USER MOD reduce.3.24.130724 H: found=0, std=0, add=827, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 828 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 Single : A 2 CYS SG : rot 180:sc= -0.0572 USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 179:sc= 1.23 (180deg=1.17) USER MOD Single : A 34 THR OG1 : rot -140:sc= 0.848 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0764 USER MOD Single : A 41 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : B 3 MET CE :methyl 180:sc= -0.0138 (180deg=-0.0138) USER MOD Single : B 5 LYS NZ :NH3+ 170:sc= 1.25 (180deg=1.09) USER MOD Single : B 34 THR OG1 : rot -120:sc= 0.616 USER MOD Single : B 35 THR OG1 : rot -66:sc= 0.124 USER MOD Single : B 41 HIS : no HD1:sc= -0.0558 X(o=-0.056,f=0) USER MOD Single : B 55 SER OG : rot 180:sc= 0 USER MOD Single : B 59 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 59 N CYS A 2 4.951 11.596 -0.169 1.00 0.00 N ATOM 60 CA CYS A 2 4.473 12.879 0.354 1.00 0.00 C ATOM 61 C CYS A 2 5.514 13.984 0.095 1.00 0.00 C ATOM 62 O CYS A 2 6.721 13.726 0.053 1.00 0.00 O ATOM 63 CB CYS A 2 4.121 12.715 1.844 1.00 0.00 C ATOM 64 SG CYS A 2 3.849 14.241 2.793 1.00 0.00 S ATOM 0 HA CYS A 2 3.566 13.189 -0.165 1.00 0.00 H new ATOM 0 HB2 CYS A 2 3.220 12.105 1.915 1.00 0.00 H new ATOM 0 HB3 CYS A 2 4.924 12.155 2.323 1.00 0.00 H new ATOM 0 HG CYS A 2 3.561 13.941 4.024 1.00 0.00 H new ATOM 69 N MET A 3 5.038 15.219 -0.072 1.00 0.00 N ATOM 70 CA MET A 3 5.838 16.436 -0.262 1.00 0.00 C ATOM 71 C MET A 3 5.136 17.644 0.375 1.00 0.00 C ATOM 72 O MET A 3 3.929 17.611 0.654 1.00 0.00 O ATOM 73 CB MET A 3 6.136 16.654 -1.762 1.00 0.00 C ATOM 74 CG MET A 3 4.927 16.999 -2.640 1.00 0.00 C ATOM 75 SD MET A 3 4.416 18.742 -2.597 1.00 0.00 S ATOM 76 CE MET A 3 3.107 18.713 -3.854 1.00 0.00 C ATOM 0 H MET A 3 4.036 15.410 -0.079 1.00 0.00 H new ATOM 0 HA MET A 3 6.796 16.318 0.244 1.00 0.00 H new ATOM 0 HB2 MET A 3 6.869 17.456 -1.855 1.00 0.00 H new ATOM 0 HB3 MET A 3 6.601 15.750 -2.156 1.00 0.00 H new ATOM 0 HG2 MET A 3 5.157 16.729 -3.671 1.00 0.00 H new ATOM 0 HG3 MET A 3 4.084 16.382 -2.330 1.00 0.00 H new ATOM 0 HE1 MET A 3 2.680 19.711 -3.958 1.00 0.00 H new ATOM 0 HE2 MET A 3 3.527 18.397 -4.809 1.00 0.00 H new ATOM 0 HE3 MET A 3 2.327 18.014 -3.551 1.00 0.00 H new ATOM 86 N ALA A 4 5.892 18.718 0.598 1.00 0.00 N ATOM 87 CA ALA A 4 5.409 19.995 1.128 1.00 0.00 C ATOM 88 C ALA A 4 5.921 21.190 0.305 1.00 0.00 C ATOM 89 O ALA A 4 6.693 21.032 -0.643 1.00 0.00 O ATOM 90 CB ALA A 4 5.838 20.092 2.603 1.00 0.00 C ATOM 0 H ALA A 4 6.894 18.724 0.408 1.00 0.00 H new ATOM 0 HA ALA A 4 4.322 20.032 1.057 1.00 0.00 H new ATOM 0 HB1 ALA A 4 5.490 21.036 3.022 1.00 0.00 H new ATOM 0 HB2 ALA A 4 5.404 19.264 3.163 1.00 0.00 H new ATOM 0 HB3 ALA A 4 6.925 20.045 2.670 1.00 0.00 H new ATOM 96 N LYS A 5 5.523 22.406 0.694 1.00 0.00 N ATOM 97 CA LYS A 5 6.232 23.640 0.332 1.00 0.00 C ATOM 98 C LYS A 5 6.952 24.241 1.541 1.00 0.00 C ATOM 99 O LYS A 5 6.407 24.245 2.647 1.00 0.00 O ATOM 100 CB LYS A 5 5.301 24.639 -0.376 1.00 0.00 C ATOM 101 CG LYS A 5 4.180 25.217 0.505 1.00 0.00 C ATOM 102 CD LYS A 5 3.372 26.248 -0.295 1.00 0.00 C ATOM 103 CE LYS A 5 2.349 26.951 0.604 1.00 0.00 C ATOM 104 NZ LYS A 5 1.728 28.102 -0.094 1.00 0.00 N1+ ATOM 0 H LYS A 5 4.697 22.564 1.271 1.00 0.00 H new ATOM 0 HA LYS A 5 7.007 23.387 -0.391 1.00 0.00 H new ATOM 0 HB2 LYS A 5 5.902 25.463 -0.761 1.00 0.00 H new ATOM 0 HB3 LYS A 5 4.849 24.145 -1.236 1.00 0.00 H new ATOM 0 HG2 LYS A 5 3.526 24.416 0.850 1.00 0.00 H new ATOM 0 HG3 LYS A 5 4.606 25.684 1.393 1.00 0.00 H new ATOM 0 HD2 LYS A 5 4.046 26.985 -0.733 1.00 0.00 H new ATOM 0 HD3 LYS A 5 2.859 25.754 -1.121 1.00 0.00 H new ATOM 0 HE2 LYS A 5 1.576 26.243 0.903 1.00 0.00 H new ATOM 0 HE3 LYS A 5 2.837 27.295 1.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 1.027 28.550 0.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 2.463 28.795 -0.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 1.258 27.770 -0.960 1.00 0.00 H new ATOM 118 N VAL A 6 8.157 24.758 1.331 1.00 0.00 N ATOM 119 CA VAL A 6 8.847 25.630 2.285 1.00 0.00 C ATOM 120 C VAL A 6 8.396 27.071 2.059 1.00 0.00 C ATOM 121 O VAL A 6 8.283 27.518 0.918 1.00 0.00 O ATOM 122 CB VAL A 6 10.375 25.463 2.177 1.00 0.00 C ATOM 123 CG1 VAL A 6 11.189 26.637 2.734 1.00 0.00 C ATOM 124 CG2 VAL A 6 10.798 24.203 2.944 1.00 0.00 C ATOM 0 H VAL A 6 8.694 24.583 0.481 1.00 0.00 H new ATOM 0 HA VAL A 6 8.583 25.348 3.304 1.00 0.00 H new ATOM 0 HB VAL A 6 10.587 25.402 1.109 1.00 0.00 H new ATOM 0 HG11 VAL A 6 12.253 26.431 2.615 1.00 0.00 H new ATOM 0 HG12 VAL A 6 10.933 27.547 2.192 1.00 0.00 H new ATOM 0 HG13 VAL A 6 10.961 26.769 3.792 1.00 0.00 H new ATOM 0 HG21 VAL A 6 11.878 24.079 2.872 1.00 0.00 H new ATOM 0 HG22 VAL A 6 10.513 24.302 3.992 1.00 0.00 H new ATOM 0 HG23 VAL A 6 10.303 23.332 2.514 1.00 0.00 H new ATOM 134 N VAL A 7 8.179 27.810 3.144 1.00 0.00 N ATOM 135 CA VAL A 7 7.898 29.251 3.141 1.00 0.00 C ATOM 136 C VAL A 7 8.634 29.932 4.298 1.00 0.00 C ATOM 137 O VAL A 7 8.718 29.401 5.410 1.00 0.00 O ATOM 138 CB VAL A 7 6.380 29.522 3.117 1.00 0.00 C ATOM 139 CG1 VAL A 7 5.641 29.042 4.374 1.00 0.00 C ATOM 140 CG2 VAL A 7 6.080 31.010 2.916 1.00 0.00 C ATOM 0 H VAL A 7 8.194 27.413 4.083 1.00 0.00 H new ATOM 0 HA VAL A 7 8.284 29.697 2.224 1.00 0.00 H new ATOM 0 HB VAL A 7 6.011 28.941 2.272 1.00 0.00 H new ATOM 0 HG11 VAL A 7 4.579 29.269 4.280 1.00 0.00 H new ATOM 0 HG12 VAL A 7 5.774 27.966 4.486 1.00 0.00 H new ATOM 0 HG13 VAL A 7 6.045 29.550 5.250 1.00 0.00 H new ATOM 0 HG21 VAL A 7 5.001 31.165 2.904 1.00 0.00 H new ATOM 0 HG22 VAL A 7 6.520 31.583 3.732 1.00 0.00 H new ATOM 0 HG23 VAL A 7 6.505 31.342 1.969 1.00 0.00 H new ATOM 150 N LEU A 8 9.219 31.099 4.024 1.00 0.00 N ATOM 151 CA LEU A 8 10.082 31.838 4.954 1.00 0.00 C ATOM 152 C LEU A 8 10.092 33.345 4.655 1.00 0.00 C ATOM 153 O LEU A 8 9.753 33.777 3.547 1.00 0.00 O ATOM 154 CB LEU A 8 11.494 31.210 4.940 1.00 0.00 C ATOM 155 CG LEU A 8 12.341 31.426 3.669 1.00 0.00 C ATOM 156 CD1 LEU A 8 13.219 32.683 3.765 1.00 0.00 C ATOM 157 CD2 LEU A 8 13.267 30.230 3.446 1.00 0.00 C ATOM 0 H LEU A 8 9.104 31.571 3.127 1.00 0.00 H new ATOM 0 HA LEU A 8 9.681 31.752 5.964 1.00 0.00 H new ATOM 0 HB2 LEU A 8 12.050 31.606 5.790 1.00 0.00 H new ATOM 0 HB3 LEU A 8 11.390 30.137 5.100 1.00 0.00 H new ATOM 0 HG LEU A 8 11.640 31.542 2.842 1.00 0.00 H new ATOM 0 HD11 LEU A 8 13.797 32.794 2.848 1.00 0.00 H new ATOM 0 HD12 LEU A 8 12.586 33.559 3.903 1.00 0.00 H new ATOM 0 HD13 LEU A 8 13.898 32.589 4.613 1.00 0.00 H new ATOM 0 HD21 LEU A 8 13.861 30.392 2.546 1.00 0.00 H new ATOM 0 HD22 LEU A 8 13.931 30.119 4.303 1.00 0.00 H new ATOM 0 HD23 LEU A 8 12.671 29.325 3.329 1.00 0.00 H new ATOM 265 N VAL A 16 9.896 34.486 0.741 1.00 0.00 N ATOM 266 CA VAL A 16 10.491 33.430 -0.104 1.00 0.00 C ATOM 267 C VAL A 16 9.705 32.121 0.046 1.00 0.00 C ATOM 268 O VAL A 16 9.332 31.738 1.157 1.00 0.00 O ATOM 269 CB VAL A 16 11.990 33.240 0.231 1.00 0.00 C ATOM 270 CG1 VAL A 16 12.642 32.088 -0.545 1.00 0.00 C ATOM 271 CG2 VAL A 16 12.812 34.505 -0.058 1.00 0.00 C ATOM 0 HA VAL A 16 10.428 33.738 -1.148 1.00 0.00 H new ATOM 0 HB VAL A 16 12.000 33.011 1.297 1.00 0.00 H new ATOM 0 HG11 VAL A 16 13.692 32.009 -0.264 1.00 0.00 H new ATOM 0 HG12 VAL A 16 12.131 31.155 -0.308 1.00 0.00 H new ATOM 0 HG13 VAL A 16 12.566 32.281 -1.615 1.00 0.00 H new ATOM 0 HG21 VAL A 16 13.857 34.325 0.192 1.00 0.00 H new ATOM 0 HG22 VAL A 16 12.730 34.758 -1.115 1.00 0.00 H new ATOM 0 HG23 VAL A 16 12.432 35.331 0.543 1.00 0.00 H new ATOM 281 N GLU A 17 9.455 31.419 -1.063 1.00 0.00 N ATOM 282 CA GLU A 17 8.658 30.189 -1.123 1.00 0.00 C ATOM 283 C GLU A 17 9.264 29.175 -2.118 1.00 0.00 C ATOM 284 O GLU A 17 9.699 29.558 -3.209 1.00 0.00 O ATOM 285 CB GLU A 17 7.215 30.580 -1.474 1.00 0.00 C ATOM 286 CG GLU A 17 6.245 29.397 -1.541 1.00 0.00 C ATOM 287 CD GLU A 17 4.805 29.878 -1.824 1.00 0.00 C ATOM 288 OE1 GLU A 17 4.559 30.507 -2.885 1.00 0.00 O ATOM 289 OE2 GLU A 17 3.902 29.633 -0.985 1.00 0.00 O1- ATOM 0 H GLU A 17 9.814 31.701 -1.975 1.00 0.00 H new ATOM 0 HA GLU A 17 8.663 29.682 -0.158 1.00 0.00 H new ATOM 0 HB2 GLU A 17 6.852 31.292 -0.732 1.00 0.00 H new ATOM 0 HB3 GLU A 17 7.213 31.093 -2.436 1.00 0.00 H new ATOM 0 HG2 GLU A 17 6.562 28.706 -2.322 1.00 0.00 H new ATOM 0 HG3 GLU A 17 6.270 28.847 -0.600 1.00 0.00 H new ATOM 296 N ILE A 18 9.286 27.885 -1.758 1.00 0.00 N ATOM 297 CA ILE A 18 9.840 26.776 -2.558 1.00 0.00 C ATOM 298 C ILE A 18 8.833 25.614 -2.573 1.00 0.00 C ATOM 299 O ILE A 18 8.459 25.106 -1.516 1.00 0.00 O ATOM 300 CB ILE A 18 11.199 26.309 -1.970 1.00 0.00 C ATOM 301 CG1 ILE A 18 12.266 27.422 -1.909 1.00 0.00 C ATOM 302 CG2 ILE A 18 11.747 25.107 -2.764 1.00 0.00 C ATOM 303 CD1 ILE A 18 13.385 27.111 -0.911 1.00 0.00 C ATOM 0 H ILE A 18 8.904 27.569 -0.867 1.00 0.00 H new ATOM 0 HA ILE A 18 10.014 27.117 -3.578 1.00 0.00 H new ATOM 0 HB ILE A 18 10.992 26.017 -0.940 1.00 0.00 H new ATOM 0 HG12 ILE A 18 12.697 27.562 -2.900 1.00 0.00 H new ATOM 0 HG13 ILE A 18 11.789 28.363 -1.633 1.00 0.00 H new ATOM 0 HG21 ILE A 18 12.700 24.793 -2.338 1.00 0.00 H new ATOM 0 HG22 ILE A 18 11.037 24.282 -2.711 1.00 0.00 H new ATOM 0 HG23 ILE A 18 11.892 25.395 -3.805 1.00 0.00 H new ATOM 0 HD11 ILE A 18 14.108 27.927 -0.909 1.00 0.00 H new ATOM 0 HD12 ILE A 18 12.962 26.999 0.087 1.00 0.00 H new ATOM 0 HD13 ILE A 18 13.883 26.186 -1.200 1.00 0.00 H new ATOM 315 N GLY A 19 8.410 25.180 -3.760 1.00 0.00 N ATOM 316 CA GLY A 19 7.478 24.054 -3.947 1.00 0.00 C ATOM 317 C GLY A 19 8.146 22.675 -4.084 1.00 0.00 C ATOM 318 O GLY A 19 9.362 22.564 -4.260 1.00 0.00 O ATOM 0 H GLY A 19 8.707 25.605 -4.638 1.00 0.00 H new ATOM 0 HA2 GLY A 19 6.791 24.026 -3.101 1.00 0.00 H new ATOM 0 HA3 GLY A 19 6.879 24.241 -4.838 1.00 0.00 H new ATOM 322 N ASP A 20 7.326 21.617 -4.027 1.00 0.00 N ATOM 323 CA ASP A 20 7.701 20.208 -4.273 1.00 0.00 C ATOM 324 C ASP A 20 8.861 19.690 -3.385 1.00 0.00 C ATOM 325 O ASP A 20 9.676 18.873 -3.814 1.00 0.00 O ATOM 326 CB ASP A 20 7.911 19.936 -5.780 1.00 0.00 C ATOM 327 CG ASP A 20 6.798 20.488 -6.687 1.00 0.00 C ATOM 328 OD1 ASP A 20 5.599 20.417 -6.326 1.00 0.00 O ATOM 329 OD2 ASP A 20 7.123 20.983 -7.796 1.00 0.00 O1- ATOM 0 H ASP A 20 6.337 21.719 -3.798 1.00 0.00 H new ATOM 0 HA ASP A 20 6.848 19.609 -3.954 1.00 0.00 H new ATOM 0 HB2 ASP A 20 8.862 20.372 -6.086 1.00 0.00 H new ATOM 0 HB3 ASP A 20 7.989 18.860 -5.935 1.00 0.00 H new ATOM 334 N VAL A 21 8.954 20.176 -2.146 1.00 0.00 N ATOM 335 CA VAL A 21 10.002 19.836 -1.170 1.00 0.00 C ATOM 336 C VAL A 21 9.789 18.433 -0.602 1.00 0.00 C ATOM 337 O VAL A 21 8.724 18.143 -0.044 1.00 0.00 O ATOM 338 CB VAL A 21 10.065 20.885 -0.038 1.00 0.00 C ATOM 339 CG1 VAL A 21 11.110 20.517 1.020 1.00 0.00 C ATOM 340 CG2 VAL A 21 10.425 22.265 -0.603 1.00 0.00 C ATOM 0 H VAL A 21 8.277 20.844 -1.776 1.00 0.00 H new ATOM 0 HA VAL A 21 10.959 19.845 -1.691 1.00 0.00 H new ATOM 0 HB VAL A 21 9.078 20.907 0.424 1.00 0.00 H new ATOM 0 HG11 VAL A 21 11.123 21.280 1.799 1.00 0.00 H new ATOM 0 HG12 VAL A 21 10.858 19.553 1.461 1.00 0.00 H new ATOM 0 HG13 VAL A 21 12.094 20.457 0.554 1.00 0.00 H new ATOM 0 HG21 VAL A 21 10.465 22.991 0.209 1.00 0.00 H new ATOM 0 HG22 VAL A 21 11.397 22.215 -1.093 1.00 0.00 H new ATOM 0 HG23 VAL A 21 9.669 22.570 -1.326 1.00 0.00 H new ATOM 350 N LEU A 22 10.817 17.582 -0.696 1.00 0.00 N ATOM 351 CA LEU A 22 10.883 16.296 0.011 1.00 0.00 C ATOM 352 C LEU A 22 11.663 16.393 1.332 1.00 0.00 C ATOM 353 O LEU A 22 11.332 15.679 2.279 1.00 0.00 O ATOM 354 CB LEU A 22 11.549 15.237 -0.887 1.00 0.00 C ATOM 355 CG LEU A 22 10.763 14.836 -2.144 1.00 0.00 C ATOM 356 CD1 LEU A 22 11.536 13.744 -2.882 1.00 0.00 C ATOM 357 CD2 LEU A 22 9.370 14.294 -1.828 1.00 0.00 C ATOM 0 H LEU A 22 11.638 17.769 -1.272 1.00 0.00 H new ATOM 0 HA LEU A 22 9.858 16.009 0.246 1.00 0.00 H new ATOM 0 HB2 LEU A 22 12.525 15.612 -1.196 1.00 0.00 H new ATOM 0 HB3 LEU A 22 11.726 14.342 -0.291 1.00 0.00 H new ATOM 0 HG LEU A 22 10.645 15.736 -2.748 1.00 0.00 H new ATOM 0 HD11 LEU A 22 10.987 13.451 -3.777 1.00 0.00 H new ATOM 0 HD12 LEU A 22 12.518 14.122 -3.166 1.00 0.00 H new ATOM 0 HD13 LEU A 22 11.655 12.879 -2.230 1.00 0.00 H new ATOM 0 HD21 LEU A 22 8.864 14.028 -2.756 1.00 0.00 H new ATOM 0 HD22 LEU A 22 9.458 13.410 -1.196 1.00 0.00 H new ATOM 0 HD23 LEU A 22 8.793 15.057 -1.306 1.00 0.00 H new ATOM 369 N GLU A 23 12.697 17.240 1.402 1.00 0.00 N ATOM 370 CA GLU A 23 13.646 17.278 2.523 1.00 0.00 C ATOM 371 C GLU A 23 13.926 18.694 3.022 1.00 0.00 C ATOM 372 O GLU A 23 14.121 19.616 2.227 1.00 0.00 O ATOM 373 CB GLU A 23 14.985 16.607 2.155 1.00 0.00 C ATOM 374 CG GLU A 23 14.810 15.226 1.504 1.00 0.00 C ATOM 375 CD GLU A 23 16.117 14.419 1.364 1.00 0.00 C ATOM 376 OE1 GLU A 23 16.213 13.619 0.401 1.00 0.00 O ATOM 377 OE2 GLU A 23 17.051 14.574 2.188 1.00 0.00 O1- ATOM 0 H GLU A 23 12.901 17.926 0.675 1.00 0.00 H new ATOM 0 HA GLU A 23 13.163 16.723 3.327 1.00 0.00 H new ATOM 0 HB2 GLU A 23 15.534 17.256 1.473 1.00 0.00 H new ATOM 0 HB3 GLU A 23 15.592 16.503 3.055 1.00 0.00 H new ATOM 0 HG2 GLU A 23 14.101 14.646 2.095 1.00 0.00 H new ATOM 0 HG3 GLU A 23 14.370 15.357 0.515 1.00 0.00 H new ATOM 384 N VAL A 24 14.003 18.850 4.348 1.00 0.00 N ATOM 385 CA VAL A 24 14.390 20.101 5.038 1.00 0.00 C ATOM 386 C VAL A 24 15.317 19.753 6.201 1.00 0.00 C ATOM 387 O VAL A 24 15.069 18.789 6.924 1.00 0.00 O ATOM 388 CB VAL A 24 13.166 20.894 5.528 1.00 0.00 C ATOM 389 CG1 VAL A 24 13.567 22.188 6.248 1.00 0.00 C ATOM 390 CG2 VAL A 24 12.238 21.267 4.369 1.00 0.00 C ATOM 0 H VAL A 24 13.793 18.091 4.996 1.00 0.00 H new ATOM 0 HA VAL A 24 14.910 20.745 4.329 1.00 0.00 H new ATOM 0 HB VAL A 24 12.647 20.236 6.226 1.00 0.00 H new ATOM 0 HG11 VAL A 24 12.671 22.715 6.576 1.00 0.00 H new ATOM 0 HG12 VAL A 24 14.183 21.947 7.114 1.00 0.00 H new ATOM 0 HG13 VAL A 24 14.132 22.824 5.566 1.00 0.00 H new ATOM 0 HG21 VAL A 24 11.384 21.826 4.752 1.00 0.00 H new ATOM 0 HG22 VAL A 24 12.781 21.881 3.651 1.00 0.00 H new ATOM 0 HG23 VAL A 24 11.887 20.360 3.878 1.00 0.00 H new ATOM 400 N ARG A 25 16.396 20.515 6.378 1.00 0.00 N ATOM 401 CA ARG A 25 17.497 20.218 7.307 1.00 0.00 C ATOM 402 C ARG A 25 17.995 21.497 7.968 1.00 0.00 C ATOM 403 O ARG A 25 18.120 22.518 7.301 1.00 0.00 O ATOM 404 CB ARG A 25 18.656 19.527 6.557 1.00 0.00 C ATOM 405 CG ARG A 25 18.238 18.408 5.584 1.00 0.00 C ATOM 406 CD ARG A 25 19.447 17.779 4.888 1.00 0.00 C ATOM 407 NE ARG A 25 19.038 17.057 3.666 1.00 0.00 N ATOM 408 CZ ARG A 25 18.890 17.555 2.450 1.00 0.00 C ATOM 409 NH1 ARG A 25 19.113 18.798 2.138 1.00 0.00 N1+ ATOM 410 NH2 ARG A 25 18.482 16.803 1.481 1.00 0.00 N ATOM 0 H ARG A 25 16.537 21.385 5.864 1.00 0.00 H new ATOM 0 HA ARG A 25 17.125 19.546 8.080 1.00 0.00 H new ATOM 0 HB2 ARG A 25 19.208 20.284 5.999 1.00 0.00 H new ATOM 0 HB3 ARG A 25 19.344 19.108 7.292 1.00 0.00 H new ATOM 0 HG2 ARG A 25 17.691 17.638 6.129 1.00 0.00 H new ATOM 0 HG3 ARG A 25 17.557 18.813 4.835 1.00 0.00 H new ATOM 0 HD2 ARG A 25 20.168 18.555 4.632 1.00 0.00 H new ATOM 0 HD3 ARG A 25 19.947 17.092 5.570 1.00 0.00 H new ATOM 0 HE ARG A 25 18.848 16.060 3.772 1.00 0.00 H new ATOM 0 HH11 ARG A 25 19.423 19.456 2.853 1.00 0.00 H new ATOM 0 HH12 ARG A 25 18.978 19.115 1.178 1.00 0.00 H new ATOM 0 HH21 ARG A 25 18.272 15.820 1.652 1.00 0.00 H new ATOM 0 HH22 ARG A 25 18.370 17.193 0.545 1.00 0.00 H new ATOM 424 N ALA A 26 18.331 21.420 9.250 1.00 0.00 N ATOM 425 CA ALA A 26 19.038 22.468 9.982 1.00 0.00 C ATOM 426 C ALA A 26 20.401 21.952 10.479 1.00 0.00 C ATOM 427 O ALA A 26 20.527 20.841 11.003 1.00 0.00 O ATOM 428 CB ALA A 26 18.148 22.993 11.113 1.00 0.00 C ATOM 0 H ALA A 26 18.114 20.606 9.826 1.00 0.00 H new ATOM 0 HA ALA A 26 19.251 23.307 9.320 1.00 0.00 H new ATOM 0 HB1 ALA A 26 18.676 23.775 11.659 1.00 0.00 H new ATOM 0 HB2 ALA A 26 17.229 23.401 10.693 1.00 0.00 H new ATOM 0 HB3 ALA A 26 17.905 22.177 11.793 1.00 0.00 H new ATOM 434 N GLU A 27 21.433 22.770 10.285 1.00 0.00 N ATOM 435 CA GLU A 27 22.857 22.458 10.476 1.00 0.00 C ATOM 436 C GLU A 27 23.536 23.510 11.379 1.00 0.00 C ATOM 437 O GLU A 27 22.864 24.303 12.043 1.00 0.00 O ATOM 438 CB GLU A 27 23.525 22.381 9.085 1.00 0.00 C ATOM 439 CG GLU A 27 22.892 21.379 8.101 1.00 0.00 C ATOM 440 CD GLU A 27 22.899 19.916 8.594 1.00 0.00 C ATOM 441 OE1 GLU A 27 21.982 19.142 8.220 1.00 0.00 O ATOM 442 OE2 GLU A 27 23.844 19.491 9.306 1.00 0.00 O1- ATOM 0 H GLU A 27 21.294 23.730 9.970 1.00 0.00 H new ATOM 0 HA GLU A 27 22.967 21.499 10.982 1.00 0.00 H new ATOM 0 HB2 GLU A 27 23.500 23.373 8.633 1.00 0.00 H new ATOM 0 HB3 GLU A 27 24.574 22.119 9.219 1.00 0.00 H new ATOM 0 HG2 GLU A 27 21.863 21.680 7.906 1.00 0.00 H new ATOM 0 HG3 GLU A 27 23.425 21.433 7.152 1.00 0.00 H new ATOM 449 N GLY A 28 24.873 23.540 11.419 1.00 0.00 N ATOM 450 CA GLY A 28 25.674 24.502 12.183 1.00 0.00 C ATOM 451 C GLY A 28 25.607 25.944 11.651 1.00 0.00 C ATOM 452 O GLY A 28 26.577 26.440 11.068 1.00 0.00 O ATOM 0 H GLY A 28 25.446 22.872 10.903 1.00 0.00 H new ATOM 0 HA2 GLY A 28 25.339 24.494 13.220 1.00 0.00 H new ATOM 0 HA3 GLY A 28 26.714 24.174 12.181 1.00 0.00 H new ATOM 456 N GLY A 29 24.476 26.624 11.866 1.00 0.00 N ATOM 457 CA GLY A 29 24.235 28.036 11.531 1.00 0.00 C ATOM 458 C GLY A 29 23.558 28.291 10.176 1.00 0.00 C ATOM 459 O GLY A 29 23.534 29.434 9.708 1.00 0.00 O ATOM 0 H GLY A 29 23.663 26.186 12.299 1.00 0.00 H new ATOM 0 HA2 GLY A 29 23.617 28.476 12.314 1.00 0.00 H new ATOM 0 HA3 GLY A 29 25.190 28.562 11.545 1.00 0.00 H new ATOM 463 N ALA A 30 23.020 27.252 9.529 1.00 0.00 N ATOM 464 CA ALA A 30 22.316 27.337 8.248 1.00 0.00 C ATOM 465 C ALA A 30 21.260 26.227 8.083 1.00 0.00 C ATOM 466 O ALA A 30 21.320 25.189 8.757 1.00 0.00 O ATOM 467 CB ALA A 30 23.342 27.277 7.108 1.00 0.00 C ATOM 0 H ALA A 30 23.064 26.301 9.894 1.00 0.00 H new ATOM 0 HA ALA A 30 21.778 28.285 8.219 1.00 0.00 H new ATOM 0 HB1 ALA A 30 22.826 27.340 6.150 1.00 0.00 H new ATOM 0 HB2 ALA A 30 24.038 28.111 7.200 1.00 0.00 H new ATOM 0 HB3 ALA A 30 23.892 26.338 7.163 1.00 0.00 H new ATOM 473 N VAL A 31 20.311 26.422 7.163 1.00 0.00 N ATOM 474 CA VAL A 31 19.363 25.381 6.708 1.00 0.00 C ATOM 475 C VAL A 31 19.619 24.960 5.256 1.00 0.00 C ATOM 476 O VAL A 31 20.167 25.738 4.473 1.00 0.00 O ATOM 477 CB VAL A 31 17.886 25.784 6.904 1.00 0.00 C ATOM 478 CG1 VAL A 31 17.579 26.139 8.363 1.00 0.00 C ATOM 479 CG2 VAL A 31 17.468 26.938 5.990 1.00 0.00 C ATOM 0 H VAL A 31 20.171 27.320 6.701 1.00 0.00 H new ATOM 0 HA VAL A 31 19.550 24.519 7.348 1.00 0.00 H new ATOM 0 HB VAL A 31 17.301 24.907 6.628 1.00 0.00 H new ATOM 0 HG11 VAL A 31 16.529 26.417 8.457 1.00 0.00 H new ATOM 0 HG12 VAL A 31 17.784 25.277 8.998 1.00 0.00 H new ATOM 0 HG13 VAL A 31 18.205 26.976 8.673 1.00 0.00 H new ATOM 0 HG21 VAL A 31 16.421 27.182 6.168 1.00 0.00 H new ATOM 0 HG22 VAL A 31 18.085 27.811 6.201 1.00 0.00 H new ATOM 0 HG23 VAL A 31 17.600 26.644 4.949 1.00 0.00 H new ATOM 489 N ARG A 32 19.183 23.744 4.900 1.00 0.00 N ATOM 490 CA ARG A 32 19.234 23.151 3.549 1.00 0.00 C ATOM 491 C ARG A 32 17.899 22.490 3.198 1.00 0.00 C ATOM 492 O ARG A 32 17.303 21.813 4.036 1.00 0.00 O ATOM 493 CB ARG A 32 20.396 22.138 3.448 1.00 0.00 C ATOM 494 CG ARG A 32 21.785 22.789 3.578 1.00 0.00 C ATOM 495 CD ARG A 32 22.927 21.765 3.639 1.00 0.00 C ATOM 496 NE ARG A 32 23.065 20.992 2.390 1.00 0.00 N ATOM 497 CZ ARG A 32 23.983 20.079 2.129 1.00 0.00 C ATOM 498 NH1 ARG A 32 24.890 19.721 2.993 1.00 0.00 N1+ ATOM 499 NH2 ARG A 32 23.975 19.503 0.966 1.00 0.00 N ATOM 0 H ARG A 32 18.762 23.111 5.580 1.00 0.00 H new ATOM 0 HA ARG A 32 19.414 23.948 2.828 1.00 0.00 H new ATOM 0 HB2 ARG A 32 20.281 21.385 4.228 1.00 0.00 H new ATOM 0 HB3 ARG A 32 20.334 21.619 2.492 1.00 0.00 H new ATOM 0 HG2 ARG A 32 21.948 23.456 2.731 1.00 0.00 H new ATOM 0 HG3 ARG A 32 21.808 23.404 4.477 1.00 0.00 H new ATOM 0 HD2 ARG A 32 23.863 22.283 3.846 1.00 0.00 H new ATOM 0 HD3 ARG A 32 22.751 21.080 4.468 1.00 0.00 H new ATOM 0 HE ARG A 32 22.384 21.182 1.655 1.00 0.00 H new ATOM 0 HH11 ARG A 32 24.911 20.151 3.918 1.00 0.00 H new ATOM 0 HH12 ARG A 32 25.579 19.011 2.745 1.00 0.00 H new ATOM 0 HH21 ARG A 32 23.269 19.758 0.275 1.00 0.00 H new ATOM 0 HH22 ARG A 32 24.675 18.795 0.743 1.00 0.00 H new ATOM 513 N VAL A 33 17.447 22.657 1.957 1.00 0.00 N ATOM 514 CA VAL A 33 16.142 22.192 1.435 1.00 0.00 C ATOM 515 C VAL A 33 16.334 21.462 0.102 1.00 0.00 C ATOM 516 O VAL A 33 17.009 22.004 -0.778 1.00 0.00 O ATOM 517 CB VAL A 33 15.196 23.399 1.254 1.00 0.00 C ATOM 518 CG1 VAL A 33 13.846 23.010 0.652 1.00 0.00 C ATOM 519 CG2 VAL A 33 14.936 24.129 2.581 1.00 0.00 C ATOM 0 H VAL A 33 17.997 23.141 1.247 1.00 0.00 H new ATOM 0 HA VAL A 33 15.699 21.497 2.148 1.00 0.00 H new ATOM 0 HB VAL A 33 15.715 24.061 0.561 1.00 0.00 H new ATOM 0 HG11 VAL A 33 13.224 23.899 0.549 1.00 0.00 H new ATOM 0 HG12 VAL A 33 14.001 22.560 -0.328 1.00 0.00 H new ATOM 0 HG13 VAL A 33 13.349 22.294 1.306 1.00 0.00 H new ATOM 0 HG21 VAL A 33 14.266 24.971 2.408 1.00 0.00 H new ATOM 0 HG22 VAL A 33 14.478 23.441 3.291 1.00 0.00 H new ATOM 0 HG23 VAL A 33 15.880 24.494 2.987 1.00 0.00 H new ATOM 529 N THR A 34 15.725 20.281 -0.102 1.00 0.00 N ATOM 530 CA THR A 34 15.826 19.516 -1.367 1.00 0.00 C ATOM 531 C THR A 34 14.453 19.098 -1.919 1.00 0.00 C ATOM 532 O THR A 34 13.578 18.652 -1.165 1.00 0.00 O ATOM 533 CB THR A 34 16.745 18.290 -1.210 1.00 0.00 C ATOM 534 OG1 THR A 34 17.994 18.664 -0.661 1.00 0.00 O ATOM 535 CG2 THR A 34 17.040 17.564 -2.523 1.00 0.00 C ATOM 0 H THR A 34 15.147 19.825 0.604 1.00 0.00 H new ATOM 0 HA THR A 34 16.272 20.191 -2.097 1.00 0.00 H new ATOM 0 HB THR A 34 16.195 17.617 -0.552 1.00 0.00 H new ATOM 0 HG1 THR A 34 18.710 18.165 -1.107 1.00 0.00 H new ATOM 0 HG21 THR A 34 17.693 16.713 -2.329 1.00 0.00 H new ATOM 0 HG22 THR A 34 16.106 17.213 -2.962 1.00 0.00 H new ATOM 0 HG23 THR A 34 17.531 18.248 -3.215 1.00 0.00 H new ATOM 543 N THR A 35 14.257 19.228 -3.237 1.00 0.00 N ATOM 544 CA THR A 35 12.978 18.965 -3.934 1.00 0.00 C ATOM 545 C THR A 35 12.875 17.566 -4.561 1.00 0.00 C ATOM 546 O THR A 35 13.863 16.844 -4.724 1.00 0.00 O ATOM 547 CB THR A 35 12.673 20.028 -5.007 1.00 0.00 C ATOM 548 OG1 THR A 35 13.481 19.839 -6.151 1.00 0.00 O ATOM 549 CG2 THR A 35 12.852 21.466 -4.507 1.00 0.00 C ATOM 0 H THR A 35 14.999 19.526 -3.870 1.00 0.00 H new ATOM 0 HA THR A 35 12.230 19.019 -3.143 1.00 0.00 H new ATOM 0 HB THR A 35 11.621 19.892 -5.260 1.00 0.00 H new ATOM 0 HG1 THR A 35 13.268 20.524 -6.819 1.00 0.00 H new ATOM 0 HG21 THR A 35 12.621 22.163 -5.313 1.00 0.00 H new ATOM 0 HG22 THR A 35 12.180 21.646 -3.668 1.00 0.00 H new ATOM 0 HG23 THR A 35 13.883 21.613 -4.184 1.00 0.00 H new ATOM 557 N LEU A 36 11.653 17.208 -4.971 1.00 0.00 N ATOM 558 CA LEU A 36 11.294 16.027 -5.767 1.00 0.00 C ATOM 559 C LEU A 36 12.058 15.924 -7.103 1.00 0.00 C ATOM 560 O LEU A 36 12.267 14.822 -7.619 1.00 0.00 O ATOM 561 CB LEU A 36 9.767 16.110 -5.992 1.00 0.00 C ATOM 562 CG LEU A 36 9.135 15.026 -6.891 1.00 0.00 C ATOM 563 CD1 LEU A 36 9.319 13.621 -6.310 1.00 0.00 C ATOM 564 CD2 LEU A 36 7.635 15.288 -7.040 1.00 0.00 C ATOM 0 H LEU A 36 10.835 17.772 -4.741 1.00 0.00 H new ATOM 0 HA LEU A 36 11.578 15.122 -5.230 1.00 0.00 H new ATOM 0 HB2 LEU A 36 9.278 16.071 -5.019 1.00 0.00 H new ATOM 0 HB3 LEU A 36 9.540 17.084 -6.424 1.00 0.00 H new ATOM 0 HG LEU A 36 9.639 15.075 -7.856 1.00 0.00 H new ATOM 0 HD11 LEU A 36 8.859 12.889 -6.974 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.383 13.404 -6.212 1.00 0.00 H new ATOM 0 HD13 LEU A 36 8.846 13.568 -5.329 1.00 0.00 H new ATOM 0 HD21 LEU A 36 7.193 14.521 -7.675 1.00 0.00 H new ATOM 0 HD22 LEU A 36 7.162 15.263 -6.058 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.480 16.267 -7.493 1.00 0.00 H new ATOM 576 N PHE A 37 12.507 17.056 -7.649 1.00 0.00 N ATOM 577 CA PHE A 37 13.248 17.157 -8.916 1.00 0.00 C ATOM 578 C PHE A 37 14.753 17.448 -8.729 1.00 0.00 C ATOM 579 O PHE A 37 15.429 17.898 -9.660 1.00 0.00 O ATOM 580 CB PHE A 37 12.507 18.140 -9.837 1.00 0.00 C ATOM 581 CG PHE A 37 11.051 17.755 -10.047 1.00 0.00 C ATOM 582 CD1 PHE A 37 10.728 16.657 -10.869 1.00 0.00 C ATOM 583 CD2 PHE A 37 10.024 18.432 -9.359 1.00 0.00 C ATOM 584 CE1 PHE A 37 9.394 16.232 -10.997 1.00 0.00 C ATOM 585 CE2 PHE A 37 8.689 18.014 -9.501 1.00 0.00 C ATOM 586 CZ PHE A 37 8.372 16.910 -10.311 1.00 0.00 C ATOM 0 H PHE A 37 12.361 17.964 -7.207 1.00 0.00 H new ATOM 0 HA PHE A 37 13.262 16.184 -9.407 1.00 0.00 H new ATOM 0 HB2 PHE A 37 12.557 19.141 -9.410 1.00 0.00 H new ATOM 0 HB3 PHE A 37 13.012 18.180 -10.802 1.00 0.00 H new ATOM 0 HD1 PHE A 37 11.510 16.139 -11.404 1.00 0.00 H new ATOM 0 HD2 PHE A 37 10.262 19.272 -8.723 1.00 0.00 H new ATOM 0 HE1 PHE A 37 9.155 15.385 -11.622 1.00 0.00 H new ATOM 0 HE2 PHE A 37 7.903 18.544 -8.985 1.00 0.00 H new ATOM 0 HZ PHE A 37 7.347 16.584 -10.406 1.00 0.00 H new ATOM 596 N ASP A 38 15.282 17.178 -7.531 1.00 0.00 N ATOM 597 CA ASP A 38 16.697 17.304 -7.145 1.00 0.00 C ATOM 598 C ASP A 38 17.287 18.732 -7.275 1.00 0.00 C ATOM 599 O ASP A 38 18.489 18.916 -7.480 1.00 0.00 O ATOM 600 CB ASP A 38 17.537 16.214 -7.842 1.00 0.00 C ATOM 601 CG ASP A 38 18.900 15.937 -7.181 1.00 0.00 C ATOM 602 OD1 ASP A 38 19.822 15.454 -7.884 1.00 0.00 O ATOM 603 OD2 ASP A 38 19.057 16.132 -5.951 1.00 0.00 O1- ATOM 0 H ASP A 38 14.704 16.847 -6.759 1.00 0.00 H new ATOM 0 HA ASP A 38 16.746 17.131 -6.070 1.00 0.00 H new ATOM 0 HB2 ASP A 38 16.962 15.288 -7.862 1.00 0.00 H new ATOM 0 HB3 ASP A 38 17.703 16.509 -8.878 1.00 0.00 H new ATOM 608 N GLU A 39 16.444 19.764 -7.149 1.00 0.00 N ATOM 609 CA GLU A 39 16.905 21.126 -6.844 1.00 0.00 C ATOM 610 C GLU A 39 17.268 21.243 -5.355 1.00 0.00 C ATOM 611 O GLU A 39 16.628 20.627 -4.500 1.00 0.00 O ATOM 612 CB GLU A 39 15.838 22.177 -7.205 1.00 0.00 C ATOM 613 CG GLU A 39 15.406 22.175 -8.681 1.00 0.00 C ATOM 614 CD GLU A 39 16.551 22.452 -9.673 1.00 0.00 C ATOM 615 OE1 GLU A 39 16.464 21.995 -10.839 1.00 0.00 O ATOM 616 OE2 GLU A 39 17.533 23.160 -9.332 1.00 0.00 O1- ATOM 0 H GLU A 39 15.433 19.682 -7.254 1.00 0.00 H new ATOM 0 HA GLU A 39 17.790 21.319 -7.450 1.00 0.00 H new ATOM 0 HB2 GLU A 39 14.958 22.010 -6.583 1.00 0.00 H new ATOM 0 HB3 GLU A 39 16.222 23.166 -6.955 1.00 0.00 H new ATOM 0 HG2 GLU A 39 14.962 21.208 -8.917 1.00 0.00 H new ATOM 0 HG3 GLU A 39 14.628 22.926 -8.822 1.00 0.00 H new ATOM 623 N GLU A 40 18.267 22.067 -5.026 1.00 0.00 N ATOM 624 CA GLU A 40 18.691 22.341 -3.647 1.00 0.00 C ATOM 625 C GLU A 40 18.801 23.850 -3.380 1.00 0.00 C ATOM 626 O GLU A 40 19.320 24.605 -4.211 1.00 0.00 O ATOM 627 CB GLU A 40 20.006 21.606 -3.316 1.00 0.00 C ATOM 628 CG GLU A 40 20.471 21.855 -1.874 1.00 0.00 C ATOM 629 CD GLU A 40 21.646 20.964 -1.435 1.00 0.00 C ATOM 630 OE1 GLU A 40 21.808 20.765 -0.203 1.00 0.00 O ATOM 631 OE2 GLU A 40 22.444 20.483 -2.277 1.00 0.00 O1- ATOM 0 H GLU A 40 18.815 22.572 -5.722 1.00 0.00 H new ATOM 0 HA GLU A 40 17.921 21.954 -2.980 1.00 0.00 H new ATOM 0 HB2 GLU A 40 19.869 20.536 -3.471 1.00 0.00 H new ATOM 0 HB3 GLU A 40 20.784 21.931 -4.007 1.00 0.00 H new ATOM 0 HG2 GLU A 40 20.763 22.900 -1.772 1.00 0.00 H new ATOM 0 HG3 GLU A 40 19.631 21.691 -1.199 1.00 0.00 H new ATOM 638 N HIS A 41 18.333 24.271 -2.200 1.00 0.00 N ATOM 639 CA HIS A 41 18.366 25.651 -1.710 1.00 0.00 C ATOM 640 C HIS A 41 18.964 25.673 -0.297 1.00 0.00 C ATOM 641 O HIS A 41 18.719 24.754 0.490 1.00 0.00 O ATOM 642 CB HIS A 41 16.946 26.235 -1.723 1.00 0.00 C ATOM 643 CG HIS A 41 16.228 26.093 -3.047 1.00 0.00 C ATOM 644 ND1 HIS A 41 16.333 26.975 -4.132 1.00 0.00 N ATOM 645 CD2 HIS A 41 15.404 25.060 -3.391 1.00 0.00 C ATOM 646 CE1 HIS A 41 15.570 26.443 -5.103 1.00 0.00 C ATOM 647 NE2 HIS A 41 15.009 25.293 -4.689 1.00 0.00 N ATOM 0 H HIS A 41 17.903 23.631 -1.533 1.00 0.00 H new ATOM 0 HA HIS A 41 18.991 26.265 -2.358 1.00 0.00 H new ATOM 0 HB2 HIS A 41 16.357 25.744 -0.949 1.00 0.00 H new ATOM 0 HB3 HIS A 41 16.998 27.292 -1.462 1.00 0.00 H new ATOM 0 HD2 HIS A 41 15.119 24.225 -2.768 1.00 0.00 H new ATOM 0 HE1 HIS A 41 15.427 26.879 -6.081 1.00 0.00 H new ATOM 0 HE2 HIS A 41 14.395 24.695 -5.243 1.00 0.00 H new ATOM 655 N ALA A 42 19.729 26.713 0.037 1.00 0.00 N ATOM 656 CA ALA A 42 20.376 26.851 1.348 1.00 0.00 C ATOM 657 C ALA A 42 20.386 28.309 1.830 1.00 0.00 C ATOM 658 O ALA A 42 20.548 29.236 1.027 1.00 0.00 O ATOM 659 CB ALA A 42 21.794 26.269 1.271 1.00 0.00 C ATOM 0 H ALA A 42 19.920 27.489 -0.596 1.00 0.00 H new ATOM 0 HA ALA A 42 19.801 26.292 2.086 1.00 0.00 H new ATOM 0 HB1 ALA A 42 22.281 26.368 2.241 1.00 0.00 H new ATOM 0 HB2 ALA A 42 21.740 25.215 0.998 1.00 0.00 H new ATOM 0 HB3 ALA A 42 22.369 26.810 0.520 1.00 0.00 H new ATOM 665 N PHE A 43 20.228 28.505 3.142 1.00 0.00 N ATOM 666 CA PHE A 43 20.046 29.825 3.763 1.00 0.00 C ATOM 667 C PHE A 43 20.760 29.900 5.125 1.00 0.00 C ATOM 668 O PHE A 43 20.373 29.184 6.053 1.00 0.00 O ATOM 669 CB PHE A 43 18.541 30.127 3.916 1.00 0.00 C ATOM 670 CG PHE A 43 17.715 30.011 2.645 1.00 0.00 C ATOM 671 CD1 PHE A 43 17.567 31.122 1.791 1.00 0.00 C ATOM 672 CD2 PHE A 43 17.099 28.788 2.309 1.00 0.00 C ATOM 673 CE1 PHE A 43 16.817 31.011 0.606 1.00 0.00 C ATOM 674 CE2 PHE A 43 16.358 28.676 1.115 1.00 0.00 C ATOM 675 CZ PHE A 43 16.217 29.788 0.266 1.00 0.00 C ATOM 0 H PHE A 43 20.223 27.739 3.816 1.00 0.00 H new ATOM 0 HA PHE A 43 20.494 30.579 3.115 1.00 0.00 H new ATOM 0 HB2 PHE A 43 18.126 29.448 4.661 1.00 0.00 H new ATOM 0 HB3 PHE A 43 18.430 31.137 4.309 1.00 0.00 H new ATOM 0 HD1 PHE A 43 18.031 32.063 2.047 1.00 0.00 H new ATOM 0 HD2 PHE A 43 17.195 27.937 2.967 1.00 0.00 H new ATOM 0 HE1 PHE A 43 16.703 31.867 -0.043 1.00 0.00 H new ATOM 0 HE2 PHE A 43 15.898 27.735 0.852 1.00 0.00 H new ATOM 0 HZ PHE A 43 15.647 29.701 -0.647 1.00 0.00 H new ATOM 685 N PRO A 44 21.797 30.749 5.289 1.00 0.00 N ATOM 686 CA PRO A 44 22.447 30.962 6.583 1.00 0.00 C ATOM 687 C PRO A 44 21.559 31.767 7.550 1.00 0.00 C ATOM 688 O PRO A 44 20.786 32.640 7.144 1.00 0.00 O ATOM 689 CB PRO A 44 23.766 31.670 6.271 1.00 0.00 C ATOM 690 CG PRO A 44 23.446 32.449 4.993 1.00 0.00 C ATOM 691 CD PRO A 44 22.439 31.560 4.264 1.00 0.00 C ATOM 0 HA PRO A 44 22.625 30.019 7.100 1.00 0.00 H new ATOM 0 HB2 PRO A 44 24.070 32.332 7.082 1.00 0.00 H new ATOM 0 HB3 PRO A 44 24.579 30.960 6.118 1.00 0.00 H new ATOM 0 HG2 PRO A 44 23.025 33.429 5.217 1.00 0.00 H new ATOM 0 HG3 PRO A 44 24.340 32.616 4.392 1.00 0.00 H new ATOM 0 HD2 PRO A 44 21.705 32.162 3.727 1.00 0.00 H new ATOM 0 HD3 PRO A 44 22.937 30.932 3.526 1.00 0.00 H new ATOM 699 N GLY A 45 21.677 31.477 8.845 1.00 0.00 N ATOM 700 CA GLY A 45 21.015 32.219 9.927 1.00 0.00 C ATOM 701 C GLY A 45 19.511 31.957 10.093 1.00 0.00 C ATOM 702 O GLY A 45 18.844 32.712 10.798 1.00 0.00 O ATOM 0 H GLY A 45 22.248 30.702 9.183 1.00 0.00 H new ATOM 0 HA2 GLY A 45 21.513 31.977 10.866 1.00 0.00 H new ATOM 0 HA3 GLY A 45 21.162 33.285 9.754 1.00 0.00 H new ATOM 706 N LEU A 46 18.973 30.909 9.458 1.00 0.00 N ATOM 707 CA LEU A 46 17.595 30.433 9.665 1.00 0.00 C ATOM 708 C LEU A 46 17.541 29.173 10.552 1.00 0.00 C ATOM 709 O LEU A 46 18.548 28.505 10.787 1.00 0.00 O ATOM 710 CB LEU A 46 16.895 30.172 8.317 1.00 0.00 C ATOM 711 CG LEU A 46 16.842 31.351 7.329 1.00 0.00 C ATOM 712 CD1 LEU A 46 15.914 30.980 6.168 1.00 0.00 C ATOM 713 CD2 LEU A 46 16.300 32.643 7.948 1.00 0.00 C ATOM 0 H LEU A 46 19.490 30.357 8.774 1.00 0.00 H new ATOM 0 HA LEU A 46 17.062 31.225 10.190 1.00 0.00 H new ATOM 0 HB2 LEU A 46 17.399 29.339 7.827 1.00 0.00 H new ATOM 0 HB3 LEU A 46 15.873 29.851 8.520 1.00 0.00 H new ATOM 0 HG LEU A 46 17.868 31.534 7.009 1.00 0.00 H new ATOM 0 HD11 LEU A 46 15.868 31.808 5.460 1.00 0.00 H new ATOM 0 HD12 LEU A 46 16.298 30.093 5.664 1.00 0.00 H new ATOM 0 HD13 LEU A 46 14.915 30.775 6.552 1.00 0.00 H new ATOM 0 HD21 LEU A 46 16.291 33.431 7.195 1.00 0.00 H new ATOM 0 HD22 LEU A 46 15.286 32.475 8.310 1.00 0.00 H new ATOM 0 HD23 LEU A 46 16.937 32.943 8.780 1.00 0.00 H new ATOM 725 N ALA A 47 16.329 28.840 11.012 1.00 0.00 N ATOM 726 CA ALA A 47 15.964 27.601 11.695 1.00 0.00 C ATOM 727 C ALA A 47 14.549 27.141 11.286 1.00 0.00 C ATOM 728 O ALA A 47 13.734 27.940 10.820 1.00 0.00 O ATOM 729 CB ALA A 47 16.070 27.824 13.213 1.00 0.00 C ATOM 0 H ALA A 47 15.532 29.468 10.909 1.00 0.00 H new ATOM 0 HA ALA A 47 16.649 26.805 11.403 1.00 0.00 H new ATOM 0 HB1 ALA A 47 15.800 26.906 13.735 1.00 0.00 H new ATOM 0 HB2 ALA A 47 17.093 28.100 13.470 1.00 0.00 H new ATOM 0 HB3 ALA A 47 15.392 28.624 13.511 1.00 0.00 H new ATOM 735 N ILE A 48 14.248 25.849 11.459 1.00 0.00 N ATOM 736 CA ILE A 48 12.908 25.290 11.209 1.00 0.00 C ATOM 737 C ILE A 48 11.961 25.735 12.331 1.00 0.00 C ATOM 738 O ILE A 48 12.244 25.492 13.505 1.00 0.00 O ATOM 739 CB ILE A 48 12.952 23.748 11.068 1.00 0.00 C ATOM 740 CG1 ILE A 48 13.928 23.284 9.955 1.00 0.00 C ATOM 741 CG2 ILE A 48 11.541 23.197 10.785 1.00 0.00 C ATOM 742 CD1 ILE A 48 14.332 21.807 10.071 1.00 0.00 C ATOM 0 H ILE A 48 14.926 25.157 11.777 1.00 0.00 H new ATOM 0 HA ILE A 48 12.532 25.672 10.260 1.00 0.00 H new ATOM 0 HB ILE A 48 13.320 23.352 12.015 1.00 0.00 H new ATOM 0 HG12 ILE A 48 13.463 23.450 8.983 1.00 0.00 H new ATOM 0 HG13 ILE A 48 14.825 23.902 9.989 1.00 0.00 H new ATOM 0 HG21 ILE A 48 11.587 22.112 10.688 1.00 0.00 H new ATOM 0 HG22 ILE A 48 10.876 23.460 11.607 1.00 0.00 H new ATOM 0 HG23 ILE A 48 11.161 23.628 9.859 1.00 0.00 H new ATOM 0 HD11 ILE A 48 15.015 21.552 9.261 1.00 0.00 H new ATOM 0 HD12 ILE A 48 14.826 21.639 11.028 1.00 0.00 H new ATOM 0 HD13 ILE A 48 13.442 21.180 10.006 1.00 0.00 H new ATOM 754 N GLY A 49 10.843 26.376 11.981 1.00 0.00 N ATOM 755 CA GLY A 49 9.849 26.916 12.920 1.00 0.00 C ATOM 756 C GLY A 49 8.649 25.998 13.148 1.00 0.00 C ATOM 757 O GLY A 49 8.308 25.703 14.296 1.00 0.00 O ATOM 0 H GLY A 49 10.594 26.540 11.006 1.00 0.00 H new ATOM 0 HA2 GLY A 49 10.334 27.107 13.877 1.00 0.00 H new ATOM 0 HA3 GLY A 49 9.494 27.876 12.545 1.00 0.00 H new ATOM 761 N ARG A 50 8.007 25.526 12.070 1.00 0.00 N ATOM 762 CA ARG A 50 6.887 24.556 12.090 1.00 0.00 C ATOM 763 C ARG A 50 6.913 23.632 10.865 1.00 0.00 C ATOM 764 O ARG A 50 7.346 24.035 9.785 1.00 0.00 O ATOM 765 CB ARG A 50 5.509 25.261 12.168 1.00 0.00 C ATOM 766 CG ARG A 50 5.100 25.781 13.557 1.00 0.00 C ATOM 767 CD ARG A 50 5.403 27.276 13.780 1.00 0.00 C ATOM 768 NE ARG A 50 4.974 27.722 15.124 1.00 0.00 N ATOM 769 CZ ARG A 50 5.666 27.638 16.250 1.00 0.00 C ATOM 770 NH1 ARG A 50 6.847 27.106 16.307 1.00 0.00 N1+ ATOM 771 NH2 ARG A 50 5.176 28.074 17.373 1.00 0.00 N ATOM 0 H ARG A 50 8.257 25.815 11.124 1.00 0.00 H new ATOM 0 HA ARG A 50 7.024 23.956 12.990 1.00 0.00 H new ATOM 0 HB2 ARG A 50 5.512 26.101 11.473 1.00 0.00 H new ATOM 0 HB3 ARG A 50 4.745 24.564 11.823 1.00 0.00 H new ATOM 0 HG2 ARG A 50 4.032 25.612 13.697 1.00 0.00 H new ATOM 0 HG3 ARG A 50 5.618 25.198 14.319 1.00 0.00 H new ATOM 0 HD2 ARG A 50 6.472 27.453 13.661 1.00 0.00 H new ATOM 0 HD3 ARG A 50 4.895 27.869 13.019 1.00 0.00 H new ATOM 0 HE ARG A 50 4.045 28.139 15.190 1.00 0.00 H new ATOM 0 HH11 ARG A 50 7.279 26.731 15.462 1.00 0.00 H new ATOM 0 HH12 ARG A 50 7.344 27.062 17.196 1.00 0.00 H new ATOM 0 HH21 ARG A 50 4.244 28.489 17.396 1.00 0.00 H new ATOM 0 HH22 ARG A 50 5.723 28.001 18.231 1.00 0.00 H new ATOM 785 N VAL A 51 6.413 22.414 11.047 1.00 0.00 N ATOM 786 CA VAL A 51 6.286 21.365 10.024 1.00 0.00 C ATOM 787 C VAL A 51 4.867 20.797 10.108 1.00 0.00 C ATOM 788 O VAL A 51 4.549 20.078 11.053 1.00 0.00 O ATOM 789 CB VAL A 51 7.350 20.260 10.251 1.00 0.00 C ATOM 790 CG1 VAL A 51 7.231 19.102 9.247 1.00 0.00 C ATOM 791 CG2 VAL A 51 8.783 20.806 10.172 1.00 0.00 C ATOM 0 H VAL A 51 6.066 22.110 11.957 1.00 0.00 H new ATOM 0 HA VAL A 51 6.457 21.776 9.029 1.00 0.00 H new ATOM 0 HB VAL A 51 7.150 19.888 11.256 1.00 0.00 H new ATOM 0 HG11 VAL A 51 8.001 18.359 9.455 1.00 0.00 H new ATOM 0 HG12 VAL A 51 6.248 18.640 9.339 1.00 0.00 H new ATOM 0 HG13 VAL A 51 7.359 19.484 8.234 1.00 0.00 H new ATOM 0 HG21 VAL A 51 9.491 19.994 10.338 1.00 0.00 H new ATOM 0 HG22 VAL A 51 8.953 21.241 9.187 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.923 21.571 10.935 1.00 0.00 H new ATOM 801 N ASP A 52 4.008 21.122 9.143 1.00 0.00 N ATOM 802 CA ASP A 52 2.596 20.715 9.100 1.00 0.00 C ATOM 803 C ASP A 52 2.370 19.661 8.000 1.00 0.00 C ATOM 804 O ASP A 52 2.304 19.987 6.812 1.00 0.00 O ATOM 805 CB ASP A 52 1.675 21.935 8.898 1.00 0.00 C ATOM 806 CG ASP A 52 1.786 23.060 9.945 1.00 0.00 C ATOM 807 OD1 ASP A 52 1.264 24.171 9.668 1.00 0.00 O ATOM 808 OD2 ASP A 52 2.355 22.857 11.042 1.00 0.00 O1- ATOM 0 H ASP A 52 4.280 21.693 8.343 1.00 0.00 H new ATOM 0 HA ASP A 52 2.342 20.264 10.059 1.00 0.00 H new ATOM 0 HB2 ASP A 52 1.883 22.361 7.916 1.00 0.00 H new ATOM 0 HB3 ASP A 52 0.643 21.585 8.882 1.00 0.00 H new ATOM 813 N LEU A 53 2.244 18.384 8.389 1.00 0.00 N ATOM 814 CA LEU A 53 2.186 17.258 7.447 1.00 0.00 C ATOM 815 C LEU A 53 0.880 17.259 6.639 1.00 0.00 C ATOM 816 O LEU A 53 0.914 17.147 5.412 1.00 0.00 O ATOM 817 CB LEU A 53 2.349 15.903 8.173 1.00 0.00 C ATOM 818 CG LEU A 53 3.702 15.578 8.832 1.00 0.00 C ATOM 819 CD1 LEU A 53 4.876 15.777 7.872 1.00 0.00 C ATOM 820 CD2 LEU A 53 3.977 16.339 10.126 1.00 0.00 C ATOM 0 H LEU A 53 2.179 18.103 9.367 1.00 0.00 H new ATOM 0 HA LEU A 53 3.019 17.387 6.756 1.00 0.00 H new ATOM 0 HB2 LEU A 53 1.583 15.847 8.946 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.133 15.114 7.453 1.00 0.00 H new ATOM 0 HG LEU A 53 3.615 14.523 9.093 1.00 0.00 H new ATOM 0 HD11 LEU A 53 5.808 15.535 8.382 1.00 0.00 H new ATOM 0 HD12 LEU A 53 4.755 15.123 7.009 1.00 0.00 H new ATOM 0 HD13 LEU A 53 4.903 16.815 7.540 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.951 16.048 10.520 1.00 0.00 H new ATOM 0 HD22 LEU A 53 3.972 17.410 9.926 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.204 16.103 10.858 1.00 0.00 H new ATOM 832 N ARG A 54 -0.265 17.421 7.317 1.00 0.00 N ATOM 833 CA ARG A 54 -1.602 17.392 6.694 1.00 0.00 C ATOM 834 C ARG A 54 -1.817 18.569 5.742 1.00 0.00 C ATOM 835 O ARG A 54 -2.361 18.392 4.649 1.00 0.00 O ATOM 836 CB ARG A 54 -2.660 17.304 7.811 1.00 0.00 C ATOM 837 CG ARG A 54 -4.089 16.954 7.344 1.00 0.00 C ATOM 838 CD ARG A 54 -4.942 18.123 6.825 1.00 0.00 C ATOM 839 NE ARG A 54 -5.162 19.157 7.849 1.00 0.00 N ATOM 840 CZ ARG A 54 -5.752 20.325 7.666 1.00 0.00 C ATOM 841 NH1 ARG A 54 -6.226 20.692 6.510 1.00 0.00 N1+ ATOM 842 NH2 ARG A 54 -5.882 21.156 8.654 1.00 0.00 N ATOM 0 H ARG A 54 -0.292 17.578 8.325 1.00 0.00 H new ATOM 0 HA ARG A 54 -1.697 16.509 6.062 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -2.339 16.554 8.534 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -2.691 18.259 8.335 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -4.017 16.206 6.554 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -4.617 16.489 8.177 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -4.452 18.571 5.960 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -5.905 17.743 6.484 1.00 0.00 H new ATOM 0 HE ARG A 54 -4.827 18.952 8.790 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -6.148 20.069 5.706 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -6.675 21.602 6.409 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -5.528 20.909 9.578 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -6.338 22.056 8.507 1.00 0.00 H new ATOM 856 N SER A 55 -1.349 19.753 6.136 1.00 0.00 N ATOM 857 CA SER A 55 -1.390 20.973 5.317 1.00 0.00 C ATOM 858 C SER A 55 -0.397 20.937 4.144 1.00 0.00 C ATOM 859 O SER A 55 -0.663 21.504 3.079 1.00 0.00 O ATOM 860 CB SER A 55 -1.104 22.177 6.223 1.00 0.00 C ATOM 861 OG SER A 55 -1.252 23.407 5.534 1.00 0.00 O ATOM 0 H SER A 55 -0.922 19.898 7.051 1.00 0.00 H new ATOM 0 HA SER A 55 -2.382 21.052 4.873 1.00 0.00 H new ATOM 0 HB2 SER A 55 -1.780 22.156 7.078 1.00 0.00 H new ATOM 0 HB3 SER A 55 -0.090 22.102 6.617 1.00 0.00 H new ATOM 0 HG SER A 55 -1.063 24.149 6.145 1.00 0.00 H new ATOM 867 N GLY A 56 0.738 20.246 4.309 1.00 0.00 N ATOM 868 CA GLY A 56 1.823 20.188 3.329 1.00 0.00 C ATOM 869 C GLY A 56 2.646 21.475 3.287 1.00 0.00 C ATOM 870 O GLY A 56 3.021 21.938 2.209 1.00 0.00 O ATOM 0 H GLY A 56 0.929 19.700 5.149 1.00 0.00 H new ATOM 0 HA2 GLY A 56 2.478 19.350 3.567 1.00 0.00 H new ATOM 0 HA3 GLY A 56 1.405 19.996 2.341 1.00 0.00 H new ATOM 874 N VAL A 57 2.923 22.070 4.455 1.00 0.00 N ATOM 875 CA VAL A 57 3.625 23.363 4.599 1.00 0.00 C ATOM 876 C VAL A 57 4.687 23.315 5.703 1.00 0.00 C ATOM 877 O VAL A 57 4.441 22.790 6.794 1.00 0.00 O ATOM 878 CB VAL A 57 2.627 24.519 4.847 1.00 0.00 C ATOM 879 CG1 VAL A 57 3.331 25.876 4.992 1.00 0.00 C ATOM 880 CG2 VAL A 57 1.609 24.652 3.708 1.00 0.00 C ATOM 0 H VAL A 57 2.661 21.659 5.351 1.00 0.00 H new ATOM 0 HA VAL A 57 4.139 23.554 3.657 1.00 0.00 H new ATOM 0 HB VAL A 57 2.121 24.262 5.778 1.00 0.00 H new ATOM 0 HG11 VAL A 57 2.588 26.655 5.165 1.00 0.00 H new ATOM 0 HG12 VAL A 57 4.021 25.840 5.835 1.00 0.00 H new ATOM 0 HG13 VAL A 57 3.884 26.098 4.080 1.00 0.00 H new ATOM 0 HG21 VAL A 57 0.928 25.475 3.923 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.133 24.849 2.773 1.00 0.00 H new ATOM 0 HG23 VAL A 57 1.041 23.726 3.617 1.00 0.00 H new ATOM 890 N ILE A 58 5.865 23.874 5.424 1.00 0.00 N ATOM 891 CA ILE A 58 6.998 23.991 6.350 1.00 0.00 C ATOM 892 C ILE A 58 7.400 25.466 6.471 1.00 0.00 C ATOM 893 O ILE A 58 7.755 26.107 5.479 1.00 0.00 O ATOM 894 CB ILE A 58 8.170 23.088 5.898 1.00 0.00 C ATOM 895 CG1 ILE A 58 7.750 21.602 5.924 1.00 0.00 C ATOM 896 CG2 ILE A 58 9.401 23.323 6.798 1.00 0.00 C ATOM 897 CD1 ILE A 58 8.727 20.647 5.228 1.00 0.00 C ATOM 0 H ILE A 58 6.067 24.275 4.508 1.00 0.00 H new ATOM 0 HA ILE A 58 6.707 23.641 7.340 1.00 0.00 H new ATOM 0 HB ILE A 58 8.436 23.348 4.873 1.00 0.00 H new ATOM 0 HG12 ILE A 58 7.635 21.289 6.962 1.00 0.00 H new ATOM 0 HG13 ILE A 58 6.772 21.507 5.452 1.00 0.00 H new ATOM 0 HG21 ILE A 58 10.219 22.682 6.470 1.00 0.00 H new ATOM 0 HG22 ILE A 58 9.708 24.367 6.729 1.00 0.00 H new ATOM 0 HG23 ILE A 58 9.147 23.087 7.831 1.00 0.00 H new ATOM 0 HD11 ILE A 58 8.350 19.627 5.297 1.00 0.00 H new ATOM 0 HD12 ILE A 58 8.825 20.928 4.179 1.00 0.00 H new ATOM 0 HD13 ILE A 58 9.702 20.707 5.712 1.00 0.00 H new ATOM 909 N SER A 59 7.345 26.007 7.689 1.00 0.00 N ATOM 910 CA SER A 59 7.703 27.392 8.010 1.00 0.00 C ATOM 911 C SER A 59 9.136 27.471 8.546 1.00 0.00 C ATOM 912 O SER A 59 9.462 26.805 9.532 1.00 0.00 O ATOM 913 CB SER A 59 6.712 27.954 9.035 1.00 0.00 C ATOM 914 OG SER A 59 7.012 29.300 9.358 1.00 0.00 O ATOM 0 H SER A 59 7.041 25.478 8.506 1.00 0.00 H new ATOM 0 HA SER A 59 7.652 27.991 7.101 1.00 0.00 H new ATOM 0 HB2 SER A 59 5.699 27.891 8.637 1.00 0.00 H new ATOM 0 HB3 SER A 59 6.738 27.346 9.940 1.00 0.00 H new ATOM 0 HG SER A 59 6.362 29.632 10.012 1.00 0.00 H new ATOM 920 N LEU A 60 9.988 28.300 7.925 1.00 0.00 N ATOM 921 CA LEU A 60 11.352 28.603 8.392 1.00 0.00 C ATOM 922 C LEU A 60 11.462 30.070 8.848 1.00 0.00 C ATOM 923 O LEU A 60 10.817 30.956 8.273 1.00 0.00 O ATOM 924 CB LEU A 60 12.418 28.254 7.324 1.00 0.00 C ATOM 925 CG LEU A 60 12.234 26.905 6.602 1.00 0.00 C ATOM 926 CD1 LEU A 60 13.331 26.718 5.557 1.00 0.00 C ATOM 927 CD2 LEU A 60 12.319 25.723 7.560 1.00 0.00 C ATOM 0 H LEU A 60 9.744 28.790 7.065 1.00 0.00 H new ATOM 0 HA LEU A 60 11.554 27.969 9.255 1.00 0.00 H new ATOM 0 HB2 LEU A 60 12.426 29.046 6.575 1.00 0.00 H new ATOM 0 HB3 LEU A 60 13.397 28.257 7.802 1.00 0.00 H new ATOM 0 HG LEU A 60 11.245 26.930 6.145 1.00 0.00 H new ATOM 0 HD11 LEU A 60 13.193 25.762 5.052 1.00 0.00 H new ATOM 0 HD12 LEU A 60 13.279 27.525 4.827 1.00 0.00 H new ATOM 0 HD13 LEU A 60 14.305 26.733 6.046 1.00 0.00 H new ATOM 0 HD21 LEU A 60 12.183 24.795 7.005 1.00 0.00 H new ATOM 0 HD22 LEU A 60 13.295 25.717 8.045 1.00 0.00 H new ATOM 0 HD23 LEU A 60 11.539 25.811 8.316 1.00 0.00 H new ATOM 939 N ILE A 61 12.260 30.320 9.888 1.00 0.00 N ATOM 940 CA ILE A 61 12.323 31.596 10.619 1.00 0.00 C ATOM 941 C ILE A 61 13.771 31.987 10.956 1.00 0.00 C ATOM 942 O ILE A 61 14.668 31.146 10.956 1.00 0.00 O ATOM 943 CB ILE A 61 11.442 31.537 11.895 1.00 0.00 C ATOM 944 CG1 ILE A 61 11.927 30.477 12.915 1.00 0.00 C ATOM 945 CG2 ILE A 61 9.956 31.308 11.555 1.00 0.00 C ATOM 946 CD1 ILE A 61 12.418 31.141 14.196 1.00 0.00 C ATOM 0 H ILE A 61 12.902 29.620 10.260 1.00 0.00 H new ATOM 0 HA ILE A 61 11.927 32.374 9.967 1.00 0.00 H new ATOM 0 HB ILE A 61 11.544 32.514 12.367 1.00 0.00 H new ATOM 0 HG12 ILE A 61 11.113 29.789 13.146 1.00 0.00 H new ATOM 0 HG13 ILE A 61 12.730 29.885 12.476 1.00 0.00 H new ATOM 0 HG21 ILE A 61 9.373 31.273 12.476 1.00 0.00 H new ATOM 0 HG22 ILE A 61 9.596 32.124 10.929 1.00 0.00 H new ATOM 0 HG23 ILE A 61 9.846 30.365 11.020 1.00 0.00 H new ATOM 0 HD11 ILE A 61 12.753 30.376 14.897 1.00 0.00 H new ATOM 0 HD12 ILE A 61 13.247 31.810 13.965 1.00 0.00 H new ATOM 0 HD13 ILE A 61 11.605 31.712 14.644 1.00 0.00 H new ATOM 958 N GLU A 62 14.015 33.265 11.252 1.00 0.00 N ATOM 959 CA GLU A 62 15.337 33.802 11.602 1.00 0.00 C ATOM 960 C GLU A 62 15.801 33.252 12.963 1.00 0.00 C ATOM 961 O GLU A 62 15.087 33.385 13.957 1.00 0.00 O ATOM 962 CB GLU A 62 15.330 35.345 11.625 1.00 0.00 C ATOM 963 CG GLU A 62 14.744 36.018 10.370 1.00 0.00 C ATOM 964 CD GLU A 62 13.260 36.421 10.539 1.00 0.00 C ATOM 965 OE1 GLU A 62 12.926 37.599 10.264 1.00 0.00 O ATOM 966 OE2 GLU A 62 12.424 35.581 10.959 1.00 0.00 O1- ATOM 0 H GLU A 62 13.283 33.975 11.256 1.00 0.00 H new ATOM 0 HA GLU A 62 16.039 33.479 10.833 1.00 0.00 H new ATOM 0 HB2 GLU A 62 14.762 35.677 12.494 1.00 0.00 H new ATOM 0 HB3 GLU A 62 16.353 35.695 11.761 1.00 0.00 H new ATOM 0 HG2 GLU A 62 15.331 36.905 10.132 1.00 0.00 H new ATOM 0 HG3 GLU A 62 14.836 35.338 9.523 1.00 0.00 H new ATOM 1113 N MET B 3 0.975 12.351 6.733 1.00 0.00 N ATOM 1114 CA MET B 3 1.318 12.128 8.143 1.00 0.00 C ATOM 1115 C MET B 3 2.727 11.517 8.252 1.00 0.00 C ATOM 1116 O MET B 3 3.240 10.947 7.286 1.00 0.00 O ATOM 1117 CB MET B 3 0.254 11.229 8.799 1.00 0.00 C ATOM 1118 CG MET B 3 0.177 9.818 8.179 1.00 0.00 C ATOM 1119 SD MET B 3 -1.323 8.877 8.572 1.00 0.00 S ATOM 1120 CE MET B 3 -1.104 8.641 10.348 1.00 0.00 C ATOM 0 HA MET B 3 1.329 13.079 8.675 1.00 0.00 H new ATOM 0 HB2 MET B 3 0.471 11.139 9.863 1.00 0.00 H new ATOM 0 HB3 MET B 3 -0.721 11.710 8.712 1.00 0.00 H new ATOM 0 HG2 MET B 3 0.254 9.911 7.096 1.00 0.00 H new ATOM 0 HG3 MET B 3 1.043 9.245 8.512 1.00 0.00 H new ATOM 0 HE1 MET B 3 -1.947 8.076 10.747 1.00 0.00 H new ATOM 0 HE2 MET B 3 -0.180 8.092 10.531 1.00 0.00 H new ATOM 0 HE3 MET B 3 -1.053 9.612 10.840 1.00 0.00 H new ATOM 1130 N ALA B 4 3.356 11.637 9.424 1.00 0.00 N ATOM 1131 CA ALA B 4 4.744 11.217 9.668 1.00 0.00 C ATOM 1132 C ALA B 4 4.930 10.563 11.050 1.00 0.00 C ATOM 1133 O ALA B 4 3.976 10.423 11.819 1.00 0.00 O ATOM 1134 CB ALA B 4 5.633 12.457 9.484 1.00 0.00 C ATOM 0 H ALA B 4 2.908 12.037 10.249 1.00 0.00 H new ATOM 0 HA ALA B 4 5.028 10.441 8.957 1.00 0.00 H new ATOM 0 HB1 ALA B 4 6.675 12.187 9.657 1.00 0.00 H new ATOM 0 HB2 ALA B 4 5.521 12.838 8.469 1.00 0.00 H new ATOM 0 HB3 ALA B 4 5.335 13.227 10.195 1.00 0.00 H new ATOM 1140 N LYS B 5 6.173 10.198 11.377 1.00 0.00 N ATOM 1141 CA LYS B 5 6.607 9.855 12.742 1.00 0.00 C ATOM 1142 C LYS B 5 7.790 10.722 13.187 1.00 0.00 C ATOM 1143 O LYS B 5 8.689 11.013 12.395 1.00 0.00 O ATOM 1144 CB LYS B 5 6.873 8.349 12.890 1.00 0.00 C ATOM 1145 CG LYS B 5 8.087 7.817 12.102 1.00 0.00 C ATOM 1146 CD LYS B 5 8.243 6.308 12.324 1.00 0.00 C ATOM 1147 CE LYS B 5 9.439 5.709 11.575 1.00 0.00 C ATOM 1148 NZ LYS B 5 10.747 6.126 12.141 1.00 0.00 N1+ ATOM 0 H LYS B 5 6.923 10.130 10.690 1.00 0.00 H new ATOM 0 HA LYS B 5 5.787 10.084 13.423 1.00 0.00 H new ATOM 0 HB2 LYS B 5 7.019 8.124 13.947 1.00 0.00 H new ATOM 0 HB3 LYS B 5 5.985 7.806 12.568 1.00 0.00 H new ATOM 0 HG2 LYS B 5 7.959 8.024 11.040 1.00 0.00 H new ATOM 0 HG3 LYS B 5 8.992 8.334 12.421 1.00 0.00 H new ATOM 0 HD2 LYS B 5 8.356 6.114 13.391 1.00 0.00 H new ATOM 0 HD3 LYS B 5 7.332 5.804 12.003 1.00 0.00 H new ATOM 0 HE2 LYS B 5 9.369 4.622 11.600 1.00 0.00 H new ATOM 0 HE3 LYS B 5 9.391 6.007 10.528 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 11.508 5.564 11.709 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 10.906 7.134 11.942 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 10.745 5.972 13.170 1.00 0.00 H new ATOM 1162 N VAL B 6 7.792 11.122 14.456 1.00 0.00 N ATOM 1163 CA VAL B 6 8.935 11.788 15.105 1.00 0.00 C ATOM 1164 C VAL B 6 9.875 10.747 15.716 1.00 0.00 C ATOM 1165 O VAL B 6 9.410 9.745 16.259 1.00 0.00 O ATOM 1166 CB VAL B 6 8.455 12.832 16.139 1.00 0.00 C ATOM 1167 CG1 VAL B 6 9.514 13.235 17.170 1.00 0.00 C ATOM 1168 CG2 VAL B 6 8.024 14.110 15.412 1.00 0.00 C ATOM 0 H VAL B 6 6.993 10.994 15.077 1.00 0.00 H new ATOM 0 HA VAL B 6 9.501 12.336 14.352 1.00 0.00 H new ATOM 0 HB VAL B 6 7.635 12.352 16.674 1.00 0.00 H new ATOM 0 HG11 VAL B 6 9.093 13.970 17.856 1.00 0.00 H new ATOM 0 HG12 VAL B 6 9.830 12.355 17.730 1.00 0.00 H new ATOM 0 HG13 VAL B 6 10.374 13.667 16.658 1.00 0.00 H new ATOM 0 HG21 VAL B 6 7.685 14.847 16.141 1.00 0.00 H new ATOM 0 HG22 VAL B 6 8.869 14.514 14.854 1.00 0.00 H new ATOM 0 HG23 VAL B 6 7.211 13.880 14.724 1.00 0.00 H new ATOM 1178 N VAL B 7 11.186 11.007 15.664 1.00 0.00 N ATOM 1179 CA VAL B 7 12.241 10.236 16.341 1.00 0.00 C ATOM 1180 C VAL B 7 13.207 11.162 17.092 1.00 0.00 C ATOM 1181 O VAL B 7 13.552 12.248 16.617 1.00 0.00 O ATOM 1182 CB VAL B 7 12.944 9.269 15.362 1.00 0.00 C ATOM 1183 CG1 VAL B 7 13.680 9.978 14.216 1.00 0.00 C ATOM 1184 CG2 VAL B 7 13.952 8.360 16.077 1.00 0.00 C ATOM 0 H VAL B 7 11.559 11.791 15.128 1.00 0.00 H new ATOM 0 HA VAL B 7 11.779 9.605 17.101 1.00 0.00 H new ATOM 0 HB VAL B 7 12.131 8.678 14.940 1.00 0.00 H new ATOM 0 HG11 VAL B 7 14.149 9.236 13.570 1.00 0.00 H new ATOM 0 HG12 VAL B 7 12.969 10.566 13.636 1.00 0.00 H new ATOM 0 HG13 VAL B 7 14.445 10.636 14.627 1.00 0.00 H new ATOM 0 HG21 VAL B 7 14.423 7.697 15.351 1.00 0.00 H new ATOM 0 HG22 VAL B 7 14.715 8.971 16.558 1.00 0.00 H new ATOM 0 HG23 VAL B 7 13.435 7.765 16.830 1.00 0.00 H new ATOM 1194 N LEU B 8 13.631 10.733 18.283 1.00 0.00 N ATOM 1195 CA LEU B 8 14.577 11.423 19.172 1.00 0.00 C ATOM 1196 C LEU B 8 15.347 10.418 20.049 1.00 0.00 C ATOM 1197 O LEU B 8 14.966 9.246 20.149 1.00 0.00 O ATOM 1198 CB LEU B 8 13.816 12.485 19.995 1.00 0.00 C ATOM 1199 CG LEU B 8 12.825 11.943 21.049 1.00 0.00 C ATOM 1200 CD1 LEU B 8 13.443 11.899 22.453 1.00 0.00 C ATOM 1201 CD2 LEU B 8 11.574 12.818 21.128 1.00 0.00 C ATOM 0 H LEU B 8 13.309 9.849 18.677 1.00 0.00 H new ATOM 0 HA LEU B 8 15.333 11.939 18.580 1.00 0.00 H new ATOM 0 HB2 LEU B 8 14.547 13.115 20.502 1.00 0.00 H new ATOM 0 HB3 LEU B 8 13.267 13.126 19.305 1.00 0.00 H new ATOM 0 HG LEU B 8 12.570 10.933 20.728 1.00 0.00 H new ATOM 0 HD11 LEU B 8 12.710 11.512 23.161 1.00 0.00 H new ATOM 0 HD12 LEU B 8 14.319 11.250 22.445 1.00 0.00 H new ATOM 0 HD13 LEU B 8 13.740 12.904 22.752 1.00 0.00 H new ATOM 0 HD21 LEU B 8 10.894 12.413 21.878 1.00 0.00 H new ATOM 0 HD22 LEU B 8 11.857 13.833 21.405 1.00 0.00 H new ATOM 0 HD23 LEU B 8 11.078 12.832 20.158 1.00 0.00 H new ATOM 1309 N VAL B 16 13.553 6.948 21.234 1.00 0.00 N ATOM 1310 CA VAL B 16 12.138 7.307 21.475 1.00 0.00 C ATOM 1311 C VAL B 16 11.475 7.748 20.166 1.00 0.00 C ATOM 1312 O VAL B 16 12.095 8.421 19.338 1.00 0.00 O ATOM 1313 CB VAL B 16 12.042 8.407 22.558 1.00 0.00 C ATOM 1314 CG1 VAL B 16 10.641 9.016 22.717 1.00 0.00 C ATOM 1315 CG2 VAL B 16 12.469 7.883 23.936 1.00 0.00 C ATOM 0 HA VAL B 16 11.603 6.431 21.842 1.00 0.00 H new ATOM 0 HB VAL B 16 12.719 9.184 22.202 1.00 0.00 H new ATOM 0 HG11 VAL B 16 10.662 9.778 23.496 1.00 0.00 H new ATOM 0 HG12 VAL B 16 10.332 9.468 21.775 1.00 0.00 H new ATOM 0 HG13 VAL B 16 9.934 8.234 22.993 1.00 0.00 H new ATOM 0 HG21 VAL B 16 12.388 8.684 24.671 1.00 0.00 H new ATOM 0 HG22 VAL B 16 11.821 7.056 24.228 1.00 0.00 H new ATOM 0 HG23 VAL B 16 13.501 7.536 23.889 1.00 0.00 H new ATOM 1325 N GLU B 17 10.211 7.377 19.973 1.00 0.00 N ATOM 1326 CA GLU B 17 9.418 7.703 18.780 1.00 0.00 C ATOM 1327 C GLU B 17 7.959 8.065 19.120 1.00 0.00 C ATOM 1328 O GLU B 17 7.399 7.584 20.110 1.00 0.00 O ATOM 1329 CB GLU B 17 9.430 6.540 17.771 1.00 0.00 C ATOM 1330 CG GLU B 17 10.801 6.285 17.130 1.00 0.00 C ATOM 1331 CD GLU B 17 10.713 5.242 15.997 1.00 0.00 C ATOM 1332 OE1 GLU B 17 11.089 5.570 14.844 1.00 0.00 O ATOM 1333 OE2 GLU B 17 10.276 4.092 16.245 1.00 0.00 O1- ATOM 0 H GLU B 17 9.692 6.827 20.658 1.00 0.00 H new ATOM 0 HA GLU B 17 9.889 8.579 18.335 1.00 0.00 H new ATOM 0 HB2 GLU B 17 9.101 5.631 18.275 1.00 0.00 H new ATOM 0 HB3 GLU B 17 8.705 6.748 16.984 1.00 0.00 H new ATOM 0 HG2 GLU B 17 11.198 7.220 16.735 1.00 0.00 H new ATOM 0 HG3 GLU B 17 11.500 5.938 17.891 1.00 0.00 H new ATOM 1340 N ILE B 18 7.340 8.884 18.263 1.00 0.00 N ATOM 1341 CA ILE B 18 5.906 9.221 18.277 1.00 0.00 C ATOM 1342 C ILE B 18 5.330 8.956 16.881 1.00 0.00 C ATOM 1343 O ILE B 18 5.814 9.523 15.901 1.00 0.00 O ATOM 1344 CB ILE B 18 5.672 10.689 18.704 1.00 0.00 C ATOM 1345 CG1 ILE B 18 6.233 10.988 20.113 1.00 0.00 C ATOM 1346 CG2 ILE B 18 4.174 11.053 18.647 1.00 0.00 C ATOM 1347 CD1 ILE B 18 6.439 12.484 20.370 1.00 0.00 C ATOM 0 H ILE B 18 7.842 9.351 17.508 1.00 0.00 H new ATOM 0 HA ILE B 18 5.397 8.597 19.011 1.00 0.00 H new ATOM 0 HB ILE B 18 6.216 11.308 17.991 1.00 0.00 H new ATOM 0 HG12 ILE B 18 5.551 10.587 20.862 1.00 0.00 H new ATOM 0 HG13 ILE B 18 7.184 10.469 20.237 1.00 0.00 H new ATOM 0 HG21 ILE B 18 4.040 12.091 18.952 1.00 0.00 H new ATOM 0 HG22 ILE B 18 3.807 10.924 17.629 1.00 0.00 H new ATOM 0 HG23 ILE B 18 3.615 10.402 19.319 1.00 0.00 H new ATOM 0 HD11 ILE B 18 6.834 12.629 21.375 1.00 0.00 H new ATOM 0 HD12 ILE B 18 7.144 12.885 19.641 1.00 0.00 H new ATOM 0 HD13 ILE B 18 5.486 13.004 20.276 1.00 0.00 H new ATOM 1359 N GLY B 19 4.301 8.108 16.788 1.00 0.00 N ATOM 1360 CA GLY B 19 3.595 7.786 15.540 1.00 0.00 C ATOM 1361 C GLY B 19 2.408 8.710 15.227 1.00 0.00 C ATOM 1362 O GLY B 19 1.919 9.442 16.088 1.00 0.00 O ATOM 0 H GLY B 19 3.925 7.613 17.597 1.00 0.00 H new ATOM 0 HA2 GLY B 19 4.304 7.832 14.713 1.00 0.00 H new ATOM 0 HA3 GLY B 19 3.236 6.758 15.595 1.00 0.00 H new ATOM 1366 N ASP B 20 1.935 8.647 13.982 1.00 0.00 N ATOM 1367 CA ASP B 20 0.751 9.361 13.458 1.00 0.00 C ATOM 1368 C ASP B 20 0.796 10.889 13.687 1.00 0.00 C ATOM 1369 O ASP B 20 -0.210 11.514 14.024 1.00 0.00 O ATOM 1370 CB ASP B 20 -0.567 8.705 13.924 1.00 0.00 C ATOM 1371 CG ASP B 20 -0.573 7.165 13.864 1.00 0.00 C ATOM 1372 OD1 ASP B 20 -1.186 6.534 14.756 1.00 0.00 O ATOM 1373 OD2 ASP B 20 -0.004 6.571 12.917 1.00 0.00 O1- ATOM 0 H ASP B 20 2.383 8.071 13.270 1.00 0.00 H new ATOM 0 HA ASP B 20 0.783 9.252 12.374 1.00 0.00 H new ATOM 0 HB2 ASP B 20 -0.770 9.016 14.949 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -1.383 9.083 13.308 1.00 0.00 H new ATOM 1378 N VAL B 21 1.978 11.488 13.533 1.00 0.00 N ATOM 1379 CA VAL B 21 2.221 12.928 13.732 1.00 0.00 C ATOM 1380 C VAL B 21 1.573 13.746 12.613 1.00 0.00 C ATOM 1381 O VAL B 21 1.776 13.477 11.425 1.00 0.00 O ATOM 1382 CB VAL B 21 3.732 13.223 13.851 1.00 0.00 C ATOM 1383 CG1 VAL B 21 4.016 14.715 14.013 1.00 0.00 C ATOM 1384 CG2 VAL B 21 4.309 12.501 15.077 1.00 0.00 C ATOM 0 H VAL B 21 2.817 10.977 13.260 1.00 0.00 H new ATOM 0 HA VAL B 21 1.757 13.227 14.672 1.00 0.00 H new ATOM 0 HB VAL B 21 4.196 12.872 12.929 1.00 0.00 H new ATOM 0 HG11 VAL B 21 5.091 14.874 14.093 1.00 0.00 H new ATOM 0 HG12 VAL B 21 3.633 15.254 13.147 1.00 0.00 H new ATOM 0 HG13 VAL B 21 3.527 15.083 14.915 1.00 0.00 H new ATOM 0 HG21 VAL B 21 5.375 12.713 15.156 1.00 0.00 H new ATOM 0 HG22 VAL B 21 3.802 12.850 15.977 1.00 0.00 H new ATOM 0 HG23 VAL B 21 4.160 11.427 14.970 1.00 0.00 H new ATOM 1394 N LEU B 22 0.798 14.756 13.014 1.00 0.00 N ATOM 1395 CA LEU B 22 0.080 15.681 12.134 1.00 0.00 C ATOM 1396 C LEU B 22 0.832 17.009 11.961 1.00 0.00 C ATOM 1397 O LEU B 22 0.809 17.590 10.875 1.00 0.00 O ATOM 1398 CB LEU B 22 -1.322 15.916 12.735 1.00 0.00 C ATOM 1399 CG LEU B 22 -2.372 16.363 11.706 1.00 0.00 C ATOM 1400 CD1 LEU B 22 -2.875 15.172 10.894 1.00 0.00 C ATOM 1401 CD2 LEU B 22 -3.561 17.022 12.404 1.00 0.00 C ATOM 0 H LEU B 22 0.647 14.960 14.002 1.00 0.00 H new ATOM 0 HA LEU B 22 -0.001 15.244 11.139 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -1.662 14.996 13.211 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -1.249 16.671 13.518 1.00 0.00 H new ATOM 0 HG LEU B 22 -1.896 17.081 11.039 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -3.617 15.512 10.172 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -2.039 14.712 10.366 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -3.328 14.441 11.563 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -4.294 17.332 11.659 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -4.020 16.311 13.091 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -3.218 17.894 12.961 1.00 0.00 H new ATOM 1413 N GLU B 23 1.523 17.473 13.009 1.00 0.00 N ATOM 1414 CA GLU B 23 2.393 18.654 12.981 1.00 0.00 C ATOM 1415 C GLU B 23 3.436 18.683 14.118 1.00 0.00 C ATOM 1416 O GLU B 23 3.234 18.106 15.192 1.00 0.00 O ATOM 1417 CB GLU B 23 1.548 19.946 12.959 1.00 0.00 C ATOM 1418 CG GLU B 23 0.645 20.151 14.187 1.00 0.00 C ATOM 1419 CD GLU B 23 -0.345 21.323 13.988 1.00 0.00 C ATOM 1420 OE1 GLU B 23 -0.406 22.216 14.867 1.00 0.00 O ATOM 1421 OE2 GLU B 23 -1.107 21.337 12.993 1.00 0.00 O1- ATOM 0 H GLU B 23 1.491 17.025 13.925 1.00 0.00 H new ATOM 0 HA GLU B 23 2.971 18.591 12.059 1.00 0.00 H new ATOM 0 HB2 GLU B 23 2.219 20.800 12.873 1.00 0.00 H new ATOM 0 HB3 GLU B 23 0.925 19.940 12.065 1.00 0.00 H new ATOM 0 HG2 GLU B 23 0.088 19.235 14.384 1.00 0.00 H new ATOM 0 HG3 GLU B 23 1.263 20.343 15.064 1.00 0.00 H new ATOM 1428 N VAL B 24 4.554 19.379 13.879 1.00 0.00 N ATOM 1429 CA VAL B 24 5.696 19.566 14.806 1.00 0.00 C ATOM 1430 C VAL B 24 6.100 21.042 14.848 1.00 0.00 C ATOM 1431 O VAL B 24 6.046 21.721 13.822 1.00 0.00 O ATOM 1432 CB VAL B 24 6.899 18.688 14.399 1.00 0.00 C ATOM 1433 CG1 VAL B 24 8.076 18.784 15.381 1.00 0.00 C ATOM 1434 CG2 VAL B 24 6.517 17.206 14.301 1.00 0.00 C ATOM 0 H VAL B 24 4.702 19.855 12.989 1.00 0.00 H new ATOM 0 HA VAL B 24 5.381 19.255 15.802 1.00 0.00 H new ATOM 0 HB VAL B 24 7.202 19.076 13.427 1.00 0.00 H new ATOM 0 HG11 VAL B 24 8.889 18.144 15.038 1.00 0.00 H new ATOM 0 HG12 VAL B 24 8.424 19.816 15.432 1.00 0.00 H new ATOM 0 HG13 VAL B 24 7.752 18.461 16.370 1.00 0.00 H new ATOM 0 HG21 VAL B 24 7.392 16.623 14.012 1.00 0.00 H new ATOM 0 HG22 VAL B 24 6.153 16.859 15.268 1.00 0.00 H new ATOM 0 HG23 VAL B 24 5.734 17.081 13.553 1.00 0.00 H new ATOM 1444 N ARG B 25 6.497 21.551 16.024 1.00 0.00 N ATOM 1445 CA ARG B 25 6.752 22.981 16.280 1.00 0.00 C ATOM 1446 C ARG B 25 8.028 23.186 17.102 1.00 0.00 C ATOM 1447 O ARG B 25 8.189 22.535 18.135 1.00 0.00 O ATOM 1448 CB ARG B 25 5.556 23.621 17.019 1.00 0.00 C ATOM 1449 CG ARG B 25 4.169 23.210 16.503 1.00 0.00 C ATOM 1450 CD ARG B 25 3.054 23.912 17.285 1.00 0.00 C ATOM 1451 NE ARG B 25 1.763 23.219 17.105 1.00 0.00 N ATOM 1452 CZ ARG B 25 1.308 22.184 17.788 1.00 0.00 C ATOM 1453 NH1 ARG B 25 1.953 21.641 18.778 1.00 0.00 N1+ ATOM 1454 NH2 ARG B 25 0.178 21.644 17.483 1.00 0.00 N ATOM 0 H ARG B 25 6.654 20.967 16.845 1.00 0.00 H new ATOM 0 HA ARG B 25 6.883 23.465 15.312 1.00 0.00 H new ATOM 0 HB2 ARG B 25 5.623 23.363 18.076 1.00 0.00 H new ATOM 0 HB3 ARG B 25 5.645 24.705 16.949 1.00 0.00 H new ATOM 0 HG2 ARG B 25 4.085 23.456 15.445 1.00 0.00 H new ATOM 0 HG3 ARG B 25 4.052 22.130 16.589 1.00 0.00 H new ATOM 0 HD2 ARG B 25 3.311 23.941 18.344 1.00 0.00 H new ATOM 0 HD3 ARG B 25 2.966 24.946 16.950 1.00 0.00 H new ATOM 0 HE ARG B 25 1.154 23.580 16.371 1.00 0.00 H new ATOM 0 HH11 ARG B 25 2.859 22.014 19.062 1.00 0.00 H new ATOM 0 HH12 ARG B 25 1.553 20.842 19.270 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -0.372 22.016 16.709 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -0.166 20.845 18.016 1.00 0.00 H new ATOM 1468 N ALA B 26 8.902 24.098 16.680 1.00 0.00 N ATOM 1469 CA ALA B 26 10.054 24.558 17.465 1.00 0.00 C ATOM 1470 C ALA B 26 9.708 25.856 18.220 1.00 0.00 C ATOM 1471 O ALA B 26 9.290 26.854 17.621 1.00 0.00 O ATOM 1472 CB ALA B 26 11.245 24.760 16.533 1.00 0.00 C ATOM 0 H ALA B 26 8.831 24.548 15.767 1.00 0.00 H new ATOM 0 HA ALA B 26 10.314 23.806 18.210 1.00 0.00 H new ATOM 0 HB1 ALA B 26 12.104 25.102 17.110 1.00 0.00 H new ATOM 0 HB2 ALA B 26 11.488 23.817 16.044 1.00 0.00 H new ATOM 0 HB3 ALA B 26 10.994 25.506 15.779 1.00 0.00 H new ATOM 1478 N GLU B 27 9.884 25.853 19.538 1.00 0.00 N ATOM 1479 CA GLU B 27 9.677 27.001 20.435 1.00 0.00 C ATOM 1480 C GLU B 27 11.027 27.562 20.925 1.00 0.00 C ATOM 1481 O GLU B 27 12.099 27.091 20.523 1.00 0.00 O ATOM 1482 CB GLU B 27 8.782 26.571 21.621 1.00 0.00 C ATOM 1483 CG GLU B 27 7.485 25.814 21.277 1.00 0.00 C ATOM 1484 CD GLU B 27 6.407 26.651 20.547 1.00 0.00 C ATOM 1485 OE1 GLU B 27 5.211 26.537 20.910 1.00 0.00 O ATOM 1486 OE2 GLU B 27 6.715 27.396 19.585 1.00 0.00 O1- ATOM 0 H GLU B 27 10.188 25.018 20.038 1.00 0.00 H new ATOM 0 HA GLU B 27 9.174 27.799 19.889 1.00 0.00 H new ATOM 0 HB2 GLU B 27 9.376 25.942 22.284 1.00 0.00 H new ATOM 0 HB3 GLU B 27 8.514 27.464 22.185 1.00 0.00 H new ATOM 0 HG2 GLU B 27 7.738 24.956 20.655 1.00 0.00 H new ATOM 0 HG3 GLU B 27 7.056 25.423 22.200 1.00 0.00 H new ATOM 1493 N GLY B 28 11.002 28.563 21.813 1.00 0.00 N ATOM 1494 CA GLY B 28 12.196 29.129 22.455 1.00 0.00 C ATOM 1495 C GLY B 28 12.898 28.147 23.406 1.00 0.00 C ATOM 1496 O GLY B 28 12.675 28.192 24.619 1.00 0.00 O ATOM 0 H GLY B 28 10.136 29.011 22.111 1.00 0.00 H new ATOM 0 HA2 GLY B 28 12.900 29.444 21.684 1.00 0.00 H new ATOM 0 HA3 GLY B 28 11.912 30.022 23.011 1.00 0.00 H new ATOM 1500 N GLY B 29 13.722 27.251 22.852 1.00 0.00 N ATOM 1501 CA GLY B 29 14.488 26.240 23.591 1.00 0.00 C ATOM 1502 C GLY B 29 13.743 24.919 23.847 1.00 0.00 C ATOM 1503 O GLY B 29 14.078 24.213 24.801 1.00 0.00 O ATOM 0 H GLY B 29 13.880 27.208 21.845 1.00 0.00 H new ATOM 0 HA2 GLY B 29 15.402 26.023 23.038 1.00 0.00 H new ATOM 0 HA3 GLY B 29 14.788 26.662 24.550 1.00 0.00 H new ATOM 1507 N ALA B 30 12.734 24.587 23.037 1.00 0.00 N ATOM 1508 CA ALA B 30 11.930 23.365 23.158 1.00 0.00 C ATOM 1509 C ALA B 30 11.300 22.933 21.820 1.00 0.00 C ATOM 1510 O ALA B 30 11.207 23.725 20.882 1.00 0.00 O ATOM 1511 CB ALA B 30 10.842 23.610 24.220 1.00 0.00 C ATOM 0 H ALA B 30 12.445 25.177 22.257 1.00 0.00 H new ATOM 0 HA ALA B 30 12.584 22.546 23.459 1.00 0.00 H new ATOM 0 HB1 ALA B 30 10.231 22.714 24.328 1.00 0.00 H new ATOM 0 HB2 ALA B 30 11.312 23.846 25.175 1.00 0.00 H new ATOM 0 HB3 ALA B 30 10.212 24.444 23.910 1.00 0.00 H new ATOM 1517 N VAL B 31 10.797 21.697 21.752 1.00 0.00 N ATOM 1518 CA VAL B 31 9.944 21.184 20.655 1.00 0.00 C ATOM 1519 C VAL B 31 8.595 20.695 21.179 1.00 0.00 C ATOM 1520 O VAL B 31 8.517 20.134 22.276 1.00 0.00 O ATOM 1521 CB VAL B 31 10.667 20.087 19.842 1.00 0.00 C ATOM 1522 CG1 VAL B 31 9.773 19.360 18.827 1.00 0.00 C ATOM 1523 CG2 VAL B 31 11.810 20.711 19.040 1.00 0.00 C ATOM 0 H VAL B 31 10.972 20.999 22.475 1.00 0.00 H new ATOM 0 HA VAL B 31 9.749 22.015 19.977 1.00 0.00 H new ATOM 0 HB VAL B 31 11.007 19.363 20.582 1.00 0.00 H new ATOM 0 HG11 VAL B 31 10.359 18.607 18.300 1.00 0.00 H new ATOM 0 HG12 VAL B 31 8.947 18.877 19.350 1.00 0.00 H new ATOM 0 HG13 VAL B 31 9.377 20.079 18.110 1.00 0.00 H new ATOM 0 HG21 VAL B 31 12.319 19.935 18.467 1.00 0.00 H new ATOM 0 HG22 VAL B 31 11.409 21.461 18.358 1.00 0.00 H new ATOM 0 HG23 VAL B 31 12.518 21.182 19.722 1.00 0.00 H new ATOM 1533 N ARG B 32 7.534 20.868 20.379 1.00 0.00 N ATOM 1534 CA ARG B 32 6.203 20.263 20.563 1.00 0.00 C ATOM 1535 C ARG B 32 5.837 19.385 19.363 1.00 0.00 C ATOM 1536 O ARG B 32 6.201 19.695 18.226 1.00 0.00 O ATOM 1537 CB ARG B 32 5.152 21.359 20.762 1.00 0.00 C ATOM 1538 CG ARG B 32 5.309 22.135 22.080 1.00 0.00 C ATOM 1539 CD ARG B 32 4.555 23.464 22.009 1.00 0.00 C ATOM 1540 NE ARG B 32 3.111 23.288 21.780 1.00 0.00 N ATOM 1541 CZ ARG B 32 2.256 24.205 21.379 1.00 0.00 C ATOM 1542 NH1 ARG B 32 2.603 25.428 21.090 1.00 0.00 N1+ ATOM 1543 NH2 ARG B 32 1.009 23.872 21.252 1.00 0.00 N ATOM 0 H ARG B 32 7.580 21.459 19.549 1.00 0.00 H new ATOM 0 HA ARG B 32 6.228 19.632 21.452 1.00 0.00 H new ATOM 0 HB2 ARG B 32 5.209 22.060 19.929 1.00 0.00 H new ATOM 0 HB3 ARG B 32 4.160 20.908 20.732 1.00 0.00 H new ATOM 0 HG2 ARG B 32 4.929 21.538 22.909 1.00 0.00 H new ATOM 0 HG3 ARG B 32 6.365 22.319 22.278 1.00 0.00 H new ATOM 0 HD2 ARG B 32 4.707 24.013 22.938 1.00 0.00 H new ATOM 0 HD3 ARG B 32 4.974 24.072 21.207 1.00 0.00 H new ATOM 0 HE ARG B 32 2.733 22.356 21.950 1.00 0.00 H new ATOM 0 HH11 ARG B 32 3.579 25.714 21.170 1.00 0.00 H new ATOM 0 HH12 ARG B 32 1.899 26.099 20.784 1.00 0.00 H new ATOM 0 HH21 ARG B 32 0.712 22.919 21.461 1.00 0.00 H new ATOM 0 HH22 ARG B 32 0.325 24.563 20.943 1.00 0.00 H new ATOM 1557 N VAL B 33 5.071 18.326 19.615 1.00 0.00 N ATOM 1558 CA VAL B 33 4.615 17.332 18.626 1.00 0.00 C ATOM 1559 C VAL B 33 3.127 17.055 18.833 1.00 0.00 C ATOM 1560 O VAL B 33 2.727 16.744 19.955 1.00 0.00 O ATOM 1561 CB VAL B 33 5.416 16.017 18.766 1.00 0.00 C ATOM 1562 CG1 VAL B 33 4.983 14.964 17.737 1.00 0.00 C ATOM 1563 CG2 VAL B 33 6.927 16.231 18.620 1.00 0.00 C ATOM 0 H VAL B 33 4.732 18.121 20.555 1.00 0.00 H new ATOM 0 HA VAL B 33 4.779 17.731 17.625 1.00 0.00 H new ATOM 0 HB VAL B 33 5.198 15.660 19.772 1.00 0.00 H new ATOM 0 HG11 VAL B 33 5.573 14.058 17.874 1.00 0.00 H new ATOM 0 HG12 VAL B 33 3.927 14.734 17.875 1.00 0.00 H new ATOM 0 HG13 VAL B 33 5.142 15.352 16.731 1.00 0.00 H new ATOM 0 HG21 VAL B 33 7.442 15.276 18.727 1.00 0.00 H new ATOM 0 HG22 VAL B 33 7.142 16.651 17.637 1.00 0.00 H new ATOM 0 HG23 VAL B 33 7.273 16.918 19.392 1.00 0.00 H new ATOM 1573 N THR B 34 2.312 17.130 17.778 1.00 0.00 N ATOM 1574 CA THR B 34 0.858 16.866 17.843 1.00 0.00 C ATOM 1575 C THR B 34 0.444 15.793 16.841 1.00 0.00 C ATOM 1576 O THR B 34 0.824 15.832 15.670 1.00 0.00 O ATOM 1577 CB THR B 34 0.047 18.160 17.659 1.00 0.00 C ATOM 1578 OG1 THR B 34 0.318 19.059 18.718 1.00 0.00 O ATOM 1579 CG2 THR B 34 -1.471 17.949 17.660 1.00 0.00 C ATOM 0 H THR B 34 2.638 17.377 16.843 1.00 0.00 H new ATOM 0 HA THR B 34 0.634 16.482 18.838 1.00 0.00 H new ATOM 0 HB THR B 34 0.351 18.545 16.686 1.00 0.00 H new ATOM 0 HG1 THR B 34 -0.512 19.258 19.199 1.00 0.00 H new ATOM 0 HG21 THR B 34 -1.972 18.908 17.525 1.00 0.00 H new ATOM 0 HG22 THR B 34 -1.746 17.279 16.846 1.00 0.00 H new ATOM 0 HG23 THR B 34 -1.777 17.510 18.610 1.00 0.00 H new ATOM 1587 N THR B 35 -0.339 14.819 17.308 1.00 0.00 N ATOM 1588 CA THR B 35 -0.804 13.660 16.528 1.00 0.00 C ATOM 1589 C THR B 35 -2.148 13.902 15.823 1.00 0.00 C ATOM 1590 O THR B 35 -2.917 14.805 16.171 1.00 0.00 O ATOM 1591 CB THR B 35 -0.911 12.397 17.404 1.00 0.00 C ATOM 1592 OG1 THR B 35 -1.971 12.530 18.330 1.00 0.00 O ATOM 1593 CG2 THR B 35 0.373 12.084 18.172 1.00 0.00 C ATOM 0 H THR B 35 -0.680 14.810 18.269 1.00 0.00 H new ATOM 0 HA THR B 35 -0.048 13.510 15.758 1.00 0.00 H new ATOM 0 HB THR B 35 -1.097 11.571 16.718 1.00 0.00 H new ATOM 0 HG1 THR B 35 -1.764 13.249 18.963 1.00 0.00 H new ATOM 0 HG21 THR B 35 0.230 11.183 18.769 1.00 0.00 H new ATOM 0 HG22 THR B 35 1.189 11.926 17.467 1.00 0.00 H new ATOM 0 HG23 THR B 35 0.617 12.919 18.829 1.00 0.00 H new ATOM 1601 N LEU B 36 -2.453 13.033 14.854 1.00 0.00 N ATOM 1602 CA LEU B 36 -3.726 12.932 14.136 1.00 0.00 C ATOM 1603 C LEU B 36 -4.928 12.613 15.056 1.00 0.00 C ATOM 1604 O LEU B 36 -6.077 12.853 14.683 1.00 0.00 O ATOM 1605 CB LEU B 36 -3.485 11.853 13.062 1.00 0.00 C ATOM 1606 CG LEU B 36 -4.687 11.387 12.215 1.00 0.00 C ATOM 1607 CD1 LEU B 36 -5.390 12.517 11.463 1.00 0.00 C ATOM 1608 CD2 LEU B 36 -4.174 10.410 11.158 1.00 0.00 C ATOM 0 H LEU B 36 -1.777 12.341 14.531 1.00 0.00 H new ATOM 0 HA LEU B 36 -4.009 13.887 13.693 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -2.722 12.227 12.380 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -3.067 10.977 13.558 1.00 0.00 H new ATOM 0 HG LEU B 36 -5.403 10.947 12.909 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -6.224 12.110 10.891 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -5.764 13.251 12.176 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -4.684 12.997 10.785 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -5.007 10.066 10.546 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -3.441 10.910 10.525 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -3.707 9.556 11.648 1.00 0.00 H new ATOM 1620 N PHE B 37 -4.669 12.098 16.263 1.00 0.00 N ATOM 1621 CA PHE B 37 -5.672 11.728 17.273 1.00 0.00 C ATOM 1622 C PHE B 37 -5.716 12.705 18.470 1.00 0.00 C ATOM 1623 O PHE B 37 -6.203 12.363 19.547 1.00 0.00 O ATOM 1624 CB PHE B 37 -5.480 10.247 17.631 1.00 0.00 C ATOM 1625 CG PHE B 37 -5.548 9.351 16.404 1.00 0.00 C ATOM 1626 CD1 PHE B 37 -6.798 9.060 15.823 1.00 0.00 C ATOM 1627 CD2 PHE B 37 -4.371 8.907 15.775 1.00 0.00 C ATOM 1628 CE1 PHE B 37 -6.871 8.340 14.615 1.00 0.00 C ATOM 1629 CE2 PHE B 37 -4.441 8.192 14.565 1.00 0.00 C ATOM 1630 CZ PHE B 37 -5.690 7.907 13.985 1.00 0.00 C ATOM 0 H PHE B 37 -3.715 11.919 16.578 1.00 0.00 H new ATOM 0 HA PHE B 37 -6.675 11.832 16.860 1.00 0.00 H new ATOM 0 HB2 PHE B 37 -4.517 10.115 18.123 1.00 0.00 H new ATOM 0 HB3 PHE B 37 -6.247 9.944 18.344 1.00 0.00 H new ATOM 0 HD1 PHE B 37 -7.705 9.391 16.307 1.00 0.00 H new ATOM 0 HD2 PHE B 37 -3.410 9.115 16.222 1.00 0.00 H new ATOM 0 HE1 PHE B 37 -7.832 8.121 14.173 1.00 0.00 H new ATOM 0 HE2 PHE B 37 -3.534 7.862 14.081 1.00 0.00 H new ATOM 0 HZ PHE B 37 -5.742 7.357 13.057 1.00 0.00 H new ATOM 1640 N ASP B 38 -5.236 13.938 18.262 1.00 0.00 N ATOM 1641 CA ASP B 38 -5.260 15.078 19.193 1.00 0.00 C ATOM 1642 C ASP B 38 -4.475 14.902 20.513 1.00 0.00 C ATOM 1643 O ASP B 38 -4.614 15.712 21.433 1.00 0.00 O ATOM 1644 CB ASP B 38 -6.700 15.587 19.423 1.00 0.00 C ATOM 1645 CG ASP B 38 -7.497 15.867 18.137 1.00 0.00 C ATOM 1646 OD1 ASP B 38 -6.913 16.321 17.122 1.00 0.00 O ATOM 1647 OD2 ASP B 38 -8.737 15.688 18.151 1.00 0.00 O1- ATOM 0 H ASP B 38 -4.790 14.184 17.379 1.00 0.00 H new ATOM 0 HA ASP B 38 -4.693 15.854 18.679 1.00 0.00 H new ATOM 0 HB2 ASP B 38 -7.241 14.850 20.016 1.00 0.00 H new ATOM 0 HB3 ASP B 38 -6.657 16.502 20.014 1.00 0.00 H new ATOM 1652 N GLU B 39 -3.611 13.888 20.615 1.00 0.00 N ATOM 1653 CA GLU B 39 -2.575 13.809 21.656 1.00 0.00 C ATOM 1654 C GLU B 39 -1.407 14.768 21.343 1.00 0.00 C ATOM 1655 O GLU B 39 -1.035 14.941 20.179 1.00 0.00 O ATOM 1656 CB GLU B 39 -2.045 12.372 21.828 1.00 0.00 C ATOM 1657 CG GLU B 39 -3.121 11.323 22.155 1.00 0.00 C ATOM 1658 CD GLU B 39 -3.928 11.631 23.434 1.00 0.00 C ATOM 1659 OE1 GLU B 39 -3.377 12.219 24.398 1.00 0.00 O ATOM 1660 OE2 GLU B 39 -5.124 11.241 23.503 1.00 0.00 O1- ATOM 0 H GLU B 39 -3.608 13.093 19.976 1.00 0.00 H new ATOM 0 HA GLU B 39 -3.040 14.111 22.594 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -1.535 12.076 20.911 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -1.299 12.367 22.623 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -3.809 11.248 21.313 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -2.644 10.349 22.264 1.00 0.00 H new ATOM 1667 N GLU B 40 -0.808 15.369 22.377 1.00 0.00 N ATOM 1668 CA GLU B 40 0.326 16.301 22.274 1.00 0.00 C ATOM 1669 C GLU B 40 1.462 15.914 23.231 1.00 0.00 C ATOM 1670 O GLU B 40 1.232 15.464 24.356 1.00 0.00 O ATOM 1671 CB GLU B 40 -0.159 17.746 22.507 1.00 0.00 C ATOM 1672 CG GLU B 40 0.952 18.803 22.364 1.00 0.00 C ATOM 1673 CD GLU B 40 0.441 20.256 22.387 1.00 0.00 C ATOM 1674 OE1 GLU B 40 1.131 21.136 21.810 1.00 0.00 O ATOM 1675 OE2 GLU B 40 -0.618 20.553 22.998 1.00 0.00 O1- ATOM 0 H GLU B 40 -1.107 15.217 23.340 1.00 0.00 H new ATOM 0 HA GLU B 40 0.738 16.239 21.267 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -0.956 17.971 21.798 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -0.591 17.818 23.505 1.00 0.00 H new ATOM 0 HG2 GLU B 40 1.673 18.669 23.171 1.00 0.00 H new ATOM 0 HG3 GLU B 40 1.485 18.631 21.429 1.00 0.00 H new ATOM 1682 N HIS B 41 2.696 16.126 22.778 1.00 0.00 N ATOM 1683 CA HIS B 41 3.947 15.874 23.502 1.00 0.00 C ATOM 1684 C HIS B 41 4.852 17.111 23.446 1.00 0.00 C ATOM 1685 O HIS B 41 4.838 17.849 22.457 1.00 0.00 O ATOM 1686 CB HIS B 41 4.658 14.646 22.908 1.00 0.00 C ATOM 1687 CG HIS B 41 3.777 13.430 22.745 1.00 0.00 C ATOM 1688 ND1 HIS B 41 3.531 12.466 23.725 1.00 0.00 N ATOM 1689 CD2 HIS B 41 3.042 13.126 21.631 1.00 0.00 C ATOM 1690 CE1 HIS B 41 2.661 11.598 23.177 1.00 0.00 C ATOM 1691 NE2 HIS B 41 2.351 11.970 21.921 1.00 0.00 N ATOM 0 H HIS B 41 2.862 16.499 21.843 1.00 0.00 H new ATOM 0 HA HIS B 41 3.719 15.668 24.548 1.00 0.00 H new ATOM 0 HB2 HIS B 41 5.068 14.915 21.935 1.00 0.00 H new ATOM 0 HB3 HIS B 41 5.501 14.385 23.548 1.00 0.00 H new ATOM 0 HD2 HIS B 41 3.010 13.683 20.706 1.00 0.00 H new ATOM 0 HE1 HIS B 41 2.267 10.725 23.675 1.00 0.00 H new ATOM 0 HE2 HIS B 41 1.714 11.480 21.292 1.00 0.00 H new ATOM 1699 N ALA B 42 5.666 17.330 24.480 1.00 0.00 N ATOM 1700 CA ALA B 42 6.574 18.476 24.579 1.00 0.00 C ATOM 1701 C ALA B 42 7.936 18.100 25.199 1.00 0.00 C ATOM 1702 O ALA B 42 8.013 17.284 26.122 1.00 0.00 O ATOM 1703 CB ALA B 42 5.883 19.615 25.338 1.00 0.00 C ATOM 0 H ALA B 42 5.714 16.706 25.286 1.00 0.00 H new ATOM 0 HA ALA B 42 6.802 18.820 23.570 1.00 0.00 H new ATOM 0 HB1 ALA B 42 6.559 20.467 25.411 1.00 0.00 H new ATOM 0 HB2 ALA B 42 4.981 19.913 24.804 1.00 0.00 H new ATOM 0 HB3 ALA B 42 5.617 19.276 26.339 1.00 0.00 H new ATOM 1709 N PHE B 43 9.007 18.713 24.686 1.00 0.00 N ATOM 1710 CA PHE B 43 10.402 18.359 24.958 1.00 0.00 C ATOM 1711 C PHE B 43 11.287 19.608 25.114 1.00 0.00 C ATOM 1712 O PHE B 43 11.760 20.147 24.104 1.00 0.00 O ATOM 1713 CB PHE B 43 10.920 17.458 23.824 1.00 0.00 C ATOM 1714 CG PHE B 43 10.147 16.173 23.629 1.00 0.00 C ATOM 1715 CD1 PHE B 43 9.144 16.085 22.642 1.00 0.00 C ATOM 1716 CD2 PHE B 43 10.423 15.065 24.452 1.00 0.00 C ATOM 1717 CE1 PHE B 43 8.419 14.888 22.483 1.00 0.00 C ATOM 1718 CE2 PHE B 43 9.694 13.872 24.295 1.00 0.00 C ATOM 1719 CZ PHE B 43 8.690 13.786 23.312 1.00 0.00 C ATOM 0 H PHE B 43 8.922 19.501 24.044 1.00 0.00 H new ATOM 0 HA PHE B 43 10.449 17.820 25.904 1.00 0.00 H new ATOM 0 HB2 PHE B 43 10.899 18.023 22.892 1.00 0.00 H new ATOM 0 HB3 PHE B 43 11.963 17.211 24.023 1.00 0.00 H new ATOM 0 HD1 PHE B 43 8.932 16.934 22.009 1.00 0.00 H new ATOM 0 HD2 PHE B 43 11.195 15.131 25.205 1.00 0.00 H new ATOM 0 HE1 PHE B 43 7.654 14.817 21.724 1.00 0.00 H new ATOM 0 HE2 PHE B 43 9.904 13.023 24.928 1.00 0.00 H new ATOM 0 HZ PHE B 43 8.127 12.872 23.195 1.00 0.00 H new ATOM 1729 N PRO B 44 11.532 20.100 26.346 1.00 0.00 N ATOM 1730 CA PRO B 44 12.500 21.168 26.590 1.00 0.00 C ATOM 1731 C PRO B 44 13.933 20.700 26.310 1.00 0.00 C ATOM 1732 O PRO B 44 14.317 19.572 26.640 1.00 0.00 O ATOM 1733 CB PRO B 44 12.295 21.582 28.050 1.00 0.00 C ATOM 1734 CG PRO B 44 11.760 20.312 28.709 1.00 0.00 C ATOM 1735 CD PRO B 44 10.944 19.652 27.600 1.00 0.00 C ATOM 0 HA PRO B 44 12.347 22.015 25.922 1.00 0.00 H new ATOM 0 HB2 PRO B 44 13.228 21.910 28.509 1.00 0.00 H new ATOM 0 HB3 PRO B 44 11.589 22.408 28.138 1.00 0.00 H new ATOM 0 HG2 PRO B 44 12.569 19.666 29.051 1.00 0.00 H new ATOM 0 HG3 PRO B 44 11.144 20.540 29.579 1.00 0.00 H new ATOM 0 HD2 PRO B 44 10.982 18.566 27.682 1.00 0.00 H new ATOM 0 HD3 PRO B 44 9.895 19.940 27.664 1.00 0.00 H new ATOM 1743 N GLY B 45 14.729 21.565 25.676 1.00 0.00 N ATOM 1744 CA GLY B 45 16.127 21.300 25.309 1.00 0.00 C ATOM 1745 C GLY B 45 16.327 20.549 23.981 1.00 0.00 C ATOM 1746 O GLY B 45 17.470 20.261 23.615 1.00 0.00 O ATOM 0 H GLY B 45 14.413 22.493 25.396 1.00 0.00 H new ATOM 0 HA2 GLY B 45 16.657 22.251 25.253 1.00 0.00 H new ATOM 0 HA3 GLY B 45 16.592 20.722 26.108 1.00 0.00 H new ATOM 1750 N LEU B 46 15.252 20.249 23.240 1.00 0.00 N ATOM 1751 CA LEU B 46 15.322 19.790 21.844 1.00 0.00 C ATOM 1752 C LEU B 46 15.059 20.931 20.843 1.00 0.00 C ATOM 1753 O LEU B 46 14.475 21.965 21.179 1.00 0.00 O ATOM 1754 CB LEU B 46 14.352 18.613 21.608 1.00 0.00 C ATOM 1755 CG LEU B 46 14.626 17.346 22.439 1.00 0.00 C ATOM 1756 CD1 LEU B 46 13.749 16.203 21.921 1.00 0.00 C ATOM 1757 CD2 LEU B 46 16.081 16.865 22.369 1.00 0.00 C ATOM 0 H LEU B 46 14.299 20.319 23.596 1.00 0.00 H new ATOM 0 HA LEU B 46 16.340 19.441 21.668 1.00 0.00 H new ATOM 0 HB2 LEU B 46 13.339 18.953 21.821 1.00 0.00 H new ATOM 0 HB3 LEU B 46 14.383 18.346 20.552 1.00 0.00 H new ATOM 0 HG LEU B 46 14.405 17.612 23.473 1.00 0.00 H new ATOM 0 HD11 LEU B 46 13.940 15.304 22.507 1.00 0.00 H new ATOM 0 HD12 LEU B 46 12.699 16.480 22.013 1.00 0.00 H new ATOM 0 HD13 LEU B 46 13.983 16.011 20.874 1.00 0.00 H new ATOM 0 HD21 LEU B 46 16.198 15.969 22.979 1.00 0.00 H new ATOM 0 HD22 LEU B 46 16.339 16.637 21.335 1.00 0.00 H new ATOM 0 HD23 LEU B 46 16.741 17.647 22.744 1.00 0.00 H new ATOM 1769 N ALA B 47 15.460 20.688 19.596 1.00 0.00 N ATOM 1770 CA ALA B 47 15.177 21.473 18.396 1.00 0.00 C ATOM 1771 C ALA B 47 14.865 20.523 17.216 1.00 0.00 C ATOM 1772 O ALA B 47 15.283 19.360 17.218 1.00 0.00 O ATOM 1773 CB ALA B 47 16.388 22.371 18.115 1.00 0.00 C ATOM 0 H ALA B 47 16.036 19.874 19.382 1.00 0.00 H new ATOM 0 HA ALA B 47 14.301 22.107 18.536 1.00 0.00 H new ATOM 0 HB1 ALA B 47 16.199 22.967 17.222 1.00 0.00 H new ATOM 0 HB2 ALA B 47 16.555 23.033 18.965 1.00 0.00 H new ATOM 0 HB3 ALA B 47 17.271 21.752 17.958 1.00 0.00 H new ATOM 1779 N ILE B 48 14.137 20.989 16.191 1.00 0.00 N ATOM 1780 CA ILE B 48 13.903 20.209 14.961 1.00 0.00 C ATOM 1781 C ILE B 48 15.214 20.146 14.157 1.00 0.00 C ATOM 1782 O ILE B 48 15.766 21.186 13.789 1.00 0.00 O ATOM 1783 CB ILE B 48 12.738 20.770 14.113 1.00 0.00 C ATOM 1784 CG1 ILE B 48 11.419 20.867 14.914 1.00 0.00 C ATOM 1785 CG2 ILE B 48 12.528 19.884 12.867 1.00 0.00 C ATOM 1786 CD1 ILE B 48 10.323 21.670 14.197 1.00 0.00 C ATOM 0 H ILE B 48 13.696 21.909 16.188 1.00 0.00 H new ATOM 0 HA ILE B 48 13.598 19.201 15.242 1.00 0.00 H new ATOM 0 HB ILE B 48 13.011 21.782 13.813 1.00 0.00 H new ATOM 0 HG12 ILE B 48 11.050 19.861 15.113 1.00 0.00 H new ATOM 0 HG13 ILE B 48 11.623 21.329 15.880 1.00 0.00 H new ATOM 0 HG21 ILE B 48 11.706 20.282 12.272 1.00 0.00 H new ATOM 0 HG22 ILE B 48 13.439 19.876 12.269 1.00 0.00 H new ATOM 0 HG23 ILE B 48 12.290 18.867 13.179 1.00 0.00 H new ATOM 0 HD11 ILE B 48 9.427 21.696 14.817 1.00 0.00 H new ATOM 0 HD12 ILE B 48 10.673 22.687 14.022 1.00 0.00 H new ATOM 0 HD13 ILE B 48 10.090 21.197 13.243 1.00 0.00 H new ATOM 1798 N GLY B 49 15.716 18.938 13.892 1.00 0.00 N ATOM 1799 CA GLY B 49 16.959 18.703 13.157 1.00 0.00 C ATOM 1800 C GLY B 49 16.737 18.532 11.659 1.00 0.00 C ATOM 1801 O GLY B 49 17.267 19.305 10.860 1.00 0.00 O ATOM 0 H GLY B 49 15.258 18.076 14.190 1.00 0.00 H new ATOM 0 HA2 GLY B 49 17.639 19.538 13.326 1.00 0.00 H new ATOM 0 HA3 GLY B 49 17.446 17.811 13.552 1.00 0.00 H new ATOM 1805 N ARG B 50 15.958 17.515 11.267 1.00 0.00 N ATOM 1806 CA ARG B 50 15.716 17.140 9.863 1.00 0.00 C ATOM 1807 C ARG B 50 14.293 16.622 9.623 1.00 0.00 C ATOM 1808 O ARG B 50 13.643 16.096 10.528 1.00 0.00 O ATOM 1809 CB ARG B 50 16.764 16.115 9.371 1.00 0.00 C ATOM 1810 CG ARG B 50 18.192 16.687 9.294 1.00 0.00 C ATOM 1811 CD ARG B 50 19.159 15.744 8.577 1.00 0.00 C ATOM 1812 NE ARG B 50 20.485 16.372 8.387 1.00 0.00 N ATOM 1813 CZ ARG B 50 21.599 15.768 8.018 1.00 0.00 C ATOM 1814 NH1 ARG B 50 21.665 14.484 7.789 1.00 0.00 N1+ ATOM 1815 NH2 ARG B 50 22.680 16.471 7.881 1.00 0.00 N ATOM 0 H ARG B 50 15.467 16.915 11.930 1.00 0.00 H new ATOM 0 HA ARG B 50 15.821 18.053 9.278 1.00 0.00 H new ATOM 0 HB2 ARG B 50 16.761 15.254 10.040 1.00 0.00 H new ATOM 0 HB3 ARG B 50 16.472 15.753 8.385 1.00 0.00 H new ATOM 0 HG2 ARG B 50 18.169 17.645 8.774 1.00 0.00 H new ATOM 0 HG3 ARG B 50 18.558 16.881 10.302 1.00 0.00 H new ATOM 0 HD2 ARG B 50 19.269 14.826 9.154 1.00 0.00 H new ATOM 0 HD3 ARG B 50 18.745 15.464 7.608 1.00 0.00 H new ATOM 0 HE ARG B 50 20.544 17.376 8.559 1.00 0.00 H new ATOM 0 HH11 ARG B 50 20.833 13.904 7.894 1.00 0.00 H new ATOM 0 HH12 ARG B 50 22.549 14.061 7.506 1.00 0.00 H new ATOM 0 HH21 ARG B 50 22.661 17.475 8.058 1.00 0.00 H new ATOM 0 HH22 ARG B 50 23.549 16.020 7.596 1.00 0.00 H new ATOM 1829 N VAL B 51 13.843 16.745 8.377 1.00 0.00 N ATOM 1830 CA VAL B 51 12.535 16.317 7.850 1.00 0.00 C ATOM 1831 C VAL B 51 12.757 15.581 6.525 1.00 0.00 C ATOM 1832 O VAL B 51 13.490 16.067 5.664 1.00 0.00 O ATOM 1833 CB VAL B 51 11.611 17.532 7.614 1.00 0.00 C ATOM 1834 CG1 VAL B 51 10.211 17.115 7.131 1.00 0.00 C ATOM 1835 CG2 VAL B 51 11.446 18.404 8.864 1.00 0.00 C ATOM 0 H VAL B 51 14.417 17.176 7.652 1.00 0.00 H new ATOM 0 HA VAL B 51 12.057 15.660 8.577 1.00 0.00 H new ATOM 0 HB VAL B 51 12.109 18.112 6.837 1.00 0.00 H new ATOM 0 HG11 VAL B 51 9.599 18.004 6.979 1.00 0.00 H new ATOM 0 HG12 VAL B 51 10.298 16.569 6.191 1.00 0.00 H new ATOM 0 HG13 VAL B 51 9.743 16.476 7.880 1.00 0.00 H new ATOM 0 HG21 VAL B 51 10.787 19.242 8.638 1.00 0.00 H new ATOM 0 HG22 VAL B 51 11.014 17.809 9.668 1.00 0.00 H new ATOM 0 HG23 VAL B 51 12.420 18.782 9.175 1.00 0.00 H new ATOM 1845 N ASP B 52 12.103 14.437 6.342 1.00 0.00 N ATOM 1846 CA ASP B 52 12.123 13.641 5.109 1.00 0.00 C ATOM 1847 C ASP B 52 10.714 13.091 4.831 1.00 0.00 C ATOM 1848 O ASP B 52 10.274 12.119 5.447 1.00 0.00 O ATOM 1849 CB ASP B 52 13.180 12.526 5.249 1.00 0.00 C ATOM 1850 CG ASP B 52 13.400 11.690 3.981 1.00 0.00 C ATOM 1851 OD1 ASP B 52 14.458 11.026 3.870 1.00 0.00 O ATOM 1852 OD2 ASP B 52 12.517 11.644 3.094 1.00 0.00 O1- ATOM 0 H ASP B 52 11.523 14.021 7.071 1.00 0.00 H new ATOM 0 HA ASP B 52 12.402 14.255 4.253 1.00 0.00 H new ATOM 0 HB2 ASP B 52 14.129 12.977 5.540 1.00 0.00 H new ATOM 0 HB3 ASP B 52 12.882 11.861 6.059 1.00 0.00 H new ATOM 1857 N LEU B 53 9.988 13.731 3.914 1.00 0.00 N ATOM 1858 CA LEU B 53 8.597 13.405 3.572 1.00 0.00 C ATOM 1859 C LEU B 53 8.480 12.204 2.610 1.00 0.00 C ATOM 1860 O LEU B 53 7.422 11.575 2.528 1.00 0.00 O ATOM 1861 CB LEU B 53 7.920 14.660 2.995 1.00 0.00 C ATOM 1862 CG LEU B 53 7.961 15.898 3.904 1.00 0.00 C ATOM 1863 CD1 LEU B 53 7.192 17.037 3.247 1.00 0.00 C ATOM 1864 CD2 LEU B 53 7.348 15.654 5.286 1.00 0.00 C ATOM 0 H LEU B 53 10.358 14.512 3.372 1.00 0.00 H new ATOM 0 HA LEU B 53 8.084 13.096 4.483 1.00 0.00 H new ATOM 0 HB2 LEU B 53 8.397 14.908 2.047 1.00 0.00 H new ATOM 0 HB3 LEU B 53 6.879 14.424 2.775 1.00 0.00 H new ATOM 0 HG LEU B 53 9.014 16.144 4.040 1.00 0.00 H new ATOM 0 HD11 LEU B 53 7.221 17.915 3.892 1.00 0.00 H new ATOM 0 HD12 LEU B 53 7.648 17.277 2.286 1.00 0.00 H new ATOM 0 HD13 LEU B 53 6.156 16.735 3.092 1.00 0.00 H new ATOM 0 HD21 LEU B 53 7.409 16.568 5.878 1.00 0.00 H new ATOM 0 HD22 LEU B 53 6.304 15.363 5.174 1.00 0.00 H new ATOM 0 HD23 LEU B 53 7.895 14.858 5.791 1.00 0.00 H new ATOM 1876 N ARG B 54 9.573 11.850 1.921 1.00 0.00 N ATOM 1877 CA ARG B 54 9.722 10.610 1.140 1.00 0.00 C ATOM 1878 C ARG B 54 9.777 9.400 2.087 1.00 0.00 C ATOM 1879 O ARG B 54 9.094 8.402 1.865 1.00 0.00 O ATOM 1880 CB ARG B 54 10.970 10.774 0.244 1.00 0.00 C ATOM 1881 CG ARG B 54 11.623 9.474 -0.264 1.00 0.00 C ATOM 1882 CD ARG B 54 13.077 9.719 -0.691 1.00 0.00 C ATOM 1883 NE ARG B 54 13.940 10.067 0.462 1.00 0.00 N ATOM 1884 CZ ARG B 54 15.258 10.013 0.509 1.00 0.00 C ATOM 1885 NH1 ARG B 54 15.982 9.692 -0.528 1.00 0.00 N1+ ATOM 1886 NH2 ARG B 54 15.886 10.275 1.615 1.00 0.00 N ATOM 0 H ARG B 54 10.407 12.437 1.889 1.00 0.00 H new ATOM 0 HA ARG B 54 8.868 10.425 0.489 1.00 0.00 H new ATOM 0 HB2 ARG B 54 10.693 11.378 -0.620 1.00 0.00 H new ATOM 0 HB3 ARG B 54 11.719 11.338 0.800 1.00 0.00 H new ATOM 0 HG2 ARG B 54 11.593 8.717 0.520 1.00 0.00 H new ATOM 0 HG3 ARG B 54 11.054 9.082 -1.107 1.00 0.00 H new ATOM 0 HD2 ARG B 54 13.467 8.826 -1.180 1.00 0.00 H new ATOM 0 HD3 ARG B 54 13.109 10.524 -1.425 1.00 0.00 H new ATOM 0 HE ARG B 54 13.466 10.381 1.309 1.00 0.00 H new ATOM 0 HH11 ARG B 54 15.531 9.471 -1.416 1.00 0.00 H new ATOM 0 HH12 ARG B 54 16.999 9.662 -0.451 1.00 0.00 H new ATOM 0 HH21 ARG B 54 15.361 10.524 2.453 1.00 0.00 H new ATOM 0 HH22 ARG B 54 16.905 10.232 1.646 1.00 0.00 H new ATOM 1900 N SER B 55 10.549 9.513 3.165 1.00 0.00 N ATOM 1901 CA SER B 55 10.636 8.511 4.239 1.00 0.00 C ATOM 1902 C SER B 55 9.426 8.534 5.190 1.00 0.00 C ATOM 1903 O SER B 55 8.998 7.494 5.693 1.00 0.00 O ATOM 1904 CB SER B 55 11.942 8.729 5.014 1.00 0.00 C ATOM 1905 OG SER B 55 12.171 7.686 5.941 1.00 0.00 O ATOM 0 H SER B 55 11.149 10.322 3.325 1.00 0.00 H new ATOM 0 HA SER B 55 10.629 7.524 3.776 1.00 0.00 H new ATOM 0 HB2 SER B 55 12.776 8.787 4.315 1.00 0.00 H new ATOM 0 HB3 SER B 55 11.900 9.683 5.540 1.00 0.00 H new ATOM 0 HG SER B 55 13.011 7.851 6.419 1.00 0.00 H new ATOM 1911 N GLY B 56 8.838 9.716 5.413 1.00 0.00 N ATOM 1912 CA GLY B 56 7.758 9.960 6.375 1.00 0.00 C ATOM 1913 C GLY B 56 8.262 10.169 7.813 1.00 0.00 C ATOM 1914 O GLY B 56 7.604 9.724 8.758 1.00 0.00 O ATOM 0 H GLY B 56 9.112 10.559 4.909 1.00 0.00 H new ATOM 0 HA2 GLY B 56 7.194 10.839 6.063 1.00 0.00 H new ATOM 0 HA3 GLY B 56 7.068 9.117 6.358 1.00 0.00 H new ATOM 1918 N VAL B 57 9.436 10.792 7.995 1.00 0.00 N ATOM 1919 CA VAL B 57 10.158 10.881 9.283 1.00 0.00 C ATOM 1920 C VAL B 57 10.618 12.314 9.592 1.00 0.00 C ATOM 1921 O VAL B 57 11.084 13.038 8.706 1.00 0.00 O ATOM 1922 CB VAL B 57 11.348 9.887 9.325 1.00 0.00 C ATOM 1923 CG1 VAL B 57 12.106 9.931 10.660 1.00 0.00 C ATOM 1924 CG2 VAL B 57 10.879 8.438 9.109 1.00 0.00 C ATOM 0 H VAL B 57 9.926 11.262 7.234 1.00 0.00 H new ATOM 0 HA VAL B 57 9.454 10.599 10.065 1.00 0.00 H new ATOM 0 HB VAL B 57 12.012 10.200 8.519 1.00 0.00 H new ATOM 0 HG11 VAL B 57 12.928 9.216 10.635 1.00 0.00 H new ATOM 0 HG12 VAL B 57 12.502 10.934 10.821 1.00 0.00 H new ATOM 0 HG13 VAL B 57 11.427 9.674 11.473 1.00 0.00 H new ATOM 0 HG21 VAL B 57 11.738 7.768 9.145 1.00 0.00 H new ATOM 0 HG22 VAL B 57 10.172 8.164 9.892 1.00 0.00 H new ATOM 0 HG23 VAL B 57 10.393 8.354 8.137 1.00 0.00 H new ATOM 1934 N ILE B 58 10.523 12.702 10.868 1.00 0.00 N ATOM 1935 CA ILE B 58 11.065 13.946 11.433 1.00 0.00 C ATOM 1936 C ILE B 58 12.031 13.591 12.575 1.00 0.00 C ATOM 1937 O ILE B 58 11.673 12.858 13.496 1.00 0.00 O ATOM 1938 CB ILE B 58 9.920 14.877 11.902 1.00 0.00 C ATOM 1939 CG1 ILE B 58 9.036 15.307 10.704 1.00 0.00 C ATOM 1940 CG2 ILE B 58 10.478 16.117 12.630 1.00 0.00 C ATOM 1941 CD1 ILE B 58 7.698 15.933 11.105 1.00 0.00 C ATOM 0 H ILE B 58 10.045 12.134 11.568 1.00 0.00 H new ATOM 0 HA ILE B 58 11.618 14.495 10.671 1.00 0.00 H new ATOM 0 HB ILE B 58 9.302 14.318 12.605 1.00 0.00 H new ATOM 0 HG12 ILE B 58 9.591 16.021 10.095 1.00 0.00 H new ATOM 0 HG13 ILE B 58 8.844 14.436 10.078 1.00 0.00 H new ATOM 0 HG21 ILE B 58 9.653 16.754 12.949 1.00 0.00 H new ATOM 0 HG22 ILE B 58 11.050 15.800 13.502 1.00 0.00 H new ATOM 0 HG23 ILE B 58 11.126 16.675 11.954 1.00 0.00 H new ATOM 0 HD11 ILE B 58 7.141 16.206 10.209 1.00 0.00 H new ATOM 0 HD12 ILE B 58 7.120 15.215 11.687 1.00 0.00 H new ATOM 0 HD13 ILE B 58 7.879 16.825 11.705 1.00 0.00 H new ATOM 1953 N SER B 59 13.262 14.101 12.522 1.00 0.00 N ATOM 1954 CA SER B 59 14.322 13.822 13.498 1.00 0.00 C ATOM 1955 C SER B 59 14.629 15.054 14.350 1.00 0.00 C ATOM 1956 O SER B 59 14.898 16.134 13.811 1.00 0.00 O ATOM 1957 CB SER B 59 15.572 13.319 12.765 1.00 0.00 C ATOM 1958 OG SER B 59 16.608 13.015 13.685 1.00 0.00 O ATOM 0 H SER B 59 13.559 14.736 11.781 1.00 0.00 H new ATOM 0 HA SER B 59 13.980 13.044 14.180 1.00 0.00 H new ATOM 0 HB2 SER B 59 15.325 12.431 12.183 1.00 0.00 H new ATOM 0 HB3 SER B 59 15.916 14.077 12.061 1.00 0.00 H new ATOM 0 HG SER B 59 17.395 12.694 13.197 1.00 0.00 H new ATOM 1964 N LEU B 60 14.580 14.904 15.677 1.00 0.00 N ATOM 1965 CA LEU B 60 14.918 15.957 16.642 1.00 0.00 C ATOM 1966 C LEU B 60 16.370 15.837 17.148 1.00 0.00 C ATOM 1967 O LEU B 60 16.931 14.737 17.225 1.00 0.00 O ATOM 1968 CB LEU B 60 13.927 15.961 17.817 1.00 0.00 C ATOM 1969 CG LEU B 60 12.434 15.987 17.435 1.00 0.00 C ATOM 1970 CD1 LEU B 60 11.601 16.099 18.711 1.00 0.00 C ATOM 1971 CD2 LEU B 60 12.072 17.160 16.519 1.00 0.00 C ATOM 0 H LEU B 60 14.299 14.030 16.120 1.00 0.00 H new ATOM 0 HA LEU B 60 14.838 16.910 16.119 1.00 0.00 H new ATOM 0 HB2 LEU B 60 14.111 15.076 18.426 1.00 0.00 H new ATOM 0 HB3 LEU B 60 14.138 16.828 18.443 1.00 0.00 H new ATOM 0 HG LEU B 60 12.224 15.066 16.892 1.00 0.00 H new ATOM 0 HD11 LEU B 60 10.542 16.118 18.454 1.00 0.00 H new ATOM 0 HD12 LEU B 60 11.803 15.242 19.354 1.00 0.00 H new ATOM 0 HD13 LEU B 60 11.863 17.017 19.237 1.00 0.00 H new ATOM 0 HD21 LEU B 60 11.008 17.124 16.285 1.00 0.00 H new ATOM 0 HD22 LEU B 60 12.301 18.099 17.023 1.00 0.00 H new ATOM 0 HD23 LEU B 60 12.649 17.093 15.597 1.00 0.00 H new ATOM 1983 N ILE B 61 16.964 16.970 17.525 1.00 0.00 N ATOM 1984 CA ILE B 61 18.354 17.100 17.999 1.00 0.00 C ATOM 1985 C ILE B 61 18.432 17.955 19.269 1.00 0.00 C ATOM 1986 O ILE B 61 17.502 18.695 19.591 1.00 0.00 O ATOM 1987 CB ILE B 61 19.280 17.660 16.887 1.00 0.00 C ATOM 1988 CG1 ILE B 61 18.885 19.081 16.408 1.00 0.00 C ATOM 1989 CG2 ILE B 61 19.336 16.688 15.698 1.00 0.00 C ATOM 1990 CD1 ILE B 61 19.762 20.181 17.004 1.00 0.00 C ATOM 0 H ILE B 61 16.473 17.864 17.510 1.00 0.00 H new ATOM 0 HA ILE B 61 18.709 16.101 18.251 1.00 0.00 H new ATOM 0 HB ILE B 61 20.271 17.754 17.332 1.00 0.00 H new ATOM 0 HG12 ILE B 61 18.950 19.122 15.321 1.00 0.00 H new ATOM 0 HG13 ILE B 61 17.845 19.271 16.673 1.00 0.00 H new ATOM 0 HG21 ILE B 61 19.989 17.095 14.926 1.00 0.00 H new ATOM 0 HG22 ILE B 61 19.724 15.726 16.032 1.00 0.00 H new ATOM 0 HG23 ILE B 61 18.334 16.553 15.291 1.00 0.00 H new ATOM 0 HD11 ILE B 61 19.434 21.151 16.629 1.00 0.00 H new ATOM 0 HD12 ILE B 61 19.678 20.164 18.091 1.00 0.00 H new ATOM 0 HD13 ILE B 61 20.800 20.014 16.718 1.00 0.00 H new ATOM 2002 N GLU B 62 19.540 17.863 20.012 1.00 0.00 N ATOM 2003 CA GLU B 62 19.774 18.654 21.226 1.00 0.00 C ATOM 2004 C GLU B 62 20.041 20.134 20.903 1.00 0.00 C ATOM 2005 O GLU B 62 20.991 20.459 20.179 1.00 0.00 O ATOM 2006 CB GLU B 62 20.954 18.074 22.019 1.00 0.00 C ATOM 2007 CG GLU B 62 20.637 16.688 22.607 1.00 0.00 C ATOM 2008 CD GLU B 62 21.774 16.176 23.511 1.00 0.00 C ATOM 2009 OE1 GLU B 62 22.962 16.202 23.099 1.00 0.00 O ATOM 2010 OE2 GLU B 62 21.488 15.707 24.643 1.00 0.00 O1- ATOM 0 H GLU B 62 20.308 17.231 19.786 1.00 0.00 H new ATOM 0 HA GLU B 62 18.868 18.601 21.829 1.00 0.00 H new ATOM 0 HB2 GLU B 62 21.825 17.999 21.368 1.00 0.00 H new ATOM 0 HB3 GLU B 62 21.217 18.757 22.826 1.00 0.00 H new ATOM 0 HG2 GLU B 62 19.712 16.740 23.181 1.00 0.00 H new ATOM 0 HG3 GLU B 62 20.470 15.979 21.796 1.00 0.00 H new