USER MOD reduce.3.24.130724 H: found=0, std=0, add=1056, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1054 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 0 SER OG : rot 44:sc= 0.604 USER MOD Single : A 1 MET CE :methyl -171:sc= 0 (180deg=-0.0845) USER MOD Single : A 2 CYS SG : rot 180:sc= 0 USER MOD Single : A 3 MET CE :methyl -136:sc= 0 (180deg=-0.00446) USER MOD Single : A 5 LYS NZ :NH3+ -173:sc= 1.25 (180deg=1.21) USER MOD Single : A 9 THR OG1 : rot 160:sc= 0.765 USER MOD Single : A -3 GLY N :NH3+ -140:sc= 0.0131 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 HIS : no HD1:sc= -0.0451 X(o=-0.045,f=-0.045) 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 : A 64 GLN : amide:sc= 0.938 K(o=0.94,f=0) USER MOD Single : A 65 ASN : amide:sc= -0.0124 K(o=-0.012,f=-1.1) USER MOD Single : B 0 SER OG : rot 70:sc= 0.188 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 2 CYS SG : rot 180:sc= 0 USER MOD Single : B 3 MET CE :methyl 166:sc= -0.0835 (180deg=-0.32) USER MOD Single : B 5 LYS NZ :NH3+ 148:sc= 1.02 (180deg=0.383) USER MOD Single : B 9 THR OG1 : rot 180:sc= 0 USER MOD Single : B -3 GLY N :NH3+ -128:sc= 0.0702 (180deg=0) USER MOD Single : B 10 LYS NZ :NH3+ 161:sc= 1.19 (180deg=0.96) USER MOD Single : B 34 THR OG1 : rot -160:sc= 0.994 USER MOD Single : B 35 THR OG1 : rot 170:sc= 0.00427 USER MOD Single : B 41 HIS : no HD1:sc= 0.895 K(o=0.89,f=-2.7!) USER MOD Single : B 55 SER OG : rot 180:sc= 0 USER MOD Single : B 59 SER OG : rot 180:sc= 0 USER MOD Single : B 64 GLN : amide:sc= 1.45 K(o=1.4,f=-5.5!) USER MOD Single : B 65 ASN : amide:sc= 0.967 K(o=0.97,f=-0.004) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 23.733 1.764 -7.831 1.00 0.00 N ATOM 2 CA GLY A -3 24.257 2.128 -6.497 1.00 0.00 C ATOM 3 C GLY A -3 23.260 1.785 -5.394 1.00 0.00 C ATOM 4 O GLY A -3 22.583 0.754 -5.482 1.00 0.00 O ATOM 0 H1 GLY A -3 24.499 1.360 -8.407 1.00 0.00 H new ATOM 0 H2 GLY A -3 22.972 1.063 -7.726 1.00 0.00 H new ATOM 0 H3 GLY A -3 23.358 2.613 -8.300 1.00 0.00 H new ATOM 0 HA2 GLY A -3 25.195 1.603 -6.317 1.00 0.00 H new ATOM 0 HA3 GLY A -3 24.479 3.195 -6.470 1.00 0.00 H new ATOM 10 N PRO A -2 23.149 2.610 -4.332 1.00 0.00 N ATOM 11 CA PRO A -2 22.234 2.377 -3.211 1.00 0.00 C ATOM 12 C PRO A -2 20.757 2.514 -3.621 1.00 0.00 C ATOM 13 O PRO A -2 20.415 3.237 -4.566 1.00 0.00 O ATOM 14 CB PRO A -2 22.627 3.406 -2.147 1.00 0.00 C ATOM 15 CG PRO A -2 23.184 4.568 -2.969 1.00 0.00 C ATOM 16 CD PRO A -2 23.887 3.852 -4.124 1.00 0.00 C ATOM 0 HA PRO A -2 22.321 1.357 -2.838 1.00 0.00 H new ATOM 0 HB2 PRO A -2 21.770 3.712 -1.548 1.00 0.00 H new ATOM 0 HB3 PRO A -2 23.372 3.008 -1.458 1.00 0.00 H new ATOM 0 HG2 PRO A -2 22.394 5.230 -3.323 1.00 0.00 H new ATOM 0 HG3 PRO A -2 23.876 5.179 -2.390 1.00 0.00 H new ATOM 0 HD2 PRO A -2 23.882 4.465 -5.025 1.00 0.00 H new ATOM 0 HD3 PRO A -2 24.930 3.651 -3.882 1.00 0.00 H new ATOM 24 N GLY A -1 19.868 1.830 -2.888 1.00 0.00 N ATOM 25 CA GLY A -1 18.412 1.883 -3.086 1.00 0.00 C ATOM 26 C GLY A -1 17.713 3.036 -2.348 1.00 0.00 C ATOM 27 O GLY A -1 16.616 3.434 -2.745 1.00 0.00 O ATOM 0 H GLY A -1 20.146 1.212 -2.126 1.00 0.00 H new ATOM 0 HA2 GLY A -1 18.206 1.972 -4.153 1.00 0.00 H new ATOM 0 HA3 GLY A -1 17.978 0.940 -2.755 1.00 0.00 H new ATOM 31 N SER A 0 18.368 3.597 -1.323 1.00 0.00 N ATOM 32 CA SER A 0 17.870 4.639 -0.402 1.00 0.00 C ATOM 33 C SER A 0 16.664 4.224 0.466 1.00 0.00 C ATOM 34 O SER A 0 15.865 3.352 0.111 1.00 0.00 O ATOM 35 CB SER A 0 17.624 5.954 -1.160 1.00 0.00 C ATOM 36 OG SER A 0 17.218 6.995 -0.282 1.00 0.00 O ATOM 0 H SER A 0 19.323 3.320 -1.096 1.00 0.00 H new ATOM 0 HA SER A 0 18.665 4.796 0.327 1.00 0.00 H new ATOM 0 HB2 SER A 0 18.535 6.251 -1.681 1.00 0.00 H new ATOM 0 HB3 SER A 0 16.858 5.799 -1.920 1.00 0.00 H new ATOM 0 HG SER A 0 17.779 6.983 0.522 1.00 0.00 H new ATOM 42 N MET A 1 16.510 4.877 1.624 1.00 0.00 N ATOM 43 CA MET A 1 15.289 4.816 2.445 1.00 0.00 C ATOM 44 C MET A 1 14.137 5.696 1.909 1.00 0.00 C ATOM 45 O MET A 1 12.997 5.575 2.368 1.00 0.00 O ATOM 46 CB MET A 1 15.612 5.160 3.913 1.00 0.00 C ATOM 47 CG MET A 1 15.964 6.641 4.132 1.00 0.00 C ATOM 48 SD MET A 1 16.479 7.061 5.821 1.00 0.00 S ATOM 49 CE MET A 1 14.910 6.825 6.697 1.00 0.00 C ATOM 0 H MET A 1 17.237 5.470 2.024 1.00 0.00 H new ATOM 0 HA MET A 1 14.928 3.789 2.386 1.00 0.00 H new ATOM 0 HB2 MET A 1 14.755 4.902 4.535 1.00 0.00 H new ATOM 0 HB3 MET A 1 16.446 4.543 4.248 1.00 0.00 H new ATOM 0 HG2 MET A 1 16.765 6.915 3.445 1.00 0.00 H new ATOM 0 HG3 MET A 1 15.097 7.248 3.870 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.005 7.193 7.718 1.00 0.00 H new ATOM 0 HE2 MET A 1 14.121 7.375 6.184 1.00 0.00 H new ATOM 0 HE3 MET A 1 14.660 5.764 6.716 1.00 0.00 H new ATOM 59 N CYS A 2 14.451 6.549 0.926 1.00 0.00 N ATOM 60 CA CYS A 2 13.597 7.578 0.313 1.00 0.00 C ATOM 61 C CYS A 2 13.110 8.679 1.285 1.00 0.00 C ATOM 62 O CYS A 2 13.181 8.554 2.512 1.00 0.00 O ATOM 63 CB CYS A 2 12.449 6.920 -0.482 1.00 0.00 C ATOM 64 SG CYS A 2 13.104 5.797 -1.762 1.00 0.00 S ATOM 0 H CYS A 2 15.380 6.538 0.505 1.00 0.00 H new ATOM 0 HA CYS A 2 14.228 8.125 -0.387 1.00 0.00 H new ATOM 0 HB2 CYS A 2 11.802 6.365 0.198 1.00 0.00 H new ATOM 0 HB3 CYS A 2 11.836 7.691 -0.948 1.00 0.00 H new ATOM 0 HG CYS A 2 12.116 5.257 -2.412 1.00 0.00 H new ATOM 70 N MET A 3 12.635 9.791 0.719 1.00 0.00 N ATOM 71 CA MET A 3 12.147 10.954 1.470 1.00 0.00 C ATOM 72 C MET A 3 10.855 10.671 2.261 1.00 0.00 C ATOM 73 O MET A 3 10.009 9.864 1.858 1.00 0.00 O ATOM 74 CB MET A 3 11.923 12.139 0.524 1.00 0.00 C ATOM 75 CG MET A 3 13.222 12.813 0.062 1.00 0.00 C ATOM 76 SD MET A 3 14.183 11.934 -1.208 1.00 0.00 S ATOM 77 CE MET A 3 13.174 12.293 -2.671 1.00 0.00 C ATOM 0 H MET A 3 12.577 9.912 -0.292 1.00 0.00 H new ATOM 0 HA MET A 3 12.920 11.194 2.200 1.00 0.00 H new ATOM 0 HB2 MET A 3 11.371 11.795 -0.351 1.00 0.00 H new ATOM 0 HB3 MET A 3 11.298 12.879 1.024 1.00 0.00 H new ATOM 0 HG2 MET A 3 12.975 13.803 -0.321 1.00 0.00 H new ATOM 0 HG3 MET A 3 13.860 12.958 0.934 1.00 0.00 H new ATOM 0 HE1 MET A 3 13.058 11.386 -3.264 1.00 0.00 H new ATOM 0 HE2 MET A 3 12.193 12.650 -2.358 1.00 0.00 H new ATOM 0 HE3 MET A 3 13.664 13.059 -3.272 1.00 0.00 H new ATOM 87 N ALA A 4 10.695 11.380 3.381 1.00 0.00 N ATOM 88 CA ALA A 4 9.475 11.413 4.189 1.00 0.00 C ATOM 89 C ALA A 4 8.383 12.325 3.572 1.00 0.00 C ATOM 90 O ALA A 4 8.552 12.887 2.478 1.00 0.00 O ATOM 91 CB ALA A 4 9.887 11.884 5.597 1.00 0.00 C ATOM 0 H ALA A 4 11.437 11.967 3.763 1.00 0.00 H new ATOM 0 HA ALA A 4 9.024 10.422 4.230 1.00 0.00 H new ATOM 0 HB1 ALA A 4 9.007 11.925 6.239 1.00 0.00 H new ATOM 0 HB2 ALA A 4 10.611 11.185 6.017 1.00 0.00 H new ATOM 0 HB3 ALA A 4 10.335 12.875 5.532 1.00 0.00 H new ATOM 97 N LYS A 5 7.292 12.545 4.317 1.00 0.00 N ATOM 98 CA LYS A 5 6.346 13.653 4.106 1.00 0.00 C ATOM 99 C LYS A 5 6.090 14.428 5.401 1.00 0.00 C ATOM 100 O LYS A 5 6.204 13.863 6.493 1.00 0.00 O ATOM 101 CB LYS A 5 5.047 13.150 3.449 1.00 0.00 C ATOM 102 CG LYS A 5 4.199 12.225 4.335 1.00 0.00 C ATOM 103 CD LYS A 5 2.867 11.914 3.644 1.00 0.00 C ATOM 104 CE LYS A 5 1.978 11.047 4.544 1.00 0.00 C ATOM 105 NZ LYS A 5 0.639 10.850 3.937 1.00 0.00 N1+ ATOM 0 H LYS A 5 7.035 11.945 5.101 1.00 0.00 H new ATOM 0 HA LYS A 5 6.800 14.360 3.412 1.00 0.00 H new ATOM 0 HB2 LYS A 5 4.443 14.011 3.163 1.00 0.00 H new ATOM 0 HB3 LYS A 5 5.301 12.620 2.531 1.00 0.00 H new ATOM 0 HG2 LYS A 5 4.741 11.300 4.532 1.00 0.00 H new ATOM 0 HG3 LYS A 5 4.016 12.699 5.299 1.00 0.00 H new ATOM 0 HD2 LYS A 5 2.351 12.843 3.402 1.00 0.00 H new ATOM 0 HD3 LYS A 5 3.052 11.398 2.702 1.00 0.00 H new ATOM 0 HE2 LYS A 5 2.453 10.080 4.707 1.00 0.00 H new ATOM 0 HE3 LYS A 5 1.873 11.519 5.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 0.019 10.363 4.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 0.228 11.774 3.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 0.730 10.275 3.075 1.00 0.00 H new ATOM 119 N VAL A 6 5.704 15.698 5.285 1.00 0.00 N ATOM 120 CA VAL A 6 5.245 16.535 6.412 1.00 0.00 C ATOM 121 C VAL A 6 3.714 16.619 6.426 1.00 0.00 C ATOM 122 O VAL A 6 3.092 16.657 5.365 1.00 0.00 O ATOM 123 CB VAL A 6 5.862 17.951 6.396 1.00 0.00 C ATOM 124 CG1 VAL A 6 5.604 18.735 7.694 1.00 0.00 C ATOM 125 CG2 VAL A 6 7.374 17.923 6.161 1.00 0.00 C ATOM 0 H VAL A 6 5.698 16.191 4.392 1.00 0.00 H new ATOM 0 HA VAL A 6 5.590 16.051 7.326 1.00 0.00 H new ATOM 0 HB VAL A 6 5.364 18.454 5.567 1.00 0.00 H new ATOM 0 HG11 VAL A 6 6.062 19.721 7.621 1.00 0.00 H new ATOM 0 HG12 VAL A 6 4.530 18.844 7.846 1.00 0.00 H new ATOM 0 HG13 VAL A 6 6.036 18.196 8.537 1.00 0.00 H new ATOM 0 HG21 VAL A 6 7.761 18.942 6.158 1.00 0.00 H new ATOM 0 HG22 VAL A 6 7.855 17.354 6.957 1.00 0.00 H new ATOM 0 HG23 VAL A 6 7.584 17.453 5.200 1.00 0.00 H new ATOM 135 N VAL A 7 3.101 16.700 7.613 1.00 0.00 N ATOM 136 CA VAL A 7 1.666 16.992 7.811 1.00 0.00 C ATOM 137 C VAL A 7 1.453 18.040 8.912 1.00 0.00 C ATOM 138 O VAL A 7 2.165 18.044 9.921 1.00 0.00 O ATOM 139 CB VAL A 7 0.850 15.696 8.036 1.00 0.00 C ATOM 140 CG1 VAL A 7 1.251 14.927 9.304 1.00 0.00 C ATOM 141 CG2 VAL A 7 -0.658 15.955 8.108 1.00 0.00 C ATOM 0 H VAL A 7 3.600 16.561 8.492 1.00 0.00 H new ATOM 0 HA VAL A 7 1.281 17.436 6.893 1.00 0.00 H new ATOM 0 HB VAL A 7 1.086 15.088 7.162 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.637 14.031 9.396 1.00 0.00 H new ATOM 0 HG12 VAL A 7 2.301 14.642 9.240 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.100 15.561 10.177 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.182 15.012 8.267 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -0.872 16.633 8.935 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -0.995 16.405 7.174 1.00 0.00 H new ATOM 151 N LEU A 8 0.483 18.940 8.714 1.00 0.00 N ATOM 152 CA LEU A 8 0.123 20.008 9.653 1.00 0.00 C ATOM 153 C LEU A 8 -1.387 20.297 9.652 1.00 0.00 C ATOM 154 O LEU A 8 -2.077 20.046 8.658 1.00 0.00 O ATOM 155 CB LEU A 8 0.980 21.261 9.376 1.00 0.00 C ATOM 156 CG LEU A 8 0.711 22.000 8.046 1.00 0.00 C ATOM 157 CD1 LEU A 8 -0.368 23.087 8.173 1.00 0.00 C ATOM 158 CD2 LEU A 8 1.991 22.689 7.561 1.00 0.00 C ATOM 0 H LEU A 8 -0.090 18.945 7.870 1.00 0.00 H new ATOM 0 HA LEU A 8 0.347 19.672 10.666 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.829 21.965 10.194 1.00 0.00 H new ATOM 0 HB3 LEU A 8 2.030 20.968 9.397 1.00 0.00 H new ATOM 0 HG LEU A 8 0.367 21.240 7.344 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -0.513 23.571 7.207 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.305 22.633 8.496 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.052 23.829 8.907 1.00 0.00 H new ATOM 0 HD21 LEU A 8 1.792 23.207 6.623 1.00 0.00 H new ATOM 0 HD22 LEU A 8 2.323 23.408 8.310 1.00 0.00 H new ATOM 0 HD23 LEU A 8 2.769 21.942 7.405 1.00 0.00 H new ATOM 170 N THR A 9 -1.886 20.858 10.757 1.00 0.00 N ATOM 171 CA THR A 9 -3.296 21.265 10.936 1.00 0.00 C ATOM 172 C THR A 9 -3.409 22.793 10.995 1.00 0.00 C ATOM 173 O THR A 9 -2.666 23.457 11.727 1.00 0.00 O ATOM 174 CB THR A 9 -3.926 20.622 12.185 1.00 0.00 C ATOM 175 OG1 THR A 9 -3.673 19.226 12.230 1.00 0.00 O ATOM 176 CG2 THR A 9 -5.451 20.764 12.220 1.00 0.00 C ATOM 0 H THR A 9 -1.311 21.050 11.577 1.00 0.00 H new ATOM 0 HA THR A 9 -3.854 20.905 10.072 1.00 0.00 H new ATOM 0 HB THR A 9 -3.473 21.148 13.026 1.00 0.00 H new ATOM 0 HG1 THR A 9 -3.789 18.902 13.148 1.00 0.00 H new ATOM 0 HG21 THR A 9 -5.840 20.292 13.122 1.00 0.00 H new ATOM 0 HG22 THR A 9 -5.718 21.821 12.219 1.00 0.00 H new ATOM 0 HG23 THR A 9 -5.882 20.280 11.343 1.00 0.00 H new ATOM 184 N LYS A 10 -4.331 23.363 10.208 1.00 0.00 N ATOM 185 CA LYS A 10 -4.632 24.804 10.128 1.00 0.00 C ATOM 186 C LYS A 10 -5.532 25.268 11.277 1.00 0.00 C ATOM 187 O LYS A 10 -6.244 24.464 11.882 1.00 0.00 O ATOM 188 CB LYS A 10 -5.296 25.103 8.770 1.00 0.00 C ATOM 189 CG LYS A 10 -4.409 24.762 7.560 1.00 0.00 C ATOM 190 CD LYS A 10 -4.994 25.277 6.235 1.00 0.00 C ATOM 191 CE LYS A 10 -6.297 24.572 5.845 1.00 0.00 C ATOM 192 NZ LYS A 10 -6.838 25.107 4.568 1.00 0.00 N1+ ATOM 0 H LYS A 10 -4.915 22.810 9.581 1.00 0.00 H new ATOM 0 HA LYS A 10 -3.696 25.356 10.216 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -6.226 24.539 8.698 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -5.560 26.160 8.729 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -3.419 25.192 7.707 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -4.281 23.681 7.501 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -5.177 26.348 6.316 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -4.260 25.138 5.441 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -6.119 23.501 5.747 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -7.034 24.701 6.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -7.720 24.611 4.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -7.030 26.124 4.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -6.143 24.961 3.808 1.00 0.00 H new ATOM 206 N ALA A 11 -5.577 26.583 11.517 1.00 0.00 N ATOM 207 CA ALA A 11 -6.493 27.215 12.477 1.00 0.00 C ATOM 208 C ALA A 11 -7.987 27.019 12.114 1.00 0.00 C ATOM 209 O ALA A 11 -8.856 27.057 12.990 1.00 0.00 O ATOM 210 CB ALA A 11 -6.133 28.706 12.556 1.00 0.00 C ATOM 0 H ALA A 11 -4.969 27.250 11.043 1.00 0.00 H new ATOM 0 HA ALA A 11 -6.370 26.734 13.447 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -6.797 29.204 13.262 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -5.101 28.814 12.890 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -6.245 29.160 11.571 1.00 0.00 H new ATOM 216 N ASP A 12 -8.291 26.767 10.838 1.00 0.00 N ATOM 217 CA ASP A 12 -9.626 26.409 10.337 1.00 0.00 C ATOM 218 C ASP A 12 -10.043 24.949 10.651 1.00 0.00 C ATOM 219 O ASP A 12 -11.177 24.551 10.361 1.00 0.00 O ATOM 220 CB ASP A 12 -9.682 26.655 8.816 1.00 0.00 C ATOM 221 CG ASP A 12 -9.391 28.102 8.383 1.00 0.00 C ATOM 222 OD1 ASP A 12 -8.960 28.291 7.218 1.00 0.00 O ATOM 223 OD2 ASP A 12 -9.627 29.058 9.165 1.00 0.00 O1- ATOM 0 H ASP A 12 -7.591 26.807 10.097 1.00 0.00 H new ATOM 0 HA ASP A 12 -10.339 27.046 10.861 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -8.965 25.994 8.329 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -10.671 26.375 8.453 1.00 0.00 H new ATOM 228 N GLY A 13 -9.145 24.131 11.215 1.00 0.00 N ATOM 229 CA GLY A 13 -9.346 22.703 11.505 1.00 0.00 C ATOM 230 C GLY A 13 -9.081 21.759 10.325 1.00 0.00 C ATOM 231 O GLY A 13 -9.051 20.538 10.509 1.00 0.00 O ATOM 0 H GLY A 13 -8.220 24.458 11.494 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -8.694 22.420 12.331 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -10.372 22.557 11.844 1.00 0.00 H new ATOM 235 N GLY A 14 -8.853 22.297 9.120 1.00 0.00 N ATOM 236 CA GLY A 14 -8.393 21.542 7.943 1.00 0.00 C ATOM 237 C GLY A 14 -6.905 21.163 8.022 1.00 0.00 C ATOM 238 O GLY A 14 -6.168 21.673 8.868 1.00 0.00 O ATOM 0 H GLY A 14 -8.985 23.290 8.930 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -8.989 20.635 7.843 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -8.565 22.137 7.046 1.00 0.00 H new ATOM 242 N ARG A 15 -6.444 20.278 7.132 1.00 0.00 N ATOM 243 CA ARG A 15 -5.067 19.748 7.127 1.00 0.00 C ATOM 244 C ARG A 15 -4.366 19.893 5.776 1.00 0.00 C ATOM 245 O ARG A 15 -5.006 19.930 4.725 1.00 0.00 O ATOM 246 CB ARG A 15 -5.052 18.294 7.632 1.00 0.00 C ATOM 247 CG ARG A 15 -5.241 18.253 9.155 1.00 0.00 C ATOM 248 CD ARG A 15 -5.201 16.837 9.737 1.00 0.00 C ATOM 249 NE ARG A 15 -5.064 16.914 11.202 1.00 0.00 N ATOM 250 CZ ARG A 15 -5.337 15.992 12.102 1.00 0.00 C ATOM 251 NH1 ARG A 15 -5.829 14.828 11.786 1.00 0.00 N1+ ATOM 252 NH2 ARG A 15 -5.118 16.240 13.362 1.00 0.00 N ATOM 0 H ARG A 15 -7.022 19.901 6.381 1.00 0.00 H new ATOM 0 HA ARG A 15 -4.486 20.361 7.817 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -5.845 17.725 7.146 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -4.108 17.819 7.364 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -4.463 18.853 9.626 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -6.196 18.714 9.407 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -6.111 16.298 9.474 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -4.366 16.280 9.311 1.00 0.00 H new ATOM 0 HE ARG A 15 -4.711 17.798 11.568 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -6.017 14.602 10.809 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -6.026 14.143 12.515 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -4.738 17.143 13.645 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -5.327 15.531 14.065 1.00 0.00 H new ATOM 266 N VAL A 16 -3.036 19.981 5.829 1.00 0.00 N ATOM 267 CA VAL A 16 -2.121 20.167 4.683 1.00 0.00 C ATOM 268 C VAL A 16 -0.968 19.154 4.769 1.00 0.00 C ATOM 269 O VAL A 16 -0.463 18.875 5.858 1.00 0.00 O ATOM 270 CB VAL A 16 -1.594 21.619 4.644 1.00 0.00 C ATOM 271 CG1 VAL A 16 -0.557 21.865 3.543 1.00 0.00 C ATOM 272 CG2 VAL A 16 -2.737 22.626 4.443 1.00 0.00 C ATOM 0 H VAL A 16 -2.534 19.922 6.715 1.00 0.00 H new ATOM 0 HA VAL A 16 -2.665 19.989 3.755 1.00 0.00 H new ATOM 0 HB VAL A 16 -1.114 21.764 5.612 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -0.232 22.905 3.575 1.00 0.00 H new ATOM 0 HG12 VAL A 16 0.301 21.211 3.699 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -1.002 21.654 2.571 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -2.331 23.637 4.420 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -3.244 22.417 3.501 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -3.448 22.539 5.265 1.00 0.00 H new ATOM 282 N GLU A 17 -0.539 18.617 3.626 1.00 0.00 N ATOM 283 CA GLU A 17 0.564 17.649 3.503 1.00 0.00 C ATOM 284 C GLU A 17 1.598 18.098 2.459 1.00 0.00 C ATOM 285 O GLU A 17 1.252 18.719 1.447 1.00 0.00 O ATOM 286 CB GLU A 17 0.037 16.242 3.158 1.00 0.00 C ATOM 287 CG GLU A 17 -0.878 15.650 4.240 1.00 0.00 C ATOM 288 CD GLU A 17 -1.412 14.261 3.842 1.00 0.00 C ATOM 289 OE1 GLU A 17 -0.601 13.327 3.623 1.00 0.00 O ATOM 290 OE2 GLU A 17 -2.653 14.083 3.765 1.00 0.00 O1- ATOM 0 H GLU A 17 -0.961 18.849 2.727 1.00 0.00 H new ATOM 0 HA GLU A 17 1.059 17.605 4.473 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -0.510 16.288 2.216 1.00 0.00 H new ATOM 0 HB3 GLU A 17 0.884 15.573 3.003 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -0.328 15.573 5.178 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -1.716 16.325 4.416 1.00 0.00 H new ATOM 297 N ILE A 18 2.871 17.753 2.688 1.00 0.00 N ATOM 298 CA ILE A 18 4.014 18.090 1.819 1.00 0.00 C ATOM 299 C ILE A 18 4.842 16.822 1.575 1.00 0.00 C ATOM 300 O ILE A 18 5.586 16.382 2.456 1.00 0.00 O ATOM 301 CB ILE A 18 4.868 19.228 2.438 1.00 0.00 C ATOM 302 CG1 ILE A 18 4.045 20.510 2.704 1.00 0.00 C ATOM 303 CG2 ILE A 18 6.072 19.556 1.534 1.00 0.00 C ATOM 304 CD1 ILE A 18 4.750 21.498 3.644 1.00 0.00 C ATOM 0 H ILE A 18 3.147 17.214 3.509 1.00 0.00 H new ATOM 0 HA ILE A 18 3.650 18.462 0.861 1.00 0.00 H new ATOM 0 HB ILE A 18 5.225 18.863 3.401 1.00 0.00 H new ATOM 0 HG12 ILE A 18 3.839 21.005 1.755 1.00 0.00 H new ATOM 0 HG13 ILE A 18 3.082 20.233 3.134 1.00 0.00 H new ATOM 0 HG21 ILE A 18 6.658 20.356 1.985 1.00 0.00 H new ATOM 0 HG22 ILE A 18 6.695 18.669 1.422 1.00 0.00 H new ATOM 0 HG23 ILE A 18 5.715 19.875 0.555 1.00 0.00 H new ATOM 0 HD11 ILE A 18 4.120 22.375 3.789 1.00 0.00 H new ATOM 0 HD12 ILE A 18 4.932 21.019 4.606 1.00 0.00 H new ATOM 0 HD13 ILE A 18 5.700 21.803 3.205 1.00 0.00 H new ATOM 316 N GLY A 19 4.680 16.212 0.398 1.00 0.00 N ATOM 317 CA GLY A 19 5.357 14.970 0.009 1.00 0.00 C ATOM 318 C GLY A 19 6.821 15.168 -0.400 1.00 0.00 C ATOM 319 O GLY A 19 7.229 16.258 -0.810 1.00 0.00 O ATOM 0 H GLY A 19 4.061 16.575 -0.327 1.00 0.00 H new ATOM 0 HA2 GLY A 19 5.313 14.267 0.841 1.00 0.00 H new ATOM 0 HA3 GLY A 19 4.815 14.516 -0.821 1.00 0.00 H new ATOM 323 N ASP A 20 7.602 14.089 -0.303 1.00 0.00 N ATOM 324 CA ASP A 20 9.000 13.982 -0.749 1.00 0.00 C ATOM 325 C ASP A 20 9.928 15.089 -0.193 1.00 0.00 C ATOM 326 O ASP A 20 10.710 15.719 -0.916 1.00 0.00 O ATOM 327 CB ASP A 20 9.061 13.812 -2.282 1.00 0.00 C ATOM 328 CG ASP A 20 8.258 12.619 -2.832 1.00 0.00 C ATOM 329 OD1 ASP A 20 8.009 11.633 -2.096 1.00 0.00 O ATOM 330 OD2 ASP A 20 7.885 12.659 -4.027 1.00 0.00 O1- ATOM 0 H ASP A 20 7.262 13.220 0.109 1.00 0.00 H new ATOM 0 HA ASP A 20 9.416 13.076 -0.307 1.00 0.00 H new ATOM 0 HB2 ASP A 20 8.694 14.726 -2.750 1.00 0.00 H new ATOM 0 HB3 ASP A 20 10.103 13.698 -2.580 1.00 0.00 H new ATOM 335 N VAL A 21 9.823 15.345 1.114 1.00 0.00 N ATOM 336 CA VAL A 21 10.568 16.387 1.830 1.00 0.00 C ATOM 337 C VAL A 21 12.048 16.015 2.033 1.00 0.00 C ATOM 338 O VAL A 21 12.372 14.888 2.416 1.00 0.00 O ATOM 339 CB VAL A 21 9.846 16.749 3.143 1.00 0.00 C ATOM 340 CG1 VAL A 21 9.921 15.676 4.231 1.00 0.00 C ATOM 341 CG2 VAL A 21 10.390 18.044 3.728 1.00 0.00 C ATOM 0 H VAL A 21 9.198 14.817 1.723 1.00 0.00 H new ATOM 0 HA VAL A 21 10.586 17.283 1.210 1.00 0.00 H new ATOM 0 HB VAL A 21 8.801 16.851 2.852 1.00 0.00 H new ATOM 0 HG11 VAL A 21 9.386 16.018 5.117 1.00 0.00 H new ATOM 0 HG12 VAL A 21 9.467 14.755 3.866 1.00 0.00 H new ATOM 0 HG13 VAL A 21 10.964 15.489 4.487 1.00 0.00 H new ATOM 0 HG21 VAL A 21 9.863 18.275 4.654 1.00 0.00 H new ATOM 0 HG22 VAL A 21 11.454 17.931 3.935 1.00 0.00 H new ATOM 0 HG23 VAL A 21 10.244 18.855 3.015 1.00 0.00 H new ATOM 351 N LEU A 22 12.952 16.967 1.785 1.00 0.00 N ATOM 352 CA LEU A 22 14.394 16.830 2.013 1.00 0.00 C ATOM 353 C LEU A 22 14.814 17.289 3.416 1.00 0.00 C ATOM 354 O LEU A 22 15.664 16.651 4.041 1.00 0.00 O ATOM 355 CB LEU A 22 15.169 17.645 0.962 1.00 0.00 C ATOM 356 CG LEU A 22 14.999 17.208 -0.501 1.00 0.00 C ATOM 357 CD1 LEU A 22 15.801 18.160 -1.388 1.00 0.00 C ATOM 358 CD2 LEU A 22 15.505 15.785 -0.754 1.00 0.00 C ATOM 0 H LEU A 22 12.694 17.880 1.410 1.00 0.00 H new ATOM 0 HA LEU A 22 14.631 15.770 1.926 1.00 0.00 H new ATOM 0 HB2 LEU A 22 14.864 18.688 1.045 1.00 0.00 H new ATOM 0 HB3 LEU A 22 16.229 17.603 1.210 1.00 0.00 H new ATOM 0 HG LEU A 22 13.933 17.232 -0.729 1.00 0.00 H new ATOM 0 HD11 LEU A 22 15.692 17.864 -2.431 1.00 0.00 H new ATOM 0 HD12 LEU A 22 15.431 19.177 -1.258 1.00 0.00 H new ATOM 0 HD13 LEU A 22 16.854 18.119 -1.108 1.00 0.00 H new ATOM 0 HD21 LEU A 22 15.360 15.529 -1.803 1.00 0.00 H new ATOM 0 HD22 LEU A 22 16.566 15.727 -0.509 1.00 0.00 H new ATOM 0 HD23 LEU A 22 14.950 15.085 -0.130 1.00 0.00 H new ATOM 370 N GLU A 23 14.234 18.378 3.929 1.00 0.00 N ATOM 371 CA GLU A 23 14.647 18.981 5.201 1.00 0.00 C ATOM 372 C GLU A 23 13.505 19.764 5.866 1.00 0.00 C ATOM 373 O GLU A 23 12.679 20.383 5.190 1.00 0.00 O ATOM 374 CB GLU A 23 15.889 19.865 4.949 1.00 0.00 C ATOM 375 CG GLU A 23 16.405 20.597 6.199 1.00 0.00 C ATOM 376 CD GLU A 23 17.785 21.254 6.016 1.00 0.00 C ATOM 377 OE1 GLU A 23 18.395 21.649 7.039 1.00 0.00 O ATOM 378 OE2 GLU A 23 18.298 21.389 4.881 1.00 0.00 O1- ATOM 0 H GLU A 23 13.464 18.868 3.474 1.00 0.00 H new ATOM 0 HA GLU A 23 14.908 18.191 5.905 1.00 0.00 H new ATOM 0 HB2 GLU A 23 16.690 19.242 4.550 1.00 0.00 H new ATOM 0 HB3 GLU A 23 15.647 20.602 4.184 1.00 0.00 H new ATOM 0 HG2 GLU A 23 15.684 21.364 6.482 1.00 0.00 H new ATOM 0 HG3 GLU A 23 16.458 19.889 7.026 1.00 0.00 H new ATOM 385 N VAL A 24 13.476 19.756 7.203 1.00 0.00 N ATOM 386 CA VAL A 24 12.525 20.504 8.047 1.00 0.00 C ATOM 387 C VAL A 24 13.259 21.167 9.214 1.00 0.00 C ATOM 388 O VAL A 24 14.142 20.551 9.813 1.00 0.00 O ATOM 389 CB VAL A 24 11.387 19.600 8.571 1.00 0.00 C ATOM 390 CG1 VAL A 24 10.265 20.408 9.241 1.00 0.00 C ATOM 391 CG2 VAL A 24 10.743 18.764 7.463 1.00 0.00 C ATOM 0 H VAL A 24 14.138 19.208 7.753 1.00 0.00 H new ATOM 0 HA VAL A 24 12.070 21.276 7.426 1.00 0.00 H new ATOM 0 HB VAL A 24 11.868 18.945 9.298 1.00 0.00 H new ATOM 0 HG11 VAL A 24 9.488 19.729 9.593 1.00 0.00 H new ATOM 0 HG12 VAL A 24 10.672 20.964 10.086 1.00 0.00 H new ATOM 0 HG13 VAL A 24 9.838 21.105 8.520 1.00 0.00 H new ATOM 0 HG21 VAL A 24 9.950 18.148 7.887 1.00 0.00 H new ATOM 0 HG22 VAL A 24 10.323 19.426 6.706 1.00 0.00 H new ATOM 0 HG23 VAL A 24 11.497 18.122 7.007 1.00 0.00 H new ATOM 401 N ARG A 25 12.908 22.417 9.539 1.00 0.00 N ATOM 402 CA ARG A 25 13.512 23.220 10.627 1.00 0.00 C ATOM 403 C ARG A 25 12.441 23.920 11.466 1.00 0.00 C ATOM 404 O ARG A 25 11.520 24.501 10.900 1.00 0.00 O ATOM 405 CB ARG A 25 14.483 24.271 10.052 1.00 0.00 C ATOM 406 CG ARG A 25 15.642 23.684 9.236 1.00 0.00 C ATOM 407 CD ARG A 25 16.566 24.796 8.715 1.00 0.00 C ATOM 408 NE ARG A 25 17.637 24.246 7.868 1.00 0.00 N ATOM 409 CZ ARG A 25 18.506 24.914 7.136 1.00 0.00 C ATOM 410 NH1 ARG A 25 18.565 26.218 7.120 1.00 0.00 N1+ ATOM 411 NH2 ARG A 25 19.345 24.255 6.398 1.00 0.00 N ATOM 0 H ARG A 25 12.174 22.920 9.041 1.00 0.00 H new ATOM 0 HA ARG A 25 14.062 22.533 11.270 1.00 0.00 H new ATOM 0 HB2 ARG A 25 13.922 24.959 9.420 1.00 0.00 H new ATOM 0 HB3 ARG A 25 14.894 24.857 10.874 1.00 0.00 H new ATOM 0 HG2 ARG A 25 16.213 22.992 9.854 1.00 0.00 H new ATOM 0 HG3 ARG A 25 15.247 23.111 8.397 1.00 0.00 H new ATOM 0 HD2 ARG A 25 15.983 25.519 8.145 1.00 0.00 H new ATOM 0 HD3 ARG A 25 17.004 25.332 9.557 1.00 0.00 H new ATOM 0 HE ARG A 25 17.716 23.229 7.845 1.00 0.00 H new ATOM 0 HH11 ARG A 25 17.920 26.765 7.691 1.00 0.00 H new ATOM 0 HH12 ARG A 25 19.256 26.690 6.537 1.00 0.00 H new ATOM 0 HH21 ARG A 25 19.326 23.235 6.390 1.00 0.00 H new ATOM 0 HH22 ARG A 25 20.024 24.757 5.826 1.00 0.00 H new ATOM 425 N ALA A 26 12.586 23.916 12.788 1.00 0.00 N ATOM 426 CA ALA A 26 11.707 24.586 13.743 1.00 0.00 C ATOM 427 C ALA A 26 12.508 25.556 14.631 1.00 0.00 C ATOM 428 O ALA A 26 13.444 25.156 15.327 1.00 0.00 O ATOM 429 CB ALA A 26 10.981 23.520 14.571 1.00 0.00 C ATOM 0 H ALA A 26 13.354 23.423 13.244 1.00 0.00 H new ATOM 0 HA ALA A 26 10.966 25.185 13.214 1.00 0.00 H new ATOM 0 HB1 ALA A 26 10.320 24.005 15.289 1.00 0.00 H new ATOM 0 HB2 ALA A 26 10.393 22.883 13.910 1.00 0.00 H new ATOM 0 HB3 ALA A 26 11.713 22.912 15.104 1.00 0.00 H new ATOM 435 N GLU A 27 12.147 26.841 14.599 1.00 0.00 N ATOM 436 CA GLU A 27 12.844 27.921 15.313 1.00 0.00 C ATOM 437 C GLU A 27 11.912 29.121 15.549 1.00 0.00 C ATOM 438 O GLU A 27 11.116 29.472 14.676 1.00 0.00 O ATOM 439 CB GLU A 27 14.110 28.321 14.526 1.00 0.00 C ATOM 440 CG GLU A 27 14.924 29.483 15.126 1.00 0.00 C ATOM 441 CD GLU A 27 14.431 30.903 14.754 1.00 0.00 C ATOM 442 OE1 GLU A 27 13.718 31.086 13.734 1.00 0.00 O ATOM 443 OE2 GLU A 27 14.777 31.868 15.481 1.00 0.00 O1- ATOM 0 H GLU A 27 11.343 27.170 14.064 1.00 0.00 H new ATOM 0 HA GLU A 27 13.148 27.564 16.297 1.00 0.00 H new ATOM 0 HB2 GLU A 27 14.759 27.449 14.447 1.00 0.00 H new ATOM 0 HB3 GLU A 27 13.816 28.592 13.512 1.00 0.00 H new ATOM 0 HG2 GLU A 27 14.916 29.387 16.212 1.00 0.00 H new ATOM 0 HG3 GLU A 27 15.961 29.381 14.805 1.00 0.00 H new ATOM 450 N GLY A 28 12.000 29.766 16.715 1.00 0.00 N ATOM 451 CA GLY A 28 11.259 31.004 17.021 1.00 0.00 C ATOM 452 C GLY A 28 9.722 30.880 16.966 1.00 0.00 C ATOM 453 O GLY A 28 9.029 31.884 16.771 1.00 0.00 O ATOM 0 H GLY A 28 12.590 29.446 17.483 1.00 0.00 H new ATOM 0 HA2 GLY A 28 11.545 31.343 18.017 1.00 0.00 H new ATOM 0 HA3 GLY A 28 11.570 31.778 16.319 1.00 0.00 H new ATOM 457 N GLY A 29 9.180 29.662 17.092 1.00 0.00 N ATOM 458 CA GLY A 29 7.749 29.365 16.931 1.00 0.00 C ATOM 459 C GLY A 29 7.263 29.315 15.473 1.00 0.00 C ATOM 460 O GLY A 29 6.080 29.545 15.224 1.00 0.00 O ATOM 0 H GLY A 29 9.736 28.836 17.314 1.00 0.00 H new ATOM 0 HA2 GLY A 29 7.535 28.406 17.404 1.00 0.00 H new ATOM 0 HA3 GLY A 29 7.173 30.120 17.466 1.00 0.00 H new ATOM 464 N ALA A 30 8.151 29.046 14.506 1.00 0.00 N ATOM 465 CA ALA A 30 7.812 28.864 13.090 1.00 0.00 C ATOM 466 C ALA A 30 8.573 27.684 12.458 1.00 0.00 C ATOM 467 O ALA A 30 9.758 27.469 12.742 1.00 0.00 O ATOM 468 CB ALA A 30 8.079 30.180 12.342 1.00 0.00 C ATOM 0 H ALA A 30 9.149 28.947 14.693 1.00 0.00 H new ATOM 0 HA ALA A 30 6.754 28.612 13.010 1.00 0.00 H new ATOM 0 HB1 ALA A 30 7.830 30.056 11.288 1.00 0.00 H new ATOM 0 HB2 ALA A 30 7.464 30.972 12.769 1.00 0.00 H new ATOM 0 HB3 ALA A 30 9.132 30.446 12.438 1.00 0.00 H new ATOM 474 N VAL A 31 7.900 26.937 11.576 1.00 0.00 N ATOM 475 CA VAL A 31 8.491 25.784 10.866 1.00 0.00 C ATOM 476 C VAL A 31 8.762 26.102 9.395 1.00 0.00 C ATOM 477 O VAL A 31 7.933 26.714 8.725 1.00 0.00 O ATOM 478 CB VAL A 31 7.648 24.505 11.036 1.00 0.00 C ATOM 479 CG1 VAL A 31 8.222 23.316 10.249 1.00 0.00 C ATOM 480 CG2 VAL A 31 7.631 24.097 12.511 1.00 0.00 C ATOM 0 H VAL A 31 6.926 27.111 11.330 1.00 0.00 H new ATOM 0 HA VAL A 31 9.456 25.585 11.331 1.00 0.00 H new ATOM 0 HB VAL A 31 6.651 24.736 10.662 1.00 0.00 H new ATOM 0 HG11 VAL A 31 7.592 22.440 10.402 1.00 0.00 H new ATOM 0 HG12 VAL A 31 8.250 23.562 9.187 1.00 0.00 H new ATOM 0 HG13 VAL A 31 9.232 23.102 10.598 1.00 0.00 H new ATOM 0 HG21 VAL A 31 7.035 23.192 12.631 1.00 0.00 H new ATOM 0 HG22 VAL A 31 8.650 23.907 12.848 1.00 0.00 H new ATOM 0 HG23 VAL A 31 7.196 24.900 13.106 1.00 0.00 H new ATOM 490 N ARG A 32 9.922 25.675 8.886 1.00 0.00 N ATOM 491 CA ARG A 32 10.355 25.774 7.483 1.00 0.00 C ATOM 492 C ARG A 32 10.538 24.376 6.886 1.00 0.00 C ATOM 493 O ARG A 32 10.917 23.446 7.603 1.00 0.00 O ATOM 494 CB ARG A 32 11.661 26.576 7.351 1.00 0.00 C ATOM 495 CG ARG A 32 11.587 28.069 7.729 1.00 0.00 C ATOM 496 CD ARG A 32 11.427 28.316 9.237 1.00 0.00 C ATOM 497 NE ARG A 32 11.948 29.634 9.637 1.00 0.00 N ATOM 498 CZ ARG A 32 12.171 30.035 10.873 1.00 0.00 C ATOM 499 NH1 ARG A 32 11.776 29.353 11.902 1.00 0.00 N1+ ATOM 500 NH2 ARG A 32 12.822 31.131 11.117 1.00 0.00 N ATOM 0 H ARG A 32 10.625 25.225 9.472 1.00 0.00 H new ATOM 0 HA ARG A 32 9.577 26.303 6.932 1.00 0.00 H new ATOM 0 HB2 ARG A 32 12.418 26.102 7.976 1.00 0.00 H new ATOM 0 HB3 ARG A 32 12.006 26.501 6.320 1.00 0.00 H new ATOM 0 HG2 ARG A 32 12.492 28.568 7.382 1.00 0.00 H new ATOM 0 HG3 ARG A 32 10.749 28.527 7.204 1.00 0.00 H new ATOM 0 HD2 ARG A 32 10.373 28.245 9.506 1.00 0.00 H new ATOM 0 HD3 ARG A 32 11.950 27.536 9.790 1.00 0.00 H new ATOM 0 HE ARG A 32 12.155 30.297 8.890 1.00 0.00 H new ATOM 0 HH11 ARG A 32 11.275 28.475 11.770 1.00 0.00 H new ATOM 0 HH12 ARG A 32 11.967 29.695 12.844 1.00 0.00 H new ATOM 0 HH21 ARG A 32 13.171 31.699 10.345 1.00 0.00 H new ATOM 0 HH22 ARG A 32 12.984 31.424 12.080 1.00 0.00 H new ATOM 514 N VAL A 33 10.318 24.237 5.576 1.00 0.00 N ATOM 515 CA VAL A 33 10.332 22.954 4.840 1.00 0.00 C ATOM 516 C VAL A 33 11.022 23.122 3.482 1.00 0.00 C ATOM 517 O VAL A 33 10.811 24.130 2.812 1.00 0.00 O ATOM 518 CB VAL A 33 8.904 22.404 4.627 1.00 0.00 C ATOM 519 CG1 VAL A 33 8.910 20.936 4.243 1.00 0.00 C ATOM 520 CG2 VAL A 33 7.964 22.576 5.836 1.00 0.00 C ATOM 0 H VAL A 33 10.118 25.035 4.972 1.00 0.00 H new ATOM 0 HA VAL A 33 10.889 22.239 5.446 1.00 0.00 H new ATOM 0 HB VAL A 33 8.516 23.013 3.811 1.00 0.00 H new ATOM 0 HG11 VAL A 33 7.885 20.592 4.103 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.466 20.805 3.315 1.00 0.00 H new ATOM 0 HG13 VAL A 33 9.383 20.355 5.035 1.00 0.00 H new ATOM 0 HG21 VAL A 33 6.984 22.162 5.597 1.00 0.00 H new ATOM 0 HG22 VAL A 33 8.379 22.052 6.697 1.00 0.00 H new ATOM 0 HG23 VAL A 33 7.863 23.636 6.070 1.00 0.00 H new ATOM 530 N THR A 34 11.797 22.124 3.040 1.00 0.00 N ATOM 531 CA THR A 34 12.486 22.098 1.732 1.00 0.00 C ATOM 532 C THR A 34 12.214 20.784 0.993 1.00 0.00 C ATOM 533 O THR A 34 12.296 19.718 1.605 1.00 0.00 O ATOM 534 CB THR A 34 14.003 22.284 1.915 1.00 0.00 C ATOM 535 OG1 THR A 34 14.288 23.483 2.604 1.00 0.00 O ATOM 536 CG2 THR A 34 14.770 22.353 0.595 1.00 0.00 C ATOM 0 H THR A 34 11.971 21.285 3.594 1.00 0.00 H new ATOM 0 HA THR A 34 12.094 22.922 1.135 1.00 0.00 H new ATOM 0 HB THR A 34 14.323 21.406 2.476 1.00 0.00 H new ATOM 0 HG1 THR A 34 15.258 23.577 2.709 1.00 0.00 H new ATOM 0 HG21 THR A 34 15.833 22.485 0.798 1.00 0.00 H new ATOM 0 HG22 THR A 34 14.619 21.429 0.038 1.00 0.00 H new ATOM 0 HG23 THR A 34 14.406 23.195 0.006 1.00 0.00 H new ATOM 544 N THR A 35 11.915 20.822 -0.310 1.00 0.00 N ATOM 545 CA THR A 35 11.517 19.643 -1.122 1.00 0.00 C ATOM 546 C THR A 35 12.400 19.433 -2.359 1.00 0.00 C ATOM 547 O THR A 35 13.171 20.312 -2.765 1.00 0.00 O ATOM 548 CB THR A 35 10.035 19.717 -1.548 1.00 0.00 C ATOM 549 OG1 THR A 35 9.838 20.738 -2.497 1.00 0.00 O ATOM 550 CG2 THR A 35 9.075 19.955 -0.383 1.00 0.00 C ATOM 0 H THR A 35 11.940 21.687 -0.851 1.00 0.00 H new ATOM 0 HA THR A 35 11.659 18.783 -0.468 1.00 0.00 H new ATOM 0 HB THR A 35 9.810 18.740 -1.975 1.00 0.00 H new ATOM 0 HG1 THR A 35 8.893 20.767 -2.755 1.00 0.00 H new ATOM 0 HG21 THR A 35 8.052 19.996 -0.757 1.00 0.00 H new ATOM 0 HG22 THR A 35 9.166 19.141 0.336 1.00 0.00 H new ATOM 0 HG23 THR A 35 9.321 20.899 0.104 1.00 0.00 H new ATOM 558 N LEU A 36 12.289 18.251 -2.987 1.00 0.00 N ATOM 559 CA LEU A 36 13.082 17.840 -4.157 1.00 0.00 C ATOM 560 C LEU A 36 12.884 18.689 -5.427 1.00 0.00 C ATOM 561 O LEU A 36 13.696 18.603 -6.351 1.00 0.00 O ATOM 562 CB LEU A 36 12.866 16.337 -4.433 1.00 0.00 C ATOM 563 CG LEU A 36 11.625 15.954 -5.272 1.00 0.00 C ATOM 564 CD1 LEU A 36 11.592 14.442 -5.494 1.00 0.00 C ATOM 565 CD2 LEU A 36 10.318 16.376 -4.604 1.00 0.00 C ATOM 0 H LEU A 36 11.627 17.535 -2.687 1.00 0.00 H new ATOM 0 HA LEU A 36 14.122 18.025 -3.888 1.00 0.00 H new ATOM 0 HB2 LEU A 36 13.751 15.954 -4.941 1.00 0.00 H new ATOM 0 HB3 LEU A 36 12.801 15.822 -3.475 1.00 0.00 H new ATOM 0 HG LEU A 36 11.710 16.483 -6.221 1.00 0.00 H new ATOM 0 HD11 LEU A 36 10.715 14.180 -6.086 1.00 0.00 H new ATOM 0 HD12 LEU A 36 12.493 14.132 -6.024 1.00 0.00 H new ATOM 0 HD13 LEU A 36 11.545 13.934 -4.531 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.477 16.084 -5.233 1.00 0.00 H new ATOM 0 HD22 LEU A 36 10.231 15.888 -3.633 1.00 0.00 H new ATOM 0 HD23 LEU A 36 10.311 17.457 -4.468 1.00 0.00 H new ATOM 577 N PHE A 37 11.840 19.522 -5.484 1.00 0.00 N ATOM 578 CA PHE A 37 11.577 20.467 -6.575 1.00 0.00 C ATOM 579 C PHE A 37 12.420 21.760 -6.487 1.00 0.00 C ATOM 580 O PHE A 37 12.217 22.691 -7.268 1.00 0.00 O ATOM 581 CB PHE A 37 10.070 20.786 -6.608 1.00 0.00 C ATOM 582 CG PHE A 37 9.169 19.568 -6.713 1.00 0.00 C ATOM 583 CD1 PHE A 37 9.302 18.691 -7.807 1.00 0.00 C ATOM 584 CD2 PHE A 37 8.208 19.307 -5.720 1.00 0.00 C ATOM 585 CE1 PHE A 37 8.480 17.552 -7.907 1.00 0.00 C ATOM 586 CE2 PHE A 37 7.378 18.166 -5.819 1.00 0.00 C ATOM 587 CZ PHE A 37 7.511 17.296 -6.915 1.00 0.00 C ATOM 0 H PHE A 37 11.133 19.559 -4.750 1.00 0.00 H new ATOM 0 HA PHE A 37 11.880 19.990 -7.507 1.00 0.00 H new ATOM 0 HB2 PHE A 37 9.809 21.338 -5.705 1.00 0.00 H new ATOM 0 HB3 PHE A 37 9.870 21.444 -7.453 1.00 0.00 H new ATOM 0 HD1 PHE A 37 10.037 18.893 -8.572 1.00 0.00 H new ATOM 0 HD2 PHE A 37 8.104 19.979 -4.881 1.00 0.00 H new ATOM 0 HE1 PHE A 37 8.591 16.876 -8.742 1.00 0.00 H new ATOM 0 HE2 PHE A 37 6.643 17.964 -5.054 1.00 0.00 H new ATOM 0 HZ PHE A 37 6.870 16.430 -6.997 1.00 0.00 H new ATOM 597 N ASP A 38 13.357 21.844 -5.535 1.00 0.00 N ATOM 598 CA ASP A 38 14.104 23.047 -5.131 1.00 0.00 C ATOM 599 C ASP A 38 13.186 24.182 -4.618 1.00 0.00 C ATOM 600 O ASP A 38 13.515 25.369 -4.697 1.00 0.00 O ATOM 601 CB ASP A 38 15.107 23.469 -6.227 1.00 0.00 C ATOM 602 CG ASP A 38 16.213 24.426 -5.741 1.00 0.00 C ATOM 603 OD1 ASP A 38 16.759 25.183 -6.583 1.00 0.00 O ATOM 604 OD2 ASP A 38 16.593 24.396 -4.543 1.00 0.00 O1- ATOM 0 H ASP A 38 13.633 21.026 -4.992 1.00 0.00 H new ATOM 0 HA ASP A 38 14.707 22.793 -4.259 1.00 0.00 H new ATOM 0 HB2 ASP A 38 15.573 22.575 -6.640 1.00 0.00 H new ATOM 0 HB3 ASP A 38 14.560 23.948 -7.039 1.00 0.00 H new ATOM 609 N GLU A 39 12.009 23.811 -4.095 1.00 0.00 N ATOM 610 CA GLU A 39 11.051 24.714 -3.437 1.00 0.00 C ATOM 611 C GLU A 39 11.245 24.755 -1.914 1.00 0.00 C ATOM 612 O GLU A 39 11.691 23.789 -1.289 1.00 0.00 O ATOM 613 CB GLU A 39 9.600 24.329 -3.776 1.00 0.00 C ATOM 614 CG GLU A 39 9.269 24.596 -5.249 1.00 0.00 C ATOM 615 CD GLU A 39 7.776 24.412 -5.595 1.00 0.00 C ATOM 616 OE1 GLU A 39 7.020 23.761 -4.831 1.00 0.00 O ATOM 617 OE2 GLU A 39 7.340 24.914 -6.664 1.00 0.00 O1- ATOM 0 H GLU A 39 11.686 22.844 -4.118 1.00 0.00 H new ATOM 0 HA GLU A 39 11.249 25.714 -3.824 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.443 23.274 -3.554 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.917 24.894 -3.142 1.00 0.00 H new ATOM 0 HG2 GLU A 39 9.568 25.614 -5.500 1.00 0.00 H new ATOM 0 HG3 GLU A 39 9.862 23.927 -5.872 1.00 0.00 H new ATOM 624 N GLU A 40 10.851 25.885 -1.327 1.00 0.00 N ATOM 625 CA GLU A 40 10.883 26.144 0.116 1.00 0.00 C ATOM 626 C GLU A 40 9.553 26.722 0.615 1.00 0.00 C ATOM 627 O GLU A 40 8.897 27.513 -0.076 1.00 0.00 O ATOM 628 CB GLU A 40 12.043 27.073 0.493 1.00 0.00 C ATOM 629 CG GLU A 40 13.415 26.432 0.285 1.00 0.00 C ATOM 630 CD GLU A 40 14.579 27.382 0.646 1.00 0.00 C ATOM 631 OE1 GLU A 40 14.458 28.195 1.596 1.00 0.00 O ATOM 632 OE2 GLU A 40 15.635 27.319 -0.029 1.00 0.00 O1- ATOM 0 H GLU A 40 10.487 26.675 -1.861 1.00 0.00 H new ATOM 0 HA GLU A 40 11.041 25.184 0.608 1.00 0.00 H new ATOM 0 HB2 GLU A 40 11.980 27.984 -0.103 1.00 0.00 H new ATOM 0 HB3 GLU A 40 11.940 27.367 1.537 1.00 0.00 H new ATOM 0 HG2 GLU A 40 13.486 25.530 0.893 1.00 0.00 H new ATOM 0 HG3 GLU A 40 13.513 26.123 -0.756 1.00 0.00 H new ATOM 639 N HIS A 41 9.173 26.346 1.838 1.00 0.00 N ATOM 640 CA HIS A 41 7.883 26.658 2.476 1.00 0.00 C ATOM 641 C HIS A 41 8.077 27.067 3.943 1.00 0.00 C ATOM 642 O HIS A 41 9.030 26.620 4.580 1.00 0.00 O ATOM 643 CB HIS A 41 6.932 25.449 2.369 1.00 0.00 C ATOM 644 CG HIS A 41 6.866 24.824 0.993 1.00 0.00 C ATOM 645 ND1 HIS A 41 6.130 25.310 -0.094 1.00 0.00 N ATOM 646 CD2 HIS A 41 7.578 23.736 0.586 1.00 0.00 C ATOM 647 CE1 HIS A 41 6.424 24.506 -1.132 1.00 0.00 C ATOM 648 NE2 HIS A 41 7.294 23.553 -0.749 1.00 0.00 N ATOM 0 H HIS A 41 9.780 25.791 2.441 1.00 0.00 H new ATOM 0 HA HIS A 41 7.436 27.503 1.952 1.00 0.00 H new ATOM 0 HB2 HIS A 41 7.248 24.690 3.085 1.00 0.00 H new ATOM 0 HB3 HIS A 41 5.930 25.764 2.660 1.00 0.00 H new ATOM 0 HD2 HIS A 41 8.238 23.134 1.193 1.00 0.00 H new ATOM 0 HE1 HIS A 41 6.020 24.610 -2.128 1.00 0.00 H new ATOM 0 HE2 HIS A 41 7.678 22.820 -1.346 1.00 0.00 H new ATOM 656 N ALA A 42 7.176 27.891 4.487 1.00 0.00 N ATOM 657 CA ALA A 42 7.248 28.384 5.864 1.00 0.00 C ATOM 658 C ALA A 42 5.854 28.563 6.504 1.00 0.00 C ATOM 659 O ALA A 42 4.906 29.009 5.850 1.00 0.00 O ATOM 660 CB ALA A 42 8.056 29.688 5.896 1.00 0.00 C ATOM 0 H ALA A 42 6.365 28.239 3.975 1.00 0.00 H new ATOM 0 HA ALA A 42 7.756 27.632 6.468 1.00 0.00 H new ATOM 0 HB1 ALA A 42 8.111 30.057 6.920 1.00 0.00 H new ATOM 0 HB2 ALA A 42 9.063 29.501 5.523 1.00 0.00 H new ATOM 0 HB3 ALA A 42 7.569 30.433 5.267 1.00 0.00 H new ATOM 666 N PHE A 43 5.749 28.222 7.788 1.00 0.00 N ATOM 667 CA PHE A 43 4.502 28.116 8.556 1.00 0.00 C ATOM 668 C PHE A 43 4.687 28.650 9.994 1.00 0.00 C ATOM 669 O PHE A 43 5.127 27.911 10.884 1.00 0.00 O ATOM 670 CB PHE A 43 4.024 26.653 8.548 1.00 0.00 C ATOM 671 CG PHE A 43 3.826 26.060 7.162 1.00 0.00 C ATOM 672 CD1 PHE A 43 4.853 25.298 6.569 1.00 0.00 C ATOM 673 CD2 PHE A 43 2.636 26.297 6.446 1.00 0.00 C ATOM 674 CE1 PHE A 43 4.697 24.792 5.268 1.00 0.00 C ATOM 675 CE2 PHE A 43 2.478 25.783 5.146 1.00 0.00 C ATOM 676 CZ PHE A 43 3.510 25.034 4.555 1.00 0.00 C ATOM 0 H PHE A 43 6.570 28.001 8.351 1.00 0.00 H new ATOM 0 HA PHE A 43 3.737 28.735 8.088 1.00 0.00 H new ATOM 0 HB2 PHE A 43 4.749 26.045 9.089 1.00 0.00 H new ATOM 0 HB3 PHE A 43 3.083 26.589 9.094 1.00 0.00 H new ATOM 0 HD1 PHE A 43 5.763 25.103 7.117 1.00 0.00 H new ATOM 0 HD2 PHE A 43 1.843 26.875 6.896 1.00 0.00 H new ATOM 0 HE1 PHE A 43 5.490 24.216 4.815 1.00 0.00 H new ATOM 0 HE2 PHE A 43 1.563 25.964 4.602 1.00 0.00 H new ATOM 0 HZ PHE A 43 3.391 24.645 3.555 1.00 0.00 H new ATOM 686 N PRO A 44 4.370 29.933 10.253 1.00 0.00 N ATOM 687 CA PRO A 44 4.359 30.506 11.600 1.00 0.00 C ATOM 688 C PRO A 44 3.322 29.856 12.534 1.00 0.00 C ATOM 689 O PRO A 44 2.265 29.386 12.099 1.00 0.00 O ATOM 690 CB PRO A 44 4.075 32.001 11.412 1.00 0.00 C ATOM 691 CG PRO A 44 4.518 32.274 9.974 1.00 0.00 C ATOM 692 CD PRO A 44 4.143 30.978 9.266 1.00 0.00 C ATOM 0 HA PRO A 44 5.316 30.325 12.090 1.00 0.00 H new ATOM 0 HB2 PRO A 44 3.019 32.230 11.556 1.00 0.00 H new ATOM 0 HB3 PRO A 44 4.633 32.608 12.125 1.00 0.00 H new ATOM 0 HG2 PRO A 44 4.003 33.134 9.546 1.00 0.00 H new ATOM 0 HG3 PRO A 44 5.587 32.478 9.910 1.00 0.00 H new ATOM 0 HD2 PRO A 44 3.103 30.993 8.939 1.00 0.00 H new ATOM 0 HD3 PRO A 44 4.755 30.822 8.377 1.00 0.00 H new ATOM 700 N GLY A 45 3.611 29.869 13.838 1.00 0.00 N ATOM 701 CA GLY A 45 2.747 29.348 14.905 1.00 0.00 C ATOM 702 C GLY A 45 2.860 27.842 15.153 1.00 0.00 C ATOM 703 O GLY A 45 2.046 27.294 15.899 1.00 0.00 O ATOM 0 H GLY A 45 4.485 30.256 14.194 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.983 29.872 15.831 1.00 0.00 H new ATOM 0 HA3 GLY A 45 1.711 29.584 14.661 1.00 0.00 H new ATOM 707 N LEU A 46 3.837 27.171 14.535 1.00 0.00 N ATOM 708 CA LEU A 46 4.055 25.728 14.619 1.00 0.00 C ATOM 709 C LEU A 46 5.418 25.346 15.222 1.00 0.00 C ATOM 710 O LEU A 46 6.376 26.124 15.215 1.00 0.00 O ATOM 711 CB LEU A 46 3.892 25.084 13.223 1.00 0.00 C ATOM 712 CG LEU A 46 2.518 25.242 12.545 1.00 0.00 C ATOM 713 CD1 LEU A 46 2.527 24.466 11.224 1.00 0.00 C ATOM 714 CD2 LEU A 46 1.367 24.683 13.384 1.00 0.00 C ATOM 0 H LEU A 46 4.522 27.638 13.941 1.00 0.00 H new ATOM 0 HA LEU A 46 3.298 25.341 15.301 1.00 0.00 H new ATOM 0 HB2 LEU A 46 4.648 25.508 12.562 1.00 0.00 H new ATOM 0 HB3 LEU A 46 4.107 24.019 13.312 1.00 0.00 H new ATOM 0 HG LEU A 46 2.358 26.311 12.406 1.00 0.00 H new ATOM 0 HD11 LEU A 46 1.559 24.570 10.734 1.00 0.00 H new ATOM 0 HD12 LEU A 46 3.307 24.863 10.574 1.00 0.00 H new ATOM 0 HD13 LEU A 46 2.722 23.412 11.422 1.00 0.00 H new ATOM 0 HD21 LEU A 46 0.426 24.825 12.852 1.00 0.00 H new ATOM 0 HD22 LEU A 46 1.528 23.619 13.560 1.00 0.00 H new ATOM 0 HD23 LEU A 46 1.326 25.206 14.339 1.00 0.00 H new ATOM 726 N ALA A 47 5.504 24.090 15.661 1.00 0.00 N ATOM 727 CA ALA A 47 6.721 23.360 16.015 1.00 0.00 C ATOM 728 C ALA A 47 6.573 21.877 15.619 1.00 0.00 C ATOM 729 O ALA A 47 5.455 21.385 15.448 1.00 0.00 O ATOM 730 CB ALA A 47 6.980 23.536 17.518 1.00 0.00 C ATOM 0 H ALA A 47 4.669 23.518 15.787 1.00 0.00 H new ATOM 0 HA ALA A 47 7.580 23.754 15.472 1.00 0.00 H new ATOM 0 HB1 ALA A 47 7.885 22.997 17.797 1.00 0.00 H new ATOM 0 HB2 ALA A 47 7.104 24.595 17.744 1.00 0.00 H new ATOM 0 HB3 ALA A 47 6.134 23.142 18.082 1.00 0.00 H new ATOM 736 N ILE A 48 7.681 21.143 15.463 1.00 0.00 N ATOM 737 CA ILE A 48 7.636 19.704 15.146 1.00 0.00 C ATOM 738 C ILE A 48 7.150 18.938 16.390 1.00 0.00 C ATOM 739 O ILE A 48 7.805 18.963 17.434 1.00 0.00 O ATOM 740 CB ILE A 48 8.998 19.192 14.623 1.00 0.00 C ATOM 741 CG1 ILE A 48 9.447 19.920 13.328 1.00 0.00 C ATOM 742 CG2 ILE A 48 8.923 17.677 14.352 1.00 0.00 C ATOM 743 CD1 ILE A 48 10.961 19.847 13.107 1.00 0.00 C ATOM 0 H ILE A 48 8.625 21.520 15.551 1.00 0.00 H new ATOM 0 HA ILE A 48 6.930 19.529 14.334 1.00 0.00 H new ATOM 0 HB ILE A 48 9.736 19.403 15.397 1.00 0.00 H new ATOM 0 HG12 ILE A 48 8.937 19.479 12.472 1.00 0.00 H new ATOM 0 HG13 ILE A 48 9.141 20.965 13.378 1.00 0.00 H new ATOM 0 HG21 ILE A 48 9.887 17.325 13.984 1.00 0.00 H new ATOM 0 HG22 ILE A 48 8.674 17.154 15.275 1.00 0.00 H new ATOM 0 HG23 ILE A 48 8.155 17.479 13.605 1.00 0.00 H new ATOM 0 HD11 ILE A 48 11.220 20.372 12.188 1.00 0.00 H new ATOM 0 HD12 ILE A 48 11.474 20.313 13.948 1.00 0.00 H new ATOM 0 HD13 ILE A 48 11.267 18.804 13.028 1.00 0.00 H new ATOM 755 N GLY A 49 5.997 18.275 16.280 1.00 0.00 N ATOM 756 CA GLY A 49 5.349 17.516 17.356 1.00 0.00 C ATOM 757 C GLY A 49 5.810 16.057 17.453 1.00 0.00 C ATOM 758 O GLY A 49 5.960 15.536 18.555 1.00 0.00 O ATOM 0 H GLY A 49 5.468 18.250 15.408 1.00 0.00 H new ATOM 0 HA2 GLY A 49 5.545 18.012 18.306 1.00 0.00 H new ATOM 0 HA3 GLY A 49 4.270 17.536 17.203 1.00 0.00 H new ATOM 762 N ARG A 50 6.087 15.404 16.312 1.00 0.00 N ATOM 763 CA ARG A 50 6.726 14.076 16.259 1.00 0.00 C ATOM 764 C ARG A 50 7.365 13.796 14.897 1.00 0.00 C ATOM 765 O ARG A 50 6.971 14.381 13.883 1.00 0.00 O ATOM 766 CB ARG A 50 5.736 12.955 16.658 1.00 0.00 C ATOM 767 CG ARG A 50 4.553 12.738 15.702 1.00 0.00 C ATOM 768 CD ARG A 50 3.733 11.520 16.142 1.00 0.00 C ATOM 769 NE ARG A 50 2.848 11.043 15.054 1.00 0.00 N ATOM 770 CZ ARG A 50 2.808 9.820 14.551 1.00 0.00 C ATOM 771 NH1 ARG A 50 3.432 8.813 15.085 1.00 0.00 N1+ ATOM 772 NH2 ARG A 50 2.119 9.577 13.474 1.00 0.00 N ATOM 0 H ARG A 50 5.872 15.786 15.391 1.00 0.00 H new ATOM 0 HA ARG A 50 7.532 14.084 16.993 1.00 0.00 H new ATOM 0 HB2 ARG A 50 6.289 12.019 16.740 1.00 0.00 H new ATOM 0 HB3 ARG A 50 5.342 13.180 17.649 1.00 0.00 H new ATOM 0 HG2 ARG A 50 3.920 13.625 15.688 1.00 0.00 H new ATOM 0 HG3 ARG A 50 4.919 12.591 14.686 1.00 0.00 H new ATOM 0 HD2 ARG A 50 4.405 10.717 16.445 1.00 0.00 H new ATOM 0 HD3 ARG A 50 3.133 11.779 17.014 1.00 0.00 H new ATOM 0 HE ARG A 50 2.205 11.726 14.653 1.00 0.00 H new ATOM 0 HH11 ARG A 50 3.985 8.946 15.932 1.00 0.00 H new ATOM 0 HH12 ARG A 50 3.369 7.889 14.658 1.00 0.00 H new ATOM 0 HH21 ARG A 50 1.608 10.331 13.015 1.00 0.00 H new ATOM 0 HH22 ARG A 50 2.090 8.633 13.089 1.00 0.00 H new ATOM 786 N VAL A 51 8.289 12.835 14.867 1.00 0.00 N ATOM 787 CA VAL A 51 8.765 12.187 13.634 1.00 0.00 C ATOM 788 C VAL A 51 8.676 10.670 13.803 1.00 0.00 C ATOM 789 O VAL A 51 9.238 10.118 14.748 1.00 0.00 O ATOM 790 CB VAL A 51 10.194 12.618 13.241 1.00 0.00 C ATOM 791 CG1 VAL A 51 10.571 12.047 11.870 1.00 0.00 C ATOM 792 CG2 VAL A 51 10.353 14.138 13.210 1.00 0.00 C ATOM 0 H VAL A 51 8.738 12.476 15.710 1.00 0.00 H new ATOM 0 HA VAL A 51 8.122 12.509 12.815 1.00 0.00 H new ATOM 0 HB VAL A 51 10.861 12.221 14.006 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.582 12.362 11.610 1.00 0.00 H new ATOM 0 HG12 VAL A 51 10.528 10.958 11.905 1.00 0.00 H new ATOM 0 HG13 VAL A 51 9.872 12.414 11.118 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.375 14.391 12.928 1.00 0.00 H new ATOM 0 HG22 VAL A 51 9.661 14.561 12.482 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.137 14.547 14.197 1.00 0.00 H new ATOM 802 N ASP A 52 7.967 10.002 12.895 1.00 0.00 N ATOM 803 CA ASP A 52 7.699 8.566 12.917 1.00 0.00 C ATOM 804 C ASP A 52 8.330 7.887 11.694 1.00 0.00 C ATOM 805 O ASP A 52 7.887 8.071 10.555 1.00 0.00 O ATOM 806 CB ASP A 52 6.184 8.340 13.026 1.00 0.00 C ATOM 807 CG ASP A 52 5.806 6.874 13.286 1.00 0.00 C ATOM 808 OD1 ASP A 52 4.697 6.640 13.824 1.00 0.00 O ATOM 809 OD2 ASP A 52 6.618 5.953 13.049 1.00 0.00 O1- ATOM 0 H ASP A 52 7.546 10.466 12.090 1.00 0.00 H new ATOM 0 HA ASP A 52 8.160 8.103 13.789 1.00 0.00 H new ATOM 0 HB2 ASP A 52 5.788 8.958 13.832 1.00 0.00 H new ATOM 0 HB3 ASP A 52 5.707 8.673 12.105 1.00 0.00 H new ATOM 814 N LEU A 53 9.403 7.136 11.929 1.00 0.00 N ATOM 815 CA LEU A 53 10.214 6.496 10.897 1.00 0.00 C ATOM 816 C LEU A 53 9.618 5.161 10.408 1.00 0.00 C ATOM 817 O LEU A 53 10.046 4.626 9.381 1.00 0.00 O ATOM 818 CB LEU A 53 11.663 6.321 11.411 1.00 0.00 C ATOM 819 CG LEU A 53 12.466 7.598 11.737 1.00 0.00 C ATOM 820 CD1 LEU A 53 12.468 8.603 10.583 1.00 0.00 C ATOM 821 CD2 LEU A 53 12.039 8.330 13.015 1.00 0.00 C ATOM 0 H LEU A 53 9.743 6.950 12.873 1.00 0.00 H new ATOM 0 HA LEU A 53 10.221 7.150 10.025 1.00 0.00 H new ATOM 0 HB2 LEU A 53 11.628 5.707 12.311 1.00 0.00 H new ATOM 0 HB3 LEU A 53 12.219 5.757 10.662 1.00 0.00 H new ATOM 0 HG LEU A 53 13.471 7.211 11.903 1.00 0.00 H new ATOM 0 HD11 LEU A 53 13.047 9.482 10.867 1.00 0.00 H new ATOM 0 HD12 LEU A 53 12.914 8.144 9.701 1.00 0.00 H new ATOM 0 HD13 LEU A 53 11.444 8.901 10.358 1.00 0.00 H new ATOM 0 HD21 LEU A 53 12.663 9.212 13.155 1.00 0.00 H new ATOM 0 HD22 LEU A 53 10.996 8.634 12.929 1.00 0.00 H new ATOM 0 HD23 LEU A 53 12.154 7.665 13.871 1.00 0.00 H new ATOM 833 N ARG A 54 8.618 4.617 11.115 1.00 0.00 N ATOM 834 CA ARG A 54 7.879 3.402 10.722 1.00 0.00 C ATOM 835 C ARG A 54 6.951 3.688 9.536 1.00 0.00 C ATOM 836 O ARG A 54 6.864 2.879 8.612 1.00 0.00 O ATOM 837 CB ARG A 54 7.063 2.863 11.919 1.00 0.00 C ATOM 838 CG ARG A 54 7.913 2.561 13.171 1.00 0.00 C ATOM 839 CD ARG A 54 7.044 2.410 14.426 1.00 0.00 C ATOM 840 NE ARG A 54 6.415 3.693 14.801 1.00 0.00 N ATOM 841 CZ ARG A 54 6.044 4.099 16.003 1.00 0.00 C ATOM 842 NH1 ARG A 54 6.279 3.414 17.089 1.00 0.00 N1+ ATOM 843 NH2 ARG A 54 5.426 5.228 16.136 1.00 0.00 N ATOM 0 H ARG A 54 8.291 5.015 11.995 1.00 0.00 H new ATOM 0 HA ARG A 54 8.602 2.646 10.417 1.00 0.00 H new ATOM 0 HB2 ARG A 54 6.296 3.592 12.180 1.00 0.00 H new ATOM 0 HB3 ARG A 54 6.547 1.952 11.614 1.00 0.00 H new ATOM 0 HG2 ARG A 54 8.483 1.646 13.011 1.00 0.00 H new ATOM 0 HG3 ARG A 54 8.635 3.364 13.323 1.00 0.00 H new ATOM 0 HD2 ARG A 54 6.271 1.662 14.248 1.00 0.00 H new ATOM 0 HD3 ARG A 54 7.655 2.047 15.252 1.00 0.00 H new ATOM 0 HE ARG A 54 6.246 4.347 14.037 1.00 0.00 H new ATOM 0 HH11 ARG A 54 6.770 2.522 17.033 1.00 0.00 H new ATOM 0 HH12 ARG A 54 5.972 3.771 17.994 1.00 0.00 H new ATOM 0 HH21 ARG A 54 5.227 5.800 15.315 1.00 0.00 H new ATOM 0 HH22 ARG A 54 5.138 5.546 17.061 1.00 0.00 H new ATOM 857 N SER A 55 6.289 4.846 9.557 1.00 0.00 N ATOM 858 CA SER A 55 5.413 5.357 8.491 1.00 0.00 C ATOM 859 C SER A 55 6.112 6.337 7.527 1.00 0.00 C ATOM 860 O SER A 55 5.675 6.498 6.387 1.00 0.00 O ATOM 861 CB SER A 55 4.190 6.029 9.132 1.00 0.00 C ATOM 862 OG SER A 55 4.584 7.109 9.961 1.00 0.00 O ATOM 0 H SER A 55 6.349 5.484 10.350 1.00 0.00 H new ATOM 0 HA SER A 55 5.116 4.503 7.883 1.00 0.00 H new ATOM 0 HB2 SER A 55 3.518 6.389 8.353 1.00 0.00 H new ATOM 0 HB3 SER A 55 3.634 5.298 9.719 1.00 0.00 H new ATOM 0 HG SER A 55 3.790 7.524 10.358 1.00 0.00 H new ATOM 868 N GLY A 56 7.200 6.984 7.961 1.00 0.00 N ATOM 869 CA GLY A 56 7.926 7.999 7.193 1.00 0.00 C ATOM 870 C GLY A 56 7.243 9.372 7.218 1.00 0.00 C ATOM 871 O GLY A 56 7.147 10.027 6.174 1.00 0.00 O ATOM 0 H GLY A 56 7.609 6.811 8.879 1.00 0.00 H new ATOM 0 HA2 GLY A 56 8.936 8.095 7.591 1.00 0.00 H new ATOM 0 HA3 GLY A 56 8.021 7.666 6.160 1.00 0.00 H new ATOM 875 N VAL A 57 6.731 9.800 8.383 1.00 0.00 N ATOM 876 CA VAL A 57 5.922 11.027 8.545 1.00 0.00 C ATOM 877 C VAL A 57 6.492 11.961 9.619 1.00 0.00 C ATOM 878 O VAL A 57 6.745 11.559 10.758 1.00 0.00 O ATOM 879 CB VAL A 57 4.445 10.681 8.845 1.00 0.00 C ATOM 880 CG1 VAL A 57 3.584 11.937 9.037 1.00 0.00 C ATOM 881 CG2 VAL A 57 3.815 9.864 7.708 1.00 0.00 C ATOM 0 H VAL A 57 6.868 9.295 9.259 1.00 0.00 H new ATOM 0 HA VAL A 57 5.966 11.564 7.597 1.00 0.00 H new ATOM 0 HB VAL A 57 4.463 10.100 9.767 1.00 0.00 H new ATOM 0 HG11 VAL A 57 2.555 11.644 9.245 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.972 12.520 9.873 1.00 0.00 H new ATOM 0 HG13 VAL A 57 3.613 12.540 8.130 1.00 0.00 H new ATOM 0 HG21 VAL A 57 2.777 9.639 7.953 1.00 0.00 H new ATOM 0 HG22 VAL A 57 3.853 10.439 6.783 1.00 0.00 H new ATOM 0 HG23 VAL A 57 4.367 8.933 7.580 1.00 0.00 H new ATOM 891 N ILE A 58 6.644 13.237 9.263 1.00 0.00 N ATOM 892 CA ILE A 58 6.908 14.374 10.160 1.00 0.00 C ATOM 893 C ILE A 58 5.569 15.063 10.454 1.00 0.00 C ATOM 894 O ILE A 58 4.842 15.408 9.522 1.00 0.00 O ATOM 895 CB ILE A 58 7.925 15.330 9.493 1.00 0.00 C ATOM 896 CG1 ILE A 58 9.293 14.624 9.310 1.00 0.00 C ATOM 897 CG2 ILE A 58 8.077 16.645 10.275 1.00 0.00 C ATOM 898 CD1 ILE A 58 10.293 15.395 8.446 1.00 0.00 C ATOM 0 H ILE A 58 6.584 13.526 8.287 1.00 0.00 H new ATOM 0 HA ILE A 58 7.346 14.047 11.103 1.00 0.00 H new ATOM 0 HB ILE A 58 7.537 15.591 8.508 1.00 0.00 H new ATOM 0 HG12 ILE A 58 9.735 14.455 10.292 1.00 0.00 H new ATOM 0 HG13 ILE A 58 9.125 13.644 8.863 1.00 0.00 H new ATOM 0 HG21 ILE A 58 8.800 17.286 9.771 1.00 0.00 H new ATOM 0 HG22 ILE A 58 7.114 17.153 10.324 1.00 0.00 H new ATOM 0 HG23 ILE A 58 8.425 16.429 11.285 1.00 0.00 H new ATOM 0 HD11 ILE A 58 11.221 14.829 8.371 1.00 0.00 H new ATOM 0 HD12 ILE A 58 9.876 15.541 7.450 1.00 0.00 H new ATOM 0 HD13 ILE A 58 10.495 16.365 8.901 1.00 0.00 H new ATOM 910 N SER A 59 5.234 15.282 11.723 1.00 0.00 N ATOM 911 CA SER A 59 3.962 15.894 12.141 1.00 0.00 C ATOM 912 C SER A 59 4.202 17.188 12.911 1.00 0.00 C ATOM 913 O SER A 59 4.991 17.205 13.863 1.00 0.00 O ATOM 914 CB SER A 59 3.163 14.901 12.987 1.00 0.00 C ATOM 915 OG SER A 59 1.885 15.437 13.291 1.00 0.00 O ATOM 0 H SER A 59 5.842 15.039 12.505 1.00 0.00 H new ATOM 0 HA SER A 59 3.387 16.143 11.249 1.00 0.00 H new ATOM 0 HB2 SER A 59 3.052 13.959 12.449 1.00 0.00 H new ATOM 0 HB3 SER A 59 3.702 14.680 13.908 1.00 0.00 H new ATOM 0 HG SER A 59 1.380 14.794 13.831 1.00 0.00 H new ATOM 921 N LEU A 60 3.539 18.276 12.509 1.00 0.00 N ATOM 922 CA LEU A 60 3.631 19.588 13.157 1.00 0.00 C ATOM 923 C LEU A 60 2.424 19.862 14.080 1.00 0.00 C ATOM 924 O LEU A 60 1.293 19.456 13.794 1.00 0.00 O ATOM 925 CB LEU A 60 3.776 20.708 12.108 1.00 0.00 C ATOM 926 CG LEU A 60 4.835 20.477 11.012 1.00 0.00 C ATOM 927 CD1 LEU A 60 4.960 21.733 10.143 1.00 0.00 C ATOM 928 CD2 LEU A 60 6.223 20.150 11.576 1.00 0.00 C ATOM 0 H LEU A 60 2.910 18.269 11.706 1.00 0.00 H new ATOM 0 HA LEU A 60 4.524 19.577 13.782 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.809 20.854 11.626 1.00 0.00 H new ATOM 0 HB3 LEU A 60 4.016 21.636 12.627 1.00 0.00 H new ATOM 0 HG LEU A 60 4.495 19.619 10.432 1.00 0.00 H new ATOM 0 HD11 LEU A 60 5.709 21.567 9.369 1.00 0.00 H new ATOM 0 HD12 LEU A 60 3.999 21.950 9.677 1.00 0.00 H new ATOM 0 HD13 LEU A 60 5.261 22.577 10.764 1.00 0.00 H new ATOM 0 HD21 LEU A 60 6.923 19.998 10.754 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.567 20.976 12.198 1.00 0.00 H new ATOM 0 HD23 LEU A 60 6.167 19.242 12.177 1.00 0.00 H new ATOM 940 N ILE A 61 2.663 20.604 15.166 1.00 0.00 N ATOM 941 CA ILE A 61 1.682 21.005 16.191 1.00 0.00 C ATOM 942 C ILE A 61 1.813 22.500 16.511 1.00 0.00 C ATOM 943 O ILE A 61 2.839 23.117 16.217 1.00 0.00 O ATOM 944 CB ILE A 61 1.796 20.128 17.464 1.00 0.00 C ATOM 945 CG1 ILE A 61 3.196 20.103 18.132 1.00 0.00 C ATOM 946 CG2 ILE A 61 1.372 18.690 17.128 1.00 0.00 C ATOM 947 CD1 ILE A 61 3.502 21.290 19.051 1.00 0.00 C ATOM 0 H ILE A 61 3.596 20.963 15.369 1.00 0.00 H new ATOM 0 HA ILE A 61 0.684 20.840 15.786 1.00 0.00 H new ATOM 0 HB ILE A 61 1.133 20.591 18.195 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.289 19.183 18.710 1.00 0.00 H new ATOM 0 HG13 ILE A 61 3.954 20.065 17.349 1.00 0.00 H new ATOM 0 HG21 ILE A 61 1.451 18.069 18.021 1.00 0.00 H new ATOM 0 HG22 ILE A 61 0.341 18.688 16.774 1.00 0.00 H new ATOM 0 HG23 ILE A 61 2.023 18.291 16.350 1.00 0.00 H new ATOM 0 HD11 ILE A 61 4.503 21.179 19.468 1.00 0.00 H new ATOM 0 HD12 ILE A 61 3.448 22.216 18.479 1.00 0.00 H new ATOM 0 HD13 ILE A 61 2.773 21.321 19.861 1.00 0.00 H new ATOM 959 N GLU A 62 0.783 23.105 17.107 1.00 0.00 N ATOM 960 CA GLU A 62 0.806 24.518 17.504 1.00 0.00 C ATOM 961 C GLU A 62 1.804 24.761 18.646 1.00 0.00 C ATOM 962 O GLU A 62 1.759 24.080 19.673 1.00 0.00 O ATOM 963 CB GLU A 62 -0.595 25.004 17.904 1.00 0.00 C ATOM 964 CG GLU A 62 -1.574 25.009 16.716 1.00 0.00 C ATOM 965 CD GLU A 62 -2.939 25.633 17.078 1.00 0.00 C ATOM 966 OE1 GLU A 62 -3.466 26.451 16.284 1.00 0.00 O ATOM 967 OE2 GLU A 62 -3.511 25.298 18.146 1.00 0.00 O1- ATOM 0 H GLU A 62 -0.092 22.630 17.329 1.00 0.00 H new ATOM 0 HA GLU A 62 1.134 25.094 16.639 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -0.988 24.363 18.693 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -0.524 26.010 18.317 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -1.133 25.564 15.888 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -1.726 23.987 16.370 1.00 0.00 H new ATOM 974 N GLU A 63 2.709 25.732 18.485 1.00 0.00 N ATOM 975 CA GLU A 63 3.837 25.959 19.403 1.00 0.00 C ATOM 976 C GLU A 63 3.425 26.415 20.817 1.00 0.00 C ATOM 977 O GLU A 63 4.116 26.097 21.788 1.00 0.00 O ATOM 978 CB GLU A 63 4.854 26.915 18.754 1.00 0.00 C ATOM 979 CG GLU A 63 4.343 28.326 18.400 1.00 0.00 C ATOM 980 CD GLU A 63 4.386 29.351 19.545 1.00 0.00 C ATOM 981 OE1 GLU A 63 3.427 30.149 19.667 1.00 0.00 O ATOM 982 OE2 GLU A 63 5.377 29.411 20.313 1.00 0.00 O1- ATOM 0 H GLU A 63 2.681 26.391 17.707 1.00 0.00 H new ATOM 0 HA GLU A 63 4.310 24.991 19.566 1.00 0.00 H new ATOM 0 HB2 GLU A 63 5.703 27.019 19.429 1.00 0.00 H new ATOM 0 HB3 GLU A 63 5.227 26.449 17.842 1.00 0.00 H new ATOM 0 HG2 GLU A 63 4.935 28.710 17.569 1.00 0.00 H new ATOM 0 HG3 GLU A 63 3.315 28.244 18.048 1.00 0.00 H new ATOM 989 N GLN A 64 2.278 27.088 20.946 1.00 0.00 N ATOM 990 CA GLN A 64 1.611 27.422 22.213 1.00 0.00 C ATOM 991 C GLN A 64 0.080 27.282 22.070 1.00 0.00 C ATOM 992 O GLN A 64 -0.482 27.603 21.018 1.00 0.00 O ATOM 993 CB GLN A 64 1.986 28.843 22.697 1.00 0.00 C ATOM 994 CG GLN A 64 3.436 28.959 23.185 1.00 0.00 C ATOM 995 CD GLN A 64 3.845 30.405 23.450 1.00 0.00 C ATOM 996 OE1 GLN A 64 3.441 31.025 24.426 1.00 0.00 O ATOM 997 NE2 GLN A 64 4.673 30.991 22.608 1.00 0.00 N ATOM 0 H GLN A 64 1.764 27.432 20.135 1.00 0.00 H new ATOM 0 HA GLN A 64 1.958 26.716 22.967 1.00 0.00 H new ATOM 0 HB2 GLN A 64 1.827 29.550 21.882 1.00 0.00 H new ATOM 0 HB3 GLN A 64 1.314 29.132 23.505 1.00 0.00 H new ATOM 0 HG2 GLN A 64 3.557 28.377 24.098 1.00 0.00 H new ATOM 0 HG3 GLN A 64 4.103 28.526 22.440 1.00 0.00 H new ATOM 0 HE21 GLN A 64 5.015 30.483 21.792 1.00 0.00 H new ATOM 0 HE22 GLN A 64 4.972 31.952 22.772 1.00 0.00 H new ATOM 1006 N ASN A 65 -0.584 26.801 23.125 1.00 0.00 N ATOM 1007 CA ASN A 65 -2.021 26.466 23.128 1.00 0.00 C ATOM 1008 C ASN A 65 -2.723 26.727 24.488 1.00 0.00 C ATOM 1009 O ASN A 65 -3.865 26.295 24.686 1.00 0.00 O ATOM 1010 CB ASN A 65 -2.184 25.006 22.643 1.00 0.00 C ATOM 1011 CG ASN A 65 -1.387 24.002 23.469 1.00 0.00 C ATOM 1012 OD1 ASN A 65 -1.495 23.924 24.686 1.00 0.00 O ATOM 1013 ND2 ASN A 65 -0.543 23.210 22.839 1.00 0.00 N ATOM 0 H ASN A 65 -0.132 26.628 24.023 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.532 27.139 22.440 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.239 24.736 22.675 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -1.870 24.940 21.601 1.00 0.00 H new ATOM 0 HD21 ASN A 65 0.015 22.538 23.365 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -0.448 23.269 21.825 1.00 0.00 H new ATOM 1020 N ARG A 66 -2.056 27.426 25.416 1.00 0.00 N ATOM 1021 CA ARG A 66 -2.506 27.707 26.797 1.00 0.00 C ATOM 1022 C ARG A 66 -1.981 29.049 27.329 1.00 0.00 C ATOM 1023 O ARG A 66 -2.671 29.657 28.180 1.00 0.00 O ATOM 1024 CB ARG A 66 -2.145 26.528 27.728 1.00 0.00 C ATOM 1025 CG ARG A 66 -0.631 26.264 27.860 1.00 0.00 C ATOM 1026 CD ARG A 66 -0.327 25.039 28.736 1.00 0.00 C ATOM 1027 NE ARG A 66 -0.695 25.251 30.149 1.00 0.00 N ATOM 1028 CZ ARG A 66 -0.603 24.369 31.127 1.00 0.00 C ATOM 1029 NH1 ARG A 66 -0.164 23.161 30.928 1.00 0.00 N1+ ATOM 1030 NH2 ARG A 66 -0.961 24.690 32.336 1.00 0.00 N ATOM 1031 OXT ARG A 66 -0.892 29.494 26.890 1.00 0.00 O1- ATOM 0 H ARG A 66 -1.142 27.834 25.220 1.00 0.00 H new ATOM 0 HA ARG A 66 -3.591 27.805 26.778 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -2.556 26.724 28.719 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -2.628 25.625 27.355 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -0.203 26.114 26.869 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -0.147 27.142 28.287 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -0.868 24.176 28.348 1.00 0.00 H new ATOM 0 HD3 ARG A 66 0.736 24.805 28.672 1.00 0.00 H new ATOM 0 HE ARG A 66 -1.057 26.172 30.395 1.00 0.00 H new ATOM 0 HH11 ARG A 66 0.122 22.870 29.993 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -0.106 22.505 31.707 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -1.315 25.627 32.531 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -0.888 24.005 33.088 1.00 0.00 H new TER 1045 ARG A 66 ATOM 1046 N GLY B -3 13.945 -5.505 1.697 1.00 0.00 N ATOM 1047 CA GLY B -3 14.184 -4.184 1.082 1.00 0.00 C ATOM 1048 C GLY B -3 15.666 -3.923 0.824 1.00 0.00 C ATOM 1049 O GLY B -3 16.479 -4.853 0.891 1.00 0.00 O ATOM 0 H1 GLY B -3 13.229 -6.020 1.146 1.00 0.00 H new ATOM 0 H2 GLY B -3 14.831 -6.049 1.707 1.00 0.00 H new ATOM 0 H3 GLY B -3 13.606 -5.378 2.672 1.00 0.00 H new ATOM 0 HA2 GLY B -3 13.637 -4.120 0.141 1.00 0.00 H new ATOM 0 HA3 GLY B -3 13.789 -3.405 1.734 1.00 0.00 H new ATOM 1055 N PRO B -2 16.053 -2.664 0.520 1.00 0.00 N ATOM 1056 CA PRO B -2 17.441 -2.279 0.239 1.00 0.00 C ATOM 1057 C PRO B -2 18.413 -2.535 1.404 1.00 0.00 C ATOM 1058 O PRO B -2 18.050 -2.426 2.576 1.00 0.00 O ATOM 1059 CB PRO B -2 17.395 -0.784 -0.122 1.00 0.00 C ATOM 1060 CG PRO B -2 15.962 -0.583 -0.617 1.00 0.00 C ATOM 1061 CD PRO B -2 15.167 -1.533 0.270 1.00 0.00 C ATOM 0 HA PRO B -2 17.831 -2.895 -0.571 1.00 0.00 H new ATOM 0 HB2 PRO B -2 17.614 -0.155 0.741 1.00 0.00 H new ATOM 0 HB3 PRO B -2 18.125 -0.534 -0.892 1.00 0.00 H new ATOM 0 HG2 PRO B -2 15.634 0.450 -0.501 1.00 0.00 H new ATOM 0 HG3 PRO B -2 15.859 -0.833 -1.673 1.00 0.00 H new ATOM 0 HD2 PRO B -2 14.876 -1.049 1.202 1.00 0.00 H new ATOM 0 HD3 PRO B -2 14.249 -1.854 -0.222 1.00 0.00 H new ATOM 1069 N GLY B -1 19.675 -2.829 1.074 1.00 0.00 N ATOM 1070 CA GLY B -1 20.770 -2.928 2.052 1.00 0.00 C ATOM 1071 C GLY B -1 21.297 -1.563 2.524 1.00 0.00 C ATOM 1072 O GLY B -1 21.882 -1.462 3.605 1.00 0.00 O ATOM 0 H GLY B -1 19.970 -3.007 0.114 1.00 0.00 H new ATOM 0 HA2 GLY B -1 20.424 -3.494 2.917 1.00 0.00 H new ATOM 0 HA3 GLY B -1 21.591 -3.492 1.610 1.00 0.00 H new ATOM 1076 N SER B 0 21.089 -0.508 1.730 1.00 0.00 N ATOM 1077 CA SER B 0 21.448 0.879 2.047 1.00 0.00 C ATOM 1078 C SER B 0 20.472 1.546 3.037 1.00 0.00 C ATOM 1079 O SER B 0 19.257 1.342 2.959 1.00 0.00 O ATOM 1080 CB SER B 0 21.500 1.706 0.754 1.00 0.00 C ATOM 1081 OG SER B 0 20.274 1.618 0.039 1.00 0.00 O ATOM 0 H SER B 0 20.649 -0.599 0.814 1.00 0.00 H new ATOM 0 HA SER B 0 22.425 0.849 2.529 1.00 0.00 H new ATOM 0 HB2 SER B 0 21.710 2.748 0.994 1.00 0.00 H new ATOM 0 HB3 SER B 0 22.317 1.352 0.125 1.00 0.00 H new ATOM 0 HG SER B 0 19.574 2.098 0.529 1.00 0.00 H new ATOM 1087 N MET B 1 21.013 2.422 3.896 1.00 0.00 N ATOM 1088 CA MET B 1 20.306 3.285 4.861 1.00 0.00 C ATOM 1089 C MET B 1 19.506 2.554 5.969 1.00 0.00 C ATOM 1090 O MET B 1 19.312 1.333 5.938 1.00 0.00 O ATOM 1091 CB MET B 1 19.464 4.351 4.130 1.00 0.00 C ATOM 1092 CG MET B 1 20.285 5.142 3.095 1.00 0.00 C ATOM 1093 SD MET B 1 19.451 6.594 2.405 1.00 0.00 S ATOM 1094 CE MET B 1 19.662 7.783 3.759 1.00 0.00 C ATOM 0 H MET B 1 22.023 2.557 3.940 1.00 0.00 H new ATOM 0 HA MET B 1 21.097 3.782 5.422 1.00 0.00 H new ATOM 0 HB2 MET B 1 18.625 3.867 3.630 1.00 0.00 H new ATOM 0 HB3 MET B 1 19.044 5.042 4.861 1.00 0.00 H new ATOM 0 HG2 MET B 1 21.216 5.464 3.561 1.00 0.00 H new ATOM 0 HG3 MET B 1 20.553 4.473 2.277 1.00 0.00 H new ATOM 0 HE1 MET B 1 19.200 8.732 3.486 1.00 0.00 H new ATOM 0 HE2 MET B 1 19.188 7.395 4.661 1.00 0.00 H new ATOM 0 HE3 MET B 1 20.725 7.938 3.945 1.00 0.00 H new ATOM 1104 N CYS B 2 19.091 3.308 6.991 1.00 0.00 N ATOM 1105 CA CYS B 2 18.422 2.818 8.208 1.00 0.00 C ATOM 1106 C CYS B 2 17.579 3.924 8.881 1.00 0.00 C ATOM 1107 O CYS B 2 17.619 5.091 8.482 1.00 0.00 O ATOM 1108 CB CYS B 2 19.491 2.256 9.167 1.00 0.00 C ATOM 1109 SG CYS B 2 20.704 3.528 9.622 1.00 0.00 S ATOM 0 H CYS B 2 19.216 4.320 6.997 1.00 0.00 H new ATOM 0 HA CYS B 2 17.724 2.025 7.940 1.00 0.00 H new ATOM 0 HB2 CYS B 2 19.010 1.871 10.066 1.00 0.00 H new ATOM 0 HB3 CYS B 2 20.001 1.417 8.695 1.00 0.00 H new ATOM 0 HG CYS B 2 21.585 3.018 10.431 1.00 0.00 H new ATOM 1115 N MET B 3 16.808 3.551 9.912 1.00 0.00 N ATOM 1116 CA MET B 3 16.005 4.464 10.736 1.00 0.00 C ATOM 1117 C MET B 3 16.862 5.507 11.485 1.00 0.00 C ATOM 1118 O MET B 3 18.092 5.400 11.547 1.00 0.00 O ATOM 1119 CB MET B 3 15.108 3.668 11.703 1.00 0.00 C ATOM 1120 CG MET B 3 14.117 2.742 10.984 1.00 0.00 C ATOM 1121 SD MET B 3 14.768 1.162 10.353 1.00 0.00 S ATOM 1122 CE MET B 3 15.162 0.315 11.906 1.00 0.00 C ATOM 0 H MET B 3 16.724 2.577 10.204 1.00 0.00 H new ATOM 0 HA MET B 3 15.367 5.032 10.059 1.00 0.00 H new ATOM 0 HB2 MET B 3 15.737 3.073 12.365 1.00 0.00 H new ATOM 0 HB3 MET B 3 14.554 4.365 12.331 1.00 0.00 H new ATOM 0 HG2 MET B 3 13.300 2.521 11.671 1.00 0.00 H new ATOM 0 HG3 MET B 3 13.688 3.291 10.145 1.00 0.00 H new ATOM 0 HE1 MET B 3 15.334 -0.743 11.710 1.00 0.00 H new ATOM 0 HE2 MET B 3 16.060 0.753 12.342 1.00 0.00 H new ATOM 0 HE3 MET B 3 14.330 0.425 12.602 1.00 0.00 H new ATOM 1132 N ALA B 4 16.223 6.556 12.013 1.00 0.00 N ATOM 1133 CA ALA B 4 16.906 7.804 12.358 1.00 0.00 C ATOM 1134 C ALA B 4 17.886 7.702 13.537 1.00 0.00 C ATOM 1135 O ALA B 4 17.806 6.808 14.388 1.00 0.00 O ATOM 1136 CB ALA B 4 15.850 8.891 12.601 1.00 0.00 C ATOM 0 H ALA B 4 15.223 6.563 12.212 1.00 0.00 H new ATOM 0 HA ALA B 4 17.541 8.063 11.511 1.00 0.00 H new ATOM 0 HB1 ALA B 4 16.345 9.827 12.859 1.00 0.00 H new ATOM 0 HB2 ALA B 4 15.257 9.031 11.697 1.00 0.00 H new ATOM 0 HB3 ALA B 4 15.197 8.588 13.420 1.00 0.00 H new ATOM 1142 N LYS B 5 18.784 8.687 13.613 1.00 0.00 N ATOM 1143 CA LYS B 5 19.613 8.984 14.785 1.00 0.00 C ATOM 1144 C LYS B 5 19.317 10.393 15.300 1.00 0.00 C ATOM 1145 O LYS B 5 19.326 11.355 14.526 1.00 0.00 O ATOM 1146 CB LYS B 5 21.110 8.722 14.515 1.00 0.00 C ATOM 1147 CG LYS B 5 21.675 9.307 13.203 1.00 0.00 C ATOM 1148 CD LYS B 5 21.623 8.297 12.042 1.00 0.00 C ATOM 1149 CE LYS B 5 22.016 8.980 10.735 1.00 0.00 C ATOM 1150 NZ LYS B 5 21.957 8.047 9.580 1.00 0.00 N1+ ATOM 0 H LYS B 5 18.960 9.322 12.834 1.00 0.00 H new ATOM 0 HA LYS B 5 19.348 8.294 15.586 1.00 0.00 H new ATOM 0 HB2 LYS B 5 21.685 9.128 15.347 1.00 0.00 H new ATOM 0 HB3 LYS B 5 21.274 7.644 14.509 1.00 0.00 H new ATOM 0 HG2 LYS B 5 21.109 10.198 12.932 1.00 0.00 H new ATOM 0 HG3 LYS B 5 22.707 9.621 13.362 1.00 0.00 H new ATOM 0 HD2 LYS B 5 22.297 7.465 12.243 1.00 0.00 H new ATOM 0 HD3 LYS B 5 20.619 7.881 11.956 1.00 0.00 H new ATOM 0 HE2 LYS B 5 21.351 9.825 10.553 1.00 0.00 H new ATOM 0 HE3 LYS B 5 23.025 9.382 10.825 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 21.691 8.572 8.723 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 22.889 7.607 9.441 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 21.249 7.308 9.766 1.00 0.00 H new ATOM 1164 N VAL B 6 19.024 10.500 16.596 1.00 0.00 N ATOM 1165 CA VAL B 6 18.704 11.754 17.302 1.00 0.00 C ATOM 1166 C VAL B 6 19.932 12.233 18.081 1.00 0.00 C ATOM 1167 O VAL B 6 20.606 11.409 18.705 1.00 0.00 O ATOM 1168 CB VAL B 6 17.485 11.554 18.231 1.00 0.00 C ATOM 1169 CG1 VAL B 6 17.177 12.781 19.101 1.00 0.00 C ATOM 1170 CG2 VAL B 6 16.207 11.238 17.444 1.00 0.00 C ATOM 0 H VAL B 6 19.000 9.688 17.212 1.00 0.00 H new ATOM 0 HA VAL B 6 18.439 12.522 16.576 1.00 0.00 H new ATOM 0 HB VAL B 6 17.770 10.715 18.866 1.00 0.00 H new ATOM 0 HG11 VAL B 6 16.310 12.574 19.729 1.00 0.00 H new ATOM 0 HG12 VAL B 6 18.037 13.005 19.732 1.00 0.00 H new ATOM 0 HG13 VAL B 6 16.964 13.637 18.461 1.00 0.00 H new ATOM 0 HG21 VAL B 6 15.376 11.105 18.137 1.00 0.00 H new ATOM 0 HG22 VAL B 6 15.985 12.061 16.765 1.00 0.00 H new ATOM 0 HG23 VAL B 6 16.350 10.323 16.870 1.00 0.00 H new ATOM 1180 N VAL B 7 20.208 13.543 18.089 1.00 0.00 N ATOM 1181 CA VAL B 7 21.283 14.189 18.875 1.00 0.00 C ATOM 1182 C VAL B 7 20.786 15.399 19.679 1.00 0.00 C ATOM 1183 O VAL B 7 19.898 16.131 19.234 1.00 0.00 O ATOM 1184 CB VAL B 7 22.497 14.530 17.974 1.00 0.00 C ATOM 1185 CG1 VAL B 7 22.187 15.568 16.884 1.00 0.00 C ATOM 1186 CG2 VAL B 7 23.700 15.052 18.773 1.00 0.00 C ATOM 0 H VAL B 7 19.675 14.211 17.532 1.00 0.00 H new ATOM 0 HA VAL B 7 21.620 13.467 19.619 1.00 0.00 H new ATOM 0 HB VAL B 7 22.739 13.577 17.504 1.00 0.00 H new ATOM 0 HG11 VAL B 7 23.084 15.755 16.294 1.00 0.00 H new ATOM 0 HG12 VAL B 7 21.398 15.189 16.234 1.00 0.00 H new ATOM 0 HG13 VAL B 7 21.858 16.497 17.349 1.00 0.00 H new ATOM 0 HG21 VAL B 7 24.521 15.275 18.091 1.00 0.00 H new ATOM 0 HG22 VAL B 7 23.416 15.959 19.307 1.00 0.00 H new ATOM 0 HG23 VAL B 7 24.018 14.294 19.488 1.00 0.00 H new ATOM 1196 N LEU B 8 21.359 15.598 20.870 1.00 0.00 N ATOM 1197 CA LEU B 8 21.065 16.711 21.787 1.00 0.00 C ATOM 1198 C LEU B 8 22.297 17.135 22.602 1.00 0.00 C ATOM 1199 O LEU B 8 23.220 16.343 22.812 1.00 0.00 O ATOM 1200 CB LEU B 8 19.874 16.327 22.689 1.00 0.00 C ATOM 1201 CG LEU B 8 20.162 15.201 23.714 1.00 0.00 C ATOM 1202 CD1 LEU B 8 20.531 15.744 25.105 1.00 0.00 C ATOM 1203 CD2 LEU B 8 18.939 14.301 23.884 1.00 0.00 C ATOM 0 H LEU B 8 22.069 14.965 21.239 1.00 0.00 H new ATOM 0 HA LEU B 8 20.790 17.585 21.197 1.00 0.00 H new ATOM 0 HB2 LEU B 8 19.547 17.215 23.230 1.00 0.00 H new ATOM 0 HB3 LEU B 8 19.043 16.016 22.055 1.00 0.00 H new ATOM 0 HG LEU B 8 21.009 14.644 23.312 1.00 0.00 H new ATOM 0 HD11 LEU B 8 20.722 14.911 25.782 1.00 0.00 H new ATOM 0 HD12 LEU B 8 21.426 16.362 25.029 1.00 0.00 H new ATOM 0 HD13 LEU B 8 19.707 16.344 25.492 1.00 0.00 H new ATOM 0 HD21 LEU B 8 19.162 13.517 24.608 1.00 0.00 H new ATOM 0 HD22 LEU B 8 18.097 14.895 24.240 1.00 0.00 H new ATOM 0 HD23 LEU B 8 18.684 13.848 22.926 1.00 0.00 H new ATOM 1215 N THR B 9 22.282 18.372 23.109 1.00 0.00 N ATOM 1216 CA THR B 9 23.321 18.933 23.995 1.00 0.00 C ATOM 1217 C THR B 9 22.752 19.227 25.383 1.00 0.00 C ATOM 1218 O THR B 9 21.685 19.836 25.513 1.00 0.00 O ATOM 1219 CB THR B 9 23.950 20.198 23.380 1.00 0.00 C ATOM 1220 OG1 THR B 9 24.418 19.945 22.068 1.00 0.00 O ATOM 1221 CG2 THR B 9 25.152 20.705 24.176 1.00 0.00 C ATOM 0 H THR B 9 21.530 19.032 22.913 1.00 0.00 H new ATOM 0 HA THR B 9 24.108 18.187 24.103 1.00 0.00 H new ATOM 0 HB THR B 9 23.157 20.945 23.388 1.00 0.00 H new ATOM 0 HG1 THR B 9 24.811 20.763 21.698 1.00 0.00 H new ATOM 0 HG21 THR B 9 25.555 21.597 23.697 1.00 0.00 H new ATOM 0 HG22 THR B 9 24.840 20.948 25.192 1.00 0.00 H new ATOM 0 HG23 THR B 9 25.920 19.932 24.207 1.00 0.00 H new ATOM 1229 N LYS B 10 23.451 18.779 26.432 1.00 0.00 N ATOM 1230 CA LYS B 10 23.091 18.933 27.855 1.00 0.00 C ATOM 1231 C LYS B 10 23.502 20.297 28.429 1.00 0.00 C ATOM 1232 O LYS B 10 24.408 20.959 27.918 1.00 0.00 O ATOM 1233 CB LYS B 10 23.777 17.826 28.668 1.00 0.00 C ATOM 1234 CG LYS B 10 23.302 16.407 28.322 1.00 0.00 C ATOM 1235 CD LYS B 10 23.925 15.371 29.272 1.00 0.00 C ATOM 1236 CE LYS B 10 25.428 15.184 29.025 1.00 0.00 C ATOM 1237 NZ LYS B 10 26.118 14.644 30.222 1.00 0.00 N1+ ATOM 0 H LYS B 10 24.328 18.273 26.310 1.00 0.00 H new ATOM 0 HA LYS B 10 22.006 18.862 27.924 1.00 0.00 H new ATOM 0 HB2 LYS B 10 24.853 17.886 28.508 1.00 0.00 H new ATOM 0 HB3 LYS B 10 23.602 18.008 29.728 1.00 0.00 H new ATOM 0 HG2 LYS B 10 22.215 16.358 28.386 1.00 0.00 H new ATOM 0 HG3 LYS B 10 23.571 16.170 27.293 1.00 0.00 H new ATOM 0 HD2 LYS B 10 23.765 15.685 30.304 1.00 0.00 H new ATOM 0 HD3 LYS B 10 23.417 14.415 29.147 1.00 0.00 H new ATOM 0 HE2 LYS B 10 25.577 14.508 28.183 1.00 0.00 H new ATOM 0 HE3 LYS B 10 25.873 16.140 28.749 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 27.031 14.233 29.941 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 26.279 15.411 30.905 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 25.528 13.908 30.661 1.00 0.00 H new ATOM 1251 N ALA B 11 22.901 20.672 29.558 1.00 0.00 N ATOM 1252 CA ALA B 11 23.249 21.882 30.310 1.00 0.00 C ATOM 1253 C ALA B 11 24.678 21.855 30.912 1.00 0.00 C ATOM 1254 O ALA B 11 25.262 22.911 31.158 1.00 0.00 O ATOM 1255 CB ALA B 11 22.197 22.063 31.410 1.00 0.00 C ATOM 0 H ALA B 11 22.146 20.136 29.985 1.00 0.00 H new ATOM 0 HA ALA B 11 23.252 22.725 29.620 1.00 0.00 H new ATOM 0 HB1 ALA B 11 22.427 22.957 31.990 1.00 0.00 H new ATOM 0 HB2 ALA B 11 21.211 22.168 30.957 1.00 0.00 H new ATOM 0 HB3 ALA B 11 22.204 21.193 32.067 1.00 0.00 H new ATOM 1261 N ASP B 12 25.257 20.666 31.122 1.00 0.00 N ATOM 1262 CA ASP B 12 26.652 20.485 31.579 1.00 0.00 C ATOM 1263 C ASP B 12 27.707 20.642 30.454 1.00 0.00 C ATOM 1264 O ASP B 12 28.912 20.545 30.711 1.00 0.00 O ATOM 1265 CB ASP B 12 26.786 19.142 32.323 1.00 0.00 C ATOM 1266 CG ASP B 12 26.628 17.875 31.470 1.00 0.00 C ATOM 1267 OD1 ASP B 12 26.438 16.779 32.054 1.00 0.00 O ATOM 1268 OD2 ASP B 12 26.711 17.939 30.222 1.00 0.00 O1- ATOM 0 H ASP B 12 24.766 19.784 30.978 1.00 0.00 H new ATOM 0 HA ASP B 12 26.872 21.298 32.271 1.00 0.00 H new ATOM 0 HB2 ASP B 12 27.764 19.112 32.802 1.00 0.00 H new ATOM 0 HB3 ASP B 12 26.041 19.115 33.118 1.00 0.00 H new ATOM 1273 N GLY B 13 27.273 20.895 29.209 1.00 0.00 N ATOM 1274 CA GLY B 13 28.122 21.073 28.022 1.00 0.00 C ATOM 1275 C GLY B 13 28.467 19.789 27.256 1.00 0.00 C ATOM 1276 O GLY B 13 29.059 19.871 26.174 1.00 0.00 O ATOM 0 H GLY B 13 26.280 20.985 28.994 1.00 0.00 H new ATOM 0 HA2 GLY B 13 27.621 21.759 27.339 1.00 0.00 H new ATOM 0 HA3 GLY B 13 29.051 21.552 28.330 1.00 0.00 H new ATOM 1280 N GLY B 14 28.094 18.612 27.766 1.00 0.00 N ATOM 1281 CA GLY B 14 28.197 17.328 27.059 1.00 0.00 C ATOM 1282 C GLY B 14 27.073 17.110 26.034 1.00 0.00 C ATOM 1283 O GLY B 14 26.093 17.861 25.991 1.00 0.00 O ATOM 0 H GLY B 14 27.703 18.521 28.704 1.00 0.00 H new ATOM 0 HA2 GLY B 14 29.159 17.277 26.550 1.00 0.00 H new ATOM 0 HA3 GLY B 14 28.178 16.517 27.787 1.00 0.00 H new ATOM 1287 N ARG B 15 27.196 16.059 25.216 1.00 0.00 N ATOM 1288 CA ARG B 15 26.196 15.659 24.206 1.00 0.00 C ATOM 1289 C ARG B 15 25.759 14.199 24.355 1.00 0.00 C ATOM 1290 O ARG B 15 26.501 13.372 24.893 1.00 0.00 O ATOM 1291 CB ARG B 15 26.705 15.955 22.782 1.00 0.00 C ATOM 1292 CG ARG B 15 26.984 17.451 22.558 1.00 0.00 C ATOM 1293 CD ARG B 15 27.155 17.809 21.078 1.00 0.00 C ATOM 1294 NE ARG B 15 28.339 17.168 20.478 1.00 0.00 N ATOM 1295 CZ ARG B 15 28.760 17.296 19.230 1.00 0.00 C ATOM 1296 NH1 ARG B 15 28.133 18.038 18.361 1.00 0.00 N1+ ATOM 1297 NH2 ARG B 15 29.832 16.670 18.834 1.00 0.00 N ATOM 0 H ARG B 15 28.011 15.445 25.234 1.00 0.00 H new ATOM 0 HA ARG B 15 25.306 16.263 24.382 1.00 0.00 H new ATOM 0 HB2 ARG B 15 27.617 15.387 22.600 1.00 0.00 H new ATOM 0 HB3 ARG B 15 25.966 15.613 22.057 1.00 0.00 H new ATOM 0 HG2 ARG B 15 26.164 18.035 22.976 1.00 0.00 H new ATOM 0 HG3 ARG B 15 27.886 17.733 23.102 1.00 0.00 H new ATOM 0 HD2 ARG B 15 26.264 17.506 20.528 1.00 0.00 H new ATOM 0 HD3 ARG B 15 27.240 18.891 20.976 1.00 0.00 H new ATOM 0 HE ARG B 15 28.890 16.564 21.087 1.00 0.00 H new ATOM 0 HH11 ARG B 15 27.290 18.542 18.635 1.00 0.00 H new ATOM 0 HH12 ARG B 15 28.485 18.114 17.407 1.00 0.00 H new ATOM 0 HH21 ARG B 15 30.348 16.080 19.486 1.00 0.00 H new ATOM 0 HH22 ARG B 15 30.155 16.770 17.872 1.00 0.00 H new ATOM 1311 N VAL B 16 24.556 13.893 23.873 1.00 0.00 N ATOM 1312 CA VAL B 16 23.911 12.569 23.930 1.00 0.00 C ATOM 1313 C VAL B 16 23.311 12.229 22.558 1.00 0.00 C ATOM 1314 O VAL B 16 22.757 13.101 21.883 1.00 0.00 O ATOM 1315 CB VAL B 16 22.845 12.501 25.049 1.00 0.00 C ATOM 1316 CG1 VAL B 16 22.142 11.136 25.130 1.00 0.00 C ATOM 1317 CG2 VAL B 16 23.443 12.791 26.438 1.00 0.00 C ATOM 0 H VAL B 16 23.972 14.589 23.409 1.00 0.00 H new ATOM 0 HA VAL B 16 24.667 11.824 24.176 1.00 0.00 H new ATOM 0 HB VAL B 16 22.119 13.268 24.778 1.00 0.00 H new ATOM 0 HG11 VAL B 16 21.406 11.153 25.934 1.00 0.00 H new ATOM 0 HG12 VAL B 16 21.641 10.928 24.184 1.00 0.00 H new ATOM 0 HG13 VAL B 16 22.879 10.358 25.329 1.00 0.00 H new ATOM 0 HG21 VAL B 16 22.658 12.732 27.192 1.00 0.00 H new ATOM 0 HG22 VAL B 16 24.217 12.056 26.662 1.00 0.00 H new ATOM 0 HG23 VAL B 16 23.879 13.790 26.445 1.00 0.00 H new ATOM 1327 N GLU B 17 23.412 10.964 22.154 1.00 0.00 N ATOM 1328 CA GLU B 17 22.874 10.434 20.892 1.00 0.00 C ATOM 1329 C GLU B 17 22.083 9.132 21.110 1.00 0.00 C ATOM 1330 O GLU B 17 22.449 8.310 21.960 1.00 0.00 O ATOM 1331 CB GLU B 17 23.999 10.190 19.873 1.00 0.00 C ATOM 1332 CG GLU B 17 24.707 11.467 19.409 1.00 0.00 C ATOM 1333 CD GLU B 17 25.870 11.176 18.439 1.00 0.00 C ATOM 1334 OE1 GLU B 17 26.902 11.892 18.502 1.00 0.00 O ATOM 1335 OE2 GLU B 17 25.776 10.252 17.590 1.00 0.00 O1- ATOM 0 H GLU B 17 23.885 10.252 22.711 1.00 0.00 H new ATOM 0 HA GLU B 17 22.192 11.187 20.498 1.00 0.00 H new ATOM 0 HB2 GLU B 17 24.735 9.518 20.314 1.00 0.00 H new ATOM 0 HB3 GLU B 17 23.584 9.681 19.003 1.00 0.00 H new ATOM 0 HG2 GLU B 17 23.986 12.122 18.921 1.00 0.00 H new ATOM 0 HG3 GLU B 17 25.088 12.004 20.278 1.00 0.00 H new ATOM 1342 N ILE B 18 21.029 8.923 20.317 1.00 0.00 N ATOM 1343 CA ILE B 18 20.208 7.696 20.289 1.00 0.00 C ATOM 1344 C ILE B 18 20.048 7.241 18.833 1.00 0.00 C ATOM 1345 O ILE B 18 19.549 7.997 17.997 1.00 0.00 O ATOM 1346 CB ILE B 18 18.839 7.907 20.994 1.00 0.00 C ATOM 1347 CG1 ILE B 18 18.981 8.370 22.463 1.00 0.00 C ATOM 1348 CG2 ILE B 18 18.032 6.594 20.969 1.00 0.00 C ATOM 1349 CD1 ILE B 18 18.913 9.894 22.638 1.00 0.00 C ATOM 0 H ILE B 18 20.707 9.625 19.651 1.00 0.00 H new ATOM 0 HA ILE B 18 20.712 6.909 20.849 1.00 0.00 H new ATOM 0 HB ILE B 18 18.325 8.695 20.444 1.00 0.00 H new ATOM 0 HG12 ILE B 18 18.193 7.909 23.058 1.00 0.00 H new ATOM 0 HG13 ILE B 18 19.931 8.010 22.858 1.00 0.00 H new ATOM 0 HG21 ILE B 18 17.073 6.747 21.464 1.00 0.00 H new ATOM 0 HG22 ILE B 18 17.862 6.291 19.936 1.00 0.00 H new ATOM 0 HG23 ILE B 18 18.589 5.815 21.489 1.00 0.00 H new ATOM 0 HD11 ILE B 18 19.020 10.144 23.694 1.00 0.00 H new ATOM 0 HD12 ILE B 18 19.718 10.362 22.071 1.00 0.00 H new ATOM 0 HD13 ILE B 18 17.953 10.260 22.274 1.00 0.00 H new ATOM 1361 N GLY B 19 20.488 6.016 18.527 1.00 0.00 N ATOM 1362 CA GLY B 19 20.412 5.397 17.194 1.00 0.00 C ATOM 1363 C GLY B 19 19.216 4.450 17.002 1.00 0.00 C ATOM 1364 O GLY B 19 18.561 4.045 17.968 1.00 0.00 O ATOM 0 H GLY B 19 20.921 5.406 19.221 1.00 0.00 H new ATOM 0 HA2 GLY B 19 20.360 6.185 16.443 1.00 0.00 H new ATOM 0 HA3 GLY B 19 21.332 4.842 17.011 1.00 0.00 H new ATOM 1368 N ASP B 20 18.946 4.082 15.745 1.00 0.00 N ATOM 1369 CA ASP B 20 17.849 3.182 15.321 1.00 0.00 C ATOM 1370 C ASP B 20 16.467 3.608 15.858 1.00 0.00 C ATOM 1371 O ASP B 20 15.661 2.783 16.294 1.00 0.00 O ATOM 1372 CB ASP B 20 18.190 1.701 15.590 1.00 0.00 C ATOM 1373 CG ASP B 20 19.605 1.282 15.155 1.00 0.00 C ATOM 1374 OD1 ASP B 20 20.217 0.439 15.850 1.00 0.00 O ATOM 1375 OD2 ASP B 20 20.103 1.747 14.098 1.00 0.00 O1- ATOM 0 H ASP B 20 19.504 4.412 14.957 1.00 0.00 H new ATOM 0 HA ASP B 20 17.761 3.283 14.239 1.00 0.00 H new ATOM 0 HB2 ASP B 20 18.078 1.504 16.656 1.00 0.00 H new ATOM 0 HB3 ASP B 20 17.464 1.074 15.072 1.00 0.00 H new ATOM 1380 N VAL B 21 16.208 4.920 15.875 1.00 0.00 N ATOM 1381 CA VAL B 21 14.973 5.534 16.376 1.00 0.00 C ATOM 1382 C VAL B 21 13.796 5.219 15.447 1.00 0.00 C ATOM 1383 O VAL B 21 13.786 5.637 14.287 1.00 0.00 O ATOM 1384 CB VAL B 21 15.174 7.051 16.563 1.00 0.00 C ATOM 1385 CG1 VAL B 21 13.876 7.806 16.851 1.00 0.00 C ATOM 1386 CG2 VAL B 21 16.137 7.300 17.737 1.00 0.00 C ATOM 0 H VAL B 21 16.876 5.608 15.528 1.00 0.00 H new ATOM 0 HA VAL B 21 14.733 5.109 17.351 1.00 0.00 H new ATOM 0 HB VAL B 21 15.575 7.424 15.621 1.00 0.00 H new ATOM 0 HG11 VAL B 21 14.092 8.868 16.971 1.00 0.00 H new ATOM 0 HG12 VAL B 21 13.183 7.668 16.021 1.00 0.00 H new ATOM 0 HG13 VAL B 21 13.427 7.421 17.766 1.00 0.00 H new ATOM 0 HG21 VAL B 21 16.279 8.372 17.870 1.00 0.00 H new ATOM 0 HG22 VAL B 21 15.717 6.874 18.648 1.00 0.00 H new ATOM 0 HG23 VAL B 21 17.097 6.830 17.526 1.00 0.00 H new ATOM 1396 N LEU B 22 12.793 4.510 15.969 1.00 0.00 N ATOM 1397 CA LEU B 22 11.514 4.264 15.295 1.00 0.00 C ATOM 1398 C LEU B 22 10.585 5.485 15.374 1.00 0.00 C ATOM 1399 O LEU B 22 9.843 5.759 14.433 1.00 0.00 O ATOM 1400 CB LEU B 22 10.824 3.041 15.920 1.00 0.00 C ATOM 1401 CG LEU B 22 11.585 1.707 15.784 1.00 0.00 C ATOM 1402 CD1 LEU B 22 10.726 0.593 16.387 1.00 0.00 C ATOM 1403 CD2 LEU B 22 11.899 1.337 14.335 1.00 0.00 C ATOM 0 H LEU B 22 12.847 4.081 16.893 1.00 0.00 H new ATOM 0 HA LEU B 22 11.722 4.073 14.242 1.00 0.00 H new ATOM 0 HB2 LEU B 22 10.661 3.240 16.979 1.00 0.00 H new ATOM 0 HB3 LEU B 22 9.841 2.927 15.462 1.00 0.00 H new ATOM 0 HG LEU B 22 12.535 1.824 16.305 1.00 0.00 H new ATOM 0 HD11 LEU B 22 11.250 -0.359 16.299 1.00 0.00 H new ATOM 0 HD12 LEU B 22 10.538 0.808 17.439 1.00 0.00 H new ATOM 0 HD13 LEU B 22 9.777 0.536 15.853 1.00 0.00 H new ATOM 0 HD21 LEU B 22 12.435 0.388 14.310 1.00 0.00 H new ATOM 0 HD22 LEU B 22 10.969 1.244 13.774 1.00 0.00 H new ATOM 0 HD23 LEU B 22 12.517 2.115 13.887 1.00 0.00 H new ATOM 1415 N GLU B 23 10.628 6.223 16.483 1.00 0.00 N ATOM 1416 CA GLU B 23 9.832 7.437 16.696 1.00 0.00 C ATOM 1417 C GLU B 23 10.485 8.390 17.719 1.00 0.00 C ATOM 1418 O GLU B 23 11.039 7.955 18.731 1.00 0.00 O ATOM 1419 CB GLU B 23 8.415 7.039 17.141 1.00 0.00 C ATOM 1420 CG GLU B 23 7.449 8.234 17.223 1.00 0.00 C ATOM 1421 CD GLU B 23 6.038 7.844 17.687 1.00 0.00 C ATOM 1422 OE1 GLU B 23 5.067 8.531 17.303 1.00 0.00 O ATOM 1423 OE2 GLU B 23 5.890 6.852 18.440 1.00 0.00 O1- ATOM 0 H GLU B 23 11.228 5.992 17.275 1.00 0.00 H new ATOM 0 HA GLU B 23 9.781 7.984 15.754 1.00 0.00 H new ATOM 0 HB2 GLU B 23 8.015 6.303 16.443 1.00 0.00 H new ATOM 0 HB3 GLU B 23 8.469 6.556 18.117 1.00 0.00 H new ATOM 0 HG2 GLU B 23 7.857 8.976 17.909 1.00 0.00 H new ATOM 0 HG3 GLU B 23 7.384 8.707 16.243 1.00 0.00 H new ATOM 1430 N VAL B 24 10.369 9.697 17.473 1.00 0.00 N ATOM 1431 CA VAL B 24 10.683 10.782 18.412 1.00 0.00 C ATOM 1432 C VAL B 24 9.459 11.697 18.558 1.00 0.00 C ATOM 1433 O VAL B 24 8.774 11.964 17.569 1.00 0.00 O ATOM 1434 CB VAL B 24 11.959 11.531 17.986 1.00 0.00 C ATOM 1435 CG1 VAL B 24 11.864 12.142 16.589 1.00 0.00 C ATOM 1436 CG2 VAL B 24 12.374 12.627 18.976 1.00 0.00 C ATOM 0 H VAL B 24 10.039 10.046 16.573 1.00 0.00 H new ATOM 0 HA VAL B 24 10.902 10.369 19.397 1.00 0.00 H new ATOM 0 HB VAL B 24 12.725 10.756 17.977 1.00 0.00 H new ATOM 0 HG11 VAL B 24 12.796 12.655 16.352 1.00 0.00 H new ATOM 0 HG12 VAL B 24 11.688 11.353 15.858 1.00 0.00 H new ATOM 0 HG13 VAL B 24 11.040 12.855 16.559 1.00 0.00 H new ATOM 0 HG21 VAL B 24 13.280 13.117 18.618 1.00 0.00 H new ATOM 0 HG22 VAL B 24 11.574 13.362 19.062 1.00 0.00 H new ATOM 0 HG23 VAL B 24 12.564 12.182 19.953 1.00 0.00 H new ATOM 1446 N ARG B 25 9.168 12.157 19.778 1.00 0.00 N ATOM 1447 CA ARG B 25 7.926 12.863 20.163 1.00 0.00 C ATOM 1448 C ARG B 25 8.250 14.066 21.047 1.00 0.00 C ATOM 1449 O ARG B 25 9.121 13.963 21.906 1.00 0.00 O ATOM 1450 CB ARG B 25 6.985 11.889 20.903 1.00 0.00 C ATOM 1451 CG ARG B 25 6.574 10.661 20.062 1.00 0.00 C ATOM 1452 CD ARG B 25 5.756 9.625 20.848 1.00 0.00 C ATOM 1453 NE ARG B 25 6.563 9.004 21.916 1.00 0.00 N ATOM 1454 CZ ARG B 25 7.336 7.933 21.839 1.00 0.00 C ATOM 1455 NH1 ARG B 25 7.393 7.139 20.813 1.00 0.00 N1+ ATOM 1456 NH2 ARG B 25 8.113 7.614 22.829 1.00 0.00 N ATOM 0 H ARG B 25 9.812 12.047 20.561 1.00 0.00 H new ATOM 0 HA ARG B 25 7.428 13.225 19.263 1.00 0.00 H new ATOM 0 HB2 ARG B 25 7.475 11.546 21.814 1.00 0.00 H new ATOM 0 HB3 ARG B 25 6.087 12.427 21.207 1.00 0.00 H new ATOM 0 HG2 ARG B 25 5.992 10.997 19.204 1.00 0.00 H new ATOM 0 HG3 ARG B 25 7.471 10.182 19.670 1.00 0.00 H new ATOM 0 HD2 ARG B 25 4.880 10.105 21.284 1.00 0.00 H new ATOM 0 HD3 ARG B 25 5.393 8.854 20.169 1.00 0.00 H new ATOM 0 HE ARG B 25 6.519 9.458 22.829 1.00 0.00 H new ATOM 0 HH11 ARG B 25 6.816 7.324 19.993 1.00 0.00 H new ATOM 0 HH12 ARG B 25 8.015 6.331 20.828 1.00 0.00 H new ATOM 0 HH21 ARG B 25 8.129 8.190 23.671 1.00 0.00 H new ATOM 0 HH22 ARG B 25 8.707 6.787 22.765 1.00 0.00 H new ATOM 1470 N ALA B 26 7.538 15.175 20.876 1.00 0.00 N ATOM 1471 CA ALA B 26 7.741 16.429 21.600 1.00 0.00 C ATOM 1472 C ALA B 26 6.411 16.964 22.143 1.00 0.00 C ATOM 1473 O ALA B 26 5.457 17.181 21.392 1.00 0.00 O ATOM 1474 CB ALA B 26 8.414 17.440 20.663 1.00 0.00 C ATOM 0 H ALA B 26 6.773 15.229 20.203 1.00 0.00 H new ATOM 0 HA ALA B 26 8.390 16.257 22.459 1.00 0.00 H new ATOM 0 HB1 ALA B 26 8.570 18.379 21.193 1.00 0.00 H new ATOM 0 HB2 ALA B 26 9.375 17.046 20.332 1.00 0.00 H new ATOM 0 HB3 ALA B 26 7.776 17.614 19.797 1.00 0.00 H new ATOM 1480 N GLU B 27 6.336 17.173 23.458 1.00 0.00 N ATOM 1481 CA GLU B 27 5.099 17.547 24.159 1.00 0.00 C ATOM 1482 C GLU B 27 5.385 18.133 25.553 1.00 0.00 C ATOM 1483 O GLU B 27 6.302 17.686 26.245 1.00 0.00 O ATOM 1484 CB GLU B 27 4.192 16.299 24.258 1.00 0.00 C ATOM 1485 CG GLU B 27 2.839 16.482 24.963 1.00 0.00 C ATOM 1486 CD GLU B 27 1.924 17.518 24.280 1.00 0.00 C ATOM 1487 OE1 GLU B 27 0.909 17.124 23.655 1.00 0.00 O ATOM 1488 OE2 GLU B 27 2.197 18.740 24.384 1.00 0.00 O1- ATOM 0 H GLU B 27 7.142 17.087 24.078 1.00 0.00 H new ATOM 0 HA GLU B 27 4.593 18.329 23.593 1.00 0.00 H new ATOM 0 HB2 GLU B 27 4.003 15.935 23.248 1.00 0.00 H new ATOM 0 HB3 GLU B 27 4.744 15.518 24.780 1.00 0.00 H new ATOM 0 HG2 GLU B 27 2.324 15.522 24.998 1.00 0.00 H new ATOM 0 HG3 GLU B 27 3.014 16.788 25.994 1.00 0.00 H new ATOM 1495 N GLY B 28 4.605 19.126 25.981 1.00 0.00 N ATOM 1496 CA GLY B 28 4.690 19.722 27.326 1.00 0.00 C ATOM 1497 C GLY B 28 6.045 20.381 27.665 1.00 0.00 C ATOM 1498 O GLY B 28 6.384 20.513 28.845 1.00 0.00 O ATOM 0 H GLY B 28 3.883 19.550 25.398 1.00 0.00 H new ATOM 0 HA2 GLY B 28 3.904 20.471 27.425 1.00 0.00 H new ATOM 0 HA3 GLY B 28 4.486 18.946 28.064 1.00 0.00 H new ATOM 1502 N GLY B 29 6.839 20.763 26.653 1.00 0.00 N ATOM 1503 CA GLY B 29 8.204 21.288 26.816 1.00 0.00 C ATOM 1504 C GLY B 29 9.273 20.216 27.081 1.00 0.00 C ATOM 1505 O GLY B 29 10.291 20.510 27.709 1.00 0.00 O ATOM 0 H GLY B 29 6.544 20.715 25.678 1.00 0.00 H new ATOM 0 HA2 GLY B 29 8.477 21.840 25.917 1.00 0.00 H new ATOM 0 HA3 GLY B 29 8.209 22.000 27.641 1.00 0.00 H new ATOM 1509 N ALA B 30 9.052 18.971 26.643 1.00 0.00 N ATOM 1510 CA ALA B 30 9.993 17.855 26.763 1.00 0.00 C ATOM 1511 C ALA B 30 9.952 16.928 25.531 1.00 0.00 C ATOM 1512 O ALA B 30 8.943 16.867 24.819 1.00 0.00 O ATOM 1513 CB ALA B 30 9.677 17.092 28.058 1.00 0.00 C ATOM 0 H ALA B 30 8.183 18.705 26.180 1.00 0.00 H new ATOM 0 HA ALA B 30 11.010 18.245 26.807 1.00 0.00 H new ATOM 0 HB1 ALA B 30 10.368 16.256 28.166 1.00 0.00 H new ATOM 0 HB2 ALA B 30 9.783 17.763 28.911 1.00 0.00 H new ATOM 0 HB3 ALA B 30 8.655 16.715 28.018 1.00 0.00 H new ATOM 1519 N VAL B 31 11.032 16.175 25.296 1.00 0.00 N ATOM 1520 CA VAL B 31 11.143 15.191 24.195 1.00 0.00 C ATOM 1521 C VAL B 31 11.295 13.760 24.712 1.00 0.00 C ATOM 1522 O VAL B 31 11.918 13.533 25.748 1.00 0.00 O ATOM 1523 CB VAL B 31 12.277 15.573 23.218 1.00 0.00 C ATOM 1524 CG1 VAL B 31 12.588 14.499 22.165 1.00 0.00 C ATOM 1525 CG2 VAL B 31 11.883 16.836 22.447 1.00 0.00 C ATOM 0 H VAL B 31 11.873 16.227 25.872 1.00 0.00 H new ATOM 0 HA VAL B 31 10.205 15.221 23.640 1.00 0.00 H new ATOM 0 HB VAL B 31 13.161 15.709 23.841 1.00 0.00 H new ATOM 0 HG11 VAL B 31 13.395 14.845 21.519 1.00 0.00 H new ATOM 0 HG12 VAL B 31 12.892 13.578 22.663 1.00 0.00 H new ATOM 0 HG13 VAL B 31 11.698 14.310 21.564 1.00 0.00 H new ATOM 0 HG21 VAL B 31 12.683 17.106 21.758 1.00 0.00 H new ATOM 0 HG22 VAL B 31 10.968 16.649 21.885 1.00 0.00 H new ATOM 0 HG23 VAL B 31 11.717 17.654 23.148 1.00 0.00 H new ATOM 1535 N ARG B 32 10.746 12.787 23.975 1.00 0.00 N ATOM 1536 CA ARG B 32 10.922 11.338 24.178 1.00 0.00 C ATOM 1537 C ARG B 32 11.309 10.632 22.870 1.00 0.00 C ATOM 1538 O ARG B 32 10.917 11.081 21.794 1.00 0.00 O ATOM 1539 CB ARG B 32 9.673 10.676 24.796 1.00 0.00 C ATOM 1540 CG ARG B 32 9.179 11.278 26.123 1.00 0.00 C ATOM 1541 CD ARG B 32 8.158 12.402 25.896 1.00 0.00 C ATOM 1542 NE ARG B 32 7.672 12.957 27.173 1.00 0.00 N ATOM 1543 CZ ARG B 32 7.160 14.157 27.353 1.00 0.00 C ATOM 1544 NH1 ARG B 32 7.077 15.005 26.372 1.00 0.00 N1+ ATOM 1545 NH2 ARG B 32 6.719 14.530 28.518 1.00 0.00 N ATOM 0 H ARG B 32 10.138 12.995 23.183 1.00 0.00 H new ATOM 0 HA ARG B 32 11.740 11.224 24.889 1.00 0.00 H new ATOM 0 HB2 ARG B 32 8.861 10.730 24.071 1.00 0.00 H new ATOM 0 HB3 ARG B 32 9.888 9.619 24.957 1.00 0.00 H new ATOM 0 HG2 ARG B 32 8.727 10.494 26.731 1.00 0.00 H new ATOM 0 HG3 ARG B 32 10.029 11.667 26.684 1.00 0.00 H new ATOM 0 HD2 ARG B 32 8.614 13.195 25.304 1.00 0.00 H new ATOM 0 HD3 ARG B 32 7.315 12.019 25.321 1.00 0.00 H new ATOM 0 HE ARG B 32 7.739 12.355 27.994 1.00 0.00 H new ATOM 0 HH11 ARG B 32 7.411 14.746 25.444 1.00 0.00 H new ATOM 0 HH12 ARG B 32 6.677 15.930 26.530 1.00 0.00 H new ATOM 0 HH21 ARG B 32 6.767 13.889 29.310 1.00 0.00 H new ATOM 0 HH22 ARG B 32 6.326 15.463 28.640 1.00 0.00 H new ATOM 1559 N VAL B 33 12.013 9.508 22.970 1.00 0.00 N ATOM 1560 CA VAL B 33 12.420 8.641 21.844 1.00 0.00 C ATOM 1561 C VAL B 33 12.073 7.173 22.110 1.00 0.00 C ATOM 1562 O VAL B 33 12.044 6.736 23.261 1.00 0.00 O ATOM 1563 CB VAL B 33 13.926 8.773 21.523 1.00 0.00 C ATOM 1564 CG1 VAL B 33 14.274 10.135 20.927 1.00 0.00 C ATOM 1565 CG2 VAL B 33 14.831 8.526 22.736 1.00 0.00 C ATOM 0 H VAL B 33 12.334 9.153 23.871 1.00 0.00 H new ATOM 0 HA VAL B 33 11.856 8.983 20.976 1.00 0.00 H new ATOM 0 HB VAL B 33 14.115 7.992 20.787 1.00 0.00 H new ATOM 0 HG11 VAL B 33 15.343 10.179 20.719 1.00 0.00 H new ATOM 0 HG12 VAL B 33 13.718 10.280 20.001 1.00 0.00 H new ATOM 0 HG13 VAL B 33 14.010 10.920 21.635 1.00 0.00 H new ATOM 0 HG21 VAL B 33 15.874 8.635 22.440 1.00 0.00 H new ATOM 0 HG22 VAL B 33 14.598 9.250 23.517 1.00 0.00 H new ATOM 0 HG23 VAL B 33 14.665 7.518 23.115 1.00 0.00 H new ATOM 1575 N THR B 34 11.861 6.407 21.035 1.00 0.00 N ATOM 1576 CA THR B 34 11.659 4.949 21.057 1.00 0.00 C ATOM 1577 C THR B 34 12.546 4.278 20.003 1.00 0.00 C ATOM 1578 O THR B 34 12.514 4.654 18.830 1.00 0.00 O ATOM 1579 CB THR B 34 10.186 4.576 20.832 1.00 0.00 C ATOM 1580 OG1 THR B 34 9.352 5.184 21.798 1.00 0.00 O ATOM 1581 CG2 THR B 34 9.939 3.066 20.925 1.00 0.00 C ATOM 0 H THR B 34 11.823 6.795 20.092 1.00 0.00 H new ATOM 0 HA THR B 34 11.942 4.588 22.046 1.00 0.00 H new ATOM 0 HB THR B 34 9.952 4.928 19.827 1.00 0.00 H new ATOM 0 HG1 THR B 34 8.499 4.704 21.842 1.00 0.00 H new ATOM 0 HG21 THR B 34 8.882 2.859 20.758 1.00 0.00 H new ATOM 0 HG22 THR B 34 10.533 2.553 20.169 1.00 0.00 H new ATOM 0 HG23 THR B 34 10.226 2.711 21.915 1.00 0.00 H new ATOM 1589 N THR B 35 13.354 3.291 20.408 1.00 0.00 N ATOM 1590 CA THR B 35 14.316 2.595 19.533 1.00 0.00 C ATOM 1591 C THR B 35 13.763 1.299 18.922 1.00 0.00 C ATOM 1592 O THR B 35 12.725 0.774 19.331 1.00 0.00 O ATOM 1593 CB THR B 35 15.638 2.280 20.259 1.00 0.00 C ATOM 1594 OG1 THR B 35 15.454 1.206 21.156 1.00 0.00 O ATOM 1595 CG2 THR B 35 16.204 3.485 21.017 1.00 0.00 C ATOM 0 H THR B 35 13.361 2.945 21.368 1.00 0.00 H new ATOM 0 HA THR B 35 14.504 3.297 18.721 1.00 0.00 H new ATOM 0 HB THR B 35 16.361 2.011 19.489 1.00 0.00 H new ATOM 0 HG1 THR B 35 16.325 0.907 21.492 1.00 0.00 H new ATOM 0 HG21 THR B 35 17.135 3.202 21.508 1.00 0.00 H new ATOM 0 HG22 THR B 35 16.396 4.298 20.317 1.00 0.00 H new ATOM 0 HG23 THR B 35 15.484 3.814 21.767 1.00 0.00 H new ATOM 1603 N LEU B 36 14.520 0.745 17.969 1.00 0.00 N ATOM 1604 CA LEU B 36 14.359 -0.586 17.369 1.00 0.00 C ATOM 1605 C LEU B 36 14.219 -1.728 18.398 1.00 0.00 C ATOM 1606 O LEU B 36 13.551 -2.732 18.135 1.00 0.00 O ATOM 1607 CB LEU B 36 15.604 -0.790 16.489 1.00 0.00 C ATOM 1608 CG LEU B 36 15.700 -2.134 15.748 1.00 0.00 C ATOM 1609 CD1 LEU B 36 14.584 -2.264 14.716 1.00 0.00 C ATOM 1610 CD2 LEU B 36 17.040 -2.213 15.014 1.00 0.00 C ATOM 0 H LEU B 36 15.313 1.246 17.569 1.00 0.00 H new ATOM 0 HA LEU B 36 13.428 -0.624 16.804 1.00 0.00 H new ATOM 0 HB2 LEU B 36 15.636 0.011 15.751 1.00 0.00 H new ATOM 0 HB3 LEU B 36 16.489 -0.681 17.117 1.00 0.00 H new ATOM 0 HG LEU B 36 15.611 -2.936 16.481 1.00 0.00 H new ATOM 0 HD11 LEU B 36 14.672 -3.222 14.204 1.00 0.00 H new ATOM 0 HD12 LEU B 36 13.617 -2.207 15.216 1.00 0.00 H new ATOM 0 HD13 LEU B 36 14.665 -1.456 13.989 1.00 0.00 H new ATOM 0 HD21 LEU B 36 17.111 -3.165 14.488 1.00 0.00 H new ATOM 0 HD22 LEU B 36 17.111 -1.395 14.297 1.00 0.00 H new ATOM 0 HD23 LEU B 36 17.854 -2.135 15.734 1.00 0.00 H new ATOM 1622 N PHE B 37 14.837 -1.571 19.568 1.00 0.00 N ATOM 1623 CA PHE B 37 14.849 -2.548 20.661 1.00 0.00 C ATOM 1624 C PHE B 37 13.718 -2.329 21.687 1.00 0.00 C ATOM 1625 O PHE B 37 13.725 -2.928 22.764 1.00 0.00 O ATOM 1626 CB PHE B 37 16.240 -2.524 21.316 1.00 0.00 C ATOM 1627 CG PHE B 37 17.371 -2.677 20.312 1.00 0.00 C ATOM 1628 CD1 PHE B 37 17.698 -3.949 19.808 1.00 0.00 C ATOM 1629 CD2 PHE B 37 18.055 -1.544 19.833 1.00 0.00 C ATOM 1630 CE1 PHE B 37 18.709 -4.091 18.838 1.00 0.00 C ATOM 1631 CE2 PHE B 37 19.061 -1.684 18.857 1.00 0.00 C ATOM 1632 CZ PHE B 37 19.389 -2.957 18.356 1.00 0.00 C ATOM 0 H PHE B 37 15.364 -0.727 19.791 1.00 0.00 H new ATOM 0 HA PHE B 37 14.653 -3.537 20.246 1.00 0.00 H new ATOM 0 HB2 PHE B 37 16.365 -1.586 21.856 1.00 0.00 H new ATOM 0 HB3 PHE B 37 16.303 -3.326 22.052 1.00 0.00 H new ATOM 0 HD1 PHE B 37 17.171 -4.821 20.167 1.00 0.00 H new ATOM 0 HD2 PHE B 37 17.808 -0.564 20.215 1.00 0.00 H new ATOM 0 HE1 PHE B 37 18.963 -5.072 18.463 1.00 0.00 H new ATOM 0 HE2 PHE B 37 19.582 -0.811 18.492 1.00 0.00 H new ATOM 0 HZ PHE B 37 20.158 -3.063 17.606 1.00 0.00 H new ATOM 1642 N ASP B 38 12.752 -1.458 21.369 1.00 0.00 N ATOM 1643 CA ASP B 38 11.680 -0.974 22.256 1.00 0.00 C ATOM 1644 C ASP B 38 12.181 -0.256 23.530 1.00 0.00 C ATOM 1645 O ASP B 38 11.431 -0.092 24.500 1.00 0.00 O ATOM 1646 CB ASP B 38 10.630 -2.071 22.540 1.00 0.00 C ATOM 1647 CG ASP B 38 10.071 -2.778 21.290 1.00 0.00 C ATOM 1648 OD1 ASP B 38 9.743 -3.986 21.386 1.00 0.00 O ATOM 1649 OD2 ASP B 38 9.882 -2.124 20.236 1.00 0.00 O1- ATOM 0 H ASP B 38 12.692 -1.049 20.437 1.00 0.00 H new ATOM 0 HA ASP B 38 11.170 -0.187 21.700 1.00 0.00 H new ATOM 0 HB2 ASP B 38 11.077 -2.820 23.193 1.00 0.00 H new ATOM 0 HB3 ASP B 38 9.800 -1.625 23.088 1.00 0.00 H new ATOM 1654 N GLU B 39 13.442 0.199 23.550 1.00 0.00 N ATOM 1655 CA GLU B 39 13.989 1.025 24.633 1.00 0.00 C ATOM 1656 C GLU B 39 13.491 2.477 24.509 1.00 0.00 C ATOM 1657 O GLU B 39 13.355 3.009 23.401 1.00 0.00 O ATOM 1658 CB GLU B 39 15.525 0.935 24.638 1.00 0.00 C ATOM 1659 CG GLU B 39 16.176 1.658 25.824 1.00 0.00 C ATOM 1660 CD GLU B 39 17.688 1.391 25.872 1.00 0.00 C ATOM 1661 OE1 GLU B 39 18.114 0.372 26.473 1.00 0.00 O ATOM 1662 OE2 GLU B 39 18.470 2.208 25.325 1.00 0.00 O1- ATOM 0 H GLU B 39 14.115 0.002 22.809 1.00 0.00 H new ATOM 0 HA GLU B 39 13.634 0.647 25.592 1.00 0.00 H new ATOM 0 HB2 GLU B 39 15.820 -0.114 24.656 1.00 0.00 H new ATOM 0 HB3 GLU B 39 15.909 1.358 23.710 1.00 0.00 H new ATOM 0 HG2 GLU B 39 15.995 2.730 25.744 1.00 0.00 H new ATOM 0 HG3 GLU B 39 15.715 1.325 26.754 1.00 0.00 H new ATOM 1669 N GLU B 40 13.233 3.128 25.646 1.00 0.00 N ATOM 1670 CA GLU B 40 12.761 4.515 25.724 1.00 0.00 C ATOM 1671 C GLU B 40 13.703 5.414 26.537 1.00 0.00 C ATOM 1672 O GLU B 40 14.274 4.993 27.551 1.00 0.00 O ATOM 1673 CB GLU B 40 11.340 4.578 26.311 1.00 0.00 C ATOM 1674 CG GLU B 40 10.281 3.940 25.392 1.00 0.00 C ATOM 1675 CD GLU B 40 8.876 3.866 26.038 1.00 0.00 C ATOM 1676 OE1 GLU B 40 8.062 3.012 25.607 1.00 0.00 O ATOM 1677 OE2 GLU B 40 8.552 4.658 26.962 1.00 0.00 O1- ATOM 0 H GLU B 40 13.349 2.695 26.562 1.00 0.00 H new ATOM 0 HA GLU B 40 12.747 4.895 24.702 1.00 0.00 H new ATOM 0 HB2 GLU B 40 11.329 4.071 27.276 1.00 0.00 H new ATOM 0 HB3 GLU B 40 11.074 5.619 26.494 1.00 0.00 H new ATOM 0 HG2 GLU B 40 10.219 4.514 24.467 1.00 0.00 H new ATOM 0 HG3 GLU B 40 10.603 2.934 25.122 1.00 0.00 H new ATOM 1684 N HIS B 41 13.813 6.679 26.117 1.00 0.00 N ATOM 1685 CA HIS B 41 14.513 7.763 26.831 1.00 0.00 C ATOM 1686 C HIS B 41 13.705 9.064 26.764 1.00 0.00 C ATOM 1687 O HIS B 41 12.935 9.266 25.820 1.00 0.00 O ATOM 1688 CB HIS B 41 15.928 7.975 26.267 1.00 0.00 C ATOM 1689 CG HIS B 41 16.849 6.782 26.378 1.00 0.00 C ATOM 1690 ND1 HIS B 41 17.671 6.489 27.471 1.00 0.00 N ATOM 1691 CD2 HIS B 41 17.015 5.809 25.433 1.00 0.00 C ATOM 1692 CE1 HIS B 41 18.309 5.346 27.159 1.00 0.00 C ATOM 1693 NE2 HIS B 41 17.931 4.915 25.946 1.00 0.00 N ATOM 0 H HIS B 41 13.403 6.992 25.237 1.00 0.00 H new ATOM 0 HA HIS B 41 14.608 7.469 27.876 1.00 0.00 H new ATOM 0 HB2 HIS B 41 15.845 8.254 25.217 1.00 0.00 H new ATOM 0 HB3 HIS B 41 16.386 8.817 26.785 1.00 0.00 H new ATOM 0 HD2 HIS B 41 16.525 5.751 24.472 1.00 0.00 H new ATOM 0 HE1 HIS B 41 19.024 4.846 27.795 1.00 0.00 H new ATOM 0 HE2 HIS B 41 18.264 4.070 25.482 1.00 0.00 H new ATOM 1701 N ALA B 42 13.894 9.954 27.742 1.00 0.00 N ATOM 1702 CA ALA B 42 13.168 11.220 27.873 1.00 0.00 C ATOM 1703 C ALA B 42 14.067 12.375 28.359 1.00 0.00 C ATOM 1704 O ALA B 42 14.960 12.173 29.182 1.00 0.00 O ATOM 1705 CB ALA B 42 11.958 11.010 28.793 1.00 0.00 C ATOM 0 H ALA B 42 14.576 9.809 28.486 1.00 0.00 H new ATOM 0 HA ALA B 42 12.821 11.522 26.885 1.00 0.00 H new ATOM 0 HB1 ALA B 42 11.412 11.948 28.896 1.00 0.00 H new ATOM 0 HB2 ALA B 42 11.302 10.253 28.364 1.00 0.00 H new ATOM 0 HB3 ALA B 42 12.300 10.680 29.774 1.00 0.00 H new ATOM 1711 N PHE B 43 13.814 13.586 27.849 1.00 0.00 N ATOM 1712 CA PHE B 43 14.681 14.762 27.972 1.00 0.00 C ATOM 1713 C PHE B 43 13.855 16.049 28.182 1.00 0.00 C ATOM 1714 O PHE B 43 13.357 16.632 27.207 1.00 0.00 O ATOM 1715 CB PHE B 43 15.584 14.855 26.724 1.00 0.00 C ATOM 1716 CG PHE B 43 16.408 13.607 26.467 1.00 0.00 C ATOM 1717 CD1 PHE B 43 15.999 12.674 25.491 1.00 0.00 C ATOM 1718 CD2 PHE B 43 17.563 13.352 27.235 1.00 0.00 C ATOM 1719 CE1 PHE B 43 16.731 11.487 25.303 1.00 0.00 C ATOM 1720 CE2 PHE B 43 18.292 12.168 27.037 1.00 0.00 C ATOM 1721 CZ PHE B 43 17.872 11.232 26.080 1.00 0.00 C ATOM 0 H PHE B 43 12.965 13.780 27.318 1.00 0.00 H new ATOM 0 HA PHE B 43 15.312 14.655 28.854 1.00 0.00 H new ATOM 0 HB2 PHE B 43 14.962 15.054 25.851 1.00 0.00 H new ATOM 0 HB3 PHE B 43 16.256 15.706 26.837 1.00 0.00 H new ATOM 0 HD1 PHE B 43 15.125 12.871 24.888 1.00 0.00 H new ATOM 0 HD2 PHE B 43 17.887 14.068 27.976 1.00 0.00 H new ATOM 0 HE1 PHE B 43 16.414 10.771 24.559 1.00 0.00 H new ATOM 0 HE2 PHE B 43 19.179 11.977 27.623 1.00 0.00 H new ATOM 0 HZ PHE B 43 18.426 10.316 25.941 1.00 0.00 H new ATOM 1731 N PRO B 44 13.673 16.501 29.437 1.00 0.00 N ATOM 1732 CA PRO B 44 12.973 17.743 29.751 1.00 0.00 C ATOM 1733 C PRO B 44 13.689 18.997 29.219 1.00 0.00 C ATOM 1734 O PRO B 44 14.922 19.058 29.142 1.00 0.00 O ATOM 1735 CB PRO B 44 12.834 17.778 31.277 1.00 0.00 C ATOM 1736 CG PRO B 44 12.937 16.310 31.684 1.00 0.00 C ATOM 1737 CD PRO B 44 13.937 15.762 30.667 1.00 0.00 C ATOM 0 HA PRO B 44 12.002 17.758 29.257 1.00 0.00 H new ATOM 0 HB2 PRO B 44 13.620 18.377 31.737 1.00 0.00 H new ATOM 0 HB3 PRO B 44 11.882 18.212 31.582 1.00 0.00 H new ATOM 0 HG2 PRO B 44 13.293 16.195 32.708 1.00 0.00 H new ATOM 0 HG3 PRO B 44 11.974 15.802 31.623 1.00 0.00 H new ATOM 0 HD2 PRO B 44 14.963 15.911 31.004 1.00 0.00 H new ATOM 0 HD3 PRO B 44 13.802 14.690 30.520 1.00 0.00 H new ATOM 1745 N GLY B 45 12.910 20.024 28.875 1.00 0.00 N ATOM 1746 CA GLY B 45 13.390 21.327 28.390 1.00 0.00 C ATOM 1747 C GLY B 45 13.735 21.372 26.892 1.00 0.00 C ATOM 1748 O GLY B 45 14.244 22.387 26.413 1.00 0.00 O ATOM 0 H GLY B 45 11.893 19.974 28.927 1.00 0.00 H new ATOM 0 HA2 GLY B 45 12.627 22.078 28.595 1.00 0.00 H new ATOM 0 HA3 GLY B 45 14.275 21.607 28.961 1.00 0.00 H new ATOM 1752 N LEU B 46 13.473 20.288 26.143 1.00 0.00 N ATOM 1753 CA LEU B 46 13.748 20.173 24.708 1.00 0.00 C ATOM 1754 C LEU B 46 12.483 20.167 23.839 1.00 0.00 C ATOM 1755 O LEU B 46 11.371 19.905 24.306 1.00 0.00 O ATOM 1756 CB LEU B 46 14.605 18.918 24.437 1.00 0.00 C ATOM 1757 CG LEU B 46 15.971 18.844 25.147 1.00 0.00 C ATOM 1758 CD1 LEU B 46 16.748 17.648 24.602 1.00 0.00 C ATOM 1759 CD2 LEU B 46 16.840 20.085 24.914 1.00 0.00 C ATOM 0 H LEU B 46 13.052 19.445 26.534 1.00 0.00 H new ATOM 0 HA LEU B 46 14.301 21.067 24.421 1.00 0.00 H new ATOM 0 HB2 LEU B 46 14.025 18.041 24.725 1.00 0.00 H new ATOM 0 HB3 LEU B 46 14.776 18.849 23.363 1.00 0.00 H new ATOM 0 HG LEU B 46 15.762 18.762 26.214 1.00 0.00 H new ATOM 0 HD11 LEU B 46 17.717 17.587 25.098 1.00 0.00 H new ATOM 0 HD12 LEU B 46 16.186 16.733 24.789 1.00 0.00 H new ATOM 0 HD13 LEU B 46 16.897 17.769 23.529 1.00 0.00 H new ATOM 0 HD21 LEU B 46 17.787 19.970 25.440 1.00 0.00 H new ATOM 0 HD22 LEU B 46 17.030 20.201 23.847 1.00 0.00 H new ATOM 0 HD23 LEU B 46 16.322 20.968 25.289 1.00 0.00 H new ATOM 1771 N ALA B 47 12.689 20.409 22.543 1.00 0.00 N ATOM 1772 CA ALA B 47 11.754 20.212 21.437 1.00 0.00 C ATOM 1773 C ALA B 47 12.521 19.726 20.186 1.00 0.00 C ATOM 1774 O ALA B 47 13.733 19.932 20.079 1.00 0.00 O ATOM 1775 CB ALA B 47 11.000 21.527 21.188 1.00 0.00 C ATOM 0 H ALA B 47 13.583 20.776 22.216 1.00 0.00 H new ATOM 0 HA ALA B 47 11.021 19.443 21.681 1.00 0.00 H new ATOM 0 HB1 ALA B 47 10.298 21.394 20.364 1.00 0.00 H new ATOM 0 HB2 ALA B 47 10.454 21.809 22.088 1.00 0.00 H new ATOM 0 HB3 ALA B 47 11.712 22.312 20.935 1.00 0.00 H new ATOM 1781 N ILE B 48 11.844 19.065 19.239 1.00 0.00 N ATOM 1782 CA ILE B 48 12.470 18.631 17.973 1.00 0.00 C ATOM 1783 C ILE B 48 12.783 19.871 17.116 1.00 0.00 C ATOM 1784 O ILE B 48 11.894 20.675 16.830 1.00 0.00 O ATOM 1785 CB ILE B 48 11.579 17.609 17.224 1.00 0.00 C ATOM 1786 CG1 ILE B 48 11.325 16.321 18.037 1.00 0.00 C ATOM 1787 CG2 ILE B 48 12.222 17.223 15.876 1.00 0.00 C ATOM 1788 CD1 ILE B 48 10.035 15.601 17.619 1.00 0.00 C ATOM 0 H ILE B 48 10.858 18.816 19.321 1.00 0.00 H new ATOM 0 HA ILE B 48 13.405 18.114 18.189 1.00 0.00 H new ATOM 0 HB ILE B 48 10.619 18.101 17.066 1.00 0.00 H new ATOM 0 HG12 ILE B 48 12.171 15.645 17.912 1.00 0.00 H new ATOM 0 HG13 ILE B 48 11.270 16.570 19.097 1.00 0.00 H new ATOM 0 HG21 ILE B 48 11.584 16.504 15.361 1.00 0.00 H new ATOM 0 HG22 ILE B 48 12.336 18.114 15.259 1.00 0.00 H new ATOM 0 HG23 ILE B 48 13.201 16.777 16.054 1.00 0.00 H new ATOM 0 HD11 ILE B 48 9.907 14.703 18.223 1.00 0.00 H new ATOM 0 HD12 ILE B 48 9.183 16.264 17.770 1.00 0.00 H new ATOM 0 HD13 ILE B 48 10.097 15.324 16.567 1.00 0.00 H new ATOM 1800 N GLY B 49 14.055 20.044 16.733 1.00 0.00 N ATOM 1801 CA GLY B 49 14.574 21.278 16.133 1.00 0.00 C ATOM 1802 C GLY B 49 14.849 21.217 14.635 1.00 0.00 C ATOM 1803 O GLY B 49 14.490 22.150 13.911 1.00 0.00 O ATOM 0 H GLY B 49 14.764 19.317 16.834 1.00 0.00 H new ATOM 0 HA2 GLY B 49 13.860 22.080 16.321 1.00 0.00 H new ATOM 0 HA3 GLY B 49 15.499 21.548 16.643 1.00 0.00 H new ATOM 1807 N ARG B 50 15.470 20.141 14.144 1.00 0.00 N ATOM 1808 CA ARG B 50 15.848 19.991 12.731 1.00 0.00 C ATOM 1809 C ARG B 50 15.853 18.526 12.301 1.00 0.00 C ATOM 1810 O ARG B 50 16.242 17.655 13.077 1.00 0.00 O ATOM 1811 CB ARG B 50 17.202 20.692 12.525 1.00 0.00 C ATOM 1812 CG ARG B 50 17.663 20.823 11.066 1.00 0.00 C ATOM 1813 CD ARG B 50 18.651 19.736 10.627 1.00 0.00 C ATOM 1814 NE ARG B 50 19.186 20.040 9.289 1.00 0.00 N ATOM 1815 CZ ARG B 50 20.230 19.496 8.700 1.00 0.00 C ATOM 1816 NH1 ARG B 50 20.958 18.562 9.245 1.00 0.00 N1+ ATOM 1817 NH2 ARG B 50 20.538 19.899 7.507 1.00 0.00 N ATOM 0 H ARG B 50 15.728 19.340 14.720 1.00 0.00 H new ATOM 0 HA ARG B 50 15.108 20.466 12.087 1.00 0.00 H new ATOM 0 HB2 ARG B 50 17.145 21.689 12.961 1.00 0.00 H new ATOM 0 HB3 ARG B 50 17.963 20.144 13.081 1.00 0.00 H new ATOM 0 HG2 ARG B 50 16.789 20.791 10.415 1.00 0.00 H new ATOM 0 HG3 ARG B 50 18.127 21.799 10.928 1.00 0.00 H new ATOM 0 HD2 ARG B 50 19.468 19.666 11.345 1.00 0.00 H new ATOM 0 HD3 ARG B 50 18.153 18.766 10.615 1.00 0.00 H new ATOM 0 HE ARG B 50 18.690 20.755 8.757 1.00 0.00 H new ATOM 0 HH11 ARG B 50 20.729 18.215 10.177 1.00 0.00 H new ATOM 0 HH12 ARG B 50 21.756 18.178 8.740 1.00 0.00 H new ATOM 0 HH21 ARG B 50 19.977 20.618 7.051 1.00 0.00 H new ATOM 0 HH22 ARG B 50 21.341 19.497 7.024 1.00 0.00 H new ATOM 1831 N VAL B 51 15.445 18.263 11.062 1.00 0.00 N ATOM 1832 CA VAL B 51 15.310 16.923 10.477 1.00 0.00 C ATOM 1833 C VAL B 51 15.852 16.945 9.049 1.00 0.00 C ATOM 1834 O VAL B 51 15.457 17.806 8.264 1.00 0.00 O ATOM 1835 CB VAL B 51 13.837 16.464 10.476 1.00 0.00 C ATOM 1836 CG1 VAL B 51 13.693 15.037 9.936 1.00 0.00 C ATOM 1837 CG2 VAL B 51 13.190 16.524 11.864 1.00 0.00 C ATOM 0 H VAL B 51 15.188 19.003 10.409 1.00 0.00 H new ATOM 0 HA VAL B 51 15.880 16.216 11.080 1.00 0.00 H new ATOM 0 HB VAL B 51 13.319 17.166 9.822 1.00 0.00 H new ATOM 0 HG11 VAL B 51 12.642 14.747 9.950 1.00 0.00 H new ATOM 0 HG12 VAL B 51 14.067 14.996 8.913 1.00 0.00 H new ATOM 0 HG13 VAL B 51 14.267 14.352 10.560 1.00 0.00 H new ATOM 0 HG21 VAL B 51 12.155 16.189 11.798 1.00 0.00 H new ATOM 0 HG22 VAL B 51 13.738 15.877 12.549 1.00 0.00 H new ATOM 0 HG23 VAL B 51 13.217 17.549 12.234 1.00 0.00 H new ATOM 1847 N ASP B 52 16.723 15.997 8.700 1.00 0.00 N ATOM 1848 CA ASP B 52 17.321 15.888 7.361 1.00 0.00 C ATOM 1849 C ASP B 52 17.218 14.456 6.809 1.00 0.00 C ATOM 1850 O ASP B 52 17.869 13.518 7.286 1.00 0.00 O ATOM 1851 CB ASP B 52 18.766 16.409 7.413 1.00 0.00 C ATOM 1852 CG ASP B 52 19.417 16.552 6.030 1.00 0.00 C ATOM 1853 OD1 ASP B 52 20.384 17.334 5.904 1.00 0.00 O ATOM 1854 OD2 ASP B 52 18.956 15.948 5.036 1.00 0.00 O1- ATOM 0 H ASP B 52 17.039 15.273 9.345 1.00 0.00 H new ATOM 0 HA ASP B 52 16.762 16.508 6.660 1.00 0.00 H new ATOM 0 HB2 ASP B 52 18.776 17.378 7.912 1.00 0.00 H new ATOM 0 HB3 ASP B 52 19.366 15.731 8.020 1.00 0.00 H new ATOM 1859 N LEU B 53 16.378 14.298 5.782 1.00 0.00 N ATOM 1860 CA LEU B 53 16.001 13.013 5.185 1.00 0.00 C ATOM 1861 C LEU B 53 17.055 12.492 4.188 1.00 0.00 C ATOM 1862 O LEU B 53 17.028 11.313 3.826 1.00 0.00 O ATOM 1863 CB LEU B 53 14.613 13.147 4.517 1.00 0.00 C ATOM 1864 CG LEU B 53 13.406 13.486 5.418 1.00 0.00 C ATOM 1865 CD1 LEU B 53 13.327 12.588 6.657 1.00 0.00 C ATOM 1866 CD2 LEU B 53 13.322 14.947 5.870 1.00 0.00 C ATOM 0 H LEU B 53 15.925 15.090 5.327 1.00 0.00 H new ATOM 0 HA LEU B 53 15.950 12.271 5.982 1.00 0.00 H new ATOM 0 HB2 LEU B 53 14.684 13.918 3.750 1.00 0.00 H new ATOM 0 HB3 LEU B 53 14.396 12.209 4.007 1.00 0.00 H new ATOM 0 HG LEU B 53 12.555 13.299 4.763 1.00 0.00 H new ATOM 0 HD11 LEU B 53 12.460 12.869 7.255 1.00 0.00 H new ATOM 0 HD12 LEU B 53 13.232 11.547 6.347 1.00 0.00 H new ATOM 0 HD13 LEU B 53 14.233 12.708 7.251 1.00 0.00 H new ATOM 0 HD21 LEU B 53 12.441 15.084 6.497 1.00 0.00 H new ATOM 0 HD22 LEU B 53 14.216 15.204 6.438 1.00 0.00 H new ATOM 0 HD23 LEU B 53 13.249 15.595 4.996 1.00 0.00 H new ATOM 1878 N ARG B 54 18.004 13.340 3.765 1.00 0.00 N ATOM 1879 CA ARG B 54 19.151 12.970 2.911 1.00 0.00 C ATOM 1880 C ARG B 54 20.206 12.153 3.670 1.00 0.00 C ATOM 1881 O ARG B 54 20.955 11.391 3.054 1.00 0.00 O ATOM 1882 CB ARG B 54 19.791 14.246 2.323 1.00 0.00 C ATOM 1883 CG ARG B 54 18.808 15.112 1.504 1.00 0.00 C ATOM 1884 CD ARG B 54 19.329 16.534 1.267 1.00 0.00 C ATOM 1885 NE ARG B 54 19.398 17.284 2.533 1.00 0.00 N ATOM 1886 CZ ARG B 54 19.258 18.580 2.725 1.00 0.00 C ATOM 1887 NH1 ARG B 54 18.957 19.423 1.778 1.00 0.00 N1+ ATOM 1888 NH2 ARG B 54 19.429 19.060 3.915 1.00 0.00 N ATOM 0 H ARG B 54 17.998 14.330 4.012 1.00 0.00 H new ATOM 0 HA ARG B 54 18.773 12.337 2.108 1.00 0.00 H new ATOM 0 HB2 ARG B 54 20.199 14.846 3.137 1.00 0.00 H new ATOM 0 HB3 ARG B 54 20.629 13.962 1.686 1.00 0.00 H new ATOM 0 HG2 ARG B 54 18.622 14.633 0.543 1.00 0.00 H new ATOM 0 HG3 ARG B 54 17.852 15.162 2.026 1.00 0.00 H new ATOM 0 HD2 ARG B 54 20.317 16.492 0.810 1.00 0.00 H new ATOM 0 HD3 ARG B 54 18.675 17.054 0.567 1.00 0.00 H new ATOM 0 HE ARG B 54 19.577 16.728 3.369 1.00 0.00 H new ATOM 0 HH11 ARG B 54 18.816 19.090 0.824 1.00 0.00 H new ATOM 0 HH12 ARG B 54 18.862 20.416 1.990 1.00 0.00 H new ATOM 0 HH21 ARG B 54 19.668 18.437 4.687 1.00 0.00 H new ATOM 0 HH22 ARG B 54 19.324 20.061 4.081 1.00 0.00 H new ATOM 1902 N SER B 55 20.246 12.288 4.999 1.00 0.00 N ATOM 1903 CA SER B 55 21.208 11.626 5.899 1.00 0.00 C ATOM 1904 C SER B 55 20.558 10.782 7.005 1.00 0.00 C ATOM 1905 O SER B 55 21.255 9.993 7.642 1.00 0.00 O ATOM 1906 CB SER B 55 22.126 12.682 6.537 1.00 0.00 C ATOM 1907 OG SER B 55 22.799 13.438 5.545 1.00 0.00 O ATOM 0 H SER B 55 19.586 12.883 5.501 1.00 0.00 H new ATOM 0 HA SER B 55 21.775 10.932 5.278 1.00 0.00 H new ATOM 0 HB2 SER B 55 21.537 13.347 7.168 1.00 0.00 H new ATOM 0 HB3 SER B 55 22.855 12.192 7.183 1.00 0.00 H new ATOM 0 HG SER B 55 23.375 14.104 5.976 1.00 0.00 H new ATOM 1913 N GLY B 56 19.248 10.926 7.259 1.00 0.00 N ATOM 1914 CA GLY B 56 18.536 10.221 8.342 1.00 0.00 C ATOM 1915 C GLY B 56 18.853 10.765 9.746 1.00 0.00 C ATOM 1916 O GLY B 56 18.865 10.005 10.720 1.00 0.00 O ATOM 0 H GLY B 56 18.645 11.541 6.713 1.00 0.00 H new ATOM 0 HA2 GLY B 56 17.463 10.294 8.167 1.00 0.00 H new ATOM 0 HA3 GLY B 56 18.793 9.162 8.305 1.00 0.00 H new ATOM 1920 N VAL B 57 19.177 12.055 9.860 1.00 0.00 N ATOM 1921 CA VAL B 57 19.577 12.729 11.111 1.00 0.00 C ATOM 1922 C VAL B 57 18.444 13.609 11.651 1.00 0.00 C ATOM 1923 O VAL B 57 17.787 14.333 10.899 1.00 0.00 O ATOM 1924 CB VAL B 57 20.872 13.541 10.917 1.00 0.00 C ATOM 1925 CG1 VAL B 57 21.279 14.306 12.183 1.00 0.00 C ATOM 1926 CG2 VAL B 57 22.043 12.622 10.543 1.00 0.00 C ATOM 0 H VAL B 57 19.170 12.687 9.059 1.00 0.00 H new ATOM 0 HA VAL B 57 19.780 11.958 11.854 1.00 0.00 H new ATOM 0 HB VAL B 57 20.660 14.250 10.117 1.00 0.00 H new ATOM 0 HG11 VAL B 57 22.197 14.862 11.993 1.00 0.00 H new ATOM 0 HG12 VAL B 57 20.485 15.000 12.460 1.00 0.00 H new ATOM 0 HG13 VAL B 57 21.444 13.600 12.997 1.00 0.00 H new ATOM 0 HG21 VAL B 57 22.946 13.218 10.411 1.00 0.00 H new ATOM 0 HG22 VAL B 57 22.202 11.893 11.338 1.00 0.00 H new ATOM 0 HG23 VAL B 57 21.814 12.101 9.614 1.00 0.00 H new ATOM 1936 N ILE B 58 18.258 13.575 12.971 1.00 0.00 N ATOM 1937 CA ILE B 58 17.361 14.435 13.744 1.00 0.00 C ATOM 1938 C ILE B 58 18.173 15.155 14.830 1.00 0.00 C ATOM 1939 O ILE B 58 19.014 14.552 15.496 1.00 0.00 O ATOM 1940 CB ILE B 58 16.189 13.606 14.321 1.00 0.00 C ATOM 1941 CG1 ILE B 58 15.317 13.028 13.177 1.00 0.00 C ATOM 1942 CG2 ILE B 58 15.355 14.455 15.295 1.00 0.00 C ATOM 1943 CD1 ILE B 58 14.137 12.151 13.615 1.00 0.00 C ATOM 0 H ILE B 58 18.757 12.910 13.562 1.00 0.00 H new ATOM 0 HA ILE B 58 16.915 15.195 13.103 1.00 0.00 H new ATOM 0 HB ILE B 58 16.597 12.766 14.882 1.00 0.00 H new ATOM 0 HG12 ILE B 58 14.929 13.858 12.587 1.00 0.00 H new ATOM 0 HG13 ILE B 58 15.957 12.441 12.519 1.00 0.00 H new ATOM 0 HG21 ILE B 58 14.535 13.855 15.691 1.00 0.00 H new ATOM 0 HG22 ILE B 58 15.987 14.793 16.116 1.00 0.00 H new ATOM 0 HG23 ILE B 58 14.951 15.320 14.769 1.00 0.00 H new ATOM 0 HD11 ILE B 58 13.597 11.801 12.735 1.00 0.00 H new ATOM 0 HD12 ILE B 58 14.509 11.294 14.177 1.00 0.00 H new ATOM 0 HD13 ILE B 58 13.465 12.734 14.245 1.00 0.00 H new ATOM 1955 N SER B 59 17.905 16.445 15.040 1.00 0.00 N ATOM 1956 CA SER B 59 18.550 17.278 16.065 1.00 0.00 C ATOM 1957 C SER B 59 17.518 17.982 16.951 1.00 0.00 C ATOM 1958 O SER B 59 16.544 18.547 16.441 1.00 0.00 O ATOM 1959 CB SER B 59 19.481 18.290 15.385 1.00 0.00 C ATOM 1960 OG SER B 59 20.194 19.047 16.346 1.00 0.00 O ATOM 0 H SER B 59 17.215 16.956 14.489 1.00 0.00 H new ATOM 0 HA SER B 59 19.139 16.635 16.719 1.00 0.00 H new ATOM 0 HB2 SER B 59 20.183 17.766 14.736 1.00 0.00 H new ATOM 0 HB3 SER B 59 18.898 18.957 14.751 1.00 0.00 H new ATOM 0 HG SER B 59 20.782 19.684 15.890 1.00 0.00 H new ATOM 1966 N LEU B 60 17.708 17.933 18.271 1.00 0.00 N ATOM 1967 CA LEU B 60 16.868 18.608 19.267 1.00 0.00 C ATOM 1968 C LEU B 60 17.420 19.991 19.649 1.00 0.00 C ATOM 1969 O LEU B 60 18.628 20.235 19.598 1.00 0.00 O ATOM 1970 CB LEU B 60 16.697 17.724 20.521 1.00 0.00 C ATOM 1971 CG LEU B 60 16.272 16.265 20.278 1.00 0.00 C ATOM 1972 CD1 LEU B 60 16.005 15.579 21.620 1.00 0.00 C ATOM 1973 CD2 LEU B 60 14.998 16.150 19.439 1.00 0.00 C ATOM 0 H LEU B 60 18.474 17.407 18.691 1.00 0.00 H new ATOM 0 HA LEU B 60 15.890 18.766 18.812 1.00 0.00 H new ATOM 0 HB2 LEU B 60 17.641 17.718 21.066 1.00 0.00 H new ATOM 0 HB3 LEU B 60 15.957 18.192 21.170 1.00 0.00 H new ATOM 0 HG LEU B 60 17.089 15.790 19.735 1.00 0.00 H new ATOM 0 HD11 LEU B 60 15.704 14.546 21.447 1.00 0.00 H new ATOM 0 HD12 LEU B 60 16.912 15.596 22.224 1.00 0.00 H new ATOM 0 HD13 LEU B 60 15.209 16.106 22.146 1.00 0.00 H new ATOM 0 HD21 LEU B 60 14.747 15.098 19.301 1.00 0.00 H new ATOM 0 HD22 LEU B 60 14.178 16.654 19.951 1.00 0.00 H new ATOM 0 HD23 LEU B 60 15.159 16.616 18.467 1.00 0.00 H new ATOM 1985 N ILE B 61 16.523 20.885 20.072 1.00 0.00 N ATOM 1986 CA ILE B 61 16.818 22.252 20.548 1.00 0.00 C ATOM 1987 C ILE B 61 16.112 22.525 21.880 1.00 0.00 C ATOM 1988 O ILE B 61 15.138 21.855 22.224 1.00 0.00 O ATOM 1989 CB ILE B 61 16.474 23.317 19.475 1.00 0.00 C ATOM 1990 CG1 ILE B 61 15.024 23.288 18.929 1.00 0.00 C ATOM 1991 CG2 ILE B 61 17.458 23.198 18.297 1.00 0.00 C ATOM 1992 CD1 ILE B 61 13.991 24.044 19.775 1.00 0.00 C ATOM 0 H ILE B 61 15.526 20.673 20.096 1.00 0.00 H new ATOM 0 HA ILE B 61 17.891 22.325 20.724 1.00 0.00 H new ATOM 0 HB ILE B 61 16.565 24.271 19.994 1.00 0.00 H new ATOM 0 HG12 ILE B 61 15.023 23.708 17.923 1.00 0.00 H new ATOM 0 HG13 ILE B 61 14.707 22.249 18.841 1.00 0.00 H new ATOM 0 HG21 ILE B 61 17.215 23.947 17.543 1.00 0.00 H new ATOM 0 HG22 ILE B 61 18.475 23.359 18.655 1.00 0.00 H new ATOM 0 HG23 ILE B 61 17.381 22.203 17.858 1.00 0.00 H new ATOM 0 HD11 ILE B 61 13.009 23.963 19.308 1.00 0.00 H new ATOM 0 HD12 ILE B 61 13.954 23.612 20.775 1.00 0.00 H new ATOM 0 HD13 ILE B 61 14.275 25.094 19.843 1.00 0.00 H new ATOM 2004 N GLU B 62 16.595 23.508 22.645 1.00 0.00 N ATOM 2005 CA GLU B 62 15.933 23.959 23.882 1.00 0.00 C ATOM 2006 C GLU B 62 14.602 24.668 23.572 1.00 0.00 C ATOM 2007 O GLU B 62 14.555 25.557 22.717 1.00 0.00 O ATOM 2008 CB GLU B 62 16.865 24.859 24.712 1.00 0.00 C ATOM 2009 CG GLU B 62 18.095 24.099 25.235 1.00 0.00 C ATOM 2010 CD GLU B 62 18.976 24.977 26.142 1.00 0.00 C ATOM 2011 OE1 GLU B 62 19.419 26.072 25.708 1.00 0.00 O ATOM 2012 OE2 GLU B 62 19.259 24.582 27.300 1.00 0.00 O1- ATOM 0 H GLU B 62 17.453 24.015 22.429 1.00 0.00 H new ATOM 0 HA GLU B 62 15.706 23.077 24.480 1.00 0.00 H new ATOM 0 HB2 GLU B 62 17.193 25.700 24.101 1.00 0.00 H new ATOM 0 HB3 GLU B 62 16.311 25.273 25.554 1.00 0.00 H new ATOM 0 HG2 GLU B 62 17.768 23.219 25.790 1.00 0.00 H new ATOM 0 HG3 GLU B 62 18.686 23.743 24.391 1.00 0.00 H new ATOM 2019 N GLU B 63 13.521 24.306 24.268 1.00 0.00 N ATOM 2020 CA GLU B 63 12.152 24.781 23.974 1.00 0.00 C ATOM 2021 C GLU B 63 11.938 26.284 24.259 1.00 0.00 C ATOM 2022 O GLU B 63 10.986 26.888 23.758 1.00 0.00 O ATOM 2023 CB GLU B 63 11.132 23.872 24.686 1.00 0.00 C ATOM 2024 CG GLU B 63 11.136 23.925 26.223 1.00 0.00 C ATOM 2025 CD GLU B 63 10.324 25.088 26.830 1.00 0.00 C ATOM 2026 OE1 GLU B 63 9.210 25.405 26.349 1.00 0.00 O ATOM 2027 OE2 GLU B 63 10.783 25.670 27.838 1.00 0.00 O1- ATOM 0 H GLU B 63 13.565 23.668 25.062 1.00 0.00 H new ATOM 0 HA GLU B 63 11.993 24.702 22.899 1.00 0.00 H new ATOM 0 HB2 GLU B 63 10.134 24.136 24.336 1.00 0.00 H new ATOM 0 HB3 GLU B 63 11.316 22.843 24.378 1.00 0.00 H new ATOM 0 HG2 GLU B 63 10.740 22.985 26.606 1.00 0.00 H new ATOM 0 HG3 GLU B 63 12.167 24.001 26.568 1.00 0.00 H new ATOM 2034 N GLN B 64 12.866 26.903 24.996 1.00 0.00 N ATOM 2035 CA GLN B 64 13.138 28.344 24.996 1.00 0.00 C ATOM 2036 C GLN B 64 14.647 28.564 24.790 1.00 0.00 C ATOM 2037 O GLN B 64 15.470 27.947 25.474 1.00 0.00 O ATOM 2038 CB GLN B 64 12.655 29.008 26.296 1.00 0.00 C ATOM 2039 CG GLN B 64 11.128 29.065 26.458 1.00 0.00 C ATOM 2040 CD GLN B 64 10.476 30.026 25.465 1.00 0.00 C ATOM 2041 OE1 GLN B 64 10.425 31.234 25.669 1.00 0.00 O ATOM 2042 NE2 GLN B 64 9.980 29.544 24.344 1.00 0.00 N ATOM 0 H GLN B 64 13.474 26.392 25.636 1.00 0.00 H new ATOM 0 HA GLN B 64 12.587 28.812 24.180 1.00 0.00 H new ATOM 0 HB2 GLN B 64 13.077 28.467 27.143 1.00 0.00 H new ATOM 0 HB3 GLN B 64 13.050 30.023 26.338 1.00 0.00 H new ATOM 0 HG2 GLN B 64 10.713 28.067 26.321 1.00 0.00 H new ATOM 0 HG3 GLN B 64 10.884 29.375 27.474 1.00 0.00 H new ATOM 0 HE21 GLN B 64 10.015 28.541 24.160 1.00 0.00 H new ATOM 0 HE22 GLN B 64 9.561 30.173 23.660 1.00 0.00 H new ATOM 2051 N ASN B 65 15.013 29.422 23.828 1.00 0.00 N ATOM 2052 CA ASN B 65 16.397 29.614 23.366 1.00 0.00 C ATOM 2053 C ASN B 65 16.730 31.090 23.016 1.00 0.00 C ATOM 2054 O ASN B 65 17.690 31.376 22.293 1.00 0.00 O ATOM 2055 CB ASN B 65 16.681 28.623 22.217 1.00 0.00 C ATOM 2056 CG ASN B 65 15.689 28.732 21.065 1.00 0.00 C ATOM 2057 OD1 ASN B 65 15.694 29.685 20.299 1.00 0.00 O ATOM 2058 ND2 ASN B 65 14.805 27.773 20.915 1.00 0.00 N ATOM 0 H ASN B 65 14.343 30.015 23.338 1.00 0.00 H new ATOM 0 HA ASN B 65 17.077 29.391 24.188 1.00 0.00 H new ATOM 0 HB2 ASN B 65 17.688 28.797 21.837 1.00 0.00 H new ATOM 0 HB3 ASN B 65 16.660 27.607 22.610 1.00 0.00 H new ATOM 0 HD21 ASN B 65 14.122 27.823 20.159 1.00 0.00 H new ATOM 0 HD22 ASN B 65 14.801 26.978 21.554 1.00 0.00 H new ATOM 2065 N ARG B 66 15.913 32.028 23.528 1.00 0.00 N ATOM 2066 CA ARG B 66 16.024 33.487 23.324 1.00 0.00 C ATOM 2067 C ARG B 66 17.253 34.102 24.007 1.00 0.00 C ATOM 2068 O ARG B 66 17.537 33.751 25.176 1.00 0.00 O ATOM 2069 CB ARG B 66 14.727 34.168 23.806 1.00 0.00 C ATOM 2070 CG ARG B 66 13.510 33.829 22.926 1.00 0.00 C ATOM 2071 CD ARG B 66 12.220 34.474 23.437 1.00 0.00 C ATOM 2072 NE ARG B 66 11.755 33.854 24.693 1.00 0.00 N ATOM 2073 CZ ARG B 66 11.788 34.355 25.910 1.00 0.00 C ATOM 2074 NH1 ARG B 66 11.304 33.658 26.895 1.00 0.00 N1+ ATOM 2075 NH2 ARG B 66 12.277 35.527 26.187 1.00 0.00 N ATOM 2076 OXT ARG B 66 17.924 34.948 23.369 1.00 0.00 O1- ATOM 0 H ARG B 66 15.122 31.781 24.122 1.00 0.00 H new ATOM 0 HA ARG B 66 16.161 33.660 22.257 1.00 0.00 H new ATOM 0 HB2 ARG B 66 14.523 33.864 24.833 1.00 0.00 H new ATOM 0 HB3 ARG B 66 14.872 35.248 23.816 1.00 0.00 H new ATOM 0 HG2 ARG B 66 13.699 34.162 21.906 1.00 0.00 H new ATOM 0 HG3 ARG B 66 13.382 32.747 22.890 1.00 0.00 H new ATOM 0 HD2 ARG B 66 12.386 35.539 23.598 1.00 0.00 H new ATOM 0 HD3 ARG B 66 11.443 34.383 22.678 1.00 0.00 H new ATOM 0 HE ARG B 66 11.358 32.919 24.607 1.00 0.00 H new ATOM 0 HH11 ARG B 66 10.905 32.736 26.720 1.00 0.00 H new ATOM 0 HH12 ARG B 66 11.323 34.034 27.843 1.00 0.00 H new ATOM 0 HH21 ARG B 66 12.661 36.108 25.442 1.00 0.00 H new ATOM 0 HH22 ARG B 66 12.277 35.865 27.149 1.00 0.00 H new TER 2090 ARG B 66