0 HB3 CYS A 126 -16.102 10.067 -6.438 1.00 0.66 H new ATOM 0 HG CYS A 126 -13.186 8.310 -6.803 1.00 1.67 H new ATOM 1905 N THR A 127 -14.645 12.411 -4.379 1.00 0.57 N ATOM 1906 CA THR A 127 -15.220 13.355 -3.366 1.00 0.60 C ATOM 1907 C THR A 127 -14.877 14.793 -3.756 1.00 0.62 C ATOM 1908 O THR A 127 -15.422 15.724 -3.208 1.00 0.70 O ATOM 1909 CB THR A 127 -14.704 12.895 -1.972 1.00 0.60 C ATOM 1910 OG1 THR A 127 -15.799 12.772 -1.076 1.00 1.14 O ATOM 1911 CG2 THR A 127 -13.640 13.815 -1.380 1.00 1.19 C ATOM 0 H THR A 127 -13.933 11.784 -4.005 1.00 0.57 H new ATOM 0 HA THR A 127 -16.309 13.337 -3.326 1.00 0.60 H new ATOM 0 HB THR A 127 -14.221 11.929 -2.118 1.00 0.60 H new ATOM 0 HG1 THR A 127 -15.473 12.481 -0.199 1.00 1.14 H new ATOM 0 HG21 THR A 127 -13.328 13.432 -0.408 1.00 1.19 H new ATOM 0 HG22 THR A 127 -12.780 13.854 -2.048 1.00 1.19 H new ATOM 0 HG23 THR A 127 -14.052 14.817 -1.260 1.00 1.19 H new ATOM 1919 N LYS A 128 -13.997 14.967 -4.729 1.00 0.60 N ATOM 1920 CA LYS A 128 -13.648 16.347 -5.205 1.00 0.70 C ATOM 1921 C LYS A 128 -12.732 17.057 -4.219 1.00 0.61 C ATOM 1922 O LYS A 128 -12.826 18.258 -4.058 1.00 0.60 O ATOM 1923 CB LYS A 128 -14.922 17.203 -5.400 1.00 0.87 C ATOM 1924 CG LYS A 128 -15.992 16.427 -6.191 1.00 1.12 C ATOM 1925 CD LYS A 128 -15.396 15.889 -7.495 1.00 1.43 C ATOM 1926 CE LYS A 128 -16.527 15.401 -8.405 1.00 1.83 C ATOM 1927 NZ LYS A 128 -15.951 14.775 -9.630 1.00 2.47 N ATOM 0 H LYS A 128 -13.510 14.211 -5.209 1.00 0.60 H new ATOM 0 HA LYS A 128 -13.132 16.233 -6.158 1.00 0.70 H new ATOM 0 HB2 LYS A 128 -15.322 17.493 -4.428 1.00 0.87 H new ATOM 0 HB3 LYS A 128 -14.670 18.122 -5.928 1.00 0.87 H new ATOM 0 HG2 LYS A 128 -16.373 15.602 -5.589 1.00 1.12 H new ATOM 0 HG3 LYS A 128 -16.837 17.079 -6.410 1.00 1.12 H new ATOM 0 HD2 LYS A 128 -14.822 16.669 -7.995 1.00 1.43 H new ATOM 0 HD3 LYS A 128 -14.706 15.072 -7.283 1.00 1.43 H new ATOM 0 HE2 LYS A 128 -17.149 14.680 -7.874 1.00 1.83 H new ATOM 0 HE3 LYS A 128 -17.172 16.236 -8.680 1.00 1.83 H new ATOM 0 HZ1 LYS A 128 -16.721 14.445 -10.246 1.00 2.47 H new ATOM 0 HZ2 LYS A 128 -15.376 15.475 -10.140 1.00 2.47 H new ATOM 0 HZ3 LYS A 128 -15.354 13.968 -9.359 1.00 2.47 H new ATOM 1941 N VAL A 129 -11.838 16.355 -3.557 1.00 0.60 N ATOM 1942 CA VAL A 129 -10.914 17.037 -2.591 1.00 0.53 C ATOM 1943 C VAL A 129 -9.483 16.534 -2.848 1.00 0.53 C ATOM 1944 O VAL A 129 -8.992 15.703 -2.109 1.00 0.56 O ATOM 1945 CB VAL A 129 -11.330 16.684 -1.166 1.00 0.57 C ATOM 1946 CG1 VAL A 129 -10.516 17.508 -0.172 1.00 1.40 C ATOM 1947 CG2 VAL A 129 -12.820 16.973 -0.983 1.00 1.22 C ATOM 0 H VAL A 129 -11.709 15.347 -3.643 1.00 0.60 H new ATOM 0 HA VAL A 129 -10.959 18.118 -2.722 1.00 0.53 H new ATOM 0 HB VAL A 129 -11.144 15.625 -0.986 1.00 0.57 H new ATOM 0 HG11 VAL A 129 -10.816 17.253 0.844 1.00 1.40 H new ATOM 0 HG12 VAL A 129 -9.456 17.292 -0.302 1.00 1.40 H new ATOM 0 HG13 VAL A 129 -10.694 18.569 -0.347 1.00 1.40 H new ATOM 0 HG21 VAL A 129 -13.117 16.721 0.035 1.00 1.22 H new ATOM 0 HG22 VAL A 129 -13.011 18.031 -1.165 1.00 1.22 H new ATOM 0 HG23 VAL A 129 -13.396 16.374 -1.688 1.00 1.22 H new ATOM 1957 N PRO A 130 -8.855 17.022 -3.901 1.00 0.62 N ATOM 1958 CA PRO A 130 -7.494 16.582 -4.254 1.00 0.73 C ATOM 1959 C PRO A 130 -6.489 16.931 -3.143 1.00 0.65 C ATOM 1960 O PRO A 130 -5.460 16.286 -3.012 1.00 0.64 O ATOM 1961 CB PRO A 130 -7.157 17.324 -5.570 1.00 1.00 C ATOM 1962 CG PRO A 130 -8.381 18.213 -5.932 1.00 1.00 C ATOM 1963 CD PRO A 130 -9.435 18.032 -4.817 1.00 0.75 C ATOM 0 HA PRO A 130 -7.437 15.500 -4.374 1.00 0.73 H new ATOM 0 HB2 PRO A 130 -6.262 17.935 -5.448 1.00 1.00 H new ATOM 0 HB3 PRO A 130 -6.950 16.612 -6.369 1.00 1.00 H new ATOM 0 HG2 PRO A 130 -8.084 19.259 -6.013 1.00 1.00 H new ATOM 0 HG3 PRO A 130 -8.792 17.923 -6.899 1.00 1.00 H new ATOM 0 HD2 PRO A 130 -9.626 18.971 -4.298 1.00 0.75 H new ATOM 0 HD3 PRO A 130 -10.387 17.694 -5.225 1.00 0.75 H new ATOM 1971 N GLU A 131 -6.737 17.951 -2.354 1.00 0.73 N ATOM 1972 CA GLU A 131 -5.724 18.291 -1.310 1.00 0.82 C ATOM 1973 C GLU A 131 -5.676 17.141 -0.301 1.00 0.72 C ATOM 1974 O GLU A 131 -4.704 16.953 0.406 1.00 0.73 O ATOM 1975 CB GLU A 131 -6.079 19.607 -0.612 1.00 1.09 C ATOM 1976 CG GLU A 131 -6.130 20.748 -1.628 1.00 1.55 C ATOM 1977 CD GLU A 131 -6.534 22.041 -0.914 1.00 2.17 C ATOM 1978 OE1 GLU A 131 -5.692 22.609 -0.239 1.00 2.86 O ATOM 1979 OE2 GLU A 131 -7.679 22.438 -1.053 1.00 2.52 O ATOM 0 H GLU A 131 -7.567 18.543 -2.385 1.00 0.73 H new ATOM 0 HA GLU A 131 -4.746 18.424 -1.773 1.00 0.82 H new ATOM 0 HB2 GLU A 131 -7.043 19.513 -0.112 1.00 1.09 H new ATOM 0 HB3 GLU A 131 -5.340 19.829 0.158 1.00 1.09 H new ATOM 0 HG2 GLU A 131 -5.157 20.870 -2.104 1.00 1.55 H new ATOM 0 HG3 GLU A 131 -6.845 20.516 -2.418 1.00 1.55 H new ATOM 1986 N LEU A 132 -6.716 16.354 -0.258 1.00 0.71 N ATOM 1987 CA LEU A 132 -6.755 15.192 0.664 1.00 0.69 C ATOM 1988 C LEU A 132 -6.057 13.997 -0.002 1.00 0.58 C ATOM 1989 O LEU A 132 -5.513 13.143 0.669 1.00 0.59 O ATOM 1990 CB LEU A 132 -8.209 14.854 1.016 1.00 0.80 C ATOM 1991 CG LEU A 132 -8.264 13.819 2.153 1.00 0.60 C ATOM 1992 CD1 LEU A 132 -8.039 14.497 3.514 1.00 1.11 C ATOM 1993 CD2 LEU A 132 -9.641 13.144 2.161 1.00 0.77 C ATOM 0 H LEU A 132 -7.551 16.472 -0.832 1.00 0.71 H new ATOM 0 HA LEU A 132 -6.231 15.433 1.589 1.00 0.69 H new ATOM 0 HB2 LEU A 132 -8.736 15.760 1.316 1.00 0.80 H new ATOM 0 HB3 LEU A 132 -8.721 14.463 0.136 1.00 0.80 H new ATOM 0 HG LEU A 132 -7.480 13.081 1.987 1.00 0.60 H new ATOM 0 HD11 LEU A 132 -8.082 13.748 4.305 1.00 1.11 H new ATOM 0 HD12 LEU A 132 -7.062 14.979 3.523 1.00 1.11 H new ATOM 0 HD13 LEU A 132 -8.814 15.245 3.680 1.00 1.11 H new ATOM 0 HD21 LEU A 132 -9.682 12.410 2.966 1.00 0.77 H new ATOM 0 HD22 LEU A 132 -10.414 13.896 2.316 1.00 0.77 H new ATOM 0 HD23 LEU A 132 -9.807 12.645 1.206 1.00 0.77 H new ATOM 2005 N ILE A 133 -6.031 13.937 -1.304 1.00 0.52 N ATOM 2006 CA ILE A 133 -5.322 12.809 -1.979 1.00 0.46 C ATOM 2007 C ILE A 133 -3.875 12.777 -1.474 1.00 0.43 C ATOM 2008 O ILE A 133 -3.373 11.760 -1.039 1.00 0.46 O ATOM 2009 CB ILE A 133 -5.329 13.048 -3.497 1.00 0.45 C ATOM 2010 CG1 ILE A 133 -6.749 12.803 -4.032 1.00 0.42 C ATOM 2011 CG2 ILE A 133 -4.349 12.085 -4.183 1.00 0.49 C ATOM 2012 CD1 ILE A 133 -6.845 13.195 -5.515 1.00 1.19 C ATOM 0 H ILE A 133 -6.467 14.615 -1.929 1.00 0.52 H new ATOM 0 HA ILE A 133 -5.816 11.863 -1.759 1.00 0.46 H new ATOM 0 HB ILE A 133 -5.023 14.073 -3.707 1.00 0.45 H new ATOM 0 HG12 ILE A 133 -7.013 11.752 -3.910 1.00 0.42 H new ATOM 0 HG13 ILE A 133 -7.467 13.381 -3.450 1.00 0.42 H new ATOM 0 HG21 ILE A 133 -4.360 12.260 -5.259 1.00 0.49 H new ATOM 0 HG22 ILE A 133 -3.343 12.254 -3.798 1.00 0.49 H new ATOM 0 HG23 ILE A 133 -4.648 11.056 -3.980 1.00 0.49 H new ATOM 0 HD11 ILE A 133 -7.858 13.014 -5.874 1.00 1.19 H new ATOM 0 HD12 ILE A 133 -6.603 14.252 -5.628 1.00 1.19 H new ATOM 0 HD13 ILE A 133 -6.142 12.598 -6.095 1.00 1.19 H new ATOM 2024 N ARG A 134 -3.217 13.904 -1.515 1.00 0.42 N ATOM 2025 CA ARG A 134 -1.807 13.991 -1.024 1.00 0.43 C ATOM 2026 C ARG A 134 -1.756 13.756 0.492 1.00 0.40 C ATOM 2027 O ARG A 134 -0.863 13.098 0.988 1.00 0.39 O ATOM 2028 CB ARG A 134 -1.250 15.384 -1.334 1.00 0.51 C ATOM 2029 CG ARG A 134 -1.309 15.637 -2.843 1.00 1.26 C ATOM 2030 CD ARG A 134 -0.891 17.080 -3.137 1.00 1.57 C ATOM 2031 NE ARG A 134 0.495 17.308 -2.638 1.00 2.30 N ATOM 2032 CZ ARG A 134 1.165 18.358 -3.029 1.00 2.86 C ATOM 2033 NH1 ARG A 134 0.623 19.210 -3.857 1.00 2.98 N ATOM 2034 NH2 ARG A 134 2.379 18.557 -2.591 1.00 3.71 N ATOM 0 H ARG A 134 -3.599 14.780 -1.872 1.00 0.42 H new ATOM 0 HA ARG A 134 -1.210 13.228 -1.524 1.00 0.43 H new ATOM 0 HB2 ARG A 134 -1.826 16.143 -0.805 1.00 0.51 H new ATOM 0 HB3 ARG A 134 -0.221 15.462 -0.982 1.00 0.51 H new ATOM 0 HG2 ARG A 134 -0.650 14.943 -3.365 1.00 1.26 H new ATOM 0 HG3 ARG A 134 -2.318 15.457 -3.213 1.00 1.26 H new ATOM 0 HD2 ARG A 134 -0.939 17.273 -4.209 1.00 1.57 H new ATOM 0 HD3 ARG A 134 -1.580 17.774 -2.657 1.00 1.57 H new ATOM 0 HE ARG A 134 0.920 16.644 -1.991 1.00 2.30 H new ATOM 0 HH11 ARG A 134 -0.325 19.056 -4.199 1.00 2.98 H new ATOM 0 HH12 ARG A 134 1.148 20.030 -4.161 1.00 2.98 H new ATOM 0 HH21 ARG A 134 2.803 17.892 -1.944 1.00 3.71 H new ATOM 0 HH22 ARG A 134 2.903 19.377 -2.896 1.00 3.71 H new ATOM 2048 N THR A 135 -2.684 14.288 1.238 1.00 0.41 N ATOM 2049 CA THR A 135 -2.637 14.079 2.716 1.00 0.41 C ATOM 2050 C THR A 135 -2.704 12.585 3.042 1.00 0.39 C ATOM 2051 O THR A 135 -2.187 12.127 4.041 1.00 0.52 O ATOM 2052 CB THR A 135 -3.798 14.807 3.392 1.00 0.42 C ATOM 2053 OG1 THR A 135 -3.670 16.203 3.156 1.00 0.89 O ATOM 2054 CG2 THR A 135 -3.763 14.545 4.898 1.00 0.88 C ATOM 0 H THR A 135 -3.463 14.851 0.897 1.00 0.41 H new ATOM 0 HA THR A 135 -1.697 14.484 3.092 1.00 0.41 H new ATOM 0 HB THR A 135 -4.742 14.445 2.985 1.00 0.42 H new ATOM 0 HG1 THR A 135 -4.009 16.416 2.262 1.00 0.89 H new ATOM 0 HG21 THR A 135 -4.592 15.066 5.377 1.00 0.88 H new ATOM 0 HG22 THR A 135 -3.851 13.474 5.083 1.00 0.88 H new ATOM 0 HG23 THR A 135 -2.821 14.908 5.309 1.00 0.88 H new ATOM 2062 N ILE A 136 -3.325 11.820 2.183 1.00 0.35 N ATOM 2063 CA ILE A 136 -3.425 10.349 2.399 1.00 0.36 C ATOM 2064 C ILE A 136 -2.095 9.699 2.012 1.00 0.35 C ATOM 2065 O ILE A 136 -1.484 9.016 2.811 1.00 0.51 O ATOM 2066 CB ILE A 136 -4.575 9.802 1.542 1.00 0.46 C ATOM 2067 CG1 ILE A 136 -5.905 10.285 2.137 1.00 0.60 C ATOM 2068 CG2 ILE A 136 -4.549 8.270 1.535 1.00 0.94 C ATOM 2069 CD1 ILE A 136 -7.033 10.110 1.117 1.00 0.64 C ATOM 0 H ILE A 136 -3.772 12.158 1.331 1.00 0.35 H new ATOM 0 HA ILE A 136 -3.630 10.124 3.446 1.00 0.36 H new ATOM 0 HB ILE A 136 -4.466 10.160 0.518 1.00 0.46 H new ATOM 0 HG12 ILE A 136 -6.133 9.722 3.042 1.00 0.60 H new ATOM 0 HG13 ILE A 136 -5.824 11.333 2.425 1.00 0.60 H new ATOM 0 HG21 ILE A 136 -5.370 7.895 0.924 1.00 0.94 H new ATOM 0 HG22 ILE A 136 -3.601 7.924 1.122 1.00 0.94 H new ATOM 0 HG23 ILE A 136 -4.657 7.900 2.554 1.00 0.94 H new ATOM 0 HD11 ILE A 136 -7.972 10.456 1.550 1.00 0.64 H new ATOM 0 HD12 ILE A 136 -6.809 10.693 0.223 1.00 0.64 H new ATOM 0 HD13 ILE A 136 -7.122 9.057 0.851 1.00 0.64 H new ATOM 2081 N MET A 137 -1.630 9.887 0.807 1.00 0.35 N ATOM 2082 CA MET A 137 -0.331 9.262 0.416 1.00 0.33 C ATOM 2083 C MET A 137 0.715 9.586 1.488 1.00 0.31 C ATOM 2084 O MET A 137 1.658 8.856 1.715 1.00 0.34 O ATOM 2085 CB MET A 137 0.108 9.826 -0.943 1.00 0.36 C ATOM 2086 CG MET A 137 -0.985 9.560 -2.009 1.00 0.67 C ATOM 2087 SD MET A 137 -0.469 8.210 -3.105 1.00 1.13 S ATOM 2088 CE MET A 137 0.716 9.150 -4.100 1.00 0.67 C ATOM 0 H MET A 137 -2.087 10.440 0.082 1.00 0.35 H new ATOM 0 HA MET A 137 -0.438 8.180 0.333 1.00 0.33 H new ATOM 0 HB2 MET A 137 0.291 10.897 -0.859 1.00 0.36 H new ATOM 0 HB3 MET A 137 1.047 9.365 -1.251 1.00 0.36 H new ATOM 0 HG2 MET A 137 -1.925 9.304 -1.521 1.00 0.67 H new ATOM 0 HG3 MET A 137 -1.164 10.464 -2.591 1.00 0.67 H new ATOM 0 HE1 MET A 137 0.428 9.103 -5.150 1.00 0.67 H new ATOM 0 HE2 MET A 137 0.723 10.189 -3.772 1.00 0.67 H new ATOM 0 HE3 MET A 137 1.712 8.724 -3.978 1.00 0.67 H new ATOM 2098 N GLY A 138 0.520 10.695 2.142 1.00 0.31 N ATOM 2099 CA GLY A 138 1.442 11.146 3.224 1.00 0.33 C ATOM 2100 C GLY A 138 1.330 10.202 4.425 1.00 0.33 C ATOM 2101 O GLY A 138 2.320 9.796 5.001 1.00 0.34 O ATOM 0 H GLY A 138 -0.262 11.326 1.968 1.00 0.31 H new ATOM 0 HA2 GLY A 138 2.468 11.163 2.857 1.00 0.33 H new ATOM 0 HA3 GLY A 138 1.194 12.164 3.525 1.00 0.33 H new ATOM 2105 N TRP A 139 0.133 9.850 4.809 1.00 0.34 N ATOM 2106 CA TRP A 139 -0.031 8.931 5.973 1.00 0.37 C ATOM 2107 C TRP A 139 0.369 7.507 5.582 1.00 0.35 C ATOM 2108 O TRP A 139 0.761 6.710 6.410 1.00 0.39 O ATOM 2109 CB TRP A 139 -1.487 8.935 6.449 1.00 0.43 C ATOM 2110 CG TRP A 139 -1.893 10.295 6.949 1.00 0.46 C ATOM 2111 CD1 TRP A 139 -1.069 11.234 7.491 1.00 0.54 C ATOM 2112 CD2 TRP A 139 -3.230 10.874 6.972 1.00 0.53 C ATOM 2113 NE1 TRP A 139 -1.821 12.341 7.834 1.00 0.57 N ATOM 2114 CE2 TRP A 139 -3.155 12.169 7.535 1.00 0.56 C ATOM 2115 CE3 TRP A 139 -4.490 10.403 6.559 1.00 0.67 C ATOM 2116 CZ2 TRP A 139 -4.289 12.968 7.686 1.00 0.66 C ATOM 2117 CZ3 TRP A 139 -5.633 11.205 6.708 1.00 0.81 C ATOM 2118 CH2 TRP A 139 -5.532 12.485 7.271 1.00 0.78 C ATOM 0 H TRP A 139 -0.735 10.157 4.370 1.00 0.34 H new ATOM 0 HA TRP A 139 0.614 9.279 6.780 1.00 0.37 H new ATOM 0 HB2 TRP A 139 -2.141 8.636 5.630 1.00 0.43 H new ATOM 0 HB3 TRP A 139 -1.615 8.200 7.243 1.00 0.43 H new ATOM 0 HD1 TRP A 139 -0.003 11.130 7.630 1.00 0.54 H new ATOM 0 HE1 TRP A 139 -1.435 13.185 8.258 1.00 0.57 H new ATOM 0 HE3 TRP A 139 -4.579 9.418 6.125 1.00 0.67 H new ATOM 0 HZ2 TRP A 139 -4.206 13.953 8.121 1.00 0.66 H new ATOM 0 HZ3 TRP A 139 -6.595 10.834 6.387 1.00 0.81 H new ATOM 0 HH2 TRP A 139 -6.415 13.097 7.384 1.00 0.78 H new ATOM 2129 N THR A 140 0.274 7.181 4.319 1.00 0.34 N ATOM 2130 CA THR A 140 0.649 5.809 3.871 1.00 0.36 C ATOM 2131 C THR A 140 2.165 5.641 3.981 1.00 0.34 C ATOM 2132 O THR A 140 2.656 4.778 4.681 1.00 0.39 O ATOM 2133 CB THR A 140 0.215 5.612 2.416 1.00 0.38 C ATOM 2134 OG1 THR A 140 -1.175 5.882 2.298 1.00 1.20 O ATOM 2135 CG2 THR A 140 0.496 4.171 1.987 1.00 1.17 C ATOM 0 H THR A 140 -0.047 7.806 3.580 1.00 0.34 H new ATOM 0 HA THR A 140 0.153 5.069 4.499 1.00 0.36 H new ATOM 0 HB THR A 140 0.774 6.294 1.775 1.00 0.38 H new ATOM 0 HG1 THR A 140 -1.330 6.846 2.385 1.00 1.20 H new ATOM 0 HG21 THR A 140 0.186 4.033 0.951 1.00 1.17 H new ATOM 0 HG22 THR A 140 1.563 3.966 2.077 1.00 1.17 H new ATOM 0 HG23 THR A 140 -0.061 3.486 2.626 1.00 1.17 H new ATOM 2143 N LEU A 141 2.909 6.468 3.301 1.00 0.33 N ATOM 2144 CA LEU A 141 4.394 6.371 3.369 1.00 0.34 C ATOM 2145 C LEU A 141 4.841 6.590 4.821 1.00 0.33 C ATOM 2146 O LEU A 141 5.923 6.200 5.210 1.00 0.33 O ATOM 2147 CB LEU A 141 5.043 7.405 2.435 1.00 0.35 C ATOM 2148 CG LEU A 141 4.388 7.359 1.037 1.00 0.41 C ATOM 2149 CD1 LEU A 141 4.641 8.677 0.302 1.00 0.99 C ATOM 2150 CD2 LEU A 141 4.981 6.209 0.216 1.00 0.80 C ATOM 0 H LEU A 141 2.551 7.210 2.699 1.00 0.33 H new ATOM 0 HA LEU A 141 4.712 5.382 3.040 1.00 0.34 H new ATOM 0 HB2 LEU A 141 4.938 8.403 2.859 1.00 0.35 H new ATOM 0 HB3 LEU A 141 6.111 7.206 2.349 1.00 0.35 H new ATOM 0 HG LEU A 141 3.316 7.205 1.159 1.00 0.41 H new ATOM 0 HD11 LEU A 141 4.177 8.639 -0.683 1.00 0.99 H new ATOM 0 HD12 LEU A 141 4.212 9.500 0.873 1.00 0.99 H new ATOM 0 HD13 LEU A 141 5.714 8.832 0.192 1.00 0.99 H new ATOM 0 HD21 LEU A 141 4.513 6.185 -0.768 1.00 0.80 H new ATOM 0 HD22 LEU A 141 6.055 6.358 0.103 1.00 0.80 H new ATOM 0 HD23 LEU A 141 4.798 5.264 0.728 1.00 0.80 H new ATOM 2162 N ASP A 142 4.011 7.191 5.628 1.00 0.36 N ATOM 2163 CA ASP A 142 4.385 7.402 7.058 1.00 0.37 C ATOM 2164 C ASP A 142 4.433 6.039 7.760 1.00 0.37 C ATOM 2165 O ASP A 142 5.275 5.779 8.595 1.00 0.42 O ATOM 2166 CB ASP A 142 3.327 8.276 7.735 1.00 0.37 C ATOM 2167 CG ASP A 142 3.787 8.618 9.154 1.00 0.78 C ATOM 2168 OD1 ASP A 142 4.977 8.521 9.409 1.00 1.32 O ATOM 2169 OD2 ASP A 142 2.944 8.971 9.961 1.00 1.59 O ATOM 0 H ASP A 142 3.092 7.545 5.362 1.00 0.36 H new ATOM 0 HA ASP A 142 5.357 7.892 7.120 1.00 0.37 H new ATOM 0 HB2 ASP A 142 3.171 9.189 7.161 1.00 0.37 H new ATOM 0 HB3 ASP A 142 2.372 7.752 7.766 1.00 0.37 H new ATOM 2174 N PHE A 143 3.518 5.172 7.412 1.00 0.41 N ATOM 2175 CA PHE A 143 3.461 3.811 8.027 1.00 0.43 C ATOM 2176 C PHE A 143 4.557 2.908 7.440 1.00 0.43 C ATOM 2177 O PHE A 143 5.159 2.127 8.151 1.00 0.45 O ATOM 2178 CB PHE A 143 2.092 3.189 7.737 1.00 0.44 C ATOM 2179 CG PHE A 143 1.896 1.963 8.599 1.00 0.47 C ATOM 2180 CD1 PHE A 143 1.330 2.086 9.873 1.00 1.29 C ATOM 2181 CD2 PHE A 143 2.282 0.704 8.123 1.00 1.16 C ATOM 2182 CE1 PHE A 143 1.148 0.950 10.672 1.00 1.35 C ATOM 2183 CE2 PHE A 143 2.101 -0.432 8.922 1.00 1.22 C ATOM 2184 CZ PHE A 143 1.534 -0.309 10.196 1.00 0.72 C ATOM 0 H PHE A 143 2.795 5.353 6.715 1.00 0.41 H new ATOM 0 HA PHE A 143 3.617 3.902 9.102 1.00 0.43 H new ATOM 0 HB2 PHE A 143 1.303 3.914 7.935 1.00 0.44 H new ATOM 0 HB3 PHE A 143 2.020 2.920 6.683 1.00 0.44 H new ATOM 0 HD1 PHE A 143 1.033 3.057 10.240 1.00 1.29 H new ATOM 0 HD2 PHE A 143 2.719 0.609 7.140 1.00 1.16 H new ATOM 0 HE1 PHE A 143 0.710 1.045 11.655 1.00 1.35 H new ATOM 0 HE2 PHE A 143 2.399 -1.403 8.555 1.00 1.22 H new ATOM 0 HZ PHE A 143 1.394 -1.185 10.812 1.00 0.72 H new ATOM 2194 N LEU A 144 4.830 2.993 6.170 1.00 0.45 N ATOM 2195 CA LEU A 144 5.895 2.116 5.588 1.00 0.47 C ATOM 2196 C LEU A 144 7.256 2.562 6.153 1.00 0.47 C ATOM 2197 O LEU A 144 8.069 1.754 6.557 1.00 0.49 O ATOM 2198 CB LEU A 144 5.808 2.204 4.033 1.00 0.49 C ATOM 2199 CG LEU A 144 7.173 2.471 3.345 1.00 0.64 C ATOM 2200 CD1 LEU A 144 8.059 1.212 3.370 1.00 1.31 C ATOM 2201 CD2 LEU A 144 6.916 2.883 1.891 1.00 1.01 C ATOM 0 H LEU A 144 4.371 3.622 5.512 1.00 0.45 H new ATOM 0 HA LEU A 144 5.764 1.068 5.859 1.00 0.47 H new ATOM 0 HB2 LEU A 144 5.393 1.272 3.648 1.00 0.49 H new ATOM 0 HB3 LEU A 144 5.113 2.998 3.761 1.00 0.49 H new ATOM 0 HG LEU A 144 7.692 3.264 3.883 1.00 0.64 H new ATOM 0 HD11 LEU A 144 9.010 1.426 2.882 1.00 1.31 H new ATOM 0 HD12 LEU A 144 8.241 0.915 4.403 1.00 1.31 H new ATOM 0 HD13 LEU A 144 7.555 0.402 2.843 1.00 1.31 H new ATOM 0 HD21 LEU A 144 7.867 3.074 1.394 1.00 1.01 H new ATOM 0 HD22 LEU A 144 6.390 2.081 1.373 1.00 1.01 H new ATOM 0 HD23 LEU A 144 6.308 3.787 1.871 1.00 1.01 H new ATOM 2213 N ARG A 145 7.504 3.837 6.170 1.00 0.47 N ATOM 2214 CA ARG A 145 8.801 4.362 6.696 1.00 0.48 C ATOM 2215 C ARG A 145 9.033 3.934 8.157 1.00 0.49 C ATOM 2216 O ARG A 145 10.139 3.609 8.539 1.00 0.50 O ATOM 2217 CB ARG A 145 8.768 5.892 6.626 1.00 0.49 C ATOM 2218 CG ARG A 145 10.178 6.449 6.838 1.00 0.69 C ATOM 2219 CD ARG A 145 10.128 7.978 6.840 1.00 0.68 C ATOM 2220 NE ARG A 145 9.264 8.445 7.960 1.00 1.56 N ATOM 2221 CZ ARG A 145 9.307 9.692 8.343 1.00 2.10 C ATOM 2222 NH1 ARG A 145 10.107 10.531 7.744 1.00 2.12 N ATOM 2223 NH2 ARG A 145 8.551 10.099 9.325 1.00 3.16 N ATOM 0 H ARG A 145 6.857 4.553 5.838 1.00 0.47 H new ATOM 0 HA ARG A 145 9.612 3.956 6.091 1.00 0.48 H new ATOM 0 HB2 ARG A 145 8.381 6.213 5.659 1.00 0.49 H new ATOM 0 HB3 ARG A 145 8.093 6.286 7.386 1.00 0.49 H new ATOM 0 HG2 ARG A 145 10.585 6.087 7.782 1.00 0.69 H new ATOM 0 HG3 ARG A 145 10.842 6.097 6.048 1.00 0.69 H new ATOM 0 HD2 ARG A 145 11.133 8.385 6.948 1.00 0.68 H new ATOM 0 HD3 ARG A 145 9.737 8.341 5.889 1.00 0.68 H new ATOM 0 HE ARG A 145 8.638 7.790 8.428 1.00 1.56 H new ATOM 0 HH11 ARG A 145 10.699 10.212 6.977 1.00 2.12 H new ATOM 0 HH12 ARG A 145 10.141 11.506 8.043 1.00 2.12 H new ATOM 0 HH21 ARG A 145 7.926 9.443 9.794 1.00 3.16 H new ATOM 0 HH22 ARG A 145 8.585 11.073 9.624 1.00 3.16 H new ATOM 2237 N GLU A 146 8.029 3.982 8.989 1.00 0.49 N ATOM 2238 CA GLU A 146 8.243 3.629 10.433 1.00 0.51 C ATOM 2239 C GLU A 146 8.163 2.113 10.686 1.00 0.53 C ATOM 2240 O GLU A 146 9.024 1.551 11.335 1.00 0.55 O ATOM 2241 CB GLU A 146 7.191 4.343 11.288 1.00 0.52 C ATOM 2242 CG GLU A 146 5.793 3.862 10.898 1.00 0.96 C ATOM 2243 CD GLU A 146 4.745 4.872 11.377 1.00 1.48 C ATOM 2244 OE1 GLU A 146 4.831 6.021 10.976 1.00 2.22 O ATOM 2245 OE2 GLU A 146 3.876 4.478 12.137 1.00 2.03 O ATOM 0 H GLU A 146 7.076 4.247 8.741 1.00 0.49 H new ATOM 0 HA GLU A 146 9.247 3.953 10.706 1.00 0.51 H new ATOM 0 HB2 GLU A 146 7.372 4.145 12.344 1.00 0.52 H new ATOM 0 HB3 GLU A 146 7.267 5.421 11.148 1.00 0.52 H new ATOM 0 HG2 GLU A 146 5.728 3.742 9.817 1.00 0.96 H new ATOM 0 HG3 GLU A 146 5.598 2.885 11.340 1.00 0.96 H new ATOM 2252 N ARG A 147 7.129 1.445 10.238 1.00 0.59 N ATOM 2253 CA ARG A 147 7.013 -0.023 10.530 1.00 0.62 C ATOM 2254 C ARG A 147 7.827 -0.849 9.523 1.00 0.58 C ATOM 2255 O ARG A 147 8.549 -1.757 9.884 1.00 0.62 O ATOM 2256 CB ARG A 147 5.528 -0.427 10.444 1.00 0.63 C ATOM 2257 CG ARG A 147 4.805 -0.106 11.771 1.00 0.73 C ATOM 2258 CD ARG A 147 4.903 -1.302 12.726 1.00 1.11 C ATOM 2259 NE ARG A 147 4.429 -0.898 14.079 1.00 1.75 N ATOM 2260 CZ ARG A 147 4.123 -1.809 14.962 1.00 2.40 C ATOM 2261 NH1 ARG A 147 4.223 -3.074 14.657 1.00 2.71 N ATOM 2262 NH2 ARG A 147 3.714 -1.455 16.150 1.00 3.30 N ATOM 0 H ARG A 147 6.367 1.844 9.689 1.00 0.59 H new ATOM 0 HA ARG A 147 7.405 -0.219 11.528 1.00 0.62 H new ATOM 0 HB2 ARG A 147 5.047 0.104 9.623 1.00 0.63 H new ATOM 0 HB3 ARG A 147 5.446 -1.492 10.226 1.00 0.63 H new ATOM 0 HG2 ARG A 147 5.250 0.776 12.233 1.00 0.73 H new ATOM 0 HG3 ARG A 147 3.759 0.130 11.577 1.00 0.73 H new ATOM 0 HD2 ARG A 147 4.302 -2.130 12.351 1.00 1.11 H new ATOM 0 HD3 ARG A 147 5.933 -1.654 12.780 1.00 1.11 H new ATOM 0 HE ARG A 147 4.344 0.091 14.315 1.00 1.75 H new ATOM 0 HH11 ARG A 147 4.540 -3.351 13.728 1.00 2.71 H new ATOM 0 HH12 ARG A 147 3.984 -3.786 15.348 1.00 2.71 H new ATOM 0 HH21 ARG A 147 3.634 -0.466 16.388 1.00 3.30 H new ATOM 0 HH22 ARG A 147 3.475 -2.167 16.840 1.00 3.30 H new ATOM 2276 N LEU A 148 7.689 -0.547 8.265 1.00 0.53 N ATOM 2277 CA LEU A 148 8.419 -1.309 7.210 1.00 0.57 C ATOM 2278 C LEU A 148 9.749 -0.627 6.886 1.00 0.67 C ATOM 2279 O LEU A 148 10.378 -0.033 7.738 1.00 1.61 O ATOM 2280 CB LEU A 148 7.553 -1.346 5.948 1.00 0.59 C ATOM 2281 CG LEU A 148 6.144 -1.847 6.293 1.00 0.70 C ATOM 2282 CD1 LEU A 148 5.310 -1.927 5.011 1.00 1.29 C ATOM 2283 CD2 LEU A 148 6.220 -3.239 6.941 1.00 1.34 C ATOM 0 H LEU A 148 7.095 0.205 7.915 1.00 0.53 H new ATOM 0 HA LEU A 148 8.620 -2.319 7.567 1.00 0.57 H new ATOM 0 HB2 LEU A 148 7.496 -0.351 5.507 1.00 0.59 H new ATOM 0 HB3 LEU A 148 8.008 -1.999 5.204 1.00 0.59 H new ATOM 0 HG LEU A 148 5.680 -1.155 6.995 1.00 0.70 H new ATOM 0 HD11 LEU A 148 4.308 -2.283 5.250 1.00 1.29 H new ATOM 0 HD12 LEU A 148 5.245 -0.938 4.557 1.00 1.29 H new ATOM 0 HD13 LEU A 148 5.782 -2.617 4.312 1.00 1.29 H new ATOM 0 HD21 LEU A 148 5.214 -3.584 7.181 1.00 1.34 H new ATOM 0 HD22 LEU A 148 6.687 -3.938 6.248 1.00 1.34 H new ATOM 0 HD23 LEU A 148 6.812 -3.183 7.854 1.00 1.34 H new ATOM 2295 N LEU A 149 10.181 -0.727 5.656 1.00 0.67 N ATOM 2296 CA LEU A 149 11.474 -0.107 5.240 1.00 0.57 C ATOM 2297 C LEU A 149 12.635 -0.925 5.817 1.00 0.56 C ATOM 2298 O LEU A 149 13.356 -1.581 5.092 1.00 0.58 O ATOM 2299 CB LEU A 149 11.549 1.357 5.717 1.00 0.54 C ATOM 2300 CG LEU A 149 12.497 2.171 4.808 1.00 0.59 C ATOM 2301 CD1 LEU A 149 11.735 2.697 3.585 1.00 0.83 C ATOM 2302 CD2 LEU A 149 13.061 3.364 5.590 1.00 1.21 C ATOM 0 H LEU A 149 9.686 -1.219 4.912 1.00 0.67 H new ATOM 0 HA LEU A 149 11.542 -0.108 4.152 1.00 0.57 H new ATOM 0 HB2 LEU A 149 10.554 1.801 5.706 1.00 0.54 H new ATOM 0 HB3 LEU A 149 11.903 1.393 6.747 1.00 0.54 H new ATOM 0 HG LEU A 149 13.309 1.522 4.479 1.00 0.59 H new ATOM 0 HD11 LEU A 149 12.413 3.269 2.952 1.00 0.83 H new ATOM 0 HD12 LEU A 149 11.332 1.857 3.019 1.00 0.83 H new ATOM 0 HD13 LEU A 149 10.918 3.339 3.914 1.00 0.83 H new ATOM 0 HD21 LEU A 149 13.729 3.937 4.947 1.00 1.21 H new ATOM 0 HD22 LEU A 149 12.242 4.002 5.922 1.00 1.21 H new ATOM 0 HD23 LEU A 149 13.613 3.002 6.457 1.00 1.21 H new ATOM 2314 N GLY A 150 12.831 -0.895 7.106 1.00 0.56 N ATOM 2315 CA GLY A 150 13.954 -1.678 7.698 1.00 0.58 C ATOM 2316 C GLY A 150 13.895 -3.128 7.207 1.00 0.62 C ATOM 2317 O GLY A 150 14.853 -3.656 6.677 1.00 0.70 O ATOM 0 H GLY A 150 12.267 -0.367 7.772 1.00 0.56 H new ATOM 0 HA2 GLY A 150 14.908 -1.229 7.420 1.00 0.58 H new ATOM 0 HA3 GLY A 150 13.894 -1.651 8.786 1.00 0.58 H new ATOM 2321 N TRP A 151 12.784 -3.785 7.407 1.00 0.63 N ATOM 2322 CA TRP A 151 12.667 -5.211 6.983 1.00 0.69 C ATOM 2323 C TRP A 151 12.819 -5.341 5.463 1.00 0.70 C ATOM 2324 O TRP A 151 13.272 -6.354 4.969 1.00 0.72 O ATOM 2325 CB TRP A 151 11.300 -5.759 7.405 1.00 0.73 C ATOM 2326 CG TRP A 151 11.000 -5.367 8.821 1.00 1.25 C ATOM 2327 CD1 TRP A 151 11.924 -5.119 9.781 1.00 2.17 C ATOM 2328 CD2 TRP A 151 9.699 -5.178 9.452 1.00 1.86 C ATOM 2329 NE1 TRP A 151 11.271 -4.790 10.956 1.00 2.65 N ATOM 2330 CE2 TRP A 151 9.900 -4.812 10.804 1.00 2.43 C ATOM 2331 CE3 TRP A 151 8.376 -5.287 8.985 1.00 2.68 C ATOM 2332 CZ2 TRP A 151 8.828 -4.564 11.662 1.00 3.17 C ATOM 2333 CZ3 TRP A 151 7.295 -5.038 9.846 1.00 3.62 C ATOM 2334 CH2 TRP A 151 7.520 -4.678 11.181 1.00 3.67 C ATOM 0 H TRP A 151 11.950 -3.395 7.847 1.00 0.63 H new ATOM 0 HA TRP A 151 13.462 -5.782 7.463 1.00 0.69 H new ATOM 0 HB2 TRP A 151 10.525 -5.375 6.742 1.00 0.73 H new ATOM 0 HB3 TRP A 151 11.290 -6.845 7.311 1.00 0.73 H new ATOM 0 HD1 TRP A 151 12.995 -5.170 9.650 1.00 2.17 H new ATOM 0 HE1 TRP A 151 11.746 -4.559 11.829 1.00 2.65 H new ATOM 0 HE3 TRP A 151 8.191 -5.564 7.958 1.00 2.68 H new ATOM 0 HZ2 TRP A 151 9.007 -4.286 12.690 1.00 3.17 H new ATOM 0 HZ3 TRP A 151 6.284 -5.125 9.477 1.00 3.62 H new ATOM 0 HH2 TRP A 151 6.684 -4.489 11.838 1.00 3.67 H new ATOM 2345 N ILE A 152 12.434 -4.345 4.710 1.00 0.73 N ATOM 2346 CA ILE A 152 12.556 -4.461 3.226 1.00 0.76 C ATOM 2347 C ILE A 152 14.037 -4.496 2.830 1.00 0.79 C ATOM 2348 O ILE A 152 14.413 -5.108 1.850 1.00 0.89 O ATOM 2349 CB ILE A 152 11.862 -3.267 2.557 1.00 0.78 C ATOM 2350 CG1 ILE A 152 10.347 -3.399 2.747 1.00 0.83 C ATOM 2351 CG2 ILE A 152 12.189 -3.245 1.058 1.00 0.92 C ATOM 2352 CD1 ILE A 152 9.650 -2.112 2.299 1.00 0.94 C ATOM 0 H ILE A 152 12.045 -3.466 5.052 1.00 0.73 H new ATOM 0 HA ILE A 152 12.078 -5.383 2.895 1.00 0.76 H new ATOM 0 HB ILE A 152 12.214 -2.341 3.011 1.00 0.78 H new ATOM 0 HG12 ILE A 152 9.972 -4.245 2.171 1.00 0.83 H new ATOM 0 HG13 ILE A 152 10.119 -3.600 3.794 1.00 0.83 H new ATOM 0 HG21 ILE A 152 11.693 -2.395 0.590 1.00 0.92 H new ATOM 0 HG22 ILE A 152 13.267 -3.156 0.922 1.00 0.92 H new ATOM 0 HG23 ILE A 152 11.840 -4.168 0.596 1.00 0.92 H new ATOM 0 HD11 ILE A 152 8.574 -2.214 2.437 1.00 0.94 H new ATOM 0 HD12 ILE A 152 10.015 -1.275 2.894 1.00 0.94 H new ATOM 0 HD13 ILE A 152 9.865 -1.929 1.246 1.00 0.94 H new ATOM 2364 N GLN A 153 14.880 -3.863 3.599 1.00 0.77 N ATOM 2365 CA GLN A 153 16.335 -3.882 3.273 1.00 0.80 C ATOM 2366 C GLN A 153 16.887 -5.279 3.568 1.00 0.81 C ATOM 2367 O GLN A 153 17.708 -5.793 2.835 1.00 0.82 O ATOM 2368 CB GLN A 153 17.096 -2.848 4.106 1.00 0.82 C ATOM 2369 CG GLN A 153 16.468 -1.452 3.956 1.00 1.09 C ATOM 2370 CD GLN A 153 16.761 -0.609 5.201 1.00 1.98 C ATOM 2371 OE1 GLN A 153 17.671 -0.905 5.949 1.00 2.66 O ATOM 2372 NE2 GLN A 153 16.026 0.440 5.448 1.00 2.77 N ATOM 0 H GLN A 153 14.627 -3.336 4.435 1.00 0.77 H new ATOM 0 HA GLN A 153 16.465 -3.635 2.219 1.00 0.80 H new ATOM 0 HB2 GLN A 153 17.088 -3.144 5.155 1.00 0.82 H new ATOM 0 HB3 GLN A 153 18.139 -2.818 3.791 1.00 0.82 H new ATOM 0 HG2 GLN A 153 16.867 -0.958 3.070 1.00 1.09 H new ATOM 0 HG3 GLN A 153 15.391 -1.542 3.813 1.00 1.09 H new ATOM 0 HE21 GLN A 153 15.262 0.687 4.819 1.00 2.77 H new ATOM 0 HE22 GLN A 153 16.215 1.013 6.270 1.00 2.77 H new ATOM 2381 N ASP A 154 16.458 -5.900 4.633 1.00 0.83 N ATOM 2382 CA ASP A 154 16.985 -7.259 4.945 1.00 0.86 C ATOM 2383 C ASP A 154 16.679 -8.196 3.772 1.00 0.85 C ATOM 2384 O ASP A 154 17.285 -9.238 3.618 1.00 0.94 O ATOM 2385 CB ASP A 154 16.324 -7.790 6.220 1.00 0.90 C ATOM 2386 CG ASP A 154 16.672 -6.877 7.397 1.00 1.28 C ATOM 2387 OD1 ASP A 154 16.697 -5.673 7.200 1.00 1.99 O ATOM 2388 OD2 ASP A 154 16.907 -7.397 8.475 1.00 1.84 O ATOM 0 H ASP A 154 15.774 -5.531 5.293 1.00 0.83 H new ATOM 0 HA ASP A 154 18.063 -7.208 5.101 1.00 0.86 H new ATOM 0 HB2 ASP A 154 15.243 -7.836 6.089 1.00 0.90 H new ATOM 0 HB3 ASP A 154 16.664 -8.806 6.422 1.00 0.90 H new ATOM 2393 N GLN A 155 15.741 -7.824 2.943 1.00 0.79 N ATOM 2394 CA GLN A 155 15.382 -8.676 1.773 1.00 0.79 C ATOM 2395 C GLN A 155 16.316 -8.361 0.602 1.00 0.72 C ATOM 2396 O GLN A 155 16.874 -9.244 -0.017 1.00 1.03 O ATOM 2397 CB GLN A 155 13.934 -8.392 1.361 1.00 0.90 C ATOM 2398 CG GLN A 155 13.482 -9.412 0.310 1.00 1.37 C ATOM 2399 CD GLN A 155 13.371 -10.799 0.948 1.00 2.01 C ATOM 2400 OE1 GLN A 155 14.090 -11.708 0.582 1.00 2.72 O ATOM 2401 NE2 GLN A 155 12.494 -11.003 1.893 1.00 2.54 N ATOM 0 H GLN A 155 15.205 -6.961 3.027 1.00 0.79 H new ATOM 0 HA GLN A 155 15.485 -9.726 2.045 1.00 0.79 H new ATOM 0 HB2 GLN A 155 13.282 -8.442 2.233 1.00 0.90 H new ATOM 0 HB3 GLN A 155 13.852 -7.382 0.959 1.00 0.90 H new ATOM 0 HG2 GLN A 155 12.520 -9.116 -0.108 1.00 1.37 H new ATOM 0 HG3 GLN A 155 14.194 -9.437 -0.515 1.00 1.37 H new ATOM 0 HE21 GLN A 155 11.890 -10.241 2.201 1.00 2.54 H new ATOM 0 HE22 GLN A 155 12.413 -11.924 2.323 1.00 2.54 H new ATOM 2410 N GLY A 156 16.487 -7.101 0.295 1.00 0.63 N ATOM 2411 CA GLY A 156 17.383 -6.711 -0.836 1.00 0.72 C ATOM 2412 C GLY A 156 16.785 -5.500 -1.556 1.00 0.87 C ATOM 2413 O GLY A 156 17.431 -4.487 -1.736 1.00 1.38 O ATOM 0 H GLY A 156 16.043 -6.322 0.781 1.00 0.63 H new ATOM 0 HA2 GLY A 156 18.378 -6.472 -0.462 1.00 0.72 H new ATOM 0 HA3 GLY A 156 17.495 -7.543 -1.531 1.00 0.72 H new ATOM 2417 N GLY A 157 15.553 -5.603 -1.975 1.00 0.81 N ATOM 2418 CA GLY A 157 14.905 -4.466 -2.692 1.00 1.10 C ATOM 2419 C GLY A 157 13.520 -4.899 -3.180 1.00 0.84 C ATOM 2420 O GLY A 157 13.072 -5.999 -2.921 1.00 0.88 O ATOM 0 H GLY A 157 14.965 -6.427 -1.852 1.00 0.81 H new ATOM 0 HA2 GLY A 157 14.817 -3.606 -2.029 1.00 1.10 H new ATOM 0 HA3 GLY A 157 15.520 -4.156 -3.537 1.00 1.10 H new ATOM 2424 N TRP A 158 12.834 -4.033 -3.878 1.00 0.67 N ATOM 2425 CA TRP A 158 11.471 -4.379 -4.377 1.00 0.50 C ATOM 2426 C TRP A 158 11.535 -5.638 -5.247 1.00 0.51 C ATOM 2427 O TRP A 158 10.524 -6.167 -5.665 1.00 0.53 O ATOM 2428 CB TRP A 158 10.907 -3.211 -5.189 1.00 0.51 C ATOM 2429 CG TRP A 158 10.829 -1.994 -4.325 1.00 0.46 C ATOM 2430 CD1 TRP A 158 11.799 -1.057 -4.213 1.00 0.59 C ATOM 2431 CD2 TRP A 158 9.744 -1.565 -3.452 1.00 0.46 C ATOM 2432 NE1 TRP A 158 11.377 -0.081 -3.328 1.00 0.55 N ATOM 2433 CE2 TRP A 158 10.117 -0.350 -2.832 1.00 0.47 C ATOM 2434 CE3 TRP A 158 8.485 -2.108 -3.142 1.00 0.65 C ATOM 2435 CZ2 TRP A 158 9.271 0.304 -1.935 1.00 0.58 C ATOM 2436 CZ3 TRP A 158 7.630 -1.453 -2.240 1.00 0.84 C ATOM 2437 CH2 TRP A 158 8.022 -0.250 -1.638 1.00 0.78 C ATOM 0 H TRP A 158 13.160 -3.098 -4.125 1.00 0.67 H new ATOM 0 HA TRP A 158 10.818 -4.572 -3.526 1.00 0.50 H new ATOM 0 HB2 TRP A 158 11.541 -3.016 -6.054 1.00 0.51 H new ATOM 0 HB3 TRP A 158 9.917 -3.463 -5.570 1.00 0.51 H new ATOM 0 HD1 TRP A 158 12.747 -1.069 -4.730 1.00 0.59 H new ATOM 0 HE1 TRP A 158 11.929 0.738 -3.073 1.00 0.55 H new ATOM 0 HE3 TRP A 158 8.173 -3.035 -3.600 1.00 0.65 H new ATOM 0 HZ2 TRP A 158 9.579 1.231 -1.474 1.00 0.58 H new ATOM 0 HZ3 TRP A 158 6.665 -1.879 -2.009 1.00 0.84 H new ATOM 0 HH2 TRP A 158 7.360 0.249 -0.945 1.00 0.78 H new ATOM 2448 N ASP A 159 12.701 -6.135 -5.532 1.00 0.50 N ATOM 2449 CA ASP A 159 12.769 -7.360 -6.373 1.00 0.51 C ATOM 2450 C ASP A 159 11.968 -8.469 -5.680 1.00 0.51 C ATOM 2451 O ASP A 159 11.420 -9.346 -6.317 1.00 0.51 O ATOM 2452 CB ASP A 159 14.227 -7.791 -6.544 1.00 0.54 C ATOM 2453 CG ASP A 159 14.865 -7.991 -5.168 1.00 1.66 C ATOM 2454 OD1 ASP A 159 14.666 -7.141 -4.316 1.00 2.46 O ATOM 2455 OD2 ASP A 159 15.542 -8.990 -4.990 1.00 2.37 O ATOM 0 H ASP A 159 13.597 -5.756 -5.226 1.00 0.50 H new ATOM 0 HA ASP A 159 12.350 -7.162 -7.360 1.00 0.51 H new ATOM 0 HB2 ASP A 159 14.279 -8.716 -7.119 1.00 0.54 H new ATOM 0 HB3 ASP A 159 14.777 -7.036 -7.105 1.00 0.54 H new ATOM 2460 N GLY A 160 11.901 -8.431 -4.374 1.00 0.52 N ATOM 2461 CA GLY A 160 11.138 -9.475 -3.626 1.00 0.54 C ATOM 2462 C GLY A 160 9.653 -9.397 -3.996 1.00 0.53 C ATOM 2463 O GLY A 160 8.962 -10.396 -4.032 1.00 0.54 O ATOM 0 H GLY A 160 12.343 -7.720 -3.792 1.00 0.52 H new ATOM 0 HA2 GLY A 160 11.530 -10.464 -3.863 1.00 0.54 H new ATOM 0 HA3 GLY A 160 11.263 -9.331 -2.553 1.00 0.54 H new ATOM 2467 N LEU A 161 9.162 -8.226 -4.299 1.00 0.54 N ATOM 2468 CA LEU A 161 7.730 -8.098 -4.695 1.00 0.56 C ATOM 2469 C LEU A 161 7.507 -8.877 -5.988 1.00 0.56 C ATOM 2470 O LEU A 161 6.566 -9.632 -6.126 1.00 0.62 O ATOM 2471 CB LEU A 161 7.401 -6.605 -4.937 1.00 0.58 C ATOM 2472 CG LEU A 161 6.908 -5.944 -3.629 1.00 0.74 C ATOM 2473 CD1 LEU A 161 5.561 -6.560 -3.173 1.00 1.63 C ATOM 2474 CD2 LEU A 161 7.970 -6.128 -2.533 1.00 1.56 C ATOM 0 H LEU A 161 9.690 -7.353 -4.290 1.00 0.54 H new ATOM 0 HA LEU A 161 7.088 -8.491 -3.907 1.00 0.56 H new ATOM 0 HB2 LEU A 161 8.286 -6.085 -5.303 1.00 0.58 H new ATOM 0 HB3 LEU A 161 6.636 -6.515 -5.708 1.00 0.58 H new ATOM 0 HG LEU A 161 6.750 -4.881 -3.811 1.00 0.74 H new ATOM 0 HD11 LEU A 161 5.235 -6.079 -2.251 1.00 1.63 H new ATOM 0 HD12 LEU A 161 4.810 -6.407 -3.948 1.00 1.63 H new ATOM 0 HD13 LEU A 161 5.690 -7.628 -2.999 1.00 1.63 H new ATOM 0 HD21 LEU A 161 7.625 -5.663 -1.610 1.00 1.56 H new ATOM 0 HD22 LEU A 161 8.137 -7.192 -2.363 1.00 1.56 H new ATOM 0 HD23 LEU A 161 8.903 -5.660 -2.848 1.00 1.56 H new ATOM 2486 N LEU A 162 8.383 -8.691 -6.940 1.00 0.53 N ATOM 2487 CA LEU A 162 8.254 -9.407 -8.237 1.00 0.56 C ATOM 2488 C LEU A 162 8.722 -10.850 -8.050 1.00 0.55 C ATOM 2489 O LEU A 162 8.183 -11.754 -8.657 1.00 0.57 O ATOM 2490 CB LEU A 162 9.103 -8.681 -9.296 1.00 0.61 C ATOM 2491 CG LEU A 162 9.154 -9.467 -10.613 1.00 0.80 C ATOM 2492 CD1 LEU A 162 7.745 -9.591 -11.206 1.00 1.56 C ATOM 2493 CD2 LEU A 162 10.060 -8.721 -11.601 1.00 1.33 C ATOM 0 H LEU A 162 9.188 -8.068 -6.871 1.00 0.53 H new ATOM 0 HA LEU A 162 7.217 -9.417 -8.573 1.00 0.56 H new ATOM 0 HB2 LEU A 162 8.688 -7.690 -9.479 1.00 0.61 H new ATOM 0 HB3 LEU A 162 10.115 -8.538 -8.917 1.00 0.61 H new ATOM 0 HG LEU A 162 9.547 -10.466 -10.425 1.00 0.80 H new ATOM 0 HD11 LEU A 162 7.791 -10.150 -12.140 1.00 1.56 H new ATOM 0 HD12 LEU A 162 7.099 -10.114 -10.502 1.00 1.56 H new ATOM 0 HD13 LEU A 162 7.342 -8.597 -11.398 1.00 1.56 H new ATOM 0 HD21 LEU A 162 10.104 -9.271 -12.541 1.00 1.33 H new ATOM 0 HD22 LEU A 162 9.658 -7.724 -11.782 1.00 1.33 H new ATOM 0 HD23 LEU A 162 11.063 -8.637 -11.183 1.00 1.33 H new ATOM 2505 N SER A 163 9.708 -11.096 -7.237 1.00 0.54 N ATOM 2506 CA SER A 163 10.155 -12.504 -7.065 1.00 0.56 C ATOM 2507 C SER A 163 9.002 -13.325 -6.473 1.00 0.53 C ATOM 2508 O SER A 163 8.924 -14.526 -6.641 1.00 0.60 O ATOM 2509 CB SER A 163 11.358 -12.551 -6.121 1.00 0.63 C ATOM 2510 OG SER A 163 10.899 -12.598 -4.777 1.00 1.32 O ATOM 0 H SER A 163 10.216 -10.398 -6.693 1.00 0.54 H new ATOM 0 HA SER A 163 10.444 -12.919 -8.031 1.00 0.56 H new ATOM 0 HB2 SER A 163 11.972 -13.425 -6.339 1.00 0.63 H new ATOM 0 HB3 SER A 163 11.988 -11.674 -6.272 1.00 0.63 H new ATOM 0 HG SER A 163 10.244 -11.884 -4.630 1.00 1.32 H new ATOM 2516 N TYR A 164 8.108 -12.671 -5.771 1.00 0.59 N ATOM 2517 CA TYR A 164 6.953 -13.387 -5.148 1.00 0.64 C ATOM 2518 C TYR A 164 5.850 -13.596 -6.190 1.00 0.63 C ATOM 2519 O TYR A 164 5.209 -14.628 -6.226 1.00 0.68 O ATOM 2520 CB TYR A 164 6.409 -12.546 -3.982 1.00 0.69 C ATOM 2521 CG TYR A 164 5.092 -13.114 -3.493 1.00 0.72 C ATOM 2522 CD1 TYR A 164 3.890 -12.697 -4.081 1.00 1.34 C ATOM 2523 CD2 TYR A 164 5.072 -14.051 -2.452 1.00 1.50 C ATOM 2524 CE1 TYR A 164 2.671 -13.218 -3.630 1.00 1.35 C ATOM 2525 CE2 TYR A 164 3.851 -14.572 -2.000 1.00 1.57 C ATOM 2526 CZ TYR A 164 2.652 -14.154 -2.590 1.00 0.87 C ATOM 2527 OH TYR A 164 1.450 -14.667 -2.145 1.00 0.97 O ATOM 0 H TYR A 164 8.130 -11.665 -5.603 1.00 0.59 H new ATOM 0 HA TYR A 164 7.282 -14.358 -4.778 1.00 0.64 H new ATOM 0 HB2 TYR A 164 7.132 -12.532 -3.166 1.00 0.69 H new ATOM 0 HB3 TYR A 164 6.271 -11.514 -4.303 1.00 0.69 H new ATOM 0 HD1 TYR A 164 3.904 -11.973 -4.883 1.00 1.34 H new ATOM 0 HD2 TYR A 164 5.997 -14.372 -1.997 1.00 1.50 H new ATOM 0 HE1 TYR A 164 1.745 -12.897 -4.085 1.00 1.35 H new ATOM 0 HE2 TYR A 164 3.836 -15.295 -1.198 1.00 1.57 H new ATOM 0 HH TYR A 164 1.615 -15.305 -1.419 1.00 0.97 H new ATOM 2537 N PHE A 165 5.622 -12.631 -7.039 1.00 0.64 N ATOM 2538 CA PHE A 165 4.558 -12.789 -8.071 1.00 0.72 C ATOM 2539 C PHE A 165 5.080 -13.676 -9.205 1.00 0.82 C ATOM 2540 O PHE A 165 5.180 -13.254 -10.341 1.00 1.56 O ATOM 2541 CB PHE A 165 4.163 -11.406 -8.620 1.00 0.74 C ATOM 2542 CG PHE A 165 3.133 -10.767 -7.709 1.00 0.84 C ATOM 2543 CD1 PHE A 165 1.863 -11.346 -7.582 1.00 1.42 C ATOM 2544 CD2 PHE A 165 3.445 -9.603 -6.991 1.00 1.65 C ATOM 2545 CE1 PHE A 165 0.907 -10.765 -6.740 1.00 1.71 C ATOM 2546 CE2 PHE A 165 2.486 -9.022 -6.149 1.00 1.96 C ATOM 2547 CZ PHE A 165 1.219 -9.604 -6.024 1.00 1.66 C ATOM 0 H PHE A 165 6.124 -11.744 -7.063 1.00 0.64 H new ATOM 0 HA PHE A 165 3.680 -13.257 -7.626 1.00 0.72 H new ATOM 0 HB2 PHE A 165 5.044 -10.768 -8.692 1.00 0.74 H new ATOM 0 HB3 PHE A 165 3.759 -11.506 -9.627 1.00 0.74 H new ATOM 0 HD1 PHE A 165 1.621 -12.242 -8.135 1.00 1.42 H new ATOM 0 HD2 PHE A 165 4.423 -9.155 -7.087 1.00 1.65 H new ATOM 0 HE1 PHE A 165 -0.071 -11.213 -6.643 1.00 1.71 H new ATOM 0 HE2 PHE A 165 2.725 -8.125 -5.597 1.00 1.96 H new ATOM 0 HZ PHE A 165 0.482 -9.156 -5.374 1.00 1.66 H new ATOM 2557 N GLY A 166 5.429 -14.896 -8.902 1.00 0.94 N ATOM 2558 CA GLY A 166 5.959 -15.804 -9.957 1.00 1.01 C ATOM 2559 C GLY A 166 4.844 -16.168 -10.937 1.00 1.23 C ATOM 2560 O GLY A 166 4.451 -15.373 -11.768 1.00 1.85 O ATOM 0 H GLY A 166 5.370 -15.303 -7.969 1.00 0.94 H new ATOM 0 HA2 GLY A 166 6.778 -15.320 -10.488 1.00 1.01 H new ATOM 0 HA3 GLY A 166 6.364 -16.708 -9.502 1.00 1.01 H new ATOM 2606 N TRP A 170 -3.359 -15.919 -8.936 1.00 1.04 N ATOM 2607 CA TRP A 170 -4.311 -14.924 -8.368 1.00 1.01 C ATOM 2608 C TRP A 170 -5.198 -15.595 -7.313 1.00 0.92 C ATOM 2609 O TRP A 170 -5.665 -14.963 -6.388 1.00 0.95 O ATOM 2610 CB TRP A 170 -5.182 -14.348 -9.489 1.00 1.32 C ATOM 2611 CG TRP A 170 -6.056 -15.419 -10.059 1.00 1.70 C ATOM 2612 CD1 TRP A 170 -7.243 -15.811 -9.541 1.00 2.30 C ATOM 2613 CD2 TRP A 170 -5.839 -16.235 -11.248 1.00 2.52 C ATOM 2614 NE1 TRP A 170 -7.768 -16.815 -10.335 1.00 3.04 N ATOM 2615 CE2 TRP A 170 -6.939 -17.112 -11.399 1.00 3.15 C ATOM 2616 CE3 TRP A 170 -4.805 -16.298 -12.199 1.00 3.32 C ATOM 2617 CZ2 TRP A 170 -7.011 -18.020 -12.456 1.00 4.11 C ATOM 2618 CZ3 TRP A 170 -4.874 -17.211 -13.265 1.00 4.37 C ATOM 2619 CH2 TRP A 170 -5.975 -18.070 -13.392 1.00 4.64 C ATOM 0 HA TRP A 170 -3.749 -14.117 -7.898 1.00 1.01 H new ATOM 0 HB2 TRP A 170 -5.795 -13.534 -9.102 1.00 1.32 H new ATOM 0 HB3 TRP A 170 -4.551 -13.927 -10.272 1.00 1.32 H new ATOM 0 HD1 TRP A 170 -7.705 -15.406 -8.653 1.00 2.30 H new ATOM 0 HE1 TRP A 170 -8.659 -17.279 -10.156 1.00 3.04 H new ATOM 0 HE3 TRP A 170 -3.953 -15.641 -12.110 1.00 3.32 H new ATOM 0 HZ2 TRP A 170 -7.861 -18.679 -12.550 1.00 4.11 H new ATOM 0 HZ3 TRP A 170 -4.075 -17.251 -13.990 1.00 4.37 H new ATOM 0 HH2 TRP A 170 -6.022 -18.770 -14.213 1.00 4.64 H new ATOM 2630 N GLN A 171 -5.427 -16.870 -7.447 1.00 0.88 N ATOM 2631 CA GLN A 171 -6.281 -17.603 -6.463 1.00 0.84 C ATOM 2632 C GLN A 171 -5.756 -17.414 -5.032 1.00 0.75 C ATOM 2633 O GLN A 171 -6.524 -17.139 -4.131 1.00 0.75 O ATOM 2634 CB GLN A 171 -6.270 -19.096 -6.811 1.00 0.88 C ATOM 2635 CG GLN A 171 -7.334 -19.829 -5.991 1.00 1.57 C ATOM 2636 CD GLN A 171 -7.245 -21.331 -6.270 1.00 1.93 C ATOM 2637 OE1 GLN A 171 -6.822 -22.094 -5.424 1.00 2.66 O ATOM 2638 NE2 GLN A 171 -7.627 -21.791 -7.430 1.00 2.34 N ATOM 0 H GLN A 171 -5.056 -17.445 -8.204 1.00 0.88 H new ATOM 0 HA GLN A 171 -7.295 -17.206 -6.514 1.00 0.84 H new ATOM 0 HB2 GLN A 171 -6.461 -19.232 -7.875 1.00 0.88 H new ATOM 0 HB3 GLN A 171 -5.286 -19.519 -6.607 1.00 0.88 H new ATOM 0 HG2 GLN A 171 -7.187 -19.636 -4.928 1.00 1.57 H new ATOM 0 HG3 GLN A 171 -8.326 -19.458 -6.248 1.00 1.57 H new ATOM 0 HE21 GLN A 171 -7.982 -21.151 -8.141 1.00 2.34 H new ATOM 0 HE22 GLN A 171 -7.570 -22.790 -7.626 1.00 2.34 H new ATOM 2647 N THR A 172 -4.486 -17.555 -4.792 1.00 0.67 N ATOM 2648 CA THR A 172 -3.990 -17.372 -3.392 1.00 0.60 C ATOM 2649 C THR A 172 -3.996 -15.884 -3.019 1.00 0.59 C ATOM 2650 O THR A 172 -4.688 -15.471 -2.111 1.00 0.74 O ATOM 2651 CB THR A 172 -2.560 -17.916 -3.267 1.00 0.59 C ATOM 2652 OG1 THR A 172 -1.805 -17.519 -4.403 1.00 0.81 O ATOM 2653 CG2 THR A 172 -2.593 -19.441 -3.185 1.00 0.92 C ATOM 0 H THR A 172 -3.776 -17.785 -5.487 1.00 0.67 H new ATOM 0 HA THR A 172 -4.649 -17.917 -2.717 1.00 0.60 H new ATOM 0 HB THR A 172 -2.099 -17.518 -2.363 1.00 0.59 H new ATOM 0 HG1 THR A 172 -0.891 -17.864 -4.325 1.00 0.81 H new ATOM 0 HG21 THR A 172 -1.576 -19.823 -3.096 1.00 0.92 H new ATOM 0 HG22 THR A 172 -3.172 -19.746 -2.314 1.00 0.92 H new ATOM 0 HG23 THR A 172 -3.054 -19.844 -4.087 1.00 0.92 H new ATOM 2661 N VAL A 173 -3.192 -15.090 -3.666 1.00 0.59 N ATOM 2662 CA VAL A 173 -3.108 -13.646 -3.295 1.00 0.58 C ATOM 2663 C VAL A 173 -4.511 -13.036 -3.123 1.00 0.57 C ATOM 2664 O VAL A 173 -4.738 -12.242 -2.233 1.00 0.60 O ATOM 2665 CB VAL A 173 -2.317 -12.892 -4.386 1.00 0.64 C ATOM 2666 CG1 VAL A 173 -3.244 -12.462 -5.529 1.00 1.13 C ATOM 2667 CG2 VAL A 173 -1.653 -11.646 -3.788 1.00 1.01 C ATOM 0 H VAL A 173 -2.588 -15.376 -4.437 1.00 0.59 H new ATOM 0 HA VAL A 173 -2.592 -13.553 -2.339 1.00 0.58 H new ATOM 0 HB VAL A 173 -1.555 -13.566 -4.777 1.00 0.64 H new ATOM 0 HG11 VAL A 173 -2.666 -11.933 -6.287 1.00 1.13 H new ATOM 0 HG12 VAL A 173 -3.705 -13.343 -5.975 1.00 1.13 H new ATOM 0 HG13 VAL A 173 -4.021 -11.804 -5.140 1.00 1.13 H new ATOM 0 HG21 VAL A 173 -1.098 -11.121 -4.565 1.00 1.01 H new ATOM 0 HG22 VAL A 173 -2.419 -10.986 -3.380 1.00 1.01 H new ATOM 0 HG23 VAL A 173 -0.970 -11.944 -2.992 1.00 1.01 H new ATOM 2677 N THR A 174 -5.444 -13.383 -3.970 1.00 0.55 N ATOM 2678 CA THR A 174 -6.814 -12.797 -3.853 1.00 0.56 C ATOM 2679 C THR A 174 -7.484 -13.263 -2.562 1.00 0.53 C ATOM 2680 O THR A 174 -8.084 -12.479 -1.856 1.00 0.55 O ATOM 2681 CB THR A 174 -7.675 -13.245 -5.038 1.00 0.59 C ATOM 2682 OG1 THR A 174 -7.631 -14.661 -5.142 1.00 1.37 O ATOM 2683 CG2 THR A 174 -7.156 -12.614 -6.333 1.00 1.27 C ATOM 0 H THR A 174 -5.318 -14.045 -4.736 1.00 0.55 H new ATOM 0 HA THR A 174 -6.722 -11.711 -3.846 1.00 0.56 H new ATOM 0 HB THR A 174 -8.704 -12.922 -4.878 1.00 0.59 H new ATOM 0 HG1 THR A 174 -7.079 -14.916 -5.911 1.00 1.37 H new ATOM 0 HG21 THR A 174 -7.775 -12.939 -7.169 1.00 1.27 H new ATOM 0 HG22 THR A 174 -7.198 -11.528 -6.251 1.00 1.27 H new ATOM 0 HG23 THR A 174 -6.125 -12.926 -6.502 1.00 1.27 H new ATOM 2691 N ILE A 175 -7.391 -14.521 -2.236 1.00 0.51 N ATOM 2692 CA ILE A 175 -8.039 -14.992 -0.981 1.00 0.50 C ATOM 2693 C ILE A 175 -7.202 -14.508 0.199 1.00 0.49 C ATOM 2694 O ILE A 175 -7.671 -14.390 1.313 1.00 0.49 O ATOM 2695 CB ILE A 175 -8.085 -16.523 -0.979 1.00 0.52 C ATOM 2696 CG1 ILE A 175 -8.897 -17.010 -2.182 1.00 0.77 C ATOM 2697 CG2 ILE A 175 -8.742 -17.015 0.312 1.00 0.87 C ATOM 2698 CD1 ILE A 175 -8.689 -18.515 -2.365 1.00 0.89 C ATOM 0 H ILE A 175 -6.902 -15.235 -2.775 1.00 0.51 H new ATOM 0 HA ILE A 175 -9.054 -14.602 -0.909 1.00 0.50 H new ATOM 0 HB ILE A 175 -7.070 -16.916 -1.041 1.00 0.52 H new ATOM 0 HG12 ILE A 175 -9.955 -16.794 -2.031 1.00 0.77 H new ATOM 0 HG13 ILE A 175 -8.588 -16.478 -3.082 1.00 0.77 H new ATOM 0 HG21 ILE A 175 -8.774 -18.105 0.312 1.00 0.87 H new ATOM 0 HG22 ILE A 175 -8.164 -16.669 1.169 1.00 0.87 H new ATOM 0 HG23 ILE A 175 -9.757 -16.622 0.376 1.00 0.87 H new ATOM 0 HD11 ILE A 175 -9.268 -18.861 -3.222 1.00 0.89 H new ATOM 0 HD12 ILE A 175 -7.632 -18.718 -2.535 1.00 0.89 H new ATOM 0 HD13 ILE A 175 -9.019 -19.040 -1.469 1.00 0.89 H new ATOM 2710 N PHE A 176 -5.955 -14.224 -0.056 1.00 0.48 N ATOM 2711 CA PHE A 176 -5.050 -13.740 1.020 1.00 0.49 C ATOM 2712 C PHE A 176 -5.397 -12.283 1.357 1.00 0.49 C ATOM 2713 O PHE A 176 -5.949 -12.004 2.400 1.00 0.56 O ATOM 2714 CB PHE A 176 -3.597 -13.838 0.507 1.00 0.51 C ATOM 2715 CG PHE A 176 -2.666 -14.188 1.646 1.00 0.51 C ATOM 2716 CD1 PHE A 176 -2.600 -13.357 2.768 1.00 1.23 C ATOM 2717 CD2 PHE A 176 -1.876 -15.343 1.579 1.00 1.41 C ATOM 2718 CE1 PHE A 176 -1.745 -13.678 3.825 1.00 1.22 C ATOM 2719 CE2 PHE A 176 -1.021 -15.666 2.633 1.00 1.52 C ATOM 2720 CZ PHE A 176 -0.955 -14.830 3.761 1.00 0.76 C ATOM 0 H PHE A 176 -5.521 -14.308 -0.975 1.00 0.48 H new ATOM 0 HA PHE A 176 -5.165 -14.343 1.921 1.00 0.49 H new ATOM 0 HB2 PHE A 176 -3.529 -14.595 -0.274 1.00 0.51 H new ATOM 0 HB3 PHE A 176 -3.296 -12.891 0.059 1.00 0.51 H new ATOM 0 HD1 PHE A 176 -3.210 -12.467 2.818 1.00 1.23 H new ATOM 0 HD2 PHE A 176 -1.929 -15.984 0.711 1.00 1.41 H new ATOM 0 HE1 PHE A 176 -1.694 -13.036 4.692 1.00 1.22 H new ATOM 0 HE2 PHE A 176 -0.411 -16.556 2.582 1.00 1.52 H new ATOM 0 HZ PHE A 176 -0.294 -15.077 4.578 1.00 0.76 H new ATOM 2730 N VAL A 177 -5.056 -11.357 0.502 1.00 0.46 N ATOM 2731 CA VAL A 177 -5.342 -9.921 0.796 1.00 0.48 C ATOM 2732 C VAL A 177 -6.836 -9.720 1.067 1.00 0.44 C ATOM 2733 O VAL A 177 -7.215 -9.004 1.973 1.00 0.57 O ATOM 2734 CB VAL A 177 -4.916 -9.064 -0.404 1.00 0.56 C ATOM 2735 CG1 VAL A 177 -3.483 -9.425 -0.807 1.00 1.20 C ATOM 2736 CG2 VAL A 177 -5.859 -9.317 -1.588 1.00 1.24 C ATOM 0 H VAL A 177 -4.591 -11.532 -0.389 1.00 0.46 H new ATOM 0 HA VAL A 177 -4.782 -9.620 1.682 1.00 0.48 H new ATOM 0 HB VAL A 177 -4.964 -8.011 -0.126 1.00 0.56 H new ATOM 0 HG11 VAL A 177 -3.180 -8.816 -1.659 1.00 1.20 H new ATOM 0 HG12 VAL A 177 -2.811 -9.236 0.030 1.00 1.20 H new ATOM 0 HG13 VAL A 177 -3.436 -10.479 -1.079 1.00 1.20 H new ATOM 0 HG21 VAL A 177 -5.551 -8.705 -2.436 1.00 1.24 H new ATOM 0 HG22 VAL A 177 -5.819 -10.370 -1.866 1.00 1.24 H new ATOM 0 HG23 VAL A 177 -6.878 -9.055 -1.304 1.00 1.24 H new ATOM 2746 N ALA A 178 -7.687 -10.339 0.302 1.00 0.45 N ATOM 2747 CA ALA A 178 -9.150 -10.168 0.533 1.00 0.43 C ATOM 2748 C ALA A 178 -9.546 -10.778 1.882 1.00 0.40 C ATOM 2749 O ALA A 178 -10.223 -10.165 2.683 1.00 0.40 O ATOM 2750 CB ALA A 178 -9.926 -10.873 -0.581 1.00 0.46 C ATOM 0 H ALA A 178 -7.437 -10.955 -0.472 1.00 0.45 H new ATOM 0 HA ALA A 178 -9.386 -9.104 0.536 1.00 0.43 H new ATOM 0 HB1 ALA A 178 -10.996 -10.749 -0.414 1.00 0.46 H new ATOM 0 HB2 ALA A 178 -9.656 -10.438 -1.544 1.00 0.46 H new ATOM 0 HB3 ALA A 178 -9.679 -11.935 -0.581 1.00 0.46 H new ATOM 2756 N GLY A 179 -9.147 -11.998 2.121 1.00 0.41 N ATOM 2757 CA GLY A 179 -9.514 -12.680 3.395 1.00 0.43 C ATOM 2758 C GLY A 179 -8.939 -11.938 4.605 1.00 0.43 C ATOM 2759 O GLY A 179 -9.632 -11.689 5.572 1.00 0.48 O ATOM 0 H GLY A 179 -8.578 -12.555 1.483 1.00 0.41 H new ATOM 0 HA2 GLY A 179 -10.599 -12.736 3.481 1.00 0.43 H new ATOM 0 HA3 GLY A 179 -9.142 -13.704 3.383 1.00 0.43 H new ATOM 2763 N VAL A 180 -7.676 -11.612 4.584 1.00 0.42 N ATOM 2764 CA VAL A 180 -7.076 -10.926 5.761 1.00 0.45 C ATOM 2765 C VAL A 180 -7.606 -9.496 5.896 1.00 0.45 C ATOM 2766 O VAL A 180 -7.635 -8.940 6.978 1.00 0.43 O ATOM 2767 CB VAL A 180 -5.544 -10.912 5.642 1.00 0.49 C ATOM 2768 CG1 VAL A 180 -5.107 -10.065 4.428 1.00 1.31 C ATOM 2769 CG2 VAL A 180 -4.943 -10.319 6.923 1.00 1.41 C ATOM 0 H VAL A 180 -7.038 -11.790 3.808 1.00 0.42 H new ATOM 0 HA VAL A 180 -7.360 -11.479 6.656 1.00 0.45 H new ATOM 0 HB VAL A 180 -5.189 -11.933 5.503 1.00 0.49 H new ATOM 0 HG11 VAL A 180 -4.019 -10.065 4.357 1.00 1.31 H new ATOM 0 HG12 VAL A 180 -5.530 -10.489 3.517 1.00 1.31 H new ATOM 0 HG13 VAL A 180 -5.463 -9.042 4.551 1.00 1.31 H new ATOM 0 HG21 VAL A 180 -3.856 -10.307 6.843 1.00 1.41 H new ATOM 0 HG22 VAL A 180 -5.308 -9.301 7.059 1.00 1.41 H new ATOM 0 HG23 VAL A 180 -5.237 -10.927 7.778 1.00 1.41 H new ATOM 2779 N LEU A 181 -8.039 -8.888 4.818 1.00 0.49 N ATOM 2780 CA LEU A 181 -8.568 -7.496 4.926 1.00 0.50 C ATOM 2781 C LEU A 181 -9.999 -7.545 5.466 1.00 0.49 C ATOM 2782 O LEU A 181 -10.428 -6.693 6.218 1.00 0.51 O ATOM 2783 CB LEU A 181 -8.576 -6.829 3.541 1.00 0.56 C ATOM 2784 CG LEU A 181 -7.169 -6.345 3.160 1.00 0.64 C ATOM 2785 CD1 LEU A 181 -7.172 -5.944 1.681 1.00 1.60 C ATOM 2786 CD2 LEU A 181 -6.760 -5.129 4.017 1.00 1.20 C ATOM 0 H LEU A 181 -8.049 -9.290 3.881 1.00 0.49 H new ATOM 0 HA LEU A 181 -7.932 -6.921 5.599 1.00 0.50 H new ATOM 0 HB2 LEU A 181 -8.937 -7.536 2.794 1.00 0.56 H new ATOM 0 HB3 LEU A 181 -9.267 -5.986 3.542 1.00 0.56 H new ATOM 0 HG LEU A 181 -6.455 -7.149 3.337 1.00 0.64 H new ATOM 0 HD11 LEU A 181 -6.179 -5.598 1.396 1.00 1.60 H new ATOM 0 HD12 LEU A 181 -7.445 -6.805 1.071 1.00 1.60 H new ATOM 0 HD13 LEU A 181 -7.894 -5.143 1.523 1.00 1.60 H new ATOM 0 HD21 LEU A 181 -5.760 -4.802 3.731 1.00 1.20 H new ATOM 0 HD22 LEU A 181 -7.468 -4.316 3.856 1.00 1.20 H new ATOM 0 HD23 LEU A 181 -6.763 -5.409 5.070 1.00 1.20 H new ATOM 2798 N THR A 182 -10.739 -8.547 5.072 1.00 0.49 N ATOM 2799 CA THR A 182 -12.146 -8.671 5.539 1.00 0.51 C ATOM 2800 C THR A 182 -12.162 -8.917 7.046 1.00 0.48 C ATOM 2801 O THR A 182 -12.999 -8.404 7.762 1.00 0.51 O ATOM 2802 CB THR A 182 -12.827 -9.837 4.820 1.00 0.54 C ATOM 2803 OG1 THR A 182 -12.638 -9.702 3.418 1.00 1.16 O ATOM 2804 CG2 THR A 182 -14.322 -9.827 5.139 1.00 1.07 C ATOM 0 H THR A 182 -10.426 -9.287 4.444 1.00 0.49 H new ATOM 0 HA THR A 182 -12.684 -7.749 5.316 1.00 0.51 H new ATOM 0 HB THR A 182 -12.391 -10.778 5.155 1.00 0.54 H new ATOM 0 HG1 THR A 182 -11.826 -10.180 3.150 1.00 1.16 H new ATOM 0 HG21 THR A 182 -14.809 -10.657 4.627 1.00 1.07 H new ATOM 0 HG22 THR A 182 -14.465 -9.930 6.215 1.00 1.07 H new ATOM 0 HG23 THR A 182 -14.760 -8.887 4.803 1.00 1.07 H new ATOM 2812 N ALA A 183 -11.242 -9.704 7.532 1.00 0.45 N ATOM 2813 CA ALA A 183 -11.206 -9.988 8.990 1.00 0.44 C ATOM 2814 C ALA A 183 -11.028 -8.676 9.751 1.00 0.44 C ATOM 2815 O ALA A 183 -11.828 -8.313 10.589 1.00 0.50 O ATOM 2816 CB ALA A 183 -10.029 -10.918 9.295 1.00 0.46 C ATOM 0 H ALA A 183 -10.515 -10.161 6.981 1.00 0.45 H new ATOM 0 HA ALA A 183 -12.136 -10.466 9.296 1.00 0.44 H new ATOM 0 HB1 ALA A 183 -9.999 -11.129 10.364 1.00 0.46 H new ATOM 0 HB2 ALA A 183 -10.150 -11.851 8.745 1.00 0.46 H new ATOM 0 HB3 ALA A 183 -9.098 -10.437 8.994 1.00 0.46 H new ATOM 2822 N SER A 184 -9.969 -7.963 9.462 1.00 0.47 N ATOM 2823 CA SER A 184 -9.712 -6.671 10.159 1.00 0.51 C ATOM 2824 C SER A 184 -10.858 -5.691 9.905 1.00 0.54 C ATOM 2825 O SER A 184 -11.372 -5.063 10.811 1.00 0.56 O ATOM 2826 CB SER A 184 -8.411 -6.063 9.633 1.00 0.62 C ATOM 2827 OG SER A 184 -8.542 -5.808 8.241 1.00 1.55 O ATOM 0 H SER A 184 -9.268 -8.224 8.768 1.00 0.47 H new ATOM 0 HA SER A 184 -9.634 -6.859 11.230 1.00 0.51 H new ATOM 0 HB2 SER A 184 -8.187 -5.138 10.165 1.00 0.62 H new ATOM 0 HB3 SER A 184 -7.579 -6.744 9.813 1.00 0.62 H new ATOM 0 HG SER A 184 -7.782 -5.271 7.934 1.00 1.55 H new ATOM 2833 N LEU A 185 -11.277 -5.557 8.682 1.00 0.58 N ATOM 2834 CA LEU A 185 -12.390 -4.620 8.386 1.00 0.69 C ATOM 2835 C LEU A 185 -13.615 -5.027 9.206 1.00 0.69 C ATOM 2836 O LEU A 185 -14.472 -4.222 9.513 1.00 0.79 O ATOM 2837 CB LEU A 185 -12.715 -4.689 6.889 1.00 0.71 C ATOM 2838 CG LEU A 185 -13.802 -3.666 6.516 1.00 0.79 C ATOM 2839 CD1 LEU A 185 -13.364 -2.240 6.899 1.00 1.62 C ATOM 2840 CD2 LEU A 185 -14.043 -3.751 5.005 1.00 1.18 C ATOM 0 H LEU A 185 -10.898 -6.054 7.876 1.00 0.58 H new ATOM 0 HA LEU A 185 -12.105 -3.601 8.646 1.00 0.69 H new ATOM 0 HB2 LEU A 185 -11.813 -4.496 6.308 1.00 0.71 H new ATOM 0 HB3 LEU A 185 -13.051 -5.693 6.632 1.00 0.71 H new ATOM 0 HG LEU A 185 -14.719 -3.892 7.060 1.00 0.79 H new ATOM 0 HD11 LEU A 185 -14.148 -1.533 6.626 1.00 1.62 H new ATOM 0 HD12 LEU A 185 -13.188 -2.190 7.974 1.00 1.62 H new ATOM 0 HD13 LEU A 185 -12.446 -1.987 6.369 1.00 1.62 H new ATOM 0 HD21 LEU A 185 -14.811 -3.033 4.718 1.00 1.18 H new ATOM 0 HD22 LEU A 185 -13.118 -3.523 4.476 1.00 1.18 H new ATOM 0 HD23 LEU A 185 -14.372 -4.757 4.745 1.00 1.18 H new ATOM 2852 N THR A 186 -13.703 -6.288 9.552 1.00 0.62 N ATOM 2853 CA THR A 186 -14.868 -6.787 10.343 1.00 0.68 C ATOM 2854 C THR A 186 -14.546 -6.784 11.842 1.00 0.62 C ATOM 2855 O THR A 186 -15.435 -6.936 12.657 1.00 0.64 O ATOM 2856 CB THR A 186 -15.240 -8.200 9.887 1.00 0.73 C ATOM 2857 OG1 THR A 186 -15.432 -8.207 8.480 1.00 0.89 O ATOM 2858 CG2 THR A 186 -16.526 -8.653 10.580 1.00 1.00 C ATOM 0 H THR A 186 -13.010 -6.999 9.317 1.00 0.62 H new ATOM 0 HA THR A 186 -15.714 -6.122 10.173 1.00 0.68 H new ATOM 0 HB THR A 186 -14.434 -8.884 10.151 1.00 0.73 H new ATOM 0 HG1 THR A 186 -14.573 -8.359 8.033 1.00 0.89 H new ATOM 0 HG21 THR A 186 -16.783 -9.659 10.249 1.00 1.00 H new ATOM 0 HG22 THR A 186 -16.377 -8.653 11.660 1.00 1.00 H new ATOM 0 HG23 THR A 186 -17.336 -7.970 10.326 1.00 1.00 H new ATOM 2866 N ILE A 187 -13.307 -6.619 12.244 1.00 0.64 N ATOM 2867 CA ILE A 187 -13.036 -6.624 13.718 1.00 0.66 C ATOM 2868 C ILE A 187 -13.540 -5.291 14.276 1.00 0.66 C ATOM 2869 O ILE A 187 -13.889 -5.184 15.435 1.00 0.75 O ATOM 2870 CB ILE A 187 -11.529 -6.811 13.988 1.00 0.72 C ATOM 2871 CG1 ILE A 187 -11.328 -7.374 15.402 1.00 0.88 C ATOM 2872 CG2 ILE A 187 -10.784 -5.466 13.859 1.00 1.57 C ATOM 2873 CD1 ILE A 187 -9.833 -7.383 15.746 1.00 0.87 C ATOM 0 H ILE A 187 -12.497 -6.485 11.639 1.00 0.64 H new ATOM 0 HA ILE A 187 -13.550 -7.452 14.206 1.00 0.66 H new ATOM 0 HB ILE A 187 -11.125 -7.507 13.252 1.00 0.72 H new ATOM 0 HG12 ILE A 187 -11.874 -6.769 16.126 1.00 0.88 H new ATOM 0 HG13 ILE A 187 -11.731 -8.385 15.462 1.00 0.88 H new ATOM 0 HG21 ILE A 187 -9.722 -5.618 14.053 1.00 1.57 H new ATOM 0 HG22 ILE A 187 -10.916 -5.072 12.851 1.00 1.57 H new ATOM 0 HG23 ILE A 187 -11.187 -4.756 14.582 1.00 1.57 H new ATOM 0 HD11 ILE A 187 -9.693 -7.783 16.750 1.00 0.87 H new ATOM 0 HD12 ILE A 187 -9.298 -8.006 15.029 1.00 0.87 H new ATOM 0 HD13 ILE A 187 -9.444 -6.366 15.703 1.00 0.87 H new ATOM 2885 N TRP A 188 -13.552 -4.269 13.465 1.00 0.64 N ATOM 2886 CA TRP A 188 -14.007 -2.935 13.958 1.00 0.70 C ATOM 2887 C TRP A 188 -15.358 -3.092 14.675 1.00 0.81 C ATOM 2888 O TRP A 188 -15.442 -2.961 15.880 1.00 1.06 O ATOM 2889 CB TRP A 188 -14.145 -1.973 12.751 1.00 0.85 C ATOM 2890 CG TRP A 188 -13.395 -0.700 13.003 1.00 0.92 C ATOM 2891 CD1 TRP A 188 -12.390 -0.226 12.233 1.00 1.76 C ATOM 2892 CD2 TRP A 188 -13.573 0.261 14.083 1.00 1.04 C ATOM 2893 NE1 TRP A 188 -11.939 0.965 12.770 1.00 2.01 N ATOM 2894 CE2 TRP A 188 -12.637 1.308 13.911 1.00 1.34 C ATOM 2895 CE3 TRP A 188 -14.446 0.326 15.184 1.00 1.79 C ATOM 2896 CZ2 TRP A 188 -12.569 2.381 14.800 1.00 1.47 C ATOM 2897 CZ3 TRP A 188 -14.380 1.405 16.081 1.00 2.17 C ATOM 2898 CH2 TRP A 188 -13.444 2.431 15.889 1.00 1.71 C ATOM 0 H TRP A 188 -13.268 -4.298 12.486 1.00 0.64 H new ATOM 0 HA TRP A 188 -13.282 -2.525 14.661 1.00 0.70 H new ATOM 0 HB2 TRP A 188 -13.764 -2.454 11.850 1.00 0.85 H new ATOM 0 HB3 TRP A 188 -15.198 -1.752 12.573 1.00 0.85 H new ATOM 0 HD1 TRP A 188 -12.003 -0.701 11.343 1.00 1.76 H new ATOM 0 HE1 TRP A 188 -11.183 1.522 12.372 1.00 2.01 H new ATOM 0 HE3 TRP A 188 -15.172 -0.459 15.341 1.00 1.79 H new ATOM 0 HZ2 TRP A 188 -11.845 3.168 14.648 1.00 1.47 H new ATOM 0 HZ3 TRP A 188 -15.054 1.444 16.924 1.00 2.17 H new ATOM 0 HH2 TRP A 188 -13.399 3.259 16.581 1.00 1.71 H new