USER MOD reduce.3.24.130724 H: found=0, std=0, add=766, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 766 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 42 SER OG : rot -26:sc= 0.147 USER MOD Set 1.2: B 43 THR OG1 : rot 42:sc= 0.615 USER MOD Set 2.1: A 42 SER OG : rot -24:sc= 0.128 USER MOD Set 2.2: A 43 THR OG1 : rot 41:sc= 0.644 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 HIS : no HD1:sc= -0.187 X(o=-0.19,f=-0.38) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 74:sc= 1.29 USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ -162:sc= -0.0121 (180deg=-0.132) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 GLN : amide:sc= -1.45 K(o=-1.4,f=-7.5!) USER MOD Single : B 47 HIS : no HD1:sc= -0.182 X(o=-0.18,f=-0.38) USER MOD Single : B 50 THR OG1 : rot 180:sc= 0 USER MOD Single : B 70 THR OG1 : rot 89:sc= 1.22 USER MOD Single : B 74 TYR OH : rot 180:sc= 0 USER MOD Single : B 78 LYS NZ :NH3+ -160:sc= -0.0149 (180deg=-0.132) USER MOD Single : B 79 SER OG : rot 180:sc= 0 USER MOD Single : B 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 42 -8.533 0.356 -0.522 1.00 0.00 N ATOM 2 CA SER A 42 -7.772 1.007 -1.582 1.00 0.00 C ATOM 3 C SER A 42 -6.865 0.007 -2.293 1.00 0.00 C ATOM 4 O SER A 42 -6.804 -0.029 -3.522 1.00 0.00 O ATOM 5 CB SER A 42 -6.935 2.152 -1.007 1.00 0.00 C ATOM 6 OG SER A 42 -6.153 1.712 0.089 1.00 0.00 O ATOM 0 HA SER A 42 -8.478 1.410 -2.308 1.00 0.00 H new ATOM 0 HB2 SER A 42 -6.285 2.556 -1.783 1.00 0.00 H new ATOM 0 HB3 SER A 42 -7.591 2.962 -0.688 1.00 0.00 H new ATOM 0 HG SER A 42 -6.569 0.921 0.491 1.00 0.00 H new ATOM 12 N THR A 43 -6.161 -0.804 -1.510 1.00 0.00 N ATOM 13 CA THR A 43 -5.256 -1.804 -2.063 1.00 0.00 C ATOM 14 C THR A 43 -5.386 -3.132 -1.325 1.00 0.00 C ATOM 15 O THR A 43 -4.909 -3.276 -0.198 1.00 0.00 O ATOM 16 CB THR A 43 -3.791 -1.334 -1.997 1.00 0.00 C ATOM 17 OG1 THR A 43 -3.448 -0.988 -0.650 1.00 0.00 O ATOM 18 CG2 THR A 43 -3.565 -0.136 -2.907 1.00 0.00 C ATOM 0 H THR A 43 -6.200 -0.788 -0.491 1.00 0.00 H new ATOM 0 HA THR A 43 -5.538 -1.943 -3.107 1.00 0.00 H new ATOM 0 HB THR A 43 -3.155 -2.152 -2.335 1.00 0.00 H new ATOM 0 HG1 THR A 43 -3.843 -1.640 -0.034 1.00 0.00 H new ATOM 0 HG21 THR A 43 -2.523 0.178 -2.843 1.00 0.00 H new ATOM 0 HG22 THR A 43 -3.799 -0.411 -3.935 1.00 0.00 H new ATOM 0 HG23 THR A 43 -4.211 0.685 -2.595 1.00 0.00 H new ATOM 26 N LEU A 44 -6.034 -4.098 -1.965 1.00 0.00 N ATOM 27 CA LEU A 44 -6.226 -5.416 -1.369 1.00 0.00 C ATOM 28 C LEU A 44 -4.895 -6.008 -0.916 1.00 0.00 C ATOM 29 O LEU A 44 -3.825 -5.626 -1.389 1.00 0.00 O ATOM 30 CB LEU A 44 -6.901 -6.356 -2.369 1.00 0.00 C ATOM 31 CG LEU A 44 -5.966 -7.215 -3.220 1.00 0.00 C ATOM 32 CD1 LEU A 44 -6.019 -8.668 -2.773 1.00 0.00 C ATOM 33 CD2 LEU A 44 -6.325 -7.095 -4.694 1.00 0.00 C ATOM 0 H LEU A 44 -6.436 -3.994 -2.897 1.00 0.00 H new ATOM 0 HA LEU A 44 -6.868 -5.303 -0.496 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.570 -7.018 -1.820 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.521 -5.758 -3.037 1.00 0.00 H new ATOM 0 HG LEU A 44 -4.947 -6.852 -3.084 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -5.347 -9.263 -3.391 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -5.712 -8.739 -1.730 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.037 -9.044 -2.878 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -5.649 -7.713 -5.285 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -7.351 -7.431 -4.847 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -6.233 -6.055 -5.007 1.00 0.00 H new ATOM 45 N PRO A 45 -4.962 -6.965 0.022 1.00 0.00 N ATOM 46 CA PRO A 45 -3.771 -7.632 0.558 1.00 0.00 C ATOM 47 C PRO A 45 -3.109 -8.546 -0.467 1.00 0.00 C ATOM 48 O PRO A 45 -3.410 -8.478 -1.658 1.00 0.00 O ATOM 49 CB PRO A 45 -4.321 -8.451 1.728 1.00 0.00 C ATOM 50 CG PRO A 45 -5.751 -8.688 1.387 1.00 0.00 C ATOM 51 CD PRO A 45 -6.204 -7.469 0.631 1.00 0.00 C ATOM 0 HA PRO A 45 -2.998 -6.919 0.845 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -3.780 -9.391 1.842 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -4.223 -7.911 2.670 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -5.864 -9.587 0.781 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -6.348 -8.833 2.287 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -6.949 -7.718 -0.124 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -6.656 -6.730 1.293 1.00 0.00 H new ATOM 59 N GLN A 46 -2.206 -9.400 0.004 1.00 0.00 N ATOM 60 CA GLN A 46 -1.501 -10.327 -0.873 1.00 0.00 C ATOM 61 C GLN A 46 -2.445 -11.404 -1.398 1.00 0.00 C ATOM 62 O GLN A 46 -2.653 -11.526 -2.606 1.00 0.00 O ATOM 63 CB GLN A 46 -0.331 -10.975 -0.130 1.00 0.00 C ATOM 64 CG GLN A 46 1.026 -10.651 -0.731 1.00 0.00 C ATOM 65 CD GLN A 46 2.019 -10.155 0.301 1.00 0.00 C ATOM 66 OE1 GLN A 46 2.919 -10.886 0.716 1.00 0.00 O ATOM 67 NE2 GLN A 46 1.860 -8.905 0.723 1.00 0.00 N ATOM 0 H GLN A 46 -1.946 -9.469 0.988 1.00 0.00 H new ATOM 0 HA GLN A 46 -1.115 -9.763 -1.722 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -0.346 -10.648 0.910 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -0.468 -12.056 -0.126 1.00 0.00 H new ATOM 0 HG2 GLN A 46 1.426 -11.542 -1.216 1.00 0.00 H new ATOM 0 HG3 GLN A 46 0.904 -9.894 -1.506 1.00 0.00 H new ATOM 0 HE21 GLN A 46 1.100 -8.334 0.352 1.00 0.00 H new ATOM 0 HE22 GLN A 46 2.498 -8.516 1.418 1.00 0.00 H new ATOM 76 N HIS A 47 -3.013 -12.183 -0.483 1.00 0.00 N ATOM 77 CA HIS A 47 -3.936 -13.250 -0.855 1.00 0.00 C ATOM 78 C HIS A 47 -5.130 -13.290 0.094 1.00 0.00 C ATOM 79 O HIS A 47 -5.046 -13.844 1.190 1.00 0.00 O ATOM 80 CB HIS A 47 -3.218 -14.600 -0.847 1.00 0.00 C ATOM 81 CG HIS A 47 -3.743 -15.563 -1.866 1.00 0.00 C ATOM 82 ND1 HIS A 47 -4.112 -15.185 -3.140 1.00 0.00 N ATOM 83 CD2 HIS A 47 -3.958 -16.898 -1.794 1.00 0.00 C ATOM 84 CE1 HIS A 47 -4.534 -16.245 -3.807 1.00 0.00 C ATOM 85 NE2 HIS A 47 -4.450 -17.297 -3.013 1.00 0.00 N ATOM 0 H HIS A 47 -2.851 -12.096 0.520 1.00 0.00 H new ATOM 0 HA HIS A 47 -4.301 -13.047 -1.862 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.155 -14.438 -1.026 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -3.310 -15.046 0.143 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.777 -17.531 -0.938 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -4.887 -16.250 -4.828 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -4.709 -18.251 -3.264 1.00 0.00 H new ATOM 93 N ALA A 48 -6.241 -12.700 -0.335 1.00 0.00 N ATOM 94 CA ALA A 48 -7.452 -12.669 0.475 1.00 0.00 C ATOM 95 C ALA A 48 -8.694 -12.526 -0.398 1.00 0.00 C ATOM 96 O ALA A 48 -8.682 -11.807 -1.397 1.00 0.00 O ATOM 97 CB ALA A 48 -7.382 -11.535 1.487 1.00 0.00 C ATOM 0 H ALA A 48 -6.327 -12.237 -1.240 1.00 0.00 H new ATOM 0 HA ALA A 48 -7.524 -13.615 1.011 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -8.293 -11.524 2.085 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -6.522 -11.682 2.140 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -7.281 -10.585 0.962 1.00 0.00 H new ATOM 103 N ARG A 49 -9.763 -13.216 -0.016 1.00 0.00 N ATOM 104 CA ARG A 49 -11.012 -13.167 -0.766 1.00 0.00 C ATOM 105 C ARG A 49 -11.874 -11.993 -0.310 1.00 0.00 C ATOM 106 O ARG A 49 -13.063 -12.153 -0.030 1.00 0.00 O ATOM 107 CB ARG A 49 -11.785 -14.477 -0.597 1.00 0.00 C ATOM 108 CG ARG A 49 -10.994 -15.707 -1.010 1.00 0.00 C ATOM 109 CD ARG A 49 -11.706 -16.485 -2.106 1.00 0.00 C ATOM 110 NE ARG A 49 -11.990 -15.652 -3.272 1.00 0.00 N ATOM 111 CZ ARG A 49 -12.840 -15.997 -4.232 1.00 0.00 C ATOM 112 NH1 ARG A 49 -13.486 -17.153 -4.166 1.00 0.00 N ATOM 113 NH2 ARG A 49 -13.045 -15.186 -5.262 1.00 0.00 N ATOM 0 H ARG A 49 -9.789 -13.816 0.809 1.00 0.00 H new ATOM 0 HA ARG A 49 -10.769 -13.030 -1.820 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -12.084 -14.581 0.446 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -12.700 -14.428 -1.188 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -10.006 -15.406 -1.359 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -10.843 -16.352 -0.144 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -11.091 -17.333 -2.407 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -12.639 -16.891 -1.715 1.00 0.00 H new ATOM 0 HE ARG A 49 -11.509 -14.756 -3.353 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -13.331 -17.780 -3.376 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -14.138 -17.416 -4.905 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -12.549 -14.296 -5.317 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -13.698 -15.452 -5.999 1.00 0.00 H new ATOM 127 N THR A 50 -11.267 -10.813 -0.236 1.00 0.00 N ATOM 128 CA THR A 50 -11.977 -9.613 0.187 1.00 0.00 C ATOM 129 C THR A 50 -12.740 -9.855 1.485 1.00 0.00 C ATOM 130 O THR A 50 -13.970 -9.857 1.519 1.00 0.00 O ATOM 131 CB THR A 50 -12.965 -9.134 -0.893 1.00 0.00 C ATOM 132 OG1 THR A 50 -12.355 -9.216 -2.186 1.00 0.00 O ATOM 133 CG2 THR A 50 -13.408 -7.703 -0.626 1.00 0.00 C ATOM 0 H THR A 50 -10.284 -10.663 -0.464 1.00 0.00 H new ATOM 0 HA THR A 50 -11.224 -8.841 0.348 1.00 0.00 H new ATOM 0 HB THR A 50 -13.842 -9.780 -0.863 1.00 0.00 H new ATOM 0 HG1 THR A 50 -12.990 -8.911 -2.867 1.00 0.00 H new ATOM 0 HG21 THR A 50 -14.105 -7.387 -1.402 1.00 0.00 H new ATOM 0 HG22 THR A 50 -13.898 -7.649 0.346 1.00 0.00 H new ATOM 0 HG23 THR A 50 -12.538 -7.046 -0.631 1.00 0.00 H new ATOM 141 N PRO A 51 -11.994 -10.062 2.581 1.00 0.00 N ATOM 142 CA PRO A 51 -12.579 -10.307 3.902 1.00 0.00 C ATOM 143 C PRO A 51 -13.253 -9.066 4.477 1.00 0.00 C ATOM 144 O PRO A 51 -14.315 -9.154 5.096 1.00 0.00 O ATOM 145 CB PRO A 51 -11.372 -10.704 4.756 1.00 0.00 C ATOM 146 CG PRO A 51 -10.206 -10.066 4.084 1.00 0.00 C ATOM 147 CD PRO A 51 -10.522 -10.072 2.613 1.00 0.00 C ATOM 0 HA PRO A 51 -13.362 -11.065 3.867 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -11.480 -10.351 5.782 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -11.259 -11.787 4.802 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -10.055 -9.049 4.447 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -9.288 -10.617 4.288 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -10.103 -9.201 2.108 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -10.115 -10.954 2.118 1.00 0.00 H new ATOM 155 N LEU A 52 -12.632 -7.911 4.268 1.00 0.00 N ATOM 156 CA LEU A 52 -13.173 -6.650 4.765 1.00 0.00 C ATOM 157 C LEU A 52 -14.597 -6.434 4.264 1.00 0.00 C ATOM 158 O LEU A 52 -15.552 -6.471 5.041 1.00 0.00 O ATOM 159 CB LEU A 52 -12.284 -5.484 4.330 1.00 0.00 C ATOM 160 CG LEU A 52 -12.897 -4.089 4.457 1.00 0.00 C ATOM 161 CD1 LEU A 52 -13.194 -3.767 5.913 1.00 0.00 C ATOM 162 CD2 LEU A 52 -11.970 -3.042 3.855 1.00 0.00 C ATOM 0 H LEU A 52 -11.753 -7.821 3.758 1.00 0.00 H new ATOM 0 HA LEU A 52 -13.194 -6.696 5.854 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -11.368 -5.512 4.920 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -11.998 -5.640 3.290 1.00 0.00 H new ATOM 0 HG LEU A 52 -13.836 -4.074 3.904 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -13.630 -2.770 5.984 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -13.896 -4.499 6.312 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -12.269 -3.800 6.489 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -12.422 -2.055 3.954 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -11.014 -3.058 4.379 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -11.809 -3.263 2.800 1.00 0.00 H new ATOM 174 N ILE A 53 -14.733 -6.209 2.961 1.00 0.00 N ATOM 175 CA ILE A 53 -16.041 -5.990 2.356 1.00 0.00 C ATOM 176 C ILE A 53 -16.991 -7.141 2.670 1.00 0.00 C ATOM 177 O ILE A 53 -18.130 -6.924 3.082 1.00 0.00 O ATOM 178 CB ILE A 53 -15.935 -5.829 0.828 1.00 0.00 C ATOM 179 CG1 ILE A 53 -14.940 -4.720 0.478 1.00 0.00 C ATOM 180 CG2 ILE A 53 -17.301 -5.530 0.231 1.00 0.00 C ATOM 181 CD1 ILE A 53 -14.779 -4.500 -1.010 1.00 0.00 C ATOM 0 H ILE A 53 -13.953 -6.174 2.304 1.00 0.00 H new ATOM 0 HA ILE A 53 -16.436 -5.068 2.783 1.00 0.00 H new ATOM 0 HB ILE A 53 -15.572 -6.765 0.403 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -15.268 -3.789 0.941 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -13.969 -4.965 0.908 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -17.209 -5.419 -0.849 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -17.983 -6.350 0.455 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -17.691 -4.606 0.659 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -14.059 -3.700 -1.184 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -14.421 -5.418 -1.477 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -15.740 -4.224 -1.443 1.00 0.00 H new ATOM 193 N ALA A 54 -16.514 -8.366 2.474 1.00 0.00 N ATOM 194 CA ALA A 54 -17.319 -9.551 2.739 1.00 0.00 C ATOM 195 C ALA A 54 -17.913 -9.508 4.143 1.00 0.00 C ATOM 196 O ALA A 54 -19.132 -9.522 4.312 1.00 0.00 O ATOM 197 CB ALA A 54 -16.483 -10.809 2.556 1.00 0.00 C ATOM 0 H ALA A 54 -15.573 -8.563 2.132 1.00 0.00 H new ATOM 0 HA ALA A 54 -18.142 -9.568 2.025 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -17.097 -11.687 2.757 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -16.111 -10.853 1.532 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -15.640 -10.790 3.247 1.00 0.00 H new ATOM 203 N ALA A 55 -17.044 -9.455 5.147 1.00 0.00 N ATOM 204 CA ALA A 55 -17.483 -9.409 6.536 1.00 0.00 C ATOM 205 C ALA A 55 -18.512 -8.304 6.750 1.00 0.00 C ATOM 206 O ALA A 55 -19.417 -8.436 7.572 1.00 0.00 O ATOM 207 CB ALA A 55 -16.291 -9.209 7.460 1.00 0.00 C ATOM 0 H ALA A 55 -16.031 -9.443 5.024 1.00 0.00 H new ATOM 0 HA ALA A 55 -17.957 -10.362 6.773 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -16.634 -9.177 8.494 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -15.591 -10.035 7.335 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -15.793 -8.271 7.213 1.00 0.00 H new ATOM 213 N GLY A 56 -18.366 -7.213 6.004 1.00 0.00 N ATOM 214 CA GLY A 56 -19.289 -6.100 6.128 1.00 0.00 C ATOM 215 C GLY A 56 -20.714 -6.489 5.787 1.00 0.00 C ATOM 216 O GLY A 56 -21.621 -6.331 6.604 1.00 0.00 O ATOM 0 H GLY A 56 -17.625 -7.080 5.316 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -19.255 -5.715 7.147 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -18.969 -5.291 5.471 1.00 0.00 H new ATOM 220 N VAL A 57 -20.913 -6.997 4.574 1.00 0.00 N ATOM 221 CA VAL A 57 -22.238 -7.408 4.126 1.00 0.00 C ATOM 222 C VAL A 57 -22.751 -8.590 4.940 1.00 0.00 C ATOM 223 O VAL A 57 -23.943 -8.681 5.237 1.00 0.00 O ATOM 224 CB VAL A 57 -22.231 -7.791 2.634 1.00 0.00 C ATOM 225 CG1 VAL A 57 -23.649 -8.028 2.137 1.00 0.00 C ATOM 226 CG2 VAL A 57 -21.542 -6.713 1.811 1.00 0.00 C ATOM 0 H VAL A 57 -20.173 -7.133 3.885 1.00 0.00 H new ATOM 0 HA VAL A 57 -22.901 -6.555 4.272 1.00 0.00 H new ATOM 0 HB VAL A 57 -21.671 -8.719 2.517 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -23.624 -8.297 1.081 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -24.104 -8.838 2.708 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -24.236 -7.119 2.266 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -21.546 -7.000 0.759 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -22.073 -5.768 1.932 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -20.513 -6.597 2.152 1.00 0.00 H new ATOM 236 N ILE A 58 -21.845 -9.493 5.299 1.00 0.00 N ATOM 237 CA ILE A 58 -22.206 -10.668 6.081 1.00 0.00 C ATOM 238 C ILE A 58 -22.679 -10.276 7.477 1.00 0.00 C ATOM 239 O ILE A 58 -23.738 -10.708 7.929 1.00 0.00 O ATOM 240 CB ILE A 58 -21.022 -11.646 6.208 1.00 0.00 C ATOM 241 CG1 ILE A 58 -20.643 -12.203 4.834 1.00 0.00 C ATOM 242 CG2 ILE A 58 -21.369 -12.775 7.166 1.00 0.00 C ATOM 243 CD1 ILE A 58 -19.402 -13.067 4.854 1.00 0.00 C ATOM 0 H ILE A 58 -20.855 -9.433 5.060 1.00 0.00 H new ATOM 0 HA ILE A 58 -23.020 -11.162 5.550 1.00 0.00 H new ATOM 0 HB ILE A 58 -20.164 -11.106 6.609 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -21.477 -12.788 4.445 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -20.487 -11.373 4.145 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -20.523 -13.458 7.245 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -21.595 -12.362 8.149 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -22.238 -13.316 6.791 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -19.193 -13.427 3.847 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -18.556 -12.480 5.212 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -19.561 -13.917 5.517 1.00 0.00 H new ATOM 255 N GLY A 59 -21.885 -9.453 8.155 1.00 0.00 N ATOM 256 CA GLY A 59 -22.240 -9.014 9.492 1.00 0.00 C ATOM 257 C GLY A 59 -23.607 -8.362 9.545 1.00 0.00 C ATOM 258 O GLY A 59 -24.453 -8.742 10.352 1.00 0.00 O ATOM 0 H GLY A 59 -21.002 -9.083 7.802 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -22.222 -9.869 10.168 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -21.490 -8.308 9.850 1.00 0.00 H new ATOM 262 N GLY A 60 -23.823 -7.374 8.681 1.00 0.00 N ATOM 263 CA GLY A 60 -25.098 -6.682 8.650 1.00 0.00 C ATOM 264 C GLY A 60 -26.264 -7.622 8.415 1.00 0.00 C ATOM 265 O GLY A 60 -27.306 -7.505 9.061 1.00 0.00 O ATOM 0 H GLY A 60 -23.138 -7.041 8.003 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -25.245 -6.155 9.593 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -25.079 -5.928 7.863 1.00 0.00 H new ATOM 269 N LEU A 61 -26.089 -8.557 7.488 1.00 0.00 N ATOM 270 CA LEU A 61 -27.136 -9.522 7.168 1.00 0.00 C ATOM 271 C LEU A 61 -27.369 -10.479 8.332 1.00 0.00 C ATOM 272 O LEU A 61 -28.473 -10.564 8.869 1.00 0.00 O ATOM 273 CB LEU A 61 -26.763 -10.310 5.911 1.00 0.00 C ATOM 274 CG LEU A 61 -26.908 -9.565 4.584 1.00 0.00 C ATOM 275 CD1 LEU A 61 -26.254 -10.350 3.457 1.00 0.00 C ATOM 276 CD2 LEU A 61 -28.376 -9.307 4.275 1.00 0.00 C ATOM 0 H LEU A 61 -25.233 -8.668 6.945 1.00 0.00 H new ATOM 0 HA LEU A 61 -28.059 -8.972 6.984 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -25.729 -10.641 6.008 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -27.382 -11.206 5.871 1.00 0.00 H new ATOM 0 HG LEU A 61 -26.401 -8.604 4.671 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -26.367 -9.804 2.520 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -25.194 -10.483 3.674 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -26.732 -11.326 3.368 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -28.460 -8.776 3.327 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -28.906 -10.257 4.207 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -28.814 -8.703 5.069 1.00 0.00 H new ATOM 288 N PHE A 62 -26.320 -11.198 8.719 1.00 0.00 N ATOM 289 CA PHE A 62 -26.410 -12.149 9.821 1.00 0.00 C ATOM 290 C PHE A 62 -27.026 -11.496 11.054 1.00 0.00 C ATOM 291 O PHE A 62 -28.024 -11.978 11.592 1.00 0.00 O ATOM 292 CB PHE A 62 -25.023 -12.700 10.161 1.00 0.00 C ATOM 293 CG PHE A 62 -25.039 -13.728 11.256 1.00 0.00 C ATOM 294 CD1 PHE A 62 -25.996 -14.731 11.270 1.00 0.00 C ATOM 295 CD2 PHE A 62 -24.097 -13.692 12.272 1.00 0.00 C ATOM 296 CE1 PHE A 62 -26.013 -15.678 12.276 1.00 0.00 C ATOM 297 CE2 PHE A 62 -24.109 -14.637 13.280 1.00 0.00 C ATOM 298 CZ PHE A 62 -25.069 -15.631 13.283 1.00 0.00 C ATOM 0 H PHE A 62 -25.398 -11.140 8.286 1.00 0.00 H new ATOM 0 HA PHE A 62 -27.054 -12.971 9.507 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -24.587 -13.142 9.265 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -24.376 -11.875 10.458 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -26.737 -14.773 10.485 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -23.345 -12.917 12.276 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -26.764 -16.454 12.275 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -23.368 -14.599 14.065 1.00 0.00 H new ATOM 0 HZ PHE A 62 -25.081 -16.369 14.071 1.00 0.00 H new ATOM 308 N ILE A 63 -26.425 -10.397 11.497 1.00 0.00 N ATOM 309 CA ILE A 63 -26.915 -9.677 12.666 1.00 0.00 C ATOM 310 C ILE A 63 -28.402 -9.365 12.537 1.00 0.00 C ATOM 311 O ILE A 63 -29.167 -9.529 13.488 1.00 0.00 O ATOM 312 CB ILE A 63 -26.142 -8.362 12.882 1.00 0.00 C ATOM 313 CG1 ILE A 63 -24.692 -8.655 13.270 1.00 0.00 C ATOM 314 CG2 ILE A 63 -26.822 -7.518 13.950 1.00 0.00 C ATOM 315 CD1 ILE A 63 -24.548 -9.298 14.632 1.00 0.00 C ATOM 0 H ILE A 63 -25.598 -9.986 11.064 1.00 0.00 H new ATOM 0 HA ILE A 63 -26.757 -10.327 13.526 1.00 0.00 H new ATOM 0 HB ILE A 63 -26.141 -7.800 11.948 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -24.249 -9.310 12.520 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -24.125 -7.724 13.255 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -26.265 -6.592 14.092 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -27.839 -7.285 13.636 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -26.850 -8.072 14.888 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -23.493 -9.477 14.840 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -24.961 -8.635 15.393 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -25.086 -10.246 14.646 1.00 0.00 H new ATOM 327 N LEU A 64 -28.805 -8.917 11.353 1.00 0.00 N ATOM 328 CA LEU A 64 -30.202 -8.583 11.097 1.00 0.00 C ATOM 329 C LEU A 64 -31.076 -9.832 11.136 1.00 0.00 C ATOM 330 O LEU A 64 -32.217 -9.791 11.597 1.00 0.00 O ATOM 331 CB LEU A 64 -30.341 -7.891 9.741 1.00 0.00 C ATOM 332 CG LEU A 64 -29.902 -6.427 9.686 1.00 0.00 C ATOM 333 CD1 LEU A 64 -29.759 -5.966 8.243 1.00 0.00 C ATOM 334 CD2 LEU A 64 -30.890 -5.545 10.434 1.00 0.00 C ATOM 0 H LEU A 64 -28.185 -8.777 10.556 1.00 0.00 H new ATOM 0 HA LEU A 64 -30.537 -7.903 11.880 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -29.760 -8.451 9.008 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -31.385 -7.948 9.432 1.00 0.00 H new ATOM 0 HG LEU A 64 -28.930 -6.341 10.171 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -29.446 -4.922 8.224 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -29.012 -6.578 7.738 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -30.717 -6.067 7.732 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -30.561 -4.507 10.384 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -31.876 -5.636 9.978 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -30.942 -5.859 11.476 1.00 0.00 H new ATOM 346 N VAL A 65 -30.533 -10.944 10.649 1.00 0.00 N ATOM 347 CA VAL A 65 -31.262 -12.206 10.631 1.00 0.00 C ATOM 348 C VAL A 65 -31.701 -12.608 12.034 1.00 0.00 C ATOM 349 O VAL A 65 -32.850 -12.996 12.248 1.00 0.00 O ATOM 350 CB VAL A 65 -30.408 -13.338 10.028 1.00 0.00 C ATOM 351 CG1 VAL A 65 -31.159 -14.660 10.082 1.00 0.00 C ATOM 352 CG2 VAL A 65 -30.008 -13.001 8.600 1.00 0.00 C ATOM 0 H VAL A 65 -29.591 -10.996 10.262 1.00 0.00 H new ATOM 0 HA VAL A 65 -32.143 -12.054 10.008 1.00 0.00 H new ATOM 0 HB VAL A 65 -29.499 -13.439 10.621 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -30.540 -15.448 9.652 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -31.390 -14.905 11.119 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -32.086 -14.576 9.514 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -29.405 -13.811 8.190 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -30.904 -12.871 7.992 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -29.428 -12.078 8.593 1.00 0.00 H new ATOM 362 N ILE A 66 -30.780 -12.512 12.987 1.00 0.00 N ATOM 363 CA ILE A 66 -31.073 -12.864 14.370 1.00 0.00 C ATOM 364 C ILE A 66 -32.091 -11.905 14.978 1.00 0.00 C ATOM 365 O ILE A 66 -33.150 -12.322 15.447 1.00 0.00 O ATOM 366 CB ILE A 66 -29.798 -12.858 15.235 1.00 0.00 C ATOM 367 CG1 ILE A 66 -28.726 -13.752 14.609 1.00 0.00 C ATOM 368 CG2 ILE A 66 -30.116 -13.315 16.651 1.00 0.00 C ATOM 369 CD1 ILE A 66 -27.460 -13.010 14.241 1.00 0.00 C ATOM 0 H ILE A 66 -29.825 -12.193 12.826 1.00 0.00 H new ATOM 0 HA ILE A 66 -31.489 -13.871 14.358 1.00 0.00 H new ATOM 0 HB ILE A 66 -29.413 -11.839 15.281 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -28.479 -14.552 15.307 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -29.134 -14.223 13.715 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -29.205 -13.305 17.250 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -30.849 -12.641 17.095 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -30.522 -14.326 16.624 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -26.745 -13.706 13.803 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -27.694 -12.227 13.519 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -27.028 -12.561 15.136 1.00 0.00 H new ATOM 381 N VAL A 67 -31.764 -10.617 14.964 1.00 0.00 N ATOM 382 CA VAL A 67 -32.650 -9.597 15.511 1.00 0.00 C ATOM 383 C VAL A 67 -34.044 -9.697 14.902 1.00 0.00 C ATOM 384 O VAL A 67 -35.040 -9.795 15.617 1.00 0.00 O ATOM 385 CB VAL A 67 -32.096 -8.181 15.266 1.00 0.00 C ATOM 386 CG1 VAL A 67 -32.957 -7.141 15.967 1.00 0.00 C ATOM 387 CG2 VAL A 67 -30.650 -8.088 15.729 1.00 0.00 C ATOM 0 H VAL A 67 -30.891 -10.255 14.579 1.00 0.00 H new ATOM 0 HA VAL A 67 -32.711 -9.774 16.585 1.00 0.00 H new ATOM 0 HB VAL A 67 -32.125 -7.979 14.195 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -32.550 -6.147 15.782 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -33.976 -7.193 15.583 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -32.963 -7.337 17.039 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -30.274 -7.081 15.549 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -30.594 -8.311 16.795 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -30.044 -8.806 15.176 1.00 0.00 H new ATOM 397 N GLY A 68 -34.108 -9.672 13.574 1.00 0.00 N ATOM 398 CA GLY A 68 -35.385 -9.762 12.890 1.00 0.00 C ATOM 399 C GLY A 68 -36.209 -10.946 13.354 1.00 0.00 C ATOM 400 O GLY A 68 -37.338 -10.782 13.819 1.00 0.00 O ATOM 0 H GLY A 68 -33.298 -9.591 12.960 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -35.948 -8.844 13.056 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -35.214 -9.841 11.816 1.00 0.00 H new ATOM 404 N LEU A 69 -35.646 -12.143 13.226 1.00 0.00 N ATOM 405 CA LEU A 69 -36.338 -13.361 13.635 1.00 0.00 C ATOM 406 C LEU A 69 -36.732 -13.296 15.107 1.00 0.00 C ATOM 407 O LEU A 69 -37.851 -13.650 15.478 1.00 0.00 O ATOM 408 CB LEU A 69 -35.451 -14.582 13.386 1.00 0.00 C ATOM 409 CG LEU A 69 -35.315 -15.027 11.929 1.00 0.00 C ATOM 410 CD1 LEU A 69 -34.406 -16.242 11.825 1.00 0.00 C ATOM 411 CD2 LEU A 69 -36.683 -15.330 11.335 1.00 0.00 C ATOM 0 H LEU A 69 -34.713 -12.296 12.843 1.00 0.00 H new ATOM 0 HA LEU A 69 -37.246 -13.451 13.039 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -34.455 -14.368 13.774 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -35.846 -15.417 13.965 1.00 0.00 H new ATOM 0 HG LEU A 69 -34.866 -14.213 11.360 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -34.321 -16.545 10.781 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -33.418 -15.992 12.212 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -34.827 -17.062 12.407 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -36.568 -15.645 10.298 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -37.159 -16.127 11.906 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -37.304 -14.435 11.375 1.00 0.00 H new ATOM 423 N THR A 70 -35.804 -12.839 15.943 1.00 0.00 N ATOM 424 CA THR A 70 -36.054 -12.726 17.374 1.00 0.00 C ATOM 425 C THR A 70 -37.343 -11.959 17.648 1.00 0.00 C ATOM 426 O THR A 70 -38.085 -12.284 18.575 1.00 0.00 O ATOM 427 CB THR A 70 -34.889 -12.022 18.094 1.00 0.00 C ATOM 428 OG1 THR A 70 -33.709 -12.831 18.023 1.00 0.00 O ATOM 429 CG2 THR A 70 -35.237 -11.752 19.550 1.00 0.00 C ATOM 0 H THR A 70 -34.873 -12.541 15.653 1.00 0.00 H new ATOM 0 HA THR A 70 -36.149 -13.741 17.759 1.00 0.00 H new ATOM 0 HB THR A 70 -34.707 -11.069 17.597 1.00 0.00 H new ATOM 0 HG1 THR A 70 -33.342 -12.795 17.115 1.00 0.00 H new ATOM 0 HG21 THR A 70 -34.399 -11.254 20.038 1.00 0.00 H new ATOM 0 HG22 THR A 70 -36.118 -11.113 19.601 1.00 0.00 H new ATOM 0 HG23 THR A 70 -35.443 -12.695 20.056 1.00 0.00 H new ATOM 437 N PHE A 71 -37.604 -10.940 16.836 1.00 0.00 N ATOM 438 CA PHE A 71 -38.804 -10.127 16.991 1.00 0.00 C ATOM 439 C PHE A 71 -40.048 -10.907 16.576 1.00 0.00 C ATOM 440 O PHE A 71 -41.032 -10.965 17.313 1.00 0.00 O ATOM 441 CB PHE A 71 -38.690 -8.847 16.160 1.00 0.00 C ATOM 442 CG PHE A 71 -39.810 -7.875 16.399 1.00 0.00 C ATOM 443 CD1 PHE A 71 -40.969 -7.934 15.641 1.00 0.00 C ATOM 444 CD2 PHE A 71 -39.705 -6.904 17.381 1.00 0.00 C ATOM 445 CE1 PHE A 71 -42.001 -7.040 15.859 1.00 0.00 C ATOM 446 CE2 PHE A 71 -40.733 -6.007 17.602 1.00 0.00 C ATOM 447 CZ PHE A 71 -41.883 -6.077 16.841 1.00 0.00 C ATOM 0 H PHE A 71 -37.000 -10.658 16.064 1.00 0.00 H new ATOM 0 HA PHE A 71 -38.898 -9.861 18.044 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -37.742 -8.359 16.387 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -38.668 -9.111 15.103 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -41.067 -8.686 14.872 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -38.809 -6.847 17.981 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -42.899 -7.095 15.261 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -40.637 -5.252 18.369 1.00 0.00 H new ATOM 0 HZ PHE A 71 -42.689 -5.379 17.014 1.00 0.00 H new ATOM 457 N ALA A 72 -39.995 -11.506 15.391 1.00 0.00 N ATOM 458 CA ALA A 72 -41.116 -12.284 14.877 1.00 0.00 C ATOM 459 C ALA A 72 -41.408 -13.483 15.773 1.00 0.00 C ATOM 460 O ALA A 72 -42.546 -13.944 15.859 1.00 0.00 O ATOM 461 CB ALA A 72 -40.832 -12.742 13.455 1.00 0.00 C ATOM 0 H ALA A 72 -39.188 -11.468 14.769 1.00 0.00 H new ATOM 0 HA ALA A 72 -41.999 -11.644 14.871 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -41.677 -13.322 13.084 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -40.680 -11.872 12.816 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -39.935 -13.361 13.444 1.00 0.00 H new ATOM 467 N VAL A 73 -40.373 -13.984 16.439 1.00 0.00 N ATOM 468 CA VAL A 73 -40.518 -15.130 17.329 1.00 0.00 C ATOM 469 C VAL A 73 -41.104 -14.711 18.673 1.00 0.00 C ATOM 470 O VAL A 73 -42.060 -15.315 19.160 1.00 0.00 O ATOM 471 CB VAL A 73 -39.168 -15.832 17.567 1.00 0.00 C ATOM 472 CG1 VAL A 73 -39.326 -16.972 18.561 1.00 0.00 C ATOM 473 CG2 VAL A 73 -38.591 -16.336 16.253 1.00 0.00 C ATOM 0 H VAL A 73 -39.424 -13.614 16.379 1.00 0.00 H new ATOM 0 HA VAL A 73 -41.199 -15.826 16.839 1.00 0.00 H new ATOM 0 HB VAL A 73 -38.472 -15.108 17.990 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -38.362 -17.456 18.716 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -39.692 -16.579 19.510 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -40.038 -17.699 18.171 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -37.637 -16.829 16.440 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -39.284 -17.045 15.800 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -38.438 -15.495 15.576 1.00 0.00 H new ATOM 483 N TYR A 74 -40.526 -13.673 19.266 1.00 0.00 N ATOM 484 CA TYR A 74 -40.990 -13.173 20.555 1.00 0.00 C ATOM 485 C TYR A 74 -42.482 -12.859 20.513 1.00 0.00 C ATOM 486 O TYR A 74 -43.221 -13.171 21.447 1.00 0.00 O ATOM 487 CB TYR A 74 -40.205 -11.922 20.953 1.00 0.00 C ATOM 488 CG TYR A 74 -40.361 -11.547 22.409 1.00 0.00 C ATOM 489 CD1 TYR A 74 -41.581 -11.102 22.905 1.00 0.00 C ATOM 490 CD2 TYR A 74 -39.290 -11.637 23.289 1.00 0.00 C ATOM 491 CE1 TYR A 74 -41.728 -10.758 24.235 1.00 0.00 C ATOM 492 CE2 TYR A 74 -39.429 -11.296 24.621 1.00 0.00 C ATOM 493 CZ TYR A 74 -40.649 -10.857 25.089 1.00 0.00 C ATOM 494 OH TYR A 74 -40.791 -10.515 26.414 1.00 0.00 O ATOM 0 H TYR A 74 -39.735 -13.161 18.875 1.00 0.00 H new ATOM 0 HA TYR A 74 -40.822 -13.951 21.299 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -39.148 -12.083 20.739 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -40.532 -11.086 20.334 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -42.428 -11.024 22.240 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -38.332 -11.979 22.926 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -42.683 -10.413 24.604 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -38.586 -11.373 25.292 1.00 0.00 H new ATOM 0 HH TYR A 74 -39.937 -10.643 26.878 1.00 0.00 H new ATOM 504 N VAL A 75 -42.919 -12.240 19.421 1.00 0.00 N ATOM 505 CA VAL A 75 -44.323 -11.884 19.253 1.00 0.00 C ATOM 506 C VAL A 75 -45.196 -13.129 19.144 1.00 0.00 C ATOM 507 O VAL A 75 -46.231 -13.233 19.803 1.00 0.00 O ATOM 508 CB VAL A 75 -44.536 -11.010 18.003 1.00 0.00 C ATOM 509 CG1 VAL A 75 -46.018 -10.762 17.771 1.00 0.00 C ATOM 510 CG2 VAL A 75 -43.781 -9.696 18.137 1.00 0.00 C ATOM 0 H VAL A 75 -42.320 -11.974 18.639 1.00 0.00 H new ATOM 0 HA VAL A 75 -44.613 -11.316 20.137 1.00 0.00 H new ATOM 0 HB VAL A 75 -44.142 -11.542 17.137 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -46.149 -10.143 16.884 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -46.528 -11.714 17.627 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -46.441 -10.251 18.636 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -43.943 -9.091 17.245 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -44.143 -9.156 19.012 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -42.716 -9.898 18.250 1.00 0.00 H new ATOM 520 N ARG A 76 -44.772 -14.071 18.309 1.00 0.00 N ATOM 521 CA ARG A 76 -45.515 -15.310 18.113 1.00 0.00 C ATOM 522 C ARG A 76 -45.786 -15.998 19.448 1.00 0.00 C ATOM 523 O ARG A 76 -46.839 -16.606 19.642 1.00 0.00 O ATOM 524 CB ARG A 76 -44.742 -16.253 17.189 1.00 0.00 C ATOM 525 CG ARG A 76 -44.774 -15.835 15.728 1.00 0.00 C ATOM 526 CD ARG A 76 -43.635 -16.467 14.943 1.00 0.00 C ATOM 527 NE ARG A 76 -43.327 -15.718 13.728 1.00 0.00 N ATOM 528 CZ ARG A 76 -42.512 -16.163 12.777 1.00 0.00 C ATOM 529 NH1 ARG A 76 -41.927 -17.346 12.901 1.00 0.00 N ATOM 530 NH2 ARG A 76 -42.281 -15.423 11.700 1.00 0.00 N ATOM 0 H ARG A 76 -43.917 -14.000 17.757 1.00 0.00 H new ATOM 0 HA ARG A 76 -46.470 -15.062 17.651 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -43.705 -16.304 17.521 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -45.156 -17.257 17.280 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -45.727 -16.125 15.286 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -44.708 -14.749 15.657 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -42.746 -16.519 15.572 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -43.900 -17.491 14.680 1.00 0.00 H new ATOM 0 HE ARG A 76 -43.761 -14.804 13.602 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -42.102 -17.917 13.728 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -41.302 -17.685 12.170 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -42.729 -14.512 11.602 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -41.655 -15.765 10.971 1.00 0.00 H new ATOM 544 N ARG A 77 -44.829 -15.898 20.365 1.00 0.00 N ATOM 545 CA ARG A 77 -44.964 -16.512 21.680 1.00 0.00 C ATOM 546 C ARG A 77 -46.219 -16.011 22.388 1.00 0.00 C ATOM 547 O ARG A 77 -46.745 -16.671 23.285 1.00 0.00 O ATOM 548 CB ARG A 77 -43.730 -16.214 22.534 1.00 0.00 C ATOM 549 CG ARG A 77 -42.454 -16.845 22.002 1.00 0.00 C ATOM 550 CD ARG A 77 -41.600 -17.408 23.127 1.00 0.00 C ATOM 551 NE ARG A 77 -41.399 -16.439 24.200 1.00 0.00 N ATOM 552 CZ ARG A 77 -40.493 -15.469 24.154 1.00 0.00 C ATOM 553 NH1 ARG A 77 -39.708 -15.340 23.094 1.00 0.00 N ATOM 554 NH2 ARG A 77 -40.370 -14.625 25.171 1.00 0.00 N ATOM 0 H ARG A 77 -43.952 -15.398 20.221 1.00 0.00 H new ATOM 0 HA ARG A 77 -45.051 -17.590 21.543 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -43.593 -15.134 22.595 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -43.906 -16.571 23.549 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -42.705 -17.641 21.301 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -41.883 -16.101 21.447 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -42.076 -18.302 23.530 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -40.632 -17.714 22.729 1.00 0.00 H new ATOM 0 HE ARG A 77 -41.987 -16.511 25.031 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -39.799 -15.987 22.310 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -39.013 -14.594 23.062 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -40.972 -14.721 25.989 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -39.674 -13.880 25.135 1.00 0.00 H new ATOM 568 N LYS A 78 -46.695 -14.840 21.979 1.00 0.00 N ATOM 569 CA LYS A 78 -47.888 -14.249 22.573 1.00 0.00 C ATOM 570 C LYS A 78 -49.152 -14.839 21.955 1.00 0.00 C ATOM 571 O LYS A 78 -50.175 -14.978 22.625 1.00 0.00 O ATOM 572 CB LYS A 78 -47.877 -12.730 22.386 1.00 0.00 C ATOM 573 CG LYS A 78 -47.847 -11.956 23.693 1.00 0.00 C ATOM 574 CD LYS A 78 -47.388 -10.523 23.482 1.00 0.00 C ATOM 575 CE LYS A 78 -46.214 -10.176 24.383 1.00 0.00 C ATOM 576 NZ LYS A 78 -46.566 -10.297 25.825 1.00 0.00 N ATOM 0 H LYS A 78 -46.272 -14.281 21.238 1.00 0.00 H new ATOM 0 HA LYS A 78 -47.885 -14.477 23.639 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -47.008 -12.452 21.789 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -48.760 -12.436 21.819 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -48.841 -11.958 24.141 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -47.179 -12.453 24.396 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -47.103 -10.381 22.440 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -48.215 -9.842 23.682 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -45.376 -10.835 24.157 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -45.884 -9.158 24.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -45.871 -9.775 26.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -47.514 -9.901 25.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -46.559 -11.300 26.101 1.00 0.00 H new ATOM 590 N SER A 79 -49.073 -15.185 20.674 1.00 0.00 N ATOM 591 CA SER A 79 -50.211 -15.757 19.965 1.00 0.00 C ATOM 592 C SER A 79 -50.433 -17.210 20.377 1.00 0.00 C ATOM 593 O SER A 79 -49.593 -17.811 21.046 1.00 0.00 O ATOM 594 CB SER A 79 -49.994 -15.672 18.453 1.00 0.00 C ATOM 595 OG SER A 79 -50.772 -14.633 17.884 1.00 0.00 O ATOM 0 H SER A 79 -48.232 -15.079 20.106 1.00 0.00 H new ATOM 0 HA SER A 79 -51.098 -15.182 20.230 1.00 0.00 H new ATOM 0 HB2 SER A 79 -48.939 -15.497 18.243 1.00 0.00 H new ATOM 0 HB3 SER A 79 -50.258 -16.623 17.990 1.00 0.00 H new ATOM 0 HG SER A 79 -50.614 -14.598 16.917 1.00 0.00 H new ATOM 601 N ILE A 80 -51.570 -17.766 19.972 1.00 0.00 N ATOM 602 CA ILE A 80 -51.902 -19.147 20.298 1.00 0.00 C ATOM 603 C ILE A 80 -51.489 -20.092 19.174 1.00 0.00 C ATOM 604 O ILE A 80 -52.312 -20.834 18.638 1.00 0.00 O ATOM 605 CB ILE A 80 -53.409 -19.316 20.566 1.00 0.00 C ATOM 606 CG1 ILE A 80 -53.912 -18.202 21.487 1.00 0.00 C ATOM 607 CG2 ILE A 80 -53.689 -20.681 21.176 1.00 0.00 C ATOM 608 CD1 ILE A 80 -55.389 -18.297 21.798 1.00 0.00 C ATOM 0 H ILE A 80 -52.276 -17.281 19.418 1.00 0.00 H new ATOM 0 HA ILE A 80 -51.349 -19.398 21.203 1.00 0.00 H new ATOM 0 HB ILE A 80 -53.942 -19.248 19.618 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -53.350 -18.231 22.420 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -53.708 -17.237 21.022 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -54.758 -20.785 21.360 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -53.361 -21.461 20.489 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -53.148 -20.777 22.118 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -55.676 -17.476 22.455 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -55.960 -18.237 20.872 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -55.597 -19.246 22.292 1.00 0.00 H new ATOM 620 N LYS A 81 -50.208 -20.059 18.822 1.00 0.00 N ATOM 621 CA LYS A 81 -49.683 -20.914 17.764 1.00 0.00 C ATOM 622 C LYS A 81 -50.516 -20.780 16.493 1.00 0.00 C ATOM 623 O LYS A 81 -50.838 -21.774 15.841 1.00 0.00 O ATOM 624 CB LYS A 81 -49.663 -22.374 18.222 1.00 0.00 C ATOM 625 CG LYS A 81 -48.552 -23.194 17.590 1.00 0.00 C ATOM 626 CD LYS A 81 -47.722 -23.912 18.641 1.00 0.00 C ATOM 627 CE LYS A 81 -46.524 -24.615 18.021 1.00 0.00 C ATOM 628 NZ LYS A 81 -45.248 -24.226 18.683 1.00 0.00 N ATOM 0 H LYS A 81 -49.514 -19.449 19.254 1.00 0.00 H new ATOM 0 HA LYS A 81 -48.664 -20.595 17.545 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -49.554 -22.405 19.306 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -50.622 -22.834 17.985 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -48.982 -23.924 16.904 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -47.908 -22.542 16.999 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -47.379 -23.195 19.387 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -48.343 -24.641 19.162 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -46.658 -25.694 18.096 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -46.471 -24.373 16.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -44.456 -24.727 18.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -45.107 -23.200 18.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -45.288 -24.480 19.691 1.00 0.00 H new ATOM 642 N LYS A 82 -50.861 -19.546 16.144 1.00 0.00 N ATOM 643 CA LYS A 82 -51.654 -19.281 14.949 1.00 0.00 C ATOM 644 C LYS A 82 -50.762 -19.177 13.716 1.00 0.00 C ATOM 645 O LYS A 82 -51.231 -18.859 12.623 1.00 0.00 O ATOM 646 CB LYS A 82 -52.457 -17.989 15.121 1.00 0.00 C ATOM 647 CG LYS A 82 -53.869 -18.215 15.634 1.00 0.00 C ATOM 648 CD LYS A 82 -54.782 -18.739 14.539 1.00 0.00 C ATOM 649 CE LYS A 82 -55.100 -20.214 14.737 1.00 0.00 C ATOM 650 NZ LYS A 82 -56.343 -20.614 14.020 1.00 0.00 N ATOM 0 H LYS A 82 -50.604 -18.712 16.672 1.00 0.00 H new ATOM 0 HA LYS A 82 -52.343 -20.114 14.808 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -51.929 -17.332 15.812 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -52.506 -17.471 14.163 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -53.847 -18.924 16.461 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -54.269 -17.280 16.026 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -55.708 -18.164 14.530 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -54.308 -18.595 13.568 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -54.265 -20.817 14.380 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -55.212 -20.422 15.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -56.526 -21.625 14.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -57.145 -20.057 14.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -56.228 -20.439 13.001 1.00 0.00 H new ATOM 664 N LYS A 83 -49.474 -19.448 13.899 1.00 0.00 N ATOM 665 CA LYS A 83 -48.516 -19.389 12.801 1.00 0.00 C ATOM 666 C LYS A 83 -48.709 -20.562 11.846 1.00 0.00 C ATOM 667 O LYS A 83 -49.694 -21.294 11.938 1.00 0.00 O ATOM 668 CB LYS A 83 -47.086 -19.389 13.345 1.00 0.00 C ATOM 669 CG LYS A 83 -46.864 -18.398 14.474 1.00 0.00 C ATOM 670 CD LYS A 83 -46.779 -19.096 15.821 1.00 0.00 C ATOM 671 CE LYS A 83 -45.368 -19.588 16.106 1.00 0.00 C ATOM 672 NZ LYS A 83 -45.258 -20.202 17.458 1.00 0.00 N ATOM 0 H LYS A 83 -49.069 -19.711 14.798 1.00 0.00 H new ATOM 0 HA LYS A 83 -48.689 -18.464 12.250 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -46.841 -20.390 13.699 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -46.397 -19.161 12.532 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -45.945 -17.840 14.294 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -47.679 -17.674 14.489 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -47.092 -18.410 16.608 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -47.470 -19.939 15.839 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -45.078 -20.319 15.351 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -44.670 -18.755 16.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -44.282 -20.525 17.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -45.510 -19.498 18.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -45.906 -21.013 17.525 1.00 0.00 H new ATOM 686 N ARG A 84 -47.761 -20.736 10.930 1.00 0.00 N ATOM 687 CA ARG A 84 -47.827 -21.821 9.959 1.00 0.00 C ATOM 688 C ARG A 84 -46.430 -22.326 9.612 1.00 0.00 C ATOM 689 O ARG A 84 -45.749 -21.758 8.758 1.00 0.00 O ATOM 690 CB ARG A 84 -48.543 -21.355 8.690 1.00 0.00 C ATOM 691 CG ARG A 84 -49.160 -22.489 7.887 1.00 0.00 C ATOM 692 CD ARG A 84 -48.130 -23.167 6.998 1.00 0.00 C ATOM 693 NE ARG A 84 -48.122 -24.617 7.177 1.00 0.00 N ATOM 694 CZ ARG A 84 -47.463 -25.452 6.382 1.00 0.00 C ATOM 695 NH1 ARG A 84 -46.761 -24.984 5.359 1.00 0.00 N ATOM 696 NH2 ARG A 84 -47.505 -26.759 6.610 1.00 0.00 N ATOM 0 H ARG A 84 -46.939 -20.139 10.841 1.00 0.00 H new ATOM 0 HA ARG A 84 -48.390 -22.641 10.405 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -49.326 -20.647 8.964 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -47.834 -20.818 8.059 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -49.595 -23.222 8.566 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -49.973 -22.101 7.273 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -48.341 -22.932 5.955 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -47.140 -22.769 7.221 1.00 0.00 H new ATOM 0 HE ARG A 84 -48.652 -25.010 7.955 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -46.726 -23.980 5.181 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -46.256 -25.628 4.750 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -48.044 -27.122 7.396 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -46.999 -27.400 5.999 1.00 0.00 H new ATOM 710 N ALA A 85 -46.009 -23.395 10.280 1.00 0.00 N ATOM 711 CA ALA A 85 -44.694 -23.977 10.041 1.00 0.00 C ATOM 712 C ALA A 85 -43.592 -22.944 10.248 1.00 0.00 C ATOM 713 O ALA A 85 -42.742 -23.137 11.116 1.00 0.00 O ATOM 714 CB ALA A 85 -44.621 -24.557 8.637 1.00 0.00 C ATOM 0 H ALA A 85 -46.560 -23.876 10.991 1.00 0.00 H new ATOM 0 HA ALA A 85 -44.542 -24.781 10.762 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -43.634 -24.988 8.472 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -45.379 -25.332 8.524 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -44.798 -23.767 7.907 1.00 0.00 H new TER 720 ALA A 85 ATOM 721 N SER B 42 -13.765 8.379 5.906 1.00 0.00 N ATOM 722 CA SER B 42 -15.088 8.021 5.407 1.00 0.00 C ATOM 723 C SER B 42 -15.137 6.549 5.006 1.00 0.00 C ATOM 724 O SER B 42 -16.076 5.830 5.348 1.00 0.00 O ATOM 725 CB SER B 42 -15.461 8.900 4.212 1.00 0.00 C ATOM 726 OG SER B 42 -14.439 8.888 3.231 1.00 0.00 O ATOM 0 HA SER B 42 -15.808 8.186 6.208 1.00 0.00 H new ATOM 0 HB2 SER B 42 -16.394 8.546 3.774 1.00 0.00 H new ATOM 0 HB3 SER B 42 -15.634 9.922 4.549 1.00 0.00 H new ATOM 0 HG SER B 42 -13.579 8.690 3.657 1.00 0.00 H new ATOM 732 N THR B 43 -14.117 6.108 4.275 1.00 0.00 N ATOM 733 CA THR B 43 -14.043 4.723 3.825 1.00 0.00 C ATOM 734 C THR B 43 -12.635 4.165 3.996 1.00 0.00 C ATOM 735 O THR B 43 -11.733 4.477 3.217 1.00 0.00 O ATOM 736 CB THR B 43 -14.460 4.590 2.349 1.00 0.00 C ATOM 737 OG1 THR B 43 -13.673 5.468 1.536 1.00 0.00 O ATOM 738 CG2 THR B 43 -15.936 4.913 2.172 1.00 0.00 C ATOM 0 H THR B 43 -13.332 6.689 3.982 1.00 0.00 H new ATOM 0 HA THR B 43 -14.735 4.151 4.443 1.00 0.00 H new ATOM 0 HB THR B 43 -14.291 3.559 2.038 1.00 0.00 H new ATOM 0 HG1 THR B 43 -12.738 5.435 1.829 1.00 0.00 H new ATOM 0 HG21 THR B 43 -16.207 4.812 1.121 1.00 0.00 H new ATOM 0 HG22 THR B 43 -16.533 4.224 2.769 1.00 0.00 H new ATOM 0 HG23 THR B 43 -16.127 5.935 2.499 1.00 0.00 H new ATOM 746 N LEU B 44 -12.452 3.337 5.019 1.00 0.00 N ATOM 747 CA LEU B 44 -11.152 2.733 5.292 1.00 0.00 C ATOM 748 C LEU B 44 -10.632 1.984 4.070 1.00 0.00 C ATOM 749 O LEU B 44 -11.397 1.513 3.228 1.00 0.00 O ATOM 750 CB LEU B 44 -11.251 1.780 6.485 1.00 0.00 C ATOM 751 CG LEU B 44 -11.856 0.406 6.197 1.00 0.00 C ATOM 752 CD1 LEU B 44 -10.809 -0.684 6.364 1.00 0.00 C ATOM 753 CD2 LEU B 44 -13.048 0.147 7.108 1.00 0.00 C ATOM 0 H LEU B 44 -13.187 3.069 5.673 1.00 0.00 H new ATOM 0 HA LEU B 44 -10.450 3.532 5.530 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -10.251 1.636 6.894 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -11.846 2.262 7.261 1.00 0.00 H new ATOM 0 HG LEU B 44 -12.203 0.392 5.164 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -11.258 -1.655 6.155 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -9.987 -0.508 5.671 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -10.431 -0.672 7.386 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -13.466 -0.835 6.889 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -12.725 0.180 8.148 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -13.807 0.910 6.939 1.00 0.00 H new ATOM 765 N PRO B 45 -9.300 1.868 3.969 1.00 0.00 N ATOM 766 CA PRO B 45 -8.648 1.174 2.855 1.00 0.00 C ATOM 767 C PRO B 45 -8.874 -0.334 2.898 1.00 0.00 C ATOM 768 O PRO B 45 -9.644 -0.831 3.720 1.00 0.00 O ATOM 769 CB PRO B 45 -7.165 1.497 3.054 1.00 0.00 C ATOM 770 CG PRO B 45 -7.030 1.773 4.512 1.00 0.00 C ATOM 771 CD PRO B 45 -8.327 2.404 4.936 1.00 0.00 C ATOM 0 HA PRO B 45 -9.043 1.493 1.890 1.00 0.00 H new ATOM 0 HB2 PRO B 45 -6.534 0.663 2.749 1.00 0.00 H new ATOM 0 HB3 PRO B 45 -6.864 2.359 2.458 1.00 0.00 H new ATOM 0 HG2 PRO B 45 -6.843 0.854 5.067 1.00 0.00 H new ATOM 0 HG3 PRO B 45 -6.190 2.439 4.707 1.00 0.00 H new ATOM 0 HD2 PRO B 45 -8.588 2.136 5.960 1.00 0.00 H new ATOM 0 HD3 PRO B 45 -8.277 3.492 4.894 1.00 0.00 H new ATOM 779 N GLN B 46 -8.199 -1.055 2.009 1.00 0.00 N ATOM 780 CA GLN B 46 -8.328 -2.506 1.947 1.00 0.00 C ATOM 781 C GLN B 46 -7.510 -3.173 3.048 1.00 0.00 C ATOM 782 O GLN B 46 -7.953 -4.143 3.663 1.00 0.00 O ATOM 783 CB GLN B 46 -7.878 -3.021 0.578 1.00 0.00 C ATOM 784 CG GLN B 46 -8.983 -3.711 -0.205 1.00 0.00 C ATOM 785 CD GLN B 46 -9.111 -3.185 -1.621 1.00 0.00 C ATOM 786 OE1 GLN B 46 -8.689 -3.835 -2.578 1.00 0.00 O ATOM 787 NE2 GLN B 46 -9.695 -2.001 -1.762 1.00 0.00 N ATOM 0 H GLN B 46 -7.558 -0.658 1.322 1.00 0.00 H new ATOM 0 HA GLN B 46 -9.378 -2.759 2.096 1.00 0.00 H new ATOM 0 HB2 GLN B 46 -7.496 -2.185 -0.008 1.00 0.00 H new ATOM 0 HB3 GLN B 46 -7.051 -3.718 0.715 1.00 0.00 H new ATOM 0 HG2 GLN B 46 -8.786 -4.783 -0.236 1.00 0.00 H new ATOM 0 HG3 GLN B 46 -9.931 -3.576 0.316 1.00 0.00 H new ATOM 0 HE21 GLN B 46 -10.030 -1.497 -0.941 1.00 0.00 H new ATOM 0 HE22 GLN B 46 -9.809 -1.596 -2.691 1.00 0.00 H new ATOM 796 N HIS B 47 -6.314 -2.646 3.291 1.00 0.00 N ATOM 797 CA HIS B 47 -5.434 -3.191 4.319 1.00 0.00 C ATOM 798 C HIS B 47 -5.193 -2.168 5.426 1.00 0.00 C ATOM 799 O HIS B 47 -4.365 -1.269 5.283 1.00 0.00 O ATOM 800 CB HIS B 47 -4.100 -3.618 3.705 1.00 0.00 C ATOM 801 CG HIS B 47 -3.478 -4.798 4.385 1.00 0.00 C ATOM 802 ND1 HIS B 47 -4.207 -5.881 4.830 1.00 0.00 N ATOM 803 CD2 HIS B 47 -2.187 -5.063 4.694 1.00 0.00 C ATOM 804 CE1 HIS B 47 -3.392 -6.760 5.385 1.00 0.00 C ATOM 805 NE2 HIS B 47 -2.160 -6.288 5.315 1.00 0.00 N ATOM 0 H HIS B 47 -5.932 -1.843 2.791 1.00 0.00 H new ATOM 0 HA HIS B 47 -5.921 -4.064 4.754 1.00 0.00 H new ATOM 0 HB2 HIS B 47 -4.253 -3.855 2.652 1.00 0.00 H new ATOM 0 HB3 HIS B 47 -3.406 -2.779 3.745 1.00 0.00 H new ATOM 0 HD2 HIS B 47 -1.337 -4.429 4.490 1.00 0.00 H new ATOM 0 HE1 HIS B 47 -3.683 -7.704 5.822 1.00 0.00 H new ATOM 0 HE2 HIS B 47 -1.325 -6.757 5.665 1.00 0.00 H new ATOM 813 N ALA B 48 -5.922 -2.312 6.527 1.00 0.00 N ATOM 814 CA ALA B 48 -5.787 -1.402 7.657 1.00 0.00 C ATOM 815 C ALA B 48 -5.598 -2.170 8.961 1.00 0.00 C ATOM 816 O ALA B 48 -5.255 -3.353 8.952 1.00 0.00 O ATOM 817 CB ALA B 48 -7.003 -0.492 7.750 1.00 0.00 C ATOM 0 H ALA B 48 -6.613 -3.051 6.661 1.00 0.00 H new ATOM 0 HA ALA B 48 -4.900 -0.790 7.495 1.00 0.00 H new ATOM 0 HB1 ALA B 48 -6.889 0.182 8.599 1.00 0.00 H new ATOM 0 HB2 ALA B 48 -7.093 0.090 6.833 1.00 0.00 H new ATOM 0 HB3 ALA B 48 -7.900 -1.096 7.885 1.00 0.00 H new ATOM 823 N ARG B 49 -5.823 -1.491 10.081 1.00 0.00 N ATOM 824 CA ARG B 49 -5.675 -2.109 11.393 1.00 0.00 C ATOM 825 C ARG B 49 -6.813 -3.088 11.663 1.00 0.00 C ATOM 826 O ARG B 49 -7.737 -2.790 12.422 1.00 0.00 O ATOM 827 CB ARG B 49 -5.639 -1.038 12.484 1.00 0.00 C ATOM 828 CG ARG B 49 -4.583 0.031 12.253 1.00 0.00 C ATOM 829 CD ARG B 49 -3.599 0.102 13.411 1.00 0.00 C ATOM 830 NE ARG B 49 -2.966 -1.188 13.670 1.00 0.00 N ATOM 831 CZ ARG B 49 -2.296 -1.468 14.783 1.00 0.00 C ATOM 832 NH1 ARG B 49 -2.174 -0.553 15.734 1.00 0.00 N ATOM 833 NH2 ARG B 49 -1.747 -2.665 14.945 1.00 0.00 N ATOM 0 H ARG B 49 -6.109 -0.512 10.106 1.00 0.00 H new ATOM 0 HA ARG B 49 -4.734 -2.660 11.404 1.00 0.00 H new ATOM 0 HB2 ARG B 49 -6.618 -0.562 12.547 1.00 0.00 H new ATOM 0 HB3 ARG B 49 -5.455 -1.517 13.446 1.00 0.00 H new ATOM 0 HG2 ARG B 49 -4.045 -0.181 11.329 1.00 0.00 H new ATOM 0 HG3 ARG B 49 -5.066 1.000 12.125 1.00 0.00 H new ATOM 0 HD2 ARG B 49 -2.832 0.844 13.190 1.00 0.00 H new ATOM 0 HD3 ARG B 49 -4.119 0.438 14.308 1.00 0.00 H new ATOM 0 HE ARG B 49 -3.042 -1.914 12.958 1.00 0.00 H new ATOM 0 HH11 ARG B 49 -2.595 0.368 15.612 1.00 0.00 H new ATOM 0 HH12 ARG B 49 -1.659 -0.770 16.587 1.00 0.00 H new ATOM 0 HH21 ARG B 49 -1.839 -3.371 14.215 1.00 0.00 H new ATOM 0 HH22 ARG B 49 -1.233 -2.879 15.800 1.00 0.00 H new ATOM 847 N THR B 50 -6.741 -4.259 11.038 1.00 0.00 N ATOM 848 CA THR B 50 -7.766 -5.282 11.210 1.00 0.00 C ATOM 849 C THR B 50 -9.106 -4.816 10.652 1.00 0.00 C ATOM 850 O THR B 50 -10.077 -4.624 11.384 1.00 0.00 O ATOM 851 CB THR B 50 -7.942 -5.657 12.693 1.00 0.00 C ATOM 852 OG1 THR B 50 -6.663 -5.757 13.329 1.00 0.00 O ATOM 853 CG2 THR B 50 -8.688 -6.975 12.833 1.00 0.00 C ATOM 0 H THR B 50 -5.984 -4.523 10.408 1.00 0.00 H new ATOM 0 HA THR B 50 -7.432 -6.161 10.659 1.00 0.00 H new ATOM 0 HB THR B 50 -8.527 -4.874 13.176 1.00 0.00 H new ATOM 0 HG1 THR B 50 -6.784 -5.994 14.272 1.00 0.00 H new ATOM 0 HG21 THR B 50 -8.800 -7.219 13.889 1.00 0.00 H new ATOM 0 HG22 THR B 50 -9.673 -6.886 12.374 1.00 0.00 H new ATOM 0 HG23 THR B 50 -8.126 -7.766 12.336 1.00 0.00 H new ATOM 861 N PRO B 51 -9.163 -4.631 9.325 1.00 0.00 N ATOM 862 CA PRO B 51 -10.381 -4.187 8.639 1.00 0.00 C ATOM 863 C PRO B 51 -11.467 -5.257 8.636 1.00 0.00 C ATOM 864 O PRO B 51 -12.653 -4.953 8.770 1.00 0.00 O ATOM 865 CB PRO B 51 -9.902 -3.906 7.213 1.00 0.00 C ATOM 866 CG PRO B 51 -8.700 -4.769 7.040 1.00 0.00 C ATOM 867 CD PRO B 51 -8.044 -4.842 8.391 1.00 0.00 C ATOM 0 HA PRO B 51 -10.834 -3.325 9.129 1.00 0.00 H new ATOM 0 HB2 PRO B 51 -10.673 -4.149 6.481 1.00 0.00 H new ATOM 0 HB3 PRO B 51 -9.656 -2.853 7.078 1.00 0.00 H new ATOM 0 HG2 PRO B 51 -8.980 -5.762 6.688 1.00 0.00 H new ATOM 0 HG3 PRO B 51 -8.021 -4.348 6.299 1.00 0.00 H new ATOM 0 HD2 PRO B 51 -7.562 -5.806 8.552 1.00 0.00 H new ATOM 0 HD3 PRO B 51 -7.275 -4.078 8.506 1.00 0.00 H new ATOM 875 N LEU B 52 -11.055 -6.511 8.482 1.00 0.00 N ATOM 876 CA LEU B 52 -11.994 -7.627 8.461 1.00 0.00 C ATOM 877 C LEU B 52 -12.836 -7.654 9.733 1.00 0.00 C ATOM 878 O LEU B 52 -14.042 -7.410 9.696 1.00 0.00 O ATOM 879 CB LEU B 52 -11.241 -8.950 8.306 1.00 0.00 C ATOM 880 CG LEU B 52 -12.028 -10.214 8.652 1.00 0.00 C ATOM 881 CD1 LEU B 52 -13.220 -10.373 7.722 1.00 0.00 C ATOM 882 CD2 LEU B 52 -11.127 -11.439 8.581 1.00 0.00 C ATOM 0 H LEU B 52 -10.078 -6.780 8.370 1.00 0.00 H new ATOM 0 HA LEU B 52 -12.660 -7.493 7.609 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -10.897 -9.031 7.275 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -10.352 -8.915 8.936 1.00 0.00 H new ATOM 0 HG LEU B 52 -12.400 -10.119 9.672 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -13.768 -11.278 7.984 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -13.877 -9.509 7.822 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -12.871 -10.446 6.692 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -11.704 -12.330 8.830 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -10.725 -11.537 7.573 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -10.306 -11.328 9.289 1.00 0.00 H new ATOM 894 N ILE B 53 -12.191 -7.951 10.856 1.00 0.00 N ATOM 895 CA ILE B 53 -12.880 -8.006 12.140 1.00 0.00 C ATOM 896 C ILE B 53 -13.599 -6.694 12.435 1.00 0.00 C ATOM 897 O ILE B 53 -14.769 -6.688 12.815 1.00 0.00 O ATOM 898 CB ILE B 53 -11.903 -8.314 13.290 1.00 0.00 C ATOM 899 CG1 ILE B 53 -11.124 -9.598 12.998 1.00 0.00 C ATOM 900 CG2 ILE B 53 -12.656 -8.433 14.607 1.00 0.00 C ATOM 901 CD1 ILE B 53 -10.133 -9.963 14.080 1.00 0.00 C ATOM 0 H ILE B 53 -11.193 -8.157 10.903 1.00 0.00 H new ATOM 0 HA ILE B 53 -13.612 -8.811 12.071 1.00 0.00 H new ATOM 0 HB ILE B 53 -11.192 -7.492 13.373 1.00 0.00 H new ATOM 0 HG12 ILE B 53 -11.829 -10.420 12.870 1.00 0.00 H new ATOM 0 HG13 ILE B 53 -10.592 -9.484 12.053 1.00 0.00 H new ATOM 0 HG21 ILE B 53 -11.952 -8.651 15.410 1.00 0.00 H new ATOM 0 HG22 ILE B 53 -13.169 -7.495 14.819 1.00 0.00 H new ATOM 0 HG23 ILE B 53 -13.387 -9.239 14.537 1.00 0.00 H new ATOM 0 HD11 ILE B 53 -9.617 -10.883 13.806 1.00 0.00 H new ATOM 0 HD12 ILE B 53 -9.405 -9.159 14.193 1.00 0.00 H new ATOM 0 HD13 ILE B 53 -10.661 -10.110 15.022 1.00 0.00 H new ATOM 913 N ALA B 54 -12.890 -5.585 12.256 1.00 0.00 N ATOM 914 CA ALA B 54 -13.461 -4.266 12.500 1.00 0.00 C ATOM 915 C ALA B 54 -14.774 -4.089 11.746 1.00 0.00 C ATOM 916 O ALA B 54 -15.817 -3.835 12.347 1.00 0.00 O ATOM 917 CB ALA B 54 -12.471 -3.180 12.103 1.00 0.00 C ATOM 0 H ALA B 54 -11.919 -5.573 11.943 1.00 0.00 H new ATOM 0 HA ALA B 54 -13.670 -4.179 13.566 1.00 0.00 H new ATOM 0 HB1 ALA B 54 -12.911 -2.200 12.291 1.00 0.00 H new ATOM 0 HB2 ALA B 54 -11.559 -3.287 12.690 1.00 0.00 H new ATOM 0 HB3 ALA B 54 -12.233 -3.274 11.043 1.00 0.00 H new ATOM 923 N ALA B 55 -14.716 -4.223 10.425 1.00 0.00 N ATOM 924 CA ALA B 55 -15.901 -4.079 9.589 1.00 0.00 C ATOM 925 C ALA B 55 -17.044 -4.947 10.103 1.00 0.00 C ATOM 926 O ALA B 55 -18.209 -4.557 10.039 1.00 0.00 O ATOM 927 CB ALA B 55 -15.575 -4.433 8.145 1.00 0.00 C ATOM 0 H ALA B 55 -13.860 -4.431 9.911 1.00 0.00 H new ATOM 0 HA ALA B 55 -16.222 -3.038 9.633 1.00 0.00 H new ATOM 0 HB1 ALA B 55 -16.469 -4.321 7.532 1.00 0.00 H new ATOM 0 HB2 ALA B 55 -14.795 -3.768 7.774 1.00 0.00 H new ATOM 0 HB3 ALA B 55 -15.226 -5.464 8.093 1.00 0.00 H new ATOM 933 N GLY B 56 -16.703 -6.127 10.612 1.00 0.00 N ATOM 934 CA GLY B 56 -17.713 -7.032 11.129 1.00 0.00 C ATOM 935 C GLY B 56 -18.517 -6.419 12.258 1.00 0.00 C ATOM 936 O GLY B 56 -19.742 -6.326 12.178 1.00 0.00 O ATOM 0 H GLY B 56 -15.745 -6.472 10.676 1.00 0.00 H new ATOM 0 HA2 GLY B 56 -18.387 -7.319 10.322 1.00 0.00 H new ATOM 0 HA3 GLY B 56 -17.232 -7.944 11.483 1.00 0.00 H new ATOM 940 N VAL B 57 -17.828 -5.999 13.314 1.00 0.00 N ATOM 941 CA VAL B 57 -18.486 -5.392 14.465 1.00 0.00 C ATOM 942 C VAL B 57 -19.163 -4.080 14.082 1.00 0.00 C ATOM 943 O VAL B 57 -20.251 -3.767 14.567 1.00 0.00 O ATOM 944 CB VAL B 57 -17.488 -5.127 15.608 1.00 0.00 C ATOM 945 CG1 VAL B 57 -18.220 -4.678 16.863 1.00 0.00 C ATOM 946 CG2 VAL B 57 -16.653 -6.368 15.883 1.00 0.00 C ATOM 0 H VAL B 57 -16.814 -6.068 13.396 1.00 0.00 H new ATOM 0 HA VAL B 57 -19.240 -6.101 14.808 1.00 0.00 H new ATOM 0 HB VAL B 57 -16.816 -4.325 15.302 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -17.499 -4.496 17.659 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -18.770 -3.760 16.655 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -18.917 -5.456 17.176 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -15.953 -6.163 16.693 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -17.308 -7.191 16.168 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -16.099 -6.640 14.985 1.00 0.00 H new ATOM 956 N ILE B 58 -18.512 -3.318 13.210 1.00 0.00 N ATOM 957 CA ILE B 58 -19.052 -2.041 12.760 1.00 0.00 C ATOM 958 C ILE B 58 -20.353 -2.235 11.989 1.00 0.00 C ATOM 959 O ILE B 58 -21.347 -1.556 12.247 1.00 0.00 O ATOM 960 CB ILE B 58 -18.048 -1.287 11.869 1.00 0.00 C ATOM 961 CG1 ILE B 58 -16.808 -0.898 12.676 1.00 0.00 C ATOM 962 CG2 ILE B 58 -18.699 -0.054 11.262 1.00 0.00 C ATOM 963 CD1 ILE B 58 -15.709 -0.283 11.838 1.00 0.00 C ATOM 0 H ILE B 58 -17.610 -3.563 12.801 1.00 0.00 H new ATOM 0 HA ILE B 58 -19.247 -1.449 13.654 1.00 0.00 H new ATOM 0 HB ILE B 58 -17.739 -1.947 11.058 1.00 0.00 H new ATOM 0 HG12 ILE B 58 -17.098 -0.192 13.455 1.00 0.00 H new ATOM 0 HG13 ILE B 58 -16.419 -1.784 13.178 1.00 0.00 H new ATOM 0 HG21 ILE B 58 -17.976 0.468 10.635 1.00 0.00 H new ATOM 0 HG22 ILE B 58 -19.554 -0.355 10.657 1.00 0.00 H new ATOM 0 HG23 ILE B 58 -19.034 0.610 12.059 1.00 0.00 H new ATOM 0 HD11 ILE B 58 -14.862 -0.032 12.476 1.00 0.00 H new ATOM 0 HD12 ILE B 58 -15.391 -0.995 11.076 1.00 0.00 H new ATOM 0 HD13 ILE B 58 -16.081 0.622 11.357 1.00 0.00 H new ATOM 975 N GLY B 59 -20.341 -3.168 11.042 1.00 0.00 N ATOM 976 CA GLY B 59 -21.526 -3.436 10.249 1.00 0.00 C ATOM 977 C GLY B 59 -22.725 -3.800 11.103 1.00 0.00 C ATOM 978 O GLY B 59 -23.798 -3.217 10.958 1.00 0.00 O ATOM 0 H GLY B 59 -19.531 -3.743 10.810 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -21.764 -2.558 9.649 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -21.318 -4.250 9.554 1.00 0.00 H new ATOM 982 N GLY B 60 -22.542 -4.769 11.995 1.00 0.00 N ATOM 983 CA GLY B 60 -23.627 -5.195 12.860 1.00 0.00 C ATOM 984 C GLY B 60 -24.199 -4.053 13.677 1.00 0.00 C ATOM 985 O GLY B 60 -25.416 -3.929 13.817 1.00 0.00 O ATOM 0 H GLY B 60 -21.662 -5.266 12.134 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -24.418 -5.637 12.254 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -23.267 -5.974 13.532 1.00 0.00 H new ATOM 989 N LEU B 61 -23.320 -3.218 14.219 1.00 0.00 N ATOM 990 CA LEU B 61 -23.744 -2.081 15.029 1.00 0.00 C ATOM 991 C LEU B 61 -24.438 -1.029 14.170 1.00 0.00 C ATOM 992 O LEU B 61 -25.603 -0.700 14.393 1.00 0.00 O ATOM 993 CB LEU B 61 -22.541 -1.461 15.742 1.00 0.00 C ATOM 994 CG LEU B 61 -22.063 -2.181 17.003 1.00 0.00 C ATOM 995 CD1 LEU B 61 -20.720 -1.630 17.457 1.00 0.00 C ATOM 996 CD2 LEU B 61 -23.096 -2.055 18.113 1.00 0.00 C ATOM 0 H LEU B 61 -22.309 -3.306 14.113 1.00 0.00 H new ATOM 0 HA LEU B 61 -24.454 -2.441 15.773 1.00 0.00 H new ATOM 0 HB2 LEU B 61 -21.711 -1.415 15.037 1.00 0.00 H new ATOM 0 HB3 LEU B 61 -22.791 -0.434 16.007 1.00 0.00 H new ATOM 0 HG LEU B 61 -21.938 -3.238 16.769 1.00 0.00 H new ATOM 0 HD11 LEU B 61 -20.396 -2.155 18.356 1.00 0.00 H new ATOM 0 HD12 LEU B 61 -19.982 -1.773 16.668 1.00 0.00 H new ATOM 0 HD13 LEU B 61 -20.818 -0.566 17.674 1.00 0.00 H new ATOM 0 HD21 LEU B 61 -22.739 -2.573 19.003 1.00 0.00 H new ATOM 0 HD22 LEU B 61 -23.254 -1.002 18.345 1.00 0.00 H new ATOM 0 HD23 LEU B 61 -24.036 -2.499 17.787 1.00 0.00 H new ATOM 1008 N PHE B 62 -23.715 -0.506 13.184 1.00 0.00 N ATOM 1009 CA PHE B 62 -24.261 0.507 12.290 1.00 0.00 C ATOM 1010 C PHE B 62 -25.596 0.055 11.706 1.00 0.00 C ATOM 1011 O PHE B 62 -26.613 0.734 11.854 1.00 0.00 O ATOM 1012 CB PHE B 62 -23.274 0.808 11.161 1.00 0.00 C ATOM 1013 CG PHE B 62 -23.741 1.888 10.227 1.00 0.00 C ATOM 1014 CD1 PHE B 62 -24.287 3.061 10.722 1.00 0.00 C ATOM 1015 CD2 PHE B 62 -23.634 1.729 8.855 1.00 0.00 C ATOM 1016 CE1 PHE B 62 -24.717 4.057 9.866 1.00 0.00 C ATOM 1017 CE2 PHE B 62 -24.062 2.722 7.994 1.00 0.00 C ATOM 1018 CZ PHE B 62 -24.605 3.886 8.500 1.00 0.00 C ATOM 0 H PHE B 62 -22.750 -0.768 12.985 1.00 0.00 H new ATOM 0 HA PHE B 62 -24.427 1.415 12.870 1.00 0.00 H new ATOM 0 HB2 PHE B 62 -22.318 1.102 11.594 1.00 0.00 H new ATOM 0 HB3 PHE B 62 -23.098 -0.104 10.590 1.00 0.00 H new ATOM 0 HD1 PHE B 62 -24.378 3.199 11.789 1.00 0.00 H new ATOM 0 HD2 PHE B 62 -23.212 0.820 8.454 1.00 0.00 H new ATOM 0 HE1 PHE B 62 -25.140 4.967 10.264 1.00 0.00 H new ATOM 0 HE2 PHE B 62 -23.972 2.587 6.926 1.00 0.00 H new ATOM 0 HZ PHE B 62 -24.942 4.662 7.829 1.00 0.00 H new ATOM 1028 N ILE B 63 -25.585 -1.096 11.041 1.00 0.00 N ATOM 1029 CA ILE B 63 -26.794 -1.640 10.435 1.00 0.00 C ATOM 1030 C ILE B 63 -27.929 -1.722 11.451 1.00 0.00 C ATOM 1031 O ILE B 63 -29.078 -1.406 11.140 1.00 0.00 O ATOM 1032 CB ILE B 63 -26.546 -3.041 9.845 1.00 0.00 C ATOM 1033 CG1 ILE B 63 -25.565 -2.958 8.674 1.00 0.00 C ATOM 1034 CG2 ILE B 63 -27.859 -3.667 9.400 1.00 0.00 C ATOM 1035 CD1 ILE B 63 -26.116 -2.217 7.475 1.00 0.00 C ATOM 0 H ILE B 63 -24.752 -1.670 10.908 1.00 0.00 H new ATOM 0 HA ILE B 63 -27.078 -0.961 9.631 1.00 0.00 H new ATOM 0 HB ILE B 63 -26.108 -3.673 10.617 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -24.653 -2.464 9.009 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -25.287 -3.968 8.371 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -27.668 -4.657 8.985 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -28.528 -3.755 10.256 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -28.323 -3.038 8.640 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -25.367 -2.197 6.684 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -27.011 -2.723 7.114 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -26.367 -1.196 7.762 1.00 0.00 H new ATOM 1047 N LEU B 64 -27.599 -2.146 12.666 1.00 0.00 N ATOM 1048 CA LEU B 64 -28.590 -2.267 13.729 1.00 0.00 C ATOM 1049 C LEU B 64 -29.114 -0.896 14.144 1.00 0.00 C ATOM 1050 O LEU B 64 -30.300 -0.735 14.433 1.00 0.00 O ATOM 1051 CB LEU B 64 -27.984 -2.982 14.938 1.00 0.00 C ATOM 1052 CG LEU B 64 -28.032 -4.510 14.909 1.00 0.00 C ATOM 1053 CD1 LEU B 64 -27.166 -5.093 16.014 1.00 0.00 C ATOM 1054 CD2 LEU B 64 -29.467 -5.001 15.038 1.00 0.00 C ATOM 0 H LEU B 64 -26.653 -2.412 12.939 1.00 0.00 H new ATOM 0 HA LEU B 64 -29.426 -2.854 13.348 1.00 0.00 H new ATOM 0 HB2 LEU B 64 -26.943 -2.673 15.033 1.00 0.00 H new ATOM 0 HB3 LEU B 64 -28.501 -2.639 15.834 1.00 0.00 H new ATOM 0 HG LEU B 64 -27.638 -4.848 13.951 1.00 0.00 H new ATOM 0 HD11 LEU B 64 -27.213 -6.181 15.977 1.00 0.00 H new ATOM 0 HD12 LEU B 64 -26.134 -4.770 15.877 1.00 0.00 H new ATOM 0 HD13 LEU B 64 -27.529 -4.747 16.982 1.00 0.00 H new ATOM 0 HD21 LEU B 64 -29.482 -6.091 15.015 1.00 0.00 H new ATOM 0 HD22 LEU B 64 -29.888 -4.652 15.981 1.00 0.00 H new ATOM 0 HD23 LEU B 64 -30.060 -4.613 14.210 1.00 0.00 H new ATOM 1066 N VAL B 65 -28.223 0.090 14.169 1.00 0.00 N ATOM 1067 CA VAL B 65 -28.596 1.448 14.546 1.00 0.00 C ATOM 1068 C VAL B 65 -29.706 1.982 13.648 1.00 0.00 C ATOM 1069 O VAL B 65 -30.699 2.529 14.129 1.00 0.00 O ATOM 1070 CB VAL B 65 -27.389 2.402 14.473 1.00 0.00 C ATOM 1071 CG1 VAL B 65 -27.810 3.823 14.815 1.00 0.00 C ATOM 1072 CG2 VAL B 65 -26.280 1.929 15.401 1.00 0.00 C ATOM 0 H VAL B 65 -27.238 -0.026 13.933 1.00 0.00 H new ATOM 0 HA VAL B 65 -28.954 1.404 15.575 1.00 0.00 H new ATOM 0 HB VAL B 65 -27.006 2.397 13.453 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -26.944 4.483 14.758 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -28.568 4.158 14.107 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -28.220 3.848 15.825 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -25.435 2.614 15.337 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -26.650 1.903 16.426 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -25.960 0.930 15.106 1.00 0.00 H new ATOM 1082 N ILE B 66 -29.532 1.819 12.340 1.00 0.00 N ATOM 1083 CA ILE B 66 -30.521 2.283 11.375 1.00 0.00 C ATOM 1084 C ILE B 66 -31.844 1.544 11.545 1.00 0.00 C ATOM 1085 O ILE B 66 -32.890 2.161 11.748 1.00 0.00 O ATOM 1086 CB ILE B 66 -30.025 2.098 9.929 1.00 0.00 C ATOM 1087 CG1 ILE B 66 -28.676 2.794 9.736 1.00 0.00 C ATOM 1088 CG2 ILE B 66 -31.051 2.637 8.944 1.00 0.00 C ATOM 1089 CD1 ILE B 66 -27.562 1.854 9.332 1.00 0.00 C ATOM 0 H ILE B 66 -28.716 1.369 11.925 1.00 0.00 H new ATOM 0 HA ILE B 66 -30.674 3.345 11.565 1.00 0.00 H new ATOM 0 HB ILE B 66 -29.893 1.033 9.740 1.00 0.00 H new ATOM 0 HG12 ILE B 66 -28.781 3.567 8.975 1.00 0.00 H new ATOM 0 HG13 ILE B 66 -28.399 3.295 10.664 1.00 0.00 H new ATOM 0 HG21 ILE B 66 -30.686 2.499 7.926 1.00 0.00 H new ATOM 0 HG22 ILE B 66 -31.991 2.100 9.068 1.00 0.00 H new ATOM 0 HG23 ILE B 66 -31.212 3.699 9.131 1.00 0.00 H new ATOM 0 HD11 ILE B 66 -26.636 2.417 9.213 1.00 0.00 H new ATOM 0 HD12 ILE B 66 -27.429 1.095 10.103 1.00 0.00 H new ATOM 0 HD13 ILE B 66 -27.817 1.372 8.388 1.00 0.00 H new ATOM 1101 N VAL B 67 -31.791 0.219 11.462 1.00 0.00 N ATOM 1102 CA VAL B 67 -32.985 -0.605 11.609 1.00 0.00 C ATOM 1103 C VAL B 67 -33.714 -0.288 12.910 1.00 0.00 C ATOM 1104 O VAL B 67 -34.908 0.008 12.909 1.00 0.00 O ATOM 1105 CB VAL B 67 -32.639 -2.105 11.580 1.00 0.00 C ATOM 1106 CG1 VAL B 67 -33.906 -2.947 11.605 1.00 0.00 C ATOM 1107 CG2 VAL B 67 -31.795 -2.433 10.357 1.00 0.00 C ATOM 0 H VAL B 67 -30.934 -0.307 11.294 1.00 0.00 H new ATOM 0 HA VAL B 67 -33.635 -0.374 10.765 1.00 0.00 H new ATOM 0 HB VAL B 67 -32.057 -2.343 12.470 1.00 0.00 H new ATOM 0 HG11 VAL B 67 -33.641 -4.004 11.584 1.00 0.00 H new ATOM 0 HG12 VAL B 67 -34.468 -2.732 12.514 1.00 0.00 H new ATOM 0 HG13 VAL B 67 -34.518 -2.709 10.735 1.00 0.00 H new ATOM 0 HG21 VAL B 67 -31.559 -3.497 10.352 1.00 0.00 H new ATOM 0 HG22 VAL B 67 -32.350 -2.180 9.454 1.00 0.00 H new ATOM 0 HG23 VAL B 67 -30.870 -1.857 10.388 1.00 0.00 H new ATOM 1117 N GLY B 68 -32.986 -0.352 14.021 1.00 0.00 N ATOM 1118 CA GLY B 68 -33.580 -0.069 15.315 1.00 0.00 C ATOM 1119 C GLY B 68 -34.309 1.260 15.339 1.00 0.00 C ATOM 1120 O GLY B 68 -35.503 1.317 15.636 1.00 0.00 O ATOM 0 H GLY B 68 -31.996 -0.595 14.048 1.00 0.00 H new ATOM 0 HA2 GLY B 68 -34.276 -0.867 15.574 1.00 0.00 H new ATOM 0 HA3 GLY B 68 -32.800 -0.066 16.077 1.00 0.00 H new ATOM 1124 N LEU B 69 -33.590 2.333 15.029 1.00 0.00 N ATOM 1125 CA LEU B 69 -34.175 3.670 15.019 1.00 0.00 C ATOM 1126 C LEU B 69 -35.363 3.736 14.064 1.00 0.00 C ATOM 1127 O LEU B 69 -36.409 4.296 14.395 1.00 0.00 O ATOM 1128 CB LEU B 69 -33.123 4.705 14.616 1.00 0.00 C ATOM 1129 CG LEU B 69 -32.094 5.068 15.686 1.00 0.00 C ATOM 1130 CD1 LEU B 69 -31.107 6.095 15.152 1.00 0.00 C ATOM 1131 CD2 LEU B 69 -32.786 5.591 16.937 1.00 0.00 C ATOM 0 H LEU B 69 -32.601 2.304 14.781 1.00 0.00 H new ATOM 0 HA LEU B 69 -34.528 3.894 16.026 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -32.591 4.331 13.741 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -33.637 5.616 14.311 1.00 0.00 H new ATOM 0 HG LEU B 69 -31.541 4.167 15.951 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -30.382 6.341 15.928 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -30.587 5.684 14.287 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -31.644 6.997 14.858 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -32.038 5.844 17.688 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -33.365 6.480 16.688 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -33.451 4.824 17.333 1.00 0.00 H new ATOM 1143 N THR B 70 -35.195 3.160 12.878 1.00 0.00 N ATOM 1144 CA THR B 70 -36.253 3.152 11.875 1.00 0.00 C ATOM 1145 C THR B 70 -37.562 2.634 12.461 1.00 0.00 C ATOM 1146 O THR B 70 -38.640 3.122 12.124 1.00 0.00 O ATOM 1147 CB THR B 70 -35.869 2.288 10.660 1.00 0.00 C ATOM 1148 OG1 THR B 70 -34.764 2.878 9.968 1.00 0.00 O ATOM 1149 CG2 THR B 70 -37.047 2.137 9.709 1.00 0.00 C ATOM 0 H THR B 70 -34.336 2.693 12.588 1.00 0.00 H new ATOM 0 HA THR B 70 -36.387 4.183 11.549 1.00 0.00 H new ATOM 0 HB THR B 70 -35.585 1.300 11.021 1.00 0.00 H new ATOM 0 HG1 THR B 70 -33.924 2.542 10.345 1.00 0.00 H new ATOM 0 HG21 THR B 70 -36.752 1.523 8.858 1.00 0.00 H new ATOM 0 HG22 THR B 70 -37.877 1.660 10.230 1.00 0.00 H new ATOM 0 HG23 THR B 70 -37.358 3.120 9.356 1.00 0.00 H new ATOM 1157 N PHE B 71 -37.459 1.642 13.340 1.00 0.00 N ATOM 1158 CA PHE B 71 -38.636 1.057 13.972 1.00 0.00 C ATOM 1159 C PHE B 71 -39.250 2.025 14.979 1.00 0.00 C ATOM 1160 O PHE B 71 -40.452 2.287 14.951 1.00 0.00 O ATOM 1161 CB PHE B 71 -38.268 -0.255 14.668 1.00 0.00 C ATOM 1162 CG PHE B 71 -39.455 -1.006 15.199 1.00 0.00 C ATOM 1163 CD1 PHE B 71 -39.917 -0.778 16.485 1.00 0.00 C ATOM 1164 CD2 PHE B 71 -40.110 -1.939 14.411 1.00 0.00 C ATOM 1165 CE1 PHE B 71 -41.009 -1.468 16.976 1.00 0.00 C ATOM 1166 CE2 PHE B 71 -41.203 -2.632 14.896 1.00 0.00 C ATOM 1167 CZ PHE B 71 -41.654 -2.395 16.180 1.00 0.00 C ATOM 0 H PHE B 71 -36.574 1.227 13.630 1.00 0.00 H new ATOM 0 HA PHE B 71 -39.372 0.854 13.194 1.00 0.00 H new ATOM 0 HB2 PHE B 71 -37.730 -0.891 13.965 1.00 0.00 H new ATOM 0 HB3 PHE B 71 -37.586 -0.041 15.491 1.00 0.00 H new ATOM 0 HD1 PHE B 71 -39.418 -0.053 17.111 1.00 0.00 H new ATOM 0 HD2 PHE B 71 -39.762 -2.127 13.406 1.00 0.00 H new ATOM 0 HE1 PHE B 71 -41.358 -1.283 17.981 1.00 0.00 H new ATOM 0 HE2 PHE B 71 -41.704 -3.358 14.272 1.00 0.00 H new ATOM 0 HZ PHE B 71 -42.509 -2.933 16.561 1.00 0.00 H new ATOM 1177 N ALA B 72 -38.415 2.553 15.869 1.00 0.00 N ATOM 1178 CA ALA B 72 -38.874 3.492 16.884 1.00 0.00 C ATOM 1179 C ALA B 72 -39.432 4.760 16.247 1.00 0.00 C ATOM 1180 O ALA B 72 -40.312 5.413 16.807 1.00 0.00 O ATOM 1181 CB ALA B 72 -37.739 3.834 17.839 1.00 0.00 C ATOM 0 H ALA B 72 -37.417 2.346 15.907 1.00 0.00 H new ATOM 0 HA ALA B 72 -39.677 3.016 17.447 1.00 0.00 H new ATOM 0 HB1 ALA B 72 -38.096 4.536 18.592 1.00 0.00 H new ATOM 0 HB2 ALA B 72 -37.389 2.925 18.328 1.00 0.00 H new ATOM 0 HB3 ALA B 72 -36.918 4.286 17.282 1.00 0.00 H new ATOM 1187 N VAL B 73 -38.913 5.104 15.072 1.00 0.00 N ATOM 1188 CA VAL B 73 -39.359 6.295 14.358 1.00 0.00 C ATOM 1189 C VAL B 73 -40.676 6.039 13.634 1.00 0.00 C ATOM 1190 O VAL B 73 -41.621 6.821 13.747 1.00 0.00 O ATOM 1191 CB VAL B 73 -38.306 6.764 13.336 1.00 0.00 C ATOM 1192 CG1 VAL B 73 -38.823 7.957 12.547 1.00 0.00 C ATOM 1193 CG2 VAL B 73 -36.999 7.103 14.036 1.00 0.00 C ATOM 0 H VAL B 73 -38.183 4.575 14.595 1.00 0.00 H new ATOM 0 HA VAL B 73 -39.503 7.077 15.104 1.00 0.00 H new ATOM 0 HB VAL B 73 -38.116 5.950 12.636 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -38.066 8.275 11.830 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -39.731 7.675 12.015 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -39.043 8.777 13.230 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -36.266 7.432 13.299 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -37.170 7.900 14.759 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -36.623 6.220 14.552 1.00 0.00 H new ATOM 1203 N TYR B 74 -40.732 4.941 12.889 1.00 0.00 N ATOM 1204 CA TYR B 74 -41.933 4.582 12.144 1.00 0.00 C ATOM 1205 C TYR B 74 -43.151 4.539 13.062 1.00 0.00 C ATOM 1206 O TYR B 74 -44.228 5.016 12.706 1.00 0.00 O ATOM 1207 CB TYR B 74 -41.748 3.228 11.459 1.00 0.00 C ATOM 1208 CG TYR B 74 -42.779 2.944 10.390 1.00 0.00 C ATOM 1209 CD1 TYR B 74 -44.113 2.741 10.720 1.00 0.00 C ATOM 1210 CD2 TYR B 74 -42.419 2.879 9.049 1.00 0.00 C ATOM 1211 CE1 TYR B 74 -45.059 2.481 9.747 1.00 0.00 C ATOM 1212 CE2 TYR B 74 -43.358 2.621 8.069 1.00 0.00 C ATOM 1213 CZ TYR B 74 -44.676 2.423 8.423 1.00 0.00 C ATOM 1214 OH TYR B 74 -45.614 2.164 7.450 1.00 0.00 O ATOM 0 H TYR B 74 -39.959 4.284 12.785 1.00 0.00 H new ATOM 0 HA TYR B 74 -42.100 5.345 11.384 1.00 0.00 H new ATOM 0 HB2 TYR B 74 -40.754 3.189 11.013 1.00 0.00 H new ATOM 0 HB3 TYR B 74 -41.791 2.441 12.212 1.00 0.00 H new ATOM 0 HD1 TYR B 74 -44.416 2.787 11.756 1.00 0.00 H new ATOM 0 HD2 TYR B 74 -41.388 3.033 8.768 1.00 0.00 H new ATOM 0 HE1 TYR B 74 -46.092 2.324 10.021 1.00 0.00 H new ATOM 0 HE2 TYR B 74 -43.061 2.575 7.032 1.00 0.00 H new ATOM 0 HH TYR B 74 -45.181 2.158 6.571 1.00 0.00 H new ATOM 1224 N VAL B 75 -42.970 3.963 14.246 1.00 0.00 N ATOM 1225 CA VAL B 75 -44.053 3.857 15.218 1.00 0.00 C ATOM 1226 C VAL B 75 -44.479 5.233 15.717 1.00 0.00 C ATOM 1227 O VAL B 75 -45.669 5.544 15.772 1.00 0.00 O ATOM 1228 CB VAL B 75 -43.642 2.990 16.423 1.00 0.00 C ATOM 1229 CG1 VAL B 75 -44.731 3.003 17.486 1.00 0.00 C ATOM 1230 CG2 VAL B 75 -43.339 1.568 15.977 1.00 0.00 C ATOM 0 H VAL B 75 -42.084 3.563 14.556 1.00 0.00 H new ATOM 0 HA VAL B 75 -44.892 3.383 14.708 1.00 0.00 H new ATOM 0 HB VAL B 75 -42.736 3.411 16.859 1.00 0.00 H new ATOM 0 HG11 VAL B 75 -44.423 2.385 18.330 1.00 0.00 H new ATOM 0 HG12 VAL B 75 -44.896 4.026 17.826 1.00 0.00 H new ATOM 0 HG13 VAL B 75 -45.655 2.608 17.065 1.00 0.00 H new ATOM 0 HG21 VAL B 75 -43.050 0.969 16.841 1.00 0.00 H new ATOM 0 HG22 VAL B 75 -44.226 1.135 15.515 1.00 0.00 H new ATOM 0 HG23 VAL B 75 -42.523 1.579 15.254 1.00 0.00 H new ATOM 1240 N ARG B 76 -43.499 6.055 16.080 1.00 0.00 N ATOM 1241 CA ARG B 76 -43.773 7.398 16.576 1.00 0.00 C ATOM 1242 C ARG B 76 -44.651 8.171 15.596 1.00 0.00 C ATOM 1243 O ARG B 76 -45.502 8.962 16.001 1.00 0.00 O ATOM 1244 CB ARG B 76 -42.464 8.154 16.811 1.00 0.00 C ATOM 1245 CG ARG B 76 -41.705 7.691 18.044 1.00 0.00 C ATOM 1246 CD ARG B 76 -40.233 8.064 17.965 1.00 0.00 C ATOM 1247 NE ARG B 76 -39.409 7.226 18.832 1.00 0.00 N ATOM 1248 CZ ARG B 76 -38.129 7.471 19.090 1.00 0.00 C ATOM 1249 NH1 ARG B 76 -37.531 8.524 18.552 1.00 0.00 N ATOM 1250 NH2 ARG B 76 -37.446 6.661 19.889 1.00 0.00 N ATOM 0 H ARG B 76 -42.509 5.814 16.040 1.00 0.00 H new ATOM 0 HA ARG B 76 -44.307 7.307 17.522 1.00 0.00 H new ATOM 0 HB2 ARG B 76 -41.825 8.037 15.936 1.00 0.00 H new ATOM 0 HB3 ARG B 76 -42.681 9.218 16.907 1.00 0.00 H new ATOM 0 HG2 ARG B 76 -42.147 8.138 18.934 1.00 0.00 H new ATOM 0 HG3 ARG B 76 -41.803 6.610 18.148 1.00 0.00 H new ATOM 0 HD2 ARG B 76 -39.889 7.968 16.935 1.00 0.00 H new ATOM 0 HD3 ARG B 76 -40.108 9.110 18.246 1.00 0.00 H new ATOM 0 HE ARG B 76 -39.840 6.408 19.263 1.00 0.00 H new ATOM 0 HH11 ARG B 76 -38.054 9.149 17.938 1.00 0.00 H new ATOM 0 HH12 ARG B 76 -36.548 8.710 18.752 1.00 0.00 H new ATOM 0 HH21 ARG B 76 -37.904 5.850 20.305 1.00 0.00 H new ATOM 0 HH22 ARG B 76 -36.463 6.849 20.087 1.00 0.00 H new ATOM 1264 N ARG B 77 -44.436 7.936 14.306 1.00 0.00 N ATOM 1265 CA ARG B 77 -45.206 8.612 13.268 1.00 0.00 C ATOM 1266 C ARG B 77 -46.701 8.368 13.455 1.00 0.00 C ATOM 1267 O ARG B 77 -47.532 9.145 12.984 1.00 0.00 O ATOM 1268 CB ARG B 77 -44.770 8.129 11.884 1.00 0.00 C ATOM 1269 CG ARG B 77 -43.339 8.503 11.532 1.00 0.00 C ATOM 1270 CD ARG B 77 -43.220 8.947 10.082 1.00 0.00 C ATOM 1271 NE ARG B 77 -43.848 7.999 9.166 1.00 0.00 N ATOM 1272 CZ ARG B 77 -43.264 6.881 8.750 1.00 0.00 C ATOM 1273 NH1 ARG B 77 -42.043 6.573 9.166 1.00 0.00 N ATOM 1274 NH2 ARG B 77 -43.900 6.069 7.916 1.00 0.00 N ATOM 0 H ARG B 77 -43.736 7.283 13.954 1.00 0.00 H new ATOM 0 HA ARG B 77 -45.016 9.682 13.349 1.00 0.00 H new ATOM 0 HB2 ARG B 77 -44.876 7.045 11.837 1.00 0.00 H new ATOM 0 HB3 ARG B 77 -45.441 8.548 11.134 1.00 0.00 H new ATOM 0 HG2 ARG B 77 -42.999 9.304 12.188 1.00 0.00 H new ATOM 0 HG3 ARG B 77 -42.685 7.649 11.707 1.00 0.00 H new ATOM 0 HD2 ARG B 77 -43.683 9.927 9.964 1.00 0.00 H new ATOM 0 HD3 ARG B 77 -42.167 9.059 9.822 1.00 0.00 H new ATOM 0 HE ARG B 77 -44.787 8.207 8.827 1.00 0.00 H new ATOM 0 HH11 ARG B 77 -41.550 7.195 9.807 1.00 0.00 H new ATOM 0 HH12 ARG B 77 -41.596 5.714 8.845 1.00 0.00 H new ATOM 0 HH21 ARG B 77 -44.839 6.303 7.593 1.00 0.00 H new ATOM 0 HH22 ARG B 77 -43.450 5.211 7.597 1.00 0.00 H new ATOM 1288 N LYS B 78 -47.037 7.284 14.146 1.00 0.00 N ATOM 1289 CA LYS B 78 -48.431 6.937 14.398 1.00 0.00 C ATOM 1290 C LYS B 78 -48.981 7.720 15.585 1.00 0.00 C ATOM 1291 O LYS B 78 -50.160 8.072 15.617 1.00 0.00 O ATOM 1292 CB LYS B 78 -48.565 5.435 14.657 1.00 0.00 C ATOM 1293 CG LYS B 78 -49.429 4.716 13.635 1.00 0.00 C ATOM 1294 CD LYS B 78 -49.180 3.217 13.650 1.00 0.00 C ATOM 1295 CE LYS B 78 -48.835 2.696 12.264 1.00 0.00 C ATOM 1296 NZ LYS B 78 -49.938 2.932 11.292 1.00 0.00 N ATOM 0 H LYS B 78 -46.362 6.630 14.542 1.00 0.00 H new ATOM 0 HA LYS B 78 -49.010 7.200 13.513 1.00 0.00 H new ATOM 0 HB2 LYS B 78 -47.572 4.986 14.661 1.00 0.00 H new ATOM 0 HB3 LYS B 78 -48.988 5.282 15.650 1.00 0.00 H new ATOM 0 HG2 LYS B 78 -50.481 4.913 13.843 1.00 0.00 H new ATOM 0 HG3 LYS B 78 -49.222 5.110 12.640 1.00 0.00 H new ATOM 0 HD2 LYS B 78 -48.366 2.989 14.339 1.00 0.00 H new ATOM 0 HD3 LYS B 78 -50.066 2.704 14.023 1.00 0.00 H new ATOM 0 HE2 LYS B 78 -47.927 3.183 11.908 1.00 0.00 H new ATOM 0 HE3 LYS B 78 -48.623 1.628 12.320 1.00 0.00 H new ATOM 0 HZ1 LYS B 78 -49.829 2.291 10.481 1.00 0.00 H new ATOM 0 HZ2 LYS B 78 -50.852 2.753 11.754 1.00 0.00 H new ATOM 0 HZ3 LYS B 78 -49.904 3.917 10.961 1.00 0.00 H new ATOM 1310 N SER B 79 -48.118 7.991 16.560 1.00 0.00 N ATOM 1311 CA SER B 79 -48.519 8.731 17.751 1.00 0.00 C ATOM 1312 C SER B 79 -48.713 10.210 17.433 1.00 0.00 C ATOM 1313 O SER B 79 -48.369 10.672 16.344 1.00 0.00 O ATOM 1314 CB SER B 79 -47.472 8.568 18.855 1.00 0.00 C ATOM 1315 OG SER B 79 -47.917 7.663 19.851 1.00 0.00 O ATOM 0 H SER B 79 -47.138 7.709 16.548 1.00 0.00 H new ATOM 0 HA SER B 79 -49.469 8.325 18.098 1.00 0.00 H new ATOM 0 HB2 SER B 79 -46.538 8.209 18.424 1.00 0.00 H new ATOM 0 HB3 SER B 79 -47.262 9.537 19.307 1.00 0.00 H new ATOM 0 HG SER B 79 -47.229 7.575 20.544 1.00 0.00 H new ATOM 1321 N ILE B 80 -49.266 10.947 18.390 1.00 0.00 N ATOM 1322 CA ILE B 80 -49.505 12.374 18.212 1.00 0.00 C ATOM 1323 C ILE B 80 -48.347 13.199 18.765 1.00 0.00 C ATOM 1324 O ILE B 80 -48.541 14.073 19.609 1.00 0.00 O ATOM 1325 CB ILE B 80 -50.810 12.817 18.900 1.00 0.00 C ATOM 1326 CG1 ILE B 80 -51.938 11.834 18.581 1.00 0.00 C ATOM 1327 CG2 ILE B 80 -51.187 14.225 18.465 1.00 0.00 C ATOM 1328 CD1 ILE B 80 -53.255 12.194 19.233 1.00 0.00 C ATOM 0 H ILE B 80 -49.557 10.580 19.296 1.00 0.00 H new ATOM 0 HA ILE B 80 -49.592 12.547 17.139 1.00 0.00 H new ATOM 0 HB ILE B 80 -50.652 12.822 19.978 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -52.076 11.790 17.501 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -51.642 10.836 18.905 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -52.111 14.523 18.960 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -50.390 14.916 18.738 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -51.331 14.246 17.385 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -54.009 11.454 18.963 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -53.133 12.209 20.316 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -53.574 13.178 18.890 1.00 0.00 H new ATOM 1340 N LYS B 81 -47.142 12.915 18.282 1.00 0.00 N ATOM 1341 CA LYS B 81 -45.952 13.631 18.724 1.00 0.00 C ATOM 1342 C LYS B 81 -45.855 13.638 20.247 1.00 0.00 C ATOM 1343 O LYS B 81 -45.544 14.662 20.855 1.00 0.00 O ATOM 1344 CB LYS B 81 -45.970 15.068 18.197 1.00 0.00 C ATOM 1345 CG LYS B 81 -44.587 15.645 17.955 1.00 0.00 C ATOM 1346 CD LYS B 81 -44.454 16.202 16.548 1.00 0.00 C ATOM 1347 CE LYS B 81 -43.029 16.647 16.257 1.00 0.00 C ATOM 1348 NZ LYS B 81 -42.497 16.027 15.012 1.00 0.00 N ATOM 0 H LYS B 81 -46.964 12.193 17.584 1.00 0.00 H new ATOM 0 HA LYS B 81 -45.079 13.115 18.324 1.00 0.00 H new ATOM 0 HB2 LYS B 81 -46.535 15.097 17.265 1.00 0.00 H new ATOM 0 HB3 LYS B 81 -46.499 15.701 18.910 1.00 0.00 H new ATOM 0 HG2 LYS B 81 -44.389 16.434 18.680 1.00 0.00 H new ATOM 0 HG3 LYS B 81 -43.836 14.871 18.113 1.00 0.00 H new ATOM 0 HD2 LYS B 81 -44.754 15.443 15.825 1.00 0.00 H new ATOM 0 HD3 LYS B 81 -45.132 17.046 16.424 1.00 0.00 H new ATOM 0 HE2 LYS B 81 -43.000 17.733 16.163 1.00 0.00 H new ATOM 0 HE3 LYS B 81 -42.387 16.382 17.097 1.00 0.00 H new ATOM 0 HZ1 LYS B 81 -41.524 16.356 14.849 1.00 0.00 H new ATOM 0 HZ2 LYS B 81 -42.501 14.992 15.111 1.00 0.00 H new ATOM 0 HZ3 LYS B 81 -43.094 16.300 14.206 1.00 0.00 H new ATOM 1362 N LYS B 82 -46.123 12.489 20.857 1.00 0.00 N ATOM 1363 CA LYS B 82 -46.064 12.360 22.308 1.00 0.00 C ATOM 1364 C LYS B 82 -44.654 12.001 22.766 1.00 0.00 C ATOM 1365 O LYS B 82 -44.424 11.722 23.943 1.00 0.00 O ATOM 1366 CB LYS B 82 -47.055 11.297 22.788 1.00 0.00 C ATOM 1367 CG LYS B 82 -48.406 11.861 23.190 1.00 0.00 C ATOM 1368 CD LYS B 82 -48.342 12.551 24.542 1.00 0.00 C ATOM 1369 CE LYS B 82 -48.401 14.064 24.399 1.00 0.00 C ATOM 1370 NZ LYS B 82 -48.845 14.724 25.658 1.00 0.00 N ATOM 0 H LYS B 82 -46.384 11.632 20.368 1.00 0.00 H new ATOM 0 HA LYS B 82 -46.334 13.322 22.744 1.00 0.00 H new ATOM 0 HB2 LYS B 82 -47.199 10.562 21.996 1.00 0.00 H new ATOM 0 HB3 LYS B 82 -46.624 10.768 23.638 1.00 0.00 H new ATOM 0 HG2 LYS B 82 -48.745 12.570 22.434 1.00 0.00 H new ATOM 0 HG3 LYS B 82 -49.141 11.057 23.225 1.00 0.00 H new ATOM 0 HD2 LYS B 82 -49.169 12.211 25.165 1.00 0.00 H new ATOM 0 HD3 LYS B 82 -47.421 12.268 25.053 1.00 0.00 H new ATOM 0 HE2 LYS B 82 -47.417 14.441 24.119 1.00 0.00 H new ATOM 0 HE3 LYS B 82 -49.084 14.326 23.591 1.00 0.00 H new ATOM 0 HZ1 LYS B 82 -48.872 15.754 25.519 1.00 0.00 H new ATOM 0 HZ2 LYS B 82 -49.794 14.384 25.912 1.00 0.00 H new ATOM 0 HZ3 LYS B 82 -48.179 14.495 26.423 1.00 0.00 H new ATOM 1384 N LYS B 83 -43.713 12.010 21.828 1.00 0.00 N ATOM 1385 CA LYS B 83 -42.324 11.687 22.135 1.00 0.00 C ATOM 1386 C LYS B 83 -42.230 10.392 22.935 1.00 0.00 C ATOM 1387 O LYS B 83 -43.206 9.650 23.050 1.00 0.00 O ATOM 1388 CB LYS B 83 -41.674 12.831 22.917 1.00 0.00 C ATOM 1389 CG LYS B 83 -41.917 14.200 22.306 1.00 0.00 C ATOM 1390 CD LYS B 83 -42.942 14.992 23.101 1.00 0.00 C ATOM 1391 CE LYS B 83 -42.296 15.734 24.261 1.00 0.00 C ATOM 1392 NZ LYS B 83 -43.279 16.577 24.996 1.00 0.00 N ATOM 0 H LYS B 83 -43.887 12.237 20.849 1.00 0.00 H new ATOM 0 HA LYS B 83 -41.792 11.550 21.193 1.00 0.00 H new ATOM 0 HB2 LYS B 83 -42.056 12.825 23.938 1.00 0.00 H new ATOM 0 HB3 LYS B 83 -40.600 12.655 22.977 1.00 0.00 H new ATOM 0 HG2 LYS B 83 -40.979 14.754 22.267 1.00 0.00 H new ATOM 0 HG3 LYS B 83 -42.262 14.085 21.279 1.00 0.00 H new ATOM 0 HD2 LYS B 83 -43.441 15.705 22.445 1.00 0.00 H new ATOM 0 HD3 LYS B 83 -43.709 14.318 23.481 1.00 0.00 H new ATOM 0 HE2 LYS B 83 -41.849 15.015 24.948 1.00 0.00 H new ATOM 0 HE3 LYS B 83 -41.488 16.362 23.886 1.00 0.00 H new ATOM 0 HZ1 LYS B 83 -42.800 17.066 25.779 1.00 0.00 H new ATOM 0 HZ2 LYS B 83 -43.688 17.279 24.347 1.00 0.00 H new ATOM 0 HZ3 LYS B 83 -44.037 15.975 25.376 1.00 0.00 H new ATOM 1406 N ARG B 84 -41.051 10.127 23.488 1.00 0.00 N ATOM 1407 CA ARG B 84 -40.831 8.922 24.278 1.00 0.00 C ATOM 1408 C ARG B 84 -39.850 9.190 25.416 1.00 0.00 C ATOM 1409 O ARG B 84 -38.636 9.153 25.224 1.00 0.00 O ATOM 1410 CB ARG B 84 -40.302 7.794 23.390 1.00 0.00 C ATOM 1411 CG ARG B 84 -40.573 6.405 23.943 1.00 0.00 C ATOM 1412 CD ARG B 84 -39.541 6.009 24.987 1.00 0.00 C ATOM 1413 NE ARG B 84 -40.164 5.543 26.223 1.00 0.00 N ATOM 1414 CZ ARG B 84 -39.492 4.959 27.209 1.00 0.00 C ATOM 1415 NH1 ARG B 84 -38.184 4.772 27.105 1.00 0.00 N ATOM 1416 NH2 ARG B 84 -40.130 4.561 28.303 1.00 0.00 N ATOM 0 H ARG B 84 -40.233 10.731 23.403 1.00 0.00 H new ATOM 0 HA ARG B 84 -41.786 8.620 24.708 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -40.756 7.877 22.402 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -39.227 7.920 23.259 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -41.569 6.376 24.385 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -40.565 5.680 23.129 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -38.901 5.223 24.585 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -38.899 6.863 25.204 1.00 0.00 H new ATOM 0 HE ARG B 84 -41.169 5.673 26.335 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -37.690 5.077 26.266 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -37.671 4.323 27.864 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -41.137 4.704 28.387 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -39.614 4.113 29.060 1.00 0.00 H new ATOM 1430 N ALA B 85 -40.388 9.460 26.601 1.00 0.00 N ATOM 1431 CA ALA B 85 -39.561 9.732 27.771 1.00 0.00 C ATOM 1432 C ALA B 85 -38.614 10.899 27.514 1.00 0.00 C ATOM 1433 O ALA B 85 -38.672 11.921 28.199 1.00 0.00 O ATOM 1434 CB ALA B 85 -38.776 8.489 28.163 1.00 0.00 C ATOM 0 H ALA B 85 -41.392 9.496 26.776 1.00 0.00 H new ATOM 0 HA ALA B 85 -40.219 10.007 28.595 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -38.163 8.707 29.038 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -39.468 7.680 28.397 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -38.133 8.188 27.335 1.00 0.00 H new TER 1440 ALA B 85