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= -0.314 USER MOD Single : A 3 MET CE :methyl -176:sc=-0.00639 (180deg=-0.0288) USER MOD Single : A 5 LYS NZ :NH3+ 175:sc= 1.25 (180deg=1.09) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.159 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 (180deg=0) USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 THR OG1 : rot 180:sc= 0 USER MOD Single : B 35 THR OG1 : rot -62:sc= 0.215 USER MOD Single : B 41 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 55 SER OG : rot 180:sc= 0 USER MOD Single : B 59 SER OG : rot 80:sc= 0.793 USER MOD ----------------------------------------------------------------- ATOM 59 N CYS A 2 5.287 11.674 0.663 1.00 0.00 N ATOM 60 CA CYS A 2 4.590 12.958 0.716 1.00 0.00 C ATOM 61 C CYS A 2 5.491 14.097 0.185 1.00 0.00 C ATOM 62 O CYS A 2 6.698 13.913 -0.008 1.00 0.00 O ATOM 63 CB CYS A 2 4.129 13.190 2.167 1.00 0.00 C ATOM 64 SG CYS A 2 3.106 14.661 2.456 1.00 0.00 S ATOM 0 HA CYS A 2 3.714 12.948 0.068 1.00 0.00 H new ATOM 0 HB2 CYS A 2 3.569 12.314 2.493 1.00 0.00 H new ATOM 0 HB3 CYS A 2 5.013 13.257 2.801 1.00 0.00 H new ATOM 0 HG CYS A 2 2.790 14.729 3.715 1.00 0.00 H new ATOM 69 N MET A 3 4.914 15.278 -0.038 1.00 0.00 N ATOM 70 CA MET A 3 5.605 16.507 -0.452 1.00 0.00 C ATOM 71 C MET A 3 4.897 17.750 0.119 1.00 0.00 C ATOM 72 O MET A 3 3.680 17.747 0.326 1.00 0.00 O ATOM 73 CB MET A 3 5.713 16.556 -1.988 1.00 0.00 C ATOM 74 CG MET A 3 4.357 16.656 -2.698 1.00 0.00 C ATOM 75 SD MET A 3 4.385 16.288 -4.479 1.00 0.00 S ATOM 76 CE MET A 3 5.308 17.727 -5.087 1.00 0.00 C ATOM 0 H MET A 3 3.909 15.414 0.069 1.00 0.00 H new ATOM 0 HA MET A 3 6.617 16.504 -0.047 1.00 0.00 H new ATOM 0 HB2 MET A 3 6.327 17.411 -2.273 1.00 0.00 H new ATOM 0 HB3 MET A 3 6.230 15.662 -2.336 1.00 0.00 H new ATOM 0 HG2 MET A 3 3.660 15.972 -2.213 1.00 0.00 H new ATOM 0 HG3 MET A 3 3.965 17.663 -2.558 1.00 0.00 H new ATOM 0 HE1 MET A 3 5.355 17.696 -6.176 1.00 0.00 H new ATOM 0 HE2 MET A 3 4.806 18.641 -4.771 1.00 0.00 H new ATOM 0 HE3 MET A 3 6.319 17.709 -4.680 1.00 0.00 H new ATOM 86 N ALA A 4 5.653 18.819 0.363 1.00 0.00 N ATOM 87 CA ALA A 4 5.183 20.079 0.950 1.00 0.00 C ATOM 88 C ALA A 4 5.751 21.315 0.227 1.00 0.00 C ATOM 89 O ALA A 4 6.533 21.203 -0.718 1.00 0.00 O ATOM 90 CB ALA A 4 5.567 20.067 2.438 1.00 0.00 C ATOM 0 H ALA A 4 6.650 18.835 0.150 1.00 0.00 H new ATOM 0 HA ALA A 4 4.101 20.153 0.836 1.00 0.00 H new ATOM 0 HB1 ALA A 4 5.232 20.992 2.908 1.00 0.00 H new ATOM 0 HB2 ALA A 4 5.092 19.218 2.929 1.00 0.00 H new ATOM 0 HB3 ALA A 4 6.650 19.983 2.534 1.00 0.00 H new ATOM 96 N LYS A 5 5.388 22.510 0.708 1.00 0.00 N ATOM 97 CA LYS A 5 6.106 23.758 0.415 1.00 0.00 C ATOM 98 C LYS A 5 6.860 24.278 1.639 1.00 0.00 C ATOM 99 O LYS A 5 6.378 24.166 2.766 1.00 0.00 O ATOM 100 CB LYS A 5 5.167 24.816 -0.194 1.00 0.00 C ATOM 101 CG LYS A 5 4.039 25.286 0.740 1.00 0.00 C ATOM 102 CD LYS A 5 3.247 26.416 0.081 1.00 0.00 C ATOM 103 CE LYS A 5 2.210 26.998 1.048 1.00 0.00 C ATOM 104 NZ LYS A 5 1.556 28.194 0.458 1.00 0.00 N1+ ATOM 0 H LYS A 5 4.580 22.640 1.317 1.00 0.00 H new ATOM 0 HA LYS A 5 6.861 23.536 -0.339 1.00 0.00 H new ATOM 0 HB2 LYS A 5 5.760 25.681 -0.490 1.00 0.00 H new ATOM 0 HB3 LYS A 5 4.723 24.409 -1.102 1.00 0.00 H new ATOM 0 HG2 LYS A 5 3.375 24.452 0.970 1.00 0.00 H new ATOM 0 HG3 LYS A 5 4.459 25.629 1.686 1.00 0.00 H new ATOM 0 HD2 LYS A 5 3.929 27.202 -0.242 1.00 0.00 H new ATOM 0 HD3 LYS A 5 2.747 26.041 -0.812 1.00 0.00 H new ATOM 0 HE2 LYS A 5 1.458 26.244 1.280 1.00 0.00 H new ATOM 0 HE3 LYS A 5 2.692 27.267 1.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 0.799 28.523 1.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 2.260 28.950 0.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 1.151 27.947 -0.467 1.00 0.00 H new ATOM 118 N VAL A 6 8.034 24.860 1.417 1.00 0.00 N ATOM 119 CA VAL A 6 8.813 25.614 2.413 1.00 0.00 C ATOM 120 C VAL A 6 8.439 27.096 2.361 1.00 0.00 C ATOM 121 O VAL A 6 8.248 27.646 1.277 1.00 0.00 O ATOM 122 CB VAL A 6 10.327 25.393 2.198 1.00 0.00 C ATOM 123 CG1 VAL A 6 11.223 26.461 2.840 1.00 0.00 C ATOM 124 CG2 VAL A 6 10.727 24.040 2.795 1.00 0.00 C ATOM 0 H VAL A 6 8.493 24.822 0.507 1.00 0.00 H new ATOM 0 HA VAL A 6 8.571 25.246 3.410 1.00 0.00 H new ATOM 0 HB VAL A 6 10.481 25.443 1.120 1.00 0.00 H new ATOM 0 HG11 VAL A 6 12.269 26.227 2.639 1.00 0.00 H new ATOM 0 HG12 VAL A 6 10.983 27.438 2.420 1.00 0.00 H new ATOM 0 HG13 VAL A 6 11.055 26.477 3.917 1.00 0.00 H new ATOM 0 HG21 VAL A 6 11.795 23.878 2.646 1.00 0.00 H new ATOM 0 HG22 VAL A 6 10.504 24.033 3.862 1.00 0.00 H new ATOM 0 HG23 VAL A 6 10.167 23.245 2.302 1.00 0.00 H new ATOM 134 N VAL A 7 8.399 27.755 3.521 1.00 0.00 N ATOM 135 CA VAL A 7 8.272 29.212 3.651 1.00 0.00 C ATOM 136 C VAL A 7 9.245 29.758 4.707 1.00 0.00 C ATOM 137 O VAL A 7 9.427 29.159 5.773 1.00 0.00 O ATOM 138 CB VAL A 7 6.803 29.623 3.878 1.00 0.00 C ATOM 139 CG1 VAL A 7 6.213 29.105 5.196 1.00 0.00 C ATOM 140 CG2 VAL A 7 6.627 31.148 3.827 1.00 0.00 C ATOM 0 H VAL A 7 8.455 27.279 4.421 1.00 0.00 H new ATOM 0 HA VAL A 7 8.565 29.679 2.711 1.00 0.00 H new ATOM 0 HB VAL A 7 6.256 29.154 3.060 1.00 0.00 H new ATOM 0 HG11 VAL A 7 5.178 29.434 5.285 1.00 0.00 H new ATOM 0 HG12 VAL A 7 6.250 28.016 5.208 1.00 0.00 H new ATOM 0 HG13 VAL A 7 6.792 29.497 6.033 1.00 0.00 H new ATOM 0 HG21 VAL A 7 5.579 31.399 3.991 1.00 0.00 H new ATOM 0 HG22 VAL A 7 7.237 31.611 4.603 1.00 0.00 H new ATOM 0 HG23 VAL A 7 6.940 31.518 2.851 1.00 0.00 H new ATOM 150 N LEU A 8 9.890 30.887 4.403 1.00 0.00 N ATOM 151 CA LEU A 8 10.915 31.546 5.226 1.00 0.00 C ATOM 152 C LEU A 8 10.942 33.066 4.987 1.00 0.00 C ATOM 153 O LEU A 8 10.377 33.556 4.005 1.00 0.00 O ATOM 154 CB LEU A 8 12.285 30.877 4.948 1.00 0.00 C ATOM 155 CG LEU A 8 12.894 31.105 3.549 1.00 0.00 C ATOM 156 CD1 LEU A 8 13.788 32.351 3.469 1.00 0.00 C ATOM 157 CD2 LEU A 8 13.763 29.910 3.157 1.00 0.00 C ATOM 0 H LEU A 8 9.705 31.393 3.537 1.00 0.00 H new ATOM 0 HA LEU A 8 10.674 31.419 6.281 1.00 0.00 H new ATOM 0 HB2 LEU A 8 12.996 31.236 5.692 1.00 0.00 H new ATOM 0 HB3 LEU A 8 12.177 29.803 5.102 1.00 0.00 H new ATOM 0 HG LEU A 8 12.046 31.238 2.878 1.00 0.00 H new ATOM 0 HD11 LEU A 8 14.183 32.451 2.458 1.00 0.00 H new ATOM 0 HD12 LEU A 8 13.202 33.236 3.719 1.00 0.00 H new ATOM 0 HD13 LEU A 8 14.614 32.252 4.173 1.00 0.00 H new ATOM 0 HD21 LEU A 8 14.189 30.079 2.168 1.00 0.00 H new ATOM 0 HD22 LEU A 8 14.567 29.791 3.883 1.00 0.00 H new ATOM 0 HD23 LEU A 8 13.153 29.007 3.140 1.00 0.00 H new ATOM 265 N VAL A 16 10.095 34.484 1.302 1.00 0.00 N ATOM 266 CA VAL A 16 10.462 33.506 0.261 1.00 0.00 C ATOM 267 C VAL A 16 9.673 32.207 0.459 1.00 0.00 C ATOM 268 O VAL A 16 9.458 31.751 1.583 1.00 0.00 O ATOM 269 CB VAL A 16 11.990 33.248 0.271 1.00 0.00 C ATOM 270 CG1 VAL A 16 12.418 32.189 -0.751 1.00 0.00 C ATOM 271 CG2 VAL A 16 12.805 34.518 -0.005 1.00 0.00 C ATOM 0 HA VAL A 16 10.204 33.914 -0.716 1.00 0.00 H new ATOM 0 HB VAL A 16 12.197 32.889 1.279 1.00 0.00 H new ATOM 0 HG11 VAL A 16 13.498 32.049 -0.700 1.00 0.00 H new ATOM 0 HG12 VAL A 16 11.919 31.246 -0.528 1.00 0.00 H new ATOM 0 HG13 VAL A 16 12.142 32.518 -1.753 1.00 0.00 H new ATOM 0 HG21 VAL A 16 13.868 34.279 0.014 1.00 0.00 H new ATOM 0 HG22 VAL A 16 12.540 34.915 -0.985 1.00 0.00 H new ATOM 0 HG23 VAL A 16 12.587 35.264 0.760 1.00 0.00 H new ATOM 281 N GLU A 17 9.232 31.599 -0.641 1.00 0.00 N ATOM 282 CA GLU A 17 8.417 30.386 -0.680 1.00 0.00 C ATOM 283 C GLU A 17 8.922 29.435 -1.784 1.00 0.00 C ATOM 284 O GLU A 17 9.212 29.876 -2.899 1.00 0.00 O ATOM 285 CB GLU A 17 6.952 30.809 -0.865 1.00 0.00 C ATOM 286 CG GLU A 17 5.956 29.646 -0.915 1.00 0.00 C ATOM 287 CD GLU A 17 4.519 30.151 -1.143 1.00 0.00 C ATOM 288 OE1 GLU A 17 3.634 29.891 -0.289 1.00 0.00 O ATOM 289 OE2 GLU A 17 4.246 30.800 -2.184 1.00 0.00 O1- ATOM 0 H GLU A 17 9.443 31.956 -1.573 1.00 0.00 H new ATOM 0 HA GLU A 17 8.496 29.824 0.251 1.00 0.00 H new ATOM 0 HB2 GLU A 17 6.673 31.474 -0.048 1.00 0.00 H new ATOM 0 HB3 GLU A 17 6.867 31.384 -1.787 1.00 0.00 H new ATOM 0 HG2 GLU A 17 6.234 28.960 -1.715 1.00 0.00 H new ATOM 0 HG3 GLU A 17 6.003 29.084 0.018 1.00 0.00 H new ATOM 296 N ILE A 18 9.038 28.135 -1.477 1.00 0.00 N ATOM 297 CA ILE A 18 9.608 27.099 -2.362 1.00 0.00 C ATOM 298 C ILE A 18 8.653 25.903 -2.413 1.00 0.00 C ATOM 299 O ILE A 18 8.393 25.270 -1.389 1.00 0.00 O ATOM 300 CB ILE A 18 11.024 26.678 -1.888 1.00 0.00 C ATOM 301 CG1 ILE A 18 11.990 27.882 -1.773 1.00 0.00 C ATOM 302 CG2 ILE A 18 11.615 25.590 -2.806 1.00 0.00 C ATOM 303 CD1 ILE A 18 13.320 27.537 -1.094 1.00 0.00 C ATOM 0 H ILE A 18 8.730 27.760 -0.580 1.00 0.00 H new ATOM 0 HA ILE A 18 9.720 27.504 -3.368 1.00 0.00 H new ATOM 0 HB ILE A 18 10.909 26.262 -0.887 1.00 0.00 H new ATOM 0 HG12 ILE A 18 12.191 28.273 -2.771 1.00 0.00 H new ATOM 0 HG13 ILE A 18 11.500 28.678 -1.212 1.00 0.00 H new ATOM 0 HG21 ILE A 18 12.608 25.314 -2.451 1.00 0.00 H new ATOM 0 HG22 ILE A 18 10.968 24.713 -2.794 1.00 0.00 H new ATOM 0 HG23 ILE A 18 11.688 25.973 -3.824 1.00 0.00 H new ATOM 0 HD11 ILE A 18 13.947 28.428 -1.048 1.00 0.00 H new ATOM 0 HD12 ILE A 18 13.130 27.175 -0.084 1.00 0.00 H new ATOM 0 HD13 ILE A 18 13.831 26.763 -1.667 1.00 0.00 H new ATOM 315 N GLY A 19 8.123 25.595 -3.602 1.00 0.00 N ATOM 316 CA GLY A 19 7.167 24.502 -3.826 1.00 0.00 C ATOM 317 C GLY A 19 7.820 23.135 -4.073 1.00 0.00 C ATOM 318 O GLY A 19 9.020 23.029 -4.341 1.00 0.00 O ATOM 0 H GLY A 19 8.351 26.108 -4.453 1.00 0.00 H new ATOM 0 HA2 GLY A 19 6.509 24.427 -2.960 1.00 0.00 H new ATOM 0 HA3 GLY A 19 6.540 24.752 -4.682 1.00 0.00 H new ATOM 322 N ASP A 20 7.004 22.080 -4.023 1.00 0.00 N ATOM 323 CA ASP A 20 7.353 20.695 -4.387 1.00 0.00 C ATOM 324 C ASP A 20 8.567 20.111 -3.631 1.00 0.00 C ATOM 325 O ASP A 20 9.359 19.349 -4.187 1.00 0.00 O ATOM 326 CB ASP A 20 7.446 20.535 -5.924 1.00 0.00 C ATOM 327 CG ASP A 20 6.233 21.080 -6.706 1.00 0.00 C ATOM 328 OD1 ASP A 20 5.099 21.106 -6.171 1.00 0.00 O ATOM 329 OD2 ASP A 20 6.410 21.458 -7.889 1.00 0.00 O1- ATOM 0 H ASP A 20 6.036 22.166 -3.714 1.00 0.00 H new ATOM 0 HA ASP A 20 6.527 20.074 -4.039 1.00 0.00 H new ATOM 0 HB2 ASP A 20 8.344 21.043 -6.274 1.00 0.00 H new ATOM 0 HB3 ASP A 20 7.566 19.477 -6.158 1.00 0.00 H new ATOM 334 N VAL A 21 8.729 20.485 -2.357 1.00 0.00 N ATOM 335 CA VAL A 21 9.820 20.051 -1.469 1.00 0.00 C ATOM 336 C VAL A 21 9.592 18.620 -0.974 1.00 0.00 C ATOM 337 O VAL A 21 8.519 18.292 -0.454 1.00 0.00 O ATOM 338 CB VAL A 21 9.986 21.037 -0.294 1.00 0.00 C ATOM 339 CG1 VAL A 21 11.047 20.583 0.715 1.00 0.00 C ATOM 340 CG2 VAL A 21 10.383 22.424 -0.817 1.00 0.00 C ATOM 0 H VAL A 21 8.080 21.123 -1.896 1.00 0.00 H new ATOM 0 HA VAL A 21 10.748 20.052 -2.040 1.00 0.00 H new ATOM 0 HB VAL A 21 9.022 21.073 0.214 1.00 0.00 H new ATOM 0 HG11 VAL A 21 11.121 21.315 1.520 1.00 0.00 H new ATOM 0 HG12 VAL A 21 10.764 19.615 1.129 1.00 0.00 H new ATOM 0 HG13 VAL A 21 12.011 20.496 0.214 1.00 0.00 H new ATOM 0 HG21 VAL A 21 10.497 23.110 0.022 1.00 0.00 H new ATOM 0 HG22 VAL A 21 11.327 22.352 -1.358 1.00 0.00 H new ATOM 0 HG23 VAL A 21 9.608 22.796 -1.487 1.00 0.00 H new ATOM 350 N LEU A 22 10.618 17.770 -1.104 1.00 0.00 N ATOM 351 CA LEU A 22 10.620 16.397 -0.585 1.00 0.00 C ATOM 352 C LEU A 22 11.323 16.262 0.771 1.00 0.00 C ATOM 353 O LEU A 22 10.959 15.393 1.563 1.00 0.00 O ATOM 354 CB LEU A 22 11.296 15.456 -1.594 1.00 0.00 C ATOM 355 CG LEU A 22 10.576 15.282 -2.942 1.00 0.00 C ATOM 356 CD1 LEU A 22 11.254 14.152 -3.719 1.00 0.00 C ATOM 357 CD2 LEU A 22 9.101 14.922 -2.792 1.00 0.00 C ATOM 0 H LEU A 22 11.484 18.021 -1.581 1.00 0.00 H new ATOM 0 HA LEU A 22 9.575 16.123 -0.438 1.00 0.00 H new ATOM 0 HB2 LEU A 22 12.303 15.826 -1.788 1.00 0.00 H new ATOM 0 HB3 LEU A 22 11.401 14.475 -1.131 1.00 0.00 H new ATOM 0 HG LEU A 22 10.638 16.239 -3.460 1.00 0.00 H new ATOM 0 HD11 LEU A 22 10.753 14.018 -4.678 1.00 0.00 H new ATOM 0 HD12 LEU A 22 12.301 14.404 -3.889 1.00 0.00 H new ATOM 0 HD13 LEU A 22 11.192 13.228 -3.145 1.00 0.00 H new ATOM 0 HD21 LEU A 22 8.651 14.813 -3.779 1.00 0.00 H new ATOM 0 HD22 LEU A 22 9.009 13.983 -2.246 1.00 0.00 H new ATOM 0 HD23 LEU A 22 8.588 15.712 -2.244 1.00 0.00 H new ATOM 369 N GLU A 23 12.327 17.098 1.054 1.00 0.00 N ATOM 370 CA GLU A 23 13.110 17.032 2.292 1.00 0.00 C ATOM 371 C GLU A 23 13.797 18.363 2.648 1.00 0.00 C ATOM 372 O GLU A 23 14.155 19.156 1.768 1.00 0.00 O ATOM 373 CB GLU A 23 14.121 15.869 2.240 1.00 0.00 C ATOM 374 CG GLU A 23 15.167 15.956 1.114 1.00 0.00 C ATOM 375 CD GLU A 23 15.951 14.639 0.965 1.00 0.00 C ATOM 376 OE1 GLU A 23 17.200 14.648 1.081 1.00 0.00 O ATOM 377 OE2 GLU A 23 15.330 13.578 0.710 1.00 0.00 O1- ATOM 0 H GLU A 23 12.621 17.845 0.425 1.00 0.00 H new ATOM 0 HA GLU A 23 12.402 16.839 3.098 1.00 0.00 H new ATOM 0 HB2 GLU A 23 14.643 15.820 3.196 1.00 0.00 H new ATOM 0 HB3 GLU A 23 13.570 14.935 2.130 1.00 0.00 H new ATOM 0 HG2 GLU A 23 14.670 16.193 0.173 1.00 0.00 H new ATOM 0 HG3 GLU A 23 15.860 16.771 1.323 1.00 0.00 H new ATOM 384 N VAL A 24 13.987 18.588 3.953 1.00 0.00 N ATOM 385 CA VAL A 24 14.633 19.775 4.542 1.00 0.00 C ATOM 386 C VAL A 24 15.542 19.358 5.700 1.00 0.00 C ATOM 387 O VAL A 24 15.179 18.509 6.520 1.00 0.00 O ATOM 388 CB VAL A 24 13.600 20.820 5.024 1.00 0.00 C ATOM 389 CG1 VAL A 24 14.258 22.105 5.548 1.00 0.00 C ATOM 390 CG2 VAL A 24 12.612 21.220 3.924 1.00 0.00 C ATOM 0 H VAL A 24 13.683 17.921 4.662 1.00 0.00 H new ATOM 0 HA VAL A 24 15.231 20.244 3.761 1.00 0.00 H new ATOM 0 HB VAL A 24 13.068 20.323 5.835 1.00 0.00 H new ATOM 0 HG11 VAL A 24 13.486 22.803 5.873 1.00 0.00 H new ATOM 0 HG12 VAL A 24 14.907 21.864 6.390 1.00 0.00 H new ATOM 0 HG13 VAL A 24 14.849 22.561 4.754 1.00 0.00 H new ATOM 0 HG21 VAL A 24 11.909 21.955 4.316 1.00 0.00 H new ATOM 0 HG22 VAL A 24 13.157 21.651 3.084 1.00 0.00 H new ATOM 0 HG23 VAL A 24 12.065 20.339 3.588 1.00 0.00 H new ATOM 400 N ARG A 25 16.715 19.989 5.786 1.00 0.00 N ATOM 401 CA ARG A 25 17.717 19.823 6.856 1.00 0.00 C ATOM 402 C ARG A 25 18.058 21.178 7.472 1.00 0.00 C ATOM 403 O ARG A 25 18.098 22.189 6.771 1.00 0.00 O ATOM 404 CB ARG A 25 18.991 19.185 6.279 1.00 0.00 C ATOM 405 CG ARG A 25 18.811 17.727 5.813 1.00 0.00 C ATOM 406 CD ARG A 25 20.007 17.238 4.981 1.00 0.00 C ATOM 407 NE ARG A 25 21.289 17.383 5.700 1.00 0.00 N ATOM 408 CZ ARG A 25 22.075 16.444 6.192 1.00 0.00 C ATOM 409 NH1 ARG A 25 21.811 15.174 6.097 1.00 0.00 N1+ ATOM 410 NH2 ARG A 25 23.154 16.806 6.816 1.00 0.00 N ATOM 0 H ARG A 25 17.012 20.663 5.081 1.00 0.00 H new ATOM 0 HA ARG A 25 17.304 19.175 7.629 1.00 0.00 H new ATOM 0 HB2 ARG A 25 19.334 19.784 5.436 1.00 0.00 H new ATOM 0 HB3 ARG A 25 19.776 19.219 7.035 1.00 0.00 H new ATOM 0 HG2 ARG A 25 18.685 17.081 6.682 1.00 0.00 H new ATOM 0 HG3 ARG A 25 17.900 17.645 5.221 1.00 0.00 H new ATOM 0 HD2 ARG A 25 19.858 16.191 4.716 1.00 0.00 H new ATOM 0 HD3 ARG A 25 20.051 17.800 4.048 1.00 0.00 H new ATOM 0 HE ARG A 25 21.611 18.341 5.835 1.00 0.00 H new ATOM 0 HH11 ARG A 25 20.962 14.864 5.624 1.00 0.00 H new ATOM 0 HH12 ARG A 25 22.453 14.489 6.495 1.00 0.00 H new ATOM 0 HH21 ARG A 25 23.377 17.796 6.917 1.00 0.00 H new ATOM 0 HH22 ARG A 25 23.779 16.100 7.206 1.00 0.00 H new ATOM 424 N ALA A 26 18.375 21.189 8.766 1.00 0.00 N ATOM 425 CA ALA A 26 19.019 22.294 9.464 1.00 0.00 C ATOM 426 C ALA A 26 20.397 21.825 9.976 1.00 0.00 C ATOM 427 O ALA A 26 20.501 21.042 10.924 1.00 0.00 O ATOM 428 CB ALA A 26 18.083 22.806 10.570 1.00 0.00 C ATOM 0 H ALA A 26 18.182 20.396 9.378 1.00 0.00 H new ATOM 0 HA ALA A 26 19.202 23.139 8.800 1.00 0.00 H new ATOM 0 HB1 ALA A 26 18.560 23.633 11.096 1.00 0.00 H new ATOM 0 HB2 ALA A 26 17.148 23.149 10.126 1.00 0.00 H new ATOM 0 HB3 ALA A 26 17.876 22.000 11.274 1.00 0.00 H new ATOM 434 N GLU A 27 21.461 22.275 9.312 1.00 0.00 N ATOM 435 CA GLU A 27 22.854 22.110 9.746 1.00 0.00 C ATOM 436 C GLU A 27 23.170 23.032 10.943 1.00 0.00 C ATOM 437 O GLU A 27 22.349 23.860 11.347 1.00 0.00 O ATOM 438 CB GLU A 27 23.804 22.415 8.563 1.00 0.00 C ATOM 439 CG GLU A 27 23.466 21.751 7.211 1.00 0.00 C ATOM 440 CD GLU A 27 23.454 20.210 7.216 1.00 0.00 C ATOM 441 OE1 GLU A 27 24.002 19.561 8.139 1.00 0.00 O ATOM 442 OE2 GLU A 27 22.924 19.613 6.249 1.00 0.00 O1- ATOM 0 H GLU A 27 21.378 22.780 8.430 1.00 0.00 H new ATOM 0 HA GLU A 27 23.002 21.080 10.069 1.00 0.00 H new ATOM 0 HB2 GLU A 27 23.827 23.495 8.415 1.00 0.00 H new ATOM 0 HB3 GLU A 27 24.811 22.111 8.849 1.00 0.00 H new ATOM 0 HG2 GLU A 27 22.487 22.104 6.887 1.00 0.00 H new ATOM 0 HG3 GLU A 27 24.189 22.089 6.469 1.00 0.00 H new ATOM 449 N GLY A 28 24.391 22.942 11.491 1.00 0.00 N ATOM 450 CA GLY A 28 24.882 23.785 12.593 1.00 0.00 C ATOM 451 C GLY A 28 25.193 25.250 12.226 1.00 0.00 C ATOM 452 O GLY A 28 26.238 25.775 12.625 1.00 0.00 O ATOM 0 H GLY A 28 25.083 22.264 11.172 1.00 0.00 H new ATOM 0 HA2 GLY A 28 24.138 23.779 13.390 1.00 0.00 H new ATOM 0 HA3 GLY A 28 25.786 23.331 12.998 1.00 0.00 H new ATOM 456 N GLY A 29 24.326 25.900 11.441 1.00 0.00 N ATOM 457 CA GLY A 29 24.470 27.295 10.996 1.00 0.00 C ATOM 458 C GLY A 29 23.672 27.700 9.744 1.00 0.00 C ATOM 459 O GLY A 29 23.661 28.881 9.391 1.00 0.00 O ATOM 0 H GLY A 29 23.478 25.458 11.086 1.00 0.00 H new ATOM 0 HA2 GLY A 29 24.172 27.948 11.817 1.00 0.00 H new ATOM 0 HA3 GLY A 29 25.526 27.485 10.804 1.00 0.00 H new ATOM 463 N ALA A 30 23.007 26.761 9.055 1.00 0.00 N ATOM 464 CA ALA A 30 22.259 26.998 7.814 1.00 0.00 C ATOM 465 C ALA A 30 21.216 25.897 7.552 1.00 0.00 C ATOM 466 O ALA A 30 21.415 24.742 7.940 1.00 0.00 O ATOM 467 CB ALA A 30 23.253 27.051 6.641 1.00 0.00 C ATOM 0 H ALA A 30 22.975 25.787 9.356 1.00 0.00 H new ATOM 0 HA ALA A 30 21.723 27.942 7.912 1.00 0.00 H new ATOM 0 HB1 ALA A 30 22.711 27.227 5.712 1.00 0.00 H new ATOM 0 HB2 ALA A 30 23.965 27.860 6.804 1.00 0.00 H new ATOM 0 HB3 ALA A 30 23.789 26.104 6.575 1.00 0.00 H new ATOM 473 N VAL A 31 20.133 26.222 6.845 1.00 0.00 N ATOM 474 CA VAL A 31 19.192 25.214 6.306 1.00 0.00 C ATOM 475 C VAL A 31 19.526 24.816 4.867 1.00 0.00 C ATOM 476 O VAL A 31 20.147 25.585 4.125 1.00 0.00 O ATOM 477 CB VAL A 31 17.716 25.656 6.396 1.00 0.00 C ATOM 478 CG1 VAL A 31 17.299 25.837 7.856 1.00 0.00 C ATOM 479 CG2 VAL A 31 17.460 26.926 5.588 1.00 0.00 C ATOM 0 H VAL A 31 19.876 27.184 6.625 1.00 0.00 H new ATOM 0 HA VAL A 31 19.319 24.341 6.946 1.00 0.00 H new ATOM 0 HB VAL A 31 17.103 24.867 5.960 1.00 0.00 H new ATOM 0 HG11 VAL A 31 16.255 26.149 7.900 1.00 0.00 H new ATOM 0 HG12 VAL A 31 17.419 24.893 8.388 1.00 0.00 H new ATOM 0 HG13 VAL A 31 17.925 26.598 8.322 1.00 0.00 H new ATOM 0 HG21 VAL A 31 16.410 27.207 5.675 1.00 0.00 H new ATOM 0 HG22 VAL A 31 18.085 27.733 5.971 1.00 0.00 H new ATOM 0 HG23 VAL A 31 17.702 26.746 4.541 1.00 0.00 H new ATOM 489 N ARG A 32 19.064 23.630 4.464 1.00 0.00 N ATOM 490 CA ARG A 32 19.102 23.078 3.100 1.00 0.00 C ATOM 491 C ARG A 32 17.741 22.473 2.739 1.00 0.00 C ATOM 492 O ARG A 32 17.144 21.763 3.546 1.00 0.00 O ATOM 493 CB ARG A 32 20.220 22.022 2.989 1.00 0.00 C ATOM 494 CG ARG A 32 21.633 22.610 3.150 1.00 0.00 C ATOM 495 CD ARG A 32 22.685 21.509 3.264 1.00 0.00 C ATOM 496 NE ARG A 32 22.751 20.664 2.057 1.00 0.00 N ATOM 497 CZ ARG A 32 23.185 19.419 1.986 1.00 0.00 C ATOM 498 NH1 ARG A 32 23.594 18.748 3.029 1.00 0.00 N1+ ATOM 499 NH2 ARG A 32 23.208 18.837 0.826 1.00 0.00 N ATOM 0 H ARG A 32 18.624 22.985 5.121 1.00 0.00 H new ATOM 0 HA ARG A 32 19.317 23.881 2.395 1.00 0.00 H new ATOM 0 HB2 ARG A 32 20.064 21.257 3.749 1.00 0.00 H new ATOM 0 HB3 ARG A 32 20.148 21.528 2.020 1.00 0.00 H new ATOM 0 HG2 ARG A 32 21.863 23.248 2.296 1.00 0.00 H new ATOM 0 HG3 ARG A 32 21.667 23.241 4.038 1.00 0.00 H new ATOM 0 HD2 ARG A 32 23.661 21.961 3.441 1.00 0.00 H new ATOM 0 HD3 ARG A 32 22.461 20.885 4.129 1.00 0.00 H new ATOM 0 HE ARG A 32 22.428 21.085 1.186 1.00 0.00 H new ATOM 0 HH11 ARG A 32 23.587 19.184 3.951 1.00 0.00 H new ATOM 0 HH12 ARG A 32 23.920 17.788 2.922 1.00 0.00 H new ATOM 0 HH21 ARG A 32 22.895 19.341 -0.004 1.00 0.00 H new ATOM 0 HH22 ARG A 32 23.539 17.876 0.744 1.00 0.00 H new ATOM 513 N VAL A 33 17.257 22.751 1.532 1.00 0.00 N ATOM 514 CA VAL A 33 15.924 22.391 1.005 1.00 0.00 C ATOM 515 C VAL A 33 16.073 21.703 -0.360 1.00 0.00 C ATOM 516 O VAL A 33 16.820 22.203 -1.203 1.00 0.00 O ATOM 517 CB VAL A 33 15.056 23.660 0.862 1.00 0.00 C ATOM 518 CG1 VAL A 33 13.680 23.381 0.239 1.00 0.00 C ATOM 519 CG2 VAL A 33 14.842 24.371 2.205 1.00 0.00 C ATOM 0 H VAL A 33 17.811 23.265 0.846 1.00 0.00 H new ATOM 0 HA VAL A 33 15.439 21.705 1.699 1.00 0.00 H new ATOM 0 HB VAL A 33 15.622 24.306 0.190 1.00 0.00 H new ATOM 0 HG11 VAL A 33 13.118 24.312 0.166 1.00 0.00 H new ATOM 0 HG12 VAL A 33 13.811 22.956 -0.756 1.00 0.00 H new ATOM 0 HG13 VAL A 33 13.133 22.676 0.865 1.00 0.00 H new ATOM 0 HG21 VAL A 33 14.226 25.257 2.053 1.00 0.00 H new ATOM 0 HG22 VAL A 33 14.341 23.695 2.899 1.00 0.00 H new ATOM 0 HG23 VAL A 33 15.807 24.666 2.618 1.00 0.00 H new ATOM 529 N THR A 34 15.363 20.594 -0.600 1.00 0.00 N ATOM 530 CA THR A 34 15.465 19.808 -1.849 1.00 0.00 C ATOM 531 C THR A 34 14.094 19.500 -2.464 1.00 0.00 C ATOM 532 O THR A 34 13.193 19.014 -1.781 1.00 0.00 O ATOM 533 CB THR A 34 16.258 18.510 -1.614 1.00 0.00 C ATOM 534 OG1 THR A 34 17.554 18.785 -1.110 1.00 0.00 O ATOM 535 CG2 THR A 34 16.433 17.666 -2.883 1.00 0.00 C ATOM 0 H THR A 34 14.695 20.209 0.068 1.00 0.00 H new ATOM 0 HA THR A 34 16.004 20.426 -2.567 1.00 0.00 H new ATOM 0 HB THR A 34 15.665 17.947 -0.893 1.00 0.00 H new ATOM 0 HG1 THR A 34 18.035 17.943 -0.968 1.00 0.00 H new ATOM 0 HG21 THR A 34 17.001 16.766 -2.646 1.00 0.00 H new ATOM 0 HG22 THR A 34 15.454 17.386 -3.271 1.00 0.00 H new ATOM 0 HG23 THR A 34 16.969 18.246 -3.634 1.00 0.00 H new ATOM 543 N THR A 35 13.939 19.761 -3.766 1.00 0.00 N ATOM 544 CA THR A 35 12.678 19.579 -4.511 1.00 0.00 C ATOM 545 C THR A 35 12.533 18.201 -5.173 1.00 0.00 C ATOM 546 O THR A 35 13.490 17.444 -5.335 1.00 0.00 O ATOM 547 CB THR A 35 12.460 20.679 -5.569 1.00 0.00 C ATOM 548 OG1 THR A 35 13.325 20.500 -6.672 1.00 0.00 O ATOM 549 CG2 THR A 35 12.661 22.090 -5.014 1.00 0.00 C ATOM 0 H THR A 35 14.699 20.112 -4.348 1.00 0.00 H new ATOM 0 HA THR A 35 11.905 19.655 -3.746 1.00 0.00 H new ATOM 0 HB THR A 35 11.421 20.582 -5.884 1.00 0.00 H new ATOM 0 HG1 THR A 35 13.167 21.209 -7.330 1.00 0.00 H new ATOM 0 HG21 THR A 35 12.494 22.820 -5.806 1.00 0.00 H new ATOM 0 HG22 THR A 35 11.954 22.266 -4.203 1.00 0.00 H new ATOM 0 HG23 THR A 35 13.679 22.191 -4.637 1.00 0.00 H new ATOM 557 N LEU A 36 11.310 17.894 -5.622 1.00 0.00 N ATOM 558 CA LEU A 36 10.942 16.739 -6.455 1.00 0.00 C ATOM 559 C LEU A 36 11.743 16.656 -7.774 1.00 0.00 C ATOM 560 O LEU A 36 11.984 15.564 -8.290 1.00 0.00 O ATOM 561 CB LEU A 36 9.423 16.853 -6.708 1.00 0.00 C ATOM 562 CG LEU A 36 8.809 15.830 -7.687 1.00 0.00 C ATOM 563 CD1 LEU A 36 8.971 14.382 -7.218 1.00 0.00 C ATOM 564 CD2 LEU A 36 7.314 16.096 -7.845 1.00 0.00 C ATOM 0 H LEU A 36 10.503 18.478 -5.402 1.00 0.00 H new ATOM 0 HA LEU A 36 11.189 15.813 -5.936 1.00 0.00 H new ATOM 0 HB2 LEU A 36 8.910 16.760 -5.751 1.00 0.00 H new ATOM 0 HB3 LEU A 36 9.214 17.854 -7.085 1.00 0.00 H new ATOM 0 HG LEU A 36 9.344 15.953 -8.629 1.00 0.00 H new ATOM 0 HD11 LEU A 36 8.519 13.710 -7.948 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.031 14.149 -7.117 1.00 0.00 H new ATOM 0 HD13 LEU A 36 8.478 14.254 -6.254 1.00 0.00 H new ATOM 0 HD21 LEU A 36 6.887 15.371 -8.537 1.00 0.00 H new ATOM 0 HD22 LEU A 36 6.824 16.005 -6.876 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.163 17.103 -8.235 1.00 0.00 H new ATOM 576 N PHE A 37 12.189 17.803 -8.292 1.00 0.00 N ATOM 577 CA PHE A 37 12.961 17.939 -9.536 1.00 0.00 C ATOM 578 C PHE A 37 14.478 18.106 -9.293 1.00 0.00 C ATOM 579 O PHE A 37 15.213 18.533 -10.188 1.00 0.00 O ATOM 580 CB PHE A 37 12.309 19.030 -10.406 1.00 0.00 C ATOM 581 CG PHE A 37 10.829 18.766 -10.631 1.00 0.00 C ATOM 582 CD1 PHE A 37 9.854 19.453 -9.880 1.00 0.00 C ATOM 583 CD2 PHE A 37 10.436 17.748 -11.521 1.00 0.00 C ATOM 584 CE1 PHE A 37 8.495 19.108 -10.012 1.00 0.00 C ATOM 585 CE2 PHE A 37 9.080 17.406 -11.651 1.00 0.00 C ATOM 586 CZ PHE A 37 8.113 18.082 -10.891 1.00 0.00 C ATOM 0 H PHE A 37 12.017 18.701 -7.840 1.00 0.00 H new ATOM 0 HA PHE A 37 12.918 17.007 -10.100 1.00 0.00 H new ATOM 0 HB2 PHE A 37 12.436 20.001 -9.927 1.00 0.00 H new ATOM 0 HB3 PHE A 37 12.819 19.080 -11.368 1.00 0.00 H new ATOM 0 HD1 PHE A 37 10.149 20.243 -9.205 1.00 0.00 H new ATOM 0 HD2 PHE A 37 11.180 17.228 -12.106 1.00 0.00 H new ATOM 0 HE1 PHE A 37 7.746 19.633 -9.437 1.00 0.00 H new ATOM 0 HE2 PHE A 37 8.782 16.625 -12.334 1.00 0.00 H new ATOM 0 HZ PHE A 37 7.071 17.812 -10.983 1.00 0.00 H new ATOM 596 N ASP A 38 14.949 17.740 -8.096 1.00 0.00 N ATOM 597 CA ASP A 38 16.353 17.735 -7.665 1.00 0.00 C ATOM 598 C ASP A 38 17.044 19.114 -7.703 1.00 0.00 C ATOM 599 O ASP A 38 18.262 19.206 -7.878 1.00 0.00 O ATOM 600 CB ASP A 38 17.117 16.607 -8.390 1.00 0.00 C ATOM 601 CG ASP A 38 18.444 16.209 -7.720 1.00 0.00 C ATOM 602 OD1 ASP A 38 19.335 15.678 -8.432 1.00 0.00 O ATOM 603 OD2 ASP A 38 18.605 16.355 -6.481 1.00 0.00 O1- ATOM 0 H ASP A 38 14.323 17.420 -7.357 1.00 0.00 H new ATOM 0 HA ASP A 38 16.371 17.510 -6.599 1.00 0.00 H new ATOM 0 HB2 ASP A 38 16.475 15.728 -8.448 1.00 0.00 H new ATOM 0 HB3 ASP A 38 17.320 16.921 -9.414 1.00 0.00 H new ATOM 608 N GLU A 39 16.284 20.205 -7.533 1.00 0.00 N ATOM 609 CA GLU A 39 16.846 21.526 -7.219 1.00 0.00 C ATOM 610 C GLU A 39 17.188 21.615 -5.725 1.00 0.00 C ATOM 611 O GLU A 39 16.423 21.139 -4.879 1.00 0.00 O ATOM 612 CB GLU A 39 15.884 22.659 -7.616 1.00 0.00 C ATOM 613 CG GLU A 39 15.496 22.641 -9.103 1.00 0.00 C ATOM 614 CD GLU A 39 14.803 23.941 -9.561 1.00 0.00 C ATOM 615 OE1 GLU A 39 14.181 24.653 -8.737 1.00 0.00 O ATOM 616 OE2 GLU A 39 14.865 24.261 -10.775 1.00 0.00 O1- ATOM 0 H GLU A 39 15.267 20.197 -7.609 1.00 0.00 H new ATOM 0 HA GLU A 39 17.759 21.648 -7.802 1.00 0.00 H new ATOM 0 HB2 GLU A 39 14.980 22.586 -7.012 1.00 0.00 H new ATOM 0 HB3 GLU A 39 16.347 23.617 -7.381 1.00 0.00 H new ATOM 0 HG2 GLU A 39 16.391 22.482 -9.704 1.00 0.00 H new ATOM 0 HG3 GLU A 39 14.832 21.797 -9.289 1.00 0.00 H new ATOM 623 N GLU A 40 18.313 22.251 -5.388 1.00 0.00 N ATOM 624 CA GLU A 40 18.753 22.504 -4.011 1.00 0.00 C ATOM 625 C GLU A 40 18.804 24.011 -3.706 1.00 0.00 C ATOM 626 O GLU A 40 19.326 24.806 -4.497 1.00 0.00 O ATOM 627 CB GLU A 40 20.100 21.806 -3.743 1.00 0.00 C ATOM 628 CG GLU A 40 20.610 22.014 -2.302 1.00 0.00 C ATOM 629 CD GLU A 40 21.852 21.164 -1.959 1.00 0.00 C ATOM 630 OE1 GLU A 40 22.068 20.864 -0.758 1.00 0.00 O ATOM 631 OE2 GLU A 40 22.641 20.806 -2.869 1.00 0.00 O1- ATOM 0 H GLU A 40 18.963 22.615 -6.085 1.00 0.00 H new ATOM 0 HA GLU A 40 18.019 22.076 -3.328 1.00 0.00 H new ATOM 0 HB2 GLU A 40 19.994 20.738 -3.935 1.00 0.00 H new ATOM 0 HB3 GLU A 40 20.844 22.183 -4.444 1.00 0.00 H new ATOM 0 HG2 GLU A 40 20.850 23.068 -2.159 1.00 0.00 H new ATOM 0 HG3 GLU A 40 19.809 21.771 -1.603 1.00 0.00 H new ATOM 638 N HIS A 41 18.307 24.398 -2.529 1.00 0.00 N ATOM 639 CA HIS A 41 18.306 25.774 -2.011 1.00 0.00 C ATOM 640 C HIS A 41 18.853 25.785 -0.580 1.00 0.00 C ATOM 641 O HIS A 41 18.581 24.854 0.180 1.00 0.00 O ATOM 642 CB HIS A 41 16.885 26.357 -2.071 1.00 0.00 C ATOM 643 CG HIS A 41 16.191 26.193 -3.406 1.00 0.00 C ATOM 644 ND1 HIS A 41 16.323 27.047 -4.506 1.00 0.00 N ATOM 645 CD2 HIS A 41 15.362 25.160 -3.740 1.00 0.00 C ATOM 646 CE1 HIS A 41 15.560 26.512 -5.476 1.00 0.00 C ATOM 647 NE2 HIS A 41 14.982 25.379 -5.044 1.00 0.00 N ATOM 0 H HIS A 41 17.876 23.737 -1.882 1.00 0.00 H new ATOM 0 HA HIS A 41 18.951 26.399 -2.629 1.00 0.00 H new ATOM 0 HB2 HIS A 41 16.279 25.881 -1.301 1.00 0.00 H new ATOM 0 HB3 HIS A 41 16.932 27.419 -1.829 1.00 0.00 H new ATOM 0 HD2 HIS A 41 15.065 24.337 -3.107 1.00 0.00 H new ATOM 0 HE1 HIS A 41 15.431 26.933 -6.462 1.00 0.00 H new ATOM 0 HE2 HIS A 41 14.364 24.780 -5.592 1.00 0.00 H new ATOM 655 N ALA A 42 19.632 26.799 -0.202 1.00 0.00 N ATOM 656 CA ALA A 42 20.272 26.875 1.114 1.00 0.00 C ATOM 657 C ALA A 42 20.361 28.316 1.648 1.00 0.00 C ATOM 658 O ALA A 42 20.581 29.260 0.882 1.00 0.00 O ATOM 659 CB ALA A 42 21.650 26.207 1.044 1.00 0.00 C ATOM 0 H ALA A 42 19.839 27.596 -0.803 1.00 0.00 H new ATOM 0 HA ALA A 42 19.649 26.338 1.829 1.00 0.00 H new ATOM 0 HB1 ALA A 42 22.131 26.261 2.021 1.00 0.00 H new ATOM 0 HB2 ALA A 42 21.534 25.163 0.754 1.00 0.00 H new ATOM 0 HB3 ALA A 42 22.267 26.722 0.307 1.00 0.00 H new ATOM 665 N PHE A 43 20.195 28.474 2.967 1.00 0.00 N ATOM 666 CA PHE A 43 20.028 29.774 3.632 1.00 0.00 C ATOM 667 C PHE A 43 20.705 29.788 5.019 1.00 0.00 C ATOM 668 O PHE A 43 20.274 29.055 5.916 1.00 0.00 O ATOM 669 CB PHE A 43 18.529 30.113 3.740 1.00 0.00 C ATOM 670 CG PHE A 43 17.752 30.071 2.431 1.00 0.00 C ATOM 671 CD1 PHE A 43 17.700 31.203 1.599 1.00 0.00 C ATOM 672 CD2 PHE A 43 17.113 28.881 2.023 1.00 0.00 C ATOM 673 CE1 PHE A 43 17.023 31.144 0.365 1.00 0.00 C ATOM 674 CE2 PHE A 43 16.451 28.817 0.782 1.00 0.00 C ATOM 675 CZ PHE A 43 16.406 29.950 -0.045 1.00 0.00 C ATOM 0 H PHE A 43 20.172 27.687 3.615 1.00 0.00 H new ATOM 0 HA PHE A 43 20.519 30.539 3.030 1.00 0.00 H new ATOM 0 HB2 PHE A 43 18.066 29.417 4.440 1.00 0.00 H new ATOM 0 HB3 PHE A 43 18.430 31.110 4.170 1.00 0.00 H new ATOM 0 HD1 PHE A 43 18.180 32.120 1.907 1.00 0.00 H new ATOM 0 HD2 PHE A 43 17.132 28.014 2.667 1.00 0.00 H new ATOM 0 HE1 PHE A 43 16.978 32.018 -0.267 1.00 0.00 H new ATOM 0 HE2 PHE A 43 15.979 27.898 0.467 1.00 0.00 H new ATOM 0 HZ PHE A 43 15.897 29.904 -0.997 1.00 0.00 H new ATOM 685 N PRO A 44 21.766 30.592 5.232 1.00 0.00 N ATOM 686 CA PRO A 44 22.411 30.732 6.539 1.00 0.00 C ATOM 687 C PRO A 44 21.501 31.343 7.621 1.00 0.00 C ATOM 688 O PRO A 44 20.623 32.158 7.336 1.00 0.00 O ATOM 689 CB PRO A 44 23.649 31.606 6.305 1.00 0.00 C ATOM 690 CG PRO A 44 23.960 31.391 4.828 1.00 0.00 C ATOM 691 CD PRO A 44 22.571 31.249 4.210 1.00 0.00 C ATOM 0 HA PRO A 44 22.665 29.746 6.927 1.00 0.00 H new ATOM 0 HB2 PRO A 44 23.448 32.655 6.525 1.00 0.00 H new ATOM 0 HB3 PRO A 44 24.481 31.301 6.939 1.00 0.00 H new ATOM 0 HG2 PRO A 44 24.508 32.232 4.403 1.00 0.00 H new ATOM 0 HG3 PRO A 44 24.568 30.500 4.668 1.00 0.00 H new ATOM 0 HD2 PRO A 44 22.156 32.222 3.946 1.00 0.00 H new ATOM 0 HD3 PRO A 44 22.605 30.658 3.295 1.00 0.00 H new ATOM 699 N GLY A 45 21.759 30.977 8.879 1.00 0.00 N ATOM 700 CA GLY A 45 21.143 31.574 10.069 1.00 0.00 C ATOM 701 C GLY A 45 19.690 31.169 10.342 1.00 0.00 C ATOM 702 O GLY A 45 19.037 31.798 11.173 1.00 0.00 O ATOM 0 H GLY A 45 22.422 30.235 9.105 1.00 0.00 H new ATOM 0 HA2 GLY A 45 21.744 31.308 10.938 1.00 0.00 H new ATOM 0 HA3 GLY A 45 21.186 32.659 9.972 1.00 0.00 H new ATOM 706 N LEU A 46 19.175 30.142 9.657 1.00 0.00 N ATOM 707 CA LEU A 46 17.828 29.592 9.877 1.00 0.00 C ATOM 708 C LEU A 46 17.846 28.206 10.554 1.00 0.00 C ATOM 709 O LEU A 46 18.848 27.483 10.522 1.00 0.00 O ATOM 710 CB LEU A 46 17.055 29.532 8.545 1.00 0.00 C ATOM 711 CG LEU A 46 16.865 30.869 7.795 1.00 0.00 C ATOM 712 CD1 LEU A 46 15.963 30.638 6.582 1.00 0.00 C ATOM 713 CD2 LEU A 46 16.198 31.953 8.649 1.00 0.00 C ATOM 0 H LEU A 46 19.690 29.659 8.921 1.00 0.00 H new ATOM 0 HA LEU A 46 17.319 30.267 10.565 1.00 0.00 H new ATOM 0 HB2 LEU A 46 17.573 28.840 7.881 1.00 0.00 H new ATOM 0 HB3 LEU A 46 16.070 29.109 8.741 1.00 0.00 H new ATOM 0 HG LEU A 46 17.862 31.211 7.519 1.00 0.00 H new ATOM 0 HD11 LEU A 46 15.824 31.578 6.047 1.00 0.00 H new ATOM 0 HD12 LEU A 46 16.426 29.908 5.918 1.00 0.00 H new ATOM 0 HD13 LEU A 46 14.995 30.263 6.915 1.00 0.00 H new ATOM 0 HD21 LEU A 46 16.094 32.866 8.062 1.00 0.00 H new ATOM 0 HD22 LEU A 46 15.213 31.611 8.966 1.00 0.00 H new ATOM 0 HD23 LEU A 46 16.812 32.154 9.527 1.00 0.00 H new ATOM 725 N ALA A 47 16.704 27.826 11.124 1.00 0.00 N ATOM 726 CA ALA A 47 16.356 26.485 11.591 1.00 0.00 C ATOM 727 C ALA A 47 14.879 26.160 11.269 1.00 0.00 C ATOM 728 O ALA A 47 14.092 27.059 10.951 1.00 0.00 O ATOM 729 CB ALA A 47 16.660 26.393 13.089 1.00 0.00 C ATOM 0 H ALA A 47 15.947 28.491 11.282 1.00 0.00 H new ATOM 0 HA ALA A 47 16.955 25.738 11.071 1.00 0.00 H new ATOM 0 HB1 ALA A 47 16.405 25.397 13.452 1.00 0.00 H new ATOM 0 HB2 ALA A 47 17.721 26.580 13.257 1.00 0.00 H new ATOM 0 HB3 ALA A 47 16.071 27.136 13.626 1.00 0.00 H new ATOM 735 N ILE A 48 14.483 24.885 11.331 1.00 0.00 N ATOM 736 CA ILE A 48 13.086 24.469 11.110 1.00 0.00 C ATOM 737 C ILE A 48 12.239 24.844 12.336 1.00 0.00 C ATOM 738 O ILE A 48 12.528 24.408 13.454 1.00 0.00 O ATOM 739 CB ILE A 48 12.996 22.965 10.753 1.00 0.00 C ATOM 740 CG1 ILE A 48 13.821 22.592 9.495 1.00 0.00 C ATOM 741 CG2 ILE A 48 11.527 22.552 10.547 1.00 0.00 C ATOM 742 CD1 ILE A 48 14.244 21.119 9.486 1.00 0.00 C ATOM 0 H ILE A 48 15.116 24.111 11.535 1.00 0.00 H new ATOM 0 HA ILE A 48 12.681 25.003 10.250 1.00 0.00 H new ATOM 0 HB ILE A 48 13.424 22.421 11.595 1.00 0.00 H new ATOM 0 HG12 ILE A 48 13.232 22.803 8.602 1.00 0.00 H new ATOM 0 HG13 ILE A 48 14.709 23.222 9.447 1.00 0.00 H new ATOM 0 HG21 ILE A 48 11.479 21.492 10.297 1.00 0.00 H new ATOM 0 HG22 ILE A 48 10.966 22.734 11.464 1.00 0.00 H new ATOM 0 HG23 ILE A 48 11.095 23.137 9.735 1.00 0.00 H new ATOM 0 HD11 ILE A 48 14.819 20.911 8.584 1.00 0.00 H new ATOM 0 HD12 ILE A 48 14.857 20.911 10.363 1.00 0.00 H new ATOM 0 HD13 ILE A 48 13.357 20.486 9.505 1.00 0.00 H new ATOM 754 N GLY A 49 11.194 25.648 12.136 1.00 0.00 N ATOM 755 CA GLY A 49 10.311 26.153 13.195 1.00 0.00 C ATOM 756 C GLY A 49 9.002 25.374 13.346 1.00 0.00 C ATOM 757 O GLY A 49 8.547 25.163 14.476 1.00 0.00 O ATOM 0 H GLY A 49 10.929 25.977 11.208 1.00 0.00 H new ATOM 0 HA2 GLY A 49 10.848 26.127 14.143 1.00 0.00 H new ATOM 0 HA3 GLY A 49 10.077 27.198 12.990 1.00 0.00 H new ATOM 761 N ARG A 50 8.397 24.942 12.235 1.00 0.00 N ATOM 762 CA ARG A 50 7.197 24.088 12.200 1.00 0.00 C ATOM 763 C ARG A 50 7.216 23.123 11.009 1.00 0.00 C ATOM 764 O ARG A 50 7.693 23.474 9.931 1.00 0.00 O ATOM 765 CB ARG A 50 5.889 24.910 12.153 1.00 0.00 C ATOM 766 CG ARG A 50 5.501 25.663 13.431 1.00 0.00 C ATOM 767 CD ARG A 50 6.020 27.102 13.511 1.00 0.00 C ATOM 768 NE ARG A 50 5.518 27.762 14.729 1.00 0.00 N ATOM 769 CZ ARG A 50 5.901 27.548 15.977 1.00 0.00 C ATOM 770 NH1 ARG A 50 6.889 26.773 16.308 1.00 0.00 N1+ ATOM 771 NH2 ARG A 50 5.279 28.098 16.978 1.00 0.00 N ATOM 0 H ARG A 50 8.737 25.183 11.304 1.00 0.00 H new ATOM 0 HA ARG A 50 7.220 23.517 13.128 1.00 0.00 H new ATOM 0 HB2 ARG A 50 5.972 25.635 11.343 1.00 0.00 H new ATOM 0 HB3 ARG A 50 5.073 24.235 11.895 1.00 0.00 H new ATOM 0 HG2 ARG A 50 4.414 25.679 13.511 1.00 0.00 H new ATOM 0 HG3 ARG A 50 5.876 25.108 14.291 1.00 0.00 H new ATOM 0 HD2 ARG A 50 7.110 27.103 13.512 1.00 0.00 H new ATOM 0 HD3 ARG A 50 5.702 27.660 12.630 1.00 0.00 H new ATOM 0 HE ARG A 50 4.791 28.465 14.594 1.00 0.00 H new ATOM 0 HH11 ARG A 50 7.420 26.287 15.585 1.00 0.00 H new ATOM 0 HH12 ARG A 50 7.134 26.650 17.291 1.00 0.00 H new ATOM 0 HH21 ARG A 50 4.479 28.708 16.809 1.00 0.00 H new ATOM 0 HH22 ARG A 50 5.591 27.919 17.933 1.00 0.00 H new ATOM 785 N VAL A 51 6.616 21.947 11.203 1.00 0.00 N ATOM 786 CA VAL A 51 6.280 20.966 10.162 1.00 0.00 C ATOM 787 C VAL A 51 4.805 20.603 10.326 1.00 0.00 C ATOM 788 O VAL A 51 4.412 20.108 11.380 1.00 0.00 O ATOM 789 CB VAL A 51 7.177 19.712 10.263 1.00 0.00 C ATOM 790 CG1 VAL A 51 6.773 18.623 9.262 1.00 0.00 C ATOM 791 CG2 VAL A 51 8.657 20.055 10.032 1.00 0.00 C ATOM 0 H VAL A 51 6.337 21.635 12.133 1.00 0.00 H new ATOM 0 HA VAL A 51 6.455 21.393 9.175 1.00 0.00 H new ATOM 0 HB VAL A 51 7.038 19.334 11.276 1.00 0.00 H new ATOM 0 HG11 VAL A 51 7.434 17.763 9.373 1.00 0.00 H new ATOM 0 HG12 VAL A 51 5.744 18.317 9.453 1.00 0.00 H new ATOM 0 HG13 VAL A 51 6.853 19.013 8.247 1.00 0.00 H new ATOM 0 HG21 VAL A 51 9.257 19.149 10.111 1.00 0.00 H new ATOM 0 HG22 VAL A 51 8.780 20.486 9.039 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.985 20.774 10.783 1.00 0.00 H new ATOM 801 N ASP A 52 3.986 20.856 9.306 1.00 0.00 N ATOM 802 CA ASP A 52 2.525 20.682 9.344 1.00 0.00 C ATOM 803 C ASP A 52 2.059 19.847 8.142 1.00 0.00 C ATOM 804 O ASP A 52 1.948 20.342 7.016 1.00 0.00 O ATOM 805 CB ASP A 52 1.875 22.076 9.423 1.00 0.00 C ATOM 806 CG ASP A 52 0.337 22.073 9.456 1.00 0.00 C ATOM 807 OD1 ASP A 52 -0.253 23.149 9.726 1.00 0.00 O ATOM 808 OD2 ASP A 52 -0.293 21.022 9.199 1.00 0.00 O1- ATOM 0 H ASP A 52 4.323 21.196 8.406 1.00 0.00 H new ATOM 0 HA ASP A 52 2.214 20.123 10.226 1.00 0.00 H new ATOM 0 HB2 ASP A 52 2.242 22.582 10.316 1.00 0.00 H new ATOM 0 HB3 ASP A 52 2.204 22.663 8.566 1.00 0.00 H new ATOM 813 N LEU A 53 1.814 18.558 8.379 1.00 0.00 N ATOM 814 CA LEU A 53 1.474 17.566 7.347 1.00 0.00 C ATOM 815 C LEU A 53 -0.030 17.515 7.018 1.00 0.00 C ATOM 816 O LEU A 53 -0.417 16.966 5.982 1.00 0.00 O ATOM 817 CB LEU A 53 2.025 16.190 7.771 1.00 0.00 C ATOM 818 CG LEU A 53 3.502 16.181 8.212 1.00 0.00 C ATOM 819 CD1 LEU A 53 3.949 14.760 8.507 1.00 0.00 C ATOM 820 CD2 LEU A 53 4.437 16.750 7.143 1.00 0.00 C ATOM 0 H LEU A 53 1.846 18.160 9.318 1.00 0.00 H new ATOM 0 HA LEU A 53 1.948 17.873 6.415 1.00 0.00 H new ATOM 0 HB2 LEU A 53 1.416 15.810 8.591 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.907 15.497 6.938 1.00 0.00 H new ATOM 0 HG LEU A 53 3.561 16.809 9.101 1.00 0.00 H new ATOM 0 HD11 LEU A 53 4.994 14.764 8.818 1.00 0.00 H new ATOM 0 HD12 LEU A 53 3.335 14.344 9.305 1.00 0.00 H new ATOM 0 HD13 LEU A 53 3.840 14.151 7.610 1.00 0.00 H new ATOM 0 HD21 LEU A 53 5.465 16.720 7.505 1.00 0.00 H new ATOM 0 HD22 LEU A 53 4.355 16.154 6.234 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.158 17.781 6.927 1.00 0.00 H new ATOM 832 N ARG A 54 -0.872 18.134 7.856 1.00 0.00 N ATOM 833 CA ARG A 54 -2.289 18.420 7.564 1.00 0.00 C ATOM 834 C ARG A 54 -2.419 19.514 6.503 1.00 0.00 C ATOM 835 O ARG A 54 -3.155 19.344 5.532 1.00 0.00 O ATOM 836 CB ARG A 54 -2.974 18.810 8.884 1.00 0.00 C ATOM 837 CG ARG A 54 -4.442 19.234 8.730 1.00 0.00 C ATOM 838 CD ARG A 54 -5.122 19.455 10.094 1.00 0.00 C ATOM 839 NE ARG A 54 -4.312 20.284 11.023 1.00 0.00 N ATOM 840 CZ ARG A 54 -4.187 21.603 11.038 1.00 0.00 C ATOM 841 NH1 ARG A 54 -4.872 22.376 10.244 1.00 0.00 N1+ ATOM 842 NH2 ARG A 54 -3.361 22.173 11.867 1.00 0.00 N ATOM 0 H ARG A 54 -0.583 18.459 8.779 1.00 0.00 H new ATOM 0 HA ARG A 54 -2.779 17.538 7.151 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -2.922 17.965 9.571 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -2.417 19.628 9.341 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -4.495 20.152 8.145 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -4.984 18.469 8.174 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -6.088 19.934 9.938 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -5.317 18.488 10.557 1.00 0.00 H new ATOM 0 HE ARG A 54 -3.788 19.776 11.736 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -5.532 21.970 9.581 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -4.748 23.388 10.285 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -2.808 21.604 12.508 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -3.267 23.189 11.876 1.00 0.00 H new ATOM 856 N SER A 55 -1.670 20.605 6.658 1.00 0.00 N ATOM 857 CA SER A 55 -1.601 21.719 5.701 1.00 0.00 C ATOM 858 C SER A 55 -0.708 21.429 4.479 1.00 0.00 C ATOM 859 O SER A 55 -0.986 21.900 3.373 1.00 0.00 O ATOM 860 CB SER A 55 -1.099 22.965 6.447 1.00 0.00 C ATOM 861 OG SER A 55 -1.169 24.122 5.626 1.00 0.00 O ATOM 0 H SER A 55 -1.076 20.746 7.475 1.00 0.00 H new ATOM 0 HA SER A 55 -2.603 21.876 5.301 1.00 0.00 H new ATOM 0 HB2 SER A 55 -1.696 23.118 7.346 1.00 0.00 H new ATOM 0 HB3 SER A 55 -0.070 22.808 6.770 1.00 0.00 H new ATOM 0 HG SER A 55 -0.845 24.899 6.127 1.00 0.00 H new ATOM 867 N GLY A 56 0.355 20.634 4.657 1.00 0.00 N ATOM 868 CA GLY A 56 1.387 20.377 3.643 1.00 0.00 C ATOM 869 C GLY A 56 2.433 21.498 3.557 1.00 0.00 C ATOM 870 O GLY A 56 2.807 21.912 2.456 1.00 0.00 O ATOM 0 H GLY A 56 0.526 20.139 5.532 1.00 0.00 H new ATOM 0 HA2 GLY A 56 1.888 19.436 3.872 1.00 0.00 H new ATOM 0 HA3 GLY A 56 0.911 20.256 2.670 1.00 0.00 H new ATOM 874 N VAL A 57 2.878 22.024 4.710 1.00 0.00 N ATOM 875 CA VAL A 57 3.755 23.210 4.823 1.00 0.00 C ATOM 876 C VAL A 57 4.873 22.988 5.850 1.00 0.00 C ATOM 877 O VAL A 57 4.657 22.399 6.915 1.00 0.00 O ATOM 878 CB VAL A 57 2.932 24.472 5.165 1.00 0.00 C ATOM 879 CG1 VAL A 57 3.796 25.736 5.290 1.00 0.00 C ATOM 880 CG2 VAL A 57 1.865 24.764 4.097 1.00 0.00 C ATOM 0 H VAL A 57 2.633 21.627 5.617 1.00 0.00 H new ATOM 0 HA VAL A 57 4.228 23.364 3.853 1.00 0.00 H new ATOM 0 HB VAL A 57 2.470 24.246 6.126 1.00 0.00 H new ATOM 0 HG11 VAL A 57 3.161 26.588 5.531 1.00 0.00 H new ATOM 0 HG12 VAL A 57 4.532 25.597 6.082 1.00 0.00 H new ATOM 0 HG13 VAL A 57 4.309 25.921 4.346 1.00 0.00 H new ATOM 0 HG21 VAL A 57 1.308 25.659 4.374 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.349 24.922 3.133 1.00 0.00 H new ATOM 0 HG23 VAL A 57 1.181 23.918 4.025 1.00 0.00 H new ATOM 890 N ILE A 58 6.070 23.491 5.547 1.00 0.00 N ATOM 891 CA ILE A 58 7.232 23.556 6.439 1.00 0.00 C ATOM 892 C ILE A 58 7.612 25.033 6.624 1.00 0.00 C ATOM 893 O ILE A 58 7.879 25.731 5.641 1.00 0.00 O ATOM 894 CB ILE A 58 8.401 22.718 5.863 1.00 0.00 C ATOM 895 CG1 ILE A 58 8.042 21.220 5.738 1.00 0.00 C ATOM 896 CG2 ILE A 58 9.657 22.886 6.742 1.00 0.00 C ATOM 897 CD1 ILE A 58 8.944 20.460 4.763 1.00 0.00 C ATOM 0 H ILE A 58 6.267 23.884 4.627 1.00 0.00 H new ATOM 0 HA ILE A 58 6.995 23.129 7.414 1.00 0.00 H new ATOM 0 HB ILE A 58 8.602 23.091 4.859 1.00 0.00 H new ATOM 0 HG12 ILE A 58 8.108 20.754 6.721 1.00 0.00 H new ATOM 0 HG13 ILE A 58 7.006 21.128 5.411 1.00 0.00 H new ATOM 0 HG21 ILE A 58 10.473 22.293 6.328 1.00 0.00 H new ATOM 0 HG22 ILE A 58 9.947 23.936 6.765 1.00 0.00 H new ATOM 0 HG23 ILE A 58 9.440 22.548 7.755 1.00 0.00 H new ATOM 0 HD11 ILE A 58 8.637 19.415 4.723 1.00 0.00 H new ATOM 0 HD12 ILE A 58 8.860 20.901 3.770 1.00 0.00 H new ATOM 0 HD13 ILE A 58 9.979 20.522 5.101 1.00 0.00 H new ATOM 909 N SER A 59 7.636 25.524 7.861 1.00 0.00 N ATOM 910 CA SER A 59 7.956 26.924 8.186 1.00 0.00 C ATOM 911 C SER A 59 9.321 27.028 8.860 1.00 0.00 C ATOM 912 O SER A 59 9.587 26.337 9.846 1.00 0.00 O ATOM 913 CB SER A 59 6.899 27.567 9.088 1.00 0.00 C ATOM 914 OG SER A 59 5.607 27.484 8.508 1.00 0.00 O ATOM 0 H SER A 59 7.431 24.956 8.683 1.00 0.00 H new ATOM 0 HA SER A 59 7.971 27.465 7.240 1.00 0.00 H new ATOM 0 HB2 SER A 59 6.897 27.072 10.059 1.00 0.00 H new ATOM 0 HB3 SER A 59 7.155 28.612 9.264 1.00 0.00 H new ATOM 0 HG SER A 59 4.952 27.901 9.106 1.00 0.00 H new ATOM 920 N LEU A 60 10.192 27.897 8.343 1.00 0.00 N ATOM 921 CA LEU A 60 11.548 28.124 8.855 1.00 0.00 C ATOM 922 C LEU A 60 11.650 29.473 9.590 1.00 0.00 C ATOM 923 O LEU A 60 10.966 30.440 9.245 1.00 0.00 O ATOM 924 CB LEU A 60 12.582 28.001 7.716 1.00 0.00 C ATOM 925 CG LEU A 60 12.410 26.772 6.793 1.00 0.00 C ATOM 926 CD1 LEU A 60 13.518 26.730 5.748 1.00 0.00 C ATOM 927 CD2 LEU A 60 12.472 25.446 7.551 1.00 0.00 C ATOM 0 H LEU A 60 9.969 28.478 7.535 1.00 0.00 H new ATOM 0 HA LEU A 60 11.774 27.351 9.589 1.00 0.00 H new ATOM 0 HB2 LEU A 60 12.533 28.902 7.105 1.00 0.00 H new ATOM 0 HB3 LEU A 60 13.579 27.967 8.155 1.00 0.00 H new ATOM 0 HG LEU A 60 11.426 26.884 6.338 1.00 0.00 H new ATOM 0 HD11 LEU A 60 13.381 25.859 5.107 1.00 0.00 H new ATOM 0 HD12 LEU A 60 13.481 27.635 5.142 1.00 0.00 H new ATOM 0 HD13 LEU A 60 14.485 26.666 6.246 1.00 0.00 H new ATOM 0 HD21 LEU A 60 12.345 24.620 6.851 1.00 0.00 H new ATOM 0 HD22 LEU A 60 13.438 25.356 8.047 1.00 0.00 H new ATOM 0 HD23 LEU A 60 11.677 25.415 8.296 1.00 0.00 H new ATOM 939 N ILE A 61 12.517 29.531 10.606 1.00 0.00 N ATOM 940 CA ILE A 61 12.681 30.655 11.552 1.00 0.00 C ATOM 941 C ILE A 61 14.164 30.960 11.795 1.00 0.00 C ATOM 942 O ILE A 61 15.033 30.121 11.562 1.00 0.00 O ATOM 943 CB ILE A 61 11.931 30.390 12.886 1.00 0.00 C ATOM 944 CG1 ILE A 61 12.488 29.175 13.668 1.00 0.00 C ATOM 945 CG2 ILE A 61 10.421 30.227 12.645 1.00 0.00 C ATOM 946 CD1 ILE A 61 13.423 29.558 14.814 1.00 0.00 C ATOM 0 H ILE A 61 13.157 28.762 10.806 1.00 0.00 H new ATOM 0 HA ILE A 61 12.231 31.537 11.097 1.00 0.00 H new ATOM 0 HB ILE A 61 12.101 31.268 13.509 1.00 0.00 H new ATOM 0 HG12 ILE A 61 11.654 28.599 14.069 1.00 0.00 H new ATOM 0 HG13 ILE A 61 13.023 28.524 12.977 1.00 0.00 H new ATOM 0 HG21 ILE A 61 9.919 30.042 13.595 1.00 0.00 H new ATOM 0 HG22 ILE A 61 10.024 31.137 12.195 1.00 0.00 H new ATOM 0 HG23 ILE A 61 10.248 29.386 11.974 1.00 0.00 H new ATOM 0 HD11 ILE A 61 13.773 28.656 15.315 1.00 0.00 H new ATOM 0 HD12 ILE A 61 14.277 30.108 14.419 1.00 0.00 H new ATOM 0 HD13 ILE A 61 12.887 30.184 15.527 1.00 0.00 H new ATOM 958 N GLU A 62 14.463 32.163 12.282 1.00 0.00 N ATOM 959 CA GLU A 62 15.835 32.602 12.573 1.00 0.00 C ATOM 960 C GLU A 62 16.447 31.857 13.771 1.00 0.00 C ATOM 961 O GLU A 62 15.961 31.956 14.899 1.00 0.00 O ATOM 962 CB GLU A 62 15.894 34.116 12.824 1.00 0.00 C ATOM 963 CG GLU A 62 15.790 34.936 11.525 1.00 0.00 C ATOM 964 CD GLU A 62 16.672 36.199 11.559 1.00 0.00 C ATOM 965 OE1 GLU A 62 17.914 36.071 11.711 1.00 0.00 O ATOM 966 OE2 GLU A 62 16.136 37.330 11.430 1.00 0.00 O1- ATOM 0 H GLU A 62 13.757 32.870 12.489 1.00 0.00 H new ATOM 0 HA GLU A 62 16.425 32.361 11.689 1.00 0.00 H new ATOM 0 HB2 GLU A 62 15.084 34.401 13.495 1.00 0.00 H new ATOM 0 HB3 GLU A 62 16.828 34.361 13.330 1.00 0.00 H new ATOM 0 HG2 GLU A 62 16.084 34.313 10.680 1.00 0.00 H new ATOM 0 HG3 GLU A 62 14.752 35.225 11.362 1.00 0.00 H new ATOM 1113 N MET B 3 0.872 12.180 7.156 1.00 0.00 N ATOM 1114 CA MET B 3 1.415 12.008 8.517 1.00 0.00 C ATOM 1115 C MET B 3 2.817 11.368 8.462 1.00 0.00 C ATOM 1116 O MET B 3 3.206 10.786 7.442 1.00 0.00 O ATOM 1117 CB MET B 3 0.425 11.233 9.413 1.00 0.00 C ATOM 1118 CG MET B 3 0.230 9.753 9.045 1.00 0.00 C ATOM 1119 SD MET B 3 1.530 8.632 9.628 1.00 0.00 S ATOM 1120 CE MET B 3 0.808 7.047 9.128 1.00 0.00 C ATOM 0 HA MET B 3 1.538 12.987 8.979 1.00 0.00 H new ATOM 0 HB2 MET B 3 0.771 11.292 10.445 1.00 0.00 H new ATOM 0 HB3 MET B 3 -0.543 11.732 9.373 1.00 0.00 H new ATOM 0 HG2 MET B 3 -0.725 9.418 9.450 1.00 0.00 H new ATOM 0 HG3 MET B 3 0.162 9.671 7.960 1.00 0.00 H new ATOM 0 HE1 MET B 3 1.479 6.236 9.411 1.00 0.00 H new ATOM 0 HE2 MET B 3 -0.153 6.912 9.624 1.00 0.00 H new ATOM 0 HE3 MET B 3 0.663 7.038 8.048 1.00 0.00 H new ATOM 1130 N ALA B 4 3.591 11.499 9.539 1.00 0.00 N ATOM 1131 CA ALA B 4 4.959 10.976 9.669 1.00 0.00 C ATOM 1132 C ALA B 4 5.210 10.322 11.046 1.00 0.00 C ATOM 1133 O ALA B 4 4.341 10.317 11.926 1.00 0.00 O ATOM 1134 CB ALA B 4 5.931 12.139 9.409 1.00 0.00 C ATOM 0 H ALA B 4 3.276 11.989 10.376 1.00 0.00 H new ATOM 0 HA ALA B 4 5.116 10.182 8.939 1.00 0.00 H new ATOM 0 HB1 ALA B 4 6.957 11.782 9.498 1.00 0.00 H new ATOM 0 HB2 ALA B 4 5.769 12.531 8.405 1.00 0.00 H new ATOM 0 HB3 ALA B 4 5.757 12.929 10.139 1.00 0.00 H new ATOM 1140 N LYS B 5 6.423 9.793 11.246 1.00 0.00 N ATOM 1141 CA LYS B 5 6.968 9.417 12.559 1.00 0.00 C ATOM 1142 C LYS B 5 8.104 10.353 12.987 1.00 0.00 C ATOM 1143 O LYS B 5 8.962 10.713 12.179 1.00 0.00 O ATOM 1144 CB LYS B 5 7.343 7.925 12.610 1.00 0.00 C ATOM 1145 CG LYS B 5 8.415 7.493 11.594 1.00 0.00 C ATOM 1146 CD LYS B 5 8.708 5.988 11.717 1.00 0.00 C ATOM 1147 CE LYS B 5 9.736 5.499 10.684 1.00 0.00 C ATOM 1148 NZ LYS B 5 9.183 5.479 9.307 1.00 0.00 N1+ ATOM 0 H LYS B 5 7.071 9.609 10.480 1.00 0.00 H new ATOM 0 HA LYS B 5 6.182 9.549 13.302 1.00 0.00 H new ATOM 0 HB2 LYS B 5 7.697 7.688 13.613 1.00 0.00 H new ATOM 0 HB3 LYS B 5 6.443 7.333 12.441 1.00 0.00 H new ATOM 0 HG2 LYS B 5 8.077 7.721 10.583 1.00 0.00 H new ATOM 0 HG3 LYS B 5 9.330 8.061 11.760 1.00 0.00 H new ATOM 0 HD2 LYS B 5 9.077 5.774 12.720 1.00 0.00 H new ATOM 0 HD3 LYS B 5 7.780 5.430 11.593 1.00 0.00 H new ATOM 0 HE2 LYS B 5 10.612 6.146 10.712 1.00 0.00 H new ATOM 0 HE3 LYS B 5 10.071 4.497 10.954 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 9.911 5.143 8.645 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 8.362 4.841 9.272 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 8.887 6.439 9.038 1.00 0.00 H new ATOM 1162 N VAL B 6 8.102 10.749 14.259 1.00 0.00 N ATOM 1163 CA VAL B 6 9.181 11.523 14.898 1.00 0.00 C ATOM 1164 C VAL B 6 10.217 10.577 15.506 1.00 0.00 C ATOM 1165 O VAL B 6 9.856 9.544 16.076 1.00 0.00 O ATOM 1166 CB VAL B 6 8.609 12.501 15.948 1.00 0.00 C ATOM 1167 CG1 VAL B 6 9.653 13.087 16.906 1.00 0.00 C ATOM 1168 CG2 VAL B 6 7.931 13.673 15.237 1.00 0.00 C ATOM 0 H VAL B 6 7.333 10.538 14.895 1.00 0.00 H new ATOM 0 HA VAL B 6 9.682 12.125 14.140 1.00 0.00 H new ATOM 0 HB VAL B 6 7.913 11.911 16.544 1.00 0.00 H new ATOM 0 HG11 VAL B 6 9.164 13.762 17.608 1.00 0.00 H new ATOM 0 HG12 VAL B 6 10.136 12.279 17.456 1.00 0.00 H new ATOM 0 HG13 VAL B 6 10.402 13.637 16.336 1.00 0.00 H new ATOM 0 HG21 VAL B 6 7.527 14.363 15.978 1.00 0.00 H new ATOM 0 HG22 VAL B 6 8.660 14.193 14.616 1.00 0.00 H new ATOM 0 HG23 VAL B 6 7.121 13.299 14.610 1.00 0.00 H new ATOM 1178 N VAL B 7 11.494 10.956 15.440 1.00 0.00 N ATOM 1179 CA VAL B 7 12.603 10.351 16.193 1.00 0.00 C ATOM 1180 C VAL B 7 13.389 11.434 16.939 1.00 0.00 C ATOM 1181 O VAL B 7 13.641 12.514 16.402 1.00 0.00 O ATOM 1182 CB VAL B 7 13.485 9.462 15.291 1.00 0.00 C ATOM 1183 CG1 VAL B 7 14.169 10.221 14.143 1.00 0.00 C ATOM 1184 CG2 VAL B 7 14.564 8.740 16.106 1.00 0.00 C ATOM 0 H VAL B 7 11.800 11.721 14.839 1.00 0.00 H new ATOM 0 HA VAL B 7 12.194 9.680 16.948 1.00 0.00 H new ATOM 0 HB VAL B 7 12.793 8.745 14.849 1.00 0.00 H new ATOM 0 HG11 VAL B 7 14.770 9.527 13.555 1.00 0.00 H new ATOM 0 HG12 VAL B 7 13.411 10.675 13.505 1.00 0.00 H new ATOM 0 HG13 VAL B 7 14.811 11.000 14.554 1.00 0.00 H new ATOM 0 HG21 VAL B 7 15.169 8.122 15.442 1.00 0.00 H new ATOM 0 HG22 VAL B 7 15.201 9.475 16.598 1.00 0.00 H new ATOM 0 HG23 VAL B 7 14.091 8.109 16.858 1.00 0.00 H new ATOM 1194 N LEU B 8 13.733 11.164 18.200 1.00 0.00 N ATOM 1195 CA LEU B 8 14.382 12.107 19.118 1.00 0.00 C ATOM 1196 C LEU B 8 15.286 11.387 20.128 1.00 0.00 C ATOM 1197 O LEU B 8 15.147 10.182 20.350 1.00 0.00 O ATOM 1198 CB LEU B 8 13.298 12.979 19.795 1.00 0.00 C ATOM 1199 CG LEU B 8 12.362 12.284 20.809 1.00 0.00 C ATOM 1200 CD1 LEU B 8 12.914 12.314 22.239 1.00 0.00 C ATOM 1201 CD2 LEU B 8 11.006 12.991 20.857 1.00 0.00 C ATOM 0 H LEU B 8 13.562 10.253 18.626 1.00 0.00 H new ATOM 0 HA LEU B 8 15.045 12.764 18.555 1.00 0.00 H new ATOM 0 HB2 LEU B 8 13.798 13.802 20.306 1.00 0.00 H new ATOM 0 HB3 LEU B 8 12.680 13.418 19.012 1.00 0.00 H new ATOM 0 HG LEU B 8 12.274 11.252 20.468 1.00 0.00 H new ATOM 0 HD11 LEU B 8 12.216 11.812 22.909 1.00 0.00 H new ATOM 0 HD12 LEU B 8 13.876 11.803 22.268 1.00 0.00 H new ATOM 0 HD13 LEU B 8 13.043 13.348 22.558 1.00 0.00 H new ATOM 0 HD21 LEU B 8 10.359 12.489 21.576 1.00 0.00 H new ATOM 0 HD22 LEU B 8 11.147 14.029 21.159 1.00 0.00 H new ATOM 0 HD23 LEU B 8 10.544 12.960 19.870 1.00 0.00 H new ATOM 1309 N VAL B 16 14.047 7.782 21.468 1.00 0.00 N ATOM 1310 CA VAL B 16 12.576 7.634 21.462 1.00 0.00 C ATOM 1311 C VAL B 16 12.016 7.838 20.047 1.00 0.00 C ATOM 1312 O VAL B 16 12.523 8.664 19.288 1.00 0.00 O ATOM 1313 CB VAL B 16 11.934 8.624 22.462 1.00 0.00 C ATOM 1314 CG1 VAL B 16 10.392 8.591 22.459 1.00 0.00 C ATOM 1315 CG2 VAL B 16 12.385 8.375 23.909 1.00 0.00 C ATOM 0 HA VAL B 16 12.326 6.621 21.777 1.00 0.00 H new ATOM 0 HB VAL B 16 12.278 9.598 22.115 1.00 0.00 H new ATOM 0 HG11 VAL B 16 10.011 9.310 23.184 1.00 0.00 H new ATOM 0 HG12 VAL B 16 10.025 8.848 21.466 1.00 0.00 H new ATOM 0 HG13 VAL B 16 10.049 7.591 22.725 1.00 0.00 H new ATOM 0 HG21 VAL B 16 11.905 9.097 24.569 1.00 0.00 H new ATOM 0 HG22 VAL B 16 12.103 7.366 24.209 1.00 0.00 H new ATOM 0 HG23 VAL B 16 13.467 8.485 23.977 1.00 0.00 H new ATOM 1325 N GLU B 17 10.947 7.115 19.704 1.00 0.00 N ATOM 1326 CA GLU B 17 10.174 7.285 18.459 1.00 0.00 C ATOM 1327 C GLU B 17 8.667 7.457 18.735 1.00 0.00 C ATOM 1328 O GLU B 17 8.137 6.889 19.695 1.00 0.00 O ATOM 1329 CB GLU B 17 10.410 6.096 17.510 1.00 0.00 C ATOM 1330 CG GLU B 17 11.853 6.028 16.982 1.00 0.00 C ATOM 1331 CD GLU B 17 12.060 4.888 15.962 1.00 0.00 C ATOM 1332 OE1 GLU B 17 11.460 3.790 16.107 1.00 0.00 O ATOM 1333 OE2 GLU B 17 12.863 5.066 15.009 1.00 0.00 O1- ATOM 0 H GLU B 17 10.580 6.372 20.299 1.00 0.00 H new ATOM 0 HA GLU B 17 10.527 8.198 17.981 1.00 0.00 H new ATOM 0 HB2 GLU B 17 10.176 5.169 18.033 1.00 0.00 H new ATOM 0 HB3 GLU B 17 9.723 6.169 16.667 1.00 0.00 H new ATOM 0 HG2 GLU B 17 12.110 6.979 16.515 1.00 0.00 H new ATOM 0 HG3 GLU B 17 12.536 5.889 17.820 1.00 0.00 H new ATOM 1340 N ILE B 18 7.969 8.226 17.892 1.00 0.00 N ATOM 1341 CA ILE B 18 6.535 8.533 18.014 1.00 0.00 C ATOM 1342 C ILE B 18 5.873 8.395 16.637 1.00 0.00 C ATOM 1343 O ILE B 18 6.261 9.089 15.692 1.00 0.00 O ATOM 1344 CB ILE B 18 6.296 9.950 18.603 1.00 0.00 C ATOM 1345 CG1 ILE B 18 7.045 10.173 19.939 1.00 0.00 C ATOM 1346 CG2 ILE B 18 4.795 10.225 18.779 1.00 0.00 C ATOM 1347 CD1 ILE B 18 7.056 11.634 20.386 1.00 0.00 C ATOM 0 H ILE B 18 8.398 8.667 17.079 1.00 0.00 H new ATOM 0 HA ILE B 18 6.085 7.824 18.709 1.00 0.00 H new ATOM 0 HB ILE B 18 6.704 10.659 17.883 1.00 0.00 H new ATOM 0 HG12 ILE B 18 6.579 9.566 20.715 1.00 0.00 H new ATOM 0 HG13 ILE B 18 8.072 9.824 19.835 1.00 0.00 H new ATOM 0 HG21 ILE B 18 4.654 11.223 19.193 1.00 0.00 H new ATOM 0 HG22 ILE B 18 4.297 10.160 17.811 1.00 0.00 H new ATOM 0 HG23 ILE B 18 4.367 9.487 19.458 1.00 0.00 H new ATOM 0 HD11 ILE B 18 7.596 11.722 21.329 1.00 0.00 H new ATOM 0 HD12 ILE B 18 7.548 12.243 19.627 1.00 0.00 H new ATOM 0 HD13 ILE B 18 6.032 11.981 20.521 1.00 0.00 H new ATOM 1359 N GLY B 19 4.877 7.510 16.508 1.00 0.00 N ATOM 1360 CA GLY B 19 4.124 7.280 15.270 1.00 0.00 C ATOM 1361 C GLY B 19 2.903 8.190 15.096 1.00 0.00 C ATOM 1362 O GLY B 19 2.462 8.849 16.039 1.00 0.00 O ATOM 0 H GLY B 19 4.565 6.920 17.280 1.00 0.00 H new ATOM 0 HA2 GLY B 19 4.792 7.422 14.421 1.00 0.00 H new ATOM 0 HA3 GLY B 19 3.795 6.241 15.247 1.00 0.00 H new ATOM 1366 N ASP B 20 2.324 8.180 13.889 1.00 0.00 N ATOM 1367 CA ASP B 20 1.063 8.862 13.539 1.00 0.00 C ATOM 1368 C ASP B 20 1.050 10.388 13.804 1.00 0.00 C ATOM 1369 O ASP B 20 0.007 10.982 14.101 1.00 0.00 O ATOM 1370 CB ASP B 20 -0.145 8.117 14.152 1.00 0.00 C ATOM 1371 CG ASP B 20 -0.140 6.597 13.891 1.00 0.00 C ATOM 1372 OD1 ASP B 20 0.239 6.148 12.779 1.00 0.00 O ATOM 1373 OD2 ASP B 20 -0.551 5.831 14.800 1.00 0.00 O1- ATOM 0 H ASP B 20 2.732 7.680 13.099 1.00 0.00 H new ATOM 0 HA ASP B 20 0.976 8.806 12.454 1.00 0.00 H new ATOM 0 HB2 ASP B 20 -0.159 8.291 15.228 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -1.064 8.542 13.749 1.00 0.00 H new ATOM 1378 N VAL B 21 2.217 11.034 13.721 1.00 0.00 N ATOM 1379 CA VAL B 21 2.399 12.470 13.955 1.00 0.00 C ATOM 1380 C VAL B 21 1.875 13.282 12.776 1.00 0.00 C ATOM 1381 O VAL B 21 2.293 13.092 11.631 1.00 0.00 O ATOM 1382 CB VAL B 21 3.873 12.801 14.248 1.00 0.00 C ATOM 1383 CG1 VAL B 21 4.081 14.302 14.457 1.00 0.00 C ATOM 1384 CG2 VAL B 21 4.346 12.070 15.513 1.00 0.00 C ATOM 0 H VAL B 21 3.087 10.558 13.482 1.00 0.00 H new ATOM 0 HA VAL B 21 1.818 12.745 14.835 1.00 0.00 H new ATOM 0 HB VAL B 21 4.450 12.475 13.383 1.00 0.00 H new ATOM 0 HG11 VAL B 21 5.133 14.498 14.662 1.00 0.00 H new ATOM 0 HG12 VAL B 21 3.780 14.840 13.558 1.00 0.00 H new ATOM 0 HG13 VAL B 21 3.478 14.639 15.300 1.00 0.00 H new ATOM 0 HG21 VAL B 21 5.390 12.315 15.706 1.00 0.00 H new ATOM 0 HG22 VAL B 21 3.738 12.381 16.362 1.00 0.00 H new ATOM 0 HG23 VAL B 21 4.246 10.994 15.370 1.00 0.00 H new ATOM 1394 N LEU B 22 0.966 14.215 13.058 1.00 0.00 N ATOM 1395 CA LEU B 22 0.320 15.099 12.081 1.00 0.00 C ATOM 1396 C LEU B 22 1.037 16.453 11.951 1.00 0.00 C ATOM 1397 O LEU B 22 1.112 17.011 10.857 1.00 0.00 O ATOM 1398 CB LEU B 22 -1.145 15.270 12.524 1.00 0.00 C ATOM 1399 CG LEU B 22 -2.035 16.008 11.513 1.00 0.00 C ATOM 1400 CD1 LEU B 22 -2.257 15.187 10.246 1.00 0.00 C ATOM 1401 CD2 LEU B 22 -3.390 16.348 12.142 1.00 0.00 C ATOM 0 H LEU B 22 0.645 14.385 14.011 1.00 0.00 H new ATOM 0 HA LEU B 22 0.371 14.654 11.087 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -1.571 14.285 12.713 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -1.164 15.812 13.469 1.00 0.00 H new ATOM 0 HG LEU B 22 -1.516 16.926 11.238 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -2.892 15.745 9.557 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -1.297 14.984 9.771 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -2.741 14.245 10.503 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -4.009 16.871 11.413 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -3.889 15.429 12.449 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -3.237 16.986 13.012 1.00 0.00 H new ATOM 1413 N GLU B 23 1.586 16.980 13.047 1.00 0.00 N ATOM 1414 CA GLU B 23 2.368 18.224 13.058 1.00 0.00 C ATOM 1415 C GLU B 23 3.340 18.312 14.252 1.00 0.00 C ATOM 1416 O GLU B 23 3.136 17.711 15.308 1.00 0.00 O ATOM 1417 CB GLU B 23 1.440 19.452 12.989 1.00 0.00 C ATOM 1418 CG GLU B 23 0.431 19.584 14.136 1.00 0.00 C ATOM 1419 CD GLU B 23 -0.467 20.812 13.920 1.00 0.00 C ATOM 1420 OE1 GLU B 23 0.005 21.949 14.176 1.00 0.00 O ATOM 1421 OE2 GLU B 23 -1.639 20.655 13.495 1.00 0.00 O1- ATOM 0 H GLU B 23 1.500 16.550 13.968 1.00 0.00 H new ATOM 0 HA GLU B 23 2.992 18.215 12.164 1.00 0.00 H new ATOM 0 HB2 GLU B 23 2.057 20.350 12.966 1.00 0.00 H new ATOM 0 HB3 GLU B 23 0.891 19.418 12.048 1.00 0.00 H new ATOM 0 HG2 GLU B 23 -0.181 18.684 14.196 1.00 0.00 H new ATOM 0 HG3 GLU B 23 0.959 19.674 15.085 1.00 0.00 H new ATOM 1428 N VAL B 24 4.417 19.083 14.062 1.00 0.00 N ATOM 1429 CA VAL B 24 5.535 19.278 15.002 1.00 0.00 C ATOM 1430 C VAL B 24 5.935 20.759 15.022 1.00 0.00 C ATOM 1431 O VAL B 24 6.000 21.392 13.968 1.00 0.00 O ATOM 1432 CB VAL B 24 6.749 18.402 14.628 1.00 0.00 C ATOM 1433 CG1 VAL B 24 7.899 18.524 15.633 1.00 0.00 C ATOM 1434 CG2 VAL B 24 6.395 16.914 14.543 1.00 0.00 C ATOM 0 H VAL B 24 4.542 19.618 13.203 1.00 0.00 H new ATOM 0 HA VAL B 24 5.204 18.974 15.995 1.00 0.00 H new ATOM 0 HB VAL B 24 7.058 18.777 13.652 1.00 0.00 H new ATOM 0 HG11 VAL B 24 8.725 17.886 15.319 1.00 0.00 H new ATOM 0 HG12 VAL B 24 8.236 19.560 15.676 1.00 0.00 H new ATOM 0 HG13 VAL B 24 7.555 18.213 16.619 1.00 0.00 H new ATOM 0 HG21 VAL B 24 7.285 16.343 14.277 1.00 0.00 H new ATOM 0 HG22 VAL B 24 6.021 16.573 15.508 1.00 0.00 H new ATOM 0 HG23 VAL B 24 5.628 16.765 13.783 1.00 0.00 H new ATOM 1444 N ARG B 25 6.218 21.318 16.205 1.00 0.00 N ATOM 1445 CA ARG B 25 6.514 22.751 16.392 1.00 0.00 C ATOM 1446 C ARG B 25 7.700 22.954 17.339 1.00 0.00 C ATOM 1447 O ARG B 25 7.639 22.549 18.500 1.00 0.00 O ATOM 1448 CB ARG B 25 5.252 23.480 16.904 1.00 0.00 C ATOM 1449 CG ARG B 25 4.005 23.298 16.016 1.00 0.00 C ATOM 1450 CD ARG B 25 2.900 24.273 16.424 1.00 0.00 C ATOM 1451 NE ARG B 25 1.695 24.097 15.590 1.00 0.00 N ATOM 1452 CZ ARG B 25 0.810 25.018 15.250 1.00 0.00 C ATOM 1453 NH1 ARG B 25 0.896 26.259 15.640 1.00 0.00 N1+ ATOM 1454 NH2 ARG B 25 -0.194 24.679 14.505 1.00 0.00 N ATOM 0 H ARG B 25 6.249 20.784 17.073 1.00 0.00 H new ATOM 0 HA ARG B 25 6.798 23.179 15.431 1.00 0.00 H new ATOM 0 HB2 ARG B 25 5.023 23.122 17.908 1.00 0.00 H new ATOM 0 HB3 ARG B 25 5.471 24.544 16.987 1.00 0.00 H new ATOM 0 HG2 ARG B 25 4.271 23.459 14.971 1.00 0.00 H new ATOM 0 HG3 ARG B 25 3.641 22.274 16.098 1.00 0.00 H new ATOM 0 HD2 ARG B 25 2.645 24.119 17.472 1.00 0.00 H new ATOM 0 HD3 ARG B 25 3.263 25.297 16.331 1.00 0.00 H new ATOM 0 HE ARG B 25 1.526 23.156 15.235 1.00 0.00 H new ATOM 0 HH11 ARG B 25 1.671 26.555 16.233 1.00 0.00 H new ATOM 0 HH12 ARG B 25 0.188 26.934 15.352 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -0.292 23.714 14.190 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -0.886 25.377 14.233 1.00 0.00 H new ATOM 1468 N ALA B 26 8.761 23.604 16.860 1.00 0.00 N ATOM 1469 CA ALA B 26 9.910 24.030 17.664 1.00 0.00 C ATOM 1470 C ALA B 26 9.670 25.436 18.244 1.00 0.00 C ATOM 1471 O ALA B 26 9.653 26.436 17.521 1.00 0.00 O ATOM 1472 CB ALA B 26 11.174 23.979 16.795 1.00 0.00 C ATOM 0 H ALA B 26 8.849 23.856 15.876 1.00 0.00 H new ATOM 0 HA ALA B 26 10.043 23.355 18.509 1.00 0.00 H new ATOM 0 HB1 ALA B 26 12.034 24.295 17.385 1.00 0.00 H new ATOM 0 HB2 ALA B 26 11.331 22.960 16.441 1.00 0.00 H new ATOM 0 HB3 ALA B 26 11.056 24.646 15.941 1.00 0.00 H new ATOM 1478 N GLU B 27 9.478 25.506 19.557 1.00 0.00 N ATOM 1479 CA GLU B 27 9.322 26.740 20.336 1.00 0.00 C ATOM 1480 C GLU B 27 10.698 27.284 20.790 1.00 0.00 C ATOM 1481 O GLU B 27 11.747 26.721 20.455 1.00 0.00 O ATOM 1482 CB GLU B 27 8.378 26.472 21.531 1.00 0.00 C ATOM 1483 CG GLU B 27 7.062 25.731 21.226 1.00 0.00 C ATOM 1484 CD GLU B 27 6.112 26.483 20.272 1.00 0.00 C ATOM 1485 OE1 GLU B 27 4.921 26.655 20.628 1.00 0.00 O ATOM 1486 OE2 GLU B 27 6.514 26.877 19.151 1.00 0.00 O1- ATOM 0 H GLU B 27 9.424 24.669 20.138 1.00 0.00 H new ATOM 0 HA GLU B 27 8.873 27.513 19.712 1.00 0.00 H new ATOM 0 HB2 GLU B 27 8.928 25.895 22.275 1.00 0.00 H new ATOM 0 HB3 GLU B 27 8.130 27.429 21.989 1.00 0.00 H new ATOM 0 HG2 GLU B 27 7.299 24.760 20.792 1.00 0.00 H new ATOM 0 HG3 GLU B 27 6.540 25.542 22.164 1.00 0.00 H new ATOM 1493 N GLY B 28 10.727 28.370 21.573 1.00 0.00 N ATOM 1494 CA GLY B 28 11.963 29.045 22.011 1.00 0.00 C ATOM 1495 C GLY B 28 12.896 28.229 22.929 1.00 0.00 C ATOM 1496 O GLY B 28 14.047 28.623 23.142 1.00 0.00 O ATOM 0 H GLY B 28 9.880 28.814 21.928 1.00 0.00 H new ATOM 0 HA2 GLY B 28 12.525 29.339 21.125 1.00 0.00 H new ATOM 0 HA3 GLY B 28 11.687 29.962 22.531 1.00 0.00 H new ATOM 1500 N GLY B 29 12.430 27.092 23.464 1.00 0.00 N ATOM 1501 CA GLY B 29 13.219 26.179 24.306 1.00 0.00 C ATOM 1502 C GLY B 29 12.662 24.749 24.421 1.00 0.00 C ATOM 1503 O GLY B 29 13.026 24.041 25.361 1.00 0.00 O ATOM 0 H GLY B 29 11.472 26.773 23.321 1.00 0.00 H new ATOM 0 HA2 GLY B 29 14.232 26.126 23.907 1.00 0.00 H new ATOM 0 HA3 GLY B 29 13.292 26.605 25.307 1.00 0.00 H new ATOM 1507 N ALA B 30 11.774 24.324 23.515 1.00 0.00 N ATOM 1508 CA ALA B 30 11.114 23.011 23.536 1.00 0.00 C ATOM 1509 C ALA B 30 10.575 22.615 22.145 1.00 0.00 C ATOM 1510 O ALA B 30 10.282 23.490 21.333 1.00 0.00 O ATOM 1511 CB ALA B 30 9.951 23.066 24.540 1.00 0.00 C ATOM 0 H ALA B 30 11.486 24.900 22.724 1.00 0.00 H new ATOM 0 HA ALA B 30 11.847 22.260 23.829 1.00 0.00 H new ATOM 0 HB1 ALA B 30 9.449 22.099 24.569 1.00 0.00 H new ATOM 0 HB2 ALA B 30 10.337 23.304 25.531 1.00 0.00 H new ATOM 0 HB3 ALA B 30 9.241 23.834 24.233 1.00 0.00 H new ATOM 1517 N VAL B 31 10.354 21.318 21.900 1.00 0.00 N ATOM 1518 CA VAL B 31 9.530 20.827 20.772 1.00 0.00 C ATOM 1519 C VAL B 31 8.192 20.268 21.261 1.00 0.00 C ATOM 1520 O VAL B 31 8.144 19.546 22.255 1.00 0.00 O ATOM 1521 CB VAL B 31 10.270 19.800 19.890 1.00 0.00 C ATOM 1522 CG1 VAL B 31 9.370 19.202 18.799 1.00 0.00 C ATOM 1523 CG2 VAL B 31 11.447 20.460 19.170 1.00 0.00 C ATOM 0 H VAL B 31 10.740 20.571 22.477 1.00 0.00 H new ATOM 0 HA VAL B 31 9.330 21.693 20.141 1.00 0.00 H new ATOM 0 HB VAL B 31 10.599 19.013 20.568 1.00 0.00 H new ATOM 0 HG11 VAL B 31 9.941 18.486 18.208 1.00 0.00 H new ATOM 0 HG12 VAL B 31 8.523 18.696 19.263 1.00 0.00 H new ATOM 0 HG13 VAL B 31 9.006 19.999 18.151 1.00 0.00 H new ATOM 0 HG21 VAL B 31 11.957 19.720 18.553 1.00 0.00 H new ATOM 0 HG22 VAL B 31 11.080 21.269 18.538 1.00 0.00 H new ATOM 0 HG23 VAL B 31 12.144 20.862 19.905 1.00 0.00 H new ATOM 1533 N ARG B 32 7.115 20.573 20.533 1.00 0.00 N ATOM 1534 CA ARG B 32 5.772 19.984 20.658 1.00 0.00 C ATOM 1535 C ARG B 32 5.497 19.047 19.485 1.00 0.00 C ATOM 1536 O ARG B 32 5.846 19.371 18.347 1.00 0.00 O ATOM 1537 CB ARG B 32 4.715 21.101 20.721 1.00 0.00 C ATOM 1538 CG ARG B 32 4.886 21.997 21.958 1.00 0.00 C ATOM 1539 CD ARG B 32 3.976 23.231 21.904 1.00 0.00 C ATOM 1540 NE ARG B 32 2.552 22.861 21.933 1.00 0.00 N ATOM 1541 CZ ARG B 32 1.517 23.669 21.848 1.00 0.00 C ATOM 1542 NH1 ARG B 32 1.643 24.959 21.684 1.00 0.00 N1+ ATOM 1543 NH2 ARG B 32 0.325 23.162 21.932 1.00 0.00 N ATOM 0 H ARG B 32 7.155 21.278 19.797 1.00 0.00 H new ATOM 0 HA ARG B 32 5.720 19.404 21.579 1.00 0.00 H new ATOM 0 HB2 ARG B 32 4.781 21.712 19.821 1.00 0.00 H new ATOM 0 HB3 ARG B 32 3.720 20.656 20.732 1.00 0.00 H new ATOM 0 HG2 ARG B 32 4.663 21.421 22.856 1.00 0.00 H new ATOM 0 HG3 ARG B 32 5.925 22.316 22.034 1.00 0.00 H new ATOM 0 HD2 ARG B 32 4.199 23.884 22.747 1.00 0.00 H new ATOM 0 HD3 ARG B 32 4.186 23.798 20.997 1.00 0.00 H new ATOM 0 HE ARG B 32 2.344 21.867 22.030 1.00 0.00 H new ATOM 0 HH11 ARG B 32 2.571 25.376 21.617 1.00 0.00 H new ATOM 0 HH12 ARG B 32 0.813 25.549 21.623 1.00 0.00 H new ATOM 0 HH21 ARG B 32 0.206 22.157 22.061 1.00 0.00 H new ATOM 0 HH22 ARG B 32 -0.493 23.768 21.869 1.00 0.00 H new ATOM 1557 N VAL B 33 4.858 17.909 19.744 1.00 0.00 N ATOM 1558 CA VAL B 33 4.541 16.841 18.777 1.00 0.00 C ATOM 1559 C VAL B 33 3.065 16.446 18.916 1.00 0.00 C ATOM 1560 O VAL B 33 2.655 16.034 20.002 1.00 0.00 O ATOM 1561 CB VAL B 33 5.452 15.613 19.015 1.00 0.00 C ATOM 1562 CG1 VAL B 33 5.127 14.470 18.048 1.00 0.00 C ATOM 1563 CG2 VAL B 33 6.941 15.936 18.856 1.00 0.00 C ATOM 0 H VAL B 33 4.526 17.687 20.683 1.00 0.00 H new ATOM 0 HA VAL B 33 4.719 17.208 17.766 1.00 0.00 H new ATOM 0 HB VAL B 33 5.254 15.314 20.044 1.00 0.00 H new ATOM 0 HG11 VAL B 33 5.788 13.626 18.247 1.00 0.00 H new ATOM 0 HG12 VAL B 33 4.091 14.160 18.186 1.00 0.00 H new ATOM 0 HG13 VAL B 33 5.271 14.809 17.022 1.00 0.00 H new ATOM 0 HG21 VAL B 33 7.530 15.036 19.035 1.00 0.00 H new ATOM 0 HG22 VAL B 33 7.129 16.298 17.845 1.00 0.00 H new ATOM 0 HG23 VAL B 33 7.225 16.704 19.575 1.00 0.00 H new ATOM 1573 N THR B 34 2.271 16.543 17.845 1.00 0.00 N ATOM 1574 CA THR B 34 0.811 16.301 17.873 1.00 0.00 C ATOM 1575 C THR B 34 0.375 15.272 16.824 1.00 0.00 C ATOM 1576 O THR B 34 0.742 15.363 15.650 1.00 0.00 O ATOM 1577 CB THR B 34 0.040 17.621 17.688 1.00 0.00 C ATOM 1578 OG1 THR B 34 0.349 18.529 18.722 1.00 0.00 O ATOM 1579 CG2 THR B 34 -1.475 17.447 17.724 1.00 0.00 C ATOM 0 H THR B 34 2.620 16.794 16.920 1.00 0.00 H new ATOM 0 HA THR B 34 0.572 15.886 18.852 1.00 0.00 H new ATOM 0 HB THR B 34 0.346 17.987 16.708 1.00 0.00 H new ATOM 0 HG1 THR B 34 -0.149 19.362 18.586 1.00 0.00 H new ATOM 0 HG21 THR B 34 -1.956 18.416 17.588 1.00 0.00 H new ATOM 0 HG22 THR B 34 -1.783 16.773 16.924 1.00 0.00 H new ATOM 0 HG23 THR B 34 -1.770 17.028 18.686 1.00 0.00 H new ATOM 1587 N THR B 35 -0.430 14.291 17.242 1.00 0.00 N ATOM 1588 CA THR B 35 -1.040 13.261 16.377 1.00 0.00 C ATOM 1589 C THR B 35 -2.427 13.673 15.869 1.00 0.00 C ATOM 1590 O THR B 35 -3.106 14.518 16.463 1.00 0.00 O ATOM 1591 CB THR B 35 -1.155 11.909 17.099 1.00 0.00 C ATOM 1592 OG1 THR B 35 -2.115 11.979 18.130 1.00 0.00 O ATOM 1593 CG2 THR B 35 0.158 11.408 17.703 1.00 0.00 C ATOM 0 H THR B 35 -0.687 14.183 18.223 1.00 0.00 H new ATOM 0 HA THR B 35 -0.372 13.159 15.522 1.00 0.00 H new ATOM 0 HB THR B 35 -1.453 11.200 16.326 1.00 0.00 H new ATOM 0 HG1 THR B 35 -1.834 12.643 18.794 1.00 0.00 H new ATOM 0 HG21 THR B 35 -0.010 10.449 18.194 1.00 0.00 H new ATOM 0 HG22 THR B 35 0.899 11.287 16.913 1.00 0.00 H new ATOM 0 HG23 THR B 35 0.522 12.131 18.433 1.00 0.00 H new ATOM 1601 N LEU B 36 -2.901 13.025 14.802 1.00 0.00 N ATOM 1602 CA LEU B 36 -4.280 13.170 14.302 1.00 0.00 C ATOM 1603 C LEU B 36 -5.357 12.501 15.185 1.00 0.00 C ATOM 1604 O LEU B 36 -6.552 12.663 14.927 1.00 0.00 O ATOM 1605 CB LEU B 36 -4.363 12.738 12.825 1.00 0.00 C ATOM 1606 CG LEU B 36 -4.369 11.234 12.491 1.00 0.00 C ATOM 1607 CD1 LEU B 36 -4.482 11.102 10.970 1.00 0.00 C ATOM 1608 CD2 LEU B 36 -3.091 10.521 12.917 1.00 0.00 C ATOM 0 H LEU B 36 -2.337 12.377 14.252 1.00 0.00 H new ATOM 0 HA LEU B 36 -4.521 14.231 14.364 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -5.270 13.173 12.404 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -3.520 13.189 12.301 1.00 0.00 H new ATOM 0 HG LEU B 36 -5.200 10.777 13.029 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -4.489 10.047 10.696 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -5.406 11.571 10.632 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -3.631 11.594 10.498 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -3.158 9.465 12.654 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -2.238 10.968 12.407 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -2.962 10.619 13.995 1.00 0.00 H new ATOM 1620 N PHE B 37 -4.953 11.797 16.247 1.00 0.00 N ATOM 1621 CA PHE B 37 -5.830 11.302 17.322 1.00 0.00 C ATOM 1622 C PHE B 37 -5.979 12.306 18.493 1.00 0.00 C ATOM 1623 O PHE B 37 -6.567 11.978 19.526 1.00 0.00 O ATOM 1624 CB PHE B 37 -5.312 9.936 17.791 1.00 0.00 C ATOM 1625 CG PHE B 37 -5.228 8.904 16.682 1.00 0.00 C ATOM 1626 CD1 PHE B 37 -6.408 8.372 16.125 1.00 0.00 C ATOM 1627 CD2 PHE B 37 -3.977 8.503 16.178 1.00 0.00 C ATOM 1628 CE1 PHE B 37 -6.336 7.444 15.071 1.00 0.00 C ATOM 1629 CE2 PHE B 37 -3.909 7.568 15.125 1.00 0.00 C ATOM 1630 CZ PHE B 37 -5.088 7.044 14.567 1.00 0.00 C ATOM 0 H PHE B 37 -3.975 11.546 16.390 1.00 0.00 H new ATOM 0 HA PHE B 37 -6.838 11.189 16.923 1.00 0.00 H new ATOM 0 HB2 PHE B 37 -4.324 10.064 18.232 1.00 0.00 H new ATOM 0 HB3 PHE B 37 -5.966 9.559 18.577 1.00 0.00 H new ATOM 0 HD1 PHE B 37 -7.370 8.678 16.509 1.00 0.00 H new ATOM 0 HD2 PHE B 37 -3.069 8.911 16.598 1.00 0.00 H new ATOM 0 HE1 PHE B 37 -7.243 7.038 14.648 1.00 0.00 H new ATOM 0 HE2 PHE B 37 -2.948 7.253 14.746 1.00 0.00 H new ATOM 0 HZ PHE B 37 -5.034 6.336 13.753 1.00 0.00 H new ATOM 1640 N ASP B 38 -5.448 13.527 18.339 1.00 0.00 N ATOM 1641 CA ASP B 38 -5.425 14.618 19.328 1.00 0.00 C ATOM 1642 C ASP B 38 -4.637 14.294 20.623 1.00 0.00 C ATOM 1643 O ASP B 38 -4.778 14.966 21.651 1.00 0.00 O ATOM 1644 CB ASP B 38 -6.851 15.149 19.579 1.00 0.00 C ATOM 1645 CG ASP B 38 -6.904 16.565 20.187 1.00 0.00 C ATOM 1646 OD1 ASP B 38 -5.984 17.389 19.944 1.00 0.00 O ATOM 1647 OD2 ASP B 38 -7.908 16.890 20.866 1.00 0.00 O1- ATOM 0 H ASP B 38 -4.994 13.798 17.467 1.00 0.00 H new ATOM 0 HA ASP B 38 -4.845 15.430 18.890 1.00 0.00 H new ATOM 0 HB2 ASP B 38 -7.396 15.151 18.635 1.00 0.00 H new ATOM 0 HB3 ASP B 38 -7.370 14.461 20.246 1.00 0.00 H new ATOM 1652 N GLU B 39 -3.772 13.278 20.582 1.00 0.00 N ATOM 1653 CA GLU B 39 -2.716 13.074 21.579 1.00 0.00 C ATOM 1654 C GLU B 39 -1.523 14.003 21.286 1.00 0.00 C ATOM 1655 O GLU B 39 -1.116 14.163 20.126 1.00 0.00 O ATOM 1656 CB GLU B 39 -2.255 11.609 21.616 1.00 0.00 C ATOM 1657 CG GLU B 39 -3.368 10.595 21.926 1.00 0.00 C ATOM 1658 CD GLU B 39 -4.061 10.812 23.290 1.00 0.00 C ATOM 1659 OE1 GLU B 39 -3.412 11.286 24.257 1.00 0.00 O ATOM 1660 OE2 GLU B 39 -5.262 10.474 23.420 1.00 0.00 O1- ATOM 0 H GLU B 39 -3.784 12.567 19.850 1.00 0.00 H new ATOM 0 HA GLU B 39 -3.127 13.319 22.559 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -1.810 11.357 20.653 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -1.470 11.508 22.366 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -4.119 10.645 21.138 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -2.946 9.590 21.901 1.00 0.00 H new ATOM 1667 N GLU B 40 -0.947 14.605 22.331 1.00 0.00 N ATOM 1668 CA GLU B 40 0.166 15.560 22.238 1.00 0.00 C ATOM 1669 C GLU B 40 1.287 15.229 23.239 1.00 0.00 C ATOM 1670 O GLU B 40 1.028 14.835 24.382 1.00 0.00 O ATOM 1671 CB GLU B 40 -0.357 16.994 22.421 1.00 0.00 C ATOM 1672 CG GLU B 40 0.734 18.081 22.344 1.00 0.00 C ATOM 1673 CD GLU B 40 0.190 19.527 22.370 1.00 0.00 C ATOM 1674 OE1 GLU B 40 -1.026 19.757 22.593 1.00 0.00 O ATOM 1675 OE2 GLU B 40 0.996 20.472 22.203 1.00 0.00 O1- ATOM 0 H GLU B 40 -1.249 14.438 23.291 1.00 0.00 H new ATOM 0 HA GLU B 40 0.606 15.479 21.244 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -1.108 17.195 21.657 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -0.857 17.065 23.387 1.00 0.00 H new ATOM 0 HG2 GLU B 40 1.423 17.949 23.179 1.00 0.00 H new ATOM 0 HG3 GLU B 40 1.310 17.938 21.430 1.00 0.00 H new ATOM 1682 N HIS B 41 2.534 15.446 22.812 1.00 0.00 N ATOM 1683 CA HIS B 41 3.761 15.272 23.590 1.00 0.00 C ATOM 1684 C HIS B 41 4.600 16.551 23.536 1.00 0.00 C ATOM 1685 O HIS B 41 4.573 17.269 22.534 1.00 0.00 O ATOM 1686 CB HIS B 41 4.554 14.072 23.047 1.00 0.00 C ATOM 1687 CG HIS B 41 3.736 12.830 22.780 1.00 0.00 C ATOM 1688 ND1 HIS B 41 3.346 11.878 23.729 1.00 0.00 N ATOM 1689 CD2 HIS B 41 3.218 12.477 21.562 1.00 0.00 C ATOM 1690 CE1 HIS B 41 2.612 10.976 23.055 1.00 0.00 C ATOM 1691 NE2 HIS B 41 2.514 11.310 21.759 1.00 0.00 N ATOM 0 H HIS B 41 2.724 15.765 21.862 1.00 0.00 H new ATOM 0 HA HIS B 41 3.506 15.075 24.631 1.00 0.00 H new ATOM 0 HB2 HIS B 41 5.045 14.370 22.121 1.00 0.00 H new ATOM 0 HB3 HIS B 41 5.341 13.824 23.760 1.00 0.00 H new ATOM 0 HD2 HIS B 41 3.338 13.009 20.630 1.00 0.00 H new ATOM 0 HE1 HIS B 41 2.161 10.100 23.497 1.00 0.00 H new ATOM 0 HE2 HIS B 41 2.006 10.790 21.044 1.00 0.00 H new ATOM 1699 N ALA B 42 5.364 16.838 24.594 1.00 0.00 N ATOM 1700 CA ALA B 42 6.268 17.991 24.664 1.00 0.00 C ATOM 1701 C ALA B 42 7.632 17.633 25.277 1.00 0.00 C ATOM 1702 O ALA B 42 7.718 16.849 26.227 1.00 0.00 O ATOM 1703 CB ALA B 42 5.578 19.124 25.434 1.00 0.00 C ATOM 0 H ALA B 42 5.372 16.267 25.439 1.00 0.00 H new ATOM 0 HA ALA B 42 6.481 18.325 23.648 1.00 0.00 H new ATOM 0 HB1 ALA B 42 6.245 19.985 25.490 1.00 0.00 H new ATOM 0 HB2 ALA B 42 4.661 19.408 24.918 1.00 0.00 H new ATOM 0 HB3 ALA B 42 5.338 18.785 26.442 1.00 0.00 H new ATOM 1709 N PHE B 43 8.693 18.232 24.729 1.00 0.00 N ATOM 1710 CA PHE B 43 10.094 17.888 25.004 1.00 0.00 C ATOM 1711 C PHE B 43 10.964 19.155 25.130 1.00 0.00 C ATOM 1712 O PHE B 43 11.434 19.676 24.111 1.00 0.00 O ATOM 1713 CB PHE B 43 10.604 16.946 23.901 1.00 0.00 C ATOM 1714 CG PHE B 43 9.808 15.665 23.743 1.00 0.00 C ATOM 1715 CD1 PHE B 43 9.979 14.607 24.659 1.00 0.00 C ATOM 1716 CD2 PHE B 43 8.870 15.541 22.702 1.00 0.00 C ATOM 1717 CE1 PHE B 43 9.194 13.444 24.546 1.00 0.00 C ATOM 1718 CE2 PHE B 43 8.097 14.373 22.581 1.00 0.00 C ATOM 1719 CZ PHE B 43 8.247 13.331 23.515 1.00 0.00 C ATOM 0 H PHE B 43 8.599 18.995 24.059 1.00 0.00 H new ATOM 0 HA PHE B 43 10.162 17.372 25.962 1.00 0.00 H new ATOM 0 HB2 PHE B 43 10.596 17.482 22.952 1.00 0.00 H new ATOM 0 HB3 PHE B 43 11.642 16.689 24.113 1.00 0.00 H new ATOM 0 HD1 PHE B 43 10.712 14.689 25.448 1.00 0.00 H new ATOM 0 HD2 PHE B 43 8.743 16.346 21.993 1.00 0.00 H new ATOM 0 HE1 PHE B 43 9.320 12.637 25.253 1.00 0.00 H new ATOM 0 HE2 PHE B 43 7.388 14.275 21.772 1.00 0.00 H new ATOM 0 HZ PHE B 43 7.634 12.445 23.439 1.00 0.00 H new ATOM 1729 N PRO B 44 11.188 19.666 26.355 1.00 0.00 N ATOM 1730 CA PRO B 44 12.113 20.770 26.606 1.00 0.00 C ATOM 1731 C PRO B 44 13.552 20.459 26.168 1.00 0.00 C ATOM 1732 O PRO B 44 14.034 19.330 26.290 1.00 0.00 O ATOM 1733 CB PRO B 44 12.031 21.057 28.107 1.00 0.00 C ATOM 1734 CG PRO B 44 10.646 20.535 28.485 1.00 0.00 C ATOM 1735 CD PRO B 44 10.482 19.314 27.582 1.00 0.00 C ATOM 0 HA PRO B 44 11.830 21.640 26.014 1.00 0.00 H new ATOM 0 HB2 PRO B 44 12.819 20.545 28.659 1.00 0.00 H new ATOM 0 HB3 PRO B 44 12.133 22.121 28.320 1.00 0.00 H new ATOM 0 HG2 PRO B 44 10.589 20.267 29.540 1.00 0.00 H new ATOM 0 HG3 PRO B 44 9.871 21.279 28.303 1.00 0.00 H new ATOM 0 HD2 PRO B 44 10.907 18.421 28.041 1.00 0.00 H new ATOM 0 HD3 PRO B 44 9.430 19.103 27.388 1.00 0.00 H new ATOM 1743 N GLY B 45 14.252 21.477 25.670 1.00 0.00 N ATOM 1744 CA GLY B 45 15.657 21.399 25.257 1.00 0.00 C ATOM 1745 C GLY B 45 15.899 20.780 23.877 1.00 0.00 C ATOM 1746 O GLY B 45 17.042 20.465 23.556 1.00 0.00 O ATOM 0 H GLY B 45 13.849 22.405 25.538 1.00 0.00 H new ATOM 0 HA2 GLY B 45 16.078 22.405 25.265 1.00 0.00 H new ATOM 0 HA3 GLY B 45 16.205 20.818 25.999 1.00 0.00 H new ATOM 1750 N LEU B 46 14.852 20.609 23.058 1.00 0.00 N ATOM 1751 CA LEU B 46 14.944 20.139 21.669 1.00 0.00 C ATOM 1752 C LEU B 46 14.620 21.240 20.643 1.00 0.00 C ATOM 1753 O LEU B 46 13.999 22.259 20.961 1.00 0.00 O ATOM 1754 CB LEU B 46 14.032 18.912 21.443 1.00 0.00 C ATOM 1755 CG LEU B 46 14.321 17.680 22.316 1.00 0.00 C ATOM 1756 CD1 LEU B 46 13.488 16.503 21.804 1.00 0.00 C ATOM 1757 CD2 LEU B 46 15.785 17.239 22.284 1.00 0.00 C ATOM 0 H LEU B 46 13.893 20.799 23.351 1.00 0.00 H new ATOM 0 HA LEU B 46 15.982 19.849 21.509 1.00 0.00 H new ATOM 0 HB2 LEU B 46 12.999 19.217 21.613 1.00 0.00 H new ATOM 0 HB3 LEU B 46 14.109 18.616 20.397 1.00 0.00 H new ATOM 0 HG LEU B 46 14.072 17.964 23.339 1.00 0.00 H new ATOM 0 HD11 LEU B 46 13.686 15.623 22.417 1.00 0.00 H new ATOM 0 HD12 LEU B 46 12.429 16.755 21.861 1.00 0.00 H new ATOM 0 HD13 LEU B 46 13.755 16.291 20.769 1.00 0.00 H new ATOM 0 HD21 LEU B 46 15.916 16.365 22.922 1.00 0.00 H new ATOM 0 HD22 LEU B 46 16.067 16.987 21.262 1.00 0.00 H new ATOM 0 HD23 LEU B 46 16.417 18.050 22.645 1.00 0.00 H new ATOM 1769 N ALA B 47 14.994 20.982 19.387 1.00 0.00 N ATOM 1770 CA ALA B 47 14.560 21.681 18.176 1.00 0.00 C ATOM 1771 C ALA B 47 14.385 20.684 17.011 1.00 0.00 C ATOM 1772 O ALA B 47 14.904 19.565 17.062 1.00 0.00 O ATOM 1773 CB ALA B 47 15.569 22.786 17.838 1.00 0.00 C ATOM 0 H ALA B 47 15.651 20.230 19.176 1.00 0.00 H new ATOM 0 HA ALA B 47 13.589 22.146 18.347 1.00 0.00 H new ATOM 0 HB1 ALA B 47 15.248 23.308 16.937 1.00 0.00 H new ATOM 0 HB2 ALA B 47 15.626 23.493 18.666 1.00 0.00 H new ATOM 0 HB3 ALA B 47 16.551 22.343 17.671 1.00 0.00 H new ATOM 1779 N ILE B 48 13.668 21.061 15.944 1.00 0.00 N ATOM 1780 CA ILE B 48 13.537 20.230 14.729 1.00 0.00 C ATOM 1781 C ILE B 48 14.828 20.345 13.899 1.00 0.00 C ATOM 1782 O ILE B 48 15.228 21.448 13.517 1.00 0.00 O ATOM 1783 CB ILE B 48 12.297 20.621 13.891 1.00 0.00 C ATOM 1784 CG1 ILE B 48 10.971 20.543 14.684 1.00 0.00 C ATOM 1785 CG2 ILE B 48 12.195 19.716 12.650 1.00 0.00 C ATOM 1786 CD1 ILE B 48 9.892 21.469 14.102 1.00 0.00 C ATOM 0 H ILE B 48 13.163 21.946 15.894 1.00 0.00 H new ATOM 0 HA ILE B 48 13.390 19.193 15.031 1.00 0.00 H new ATOM 0 HB ILE B 48 12.439 21.662 13.601 1.00 0.00 H new ATOM 0 HG12 ILE B 48 10.607 19.516 14.680 1.00 0.00 H new ATOM 0 HG13 ILE B 48 11.155 20.811 15.724 1.00 0.00 H new ATOM 0 HG21 ILE B 48 11.319 19.998 12.065 1.00 0.00 H new ATOM 0 HG22 ILE B 48 13.091 19.832 12.040 1.00 0.00 H new ATOM 0 HG23 ILE B 48 12.102 18.676 12.964 1.00 0.00 H new ATOM 0 HD11 ILE B 48 8.980 21.380 14.692 1.00 0.00 H new ATOM 0 HD12 ILE B 48 10.243 22.500 14.131 1.00 0.00 H new ATOM 0 HD13 ILE B 48 9.686 21.185 13.070 1.00 0.00 H new ATOM 1798 N GLY B 49 15.468 19.209 13.609 1.00 0.00 N ATOM 1799 CA GLY B 49 16.726 19.134 12.857 1.00 0.00 C ATOM 1800 C GLY B 49 16.563 18.717 11.388 1.00 0.00 C ATOM 1801 O GLY B 49 17.290 19.222 10.528 1.00 0.00 O ATOM 0 H GLY B 49 15.119 18.295 13.896 1.00 0.00 H new ATOM 0 HA2 GLY B 49 17.216 20.107 12.894 1.00 0.00 H new ATOM 0 HA3 GLY B 49 17.389 18.425 13.352 1.00 0.00 H new ATOM 1805 N ARG B 50 15.612 17.822 11.078 1.00 0.00 N ATOM 1806 CA ARG B 50 15.324 17.344 9.705 1.00 0.00 C ATOM 1807 C ARG B 50 13.846 16.992 9.514 1.00 0.00 C ATOM 1808 O ARG B 50 13.166 16.608 10.468 1.00 0.00 O ATOM 1809 CB ARG B 50 16.160 16.101 9.337 1.00 0.00 C ATOM 1810 CG ARG B 50 17.672 16.179 9.611 1.00 0.00 C ATOM 1811 CD ARG B 50 18.407 14.893 9.194 1.00 0.00 C ATOM 1812 NE ARG B 50 17.968 13.721 9.984 1.00 0.00 N ATOM 1813 CZ ARG B 50 18.637 12.615 10.256 1.00 0.00 C ATOM 1814 NH1 ARG B 50 19.851 12.390 9.827 1.00 0.00 N1+ ATOM 1815 NH2 ARG B 50 18.073 11.696 10.981 1.00 0.00 N ATOM 0 H ARG B 50 15.008 17.399 11.783 1.00 0.00 H new ATOM 0 HA ARG B 50 15.590 18.174 9.050 1.00 0.00 H new ATOM 0 HB2 ARG B 50 15.759 15.247 9.883 1.00 0.00 H new ATOM 0 HB3 ARG B 50 16.017 15.896 8.276 1.00 0.00 H new ATOM 0 HG2 ARG B 50 18.094 17.027 9.072 1.00 0.00 H new ATOM 0 HG3 ARG B 50 17.838 16.362 10.673 1.00 0.00 H new ATOM 0 HD2 ARG B 50 18.232 14.703 8.135 1.00 0.00 H new ATOM 0 HD3 ARG B 50 19.481 15.033 9.319 1.00 0.00 H new ATOM 0 HE ARG B 50 17.025 13.774 10.369 1.00 0.00 H new ATOM 0 HH11 ARG B 50 20.326 13.086 9.253 1.00 0.00 H new ATOM 0 HH12 ARG B 50 20.323 11.518 10.066 1.00 0.00 H new ATOM 0 HH21 ARG B 50 17.125 11.834 11.332 1.00 0.00 H new ATOM 0 HH22 ARG B 50 18.578 10.837 11.199 1.00 0.00 H new ATOM 1829 N VAL B 51 13.392 17.019 8.263 1.00 0.00 N ATOM 1830 CA VAL B 51 12.129 16.417 7.811 1.00 0.00 C ATOM 1831 C VAL B 51 12.298 15.825 6.409 1.00 0.00 C ATOM 1832 O VAL B 51 12.690 16.515 5.473 1.00 0.00 O ATOM 1833 CB VAL B 51 10.953 17.416 7.912 1.00 0.00 C ATOM 1834 CG1 VAL B 51 11.215 18.776 7.252 1.00 0.00 C ATOM 1835 CG2 VAL B 51 9.673 16.833 7.302 1.00 0.00 C ATOM 0 H VAL B 51 13.906 17.474 7.508 1.00 0.00 H new ATOM 0 HA VAL B 51 11.872 15.595 8.479 1.00 0.00 H new ATOM 0 HB VAL B 51 10.837 17.584 8.983 1.00 0.00 H new ATOM 0 HG11 VAL B 51 10.338 19.413 7.371 1.00 0.00 H new ATOM 0 HG12 VAL B 51 12.075 19.250 7.725 1.00 0.00 H new ATOM 0 HG13 VAL B 51 11.418 18.632 6.191 1.00 0.00 H new ATOM 0 HG21 VAL B 51 8.865 17.559 7.389 1.00 0.00 H new ATOM 0 HG22 VAL B 51 9.843 16.603 6.250 1.00 0.00 H new ATOM 0 HG23 VAL B 51 9.400 15.921 7.833 1.00 0.00 H new ATOM 1845 N ASP B 52 11.991 14.538 6.267 1.00 0.00 N ATOM 1846 CA ASP B 52 12.121 13.747 5.043 1.00 0.00 C ATOM 1847 C ASP B 52 10.742 13.192 4.642 1.00 0.00 C ATOM 1848 O ASP B 52 10.372 12.074 5.006 1.00 0.00 O ATOM 1849 CB ASP B 52 13.133 12.599 5.243 1.00 0.00 C ATOM 1850 CG ASP B 52 14.551 13.020 5.664 1.00 0.00 C ATOM 1851 OD1 ASP B 52 15.257 12.176 6.270 1.00 0.00 O ATOM 1852 OD2 ASP B 52 15.011 14.140 5.343 1.00 0.00 O1- ATOM 0 H ASP B 52 11.625 13.988 7.044 1.00 0.00 H new ATOM 0 HA ASP B 52 12.494 14.386 4.243 1.00 0.00 H new ATOM 0 HB2 ASP B 52 12.738 11.919 5.998 1.00 0.00 H new ATOM 0 HB3 ASP B 52 13.203 12.036 4.312 1.00 0.00 H new ATOM 1857 N LEU B 53 9.964 13.970 3.883 1.00 0.00 N ATOM 1858 CA LEU B 53 8.624 13.580 3.417 1.00 0.00 C ATOM 1859 C LEU B 53 8.677 12.449 2.375 1.00 0.00 C ATOM 1860 O LEU B 53 7.736 11.661 2.254 1.00 0.00 O ATOM 1861 CB LEU B 53 7.885 14.810 2.858 1.00 0.00 C ATOM 1862 CG LEU B 53 7.809 16.029 3.794 1.00 0.00 C ATOM 1863 CD1 LEU B 53 6.940 17.101 3.152 1.00 0.00 C ATOM 1864 CD2 LEU B 53 7.186 15.680 5.149 1.00 0.00 C ATOM 0 H LEU B 53 10.247 14.899 3.570 1.00 0.00 H new ATOM 0 HA LEU B 53 8.073 13.191 4.273 1.00 0.00 H new ATOM 0 HB2 LEU B 53 8.375 15.116 1.934 1.00 0.00 H new ATOM 0 HB3 LEU B 53 6.869 14.512 2.597 1.00 0.00 H new ATOM 0 HG LEU B 53 8.830 16.376 3.954 1.00 0.00 H new ATOM 0 HD11 LEU B 53 6.883 17.967 3.812 1.00 0.00 H new ATOM 0 HD12 LEU B 53 7.375 17.399 2.198 1.00 0.00 H new ATOM 0 HD13 LEU B 53 5.938 16.706 2.985 1.00 0.00 H new ATOM 0 HD21 LEU B 53 7.154 16.572 5.775 1.00 0.00 H new ATOM 0 HD22 LEU B 53 6.173 15.306 4.998 1.00 0.00 H new ATOM 0 HD23 LEU B 53 7.787 14.914 5.639 1.00 0.00 H new ATOM 1876 N ARG B 54 9.818 12.305 1.692 1.00 0.00 N ATOM 1877 CA ARG B 54 10.187 11.148 0.849 1.00 0.00 C ATOM 1878 C ARG B 54 10.204 9.815 1.627 1.00 0.00 C ATOM 1879 O ARG B 54 9.947 8.764 1.038 1.00 0.00 O ATOM 1880 CB ARG B 54 11.561 11.469 0.232 1.00 0.00 C ATOM 1881 CG ARG B 54 12.034 10.436 -0.805 1.00 0.00 C ATOM 1882 CD ARG B 54 13.261 10.935 -1.584 1.00 0.00 C ATOM 1883 NE ARG B 54 14.396 11.259 -0.697 1.00 0.00 N ATOM 1884 CZ ARG B 54 15.352 10.460 -0.260 1.00 0.00 C ATOM 1885 NH1 ARG B 54 15.427 9.196 -0.578 1.00 0.00 N1+ ATOM 1886 NH2 ARG B 54 16.256 10.950 0.530 1.00 0.00 N ATOM 0 H ARG B 54 10.546 13.020 1.708 1.00 0.00 H new ATOM 0 HA ARG B 54 9.435 11.001 0.074 1.00 0.00 H new ATOM 0 HB2 ARG B 54 11.516 12.450 -0.241 1.00 0.00 H new ATOM 0 HB3 ARG B 54 12.301 11.534 1.030 1.00 0.00 H new ATOM 0 HG2 ARG B 54 12.278 9.500 -0.302 1.00 0.00 H new ATOM 0 HG3 ARG B 54 11.223 10.221 -1.501 1.00 0.00 H new ATOM 0 HD2 ARG B 54 13.569 10.173 -2.300 1.00 0.00 H new ATOM 0 HD3 ARG B 54 12.988 11.820 -2.159 1.00 0.00 H new ATOM 0 HE ARG B 54 14.448 12.227 -0.380 1.00 0.00 H new ATOM 0 HH11 ARG B 54 14.726 8.782 -1.192 1.00 0.00 H new ATOM 0 HH12 ARG B 54 16.187 8.622 -0.212 1.00 0.00 H new ATOM 0 HH21 ARG B 54 16.218 11.933 0.801 1.00 0.00 H new ATOM 0 HH22 ARG B 54 17.005 10.353 0.881 1.00 0.00 H new ATOM 1900 N SER B 55 10.480 9.867 2.937 1.00 0.00 N ATOM 1901 CA SER B 55 10.543 8.715 3.857 1.00 0.00 C ATOM 1902 C SER B 55 9.370 8.650 4.861 1.00 0.00 C ATOM 1903 O SER B 55 9.018 7.571 5.346 1.00 0.00 O ATOM 1904 CB SER B 55 11.884 8.779 4.597 1.00 0.00 C ATOM 1905 OG SER B 55 12.124 7.631 5.398 1.00 0.00 O ATOM 0 H SER B 55 10.675 10.750 3.409 1.00 0.00 H new ATOM 0 HA SER B 55 10.458 7.805 3.263 1.00 0.00 H new ATOM 0 HB2 SER B 55 12.690 8.885 3.871 1.00 0.00 H new ATOM 0 HB3 SER B 55 11.904 9.668 5.228 1.00 0.00 H new ATOM 0 HG SER B 55 12.991 7.720 5.847 1.00 0.00 H new ATOM 1911 N GLY B 56 8.736 9.795 5.160 1.00 0.00 N ATOM 1912 CA GLY B 56 7.718 9.938 6.204 1.00 0.00 C ATOM 1913 C GLY B 56 8.313 10.066 7.618 1.00 0.00 C ATOM 1914 O GLY B 56 7.783 9.477 8.566 1.00 0.00 O ATOM 0 H GLY B 56 8.925 10.668 4.667 1.00 0.00 H new ATOM 0 HA2 GLY B 56 7.110 10.818 5.992 1.00 0.00 H new ATOM 0 HA3 GLY B 56 7.052 9.076 6.174 1.00 0.00 H new ATOM 1918 N VAL B 57 9.436 10.782 7.752 1.00 0.00 N ATOM 1919 CA VAL B 57 10.231 10.879 8.994 1.00 0.00 C ATOM 1920 C VAL B 57 10.561 12.334 9.362 1.00 0.00 C ATOM 1921 O VAL B 57 10.897 13.139 8.494 1.00 0.00 O ATOM 1922 CB VAL B 57 11.512 10.021 8.892 1.00 0.00 C ATOM 1923 CG1 VAL B 57 12.430 10.143 10.120 1.00 0.00 C ATOM 1924 CG2 VAL B 57 11.156 8.534 8.743 1.00 0.00 C ATOM 0 H VAL B 57 9.831 11.325 6.984 1.00 0.00 H new ATOM 0 HA VAL B 57 9.617 10.484 9.803 1.00 0.00 H new ATOM 0 HB VAL B 57 12.041 10.401 8.018 1.00 0.00 H new ATOM 0 HG11 VAL B 57 13.310 9.515 9.981 1.00 0.00 H new ATOM 0 HG12 VAL B 57 12.741 11.181 10.240 1.00 0.00 H new ATOM 0 HG13 VAL B 57 11.891 9.820 11.011 1.00 0.00 H new ATOM 0 HG21 VAL B 57 12.071 7.946 8.673 1.00 0.00 H new ATOM 0 HG22 VAL B 57 10.581 8.209 9.610 1.00 0.00 H new ATOM 0 HG23 VAL B 57 10.562 8.391 7.840 1.00 0.00 H new ATOM 1934 N ILE B 58 10.514 12.662 10.655 1.00 0.00 N ATOM 1935 CA ILE B 58 10.941 13.940 11.252 1.00 0.00 C ATOM 1936 C ILE B 58 11.999 13.657 12.334 1.00 0.00 C ATOM 1937 O ILE B 58 11.789 12.801 13.197 1.00 0.00 O ATOM 1938 CB ILE B 58 9.722 14.703 11.822 1.00 0.00 C ATOM 1939 CG1 ILE B 58 8.700 15.067 10.717 1.00 0.00 C ATOM 1940 CG2 ILE B 58 10.159 15.979 12.571 1.00 0.00 C ATOM 1941 CD1 ILE B 58 7.315 15.453 11.252 1.00 0.00 C ATOM 0 H ILE B 58 10.159 12.012 11.356 1.00 0.00 H new ATOM 0 HA ILE B 58 11.388 14.578 10.490 1.00 0.00 H new ATOM 0 HB ILE B 58 9.235 14.030 12.528 1.00 0.00 H new ATOM 0 HG12 ILE B 58 9.095 15.896 10.129 1.00 0.00 H new ATOM 0 HG13 ILE B 58 8.594 14.219 10.041 1.00 0.00 H new ATOM 0 HG21 ILE B 58 9.279 16.492 12.959 1.00 0.00 H new ATOM 0 HG22 ILE B 58 10.816 15.709 13.398 1.00 0.00 H new ATOM 0 HG23 ILE B 58 10.691 16.639 11.886 1.00 0.00 H new ATOM 0 HD11 ILE B 58 6.657 15.694 10.417 1.00 0.00 H new ATOM 0 HD12 ILE B 58 6.897 14.618 11.815 1.00 0.00 H new ATOM 0 HD13 ILE B 58 7.406 16.321 11.905 1.00 0.00 H new ATOM 1953 N SER B 59 13.134 14.362 12.305 1.00 0.00 N ATOM 1954 CA SER B 59 14.235 14.193 13.268 1.00 0.00 C ATOM 1955 C SER B 59 14.364 15.417 14.173 1.00 0.00 C ATOM 1956 O SER B 59 14.479 16.543 13.676 1.00 0.00 O ATOM 1957 CB SER B 59 15.572 13.993 12.553 1.00 0.00 C ATOM 1958 OG SER B 59 15.520 12.924 11.621 1.00 0.00 O ATOM 0 H SER B 59 13.320 15.078 11.603 1.00 0.00 H new ATOM 0 HA SER B 59 13.998 13.311 13.863 1.00 0.00 H new ATOM 0 HB2 SER B 59 15.848 14.912 12.036 1.00 0.00 H new ATOM 0 HB3 SER B 59 16.351 13.795 13.289 1.00 0.00 H new ATOM 0 HG SER B 59 15.092 13.231 10.795 1.00 0.00 H new ATOM 1964 N LEU B 60 14.403 15.207 15.490 1.00 0.00 N ATOM 1965 CA LEU B 60 14.716 16.247 16.473 1.00 0.00 C ATOM 1966 C LEU B 60 16.184 16.181 16.926 1.00 0.00 C ATOM 1967 O LEU B 60 16.799 15.110 16.943 1.00 0.00 O ATOM 1968 CB LEU B 60 13.761 16.170 17.674 1.00 0.00 C ATOM 1969 CG LEU B 60 12.261 16.122 17.327 1.00 0.00 C ATOM 1970 CD1 LEU B 60 11.441 16.222 18.613 1.00 0.00 C ATOM 1971 CD2 LEU B 60 11.824 17.265 16.405 1.00 0.00 C ATOM 0 H LEU B 60 14.215 14.297 15.910 1.00 0.00 H new ATOM 0 HA LEU B 60 14.573 17.212 15.986 1.00 0.00 H new ATOM 0 HB2 LEU B 60 14.010 15.283 18.257 1.00 0.00 H new ATOM 0 HB3 LEU B 60 13.940 17.034 18.314 1.00 0.00 H new ATOM 0 HG LEU B 60 12.091 15.179 16.807 1.00 0.00 H new ATOM 0 HD11 LEU B 60 10.379 16.188 18.371 1.00 0.00 H new ATOM 0 HD12 LEU B 60 11.690 15.388 19.269 1.00 0.00 H new ATOM 0 HD13 LEU B 60 11.668 17.161 19.117 1.00 0.00 H new ATOM 0 HD21 LEU B 60 10.758 17.177 16.197 1.00 0.00 H new ATOM 0 HD22 LEU B 60 12.021 18.220 16.891 1.00 0.00 H new ATOM 0 HD23 LEU B 60 12.382 17.212 15.470 1.00 0.00 H new ATOM 1983 N ILE B 61 16.725 17.330 17.328 1.00 0.00 N ATOM 1984 CA ILE B 61 18.095 17.524 17.824 1.00 0.00 C ATOM 1985 C ILE B 61 18.094 18.308 19.142 1.00 0.00 C ATOM 1986 O ILE B 61 17.117 18.972 19.491 1.00 0.00 O ATOM 1987 CB ILE B 61 19.004 18.194 16.762 1.00 0.00 C ATOM 1988 CG1 ILE B 61 18.551 19.625 16.376 1.00 0.00 C ATOM 1989 CG2 ILE B 61 19.119 17.304 15.516 1.00 0.00 C ATOM 1990 CD1 ILE B 61 19.202 20.752 17.185 1.00 0.00 C ATOM 0 H ILE B 61 16.194 18.201 17.318 1.00 0.00 H new ATOM 0 HA ILE B 61 18.516 16.538 18.022 1.00 0.00 H new ATOM 0 HB ILE B 61 19.987 18.302 17.221 1.00 0.00 H new ATOM 0 HG12 ILE B 61 18.767 19.785 15.320 1.00 0.00 H new ATOM 0 HG13 ILE B 61 17.469 19.692 16.494 1.00 0.00 H new ATOM 0 HG21 ILE B 61 19.761 17.789 14.780 1.00 0.00 H new ATOM 0 HG22 ILE B 61 19.549 16.342 15.794 1.00 0.00 H new ATOM 0 HG23 ILE B 61 18.129 17.148 15.087 1.00 0.00 H new ATOM 0 HD11 ILE B 61 18.821 21.714 16.841 1.00 0.00 H new ATOM 0 HD12 ILE B 61 18.966 20.625 18.241 1.00 0.00 H new ATOM 0 HD13 ILE B 61 20.283 20.720 17.049 1.00 0.00 H new ATOM 2002 N GLU B 62 19.205 18.244 19.874 1.00 0.00 N ATOM 2003 CA GLU B 62 19.382 18.939 21.157 1.00 0.00 C ATOM 2004 C GLU B 62 19.661 20.433 20.939 1.00 0.00 C ATOM 2005 O GLU B 62 20.698 20.819 20.380 1.00 0.00 O ATOM 2006 CB GLU B 62 20.509 18.288 21.969 1.00 0.00 C ATOM 2007 CG GLU B 62 20.162 16.857 22.417 1.00 0.00 C ATOM 2008 CD GLU B 62 21.308 16.245 23.244 1.00 0.00 C ATOM 2009 OE1 GLU B 62 21.875 15.211 22.821 1.00 0.00 O ATOM 2010 OE2 GLU B 62 21.649 16.795 24.321 1.00 0.00 O1- ATOM 0 H GLU B 62 20.022 17.701 19.592 1.00 0.00 H new ATOM 0 HA GLU B 62 18.455 18.851 21.723 1.00 0.00 H new ATOM 0 HB2 GLU B 62 21.419 18.267 21.369 1.00 0.00 H new ATOM 0 HB3 GLU B 62 20.720 18.899 22.847 1.00 0.00 H new ATOM 0 HG2 GLU B 62 19.247 16.869 23.010 1.00 0.00 H new ATOM 0 HG3 GLU B 62 19.967 16.236 21.543 1.00 0.00 H new