USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 890 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 6 THR OG1 : rot 20:sc= 0.682 USER MOD Single : A 8 THR OG1 : rot 91:sc= 0.0807 USER MOD Single : A 13 SER OG : rot 180:sc= 0.0974 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -14.6! C(o=-15!,f=-11!) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 17:sc=-0.00832 USER MOD Single : A 31 SER OG : rot -18:sc= 0.644 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.0971 K(o=-0.097,f=-1.9!) USER MOD Single : A 35 SER OG : rot 62:sc= -1.1! USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 150:sc= 0.415 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -3.33! C(o=-3.3!,f=-6.5!) USER MOD Single : A 54 SER OG : rot -57:sc= 0.0722 USER MOD Single : A 59 GLN : amide:sc= -0.293 K(o=-0.29,f=-2.5!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 TYR OH : rot 100:sc= -1.12 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : B 6 THR OG1 : rot 14:sc= 0.62 USER MOD Single : B 8 THR OG1 : rot 85:sc= 0.191 USER MOD Single : B 13 SER OG : rot 50:sc= 0.0998 USER MOD Single : B 14 TYR OH : rot 180:sc= 0 USER MOD Single : B 15 THR OG1 : rot 180:sc= 0.00133 USER MOD Single : B 16 SER OG : rot 180:sc= 0 USER MOD Single : B 18 GLN : amide:sc= -14.9! C(o=-15!,f=-11!) USER MOD Single : B 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 22 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 27 TYR OH : rot 180:sc= 0 USER MOD Single : B 30 THR OG1 : rot 18:sc= 0.133 USER MOD Single : B 31 SER OG : rot -22:sc= 0.608 USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 33 GLN : amide:sc= -0.106 K(o=-0.11,f=-2!) USER MOD Single : B 35 SER OG : rot 62:sc= -1.14! USER MOD Single : B 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 THR OG1 : rot 150:sc= 0.42 USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -2.82! C(o=-2.8!,f=-6.3!) USER MOD Single : B 54 SER OG : rot -56:sc= 0.0737 USER MOD Single : B 59 GLN : amide:sc= -0.294 K(o=-0.29,f=-2.5!) USER MOD Single : B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 TYR OH : rot 100:sc= -1.14 USER MOD Single : B 63 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 53 N ASP A 5 50.621 2.193 -12.485 1.00 0.00 N ATOM 54 CA ASP A 5 50.013 1.010 -11.812 1.00 0.00 C ATOM 55 C ASP A 5 50.593 0.875 -10.402 1.00 0.00 C ATOM 56 O ASP A 5 51.337 -0.041 -10.114 1.00 0.00 O ATOM 57 CB ASP A 5 50.328 -0.252 -12.618 1.00 0.00 C ATOM 58 CG ASP A 5 50.000 -1.490 -11.783 1.00 0.00 C ATOM 59 OD1 ASP A 5 48.909 -1.542 -11.238 1.00 0.00 O ATOM 60 OD2 ASP A 5 50.845 -2.366 -11.701 1.00 0.00 O ATOM 0 HA ASP A 5 48.933 1.140 -11.750 1.00 0.00 H new ATOM 0 HB2 ASP A 5 49.749 -0.260 -13.541 1.00 0.00 H new ATOM 0 HB3 ASP A 5 51.380 -0.261 -12.902 1.00 0.00 H new ATOM 65 N THR A 6 50.258 1.779 -9.522 1.00 0.00 N ATOM 66 CA THR A 6 50.791 1.699 -8.130 1.00 0.00 C ATOM 67 C THR A 6 50.162 2.817 -7.286 1.00 0.00 C ATOM 68 O THR A 6 50.062 3.942 -7.733 1.00 0.00 O ATOM 69 CB THR A 6 52.319 1.873 -8.160 1.00 0.00 C ATOM 70 OG1 THR A 6 52.926 0.658 -8.573 1.00 0.00 O ATOM 71 CG2 THR A 6 52.831 2.246 -6.766 1.00 0.00 C ATOM 0 H THR A 6 49.639 2.569 -9.705 1.00 0.00 H new ATOM 0 HA THR A 6 50.546 0.730 -7.694 1.00 0.00 H new ATOM 0 HB THR A 6 52.573 2.668 -8.861 1.00 0.00 H new ATOM 0 HG1 THR A 6 52.265 0.104 -9.038 1.00 0.00 H new ATOM 0 HG21 THR A 6 53.914 2.367 -6.796 1.00 0.00 H new ATOM 0 HG22 THR A 6 52.370 3.181 -6.447 1.00 0.00 H new ATOM 0 HG23 THR A 6 52.574 1.456 -6.061 1.00 0.00 H new ATOM 79 N PRO A 7 49.764 2.476 -6.085 1.00 0.00 N ATOM 80 CA PRO A 7 49.149 3.438 -5.153 1.00 0.00 C ATOM 81 C PRO A 7 50.232 4.307 -4.507 1.00 0.00 C ATOM 82 O PRO A 7 51.321 4.445 -5.028 1.00 0.00 O ATOM 83 CB PRO A 7 48.469 2.545 -4.111 1.00 0.00 C ATOM 84 CG PRO A 7 49.188 1.177 -4.172 1.00 0.00 C ATOM 85 CD PRO A 7 49.885 1.107 -5.544 1.00 0.00 C ATOM 0 HA PRO A 7 48.451 4.123 -5.635 1.00 0.00 H new ATOM 0 HB2 PRO A 7 48.548 2.981 -3.115 1.00 0.00 H new ATOM 0 HB3 PRO A 7 47.406 2.435 -4.328 1.00 0.00 H new ATOM 0 HG2 PRO A 7 49.913 1.084 -3.364 1.00 0.00 H new ATOM 0 HG3 PRO A 7 48.476 0.360 -4.057 1.00 0.00 H new ATOM 0 HD2 PRO A 7 50.929 0.809 -5.445 1.00 0.00 H new ATOM 0 HD3 PRO A 7 49.406 0.377 -6.197 1.00 0.00 H new ATOM 93 N THR A 8 49.946 4.893 -3.378 1.00 0.00 N ATOM 94 CA THR A 8 50.963 5.747 -2.706 1.00 0.00 C ATOM 95 C THR A 8 50.823 5.610 -1.190 1.00 0.00 C ATOM 96 O THR A 8 50.425 6.533 -0.507 1.00 0.00 O ATOM 97 CB THR A 8 50.748 7.207 -3.109 1.00 0.00 C ATOM 98 OG1 THR A 8 49.993 7.258 -4.311 1.00 0.00 O ATOM 99 CG2 THR A 8 52.103 7.883 -3.326 1.00 0.00 C ATOM 0 H THR A 8 49.052 4.817 -2.892 1.00 0.00 H new ATOM 0 HA THR A 8 51.961 5.430 -3.008 1.00 0.00 H new ATOM 0 HB THR A 8 50.208 7.727 -2.318 1.00 0.00 H new ATOM 0 HG1 THR A 8 49.038 7.305 -4.096 1.00 0.00 H new ATOM 0 HG21 THR A 8 51.949 8.923 -3.613 1.00 0.00 H new ATOM 0 HG22 THR A 8 52.681 7.843 -2.403 1.00 0.00 H new ATOM 0 HG23 THR A 8 52.646 7.365 -4.117 1.00 0.00 H new ATOM 107 N ALA A 9 51.146 4.465 -0.656 1.00 0.00 N ATOM 108 CA ALA A 9 51.031 4.269 0.817 1.00 0.00 C ATOM 109 C ALA A 9 51.735 5.418 1.542 1.00 0.00 C ATOM 110 O ALA A 9 52.923 5.370 1.792 1.00 0.00 O ATOM 111 CB ALA A 9 51.685 2.942 1.206 1.00 0.00 C ATOM 0 H ALA A 9 51.485 3.656 -1.176 1.00 0.00 H new ATOM 0 HA ALA A 9 49.979 4.253 1.101 1.00 0.00 H new ATOM 0 HB1 ALA A 9 51.602 2.797 2.283 1.00 0.00 H new ATOM 0 HB2 ALA A 9 51.183 2.124 0.690 1.00 0.00 H new ATOM 0 HB3 ALA A 9 52.737 2.958 0.922 1.00 0.00 H new ATOM 117 N CYS A 10 51.011 6.449 1.885 1.00 0.00 N ATOM 118 CA CYS A 10 51.643 7.597 2.595 1.00 0.00 C ATOM 119 C CYS A 10 52.021 7.167 4.014 1.00 0.00 C ATOM 120 O CYS A 10 51.373 6.331 4.613 1.00 0.00 O ATOM 121 CB CYS A 10 50.660 8.769 2.640 1.00 0.00 C ATOM 122 SG CYS A 10 50.607 9.558 1.009 1.00 0.00 S ATOM 0 H CYS A 10 50.012 6.546 1.705 1.00 0.00 H new ATOM 0 HA CYS A 10 52.544 7.911 2.067 1.00 0.00 H new ATOM 0 HB2 CYS A 10 49.667 8.417 2.920 1.00 0.00 H new ATOM 0 HB3 CYS A 10 50.968 9.490 3.397 1.00 0.00 H new ATOM 127 N CYS A 11 53.080 7.713 4.548 1.00 0.00 N ATOM 128 CA CYS A 11 53.514 7.315 5.916 1.00 0.00 C ATOM 129 C CYS A 11 52.882 8.233 6.964 1.00 0.00 C ATOM 130 O CYS A 11 52.933 9.444 6.862 1.00 0.00 O ATOM 131 CB CYS A 11 55.038 7.404 6.005 1.00 0.00 C ATOM 132 SG CYS A 11 55.727 5.732 6.097 1.00 0.00 S ATOM 0 H CYS A 11 53.663 8.417 4.095 1.00 0.00 H new ATOM 0 HA CYS A 11 53.191 6.292 6.110 1.00 0.00 H new ATOM 0 HB2 CYS A 11 55.435 7.927 5.135 1.00 0.00 H new ATOM 0 HB3 CYS A 11 55.330 7.980 6.883 1.00 0.00 H new ATOM 137 N PHE A 12 52.293 7.658 7.978 1.00 0.00 N ATOM 138 CA PHE A 12 51.662 8.480 9.048 1.00 0.00 C ATOM 139 C PHE A 12 51.925 7.814 10.401 1.00 0.00 C ATOM 140 O PHE A 12 52.454 8.424 11.309 1.00 0.00 O ATOM 141 CB PHE A 12 50.160 8.586 8.786 1.00 0.00 C ATOM 142 CG PHE A 12 49.948 9.358 7.505 1.00 0.00 C ATOM 143 CD1 PHE A 12 50.585 10.592 7.326 1.00 0.00 C ATOM 144 CD2 PHE A 12 49.131 8.839 6.494 1.00 0.00 C ATOM 145 CE1 PHE A 12 50.404 11.309 6.138 1.00 0.00 C ATOM 146 CE2 PHE A 12 48.947 9.557 5.306 1.00 0.00 C ATOM 147 CZ PHE A 12 49.585 10.792 5.128 1.00 0.00 C ATOM 0 H PHE A 12 52.222 6.649 8.111 1.00 0.00 H new ATOM 0 HA PHE A 12 52.086 9.484 9.054 1.00 0.00 H new ATOM 0 HB2 PHE A 12 49.719 7.592 8.706 1.00 0.00 H new ATOM 0 HB3 PHE A 12 49.665 9.089 9.617 1.00 0.00 H new ATOM 0 HD1 PHE A 12 51.217 10.991 8.106 1.00 0.00 H new ATOM 0 HD2 PHE A 12 48.643 7.885 6.630 1.00 0.00 H new ATOM 0 HE1 PHE A 12 50.896 12.261 6.001 1.00 0.00 H new ATOM 0 HE2 PHE A 12 48.314 9.159 4.527 1.00 0.00 H new ATOM 0 HZ PHE A 12 49.445 11.345 4.211 1.00 0.00 H new ATOM 157 N SER A 13 51.592 6.559 10.534 1.00 0.00 N ATOM 158 CA SER A 13 51.864 5.854 11.818 1.00 0.00 C ATOM 159 C SER A 13 53.294 5.319 11.754 1.00 0.00 C ATOM 160 O SER A 13 53.601 4.451 10.962 1.00 0.00 O ATOM 161 CB SER A 13 50.883 4.695 11.994 1.00 0.00 C ATOM 162 OG SER A 13 50.506 4.199 10.717 1.00 0.00 O ATOM 0 H SER A 13 51.145 5.994 9.812 1.00 0.00 H new ATOM 0 HA SER A 13 51.745 6.534 12.662 1.00 0.00 H new ATOM 0 HB2 SER A 13 51.342 3.902 12.584 1.00 0.00 H new ATOM 0 HB3 SER A 13 50.002 5.030 12.541 1.00 0.00 H new ATOM 0 HG SER A 13 49.878 3.455 10.827 1.00 0.00 H new ATOM 168 N TYR A 14 54.181 5.855 12.546 1.00 0.00 N ATOM 169 CA TYR A 14 55.595 5.396 12.477 1.00 0.00 C ATOM 170 C TYR A 14 55.909 4.375 13.588 1.00 0.00 C ATOM 171 O TYR A 14 55.265 3.353 13.680 1.00 0.00 O ATOM 172 CB TYR A 14 56.514 6.618 12.575 1.00 0.00 C ATOM 173 CG TYR A 14 55.896 7.768 11.816 1.00 0.00 C ATOM 174 CD1 TYR A 14 56.065 7.861 10.433 1.00 0.00 C ATOM 175 CD2 TYR A 14 55.148 8.737 12.497 1.00 0.00 C ATOM 176 CE1 TYR A 14 55.490 8.922 9.724 1.00 0.00 C ATOM 177 CE2 TYR A 14 54.571 9.799 11.789 1.00 0.00 C ATOM 178 CZ TYR A 14 54.741 9.891 10.403 1.00 0.00 C ATOM 179 OH TYR A 14 54.172 10.936 9.706 1.00 0.00 O ATOM 0 H TYR A 14 53.990 6.585 13.232 1.00 0.00 H new ATOM 0 HA TYR A 14 55.763 4.889 11.527 1.00 0.00 H new ATOM 0 HB2 TYR A 14 56.662 6.894 13.619 1.00 0.00 H new ATOM 0 HB3 TYR A 14 57.496 6.383 12.165 1.00 0.00 H new ATOM 0 HD1 TYR A 14 56.641 7.112 9.909 1.00 0.00 H new ATOM 0 HD2 TYR A 14 55.016 8.665 13.567 1.00 0.00 H new ATOM 0 HE1 TYR A 14 55.624 8.993 8.655 1.00 0.00 H new ATOM 0 HE2 TYR A 14 53.995 10.547 12.313 1.00 0.00 H new ATOM 0 HH TYR A 14 53.686 11.517 10.327 1.00 0.00 H new ATOM 189 N THR A 15 56.921 4.637 14.393 1.00 0.00 N ATOM 190 CA THR A 15 57.344 3.696 15.481 1.00 0.00 C ATOM 191 C THR A 15 56.252 2.681 15.853 1.00 0.00 C ATOM 192 O THR A 15 56.019 1.728 15.136 1.00 0.00 O ATOM 193 CB THR A 15 57.727 4.504 16.720 1.00 0.00 C ATOM 194 OG1 THR A 15 56.815 5.580 16.881 1.00 0.00 O ATOM 195 CG2 THR A 15 59.146 5.052 16.561 1.00 0.00 C ATOM 0 H THR A 15 57.482 5.487 14.336 1.00 0.00 H new ATOM 0 HA THR A 15 58.195 3.127 15.106 1.00 0.00 H new ATOM 0 HB THR A 15 57.689 3.860 17.599 1.00 0.00 H new ATOM 0 HG1 THR A 15 57.058 6.099 17.676 1.00 0.00 H new ATOM 0 HG21 THR A 15 59.415 5.628 17.447 1.00 0.00 H new ATOM 0 HG22 THR A 15 59.844 4.224 16.440 1.00 0.00 H new ATOM 0 HG23 THR A 15 59.191 5.696 15.683 1.00 0.00 H new ATOM 203 N SER A 16 55.613 2.838 16.983 1.00 0.00 N ATOM 204 CA SER A 16 54.588 1.841 17.387 1.00 0.00 C ATOM 205 C SER A 16 55.316 0.531 17.674 1.00 0.00 C ATOM 206 O SER A 16 55.109 -0.464 17.011 1.00 0.00 O ATOM 207 CB SER A 16 53.585 1.639 16.250 1.00 0.00 C ATOM 208 OG SER A 16 52.323 2.165 16.639 1.00 0.00 O ATOM 0 H SER A 16 55.757 3.608 17.636 1.00 0.00 H new ATOM 0 HA SER A 16 54.044 2.181 18.268 1.00 0.00 H new ATOM 0 HB2 SER A 16 53.937 2.137 15.346 1.00 0.00 H new ATOM 0 HB3 SER A 16 53.493 0.579 16.014 1.00 0.00 H new ATOM 0 HG SER A 16 51.678 2.039 15.912 1.00 0.00 H new ATOM 214 N ARG A 17 56.198 0.541 18.642 1.00 0.00 N ATOM 215 CA ARG A 17 56.977 -0.688 18.963 1.00 0.00 C ATOM 216 C ARG A 17 57.925 -0.977 17.799 1.00 0.00 C ATOM 217 O ARG A 17 57.511 -1.424 16.748 1.00 0.00 O ATOM 218 CB ARG A 17 56.031 -1.868 19.167 1.00 0.00 C ATOM 219 CG ARG A 17 56.845 -3.115 19.518 1.00 0.00 C ATOM 220 CD ARG A 17 56.662 -4.167 18.421 1.00 0.00 C ATOM 221 NE ARG A 17 55.755 -5.247 18.906 1.00 0.00 N ATOM 222 CZ ARG A 17 54.752 -4.957 19.689 1.00 0.00 C ATOM 223 NH1 ARG A 17 53.690 -4.374 19.200 1.00 0.00 N ATOM 224 NH2 ARG A 17 54.812 -5.244 20.959 1.00 0.00 N ATOM 0 H ARG A 17 56.411 1.351 19.224 1.00 0.00 H new ATOM 0 HA ARG A 17 57.546 -0.538 19.881 1.00 0.00 H new ATOM 0 HB2 ARG A 17 55.322 -1.646 19.965 1.00 0.00 H new ATOM 0 HB3 ARG A 17 55.449 -2.043 18.262 1.00 0.00 H new ATOM 0 HG2 ARG A 17 57.899 -2.858 19.618 1.00 0.00 H new ATOM 0 HG3 ARG A 17 56.522 -3.515 20.479 1.00 0.00 H new ATOM 0 HD2 ARG A 17 56.246 -3.704 17.526 1.00 0.00 H new ATOM 0 HD3 ARG A 17 57.628 -4.588 18.143 1.00 0.00 H new ATOM 0 HE ARG A 17 55.919 -6.214 18.625 1.00 0.00 H new ATOM 0 HH11 ARG A 17 53.645 -4.146 18.207 1.00 0.00 H new ATOM 0 HH12 ARG A 17 52.906 -4.147 19.811 1.00 0.00 H new ATOM 0 HH21 ARG A 17 55.643 -5.695 21.341 1.00 0.00 H new ATOM 0 HH22 ARG A 17 54.028 -5.017 21.571 1.00 0.00 H new ATOM 238 N GLN A 18 59.190 -0.703 17.966 1.00 0.00 N ATOM 239 CA GLN A 18 60.149 -0.937 16.863 1.00 0.00 C ATOM 240 C GLN A 18 60.130 -2.397 16.452 1.00 0.00 C ATOM 241 O GLN A 18 59.303 -3.175 16.881 1.00 0.00 O ATOM 242 CB GLN A 18 61.552 -0.548 17.296 1.00 0.00 C ATOM 243 CG GLN A 18 61.673 0.969 17.538 1.00 0.00 C ATOM 244 CD GLN A 18 60.606 1.742 16.752 1.00 0.00 C ATOM 245 OE1 GLN A 18 60.885 2.289 15.706 1.00 0.00 O ATOM 246 NE2 GLN A 18 59.393 1.819 17.223 1.00 0.00 N ATOM 0 H GLN A 18 59.596 -0.327 18.823 1.00 0.00 H new ATOM 0 HA GLN A 18 59.854 -0.323 16.012 1.00 0.00 H new ATOM 0 HB2 GLN A 18 61.813 -1.084 18.208 1.00 0.00 H new ATOM 0 HB3 GLN A 18 62.267 -0.853 16.531 1.00 0.00 H new ATOM 0 HG2 GLN A 18 61.569 1.180 18.602 1.00 0.00 H new ATOM 0 HG3 GLN A 18 62.665 1.309 17.241 1.00 0.00 H new ATOM 0 HE21 GLN A 18 59.157 1.359 18.103 1.00 0.00 H new ATOM 0 HE22 GLN A 18 58.680 2.339 16.712 1.00 0.00 H new ATOM 255 N ILE A 19 61.045 -2.759 15.615 1.00 0.00 N ATOM 256 CA ILE A 19 61.128 -4.139 15.139 1.00 0.00 C ATOM 257 C ILE A 19 62.600 -4.449 14.884 1.00 0.00 C ATOM 258 O ILE A 19 63.171 -3.992 13.913 1.00 0.00 O ATOM 259 CB ILE A 19 60.342 -4.272 13.850 1.00 0.00 C ATOM 260 CG1 ILE A 19 60.492 -2.985 13.019 1.00 0.00 C ATOM 261 CG2 ILE A 19 58.871 -4.529 14.180 1.00 0.00 C ATOM 262 CD1 ILE A 19 59.450 -1.945 13.441 1.00 0.00 C ATOM 0 H ILE A 19 61.755 -2.133 15.235 1.00 0.00 H new ATOM 0 HA ILE A 19 60.715 -4.831 15.873 1.00 0.00 H new ATOM 0 HB ILE A 19 60.725 -5.109 13.267 1.00 0.00 H new ATOM 0 HG12 ILE A 19 61.494 -2.577 13.149 1.00 0.00 H new ATOM 0 HG13 ILE A 19 60.376 -3.214 11.960 1.00 0.00 H new ATOM 0 HG21 ILE A 19 58.302 -4.625 13.255 1.00 0.00 H new ATOM 0 HG22 ILE A 19 58.783 -5.449 14.758 1.00 0.00 H new ATOM 0 HG23 ILE A 19 58.478 -3.696 14.763 1.00 0.00 H new ATOM 0 HD11 ILE A 19 59.573 -1.043 12.842 1.00 0.00 H new ATOM 0 HD12 ILE A 19 58.449 -2.349 13.287 1.00 0.00 H new ATOM 0 HD13 ILE A 19 59.585 -1.702 14.495 1.00 0.00 H new ATOM 274 N PRO A 20 63.169 -5.203 15.772 1.00 0.00 N ATOM 275 CA PRO A 20 64.586 -5.587 15.697 1.00 0.00 C ATOM 276 C PRO A 20 64.848 -6.483 14.489 1.00 0.00 C ATOM 277 O PRO A 20 63.947 -6.846 13.759 1.00 0.00 O ATOM 278 CB PRO A 20 64.830 -6.303 17.029 1.00 0.00 C ATOM 279 CG PRO A 20 63.438 -6.734 17.542 1.00 0.00 C ATOM 280 CD PRO A 20 62.443 -5.768 16.921 1.00 0.00 C ATOM 0 HA PRO A 20 65.261 -4.742 15.559 1.00 0.00 H new ATOM 0 HB2 PRO A 20 65.481 -7.167 16.894 1.00 0.00 H new ATOM 0 HB3 PRO A 20 65.322 -5.642 17.743 1.00 0.00 H new ATOM 0 HG2 PRO A 20 63.217 -7.761 17.252 1.00 0.00 H new ATOM 0 HG3 PRO A 20 63.394 -6.693 18.630 1.00 0.00 H new ATOM 0 HD2 PRO A 20 61.533 -6.279 16.607 1.00 0.00 H new ATOM 0 HD3 PRO A 20 62.146 -4.992 17.627 1.00 0.00 H new ATOM 288 N GLN A 21 66.083 -6.817 14.258 1.00 0.00 N ATOM 289 CA GLN A 21 66.424 -7.661 13.083 1.00 0.00 C ATOM 290 C GLN A 21 65.695 -9.006 13.174 1.00 0.00 C ATOM 291 O GLN A 21 65.430 -9.645 12.176 1.00 0.00 O ATOM 292 CB GLN A 21 67.935 -7.899 13.064 1.00 0.00 C ATOM 293 CG GLN A 21 68.678 -6.557 13.096 1.00 0.00 C ATOM 294 CD GLN A 21 70.126 -6.791 13.536 1.00 0.00 C ATOM 295 OE1 GLN A 21 70.446 -6.663 14.702 1.00 0.00 O ATOM 296 NE2 GLN A 21 71.019 -7.132 12.648 1.00 0.00 N ATOM 0 H GLN A 21 66.877 -6.540 14.836 1.00 0.00 H new ATOM 0 HA GLN A 21 66.116 -7.153 12.169 1.00 0.00 H new ATOM 0 HB2 GLN A 21 68.227 -8.506 13.921 1.00 0.00 H new ATOM 0 HB3 GLN A 21 68.212 -8.456 12.169 1.00 0.00 H new ATOM 0 HG2 GLN A 21 68.656 -6.092 12.110 1.00 0.00 H new ATOM 0 HG3 GLN A 21 68.183 -5.871 13.783 1.00 0.00 H new ATOM 0 HE21 GLN A 21 70.750 -7.239 11.670 1.00 0.00 H new ATOM 0 HE22 GLN A 21 71.986 -7.291 12.932 1.00 0.00 H new ATOM 305 N ASN A 22 65.373 -9.447 14.361 1.00 0.00 N ATOM 306 CA ASN A 22 64.668 -10.755 14.507 1.00 0.00 C ATOM 307 C ASN A 22 63.163 -10.555 14.309 1.00 0.00 C ATOM 308 O ASN A 22 62.430 -11.488 14.049 1.00 0.00 O ATOM 309 CB ASN A 22 64.922 -11.318 15.906 1.00 0.00 C ATOM 310 CG ASN A 22 65.590 -12.691 15.796 1.00 0.00 C ATOM 311 OD1 ASN A 22 64.920 -13.694 15.649 1.00 0.00 O ATOM 312 ND2 ASN A 22 66.890 -12.779 15.861 1.00 0.00 N ATOM 0 H ASN A 22 65.567 -8.959 15.235 1.00 0.00 H new ATOM 0 HA ASN A 22 65.044 -11.451 13.757 1.00 0.00 H new ATOM 0 HB2 ASN A 22 65.558 -10.638 16.472 1.00 0.00 H new ATOM 0 HB3 ASN A 22 63.982 -11.403 16.451 1.00 0.00 H new ATOM 0 HD21 ASN A 22 67.344 -13.690 15.788 1.00 0.00 H new ATOM 0 HD22 ASN A 22 67.453 -11.937 15.984 1.00 0.00 H new ATOM 319 N PHE A 23 62.698 -9.345 14.441 1.00 0.00 N ATOM 320 CA PHE A 23 61.244 -9.075 14.273 1.00 0.00 C ATOM 321 C PHE A 23 61.011 -8.327 12.963 1.00 0.00 C ATOM 322 O PHE A 23 60.053 -7.593 12.822 1.00 0.00 O ATOM 323 CB PHE A 23 60.778 -8.199 15.434 1.00 0.00 C ATOM 324 CG PHE A 23 59.618 -8.854 16.136 1.00 0.00 C ATOM 325 CD1 PHE A 23 59.856 -9.830 17.107 1.00 0.00 C ATOM 326 CD2 PHE A 23 58.306 -8.484 15.818 1.00 0.00 C ATOM 327 CE1 PHE A 23 58.783 -10.441 17.762 1.00 0.00 C ATOM 328 CE2 PHE A 23 57.231 -9.095 16.473 1.00 0.00 C ATOM 329 CZ PHE A 23 57.469 -10.075 17.446 1.00 0.00 C ATOM 0 H PHE A 23 63.266 -8.527 14.659 1.00 0.00 H new ATOM 0 HA PHE A 23 60.691 -10.014 14.257 1.00 0.00 H new ATOM 0 HB2 PHE A 23 61.598 -8.043 16.135 1.00 0.00 H new ATOM 0 HB3 PHE A 23 60.483 -7.217 15.065 1.00 0.00 H new ATOM 0 HD1 PHE A 23 60.869 -10.112 17.352 1.00 0.00 H new ATOM 0 HD2 PHE A 23 58.124 -7.728 15.068 1.00 0.00 H new ATOM 0 HE1 PHE A 23 58.968 -11.196 18.512 1.00 0.00 H new ATOM 0 HE2 PHE A 23 56.218 -8.811 16.229 1.00 0.00 H new ATOM 0 HZ PHE A 23 56.640 -10.547 17.952 1.00 0.00 H new ATOM 339 N ILE A 24 61.893 -8.470 12.013 1.00 0.00 N ATOM 340 CA ILE A 24 61.719 -7.723 10.741 1.00 0.00 C ATOM 341 C ILE A 24 62.038 -8.603 9.530 1.00 0.00 C ATOM 342 O ILE A 24 62.440 -9.744 9.646 1.00 0.00 O ATOM 343 CB ILE A 24 62.662 -6.512 10.793 1.00 0.00 C ATOM 344 CG1 ILE A 24 61.842 -5.231 10.740 1.00 0.00 C ATOM 345 CG2 ILE A 24 63.663 -6.507 9.627 1.00 0.00 C ATOM 346 CD1 ILE A 24 62.779 -4.056 10.970 1.00 0.00 C ATOM 0 H ILE A 24 62.719 -9.067 12.063 1.00 0.00 H new ATOM 0 HA ILE A 24 60.683 -7.404 10.632 1.00 0.00 H new ATOM 0 HB ILE A 24 63.226 -6.575 11.724 1.00 0.00 H new ATOM 0 HG12 ILE A 24 61.345 -5.138 9.774 1.00 0.00 H new ATOM 0 HG13 ILE A 24 61.061 -5.248 11.500 1.00 0.00 H new ATOM 0 HG21 ILE A 24 64.309 -5.632 9.706 1.00 0.00 H new ATOM 0 HG22 ILE A 24 64.270 -7.411 9.665 1.00 0.00 H new ATOM 0 HG23 ILE A 24 63.121 -6.474 8.682 1.00 0.00 H new ATOM 0 HD11 ILE A 24 62.211 -3.126 10.936 1.00 0.00 H new ATOM 0 HD12 ILE A 24 63.255 -4.155 11.946 1.00 0.00 H new ATOM 0 HD13 ILE A 24 63.544 -4.043 10.193 1.00 0.00 H new ATOM 358 N ALA A 25 61.874 -8.041 8.365 1.00 0.00 N ATOM 359 CA ALA A 25 62.172 -8.777 7.110 1.00 0.00 C ATOM 360 C ALA A 25 62.537 -7.761 6.022 1.00 0.00 C ATOM 361 O ALA A 25 63.637 -7.753 5.507 1.00 0.00 O ATOM 362 CB ALA A 25 60.940 -9.574 6.674 1.00 0.00 C ATOM 0 H ALA A 25 61.540 -7.087 8.230 1.00 0.00 H new ATOM 0 HA ALA A 25 63.001 -9.466 7.272 1.00 0.00 H new ATOM 0 HB1 ALA A 25 61.162 -10.113 5.753 1.00 0.00 H new ATOM 0 HB2 ALA A 25 60.672 -10.286 7.455 1.00 0.00 H new ATOM 0 HB3 ALA A 25 60.107 -8.892 6.503 1.00 0.00 H new ATOM 368 N ALA A 26 61.617 -6.899 5.673 1.00 0.00 N ATOM 369 CA ALA A 26 61.901 -5.875 4.622 1.00 0.00 C ATOM 370 C ALA A 26 62.146 -4.504 5.267 1.00 0.00 C ATOM 371 O ALA A 26 62.620 -4.402 6.380 1.00 0.00 O ATOM 372 CB ALA A 26 60.704 -5.782 3.675 1.00 0.00 C ATOM 0 H ALA A 26 60.679 -6.860 6.071 1.00 0.00 H new ATOM 0 HA ALA A 26 62.793 -6.170 4.069 1.00 0.00 H new ATOM 0 HB1 ALA A 26 60.906 -5.036 2.906 1.00 0.00 H new ATOM 0 HB2 ALA A 26 60.535 -6.751 3.205 1.00 0.00 H new ATOM 0 HB3 ALA A 26 59.817 -5.492 4.238 1.00 0.00 H new ATOM 378 N TYR A 27 61.801 -3.449 4.570 1.00 0.00 N ATOM 379 CA TYR A 27 61.975 -2.071 5.119 1.00 0.00 C ATOM 380 C TYR A 27 61.624 -1.049 4.027 1.00 0.00 C ATOM 381 O TYR A 27 60.841 -0.157 4.237 1.00 0.00 O ATOM 382 CB TYR A 27 63.418 -1.848 5.590 1.00 0.00 C ATOM 383 CG TYR A 27 64.367 -2.063 4.444 1.00 0.00 C ATOM 384 CD1 TYR A 27 64.867 -3.339 4.195 1.00 0.00 C ATOM 385 CD2 TYR A 27 64.743 -0.989 3.630 1.00 0.00 C ATOM 386 CE1 TYR A 27 65.746 -3.548 3.133 1.00 0.00 C ATOM 387 CE2 TYR A 27 65.623 -1.195 2.563 1.00 0.00 C ATOM 388 CZ TYR A 27 66.126 -2.477 2.315 1.00 0.00 C ATOM 389 OH TYR A 27 66.996 -2.688 1.264 1.00 0.00 O ATOM 0 H TYR A 27 61.401 -3.486 3.632 1.00 0.00 H new ATOM 0 HA TYR A 27 61.313 -1.946 5.976 1.00 0.00 H new ATOM 0 HB2 TYR A 27 63.530 -0.837 5.982 1.00 0.00 H new ATOM 0 HB3 TYR A 27 63.655 -2.534 6.404 1.00 0.00 H new ATOM 0 HD1 TYR A 27 64.574 -4.166 4.824 1.00 0.00 H new ATOM 0 HD2 TYR A 27 64.354 -0.001 3.826 1.00 0.00 H new ATOM 0 HE1 TYR A 27 66.134 -4.537 2.941 1.00 0.00 H new ATOM 0 HE2 TYR A 27 65.913 -0.368 1.933 1.00 0.00 H new ATOM 0 HH TYR A 27 67.155 -1.842 0.796 1.00 0.00 H new ATOM 399 N PHE A 28 62.194 -1.174 2.862 1.00 0.00 N ATOM 400 CA PHE A 28 61.882 -0.206 1.766 1.00 0.00 C ATOM 401 C PHE A 28 62.222 1.214 2.229 1.00 0.00 C ATOM 402 O PHE A 28 63.158 1.424 2.970 1.00 0.00 O ATOM 403 CB PHE A 28 60.393 -0.290 1.416 1.00 0.00 C ATOM 404 CG PHE A 28 60.046 -1.704 1.015 1.00 0.00 C ATOM 405 CD1 PHE A 28 59.693 -2.641 1.991 1.00 0.00 C ATOM 406 CD2 PHE A 28 60.073 -2.076 -0.336 1.00 0.00 C ATOM 407 CE1 PHE A 28 59.369 -3.951 1.619 1.00 0.00 C ATOM 408 CE2 PHE A 28 59.746 -3.386 -0.707 1.00 0.00 C ATOM 409 CZ PHE A 28 59.395 -4.322 0.270 1.00 0.00 C ATOM 0 H PHE A 28 62.863 -1.904 2.618 1.00 0.00 H new ATOM 0 HA PHE A 28 62.474 -0.452 0.884 1.00 0.00 H new ATOM 0 HB2 PHE A 28 59.790 0.014 2.272 1.00 0.00 H new ATOM 0 HB3 PHE A 28 60.161 0.397 0.602 1.00 0.00 H new ATOM 0 HD1 PHE A 28 59.670 -2.354 3.032 1.00 0.00 H new ATOM 0 HD2 PHE A 28 60.346 -1.353 -1.090 1.00 0.00 H new ATOM 0 HE1 PHE A 28 59.099 -4.675 2.373 1.00 0.00 H new ATOM 0 HE2 PHE A 28 59.765 -3.673 -1.748 1.00 0.00 H new ATOM 0 HZ PHE A 28 59.144 -5.332 -0.017 1.00 0.00 H new ATOM 419 N GLU A 29 61.474 2.195 1.799 1.00 0.00 N ATOM 420 CA GLU A 29 61.770 3.587 2.224 1.00 0.00 C ATOM 421 C GLU A 29 60.814 4.553 1.536 1.00 0.00 C ATOM 422 O GLU A 29 61.196 5.606 1.069 1.00 0.00 O ATOM 423 CB GLU A 29 63.209 3.922 1.863 1.00 0.00 C ATOM 424 CG GLU A 29 63.455 3.573 0.395 1.00 0.00 C ATOM 425 CD GLU A 29 64.242 4.702 -0.274 1.00 0.00 C ATOM 426 OE1 GLU A 29 63.629 5.692 -0.637 1.00 0.00 O ATOM 427 OE2 GLU A 29 65.446 4.556 -0.412 1.00 0.00 O ATOM 0 H GLU A 29 60.675 2.090 1.174 1.00 0.00 H new ATOM 0 HA GLU A 29 61.638 3.679 3.302 1.00 0.00 H new ATOM 0 HB2 GLU A 29 63.402 4.981 2.034 1.00 0.00 H new ATOM 0 HB3 GLU A 29 63.895 3.365 2.501 1.00 0.00 H new ATOM 0 HG2 GLU A 29 64.008 2.637 0.321 1.00 0.00 H new ATOM 0 HG3 GLU A 29 62.505 3.424 -0.118 1.00 0.00 H new ATOM 434 N THR A 30 59.567 4.195 1.513 1.00 0.00 N ATOM 435 CA THR A 30 58.525 5.067 0.896 1.00 0.00 C ATOM 436 C THR A 30 59.072 5.776 -0.351 1.00 0.00 C ATOM 437 O THR A 30 60.067 5.376 -0.923 1.00 0.00 O ATOM 438 CB THR A 30 58.092 6.102 1.933 1.00 0.00 C ATOM 439 OG1 THR A 30 59.223 6.856 2.348 1.00 0.00 O ATOM 440 CG2 THR A 30 57.488 5.381 3.138 1.00 0.00 C ATOM 0 H THR A 30 59.214 3.320 1.901 1.00 0.00 H new ATOM 0 HA THR A 30 57.676 4.456 0.588 1.00 0.00 H new ATOM 0 HB THR A 30 57.351 6.772 1.498 1.00 0.00 H new ATOM 0 HG1 THR A 30 59.951 6.737 1.702 1.00 0.00 H new ATOM 0 HG21 THR A 30 57.177 6.114 3.882 1.00 0.00 H new ATOM 0 HG22 THR A 30 56.624 4.799 2.818 1.00 0.00 H new ATOM 0 HG23 THR A 30 58.232 4.715 3.574 1.00 0.00 H new ATOM 448 N SER A 31 58.419 6.828 -0.779 1.00 0.00 N ATOM 449 CA SER A 31 58.891 7.567 -1.986 1.00 0.00 C ATOM 450 C SER A 31 58.366 9.011 -1.935 1.00 0.00 C ATOM 451 O SER A 31 58.740 9.772 -1.071 1.00 0.00 O ATOM 452 CB SER A 31 58.383 6.866 -3.246 1.00 0.00 C ATOM 453 OG SER A 31 58.809 5.510 -3.235 1.00 0.00 O ATOM 0 H SER A 31 57.578 7.206 -0.342 1.00 0.00 H new ATOM 0 HA SER A 31 59.981 7.583 -2.006 1.00 0.00 H new ATOM 0 HB2 SER A 31 57.295 6.917 -3.290 1.00 0.00 H new ATOM 0 HB3 SER A 31 58.762 7.371 -4.135 1.00 0.00 H new ATOM 0 HG SER A 31 59.548 5.404 -2.600 1.00 0.00 H new ATOM 459 N SER A 32 57.505 9.402 -2.844 1.00 0.00 N ATOM 460 CA SER A 32 56.977 10.799 -2.816 1.00 0.00 C ATOM 461 C SER A 32 55.578 10.808 -2.197 1.00 0.00 C ATOM 462 O SER A 32 55.142 9.836 -1.615 1.00 0.00 O ATOM 463 CB SER A 32 56.913 11.350 -4.240 1.00 0.00 C ATOM 464 OG SER A 32 57.852 12.408 -4.376 1.00 0.00 O ATOM 0 H SER A 32 57.148 8.817 -3.599 1.00 0.00 H new ATOM 0 HA SER A 32 57.639 11.424 -2.216 1.00 0.00 H new ATOM 0 HB2 SER A 32 57.131 10.560 -4.958 1.00 0.00 H new ATOM 0 HB3 SER A 32 55.908 11.710 -4.458 1.00 0.00 H new ATOM 0 HG SER A 32 57.815 12.763 -5.289 1.00 0.00 H new ATOM 470 N GLN A 33 54.872 11.902 -2.317 1.00 0.00 N ATOM 471 CA GLN A 33 53.501 11.975 -1.731 1.00 0.00 C ATOM 472 C GLN A 33 53.544 11.459 -0.294 1.00 0.00 C ATOM 473 O GLN A 33 53.476 10.274 -0.057 1.00 0.00 O ATOM 474 CB GLN A 33 52.544 11.111 -2.554 1.00 0.00 C ATOM 475 CG GLN A 33 52.609 11.539 -4.020 1.00 0.00 C ATOM 476 CD GLN A 33 52.025 12.945 -4.166 1.00 0.00 C ATOM 477 OE1 GLN A 33 51.242 13.378 -3.345 1.00 0.00 O ATOM 478 NE2 GLN A 33 52.377 13.684 -5.182 1.00 0.00 N ATOM 0 H GLN A 33 55.185 12.747 -2.795 1.00 0.00 H new ATOM 0 HA GLN A 33 53.153 13.008 -1.742 1.00 0.00 H new ATOM 0 HB2 GLN A 33 52.812 10.059 -2.458 1.00 0.00 H new ATOM 0 HB3 GLN A 33 51.526 11.216 -2.178 1.00 0.00 H new ATOM 0 HG2 GLN A 33 53.642 11.524 -4.369 1.00 0.00 H new ATOM 0 HG3 GLN A 33 52.053 10.836 -4.640 1.00 0.00 H new ATOM 0 HE21 GLN A 33 53.035 13.322 -5.873 1.00 0.00 H new ATOM 0 HE22 GLN A 33 51.995 14.624 -5.286 1.00 0.00 H new ATOM 487 N CYS A 34 53.670 12.348 0.662 1.00 0.00 N ATOM 488 CA CYS A 34 53.742 11.935 2.103 1.00 0.00 C ATOM 489 C CYS A 34 54.828 10.868 2.258 1.00 0.00 C ATOM 490 O CYS A 34 55.957 11.177 2.586 1.00 0.00 O ATOM 491 CB CYS A 34 52.400 11.378 2.620 1.00 0.00 C ATOM 492 SG CYS A 34 51.106 11.484 1.357 1.00 0.00 S ATOM 0 H CYS A 34 53.727 13.354 0.505 1.00 0.00 H new ATOM 0 HA CYS A 34 53.978 12.820 2.695 1.00 0.00 H new ATOM 0 HB2 CYS A 34 52.529 10.339 2.924 1.00 0.00 H new ATOM 0 HB3 CYS A 34 52.092 11.933 3.506 1.00 0.00 H new ATOM 497 N SER A 35 54.498 9.621 2.017 1.00 0.00 N ATOM 498 CA SER A 35 55.507 8.527 2.132 1.00 0.00 C ATOM 499 C SER A 35 56.871 9.041 1.664 1.00 0.00 C ATOM 500 O SER A 35 57.112 9.199 0.485 1.00 0.00 O ATOM 501 CB SER A 35 55.073 7.352 1.249 1.00 0.00 C ATOM 502 OG SER A 35 53.911 7.718 0.516 1.00 0.00 O ATOM 0 H SER A 35 53.564 9.315 1.743 1.00 0.00 H new ATOM 0 HA SER A 35 55.581 8.200 3.169 1.00 0.00 H new ATOM 0 HB2 SER A 35 55.877 7.080 0.565 1.00 0.00 H new ATOM 0 HB3 SER A 35 54.868 6.476 1.865 1.00 0.00 H new ATOM 0 HG SER A 35 54.121 8.471 -0.075 1.00 0.00 H new ATOM 508 N LYS A 36 57.759 9.316 2.580 1.00 0.00 N ATOM 509 CA LYS A 36 59.099 9.832 2.184 1.00 0.00 C ATOM 510 C LYS A 36 60.017 9.894 3.417 1.00 0.00 C ATOM 511 O LYS A 36 61.056 9.263 3.430 1.00 0.00 O ATOM 512 CB LYS A 36 58.932 11.222 1.537 1.00 0.00 C ATOM 513 CG LYS A 36 60.102 12.147 1.901 1.00 0.00 C ATOM 514 CD LYS A 36 61.424 11.465 1.540 1.00 0.00 C ATOM 515 CE LYS A 36 62.089 12.216 0.385 1.00 0.00 C ATOM 516 NZ LYS A 36 62.644 11.236 -0.591 1.00 0.00 N ATOM 0 H LYS A 36 57.614 9.206 3.584 1.00 0.00 H new ATOM 0 HA LYS A 36 59.561 9.164 1.457 1.00 0.00 H new ATOM 0 HB2 LYS A 36 58.871 11.117 0.454 1.00 0.00 H new ATOM 0 HB3 LYS A 36 57.995 11.670 1.867 1.00 0.00 H new ATOM 0 HG2 LYS A 36 60.011 13.093 1.367 1.00 0.00 H new ATOM 0 HG3 LYS A 36 60.079 12.378 2.966 1.00 0.00 H new ATOM 0 HD2 LYS A 36 62.086 11.450 2.406 1.00 0.00 H new ATOM 0 HD3 LYS A 36 61.245 10.428 1.257 1.00 0.00 H new ATOM 0 HE2 LYS A 36 61.364 12.864 -0.107 1.00 0.00 H new ATOM 0 HE3 LYS A 36 62.884 12.858 0.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 63.096 11.746 -1.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 63.348 10.635 -0.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 61.875 10.642 -0.961 1.00 0.00 H new ATOM 530 N PRO A 37 59.617 10.647 4.418 1.00 0.00 N ATOM 531 CA PRO A 37 60.405 10.787 5.659 1.00 0.00 C ATOM 532 C PRO A 37 60.197 9.576 6.576 1.00 0.00 C ATOM 533 O PRO A 37 60.124 9.709 7.780 1.00 0.00 O ATOM 534 CB PRO A 37 59.827 12.044 6.312 1.00 0.00 C ATOM 535 CG PRO A 37 58.401 12.216 5.738 1.00 0.00 C ATOM 536 CD PRO A 37 58.362 11.432 4.413 1.00 0.00 C ATOM 0 HA PRO A 37 61.477 10.852 5.470 1.00 0.00 H new ATOM 0 HB2 PRO A 37 59.799 11.941 7.397 1.00 0.00 H new ATOM 0 HB3 PRO A 37 60.443 12.915 6.090 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.654 11.836 6.435 1.00 0.00 H new ATOM 0 HG3 PRO A 37 58.175 13.269 5.572 1.00 0.00 H new ATOM 0 HD2 PRO A 37 57.487 10.784 4.359 1.00 0.00 H new ATOM 0 HD3 PRO A 37 58.315 12.102 3.555 1.00 0.00 H new ATOM 544 N GLY A 38 60.099 8.396 6.026 1.00 0.00 N ATOM 545 CA GLY A 38 59.893 7.200 6.884 1.00 0.00 C ATOM 546 C GLY A 38 60.302 5.939 6.121 1.00 0.00 C ATOM 547 O GLY A 38 61.361 5.871 5.532 1.00 0.00 O ATOM 0 H GLY A 38 60.153 8.211 5.024 1.00 0.00 H new ATOM 0 HA2 GLY A 38 60.481 7.290 7.797 1.00 0.00 H new ATOM 0 HA3 GLY A 38 58.847 7.132 7.184 1.00 0.00 H new ATOM 551 N VAL A 39 59.464 4.941 6.144 1.00 0.00 N ATOM 552 CA VAL A 39 59.779 3.666 5.443 1.00 0.00 C ATOM 553 C VAL A 39 58.637 2.680 5.724 1.00 0.00 C ATOM 554 O VAL A 39 57.694 3.001 6.412 1.00 0.00 O ATOM 555 CB VAL A 39 61.105 3.116 5.997 1.00 0.00 C ATOM 556 CG1 VAL A 39 60.856 2.427 7.344 1.00 0.00 C ATOM 557 CG2 VAL A 39 61.723 2.114 5.010 1.00 0.00 C ATOM 0 H VAL A 39 58.564 4.955 6.624 1.00 0.00 H new ATOM 0 HA VAL A 39 59.879 3.818 4.368 1.00 0.00 H new ATOM 0 HB VAL A 39 61.798 3.946 6.135 1.00 0.00 H new ATOM 0 HG11 VAL A 39 61.797 2.039 7.733 1.00 0.00 H new ATOM 0 HG12 VAL A 39 60.441 3.147 8.049 1.00 0.00 H new ATOM 0 HG13 VAL A 39 60.153 1.605 7.208 1.00 0.00 H new ATOM 0 HG21 VAL A 39 62.660 1.734 5.416 1.00 0.00 H new ATOM 0 HG22 VAL A 39 61.033 1.285 4.853 1.00 0.00 H new ATOM 0 HG23 VAL A 39 61.915 2.611 4.059 1.00 0.00 H new ATOM 567 N ILE A 40 58.715 1.488 5.213 1.00 0.00 N ATOM 568 CA ILE A 40 57.639 0.492 5.479 1.00 0.00 C ATOM 569 C ILE A 40 58.288 -0.869 5.726 1.00 0.00 C ATOM 570 O ILE A 40 59.026 -1.379 4.907 1.00 0.00 O ATOM 571 CB ILE A 40 56.677 0.441 4.290 1.00 0.00 C ATOM 572 CG1 ILE A 40 55.630 1.538 4.474 1.00 0.00 C ATOM 573 CG2 ILE A 40 55.978 -0.922 4.222 1.00 0.00 C ATOM 574 CD1 ILE A 40 54.874 1.745 3.168 1.00 0.00 C ATOM 0 H ILE A 40 59.477 1.157 4.621 1.00 0.00 H new ATOM 0 HA ILE A 40 57.064 0.776 6.360 1.00 0.00 H new ATOM 0 HB ILE A 40 57.233 0.590 3.365 1.00 0.00 H new ATOM 0 HG12 ILE A 40 54.936 1.263 5.268 1.00 0.00 H new ATOM 0 HG13 ILE A 40 56.111 2.467 4.779 1.00 0.00 H new ATOM 0 HG21 ILE A 40 55.298 -0.940 3.370 1.00 0.00 H new ATOM 0 HG22 ILE A 40 56.724 -1.708 4.107 1.00 0.00 H new ATOM 0 HG23 ILE A 40 55.414 -1.088 5.140 1.00 0.00 H new ATOM 0 HD11 ILE A 40 54.127 2.528 3.300 1.00 0.00 H new ATOM 0 HD12 ILE A 40 55.573 2.039 2.385 1.00 0.00 H new ATOM 0 HD13 ILE A 40 54.380 0.816 2.883 1.00 0.00 H new ATOM 586 N PHE A 41 58.036 -1.447 6.862 1.00 0.00 N ATOM 587 CA PHE A 41 58.662 -2.755 7.184 1.00 0.00 C ATOM 588 C PHE A 41 57.685 -3.900 6.943 1.00 0.00 C ATOM 589 O PHE A 41 56.523 -3.700 6.654 1.00 0.00 O ATOM 590 CB PHE A 41 59.077 -2.755 8.654 1.00 0.00 C ATOM 591 CG PHE A 41 60.363 -1.986 8.803 1.00 0.00 C ATOM 592 CD1 PHE A 41 61.568 -2.561 8.389 1.00 0.00 C ATOM 593 CD2 PHE A 41 60.351 -0.696 9.346 1.00 0.00 C ATOM 594 CE1 PHE A 41 62.765 -1.849 8.520 1.00 0.00 C ATOM 595 CE2 PHE A 41 61.548 0.017 9.476 1.00 0.00 C ATOM 596 CZ PHE A 41 62.754 -0.560 9.063 1.00 0.00 C ATOM 0 H PHE A 41 57.422 -1.070 7.584 1.00 0.00 H new ATOM 0 HA PHE A 41 59.529 -2.897 6.539 1.00 0.00 H new ATOM 0 HB2 PHE A 41 58.296 -2.303 9.265 1.00 0.00 H new ATOM 0 HB3 PHE A 41 59.207 -3.778 9.008 1.00 0.00 H new ATOM 0 HD1 PHE A 41 61.575 -3.555 7.968 1.00 0.00 H new ATOM 0 HD2 PHE A 41 59.419 -0.252 9.664 1.00 0.00 H new ATOM 0 HE1 PHE A 41 63.696 -2.294 8.202 1.00 0.00 H new ATOM 0 HE2 PHE A 41 61.541 1.012 9.895 1.00 0.00 H new ATOM 0 HZ PHE A 41 63.678 -0.009 9.164 1.00 0.00 H new ATOM 606 N LEU A 42 58.163 -5.103 7.072 1.00 0.00 N ATOM 607 CA LEU A 42 57.301 -6.289 6.871 1.00 0.00 C ATOM 608 C LEU A 42 57.639 -7.312 7.948 1.00 0.00 C ATOM 609 O LEU A 42 58.080 -8.409 7.668 1.00 0.00 O ATOM 610 CB LEU A 42 57.581 -6.885 5.497 1.00 0.00 C ATOM 611 CG LEU A 42 56.557 -6.357 4.497 1.00 0.00 C ATOM 612 CD1 LEU A 42 57.287 -5.811 3.273 1.00 0.00 C ATOM 613 CD2 LEU A 42 55.625 -7.496 4.072 1.00 0.00 C ATOM 0 H LEU A 42 59.131 -5.314 7.312 1.00 0.00 H new ATOM 0 HA LEU A 42 56.249 -6.011 6.934 1.00 0.00 H new ATOM 0 HB2 LEU A 42 58.589 -6.624 5.174 1.00 0.00 H new ATOM 0 HB3 LEU A 42 57.533 -7.973 5.544 1.00 0.00 H new ATOM 0 HG LEU A 42 55.970 -5.563 4.957 1.00 0.00 H new ATOM 0 HD11 LEU A 42 56.560 -5.432 2.555 1.00 0.00 H new ATOM 0 HD12 LEU A 42 57.952 -5.003 3.577 1.00 0.00 H new ATOM 0 HD13 LEU A 42 57.871 -6.608 2.812 1.00 0.00 H new ATOM 0 HD21 LEU A 42 54.893 -7.120 3.357 1.00 0.00 H new ATOM 0 HD22 LEU A 42 56.210 -8.291 3.608 1.00 0.00 H new ATOM 0 HD23 LEU A 42 55.108 -7.889 4.948 1.00 0.00 H new ATOM 625 N THR A 43 57.448 -6.947 9.179 1.00 0.00 N ATOM 626 CA THR A 43 57.766 -7.877 10.295 1.00 0.00 C ATOM 627 C THR A 43 57.269 -9.282 9.951 1.00 0.00 C ATOM 628 O THR A 43 56.514 -9.477 9.020 1.00 0.00 O ATOM 629 CB THR A 43 57.086 -7.384 11.574 1.00 0.00 C ATOM 630 OG1 THR A 43 55.699 -7.697 11.522 1.00 0.00 O ATOM 631 CG2 THR A 43 57.274 -5.868 11.705 1.00 0.00 C ATOM 0 H THR A 43 57.083 -6.038 9.465 1.00 0.00 H new ATOM 0 HA THR A 43 58.845 -7.909 10.448 1.00 0.00 H new ATOM 0 HB THR A 43 57.534 -7.874 12.438 1.00 0.00 H new ATOM 0 HG1 THR A 43 55.362 -7.842 12.431 1.00 0.00 H new ATOM 0 HG21 THR A 43 56.789 -5.519 12.616 1.00 0.00 H new ATOM 0 HG22 THR A 43 58.338 -5.636 11.748 1.00 0.00 H new ATOM 0 HG23 THR A 43 56.829 -5.370 10.844 1.00 0.00 H new ATOM 639 N LYS A 44 57.690 -10.263 10.699 1.00 0.00 N ATOM 640 CA LYS A 44 57.250 -11.658 10.419 1.00 0.00 C ATOM 641 C LYS A 44 55.770 -11.805 10.778 1.00 0.00 C ATOM 642 O LYS A 44 55.109 -12.733 10.358 1.00 0.00 O ATOM 643 CB LYS A 44 58.084 -12.635 11.253 1.00 0.00 C ATOM 644 CG LYS A 44 59.538 -12.155 11.306 1.00 0.00 C ATOM 645 CD LYS A 44 60.008 -11.772 9.899 1.00 0.00 C ATOM 646 CE LYS A 44 61.268 -12.567 9.549 1.00 0.00 C ATOM 647 NZ LYS A 44 60.970 -13.500 8.426 1.00 0.00 N ATOM 0 H LYS A 44 58.321 -10.159 11.494 1.00 0.00 H new ATOM 0 HA LYS A 44 57.389 -11.880 9.361 1.00 0.00 H new ATOM 0 HB2 LYS A 44 57.677 -12.707 12.262 1.00 0.00 H new ATOM 0 HB3 LYS A 44 58.036 -13.633 10.818 1.00 0.00 H new ATOM 0 HG2 LYS A 44 59.624 -11.298 11.974 1.00 0.00 H new ATOM 0 HG3 LYS A 44 60.176 -12.941 11.711 1.00 0.00 H new ATOM 0 HD2 LYS A 44 59.222 -11.978 9.173 1.00 0.00 H new ATOM 0 HD3 LYS A 44 60.214 -10.703 9.851 1.00 0.00 H new ATOM 0 HE2 LYS A 44 62.073 -11.888 9.268 1.00 0.00 H new ATOM 0 HE3 LYS A 44 61.612 -13.126 10.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 61.826 -14.041 8.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 60.214 -14.156 8.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 60.662 -12.956 7.595 1.00 0.00 H new ATOM 661 N ARG A 45 55.244 -10.891 11.544 1.00 0.00 N ATOM 662 CA ARG A 45 53.806 -10.972 11.919 1.00 0.00 C ATOM 663 C ARG A 45 52.979 -10.201 10.892 1.00 0.00 C ATOM 664 O ARG A 45 51.858 -9.811 11.146 1.00 0.00 O ATOM 665 CB ARG A 45 53.602 -10.358 13.305 1.00 0.00 C ATOM 666 CG ARG A 45 54.729 -10.807 14.235 1.00 0.00 C ATOM 667 CD ARG A 45 54.597 -12.307 14.505 1.00 0.00 C ATOM 668 NE ARG A 45 54.132 -12.518 15.904 1.00 0.00 N ATOM 669 CZ ARG A 45 53.472 -13.602 16.214 1.00 0.00 C ATOM 670 NH1 ARG A 45 52.269 -13.790 15.748 1.00 0.00 N ATOM 671 NH2 ARG A 45 54.019 -14.497 16.992 1.00 0.00 N ATOM 0 H ARG A 45 55.748 -10.091 11.927 1.00 0.00 H new ATOM 0 HA ARG A 45 53.490 -12.015 11.939 1.00 0.00 H new ATOM 0 HB2 ARG A 45 53.587 -9.270 13.234 1.00 0.00 H new ATOM 0 HB3 ARG A 45 52.638 -10.664 13.711 1.00 0.00 H new ATOM 0 HG2 ARG A 45 55.697 -10.591 13.782 1.00 0.00 H new ATOM 0 HG3 ARG A 45 54.685 -10.252 15.172 1.00 0.00 H new ATOM 0 HD2 ARG A 45 53.891 -12.753 13.804 1.00 0.00 H new ATOM 0 HD3 ARG A 45 55.556 -12.802 14.350 1.00 0.00 H new ATOM 0 HE ARG A 45 54.328 -11.817 16.619 1.00 0.00 H new ATOM 0 HH11 ARG A 45 51.842 -13.090 15.141 1.00 0.00 H new ATOM 0 HH12 ARG A 45 51.755 -14.637 15.991 1.00 0.00 H new ATOM 0 HH21 ARG A 45 54.960 -14.349 17.357 1.00 0.00 H new ATOM 0 HH22 ARG A 45 53.505 -15.344 17.235 1.00 0.00 H new ATOM 685 N SER A 46 53.528 -9.974 9.729 1.00 0.00 N ATOM 686 CA SER A 46 52.775 -9.223 8.687 1.00 0.00 C ATOM 687 C SER A 46 52.328 -7.880 9.263 1.00 0.00 C ATOM 688 O SER A 46 51.225 -7.430 9.029 1.00 0.00 O ATOM 689 CB SER A 46 51.548 -10.031 8.265 1.00 0.00 C ATOM 690 OG SER A 46 51.872 -10.813 7.122 1.00 0.00 O ATOM 0 H SER A 46 54.464 -10.276 9.457 1.00 0.00 H new ATOM 0 HA SER A 46 53.414 -9.056 7.820 1.00 0.00 H new ATOM 0 HB2 SER A 46 51.224 -10.676 9.082 1.00 0.00 H new ATOM 0 HB3 SER A 46 50.718 -9.362 8.039 1.00 0.00 H new ATOM 0 HG SER A 46 51.088 -11.334 6.849 1.00 0.00 H new ATOM 696 N ARG A 47 53.174 -7.239 10.023 1.00 0.00 N ATOM 697 CA ARG A 47 52.788 -5.927 10.619 1.00 0.00 C ATOM 698 C ARG A 47 53.586 -4.802 9.958 1.00 0.00 C ATOM 699 O ARG A 47 54.593 -4.359 10.471 1.00 0.00 O ATOM 700 CB ARG A 47 53.084 -5.946 12.120 1.00 0.00 C ATOM 701 CG ARG A 47 51.836 -5.515 12.894 1.00 0.00 C ATOM 702 CD ARG A 47 52.246 -4.622 14.067 1.00 0.00 C ATOM 703 NE ARG A 47 51.026 -4.080 14.730 1.00 0.00 N ATOM 704 CZ ARG A 47 51.138 -3.158 15.647 1.00 0.00 C ATOM 705 NH1 ARG A 47 52.060 -2.240 15.539 1.00 0.00 N ATOM 706 NH2 ARG A 47 50.330 -3.154 16.672 1.00 0.00 N ATOM 0 H ARG A 47 54.112 -7.565 10.257 1.00 0.00 H new ATOM 0 HA ARG A 47 51.724 -5.756 10.456 1.00 0.00 H new ATOM 0 HB2 ARG A 47 53.388 -6.946 12.428 1.00 0.00 H new ATOM 0 HB3 ARG A 47 53.914 -5.276 12.346 1.00 0.00 H new ATOM 0 HG2 ARG A 47 51.154 -4.978 12.235 1.00 0.00 H new ATOM 0 HG3 ARG A 47 51.301 -6.392 13.260 1.00 0.00 H new ATOM 0 HD2 ARG A 47 52.838 -5.192 14.782 1.00 0.00 H new ATOM 0 HD3 ARG A 47 52.874 -3.804 13.713 1.00 0.00 H new ATOM 0 HE ARG A 47 50.104 -4.429 14.467 1.00 0.00 H new ATOM 0 HH11 ARG A 47 52.692 -2.244 14.738 1.00 0.00 H new ATOM 0 HH12 ARG A 47 52.148 -1.519 16.255 1.00 0.00 H new ATOM 0 HH21 ARG A 47 49.610 -3.872 16.757 1.00 0.00 H new ATOM 0 HH22 ARG A 47 50.418 -2.433 17.388 1.00 0.00 H new ATOM 720 N GLN A 48 53.140 -4.330 8.826 1.00 0.00 N ATOM 721 CA GLN A 48 53.873 -3.228 8.142 1.00 0.00 C ATOM 722 C GLN A 48 53.872 -1.992 9.044 1.00 0.00 C ATOM 723 O GLN A 48 52.849 -1.603 9.573 1.00 0.00 O ATOM 724 CB GLN A 48 53.187 -2.900 6.809 1.00 0.00 C ATOM 725 CG GLN A 48 51.942 -2.039 7.057 1.00 0.00 C ATOM 726 CD GLN A 48 52.336 -0.561 7.050 1.00 0.00 C ATOM 727 OE1 GLN A 48 53.237 -0.164 6.336 1.00 0.00 O ATOM 728 NE2 GLN A 48 51.698 0.279 7.820 1.00 0.00 N ATOM 0 H GLN A 48 52.302 -4.659 8.347 1.00 0.00 H new ATOM 0 HA GLN A 48 54.900 -3.536 7.945 1.00 0.00 H new ATOM 0 HB2 GLN A 48 53.880 -2.372 6.154 1.00 0.00 H new ATOM 0 HB3 GLN A 48 52.906 -3.821 6.299 1.00 0.00 H new ATOM 0 HG2 GLN A 48 51.194 -2.231 6.287 1.00 0.00 H new ATOM 0 HG3 GLN A 48 51.490 -2.301 8.013 1.00 0.00 H new ATOM 0 HE21 GLN A 48 50.942 -0.052 8.420 1.00 0.00 H new ATOM 0 HE22 GLN A 48 51.956 1.266 7.822 1.00 0.00 H new ATOM 737 N VAL A 49 55.003 -1.371 9.231 1.00 0.00 N ATOM 738 CA VAL A 49 55.044 -0.167 10.107 1.00 0.00 C ATOM 739 C VAL A 49 55.933 0.906 9.479 1.00 0.00 C ATOM 740 O VAL A 49 56.883 0.610 8.781 1.00 0.00 O ATOM 741 CB VAL A 49 55.617 -0.555 11.473 1.00 0.00 C ATOM 742 CG1 VAL A 49 55.157 0.449 12.532 1.00 0.00 C ATOM 743 CG2 VAL A 49 55.132 -1.956 11.852 1.00 0.00 C ATOM 0 H VAL A 49 55.895 -1.643 8.818 1.00 0.00 H new ATOM 0 HA VAL A 49 54.033 0.225 10.223 1.00 0.00 H new ATOM 0 HB VAL A 49 56.706 -0.548 11.421 1.00 0.00 H new ATOM 0 HG11 VAL A 49 55.567 0.168 13.502 1.00 0.00 H new ATOM 0 HG12 VAL A 49 55.507 1.446 12.265 1.00 0.00 H new ATOM 0 HG13 VAL A 49 54.068 0.449 12.585 1.00 0.00 H new ATOM 0 HG21 VAL A 49 55.540 -2.232 12.824 1.00 0.00 H new ATOM 0 HG22 VAL A 49 54.043 -1.963 11.900 1.00 0.00 H new ATOM 0 HG23 VAL A 49 55.467 -2.672 11.102 1.00 0.00 H new ATOM 753 N CYS A 50 55.650 2.152 9.746 1.00 0.00 N ATOM 754 CA CYS A 50 56.491 3.241 9.198 1.00 0.00 C ATOM 755 C CYS A 50 57.503 3.611 10.277 1.00 0.00 C ATOM 756 O CYS A 50 57.245 3.443 11.453 1.00 0.00 O ATOM 757 CB CYS A 50 55.617 4.450 8.843 1.00 0.00 C ATOM 758 SG CYS A 50 56.599 5.655 7.917 1.00 0.00 S ATOM 0 H CYS A 50 54.867 2.459 10.324 1.00 0.00 H new ATOM 0 HA CYS A 50 57.001 2.923 8.288 1.00 0.00 H new ATOM 0 HB2 CYS A 50 54.760 4.131 8.250 1.00 0.00 H new ATOM 0 HB3 CYS A 50 55.224 4.907 9.751 1.00 0.00 H new ATOM 763 N ALA A 51 58.658 4.073 9.912 1.00 0.00 N ATOM 764 CA ALA A 51 59.661 4.397 10.959 1.00 0.00 C ATOM 765 C ALA A 51 60.242 5.793 10.746 1.00 0.00 C ATOM 766 O ALA A 51 60.354 6.273 9.635 1.00 0.00 O ATOM 767 CB ALA A 51 60.784 3.363 10.900 1.00 0.00 C ATOM 0 H ALA A 51 58.951 4.240 8.949 1.00 0.00 H new ATOM 0 HA ALA A 51 59.174 4.376 11.934 1.00 0.00 H new ATOM 0 HB1 ALA A 51 61.528 3.589 11.664 1.00 0.00 H new ATOM 0 HB2 ALA A 51 60.373 2.369 11.077 1.00 0.00 H new ATOM 0 HB3 ALA A 51 61.254 3.392 9.917 1.00 0.00 H new ATOM 773 N ASP A 52 60.624 6.438 11.815 1.00 0.00 N ATOM 774 CA ASP A 52 61.216 7.798 11.704 1.00 0.00 C ATOM 775 C ASP A 52 62.194 7.821 10.530 1.00 0.00 C ATOM 776 O ASP A 52 62.668 6.789 10.107 1.00 0.00 O ATOM 777 CB ASP A 52 61.968 8.118 13.001 1.00 0.00 C ATOM 778 CG ASP A 52 61.380 9.378 13.640 1.00 0.00 C ATOM 779 OD1 ASP A 52 60.252 9.313 14.100 1.00 0.00 O ATOM 780 OD2 ASP A 52 62.067 10.386 13.660 1.00 0.00 O ATOM 0 H ASP A 52 60.550 6.077 12.766 1.00 0.00 H new ATOM 0 HA ASP A 52 60.432 8.537 11.541 1.00 0.00 H new ATOM 0 HB2 ASP A 52 61.893 7.279 13.693 1.00 0.00 H new ATOM 0 HB3 ASP A 52 63.028 8.265 12.792 1.00 0.00 H new ATOM 785 N PRO A 53 62.476 8.996 10.041 1.00 0.00 N ATOM 786 CA PRO A 53 63.412 9.172 8.923 1.00 0.00 C ATOM 787 C PRO A 53 64.854 9.059 9.430 1.00 0.00 C ATOM 788 O PRO A 53 65.799 9.093 8.668 1.00 0.00 O ATOM 789 CB PRO A 53 63.114 10.586 8.421 1.00 0.00 C ATOM 790 CG PRO A 53 62.450 11.334 9.603 1.00 0.00 C ATOM 791 CD PRO A 53 61.892 10.254 10.549 1.00 0.00 C ATOM 0 HA PRO A 53 63.300 8.422 8.140 1.00 0.00 H new ATOM 0 HB2 PRO A 53 64.029 11.088 8.107 1.00 0.00 H new ATOM 0 HB3 PRO A 53 62.452 10.560 7.556 1.00 0.00 H new ATOM 0 HG2 PRO A 53 63.175 11.964 10.119 1.00 0.00 H new ATOM 0 HG3 PRO A 53 61.653 11.988 9.249 1.00 0.00 H new ATOM 0 HD2 PRO A 53 62.183 10.440 11.583 1.00 0.00 H new ATOM 0 HD3 PRO A 53 60.803 10.227 10.525 1.00 0.00 H new ATOM 799 N SER A 54 65.025 8.921 10.721 1.00 0.00 N ATOM 800 CA SER A 54 66.396 8.800 11.289 1.00 0.00 C ATOM 801 C SER A 54 66.392 7.724 12.378 1.00 0.00 C ATOM 802 O SER A 54 66.975 7.886 13.432 1.00 0.00 O ATOM 803 CB SER A 54 66.823 10.140 11.889 1.00 0.00 C ATOM 804 OG SER A 54 68.230 10.139 12.094 1.00 0.00 O ATOM 0 H SER A 54 64.270 8.887 11.405 1.00 0.00 H new ATOM 0 HA SER A 54 67.098 8.522 10.502 1.00 0.00 H new ATOM 0 HB2 SER A 54 66.542 10.955 11.222 1.00 0.00 H new ATOM 0 HB3 SER A 54 66.307 10.309 12.834 1.00 0.00 H new ATOM 0 HG SER A 54 68.475 9.390 12.676 1.00 0.00 H new ATOM 810 N GLU A 55 65.732 6.625 12.126 1.00 0.00 N ATOM 811 CA GLU A 55 65.679 5.525 13.140 1.00 0.00 C ATOM 812 C GLU A 55 67.027 4.847 13.231 1.00 0.00 C ATOM 813 O GLU A 55 67.803 4.811 12.296 1.00 0.00 O ATOM 814 CB GLU A 55 64.617 4.470 12.776 1.00 0.00 C ATOM 815 CG GLU A 55 63.638 5.032 11.746 1.00 0.00 C ATOM 816 CD GLU A 55 64.129 4.721 10.324 1.00 0.00 C ATOM 817 OE1 GLU A 55 65.312 4.884 10.072 1.00 0.00 O ATOM 818 OE2 GLU A 55 63.309 4.331 9.508 1.00 0.00 O ATOM 0 H GLU A 55 65.225 6.439 11.261 1.00 0.00 H new ATOM 0 HA GLU A 55 65.412 5.972 14.098 1.00 0.00 H new ATOM 0 HB2 GLU A 55 65.102 3.579 12.377 1.00 0.00 H new ATOM 0 HB3 GLU A 55 64.076 4.165 13.672 1.00 0.00 H new ATOM 0 HG2 GLU A 55 62.649 4.600 11.900 1.00 0.00 H new ATOM 0 HG3 GLU A 55 63.539 6.110 11.877 1.00 0.00 H new ATOM 825 N GLU A 56 67.296 4.316 14.374 1.00 0.00 N ATOM 826 CA GLU A 56 68.581 3.625 14.609 1.00 0.00 C ATOM 827 C GLU A 56 68.435 2.152 14.229 1.00 0.00 C ATOM 828 O GLU A 56 69.272 1.577 13.563 1.00 0.00 O ATOM 829 CB GLU A 56 68.901 3.770 16.088 1.00 0.00 C ATOM 830 CG GLU A 56 70.387 4.091 16.268 1.00 0.00 C ATOM 831 CD GLU A 56 70.849 3.613 17.646 1.00 0.00 C ATOM 832 OE1 GLU A 56 70.251 4.026 18.626 1.00 0.00 O ATOM 833 OE2 GLU A 56 71.795 2.843 17.698 1.00 0.00 O ATOM 0 H GLU A 56 66.667 4.330 15.176 1.00 0.00 H new ATOM 0 HA GLU A 56 69.384 4.052 14.008 1.00 0.00 H new ATOM 0 HB2 GLU A 56 68.293 4.562 16.525 1.00 0.00 H new ATOM 0 HB3 GLU A 56 68.652 2.849 16.615 1.00 0.00 H new ATOM 0 HG2 GLU A 56 70.972 3.605 15.488 1.00 0.00 H new ATOM 0 HG3 GLU A 56 70.553 5.164 16.169 1.00 0.00 H new ATOM 840 N TRP A 57 67.363 1.549 14.648 1.00 0.00 N ATOM 841 CA TRP A 57 67.112 0.119 14.326 1.00 0.00 C ATOM 842 C TRP A 57 66.863 -0.041 12.828 1.00 0.00 C ATOM 843 O TRP A 57 67.125 -1.079 12.255 1.00 0.00 O ATOM 844 CB TRP A 57 65.879 -0.342 15.105 1.00 0.00 C ATOM 845 CG TRP A 57 64.713 0.583 14.859 1.00 0.00 C ATOM 846 CD1 TRP A 57 64.501 1.757 15.496 1.00 0.00 C ATOM 847 CD2 TRP A 57 63.592 0.423 13.942 1.00 0.00 C ATOM 848 NE1 TRP A 57 63.327 2.316 15.041 1.00 0.00 N ATOM 849 CE2 TRP A 57 62.727 1.531 14.083 1.00 0.00 C ATOM 850 CE3 TRP A 57 63.244 -0.563 13.019 1.00 0.00 C ATOM 851 CZ2 TRP A 57 61.560 1.648 13.336 1.00 0.00 C ATOM 852 CZ3 TRP A 57 62.069 -0.455 12.257 1.00 0.00 C ATOM 853 CH2 TRP A 57 61.226 0.650 12.419 1.00 0.00 C ATOM 0 H TRP A 57 66.637 1.993 15.210 1.00 0.00 H new ATOM 0 HA TRP A 57 67.978 -0.482 14.602 1.00 0.00 H new ATOM 0 HB2 TRP A 57 65.613 -1.356 14.807 1.00 0.00 H new ATOM 0 HB3 TRP A 57 66.107 -0.372 16.171 1.00 0.00 H new ATOM 0 HD1 TRP A 57 65.150 2.188 16.244 1.00 0.00 H new ATOM 0 HE1 TRP A 57 62.949 3.203 15.373 1.00 0.00 H new ATOM 0 HE3 TRP A 57 63.887 -1.421 12.888 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 60.916 2.506 13.464 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 61.816 -1.226 11.545 1.00 0.00 H new ATOM 0 HH2 TRP A 57 60.320 0.730 11.837 1.00 0.00 H new ATOM 864 N VAL A 58 66.357 0.972 12.188 1.00 0.00 N ATOM 865 CA VAL A 58 66.088 0.864 10.729 1.00 0.00 C ATOM 866 C VAL A 58 67.390 1.019 9.944 1.00 0.00 C ATOM 867 O VAL A 58 67.651 0.282 9.021 1.00 0.00 O ATOM 868 CB VAL A 58 65.128 1.968 10.309 1.00 0.00 C ATOM 869 CG1 VAL A 58 64.929 1.914 8.796 1.00 0.00 C ATOM 870 CG2 VAL A 58 63.785 1.774 11.009 1.00 0.00 C ATOM 0 H VAL A 58 66.118 1.869 12.610 1.00 0.00 H new ATOM 0 HA VAL A 58 65.651 -0.113 10.521 1.00 0.00 H new ATOM 0 HB VAL A 58 65.542 2.937 10.589 1.00 0.00 H new ATOM 0 HG11 VAL A 58 64.242 2.703 8.491 1.00 0.00 H new ATOM 0 HG12 VAL A 58 65.888 2.055 8.298 1.00 0.00 H new ATOM 0 HG13 VAL A 58 64.515 0.945 8.518 1.00 0.00 H new ATOM 0 HG21 VAL A 58 63.099 2.566 10.707 1.00 0.00 H new ATOM 0 HG22 VAL A 58 63.367 0.806 10.732 1.00 0.00 H new ATOM 0 HG23 VAL A 58 63.929 1.811 12.089 1.00 0.00 H new ATOM 880 N GLN A 59 68.202 1.978 10.296 1.00 0.00 N ATOM 881 CA GLN A 59 69.486 2.186 9.563 1.00 0.00 C ATOM 882 C GLN A 59 70.130 0.836 9.254 1.00 0.00 C ATOM 883 O GLN A 59 70.714 0.637 8.207 1.00 0.00 O ATOM 884 CB GLN A 59 70.432 3.000 10.442 1.00 0.00 C ATOM 885 CG GLN A 59 69.889 4.422 10.599 1.00 0.00 C ATOM 886 CD GLN A 59 70.512 5.328 9.537 1.00 0.00 C ATOM 887 OE1 GLN A 59 71.607 5.077 9.072 1.00 0.00 O ATOM 888 NE2 GLN A 59 69.856 6.380 9.129 1.00 0.00 N ATOM 0 H GLN A 59 68.032 2.629 11.062 1.00 0.00 H new ATOM 0 HA GLN A 59 69.290 2.715 8.630 1.00 0.00 H new ATOM 0 HB2 GLN A 59 70.533 2.528 11.419 1.00 0.00 H new ATOM 0 HB3 GLN A 59 71.426 3.027 9.997 1.00 0.00 H new ATOM 0 HG2 GLN A 59 68.804 4.421 10.499 1.00 0.00 H new ATOM 0 HG3 GLN A 59 70.117 4.802 11.595 1.00 0.00 H new ATOM 0 HE21 GLN A 59 68.937 6.591 9.519 1.00 0.00 H new ATOM 0 HE22 GLN A 59 70.262 6.991 8.420 1.00 0.00 H new ATOM 897 N LYS A 60 70.033 -0.087 10.163 1.00 0.00 N ATOM 898 CA LYS A 60 70.643 -1.427 9.936 1.00 0.00 C ATOM 899 C LYS A 60 69.710 -2.280 9.073 1.00 0.00 C ATOM 900 O LYS A 60 70.134 -2.929 8.137 1.00 0.00 O ATOM 901 CB LYS A 60 70.857 -2.113 11.291 1.00 0.00 C ATOM 902 CG LYS A 60 71.128 -3.610 11.086 1.00 0.00 C ATOM 903 CD LYS A 60 72.511 -3.959 11.637 1.00 0.00 C ATOM 904 CE LYS A 60 73.475 -4.209 10.476 1.00 0.00 C ATOM 905 NZ LYS A 60 74.371 -3.029 10.313 1.00 0.00 N ATOM 0 H LYS A 60 69.556 0.026 11.058 1.00 0.00 H new ATOM 0 HA LYS A 60 71.598 -1.313 9.423 1.00 0.00 H new ATOM 0 HB2 LYS A 60 71.695 -1.652 11.813 1.00 0.00 H new ATOM 0 HB3 LYS A 60 69.977 -1.977 11.919 1.00 0.00 H new ATOM 0 HG2 LYS A 60 70.364 -4.201 11.591 1.00 0.00 H new ATOM 0 HG3 LYS A 60 71.074 -3.858 10.026 1.00 0.00 H new ATOM 0 HD2 LYS A 60 72.881 -3.146 12.262 1.00 0.00 H new ATOM 0 HD3 LYS A 60 72.449 -4.845 12.269 1.00 0.00 H new ATOM 0 HE2 LYS A 60 74.066 -5.105 10.666 1.00 0.00 H new ATOM 0 HE3 LYS A 60 72.916 -4.385 9.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 75.027 -3.198 9.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 73.799 -2.184 10.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 74.913 -2.881 11.188 1.00 0.00 H new ATOM 919 N TYR A 61 68.451 -2.317 9.404 1.00 0.00 N ATOM 920 CA TYR A 61 67.493 -3.161 8.630 1.00 0.00 C ATOM 921 C TYR A 61 67.336 -2.633 7.196 1.00 0.00 C ATOM 922 O TYR A 61 66.755 -3.281 6.349 1.00 0.00 O ATOM 923 CB TYR A 61 66.144 -3.173 9.361 1.00 0.00 C ATOM 924 CG TYR A 61 66.377 -3.282 10.841 1.00 0.00 C ATOM 925 CD1 TYR A 61 67.585 -3.781 11.332 1.00 0.00 C ATOM 926 CD2 TYR A 61 65.381 -2.875 11.723 1.00 0.00 C ATOM 927 CE1 TYR A 61 67.797 -3.867 12.700 1.00 0.00 C ATOM 928 CE2 TYR A 61 65.593 -2.965 13.095 1.00 0.00 C ATOM 929 CZ TYR A 61 66.802 -3.457 13.590 1.00 0.00 C ATOM 930 OH TYR A 61 67.010 -3.544 14.951 1.00 0.00 O ATOM 0 H TYR A 61 68.040 -1.798 10.180 1.00 0.00 H new ATOM 0 HA TYR A 61 67.877 -4.179 8.561 1.00 0.00 H new ATOM 0 HB2 TYR A 61 65.588 -2.263 9.136 1.00 0.00 H new ATOM 0 HB3 TYR A 61 65.538 -4.010 9.015 1.00 0.00 H new ATOM 0 HD1 TYR A 61 68.355 -4.100 10.646 1.00 0.00 H new ATOM 0 HD2 TYR A 61 64.446 -2.490 11.344 1.00 0.00 H new ATOM 0 HE1 TYR A 61 68.733 -4.252 13.077 1.00 0.00 H new ATOM 0 HE2 TYR A 61 64.819 -2.653 13.780 1.00 0.00 H new ATOM 0 HH TYR A 61 67.261 -2.664 15.300 1.00 0.00 H new ATOM 940 N VAL A 62 67.860 -1.473 6.914 1.00 0.00 N ATOM 941 CA VAL A 62 67.758 -0.912 5.534 1.00 0.00 C ATOM 942 C VAL A 62 69.093 -1.097 4.803 1.00 0.00 C ATOM 943 O VAL A 62 69.210 -0.821 3.625 1.00 0.00 O ATOM 944 CB VAL A 62 67.425 0.577 5.615 1.00 0.00 C ATOM 945 CG1 VAL A 62 67.394 1.172 4.206 1.00 0.00 C ATOM 946 CG2 VAL A 62 66.059 0.750 6.277 1.00 0.00 C ATOM 0 H VAL A 62 68.358 -0.885 7.582 1.00 0.00 H new ATOM 0 HA VAL A 62 66.972 -1.433 4.988 1.00 0.00 H new ATOM 0 HB VAL A 62 68.184 1.092 6.204 1.00 0.00 H new ATOM 0 HG11 VAL A 62 67.156 2.234 4.265 1.00 0.00 H new ATOM 0 HG12 VAL A 62 68.369 1.044 3.735 1.00 0.00 H new ATOM 0 HG13 VAL A 62 66.635 0.663 3.613 1.00 0.00 H new ATOM 0 HG21 VAL A 62 65.816 1.811 6.338 1.00 0.00 H new ATOM 0 HG22 VAL A 62 65.301 0.237 5.686 1.00 0.00 H new ATOM 0 HG23 VAL A 62 66.085 0.326 7.281 1.00 0.00 H new ATOM 956 N SER A 63 70.104 -1.546 5.498 1.00 0.00 N ATOM 957 CA SER A 63 71.437 -1.736 4.863 1.00 0.00 C ATOM 958 C SER A 63 71.283 -2.498 3.549 1.00 0.00 C ATOM 959 O SER A 63 71.821 -2.109 2.531 1.00 0.00 O ATOM 960 CB SER A 63 72.340 -2.529 5.808 1.00 0.00 C ATOM 961 OG SER A 63 73.329 -3.213 5.051 1.00 0.00 O ATOM 0 H SER A 63 70.061 -1.791 6.487 1.00 0.00 H new ATOM 0 HA SER A 63 71.881 -0.761 4.661 1.00 0.00 H new ATOM 0 HB2 SER A 63 72.814 -1.858 6.525 1.00 0.00 H new ATOM 0 HB3 SER A 63 71.748 -3.242 6.382 1.00 0.00 H new ATOM 0 HG SER A 63 73.910 -3.721 5.655 1.00 0.00 H new ATOM 1107 N ASP B 5 48.376 -1.227 11.767 1.00 0.00 N ATOM 1108 CA ASP B 5 49.072 -2.112 10.790 1.00 0.00 C ATOM 1109 C ASP B 5 48.478 -1.899 9.396 1.00 0.00 C ATOM 1110 O ASP B 5 47.813 -2.759 8.857 1.00 0.00 O ATOM 1111 CB ASP B 5 48.886 -3.574 11.208 1.00 0.00 C ATOM 1112 CG ASP B 5 49.306 -4.494 10.058 1.00 0.00 C ATOM 1113 OD1 ASP B 5 50.385 -4.291 9.527 1.00 0.00 O ATOM 1114 OD2 ASP B 5 48.540 -5.384 9.729 1.00 0.00 O ATOM 0 HA ASP B 5 50.135 -1.871 10.771 1.00 0.00 H new ATOM 0 HB2 ASP B 5 49.483 -3.788 12.095 1.00 0.00 H new ATOM 0 HB3 ASP B 5 47.845 -3.758 11.472 1.00 0.00 H new ATOM 1119 N THR B 6 48.713 -0.757 8.807 1.00 0.00 N ATOM 1120 CA THR B 6 48.162 -0.490 7.448 1.00 0.00 C ATOM 1121 C THR B 6 48.674 0.872 6.956 1.00 0.00 C ATOM 1122 O THR B 6 48.683 1.830 7.703 1.00 0.00 O ATOM 1123 CB THR B 6 46.627 -0.470 7.516 1.00 0.00 C ATOM 1124 OG1 THR B 6 46.137 -1.802 7.568 1.00 0.00 O ATOM 1125 CG2 THR B 6 46.056 0.232 6.281 1.00 0.00 C ATOM 0 H THR B 6 49.263 0.002 9.209 1.00 0.00 H new ATOM 0 HA THR B 6 48.483 -1.271 6.759 1.00 0.00 H new ATOM 0 HB THR B 6 46.318 0.071 8.411 1.00 0.00 H new ATOM 0 HG1 THR B 6 46.875 -2.415 7.768 1.00 0.00 H new ATOM 0 HG21 THR B 6 44.968 0.241 6.338 1.00 0.00 H new ATOM 0 HG22 THR B 6 46.426 1.257 6.241 1.00 0.00 H new ATOM 0 HG23 THR B 6 46.368 -0.301 5.383 1.00 0.00 H new ATOM 1133 N PRO B 7 49.077 0.920 5.711 1.00 0.00 N ATOM 1134 CA PRO B 7 49.586 2.155 5.091 1.00 0.00 C ATOM 1135 C PRO B 7 48.419 3.071 4.710 1.00 0.00 C ATOM 1136 O PRO B 7 47.332 2.958 5.243 1.00 0.00 O ATOM 1137 CB PRO B 7 50.322 1.657 3.844 1.00 0.00 C ATOM 1138 CG PRO B 7 49.727 0.267 3.513 1.00 0.00 C ATOM 1139 CD PRO B 7 49.067 -0.248 4.805 1.00 0.00 C ATOM 0 HA PRO B 7 50.230 2.736 5.751 1.00 0.00 H new ATOM 0 HB2 PRO B 7 50.186 2.347 3.011 1.00 0.00 H new ATOM 0 HB3 PRO B 7 51.394 1.587 4.028 1.00 0.00 H new ATOM 0 HG2 PRO B 7 48.996 0.340 2.707 1.00 0.00 H new ATOM 0 HG3 PRO B 7 50.506 -0.417 3.176 1.00 0.00 H new ATOM 0 HD2 PRO B 7 48.052 -0.599 4.620 1.00 0.00 H new ATOM 0 HD3 PRO B 7 49.622 -1.085 5.229 1.00 0.00 H new ATOM 1147 N THR B 8 48.630 3.973 3.793 1.00 0.00 N ATOM 1148 CA THR B 8 47.527 4.887 3.384 1.00 0.00 C ATOM 1149 C THR B 8 47.648 5.195 1.890 1.00 0.00 C ATOM 1150 O THR B 8 47.950 6.304 1.498 1.00 0.00 O ATOM 1151 CB THR B 8 47.620 6.188 4.182 1.00 0.00 C ATOM 1152 OG1 THR B 8 48.392 5.967 5.355 1.00 0.00 O ATOM 1153 CG2 THR B 8 46.216 6.651 4.573 1.00 0.00 C ATOM 0 H THR B 8 49.517 4.117 3.310 1.00 0.00 H new ATOM 0 HA THR B 8 46.567 4.409 3.580 1.00 0.00 H new ATOM 0 HB THR B 8 48.096 6.956 3.572 1.00 0.00 H new ATOM 0 HG1 THR B 8 49.344 6.059 5.142 1.00 0.00 H new ATOM 0 HG21 THR B 8 46.284 7.578 5.142 1.00 0.00 H new ATOM 0 HG22 THR B 8 45.625 6.820 3.673 1.00 0.00 H new ATOM 0 HG23 THR B 8 45.737 5.885 5.183 1.00 0.00 H new ATOM 1161 N ALA B 9 47.417 4.222 1.054 1.00 0.00 N ATOM 1162 CA ALA B 9 47.519 4.458 -0.413 1.00 0.00 C ATOM 1163 C ALA B 9 46.703 5.697 -0.790 1.00 0.00 C ATOM 1164 O ALA B 9 45.518 5.615 -1.050 1.00 0.00 O ATOM 1165 CB ALA B 9 46.976 3.242 -1.163 1.00 0.00 C ATOM 0 H ALA B 9 47.162 3.272 1.324 1.00 0.00 H new ATOM 0 HA ALA B 9 48.563 4.616 -0.684 1.00 0.00 H new ATOM 0 HB1 ALA B 9 47.050 3.414 -2.237 1.00 0.00 H new ATOM 0 HB2 ALA B 9 47.558 2.360 -0.896 1.00 0.00 H new ATOM 0 HB3 ALA B 9 45.932 3.084 -0.892 1.00 0.00 H new ATOM 1171 N CYS B 10 47.326 6.844 -0.824 1.00 0.00 N ATOM 1172 CA CYS B 10 46.582 8.083 -1.186 1.00 0.00 C ATOM 1173 C CYS B 10 46.213 8.036 -2.670 1.00 0.00 C ATOM 1174 O CYS B 10 46.921 7.466 -3.477 1.00 0.00 O ATOM 1175 CB CYS B 10 47.456 9.304 -0.893 1.00 0.00 C ATOM 1176 SG CYS B 10 47.472 9.605 0.894 1.00 0.00 S ATOM 0 H CYS B 10 48.316 6.976 -0.617 1.00 0.00 H new ATOM 0 HA CYS B 10 45.668 8.154 -0.596 1.00 0.00 H new ATOM 0 HB2 CYS B 10 48.470 9.136 -1.255 1.00 0.00 H new ATOM 0 HB3 CYS B 10 47.070 10.178 -1.418 1.00 0.00 H new ATOM 1181 N CYS B 11 45.101 8.613 -3.035 1.00 0.00 N ATOM 1182 CA CYS B 11 44.677 8.579 -4.462 1.00 0.00 C ATOM 1183 C CYS B 11 45.204 9.808 -5.205 1.00 0.00 C ATOM 1184 O CYS B 11 45.049 10.930 -4.766 1.00 0.00 O ATOM 1185 CB CYS B 11 43.149 8.552 -4.531 1.00 0.00 C ATOM 1186 SG CYS B 11 42.608 6.918 -5.094 1.00 0.00 S ATOM 0 H CYS B 11 44.468 9.107 -2.406 1.00 0.00 H new ATOM 0 HA CYS B 11 45.085 7.686 -4.934 1.00 0.00 H new ATOM 0 HB2 CYS B 11 42.725 8.771 -3.551 1.00 0.00 H new ATOM 0 HB3 CYS B 11 42.790 9.322 -5.213 1.00 0.00 H new ATOM 1191 N PHE B 12 45.821 9.597 -6.336 1.00 0.00 N ATOM 1192 CA PHE B 12 46.356 10.740 -7.127 1.00 0.00 C ATOM 1193 C PHE B 12 46.126 10.460 -8.615 1.00 0.00 C ATOM 1194 O PHE B 12 45.527 11.249 -9.316 1.00 0.00 O ATOM 1195 CB PHE B 12 47.847 10.903 -6.838 1.00 0.00 C ATOM 1196 CG PHE B 12 48.016 11.299 -5.391 1.00 0.00 C ATOM 1197 CD1 PHE B 12 47.277 12.370 -4.874 1.00 0.00 C ATOM 1198 CD2 PHE B 12 48.897 10.593 -4.563 1.00 0.00 C ATOM 1199 CE1 PHE B 12 47.418 12.736 -3.532 1.00 0.00 C ATOM 1200 CE2 PHE B 12 49.039 10.961 -3.219 1.00 0.00 C ATOM 1201 CZ PHE B 12 48.299 12.033 -2.703 1.00 0.00 C ATOM 0 H PHE B 12 45.978 8.677 -6.747 1.00 0.00 H new ATOM 0 HA PHE B 12 45.845 11.663 -6.852 1.00 0.00 H new ATOM 0 HB2 PHE B 12 48.376 9.971 -7.040 1.00 0.00 H new ATOM 0 HB3 PHE B 12 48.278 11.662 -7.491 1.00 0.00 H new ATOM 0 HD1 PHE B 12 46.597 12.914 -5.513 1.00 0.00 H new ATOM 0 HD2 PHE B 12 49.466 9.766 -4.960 1.00 0.00 H new ATOM 0 HE1 PHE B 12 46.846 13.562 -3.135 1.00 0.00 H new ATOM 0 HE2 PHE B 12 49.719 10.418 -2.580 1.00 0.00 H new ATOM 0 HZ PHE B 12 48.408 12.316 -1.667 1.00 0.00 H new ATOM 1211 N SER B 13 46.565 9.328 -9.095 1.00 0.00 N ATOM 1212 CA SER B 13 46.331 8.991 -10.527 1.00 0.00 C ATOM 1213 C SER B 13 44.955 8.333 -10.624 1.00 0.00 C ATOM 1214 O SER B 13 44.740 7.253 -10.113 1.00 0.00 O ATOM 1215 CB SER B 13 47.406 8.022 -11.017 1.00 0.00 C ATOM 1216 OG SER B 13 47.850 7.222 -9.929 1.00 0.00 O ATOM 0 H SER B 13 47.074 8.625 -8.559 1.00 0.00 H new ATOM 0 HA SER B 13 46.373 9.888 -11.145 1.00 0.00 H new ATOM 0 HB2 SER B 13 47.007 7.389 -11.810 1.00 0.00 H new ATOM 0 HB3 SER B 13 48.244 8.575 -11.442 1.00 0.00 H new ATOM 0 HG SER B 13 47.075 6.847 -9.461 1.00 0.00 H new ATOM 1222 N TYR B 14 44.009 8.987 -11.237 1.00 0.00 N ATOM 1223 CA TYR B 14 42.642 8.402 -11.309 1.00 0.00 C ATOM 1224 C TYR B 14 42.396 7.711 -12.664 1.00 0.00 C ATOM 1225 O TYR B 14 43.127 6.818 -13.037 1.00 0.00 O ATOM 1226 CB TYR B 14 41.617 9.514 -11.064 1.00 0.00 C ATOM 1227 CG TYR B 14 42.147 10.455 -10.009 1.00 0.00 C ATOM 1228 CD1 TYR B 14 41.997 10.140 -8.655 1.00 0.00 C ATOM 1229 CD2 TYR B 14 42.792 11.640 -10.385 1.00 0.00 C ATOM 1230 CE1 TYR B 14 42.491 11.007 -7.673 1.00 0.00 C ATOM 1231 CE2 TYR B 14 43.288 12.507 -9.403 1.00 0.00 C ATOM 1232 CZ TYR B 14 43.138 12.190 -8.047 1.00 0.00 C ATOM 1233 OH TYR B 14 43.627 13.045 -7.080 1.00 0.00 O ATOM 0 H TYR B 14 44.122 9.895 -11.688 1.00 0.00 H new ATOM 0 HA TYR B 14 42.540 7.635 -10.541 1.00 0.00 H new ATOM 0 HB2 TYR B 14 41.424 10.057 -11.989 1.00 0.00 H new ATOM 0 HB3 TYR B 14 40.668 9.085 -10.742 1.00 0.00 H new ATOM 0 HD1 TYR B 14 41.499 9.226 -8.366 1.00 0.00 H new ATOM 0 HD2 TYR B 14 42.907 11.885 -11.431 1.00 0.00 H new ATOM 0 HE1 TYR B 14 42.373 10.763 -6.628 1.00 0.00 H new ATOM 0 HE2 TYR B 14 43.786 13.421 -9.692 1.00 0.00 H new ATOM 0 HH TYR B 14 44.048 13.818 -7.510 1.00 0.00 H new ATOM 1243 N THR B 15 41.350 8.096 -13.370 1.00 0.00 N ATOM 1244 CA THR B 15 40.989 7.464 -14.680 1.00 0.00 C ATOM 1245 C THR B 15 42.159 6.697 -15.317 1.00 0.00 C ATOM 1246 O THR B 15 42.490 5.606 -14.896 1.00 0.00 O ATOM 1247 CB THR B 15 40.512 8.550 -15.643 1.00 0.00 C ATOM 1248 OG1 THR B 15 41.323 9.706 -15.490 1.00 0.00 O ATOM 1249 CG2 THR B 15 39.053 8.902 -15.344 1.00 0.00 C ATOM 0 H THR B 15 40.718 8.842 -13.080 1.00 0.00 H new ATOM 0 HA THR B 15 40.199 6.739 -14.485 1.00 0.00 H new ATOM 0 HB THR B 15 40.589 8.185 -16.667 1.00 0.00 H new ATOM 0 HG1 THR B 15 41.019 10.403 -16.108 1.00 0.00 H new ATOM 0 HG21 THR B 15 38.717 9.677 -16.033 1.00 0.00 H new ATOM 0 HG22 THR B 15 38.432 8.014 -15.466 1.00 0.00 H new ATOM 0 HG23 THR B 15 38.969 9.266 -14.320 1.00 0.00 H new ATOM 1257 N SER B 16 42.759 7.224 -16.354 1.00 0.00 N ATOM 1258 CA SER B 16 43.859 6.477 -17.015 1.00 0.00 C ATOM 1259 C SER B 16 43.244 5.241 -17.665 1.00 0.00 C ATOM 1260 O SER B 16 43.552 4.122 -17.308 1.00 0.00 O ATOM 1261 CB SER B 16 44.899 6.055 -15.976 1.00 0.00 C ATOM 1262 OG SER B 16 46.102 6.780 -16.195 1.00 0.00 O ATOM 0 H SER B 16 42.534 8.130 -16.765 1.00 0.00 H new ATOM 0 HA SER B 16 44.354 7.099 -17.761 1.00 0.00 H new ATOM 0 HB2 SER B 16 44.524 6.246 -14.971 1.00 0.00 H new ATOM 0 HB3 SER B 16 45.088 4.984 -16.048 1.00 0.00 H new ATOM 0 HG SER B 16 46.770 6.513 -15.530 1.00 0.00 H new ATOM 1268 N ARG B 17 42.346 5.442 -18.596 1.00 0.00 N ATOM 1269 CA ARG B 17 41.671 4.288 -19.254 1.00 0.00 C ATOM 1270 C ARG B 17 40.777 3.599 -18.224 1.00 0.00 C ATOM 1271 O ARG B 17 41.249 2.914 -17.340 1.00 0.00 O ATOM 1272 CB ARG B 17 42.714 3.302 -19.778 1.00 0.00 C ATOM 1273 CG ARG B 17 42.007 2.137 -20.470 1.00 0.00 C ATOM 1274 CD ARG B 17 42.303 0.840 -19.713 1.00 0.00 C ATOM 1275 NE ARG B 17 43.291 0.027 -20.477 1.00 0.00 N ATOM 1276 CZ ARG B 17 44.250 0.615 -21.141 1.00 0.00 C ATOM 1277 NH1 ARG B 17 45.265 1.129 -20.502 1.00 0.00 N ATOM 1278 NH2 ARG B 17 44.190 0.692 -22.441 1.00 0.00 N ATOM 0 H ARG B 17 42.052 6.360 -18.928 1.00 0.00 H new ATOM 0 HA ARG B 17 41.072 4.638 -20.095 1.00 0.00 H new ATOM 0 HB2 ARG B 17 43.385 3.802 -20.477 1.00 0.00 H new ATOM 0 HB3 ARG B 17 43.328 2.933 -18.956 1.00 0.00 H new ATOM 0 HG2 ARG B 17 40.932 2.316 -20.500 1.00 0.00 H new ATOM 0 HG3 ARG B 17 42.346 2.054 -21.503 1.00 0.00 H new ATOM 0 HD2 ARG B 17 42.694 1.068 -18.721 1.00 0.00 H new ATOM 0 HD3 ARG B 17 41.383 0.273 -19.571 1.00 0.00 H new ATOM 0 HE ARG B 17 43.218 -0.990 -20.481 1.00 0.00 H new ATOM 0 HH11 ARG B 17 45.309 1.071 -19.485 1.00 0.00 H new ATOM 0 HH12 ARG B 17 46.014 1.588 -21.020 1.00 0.00 H new ATOM 0 HH21 ARG B 17 43.394 0.293 -22.939 1.00 0.00 H new ATOM 0 HH22 ARG B 17 44.939 1.151 -22.960 1.00 0.00 H new ATOM 1292 N GLN B 18 39.489 3.795 -18.315 1.00 0.00 N ATOM 1293 CA GLN B 18 38.577 3.174 -17.328 1.00 0.00 C ATOM 1294 C GLN B 18 38.732 1.666 -17.344 1.00 0.00 C ATOM 1295 O GLN B 18 39.616 1.116 -17.970 1.00 0.00 O ATOM 1296 CB GLN B 18 37.137 3.541 -17.642 1.00 0.00 C ATOM 1297 CG GLN B 18 36.878 5.048 -17.448 1.00 0.00 C ATOM 1298 CD GLN B 18 37.887 5.661 -16.469 1.00 0.00 C ATOM 1299 OE1 GLN B 18 37.583 5.866 -15.313 1.00 0.00 O ATOM 1300 NE2 GLN B 18 39.079 5.977 -16.892 1.00 0.00 N ATOM 0 H GLN B 18 39.034 4.360 -19.033 1.00 0.00 H new ATOM 0 HA GLN B 18 38.835 3.548 -16.337 1.00 0.00 H new ATOM 0 HB2 GLN B 18 36.906 3.261 -18.670 1.00 0.00 H new ATOM 0 HB3 GLN B 18 36.467 2.971 -16.998 1.00 0.00 H new ATOM 0 HG2 GLN B 18 36.944 5.558 -18.409 1.00 0.00 H new ATOM 0 HG3 GLN B 18 35.865 5.201 -17.074 1.00 0.00 H new ATOM 0 HE21 GLN B 18 39.337 5.806 -17.864 1.00 0.00 H new ATOM 0 HE22 GLN B 18 39.753 6.396 -16.251 1.00 0.00 H new ATOM 1309 N ILE B 19 37.870 1.002 -16.649 1.00 0.00 N ATOM 1310 CA ILE B 19 37.918 -0.459 -16.581 1.00 0.00 C ATOM 1311 C ILE B 19 36.485 -0.959 -16.432 1.00 0.00 C ATOM 1312 O ILE B 19 35.895 -0.847 -15.375 1.00 0.00 O ATOM 1313 CB ILE B 19 38.738 -0.876 -15.376 1.00 0.00 C ATOM 1314 CG1 ILE B 19 38.491 0.105 -14.219 1.00 0.00 C ATOM 1315 CG2 ILE B 19 40.219 -0.897 -15.758 1.00 0.00 C ATOM 1316 CD1 ILE B 19 39.430 1.312 -14.325 1.00 0.00 C ATOM 0 H ILE B 19 37.115 1.429 -16.112 1.00 0.00 H new ATOM 0 HA ILE B 19 38.375 -0.878 -17.477 1.00 0.00 H new ATOM 0 HB ILE B 19 38.442 -1.874 -15.052 1.00 0.00 H new ATOM 0 HG12 ILE B 19 37.454 0.441 -14.235 1.00 0.00 H new ATOM 0 HG13 ILE B 19 38.647 -0.401 -13.266 1.00 0.00 H new ATOM 0 HG21 ILE B 19 40.813 -1.196 -14.895 1.00 0.00 H new ATOM 0 HG22 ILE B 19 40.375 -1.607 -16.570 1.00 0.00 H new ATOM 0 HG23 ILE B 19 40.525 0.098 -16.082 1.00 0.00 H new ATOM 0 HD11 ILE B 19 39.240 1.995 -13.497 1.00 0.00 H new ATOM 0 HD12 ILE B 19 40.465 0.972 -14.285 1.00 0.00 H new ATOM 0 HD13 ILE B 19 39.254 1.828 -15.269 1.00 0.00 H new ATOM 1328 N PRO B 20 35.966 -1.481 -17.501 1.00 0.00 N ATOM 1329 CA PRO B 20 34.591 -1.997 -17.545 1.00 0.00 C ATOM 1330 C PRO B 20 34.433 -3.217 -16.640 1.00 0.00 C ATOM 1331 O PRO B 20 35.377 -3.686 -16.037 1.00 0.00 O ATOM 1332 CB PRO B 20 34.384 -2.329 -19.026 1.00 0.00 C ATOM 1333 CG PRO B 20 35.798 -2.471 -19.631 1.00 0.00 C ATOM 1334 CD PRO B 20 36.716 -1.631 -18.759 1.00 0.00 C ATOM 0 HA PRO B 20 33.848 -1.289 -17.178 1.00 0.00 H new ATOM 0 HB2 PRO B 20 33.815 -3.251 -19.143 1.00 0.00 H new ATOM 0 HB3 PRO B 20 33.822 -1.541 -19.528 1.00 0.00 H new ATOM 0 HG2 PRO B 20 36.115 -3.514 -19.639 1.00 0.00 H new ATOM 0 HG3 PRO B 20 35.817 -2.124 -20.664 1.00 0.00 H new ATOM 0 HD2 PRO B 20 37.675 -2.124 -18.597 1.00 0.00 H new ATOM 0 HD3 PRO B 20 36.928 -0.664 -19.216 1.00 0.00 H new ATOM 1342 N GLN B 21 33.236 -3.710 -16.518 1.00 0.00 N ATOM 1343 CA GLN B 21 32.995 -4.879 -15.631 1.00 0.00 C ATOM 1344 C GLN B 21 33.837 -6.073 -16.093 1.00 0.00 C ATOM 1345 O GLN B 21 34.178 -6.941 -15.314 1.00 0.00 O ATOM 1346 CB GLN B 21 31.511 -5.248 -15.688 1.00 0.00 C ATOM 1347 CG GLN B 21 30.653 -4.024 -15.346 1.00 0.00 C ATOM 1348 CD GLN B 21 29.223 -4.254 -15.842 1.00 0.00 C ATOM 1349 OE1 GLN B 21 28.870 -3.834 -16.926 1.00 0.00 O ATOM 1350 NE2 GLN B 21 28.381 -4.909 -15.091 1.00 0.00 N ATOM 0 H GLN B 21 32.409 -3.352 -16.997 1.00 0.00 H new ATOM 0 HA GLN B 21 33.277 -4.623 -14.610 1.00 0.00 H new ATOM 0 HB2 GLN B 21 31.257 -5.614 -16.683 1.00 0.00 H new ATOM 0 HB3 GLN B 21 31.302 -6.056 -14.988 1.00 0.00 H new ATOM 0 HG2 GLN B 21 30.654 -3.854 -14.269 1.00 0.00 H new ATOM 0 HG3 GLN B 21 31.072 -3.131 -15.810 1.00 0.00 H new ATOM 0 HE21 GLN B 21 28.677 -5.262 -14.181 1.00 0.00 H new ATOM 0 HE22 GLN B 21 27.427 -5.068 -15.414 1.00 0.00 H new ATOM 1359 N ASN B 22 34.174 -6.131 -17.355 1.00 0.00 N ATOM 1360 CA ASN B 22 34.989 -7.277 -17.859 1.00 0.00 C ATOM 1361 C ASN B 22 36.473 -7.005 -17.605 1.00 0.00 C ATOM 1362 O ASN B 22 37.291 -7.904 -17.615 1.00 0.00 O ATOM 1363 CB ASN B 22 34.756 -7.443 -19.364 1.00 0.00 C ATOM 1364 CG ASN B 22 34.215 -8.847 -19.647 1.00 0.00 C ATOM 1365 OD1 ASN B 22 34.974 -9.787 -19.785 1.00 0.00 O ATOM 1366 ND2 ASN B 22 32.926 -9.030 -19.741 1.00 0.00 N ATOM 0 H ASN B 22 33.921 -5.436 -18.058 1.00 0.00 H new ATOM 0 HA ASN B 22 34.693 -8.187 -17.338 1.00 0.00 H new ATOM 0 HB2 ASN B 22 34.050 -6.692 -19.718 1.00 0.00 H new ATOM 0 HB3 ASN B 22 35.688 -7.285 -19.906 1.00 0.00 H new ATOM 0 HD21 ASN B 22 32.556 -9.961 -19.930 1.00 0.00 H new ATOM 0 HD22 ASN B 22 32.289 -8.242 -19.625 1.00 0.00 H new ATOM 1373 N PHE B 23 36.827 -5.770 -17.387 1.00 0.00 N ATOM 1374 CA PHE B 23 38.255 -5.429 -17.142 1.00 0.00 C ATOM 1375 C PHE B 23 38.447 -5.060 -15.673 1.00 0.00 C ATOM 1376 O PHE B 23 39.339 -4.313 -15.325 1.00 0.00 O ATOM 1377 CB PHE B 23 38.619 -4.222 -18.007 1.00 0.00 C ATOM 1378 CG PHE B 23 39.817 -4.546 -18.858 1.00 0.00 C ATOM 1379 CD1 PHE B 23 39.647 -5.229 -20.066 1.00 0.00 C ATOM 1380 CD2 PHE B 23 41.098 -4.164 -18.440 1.00 0.00 C ATOM 1381 CE1 PHE B 23 40.756 -5.530 -20.861 1.00 0.00 C ATOM 1382 CE2 PHE B 23 42.210 -4.467 -19.236 1.00 0.00 C ATOM 1383 CZ PHE B 23 42.038 -5.151 -20.446 1.00 0.00 C ATOM 0 H PHE B 23 36.185 -4.978 -17.368 1.00 0.00 H new ATOM 0 HA PHE B 23 38.888 -6.281 -17.388 1.00 0.00 H new ATOM 0 HB2 PHE B 23 37.775 -3.949 -18.640 1.00 0.00 H new ATOM 0 HB3 PHE B 23 38.834 -3.361 -17.374 1.00 0.00 H new ATOM 0 HD1 PHE B 23 38.658 -5.524 -20.385 1.00 0.00 H new ATOM 0 HD2 PHE B 23 41.228 -3.637 -17.506 1.00 0.00 H new ATOM 0 HE1 PHE B 23 40.624 -6.055 -21.796 1.00 0.00 H new ATOM 0 HE2 PHE B 23 43.199 -4.173 -18.917 1.00 0.00 H new ATOM 0 HZ PHE B 23 42.895 -5.386 -21.059 1.00 0.00 H new ATOM 1393 N ILE B 24 37.600 -5.545 -14.807 1.00 0.00 N ATOM 1394 CA ILE B 24 37.732 -5.172 -13.376 1.00 0.00 C ATOM 1395 C ILE B 24 37.516 -6.382 -12.462 1.00 0.00 C ATOM 1396 O ILE B 24 37.214 -7.476 -12.898 1.00 0.00 O ATOM 1397 CB ILE B 24 36.686 -4.084 -13.089 1.00 0.00 C ATOM 1398 CG1 ILE B 24 37.392 -2.802 -12.672 1.00 0.00 C ATOM 1399 CG2 ILE B 24 35.711 -4.498 -11.974 1.00 0.00 C ATOM 1400 CD1 ILE B 24 36.349 -1.700 -12.567 1.00 0.00 C ATOM 0 H ILE B 24 36.830 -6.177 -15.028 1.00 0.00 H new ATOM 0 HA ILE B 24 38.738 -4.804 -13.177 1.00 0.00 H new ATOM 0 HB ILE B 24 36.111 -3.932 -14.003 1.00 0.00 H new ATOM 0 HG12 ILE B 24 37.898 -2.940 -11.716 1.00 0.00 H new ATOM 0 HG13 ILE B 24 38.156 -2.534 -13.401 1.00 0.00 H new ATOM 0 HG21 ILE B 24 34.990 -3.698 -11.806 1.00 0.00 H new ATOM 0 HG22 ILE B 24 35.184 -5.405 -12.270 1.00 0.00 H new ATOM 0 HG23 ILE B 24 36.267 -4.684 -11.055 1.00 0.00 H new ATOM 0 HD11 ILE B 24 36.832 -0.769 -12.269 1.00 0.00 H new ATOM 0 HD12 ILE B 24 35.865 -1.564 -13.534 1.00 0.00 H new ATOM 0 HD13 ILE B 24 35.602 -1.976 -11.823 1.00 0.00 H new ATOM 1412 N ALA B 25 37.654 -6.158 -11.185 1.00 0.00 N ATOM 1413 CA ALA B 25 37.447 -7.241 -10.190 1.00 0.00 C ATOM 1414 C ALA B 25 37.016 -6.608 -8.862 1.00 0.00 C ATOM 1415 O ALA B 25 35.930 -6.845 -8.372 1.00 0.00 O ATOM 1416 CB ALA B 25 38.753 -8.014 -9.991 1.00 0.00 C ATOM 0 H ALA B 25 37.906 -5.254 -10.785 1.00 0.00 H new ATOM 0 HA ALA B 25 36.679 -7.929 -10.542 1.00 0.00 H new ATOM 0 HB1 ALA B 25 38.598 -8.808 -9.260 1.00 0.00 H new ATOM 0 HB2 ALA B 25 39.066 -8.450 -10.940 1.00 0.00 H new ATOM 0 HB3 ALA B 25 39.526 -7.335 -9.631 1.00 0.00 H new ATOM 1422 N ALA B 26 37.863 -5.800 -8.280 1.00 0.00 N ATOM 1423 CA ALA B 26 37.511 -5.143 -6.985 1.00 0.00 C ATOM 1424 C ALA B 26 37.134 -3.674 -7.219 1.00 0.00 C ATOM 1425 O ALA B 26 36.629 -3.306 -8.261 1.00 0.00 O ATOM 1426 CB ALA B 26 38.714 -5.213 -6.043 1.00 0.00 C ATOM 0 H ALA B 26 38.786 -5.566 -8.646 1.00 0.00 H new ATOM 0 HA ALA B 26 36.660 -5.660 -6.543 1.00 0.00 H new ATOM 0 HB1 ALA B 26 38.463 -4.735 -5.096 1.00 0.00 H new ATOM 0 HB2 ALA B 26 38.976 -6.256 -5.865 1.00 0.00 H new ATOM 0 HB3 ALA B 26 39.561 -4.698 -6.496 1.00 0.00 H new ATOM 1432 N TYR B 27 37.399 -2.831 -6.250 1.00 0.00 N ATOM 1433 CA TYR B 27 37.093 -1.376 -6.389 1.00 0.00 C ATOM 1434 C TYR B 27 37.374 -0.674 -5.052 1.00 0.00 C ATOM 1435 O TYR B 27 38.071 0.307 -4.997 1.00 0.00 O ATOM 1436 CB TYR B 27 35.626 -1.160 -6.786 1.00 0.00 C ATOM 1437 CG TYR B 27 34.723 -1.774 -5.753 1.00 0.00 C ATOM 1438 CD1 TYR B 27 34.343 -3.107 -5.877 1.00 0.00 C ATOM 1439 CD2 TYR B 27 34.270 -1.010 -4.671 1.00 0.00 C ATOM 1440 CE1 TYR B 27 33.507 -3.684 -4.922 1.00 0.00 C ATOM 1441 CE2 TYR B 27 33.433 -1.586 -3.711 1.00 0.00 C ATOM 1442 CZ TYR B 27 33.051 -2.927 -3.837 1.00 0.00 C ATOM 1443 OH TYR B 27 32.224 -3.502 -2.893 1.00 0.00 O ATOM 0 H TYR B 27 37.819 -3.095 -5.359 1.00 0.00 H new ATOM 0 HA TYR B 27 37.724 -0.957 -7.173 1.00 0.00 H new ATOM 0 HB2 TYR B 27 35.418 -0.094 -6.877 1.00 0.00 H new ATOM 0 HB3 TYR B 27 35.434 -1.607 -7.762 1.00 0.00 H new ATOM 0 HD1 TYR B 27 34.695 -3.694 -6.712 1.00 0.00 H new ATOM 0 HD2 TYR B 27 34.567 0.024 -4.578 1.00 0.00 H new ATOM 0 HE1 TYR B 27 33.211 -4.718 -5.020 1.00 0.00 H new ATOM 0 HE2 TYR B 27 33.082 -0.999 -2.875 1.00 0.00 H new ATOM 0 HH TYR B 27 32.001 -2.839 -2.206 1.00 0.00 H new ATOM 1453 N PHE B 28 36.840 -1.173 -3.973 1.00 0.00 N ATOM 1454 CA PHE B 28 37.087 -0.528 -2.646 1.00 0.00 C ATOM 1455 C PHE B 28 36.615 0.928 -2.692 1.00 0.00 C ATOM 1456 O PHE B 28 35.650 1.253 -3.350 1.00 0.00 O ATOM 1457 CB PHE B 28 38.585 -0.572 -2.326 1.00 0.00 C ATOM 1458 CG PHE B 28 39.063 -2.004 -2.336 1.00 0.00 C ATOM 1459 CD1 PHE B 28 39.477 -2.594 -3.536 1.00 0.00 C ATOM 1460 CD2 PHE B 28 39.096 -2.742 -1.146 1.00 0.00 C ATOM 1461 CE1 PHE B 28 39.924 -3.920 -3.546 1.00 0.00 C ATOM 1462 CE2 PHE B 28 39.544 -4.069 -1.157 1.00 0.00 C ATOM 1463 CZ PHE B 28 39.958 -4.658 -2.358 1.00 0.00 C ATOM 0 H PHE B 28 36.243 -1.999 -3.949 1.00 0.00 H new ATOM 0 HA PHE B 28 36.537 -1.064 -1.873 1.00 0.00 H new ATOM 0 HB2 PHE B 28 39.141 0.013 -3.059 1.00 0.00 H new ATOM 0 HB3 PHE B 28 38.772 -0.122 -1.351 1.00 0.00 H new ATOM 0 HD1 PHE B 28 39.451 -2.026 -4.454 1.00 0.00 H new ATOM 0 HD2 PHE B 28 38.776 -2.288 -0.220 1.00 0.00 H new ATOM 0 HE1 PHE B 28 40.243 -4.374 -4.472 1.00 0.00 H new ATOM 0 HE2 PHE B 28 39.570 -4.638 -0.239 1.00 0.00 H new ATOM 0 HZ PHE B 28 40.303 -5.681 -2.367 1.00 0.00 H new ATOM 1473 N GLU B 29 37.282 1.811 -2.000 1.00 0.00 N ATOM 1474 CA GLU B 29 36.858 3.235 -2.016 1.00 0.00 C ATOM 1475 C GLU B 29 37.738 4.050 -1.079 1.00 0.00 C ATOM 1476 O GLU B 29 37.274 4.891 -0.336 1.00 0.00 O ATOM 1477 CB GLU B 29 35.402 3.324 -1.584 1.00 0.00 C ATOM 1478 CG GLU B 29 35.216 2.555 -0.275 1.00 0.00 C ATOM 1479 CD GLU B 29 34.346 3.374 0.681 1.00 0.00 C ATOM 1480 OE1 GLU B 29 34.877 4.274 1.311 1.00 0.00 O ATOM 1481 OE2 GLU B 29 33.163 3.087 0.765 1.00 0.00 O ATOM 0 H GLU B 29 38.100 1.606 -1.426 1.00 0.00 H new ATOM 0 HA GLU B 29 36.961 3.638 -3.023 1.00 0.00 H new ATOM 0 HB2 GLU B 29 35.113 4.367 -1.451 1.00 0.00 H new ATOM 0 HB3 GLU B 29 34.755 2.910 -2.358 1.00 0.00 H new ATOM 0 HG2 GLU B 29 34.749 1.590 -0.471 1.00 0.00 H new ATOM 0 HG3 GLU B 29 36.185 2.353 0.181 1.00 0.00 H new ATOM 1488 N THR B 30 39.011 3.815 -1.150 1.00 0.00 N ATOM 1489 CA THR B 30 39.984 4.569 -0.306 1.00 0.00 C ATOM 1490 C THR B 30 39.401 4.846 1.086 1.00 0.00 C ATOM 1491 O THR B 30 38.457 4.213 1.516 1.00 0.00 O ATOM 1492 CB THR B 30 40.304 5.888 -1.008 1.00 0.00 C ATOM 1493 OG1 THR B 30 39.103 6.623 -1.200 1.00 0.00 O ATOM 1494 CG2 THR B 30 40.945 5.592 -2.364 1.00 0.00 C ATOM 0 H THR B 30 39.432 3.120 -1.767 1.00 0.00 H new ATOM 0 HA THR B 30 40.889 3.976 -0.176 1.00 0.00 H new ATOM 0 HB THR B 30 40.993 6.473 -0.398 1.00 0.00 H new ATOM 0 HG1 THR B 30 38.406 6.272 -0.607 1.00 0.00 H new ATOM 0 HG21 THR B 30 41.176 6.530 -2.870 1.00 0.00 H new ATOM 0 HG22 THR B 30 41.863 5.024 -2.216 1.00 0.00 H new ATOM 0 HG23 THR B 30 40.253 5.011 -2.974 1.00 0.00 H new ATOM 1502 N SER B 31 39.968 5.789 1.796 1.00 0.00 N ATOM 1503 CA SER B 31 39.457 6.114 3.162 1.00 0.00 C ATOM 1504 C SER B 31 39.852 7.554 3.521 1.00 0.00 C ATOM 1505 O SER B 31 39.393 8.491 2.906 1.00 0.00 O ATOM 1506 CB SER B 31 40.050 5.135 4.176 1.00 0.00 C ATOM 1507 OG SER B 31 39.745 3.804 3.779 1.00 0.00 O ATOM 0 H SER B 31 40.764 6.348 1.488 1.00 0.00 H new ATOM 0 HA SER B 31 38.371 6.026 3.181 1.00 0.00 H new ATOM 0 HB2 SER B 31 41.130 5.269 4.240 1.00 0.00 H new ATOM 0 HB3 SER B 31 39.645 5.332 5.169 1.00 0.00 H new ATOM 0 HG SER B 31 38.965 3.810 3.185 1.00 0.00 H new ATOM 1513 N SER B 32 40.693 7.750 4.508 1.00 0.00 N ATOM 1514 CA SER B 32 41.094 9.140 4.878 1.00 0.00 C ATOM 1515 C SER B 32 42.475 9.449 4.295 1.00 0.00 C ATOM 1516 O SER B 32 42.983 8.723 3.465 1.00 0.00 O ATOM 1517 CB SER B 32 41.139 9.272 6.399 1.00 0.00 C ATOM 1518 OG SER B 32 40.113 10.159 6.824 1.00 0.00 O ATOM 0 H SER B 32 41.116 7.011 5.069 1.00 0.00 H new ATOM 0 HA SER B 32 40.367 9.845 4.475 1.00 0.00 H new ATOM 0 HB2 SER B 32 41.007 8.295 6.864 1.00 0.00 H new ATOM 0 HB3 SER B 32 42.113 9.646 6.714 1.00 0.00 H new ATOM 0 HG SER B 32 40.138 10.245 7.800 1.00 0.00 H new ATOM 1524 N GLN B 33 43.085 10.525 4.722 1.00 0.00 N ATOM 1525 CA GLN B 33 44.432 10.882 4.188 1.00 0.00 C ATOM 1526 C GLN B 33 44.405 10.790 2.663 1.00 0.00 C ATOM 1527 O GLN B 33 44.574 9.731 2.103 1.00 0.00 O ATOM 1528 CB GLN B 33 45.477 9.912 4.740 1.00 0.00 C ATOM 1529 CG GLN B 33 45.404 9.901 6.268 1.00 0.00 C ATOM 1530 CD GLN B 33 45.865 11.258 6.807 1.00 0.00 C ATOM 1531 OE1 GLN B 33 46.591 11.972 6.145 1.00 0.00 O ATOM 1532 NE2 GLN B 33 45.470 11.647 7.988 1.00 0.00 N ATOM 0 H GLN B 33 42.709 11.170 5.416 1.00 0.00 H new ATOM 0 HA GLN B 33 44.689 11.897 4.491 1.00 0.00 H new ATOM 0 HB2 GLN B 33 45.301 8.910 4.349 1.00 0.00 H new ATOM 0 HB3 GLN B 33 46.474 10.210 4.415 1.00 0.00 H new ATOM 0 HG2 GLN B 33 44.384 9.695 6.593 1.00 0.00 H new ATOM 0 HG3 GLN B 33 46.033 9.105 6.668 1.00 0.00 H new ATOM 0 HE21 GLN B 33 44.860 11.048 8.545 1.00 0.00 H new ATOM 0 HE22 GLN B 33 45.771 12.550 8.355 1.00 0.00 H new ATOM 1541 N CYS B 34 44.182 11.896 1.997 1.00 0.00 N ATOM 1542 CA CYS B 34 44.118 11.900 0.498 1.00 0.00 C ATOM 1543 C CYS B 34 43.127 10.826 0.042 1.00 0.00 C ATOM 1544 O CYS B 34 41.970 11.113 -0.192 1.00 0.00 O ATOM 1545 CB CYS B 34 45.494 11.634 -0.148 1.00 0.00 C ATOM 1546 SG CYS B 34 46.799 11.498 1.100 1.00 0.00 S ATOM 0 H CYS B 34 44.040 12.808 2.431 1.00 0.00 H new ATOM 0 HA CYS B 34 43.794 12.890 0.179 1.00 0.00 H new ATOM 0 HB2 CYS B 34 45.451 10.715 -0.732 1.00 0.00 H new ATOM 0 HB3 CYS B 34 45.734 12.441 -0.840 1.00 0.00 H new ATOM 1551 N SER B 35 43.571 9.596 -0.077 1.00 0.00 N ATOM 1552 CA SER B 35 42.660 8.493 -0.501 1.00 0.00 C ATOM 1553 C SER B 35 41.266 8.730 0.085 1.00 0.00 C ATOM 1554 O SER B 35 41.036 8.528 1.260 1.00 0.00 O ATOM 1555 CB SER B 35 43.214 7.161 0.018 1.00 0.00 C ATOM 1556 OG SER B 35 44.353 7.410 0.831 1.00 0.00 O ATOM 0 H SER B 35 44.534 9.311 0.104 1.00 0.00 H new ATOM 0 HA SER B 35 42.594 8.466 -1.589 1.00 0.00 H new ATOM 0 HB2 SER B 35 42.451 6.636 0.592 1.00 0.00 H new ATOM 0 HB3 SER B 35 43.484 6.516 -0.818 1.00 0.00 H new ATOM 0 HG SER B 35 44.089 7.944 1.609 1.00 0.00 H new ATOM 1562 N LYS B 36 40.339 9.170 -0.722 1.00 0.00 N ATOM 1563 CA LYS B 36 38.967 9.431 -0.203 1.00 0.00 C ATOM 1564 C LYS B 36 38.022 9.754 -1.374 1.00 0.00 C ATOM 1565 O LYS B 36 37.043 9.061 -1.571 1.00 0.00 O ATOM 1566 CB LYS B 36 39.024 10.591 0.810 1.00 0.00 C ATOM 1567 CG LYS B 36 37.770 11.473 0.715 1.00 0.00 C ATOM 1568 CD LYS B 36 36.520 10.601 0.862 1.00 0.00 C ATOM 1569 CE LYS B 36 35.815 10.934 2.178 1.00 0.00 C ATOM 1570 NZ LYS B 36 35.368 9.673 2.835 1.00 0.00 N ATOM 0 H LYS B 36 40.472 9.359 -1.715 1.00 0.00 H new ATOM 0 HA LYS B 36 38.581 8.547 0.304 1.00 0.00 H new ATOM 0 HB2 LYS B 36 39.115 10.191 1.820 1.00 0.00 H new ATOM 0 HB3 LYS B 36 39.912 11.196 0.625 1.00 0.00 H new ATOM 0 HG2 LYS B 36 37.788 12.235 1.494 1.00 0.00 H new ATOM 0 HG3 LYS B 36 37.751 11.995 -0.241 1.00 0.00 H new ATOM 0 HD2 LYS B 36 35.845 10.771 0.023 1.00 0.00 H new ATOM 0 HD3 LYS B 36 36.795 9.547 0.842 1.00 0.00 H new ATOM 0 HE2 LYS B 36 36.490 11.480 2.837 1.00 0.00 H new ATOM 0 HE3 LYS B 36 34.959 11.582 1.991 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 34.889 9.899 3.730 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 34.710 9.169 2.207 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 36.193 9.070 3.027 1.00 0.00 H new ATOM 1584 N PRO B 37 38.335 10.791 -2.121 1.00 0.00 N ATOM 1585 CA PRO B 37 37.514 11.203 -3.276 1.00 0.00 C ATOM 1586 C PRO B 37 37.808 10.321 -4.496 1.00 0.00 C ATOM 1587 O PRO B 37 37.846 10.795 -5.615 1.00 0.00 O ATOM 1588 CB PRO B 37 37.964 12.639 -3.545 1.00 0.00 C ATOM 1589 CG PRO B 37 39.381 12.770 -2.938 1.00 0.00 C ATOM 1590 CD PRO B 37 39.515 11.652 -1.888 1.00 0.00 C ATOM 0 HA PRO B 37 36.445 11.116 -3.082 1.00 0.00 H new ATOM 0 HB2 PRO B 37 37.978 12.848 -4.615 1.00 0.00 H new ATOM 0 HB3 PRO B 37 37.278 13.353 -3.090 1.00 0.00 H new ATOM 0 HG2 PRO B 37 40.144 12.670 -3.710 1.00 0.00 H new ATOM 0 HG3 PRO B 37 39.517 13.750 -2.480 1.00 0.00 H new ATOM 0 HD2 PRO B 37 40.444 11.097 -2.014 1.00 0.00 H new ATOM 0 HD3 PRO B 37 39.520 12.055 -0.875 1.00 0.00 H new ATOM 1598 N GLY B 38 38.021 9.049 -4.300 1.00 0.00 N ATOM 1599 CA GLY B 38 38.314 8.166 -5.458 1.00 0.00 C ATOM 1600 C GLY B 38 38.033 6.710 -5.085 1.00 0.00 C ATOM 1601 O GLY B 38 36.996 6.384 -4.545 1.00 0.00 O ATOM 0 H GLY B 38 38.004 8.587 -3.391 1.00 0.00 H new ATOM 0 HA2 GLY B 38 37.702 8.456 -6.312 1.00 0.00 H new ATOM 0 HA3 GLY B 38 39.356 8.279 -5.759 1.00 0.00 H new ATOM 1605 N VAL B 39 38.954 5.838 -5.383 1.00 0.00 N ATOM 1606 CA VAL B 39 38.768 4.395 -5.072 1.00 0.00 C ATOM 1607 C VAL B 39 39.987 3.635 -5.612 1.00 0.00 C ATOM 1608 O VAL B 39 40.884 4.220 -6.178 1.00 0.00 O ATOM 1609 CB VAL B 39 37.485 3.905 -5.766 1.00 0.00 C ATOM 1610 CG1 VAL B 39 37.766 3.649 -7.252 1.00 0.00 C ATOM 1611 CG2 VAL B 39 36.977 2.614 -5.104 1.00 0.00 C ATOM 0 H VAL B 39 39.839 6.067 -5.835 1.00 0.00 H new ATOM 0 HA VAL B 39 38.677 4.229 -3.999 1.00 0.00 H new ATOM 0 HB VAL B 39 36.718 4.674 -5.669 1.00 0.00 H new ATOM 0 HG11 VAL B 39 36.855 3.302 -7.740 1.00 0.00 H new ATOM 0 HG12 VAL B 39 38.101 4.573 -7.723 1.00 0.00 H new ATOM 0 HG13 VAL B 39 38.542 2.890 -7.350 1.00 0.00 H new ATOM 0 HG21 VAL B 39 36.069 2.280 -5.606 1.00 0.00 H new ATOM 0 HG22 VAL B 39 37.740 1.840 -5.183 1.00 0.00 H new ATOM 0 HG23 VAL B 39 36.761 2.805 -4.053 1.00 0.00 H new ATOM 1621 N ILE B 40 40.024 2.346 -5.459 1.00 0.00 N ATOM 1622 CA ILE B 40 41.178 1.565 -5.988 1.00 0.00 C ATOM 1623 C ILE B 40 40.646 0.276 -6.612 1.00 0.00 C ATOM 1624 O ILE B 40 39.972 -0.507 -5.975 1.00 0.00 O ATOM 1625 CB ILE B 40 42.163 1.268 -4.857 1.00 0.00 C ATOM 1626 CG1 ILE B 40 43.107 2.463 -4.718 1.00 0.00 C ATOM 1627 CG2 ILE B 40 42.982 0.010 -5.171 1.00 0.00 C ATOM 1628 CD1 ILE B 40 43.868 2.362 -3.402 1.00 0.00 C ATOM 0 H ILE B 40 39.305 1.795 -4.990 1.00 0.00 H new ATOM 0 HA ILE B 40 41.709 2.136 -6.750 1.00 0.00 H new ATOM 0 HB ILE B 40 41.613 1.099 -3.931 1.00 0.00 H new ATOM 0 HG12 ILE B 40 43.807 2.486 -5.554 1.00 0.00 H new ATOM 0 HG13 ILE B 40 42.540 3.393 -4.751 1.00 0.00 H new ATOM 0 HG21 ILE B 40 43.677 -0.185 -4.354 1.00 0.00 H new ATOM 0 HG22 ILE B 40 42.311 -0.841 -5.287 1.00 0.00 H new ATOM 0 HG23 ILE B 40 43.541 0.161 -6.095 1.00 0.00 H new ATOM 0 HD11 ILE B 40 44.540 3.214 -3.304 1.00 0.00 H new ATOM 0 HD12 ILE B 40 43.161 2.360 -2.572 1.00 0.00 H new ATOM 0 HD13 ILE B 40 44.448 1.439 -3.387 1.00 0.00 H new ATOM 1640 N PHE B 41 40.925 0.064 -7.865 1.00 0.00 N ATOM 1641 CA PHE B 41 40.410 -1.151 -8.546 1.00 0.00 C ATOM 1642 C PHE B 41 41.490 -2.223 -8.631 1.00 0.00 C ATOM 1643 O PHE B 41 42.635 -2.007 -8.291 1.00 0.00 O ATOM 1644 CB PHE B 41 39.968 -0.775 -9.958 1.00 0.00 C ATOM 1645 CG PHE B 41 38.616 -0.114 -9.890 1.00 0.00 C ATOM 1646 CD1 PHE B 41 37.477 -0.888 -9.663 1.00 0.00 C ATOM 1647 CD2 PHE B 41 38.503 1.272 -10.048 1.00 0.00 C ATOM 1648 CE1 PHE B 41 36.219 -0.278 -9.595 1.00 0.00 C ATOM 1649 CE2 PHE B 41 37.247 1.883 -9.979 1.00 0.00 C ATOM 1650 CZ PHE B 41 36.105 1.106 -9.753 1.00 0.00 C ATOM 0 H PHE B 41 41.489 0.682 -8.448 1.00 0.00 H new ATOM 0 HA PHE B 41 39.571 -1.547 -7.974 1.00 0.00 H new ATOM 0 HB2 PHE B 41 40.694 -0.101 -10.413 1.00 0.00 H new ATOM 0 HB3 PHE B 41 39.921 -1.664 -10.587 1.00 0.00 H new ATOM 0 HD1 PHE B 41 37.566 -1.957 -9.540 1.00 0.00 H new ATOM 0 HD2 PHE B 41 39.385 1.869 -10.223 1.00 0.00 H new ATOM 0 HE1 PHE B 41 35.337 -0.876 -9.421 1.00 0.00 H new ATOM 0 HE2 PHE B 41 37.158 2.953 -10.100 1.00 0.00 H new ATOM 0 HZ PHE B 41 35.134 1.577 -9.701 1.00 0.00 H new ATOM 1660 N LEU B 42 41.117 -3.379 -9.097 1.00 0.00 N ATOM 1661 CA LEU B 42 42.083 -4.492 -9.233 1.00 0.00 C ATOM 1662 C LEU B 42 41.816 -5.197 -10.557 1.00 0.00 C ATOM 1663 O LEU B 42 41.479 -6.363 -10.600 1.00 0.00 O ATOM 1664 CB LEU B 42 41.886 -5.473 -8.084 1.00 0.00 C ATOM 1665 CG LEU B 42 42.879 -5.158 -6.970 1.00 0.00 C ATOM 1666 CD1 LEU B 42 42.129 -5.046 -5.645 1.00 0.00 C ATOM 1667 CD2 LEU B 42 43.916 -6.280 -6.877 1.00 0.00 C ATOM 0 H LEU B 42 40.166 -3.600 -9.394 1.00 0.00 H new ATOM 0 HA LEU B 42 43.105 -4.113 -9.208 1.00 0.00 H new ATOM 0 HB2 LEU B 42 40.866 -5.406 -7.706 1.00 0.00 H new ATOM 0 HB3 LEU B 42 42.030 -6.495 -8.435 1.00 0.00 H new ATOM 0 HG LEU B 42 43.384 -4.217 -7.186 1.00 0.00 H new ATOM 0 HD11 LEU B 42 42.835 -4.821 -4.845 1.00 0.00 H new ATOM 0 HD12 LEU B 42 41.390 -4.248 -5.712 1.00 0.00 H new ATOM 0 HD13 LEU B 42 41.626 -5.989 -5.431 1.00 0.00 H new ATOM 0 HD21 LEU B 42 44.626 -6.055 -6.081 1.00 0.00 H new ATOM 0 HD22 LEU B 42 43.414 -7.223 -6.659 1.00 0.00 H new ATOM 0 HD23 LEU B 42 44.448 -6.363 -7.825 1.00 0.00 H new ATOM 1679 N THR B 43 41.950 -4.485 -11.634 1.00 0.00 N ATOM 1680 CA THR B 43 41.692 -5.089 -12.968 1.00 0.00 C ATOM 1681 C THR B 43 42.319 -6.483 -13.031 1.00 0.00 C ATOM 1682 O THR B 43 43.106 -6.863 -12.188 1.00 0.00 O ATOM 1683 CB THR B 43 42.301 -4.197 -14.054 1.00 0.00 C ATOM 1684 OG1 THR B 43 43.711 -4.385 -14.083 1.00 0.00 O ATOM 1685 CG2 THR B 43 41.977 -2.728 -13.752 1.00 0.00 C ATOM 0 H THR B 43 42.229 -3.504 -11.650 1.00 0.00 H new ATOM 0 HA THR B 43 40.617 -5.174 -13.129 1.00 0.00 H new ATOM 0 HB THR B 43 41.882 -4.463 -15.024 1.00 0.00 H new ATOM 0 HG1 THR B 43 44.042 -4.239 -14.994 1.00 0.00 H new ATOM 0 HG21 THR B 43 42.411 -2.093 -14.525 1.00 0.00 H new ATOM 0 HG22 THR B 43 40.896 -2.590 -13.734 1.00 0.00 H new ATOM 0 HG23 THR B 43 42.394 -2.455 -12.783 1.00 0.00 H new ATOM 1693 N LYS B 44 41.970 -7.248 -14.027 1.00 0.00 N ATOM 1694 CA LYS B 44 42.538 -8.620 -14.150 1.00 0.00 C ATOM 1695 C LYS B 44 44.016 -8.526 -14.526 1.00 0.00 C ATOM 1696 O LYS B 44 44.766 -9.471 -14.382 1.00 0.00 O ATOM 1697 CB LYS B 44 41.776 -9.394 -15.230 1.00 0.00 C ATOM 1698 CG LYS B 44 40.284 -9.051 -15.153 1.00 0.00 C ATOM 1699 CD LYS B 44 39.811 -9.124 -13.698 1.00 0.00 C ATOM 1700 CE LYS B 44 38.633 -10.094 -13.593 1.00 0.00 C ATOM 1701 NZ LYS B 44 39.035 -11.275 -12.778 1.00 0.00 N ATOM 0 H LYS B 44 41.315 -6.982 -14.762 1.00 0.00 H new ATOM 0 HA LYS B 44 42.441 -9.143 -13.198 1.00 0.00 H new ATOM 0 HB2 LYS B 44 42.167 -9.142 -16.216 1.00 0.00 H new ATOM 0 HB3 LYS B 44 41.921 -10.466 -15.094 1.00 0.00 H new ATOM 0 HG2 LYS B 44 40.110 -8.052 -15.552 1.00 0.00 H new ATOM 0 HG3 LYS B 44 39.710 -9.744 -15.767 1.00 0.00 H new ATOM 0 HD2 LYS B 44 40.627 -9.455 -13.055 1.00 0.00 H new ATOM 0 HD3 LYS B 44 39.513 -8.135 -13.351 1.00 0.00 H new ATOM 0 HE2 LYS B 44 37.778 -9.597 -13.135 1.00 0.00 H new ATOM 0 HE3 LYS B 44 38.321 -10.414 -14.587 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 38.235 -11.935 -12.706 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 39.839 -11.753 -13.233 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 39.312 -10.962 -11.826 1.00 0.00 H new ATOM 1715 N ARG B 45 44.444 -7.389 -15.001 1.00 0.00 N ATOM 1716 CA ARG B 45 45.877 -7.232 -15.376 1.00 0.00 C ATOM 1717 C ARG B 45 46.652 -6.710 -14.169 1.00 0.00 C ATOM 1718 O ARG B 45 47.730 -6.164 -14.298 1.00 0.00 O ATOM 1719 CB ARG B 45 45.999 -6.237 -16.533 1.00 0.00 C ATOM 1720 CG ARG B 45 44.897 -6.507 -17.557 1.00 0.00 C ATOM 1721 CD ARG B 45 45.154 -7.852 -18.238 1.00 0.00 C ATOM 1722 NE ARG B 45 45.609 -7.619 -19.637 1.00 0.00 N ATOM 1723 CZ ARG B 45 46.354 -8.507 -20.237 1.00 0.00 C ATOM 1724 NH1 ARG B 45 47.579 -8.709 -19.834 1.00 0.00 N ATOM 1725 NH2 ARG B 45 45.874 -9.192 -21.238 1.00 0.00 N ATOM 0 H ARG B 45 43.864 -6.563 -15.146 1.00 0.00 H new ATOM 0 HA ARG B 45 46.284 -8.194 -15.687 1.00 0.00 H new ATOM 0 HB2 ARG B 45 45.920 -5.216 -16.159 1.00 0.00 H new ATOM 0 HB3 ARG B 45 46.978 -6.329 -17.004 1.00 0.00 H new ATOM 0 HG2 ARG B 45 43.924 -6.516 -17.066 1.00 0.00 H new ATOM 0 HG3 ARG B 45 44.872 -5.710 -18.300 1.00 0.00 H new ATOM 0 HD2 ARG B 45 45.909 -8.413 -17.687 1.00 0.00 H new ATOM 0 HD3 ARG B 45 44.245 -8.453 -18.235 1.00 0.00 H new ATOM 0 HE ARG B 45 45.338 -6.766 -20.126 1.00 0.00 H new ATOM 0 HH11 ARG B 45 47.953 -8.173 -19.051 1.00 0.00 H new ATOM 0 HH12 ARG B 45 48.162 -9.403 -20.302 1.00 0.00 H new ATOM 0 HH21 ARG B 45 44.916 -9.034 -21.552 1.00 0.00 H new ATOM 0 HH22 ARG B 45 46.456 -9.886 -21.707 1.00 0.00 H new ATOM 1739 N SER B 46 46.109 -6.869 -12.992 1.00 0.00 N ATOM 1740 CA SER B 46 46.813 -6.377 -11.776 1.00 0.00 C ATOM 1741 C SER B 46 47.129 -4.891 -11.949 1.00 0.00 C ATOM 1742 O SER B 46 48.194 -4.427 -11.590 1.00 0.00 O ATOM 1743 CB SER B 46 48.115 -7.157 -11.591 1.00 0.00 C ATOM 1744 OG SER B 46 47.884 -8.254 -10.718 1.00 0.00 O ATOM 0 H SER B 46 45.209 -7.318 -12.821 1.00 0.00 H new ATOM 0 HA SER B 46 46.179 -6.519 -10.900 1.00 0.00 H new ATOM 0 HB2 SER B 46 48.479 -7.514 -12.554 1.00 0.00 H new ATOM 0 HB3 SER B 46 48.887 -6.506 -11.180 1.00 0.00 H new ATOM 0 HG SER B 46 48.716 -8.758 -10.598 1.00 0.00 H new ATOM 1750 N ARG B 47 46.215 -4.141 -12.502 1.00 0.00 N ATOM 1751 CA ARG B 47 46.472 -2.687 -12.702 1.00 0.00 C ATOM 1752 C ARG B 47 45.592 -1.869 -11.754 1.00 0.00 C ATOM 1753 O ARG B 47 44.539 -1.392 -12.127 1.00 0.00 O ATOM 1754 CB ARG B 47 46.149 -2.308 -14.149 1.00 0.00 C ATOM 1755 CG ARG B 47 47.338 -1.566 -14.762 1.00 0.00 C ATOM 1756 CD ARG B 47 46.828 -0.420 -15.638 1.00 0.00 C ATOM 1757 NE ARG B 47 47.982 0.394 -16.115 1.00 0.00 N ATOM 1758 CZ ARG B 47 47.771 1.523 -16.735 1.00 0.00 C ATOM 1759 NH1 ARG B 47 46.773 2.285 -16.379 1.00 0.00 N ATOM 1760 NH2 ARG B 47 48.554 1.887 -17.713 1.00 0.00 N ATOM 0 H ARG B 47 45.305 -4.471 -12.823 1.00 0.00 H new ATOM 0 HA ARG B 47 47.520 -2.475 -12.492 1.00 0.00 H new ATOM 0 HB2 ARG B 47 45.928 -3.204 -14.730 1.00 0.00 H new ATOM 0 HB3 ARG B 47 45.259 -1.679 -14.181 1.00 0.00 H new ATOM 0 HG2 ARG B 47 47.983 -1.176 -13.974 1.00 0.00 H new ATOM 0 HG3 ARG B 47 47.941 -2.252 -15.357 1.00 0.00 H new ATOM 0 HD2 ARG B 47 46.274 -0.817 -16.488 1.00 0.00 H new ATOM 0 HD3 ARG B 47 46.138 0.205 -15.072 1.00 0.00 H new ATOM 0 HE ARG B 47 48.936 0.069 -15.957 1.00 0.00 H new ATOM 0 HH11 ARG B 47 46.159 1.998 -15.617 1.00 0.00 H new ATOM 0 HH12 ARG B 47 46.607 3.167 -16.863 1.00 0.00 H new ATOM 0 HH21 ARG B 47 49.331 1.289 -17.993 1.00 0.00 H new ATOM 0 HH22 ARG B 47 48.389 2.769 -18.197 1.00 0.00 H new ATOM 1774 N GLN B 48 46.017 -1.696 -10.532 1.00 0.00 N ATOM 1775 CA GLN B 48 45.203 -0.901 -9.570 1.00 0.00 C ATOM 1776 C GLN B 48 45.078 0.533 -10.088 1.00 0.00 C ATOM 1777 O GLN B 48 46.052 1.146 -10.479 1.00 0.00 O ATOM 1778 CB GLN B 48 45.884 -0.902 -8.195 1.00 0.00 C ATOM 1779 CG GLN B 48 47.042 0.103 -8.183 1.00 0.00 C ATOM 1780 CD GLN B 48 46.520 1.480 -7.762 1.00 0.00 C ATOM 1781 OE1 GLN B 48 45.603 1.576 -6.971 1.00 0.00 O ATOM 1782 NE2 GLN B 48 47.067 2.556 -8.261 1.00 0.00 N ATOM 0 H GLN B 48 46.890 -2.070 -10.159 1.00 0.00 H new ATOM 0 HA GLN B 48 44.211 -1.341 -9.474 1.00 0.00 H new ATOM 0 HB2 GLN B 48 45.160 -0.645 -7.421 1.00 0.00 H new ATOM 0 HB3 GLN B 48 46.256 -1.900 -7.965 1.00 0.00 H new ATOM 0 HG2 GLN B 48 47.819 -0.229 -7.494 1.00 0.00 H new ATOM 0 HG3 GLN B 48 47.497 0.162 -9.172 1.00 0.00 H new ATOM 0 HE21 GLN B 48 47.837 2.476 -8.925 1.00 0.00 H new ATOM 0 HE22 GLN B 48 46.724 3.477 -7.986 1.00 0.00 H new ATOM 1791 N VAL B 49 43.893 1.077 -10.098 1.00 0.00 N ATOM 1792 CA VAL B 49 43.729 2.470 -10.600 1.00 0.00 C ATOM 1793 C VAL B 49 42.762 3.239 -9.700 1.00 0.00 C ATOM 1794 O VAL B 49 41.855 2.675 -9.120 1.00 0.00 O ATOM 1795 CB VAL B 49 43.163 2.433 -12.023 1.00 0.00 C ATOM 1796 CG1 VAL B 49 43.512 3.732 -12.754 1.00 0.00 C ATOM 1797 CG2 VAL B 49 43.762 1.244 -12.778 1.00 0.00 C ATOM 0 H VAL B 49 43.037 0.621 -9.783 1.00 0.00 H new ATOM 0 HA VAL B 49 44.699 2.966 -10.597 1.00 0.00 H new ATOM 0 HB VAL B 49 42.079 2.328 -11.977 1.00 0.00 H new ATOM 0 HG11 VAL B 49 43.107 3.700 -13.766 1.00 0.00 H new ATOM 0 HG12 VAL B 49 43.083 4.578 -12.218 1.00 0.00 H new ATOM 0 HG13 VAL B 49 44.595 3.844 -12.800 1.00 0.00 H new ATOM 0 HG21 VAL B 49 43.360 1.216 -13.791 1.00 0.00 H new ATOM 0 HG22 VAL B 49 44.846 1.349 -12.820 1.00 0.00 H new ATOM 0 HG23 VAL B 49 43.507 0.319 -12.261 1.00 0.00 H new ATOM 1807 N CYS B 50 42.928 4.530 -9.603 1.00 0.00 N ATOM 1808 CA CYS B 50 42.006 5.340 -8.776 1.00 0.00 C ATOM 1809 C CYS B 50 40.944 5.906 -9.713 1.00 0.00 C ATOM 1810 O CYS B 50 41.192 6.100 -10.886 1.00 0.00 O ATOM 1811 CB CYS B 50 42.776 6.474 -8.089 1.00 0.00 C ATOM 1812 SG CYS B 50 41.710 7.278 -6.867 1.00 0.00 S ATOM 0 H CYS B 50 43.669 5.056 -10.066 1.00 0.00 H new ATOM 0 HA CYS B 50 41.545 4.734 -7.996 1.00 0.00 H new ATOM 0 HB2 CYS B 50 43.669 6.079 -7.604 1.00 0.00 H new ATOM 0 HB3 CYS B 50 43.110 7.201 -8.829 1.00 0.00 H new ATOM 1817 N ALA B 51 39.759 6.141 -9.238 1.00 0.00 N ATOM 1818 CA ALA B 51 38.710 6.654 -10.158 1.00 0.00 C ATOM 1819 C ALA B 51 38.014 7.876 -9.563 1.00 0.00 C ATOM 1820 O ALA B 51 37.883 8.012 -8.363 1.00 0.00 O ATOM 1821 CB ALA B 51 37.685 5.548 -10.399 1.00 0.00 C ATOM 0 H ALA B 51 39.472 6.004 -8.269 1.00 0.00 H new ATOM 0 HA ALA B 51 39.175 6.951 -11.098 1.00 0.00 H new ATOM 0 HB1 ALA B 51 36.909 5.911 -11.073 1.00 0.00 H new ATOM 0 HB2 ALA B 51 38.179 4.685 -10.846 1.00 0.00 H new ATOM 0 HB3 ALA B 51 37.234 5.257 -9.450 1.00 0.00 H new ATOM 1827 N ASP B 52 37.555 8.758 -10.408 1.00 0.00 N ATOM 1828 CA ASP B 52 36.848 9.974 -9.923 1.00 0.00 C ATOM 1829 C ASP B 52 35.896 9.577 -8.796 1.00 0.00 C ATOM 1830 O ASP B 52 35.523 8.430 -8.682 1.00 0.00 O ATOM 1831 CB ASP B 52 36.043 10.575 -11.081 1.00 0.00 C ATOM 1832 CG ASP B 52 36.506 12.012 -11.336 1.00 0.00 C ATOM 1833 OD1 ASP B 52 37.627 12.180 -11.789 1.00 0.00 O ATOM 1834 OD2 ASP B 52 35.732 12.918 -11.075 1.00 0.00 O ATOM 0 H ASP B 52 37.641 8.686 -11.422 1.00 0.00 H new ATOM 0 HA ASP B 52 37.567 10.706 -9.556 1.00 0.00 H new ATOM 0 HB2 ASP B 52 36.176 9.974 -11.981 1.00 0.00 H new ATOM 0 HB3 ASP B 52 34.979 10.562 -10.843 1.00 0.00 H new ATOM 1839 N PRO B 53 35.520 10.537 -7.998 1.00 0.00 N ATOM 1840 CA PRO B 53 34.594 10.305 -6.879 1.00 0.00 C ATOM 1841 C PRO B 53 33.159 10.211 -7.407 1.00 0.00 C ATOM 1842 O PRO B 53 32.230 9.944 -6.671 1.00 0.00 O ATOM 1843 CB PRO B 53 34.777 11.543 -5.998 1.00 0.00 C ATOM 1844 CG PRO B 53 35.349 12.650 -6.918 1.00 0.00 C ATOM 1845 CD PRO B 53 35.982 11.933 -8.127 1.00 0.00 C ATOM 0 HA PRO B 53 34.786 9.379 -6.337 1.00 0.00 H new ATOM 0 HB2 PRO B 53 33.828 11.853 -5.561 1.00 0.00 H new ATOM 0 HB3 PRO B 53 35.456 11.335 -5.171 1.00 0.00 H new ATOM 0 HG2 PRO B 53 34.562 13.331 -7.240 1.00 0.00 H new ATOM 0 HG3 PRO B 53 36.092 13.248 -6.390 1.00 0.00 H new ATOM 0 HD2 PRO B 53 35.657 12.376 -9.068 1.00 0.00 H new ATOM 0 HD3 PRO B 53 37.070 11.997 -8.104 1.00 0.00 H new ATOM 1853 N SER B 54 32.975 10.426 -8.683 1.00 0.00 N ATOM 1854 CA SER B 54 31.608 10.347 -9.271 1.00 0.00 C ATOM 1855 C SER B 54 31.686 9.625 -10.620 1.00 0.00 C ATOM 1856 O SER B 54 31.069 10.023 -11.589 1.00 0.00 O ATOM 1857 CB SER B 54 31.053 11.758 -9.473 1.00 0.00 C ATOM 1858 OG SER B 54 29.647 11.687 -9.677 1.00 0.00 O ATOM 0 H SER B 54 33.717 10.654 -9.345 1.00 0.00 H new ATOM 0 HA SER B 54 30.949 9.798 -8.598 1.00 0.00 H new ATOM 0 HB2 SER B 54 31.275 12.376 -8.603 1.00 0.00 H new ATOM 0 HB3 SER B 54 31.533 12.230 -10.330 1.00 0.00 H new ATOM 0 HG SER B 54 29.456 11.099 -10.438 1.00 0.00 H new ATOM 1864 N GLU B 55 32.446 8.564 -10.683 1.00 0.00 N ATOM 1865 CA GLU B 55 32.574 7.803 -11.967 1.00 0.00 C ATOM 1866 C GLU B 55 31.289 7.059 -12.253 1.00 0.00 C ATOM 1867 O GLU B 55 30.539 6.691 -11.370 1.00 0.00 O ATOM 1868 CB GLU B 55 33.733 6.788 -11.908 1.00 0.00 C ATOM 1869 CG GLU B 55 34.678 7.123 -10.756 1.00 0.00 C ATOM 1870 CD GLU B 55 34.246 6.383 -9.483 1.00 0.00 C ATOM 1871 OE1 GLU B 55 33.057 6.361 -9.202 1.00 0.00 O ATOM 1872 OE2 GLU B 55 35.112 5.854 -8.805 1.00 0.00 O ATOM 0 H GLU B 55 32.985 8.189 -9.902 1.00 0.00 H new ATOM 0 HA GLU B 55 32.780 8.523 -12.759 1.00 0.00 H new ATOM 0 HB2 GLU B 55 33.336 5.781 -11.780 1.00 0.00 H new ATOM 0 HB3 GLU B 55 34.281 6.797 -12.850 1.00 0.00 H new ATOM 0 HG2 GLU B 55 35.698 6.843 -11.020 1.00 0.00 H new ATOM 0 HG3 GLU B 55 34.679 8.198 -10.578 1.00 0.00 H new ATOM 1879 N GLU B 56 31.045 6.850 -13.499 1.00 0.00 N ATOM 1880 CA GLU B 56 29.822 6.139 -13.928 1.00 0.00 C ATOM 1881 C GLU B 56 30.106 4.638 -13.977 1.00 0.00 C ATOM 1882 O GLU B 56 29.335 3.826 -13.504 1.00 0.00 O ATOM 1883 CB GLU B 56 29.460 6.664 -15.308 1.00 0.00 C ATOM 1884 CG GLU B 56 27.949 6.888 -15.399 1.00 0.00 C ATOM 1885 CD GLU B 56 27.503 6.777 -16.858 1.00 0.00 C ATOM 1886 OE1 GLU B 56 28.043 7.500 -17.679 1.00 0.00 O ATOM 1887 OE2 GLU B 56 26.628 5.971 -17.129 1.00 0.00 O ATOM 0 H GLU B 56 31.654 7.148 -14.261 1.00 0.00 H new ATOM 0 HA GLU B 56 28.996 6.305 -13.236 1.00 0.00 H new ATOM 0 HB2 GLU B 56 29.987 7.598 -15.501 1.00 0.00 H new ATOM 0 HB3 GLU B 56 29.778 5.954 -16.072 1.00 0.00 H new ATOM 0 HG2 GLU B 56 27.424 6.152 -14.790 1.00 0.00 H new ATOM 0 HG3 GLU B 56 27.692 7.870 -15.003 1.00 0.00 H new ATOM 1894 N TRP B 57 31.217 4.276 -14.543 1.00 0.00 N ATOM 1895 CA TRP B 57 31.599 2.842 -14.635 1.00 0.00 C ATOM 1896 C TRP B 57 31.892 2.290 -13.241 1.00 0.00 C ATOM 1897 O TRP B 57 31.734 1.114 -12.985 1.00 0.00 O ATOM 1898 CB TRP B 57 32.852 2.731 -15.505 1.00 0.00 C ATOM 1899 CG TRP B 57 33.936 3.652 -15.003 1.00 0.00 C ATOM 1900 CD1 TRP B 57 34.033 4.972 -15.283 1.00 0.00 C ATOM 1901 CD2 TRP B 57 35.086 3.343 -14.162 1.00 0.00 C ATOM 1902 NE1 TRP B 57 35.161 5.483 -14.681 1.00 0.00 N ATOM 1903 CE2 TRP B 57 35.846 4.519 -13.981 1.00 0.00 C ATOM 1904 CE3 TRP B 57 35.537 2.171 -13.551 1.00 0.00 C ATOM 1905 CZ2 TRP B 57 37.014 4.525 -13.224 1.00 0.00 C ATOM 1906 CZ3 TRP B 57 36.713 2.167 -12.785 1.00 0.00 C ATOM 1907 CH2 TRP B 57 37.453 3.344 -12.623 1.00 0.00 C ATOM 0 H TRP B 57 31.890 4.923 -14.954 1.00 0.00 H new ATOM 0 HA TRP B 57 30.783 2.268 -15.074 1.00 0.00 H new ATOM 0 HB2 TRP B 57 33.212 1.702 -15.502 1.00 0.00 H new ATOM 0 HB3 TRP B 57 32.607 2.980 -16.537 1.00 0.00 H new ATOM 0 HD1 TRP B 57 33.335 5.536 -15.884 1.00 0.00 H new ATOM 0 HE1 TRP B 57 35.453 6.458 -14.747 1.00 0.00 H new ATOM 0 HE3 TRP B 57 34.974 1.257 -13.669 1.00 0.00 H new ATOM 0 HZ2 TRP B 57 37.578 5.438 -13.102 1.00 0.00 H new ATOM 0 HZ3 TRP B 57 37.048 1.252 -12.319 1.00 0.00 H new ATOM 0 HH2 TRP B 57 38.359 3.338 -12.036 1.00 0.00 H new ATOM 1918 N VAL B 58 32.320 3.123 -12.340 1.00 0.00 N ATOM 1919 CA VAL B 58 32.626 2.635 -10.968 1.00 0.00 C ATOM 1920 C VAL B 58 31.330 2.445 -10.179 1.00 0.00 C ATOM 1921 O VAL B 58 31.154 1.458 -9.503 1.00 0.00 O ATOM 1922 CB VAL B 58 33.492 3.658 -10.250 1.00 0.00 C ATOM 1923 CG1 VAL B 58 33.726 3.199 -8.811 1.00 0.00 C ATOM 1924 CG2 VAL B 58 34.834 3.790 -10.967 1.00 0.00 C ATOM 0 H VAL B 58 32.472 4.120 -12.492 1.00 0.00 H new ATOM 0 HA VAL B 58 33.151 1.683 -11.040 1.00 0.00 H new ATOM 0 HB VAL B 58 32.988 4.625 -10.250 1.00 0.00 H new ATOM 0 HG11 VAL B 58 34.347 3.930 -8.292 1.00 0.00 H new ATOM 0 HG12 VAL B 58 32.769 3.107 -8.298 1.00 0.00 H new ATOM 0 HG13 VAL B 58 34.230 2.232 -8.815 1.00 0.00 H new ATOM 0 HG21 VAL B 58 35.452 4.524 -10.450 1.00 0.00 H new ATOM 0 HG22 VAL B 58 35.342 2.825 -10.970 1.00 0.00 H new ATOM 0 HG23 VAL B 58 34.667 4.115 -11.994 1.00 0.00 H new ATOM 1934 N GLN B 59 30.432 3.387 -10.251 1.00 0.00 N ATOM 1935 CA GLN B 59 29.149 3.264 -9.497 1.00 0.00 C ATOM 1936 C GLN B 59 28.632 1.829 -9.584 1.00 0.00 C ATOM 1937 O GLN B 59 28.089 1.292 -8.638 1.00 0.00 O ATOM 1938 CB GLN B 59 28.117 4.203 -10.116 1.00 0.00 C ATOM 1939 CG GLN B 59 28.530 5.654 -9.863 1.00 0.00 C ATOM 1940 CD GLN B 59 27.851 6.166 -8.592 1.00 0.00 C ATOM 1941 OE1 GLN B 59 26.792 5.697 -8.224 1.00 0.00 O ATOM 1942 NE2 GLN B 59 28.419 7.115 -7.901 1.00 0.00 N ATOM 0 H GLN B 59 30.530 4.241 -10.801 1.00 0.00 H new ATOM 0 HA GLN B 59 29.317 3.525 -8.452 1.00 0.00 H new ATOM 0 HB2 GLN B 59 28.038 4.018 -11.187 1.00 0.00 H new ATOM 0 HB3 GLN B 59 27.133 4.014 -9.686 1.00 0.00 H new ATOM 0 HG2 GLN B 59 29.613 5.722 -9.762 1.00 0.00 H new ATOM 0 HG3 GLN B 59 28.250 6.276 -10.713 1.00 0.00 H new ATOM 0 HE21 GLN B 59 29.308 7.509 -8.210 1.00 0.00 H new ATOM 0 HE22 GLN B 59 27.974 7.464 -7.052 1.00 0.00 H new ATOM 1951 N LYS B 60 28.792 1.210 -10.715 1.00 0.00 N ATOM 1952 CA LYS B 60 28.308 -0.188 -10.880 1.00 0.00 C ATOM 1953 C LYS B 60 29.328 -1.162 -10.286 1.00 0.00 C ATOM 1954 O LYS B 60 28.982 -2.083 -9.574 1.00 0.00 O ATOM 1955 CB LYS B 60 28.128 -0.481 -12.374 1.00 0.00 C ATOM 1956 CG LYS B 60 27.993 -1.993 -12.600 1.00 0.00 C ATOM 1957 CD LYS B 60 26.635 -2.297 -13.235 1.00 0.00 C ATOM 1958 CE LYS B 60 25.720 -2.948 -12.197 1.00 0.00 C ATOM 1959 NZ LYS B 60 24.728 -1.949 -11.715 1.00 0.00 N ATOM 0 H LYS B 60 29.240 1.613 -11.538 1.00 0.00 H new ATOM 0 HA LYS B 60 27.356 -0.309 -10.362 1.00 0.00 H new ATOM 0 HB2 LYS B 60 27.242 0.032 -12.749 1.00 0.00 H new ATOM 0 HB3 LYS B 60 28.980 -0.096 -12.934 1.00 0.00 H new ATOM 0 HG2 LYS B 60 28.796 -2.347 -13.247 1.00 0.00 H new ATOM 0 HG3 LYS B 60 28.090 -2.523 -11.652 1.00 0.00 H new ATOM 0 HD2 LYS B 60 26.183 -1.378 -13.609 1.00 0.00 H new ATOM 0 HD3 LYS B 60 26.762 -2.961 -14.090 1.00 0.00 H new ATOM 0 HE2 LYS B 60 25.207 -3.804 -12.635 1.00 0.00 H new ATOM 0 HE3 LYS B 60 26.310 -3.323 -11.361 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 24.105 -2.391 -11.009 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 25.227 -1.146 -11.282 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 24.158 -1.611 -12.517 1.00 0.00 H new ATOM 1973 N TYR B 61 30.578 -0.989 -10.608 1.00 0.00 N ATOM 1974 CA TYR B 61 31.623 -1.927 -10.097 1.00 0.00 C ATOM 1975 C TYR B 61 31.762 -1.811 -8.572 1.00 0.00 C ATOM 1976 O TYR B 61 32.414 -2.616 -7.938 1.00 0.00 O ATOM 1977 CB TYR B 61 32.954 -1.612 -10.793 1.00 0.00 C ATOM 1978 CG TYR B 61 32.701 -1.320 -12.246 1.00 0.00 C ATOM 1979 CD1 TYR B 61 31.532 -1.768 -12.864 1.00 0.00 C ATOM 1980 CD2 TYR B 61 33.639 -0.594 -12.973 1.00 0.00 C ATOM 1981 CE1 TYR B 61 31.301 -1.485 -14.202 1.00 0.00 C ATOM 1982 CE2 TYR B 61 33.410 -0.313 -14.315 1.00 0.00 C ATOM 1983 CZ TYR B 61 32.238 -0.754 -14.935 1.00 0.00 C ATOM 1984 OH TYR B 61 32.010 -0.472 -16.267 1.00 0.00 O ATOM 0 H TYR B 61 30.925 -0.238 -11.204 1.00 0.00 H new ATOM 0 HA TYR B 61 31.331 -2.953 -10.320 1.00 0.00 H new ATOM 0 HB2 TYR B 61 33.432 -0.756 -10.317 1.00 0.00 H new ATOM 0 HB3 TYR B 61 33.637 -2.455 -10.694 1.00 0.00 H new ATOM 0 HD1 TYR B 61 30.807 -2.335 -12.300 1.00 0.00 H new ATOM 0 HD2 TYR B 61 34.544 -0.249 -12.495 1.00 0.00 H new ATOM 0 HE1 TYR B 61 30.395 -1.831 -14.678 1.00 0.00 H new ATOM 0 HE2 TYR B 61 34.140 0.248 -14.880 1.00 0.00 H new ATOM 0 HH TYR B 61 31.676 0.445 -16.355 1.00 0.00 H new ATOM 1994 N VAL B 62 31.142 -0.829 -7.977 1.00 0.00 N ATOM 1995 CA VAL B 62 31.223 -0.673 -6.495 1.00 0.00 C ATOM 1996 C VAL B 62 29.924 -1.176 -5.851 1.00 0.00 C ATOM 1997 O VAL B 62 29.807 -1.255 -4.645 1.00 0.00 O ATOM 1998 CB VAL B 62 31.421 0.802 -6.151 1.00 0.00 C ATOM 1999 CG1 VAL B 62 31.429 0.978 -4.631 1.00 0.00 C ATOM 2000 CG2 VAL B 62 32.753 1.278 -6.729 1.00 0.00 C ATOM 0 H VAL B 62 30.580 -0.124 -8.455 1.00 0.00 H new ATOM 0 HA VAL B 62 32.063 -1.254 -6.116 1.00 0.00 H new ATOM 0 HB VAL B 62 30.607 1.389 -6.576 1.00 0.00 H new ATOM 0 HG11 VAL B 62 31.570 2.031 -4.387 1.00 0.00 H new ATOM 0 HG12 VAL B 62 30.480 0.635 -4.220 1.00 0.00 H new ATOM 0 HG13 VAL B 62 32.243 0.394 -4.201 1.00 0.00 H new ATOM 0 HG21 VAL B 62 32.900 2.331 -6.486 1.00 0.00 H new ATOM 0 HG22 VAL B 62 33.566 0.691 -6.302 1.00 0.00 H new ATOM 0 HG23 VAL B 62 32.745 1.153 -7.812 1.00 0.00 H new ATOM 2010 N SER B 63 28.944 -1.500 -6.651 1.00 0.00 N ATOM 2011 CA SER B 63 27.646 -1.981 -6.103 1.00 0.00 C ATOM 2012 C SER B 63 27.891 -3.064 -5.056 1.00 0.00 C ATOM 2013 O SER B 63 27.341 -3.028 -3.974 1.00 0.00 O ATOM 2014 CB SER B 63 26.797 -2.553 -7.239 1.00 0.00 C ATOM 2015 OG SER B 63 25.887 -3.510 -6.710 1.00 0.00 O ATOM 0 H SER B 63 28.989 -1.451 -7.669 1.00 0.00 H new ATOM 0 HA SER B 63 27.122 -1.146 -5.637 1.00 0.00 H new ATOM 0 HB2 SER B 63 26.251 -1.753 -7.739 1.00 0.00 H new ATOM 0 HB3 SER B 63 27.437 -3.018 -7.988 1.00 0.00 H new ATOM 0 HG SER B 63 25.340 -3.877 -7.436 1.00 0.00 H new