USER MOD reduce.3.24.130724 H: found=0, std=0, add=797, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 795 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 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -0.0878 X(o=-0.088,f=-0.088) USER MOD Single : A 18 THR OG1 : rot -13:sc= -1.27! USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 67:sc= 0.964 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 GLN : amide:sc= -0.207 X(o=-0.21,f=-0.023) USER MOD Single : A 39 MET CE :methyl -152:sc= -3.9 (180deg=-7.58!) USER MOD Single : A 42 ASN : amide:sc= -0.151 K(o=-0.15,f=-2.1!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= -3.25! C(o=-3.2!,f=-2.9!) USER MOD Single : A 56 GLN : amide:sc= -0.065 K(o=-0.065,f=-1.5!) USER MOD Single : A 57 MET CE :methyl -108:sc= -3.56! (180deg=-6.57!) USER MOD Single : A 67 GLN : amide:sc=-0.00449 X(o=-0.0045,f=-0.04) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc=-0.000871 X(o=-0.00087,f=-0.27) USER MOD Single : A 76 MET CE :methyl -176:sc= -2.87! (180deg=-2.89!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot -15:sc= -1.67 USER MOD Single : A 80 LYS NZ :NH3+ -118:sc= 0.299 (180deg=-0.151) USER MOD Single : A 81 GLN : amide:sc= -2.84! C(o=-2.8!,f=-3.6!) USER MOD Single : A 83 MET CE :methyl -177:sc= -0.0295 (180deg=-0.0436) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot -64:sc= -1.57! USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 69:sc= 0.935 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -35.795 -8.914 -11.563 1.00 0.00 N ATOM 2 CA GLY A 1 -35.182 -10.025 -12.271 1.00 0.00 C ATOM 3 C GLY A 1 -33.970 -10.560 -11.506 1.00 0.00 C ATOM 4 O GLY A 1 -34.121 -11.316 -10.547 1.00 0.00 O ATOM 0 H1 GLY A 1 -36.615 -8.569 -12.102 1.00 0.00 H new ATOM 0 H2 GLY A 1 -36.107 -9.231 -10.623 1.00 0.00 H new ATOM 0 H3 GLY A 1 -35.102 -8.146 -11.456 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -35.913 -10.823 -12.406 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -34.875 -9.702 -13.266 1.00 0.00 H new ATOM 8 N SER A 2 -32.795 -10.147 -11.958 1.00 0.00 N ATOM 9 CA SER A 2 -31.558 -10.575 -11.328 1.00 0.00 C ATOM 10 C SER A 2 -30.941 -9.416 -10.545 1.00 0.00 C ATOM 11 O SER A 2 -31.268 -8.255 -10.786 1.00 0.00 O ATOM 12 CB SER A 2 -30.565 -11.102 -12.367 1.00 0.00 C ATOM 13 OG SER A 2 -30.010 -10.053 -13.155 1.00 0.00 O ATOM 0 H SER A 2 -32.674 -9.520 -12.753 1.00 0.00 H new ATOM 0 HA SER A 2 -31.788 -11.388 -10.639 1.00 0.00 H new ATOM 0 HB2 SER A 2 -29.762 -11.639 -11.862 1.00 0.00 H new ATOM 0 HB3 SER A 2 -31.067 -11.818 -13.018 1.00 0.00 H new ATOM 0 HG SER A 2 -29.380 -10.430 -13.805 1.00 0.00 H new ATOM 19 N SER A 3 -30.058 -9.770 -9.622 1.00 0.00 N ATOM 20 CA SER A 3 -29.392 -8.773 -8.801 1.00 0.00 C ATOM 21 C SER A 3 -27.968 -8.543 -9.310 1.00 0.00 C ATOM 22 O SER A 3 -27.619 -7.433 -9.711 1.00 0.00 O ATOM 23 CB SER A 3 -29.369 -9.196 -7.331 1.00 0.00 C ATOM 24 OG SER A 3 -29.944 -8.207 -6.482 1.00 0.00 O ATOM 0 H SER A 3 -29.788 -10.734 -9.425 1.00 0.00 H new ATOM 0 HA SER A 3 -29.952 -7.841 -8.873 1.00 0.00 H new ATOM 0 HB2 SER A 3 -29.912 -10.134 -7.215 1.00 0.00 H new ATOM 0 HB3 SER A 3 -28.340 -9.384 -7.024 1.00 0.00 H new ATOM 0 HG SER A 3 -29.912 -8.515 -5.552 1.00 0.00 H new ATOM 30 N GLY A 4 -27.182 -9.610 -9.278 1.00 0.00 N ATOM 31 CA GLY A 4 -25.804 -9.538 -9.731 1.00 0.00 C ATOM 32 C GLY A 4 -24.940 -10.585 -9.025 1.00 0.00 C ATOM 33 O GLY A 4 -25.393 -11.699 -8.769 1.00 0.00 O ATOM 0 H GLY A 4 -27.474 -10.529 -8.945 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -25.763 -9.694 -10.809 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -25.405 -8.542 -9.538 1.00 0.00 H new ATOM 37 N SER A 5 -23.710 -10.190 -8.730 1.00 0.00 N ATOM 38 CA SER A 5 -22.778 -11.080 -8.059 1.00 0.00 C ATOM 39 C SER A 5 -21.447 -10.364 -7.824 1.00 0.00 C ATOM 40 O SER A 5 -21.055 -9.501 -8.609 1.00 0.00 O ATOM 41 CB SER A 5 -22.558 -12.359 -8.868 1.00 0.00 C ATOM 42 OG SER A 5 -22.731 -13.530 -8.075 1.00 0.00 O ATOM 0 H SER A 5 -23.337 -9.265 -8.944 1.00 0.00 H new ATOM 0 HA SER A 5 -23.206 -11.361 -7.097 1.00 0.00 H new ATOM 0 HB2 SER A 5 -23.255 -12.382 -9.706 1.00 0.00 H new ATOM 0 HB3 SER A 5 -21.553 -12.352 -9.290 1.00 0.00 H new ATOM 0 HG SER A 5 -22.584 -14.325 -8.629 1.00 0.00 H new ATOM 48 N SER A 6 -20.787 -10.748 -6.742 1.00 0.00 N ATOM 49 CA SER A 6 -19.507 -10.154 -6.394 1.00 0.00 C ATOM 50 C SER A 6 -18.604 -11.201 -5.741 1.00 0.00 C ATOM 51 O SER A 6 -19.086 -12.210 -5.230 1.00 0.00 O ATOM 52 CB SER A 6 -19.692 -8.956 -5.461 1.00 0.00 C ATOM 53 OG SER A 6 -19.069 -7.780 -5.972 1.00 0.00 O ATOM 0 H SER A 6 -21.115 -11.464 -6.094 1.00 0.00 H new ATOM 0 HA SER A 6 -19.035 -9.798 -7.310 1.00 0.00 H new ATOM 0 HB2 SER A 6 -20.756 -8.769 -5.317 1.00 0.00 H new ATOM 0 HB3 SER A 6 -19.275 -9.191 -4.482 1.00 0.00 H new ATOM 0 HG SER A 6 -19.211 -7.037 -5.349 1.00 0.00 H new ATOM 59 N GLY A 7 -17.308 -10.926 -5.780 1.00 0.00 N ATOM 60 CA GLY A 7 -16.333 -11.832 -5.198 1.00 0.00 C ATOM 61 C GLY A 7 -15.430 -11.100 -4.203 1.00 0.00 C ATOM 62 O GLY A 7 -15.854 -10.137 -3.566 1.00 0.00 O ATOM 0 H GLY A 7 -16.911 -10.088 -6.206 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -16.847 -12.650 -4.694 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -15.726 -12.275 -5.988 1.00 0.00 H new ATOM 66 N GLU A 8 -14.201 -11.585 -4.101 1.00 0.00 N ATOM 67 CA GLU A 8 -13.234 -10.989 -3.194 1.00 0.00 C ATOM 68 C GLU A 8 -11.868 -10.878 -3.873 1.00 0.00 C ATOM 69 O GLU A 8 -11.640 -11.483 -4.920 1.00 0.00 O ATOM 70 CB GLU A 8 -13.137 -11.788 -1.893 1.00 0.00 C ATOM 71 CG GLU A 8 -12.516 -13.165 -2.141 1.00 0.00 C ATOM 72 CD GLU A 8 -13.559 -14.273 -1.980 1.00 0.00 C ATOM 73 OE1 GLU A 8 -14.341 -14.460 -2.937 1.00 0.00 O ATOM 74 OE2 GLU A 8 -13.550 -14.908 -0.903 1.00 0.00 O ATOM 0 H GLU A 8 -13.853 -12.384 -4.631 1.00 0.00 H new ATOM 0 HA GLU A 8 -13.574 -9.985 -2.940 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -12.536 -11.239 -1.169 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -14.130 -11.906 -1.459 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -12.093 -13.202 -3.145 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -11.695 -13.329 -1.443 1.00 0.00 H new ATOM 81 N GLY A 9 -10.994 -10.100 -3.251 1.00 0.00 N ATOM 82 CA GLY A 9 -9.656 -9.903 -3.782 1.00 0.00 C ATOM 83 C GLY A 9 -8.932 -8.779 -3.039 1.00 0.00 C ATOM 84 O GLY A 9 -9.544 -7.778 -2.670 1.00 0.00 O ATOM 0 H GLY A 9 -11.187 -9.599 -2.384 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -9.086 -10.828 -3.694 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -9.714 -9.664 -4.844 1.00 0.00 H new ATOM 88 N TYR A 10 -7.637 -8.982 -2.841 1.00 0.00 N ATOM 89 CA TYR A 10 -6.823 -7.998 -2.148 1.00 0.00 C ATOM 90 C TYR A 10 -5.965 -7.204 -3.135 1.00 0.00 C ATOM 91 O TYR A 10 -6.104 -5.986 -3.243 1.00 0.00 O ATOM 92 CB TYR A 10 -5.905 -8.792 -1.216 1.00 0.00 C ATOM 93 CG TYR A 10 -6.613 -9.372 0.010 1.00 0.00 C ATOM 94 CD1 TYR A 10 -7.532 -8.609 0.701 1.00 0.00 C ATOM 95 CD2 TYR A 10 -6.332 -10.658 0.424 1.00 0.00 C ATOM 96 CE1 TYR A 10 -8.198 -9.154 1.855 1.00 0.00 C ATOM 97 CE2 TYR A 10 -6.998 -11.203 1.578 1.00 0.00 C ATOM 98 CZ TYR A 10 -7.899 -10.425 2.237 1.00 0.00 C ATOM 99 OH TYR A 10 -8.528 -10.940 3.326 1.00 0.00 O ATOM 0 H TYR A 10 -7.132 -9.813 -3.148 1.00 0.00 H new ATOM 0 HA TYR A 10 -7.452 -7.289 -1.610 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -5.450 -9.607 -1.779 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -5.095 -8.144 -0.882 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -7.752 -7.603 0.376 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -5.613 -11.255 -0.117 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -8.919 -8.567 2.405 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -6.787 -12.208 1.913 1.00 0.00 H new ATOM 0 HH TYR A 10 -8.217 -11.856 3.481 1.00 0.00 H new ATOM 109 N GLU A 11 -5.097 -7.925 -3.829 1.00 0.00 N ATOM 110 CA GLU A 11 -4.217 -7.302 -4.803 1.00 0.00 C ATOM 111 C GLU A 11 -4.990 -6.281 -5.641 1.00 0.00 C ATOM 112 O GLU A 11 -4.477 -5.204 -5.941 1.00 0.00 O ATOM 113 CB GLU A 11 -3.555 -8.355 -5.695 1.00 0.00 C ATOM 114 CG GLU A 11 -2.510 -9.155 -4.916 1.00 0.00 C ATOM 115 CD GLU A 11 -3.053 -10.531 -4.524 1.00 0.00 C ATOM 116 OE1 GLU A 11 -4.160 -10.560 -3.945 1.00 0.00 O ATOM 117 OE2 GLU A 11 -2.349 -11.522 -4.813 1.00 0.00 O ATOM 0 H GLU A 11 -4.984 -8.934 -3.736 1.00 0.00 H new ATOM 0 HA GLU A 11 -3.426 -6.778 -4.267 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -4.314 -9.030 -6.091 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -3.083 -7.869 -6.549 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -1.612 -9.274 -5.522 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -2.220 -8.606 -4.020 1.00 0.00 H new ATOM 124 N GLN A 12 -6.211 -6.655 -5.993 1.00 0.00 N ATOM 125 CA GLN A 12 -7.059 -5.786 -6.790 1.00 0.00 C ATOM 126 C GLN A 12 -7.262 -4.446 -6.079 1.00 0.00 C ATOM 127 O GLN A 12 -6.896 -3.397 -6.607 1.00 0.00 O ATOM 128 CB GLN A 12 -8.401 -6.455 -7.092 1.00 0.00 C ATOM 129 CG GLN A 12 -8.837 -6.185 -8.534 1.00 0.00 C ATOM 130 CD GLN A 12 -8.028 -7.031 -9.519 1.00 0.00 C ATOM 131 OE1 GLN A 12 -8.150 -8.243 -9.581 1.00 0.00 O ATOM 132 NE2 GLN A 12 -7.199 -6.327 -10.283 1.00 0.00 N ATOM 0 H GLN A 12 -6.633 -7.549 -5.741 1.00 0.00 H new ATOM 0 HA GLN A 12 -6.562 -5.599 -7.742 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -8.321 -7.530 -6.928 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -9.160 -6.083 -6.403 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -9.898 -6.407 -8.644 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -8.707 -5.128 -8.765 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -7.146 -5.314 -10.179 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -6.616 -6.800 -10.973 1.00 0.00 H new ATOM 141 N ASP A 13 -7.846 -4.525 -4.892 1.00 0.00 N ATOM 142 CA ASP A 13 -8.102 -3.332 -4.104 1.00 0.00 C ATOM 143 C ASP A 13 -6.805 -2.534 -3.957 1.00 0.00 C ATOM 144 O ASP A 13 -6.769 -1.341 -4.254 1.00 0.00 O ATOM 145 CB ASP A 13 -8.596 -3.694 -2.702 1.00 0.00 C ATOM 146 CG ASP A 13 -9.972 -3.135 -2.336 1.00 0.00 C ATOM 147 OD1 ASP A 13 -10.907 -3.361 -3.135 1.00 0.00 O ATOM 148 OD2 ASP A 13 -10.059 -2.494 -1.266 1.00 0.00 O ATOM 0 H ASP A 13 -8.149 -5.397 -4.457 1.00 0.00 H new ATOM 0 HA ASP A 13 -8.866 -2.747 -4.616 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -8.627 -4.780 -2.613 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -7.869 -3.335 -1.973 1.00 0.00 H new ATOM 153 N PHE A 14 -5.771 -3.225 -3.499 1.00 0.00 N ATOM 154 CA PHE A 14 -4.475 -2.596 -3.309 1.00 0.00 C ATOM 155 C PHE A 14 -3.990 -1.940 -4.604 1.00 0.00 C ATOM 156 O PHE A 14 -3.688 -0.748 -4.624 1.00 0.00 O ATOM 157 CB PHE A 14 -3.495 -3.702 -2.913 1.00 0.00 C ATOM 158 CG PHE A 14 -2.035 -3.250 -2.861 1.00 0.00 C ATOM 159 CD1 PHE A 14 -1.574 -2.562 -1.782 1.00 0.00 C ATOM 160 CD2 PHE A 14 -1.197 -3.535 -3.894 1.00 0.00 C ATOM 161 CE1 PHE A 14 -0.218 -2.142 -1.734 1.00 0.00 C ATOM 162 CE2 PHE A 14 0.158 -3.116 -3.846 1.00 0.00 C ATOM 163 CZ PHE A 14 0.619 -2.427 -2.767 1.00 0.00 C ATOM 0 H PHE A 14 -5.805 -4.215 -3.254 1.00 0.00 H new ATOM 0 HA PHE A 14 -4.545 -1.822 -2.545 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -3.779 -4.092 -1.936 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -3.585 -4.524 -3.623 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -2.239 -2.335 -0.962 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -1.563 -4.080 -4.751 1.00 0.00 H new ATOM 0 HE1 PHE A 14 0.148 -1.596 -0.877 1.00 0.00 H new ATOM 0 HE2 PHE A 14 0.823 -3.344 -4.666 1.00 0.00 H new ATOM 0 HZ PHE A 14 1.650 -2.106 -2.731 1.00 0.00 H new ATOM 173 N ALA A 15 -3.929 -2.748 -5.652 1.00 0.00 N ATOM 174 CA ALA A 15 -3.485 -2.261 -6.947 1.00 0.00 C ATOM 175 C ALA A 15 -4.202 -0.948 -7.266 1.00 0.00 C ATOM 176 O ALA A 15 -3.560 0.053 -7.582 1.00 0.00 O ATOM 177 CB ALA A 15 -3.734 -3.334 -8.009 1.00 0.00 C ATOM 0 H ALA A 15 -4.180 -3.737 -5.631 1.00 0.00 H new ATOM 0 HA ALA A 15 -2.414 -2.058 -6.934 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -3.401 -2.969 -8.980 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -3.180 -4.237 -7.751 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -4.799 -3.562 -8.053 1.00 0.00 H new ATOM 183 N VAL A 16 -5.523 -0.994 -7.173 1.00 0.00 N ATOM 184 CA VAL A 16 -6.333 0.180 -7.448 1.00 0.00 C ATOM 185 C VAL A 16 -5.880 1.331 -6.548 1.00 0.00 C ATOM 186 O VAL A 16 -5.693 2.453 -7.015 1.00 0.00 O ATOM 187 CB VAL A 16 -7.817 -0.158 -7.284 1.00 0.00 C ATOM 188 CG1 VAL A 16 -8.655 1.113 -7.132 1.00 0.00 C ATOM 189 CG2 VAL A 16 -8.317 -1.008 -8.454 1.00 0.00 C ATOM 0 H VAL A 16 -6.052 -1.826 -6.911 1.00 0.00 H new ATOM 0 HA VAL A 16 -6.198 0.503 -8.480 1.00 0.00 H new ATOM 0 HB VAL A 16 -7.929 -0.744 -6.372 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -9.705 0.845 -7.017 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -8.323 1.665 -6.252 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -8.535 1.736 -8.018 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -9.374 -1.235 -8.314 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -8.184 -0.458 -9.386 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -7.749 -1.938 -8.497 1.00 0.00 H new ATOM 199 N LEU A 17 -5.715 1.012 -5.272 1.00 0.00 N ATOM 200 CA LEU A 17 -5.287 2.005 -4.302 1.00 0.00 C ATOM 201 C LEU A 17 -3.962 2.619 -4.758 1.00 0.00 C ATOM 202 O LEU A 17 -3.902 3.805 -5.082 1.00 0.00 O ATOM 203 CB LEU A 17 -5.231 1.395 -2.900 1.00 0.00 C ATOM 204 CG LEU A 17 -6.531 1.443 -2.095 1.00 0.00 C ATOM 205 CD1 LEU A 17 -6.359 0.764 -0.735 1.00 0.00 C ATOM 206 CD2 LEU A 17 -7.038 2.880 -1.958 1.00 0.00 C ATOM 0 H LEU A 17 -5.870 0.080 -4.888 1.00 0.00 H new ATOM 0 HA LEU A 17 -6.012 2.817 -4.243 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -4.921 0.354 -2.991 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -4.456 1.910 -2.332 1.00 0.00 H new ATOM 0 HG LEU A 17 -7.291 0.884 -2.640 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -7.298 0.812 -0.183 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -6.077 -0.279 -0.882 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -5.579 1.274 -0.170 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -7.963 2.886 -1.382 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -6.288 3.483 -1.447 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -7.225 3.296 -2.948 1.00 0.00 H new ATOM 218 N THR A 18 -2.932 1.785 -4.770 1.00 0.00 N ATOM 219 CA THR A 18 -1.612 2.232 -5.181 1.00 0.00 C ATOM 220 C THR A 18 -1.717 3.157 -6.395 1.00 0.00 C ATOM 221 O THR A 18 -1.386 4.339 -6.309 1.00 0.00 O ATOM 222 CB THR A 18 -0.752 0.992 -5.434 1.00 0.00 C ATOM 223 OG1 THR A 18 -1.585 0.146 -6.222 1.00 0.00 O ATOM 224 CG2 THR A 18 -0.499 0.185 -4.160 1.00 0.00 C ATOM 0 H THR A 18 -2.985 0.802 -4.502 1.00 0.00 H new ATOM 0 HA THR A 18 -1.133 2.824 -4.401 1.00 0.00 H new ATOM 0 HB THR A 18 0.202 1.294 -5.867 1.00 0.00 H new ATOM 0 HG1 THR A 18 -2.506 0.481 -6.200 1.00 0.00 H new ATOM 0 HG21 THR A 18 0.116 -0.684 -4.396 1.00 0.00 H new ATOM 0 HG22 THR A 18 0.018 0.809 -3.431 1.00 0.00 H new ATOM 0 HG23 THR A 18 -1.451 -0.146 -3.744 1.00 0.00 H new ATOM 232 N ALA A 19 -2.178 2.585 -7.497 1.00 0.00 N ATOM 233 CA ALA A 19 -2.330 3.344 -8.727 1.00 0.00 C ATOM 234 C ALA A 19 -2.994 4.687 -8.414 1.00 0.00 C ATOM 235 O ALA A 19 -2.487 5.739 -8.800 1.00 0.00 O ATOM 236 CB ALA A 19 -3.129 2.521 -9.740 1.00 0.00 C ATOM 0 H ALA A 19 -2.451 1.605 -7.564 1.00 0.00 H new ATOM 0 HA ALA A 19 -1.357 3.553 -9.172 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -3.243 3.090 -10.662 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -2.601 1.591 -9.951 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -4.113 2.295 -9.330 1.00 0.00 H new ATOM 242 N GLU A 20 -4.118 4.607 -7.717 1.00 0.00 N ATOM 243 CA GLU A 20 -4.856 5.802 -7.348 1.00 0.00 C ATOM 244 C GLU A 20 -3.948 6.774 -6.591 1.00 0.00 C ATOM 245 O GLU A 20 -3.800 7.928 -6.990 1.00 0.00 O ATOM 246 CB GLU A 20 -6.093 5.449 -6.519 1.00 0.00 C ATOM 247 CG GLU A 20 -7.163 6.536 -6.640 1.00 0.00 C ATOM 248 CD GLU A 20 -7.580 7.050 -5.261 1.00 0.00 C ATOM 249 OE1 GLU A 20 -6.683 7.151 -4.397 1.00 0.00 O ATOM 250 OE2 GLU A 20 -8.788 7.329 -5.101 1.00 0.00 O ATOM 0 H GLU A 20 -4.535 3.733 -7.398 1.00 0.00 H new ATOM 0 HA GLU A 20 -5.198 6.290 -8.261 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -6.499 4.495 -6.854 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -5.811 5.326 -5.473 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -6.781 7.362 -7.240 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -8.033 6.138 -7.162 1.00 0.00 H new ATOM 257 N ILE A 21 -3.365 6.271 -5.513 1.00 0.00 N ATOM 258 CA ILE A 21 -2.476 7.081 -4.697 1.00 0.00 C ATOM 259 C ILE A 21 -1.394 7.696 -5.586 1.00 0.00 C ATOM 260 O ILE A 21 -1.294 8.917 -5.694 1.00 0.00 O ATOM 261 CB ILE A 21 -1.921 6.258 -3.532 1.00 0.00 C ATOM 262 CG1 ILE A 21 -3.051 5.719 -2.654 1.00 0.00 C ATOM 263 CG2 ILE A 21 -0.904 7.068 -2.725 1.00 0.00 C ATOM 264 CD1 ILE A 21 -2.536 4.642 -1.697 1.00 0.00 C ATOM 0 H ILE A 21 -3.491 5.313 -5.186 1.00 0.00 H new ATOM 0 HA ILE A 21 -3.022 7.907 -4.242 1.00 0.00 H new ATOM 0 HB ILE A 21 -1.394 5.397 -3.942 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -3.494 6.535 -2.084 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -3.839 5.305 -3.283 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -0.525 6.461 -1.903 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -0.077 7.361 -3.372 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -1.385 7.960 -2.325 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -3.360 4.276 -1.084 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -2.116 3.816 -2.271 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -1.765 5.066 -1.053 1.00 0.00 H new ATOM 276 N THR A 22 -0.610 6.822 -6.201 1.00 0.00 N ATOM 277 CA THR A 22 0.461 7.265 -7.077 1.00 0.00 C ATOM 278 C THR A 22 0.015 8.480 -7.893 1.00 0.00 C ATOM 279 O THR A 22 0.756 9.453 -8.019 1.00 0.00 O ATOM 280 CB THR A 22 0.886 6.076 -7.941 1.00 0.00 C ATOM 281 OG1 THR A 22 2.304 6.035 -7.802 1.00 0.00 O ATOM 282 CG2 THR A 22 0.666 6.328 -9.434 1.00 0.00 C ATOM 0 H THR A 22 -0.695 5.810 -6.110 1.00 0.00 H new ATOM 0 HA THR A 22 1.328 7.597 -6.506 1.00 0.00 H new ATOM 0 HB THR A 22 0.329 5.190 -7.637 1.00 0.00 H new ATOM 0 HG1 THR A 22 2.663 5.291 -8.329 1.00 0.00 H new ATOM 0 HG21 THR A 22 0.984 5.453 -10.001 1.00 0.00 H new ATOM 0 HG22 THR A 22 -0.392 6.516 -9.619 1.00 0.00 H new ATOM 0 HG23 THR A 22 1.249 7.195 -9.746 1.00 0.00 H new ATOM 290 N SER A 23 -1.194 8.383 -8.426 1.00 0.00 N ATOM 291 CA SER A 23 -1.747 9.463 -9.226 1.00 0.00 C ATOM 292 C SER A 23 -1.805 10.750 -8.401 1.00 0.00 C ATOM 293 O SER A 23 -1.152 11.737 -8.737 1.00 0.00 O ATOM 294 CB SER A 23 -3.140 9.104 -9.747 1.00 0.00 C ATOM 295 OG SER A 23 -3.131 7.902 -10.513 1.00 0.00 O ATOM 0 H SER A 23 -1.806 7.574 -8.320 1.00 0.00 H new ATOM 0 HA SER A 23 -1.095 9.620 -10.086 1.00 0.00 H new ATOM 0 HB2 SER A 23 -3.824 8.992 -8.906 1.00 0.00 H new ATOM 0 HB3 SER A 23 -3.519 9.922 -10.360 1.00 0.00 H new ATOM 0 HG SER A 23 -2.923 7.143 -9.929 1.00 0.00 H new ATOM 301 N LYS A 24 -2.591 10.697 -7.336 1.00 0.00 N ATOM 302 CA LYS A 24 -2.742 11.847 -6.460 1.00 0.00 C ATOM 303 C LYS A 24 -1.359 12.357 -6.052 1.00 0.00 C ATOM 304 O LYS A 24 -1.182 13.547 -5.798 1.00 0.00 O ATOM 305 CB LYS A 24 -3.645 11.501 -5.274 1.00 0.00 C ATOM 306 CG LYS A 24 -5.121 11.651 -5.646 1.00 0.00 C ATOM 307 CD LYS A 24 -5.770 10.284 -5.875 1.00 0.00 C ATOM 308 CE LYS A 24 -6.819 10.354 -6.987 1.00 0.00 C ATOM 309 NZ LYS A 24 -8.063 10.979 -6.487 1.00 0.00 N ATOM 0 H LYS A 24 -3.130 9.876 -7.060 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.241 12.663 -6.984 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.450 10.479 -4.950 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.411 12.152 -4.432 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.648 12.179 -4.852 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -5.213 12.257 -6.547 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.005 9.554 -6.138 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -6.236 9.939 -4.952 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -6.429 10.928 -7.827 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.032 9.351 -7.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -8.764 11.019 -7.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -8.443 10.415 -5.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -7.858 11.943 -6.155 1.00 0.00 H new ATOM 323 N ILE A 25 -0.413 11.431 -6.002 1.00 0.00 N ATOM 324 CA ILE A 25 0.950 11.772 -5.630 1.00 0.00 C ATOM 325 C ILE A 25 1.618 12.520 -6.785 1.00 0.00 C ATOM 326 O ILE A 25 2.489 13.359 -6.564 1.00 0.00 O ATOM 327 CB ILE A 25 1.712 10.522 -5.184 1.00 0.00 C ATOM 328 CG1 ILE A 25 1.203 10.024 -3.829 1.00 0.00 C ATOM 329 CG2 ILE A 25 3.221 10.776 -5.172 1.00 0.00 C ATOM 330 CD1 ILE A 25 1.812 8.665 -3.481 1.00 0.00 C ATOM 0 H ILE A 25 -0.563 10.444 -6.213 1.00 0.00 H new ATOM 0 HA ILE A 25 0.954 12.443 -4.771 1.00 0.00 H new ATOM 0 HB ILE A 25 1.524 9.730 -5.909 1.00 0.00 H new ATOM 0 HG12 ILE A 25 1.454 10.748 -3.054 1.00 0.00 H new ATOM 0 HG13 ILE A 25 0.116 9.945 -3.852 1.00 0.00 H new ATOM 0 HG21 ILE A 25 3.740 9.872 -4.852 1.00 0.00 H new ATOM 0 HG22 ILE A 25 3.552 11.048 -6.174 1.00 0.00 H new ATOM 0 HG23 ILE A 25 3.448 11.589 -4.482 1.00 0.00 H new ATOM 0 HD11 ILE A 25 1.434 8.334 -2.514 1.00 0.00 H new ATOM 0 HD12 ILE A 25 1.539 7.938 -4.246 1.00 0.00 H new ATOM 0 HD13 ILE A 25 2.897 8.754 -3.435 1.00 0.00 H new ATOM 342 N ALA A 26 1.184 12.188 -7.992 1.00 0.00 N ATOM 343 CA ALA A 26 1.729 12.818 -9.183 1.00 0.00 C ATOM 344 C ALA A 26 0.939 14.092 -9.488 1.00 0.00 C ATOM 345 O ALA A 26 1.291 14.842 -10.397 1.00 0.00 O ATOM 346 CB ALA A 26 1.703 11.823 -10.345 1.00 0.00 C ATOM 0 H ALA A 26 0.461 11.491 -8.171 1.00 0.00 H new ATOM 0 HA ALA A 26 2.768 13.105 -9.024 1.00 0.00 H new ATOM 0 HB1 ALA A 26 2.112 12.296 -11.238 1.00 0.00 H new ATOM 0 HB2 ALA A 26 2.303 10.950 -10.090 1.00 0.00 H new ATOM 0 HB3 ALA A 26 0.675 11.514 -10.536 1.00 0.00 H new ATOM 352 N ARG A 27 -0.115 14.297 -8.711 1.00 0.00 N ATOM 353 CA ARG A 27 -0.958 15.467 -8.887 1.00 0.00 C ATOM 354 C ARG A 27 -0.720 16.468 -7.755 1.00 0.00 C ATOM 355 O ARG A 27 -1.144 17.619 -7.840 1.00 0.00 O ATOM 356 CB ARG A 27 -2.438 15.080 -8.914 1.00 0.00 C ATOM 357 CG ARG A 27 -2.915 14.833 -10.347 1.00 0.00 C ATOM 358 CD ARG A 27 -4.415 15.101 -10.480 1.00 0.00 C ATOM 359 NE ARG A 27 -4.861 14.809 -11.861 1.00 0.00 N ATOM 360 CZ ARG A 27 -6.136 14.877 -12.268 1.00 0.00 C ATOM 361 NH1 ARG A 27 -7.098 15.227 -11.404 1.00 0.00 N ATOM 362 NH2 ARG A 27 -6.448 14.595 -13.541 1.00 0.00 N ATOM 0 H ARG A 27 -0.404 13.672 -7.958 1.00 0.00 H new ATOM 0 HA ARG A 27 -0.696 15.924 -9.841 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -2.594 14.182 -8.315 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -3.033 15.873 -8.461 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -2.365 15.477 -11.033 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -2.699 13.804 -10.633 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -4.967 14.483 -9.772 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -4.631 16.140 -10.231 1.00 0.00 H new ATOM 0 HE ARG A 27 -4.154 14.539 -12.545 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -6.860 15.442 -10.436 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -8.068 15.279 -11.714 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -5.715 14.329 -14.199 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -7.418 14.646 -13.852 1.00 0.00 H new ATOM 376 N VAL A 28 -0.043 15.992 -6.720 1.00 0.00 N ATOM 377 CA VAL A 28 0.257 16.831 -5.572 1.00 0.00 C ATOM 378 C VAL A 28 1.016 18.075 -6.039 1.00 0.00 C ATOM 379 O VAL A 28 0.633 19.198 -5.716 1.00 0.00 O ATOM 380 CB VAL A 28 1.020 16.025 -4.520 1.00 0.00 C ATOM 381 CG1 VAL A 28 2.189 16.832 -3.952 1.00 0.00 C ATOM 382 CG2 VAL A 28 0.085 15.555 -3.404 1.00 0.00 C ATOM 0 H VAL A 28 0.306 15.036 -6.653 1.00 0.00 H new ATOM 0 HA VAL A 28 -0.663 17.171 -5.097 1.00 0.00 H new ATOM 0 HB VAL A 28 1.429 15.141 -5.008 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.715 16.236 -3.206 1.00 0.00 H new ATOM 0 HG12 VAL A 28 2.876 17.094 -4.757 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.811 17.743 -3.487 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.653 14.984 -2.669 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.368 16.420 -2.920 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.698 14.925 -3.826 1.00 0.00 H new ATOM 392 N PRO A 29 2.107 17.825 -6.812 1.00 0.00 N ATOM 393 CA PRO A 29 2.924 18.912 -7.326 1.00 0.00 C ATOM 394 C PRO A 29 2.223 19.623 -8.485 1.00 0.00 C ATOM 395 O PRO A 29 2.773 20.554 -9.071 1.00 0.00 O ATOM 396 CB PRO A 29 4.234 18.259 -7.736 1.00 0.00 C ATOM 397 CG PRO A 29 3.937 16.775 -7.869 1.00 0.00 C ATOM 398 CD PRO A 29 2.591 16.508 -7.214 1.00 0.00 C ATOM 0 HA PRO A 29 3.098 19.694 -6.587 1.00 0.00 H new ATOM 0 HB2 PRO A 29 4.597 18.670 -8.678 1.00 0.00 H new ATOM 0 HB3 PRO A 29 5.009 18.437 -6.990 1.00 0.00 H new ATOM 0 HG2 PRO A 29 3.915 16.483 -8.919 1.00 0.00 H new ATOM 0 HG3 PRO A 29 4.718 16.185 -7.390 1.00 0.00 H new ATOM 0 HD2 PRO A 29 1.901 16.027 -7.908 1.00 0.00 H new ATOM 0 HD3 PRO A 29 2.693 15.844 -6.355 1.00 0.00 H new ATOM 406 N ARG A 30 1.018 19.157 -8.782 1.00 0.00 N ATOM 407 CA ARG A 30 0.236 19.737 -9.860 1.00 0.00 C ATOM 408 C ARG A 30 -1.038 20.378 -9.307 1.00 0.00 C ATOM 409 O ARG A 30 -1.748 21.079 -10.026 1.00 0.00 O ATOM 410 CB ARG A 30 -0.143 18.678 -10.897 1.00 0.00 C ATOM 411 CG ARG A 30 1.068 18.285 -11.747 1.00 0.00 C ATOM 412 CD ARG A 30 0.700 17.190 -12.751 1.00 0.00 C ATOM 413 NE ARG A 30 0.404 17.792 -14.070 1.00 0.00 N ATOM 414 CZ ARG A 30 1.324 18.364 -14.859 1.00 0.00 C ATOM 415 NH1 ARG A 30 2.604 18.415 -14.467 1.00 0.00 N ATOM 416 NH2 ARG A 30 0.963 18.884 -16.040 1.00 0.00 N ATOM 0 H ARG A 30 0.565 18.384 -8.294 1.00 0.00 H new ATOM 0 HA ARG A 30 0.850 20.498 -10.342 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -0.540 17.796 -10.394 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -0.935 19.061 -11.541 1.00 0.00 H new ATOM 0 HG2 ARG A 30 1.443 19.160 -12.278 1.00 0.00 H new ATOM 0 HG3 ARG A 30 1.873 17.935 -11.100 1.00 0.00 H new ATOM 0 HD2 ARG A 30 1.521 16.478 -12.843 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -0.166 16.633 -12.393 1.00 0.00 H new ATOM 0 HE ARG A 30 -0.561 17.770 -14.399 1.00 0.00 H new ATOM 0 HH11 ARG A 30 2.878 18.018 -13.568 1.00 0.00 H new ATOM 0 HH12 ARG A 30 3.304 18.850 -15.067 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -0.012 18.844 -16.338 1.00 0.00 H new ATOM 0 HH22 ARG A 30 1.663 19.319 -16.641 1.00 0.00 H new ATOM 430 N LEU A 31 -1.290 20.114 -8.033 1.00 0.00 N ATOM 431 CA LEU A 31 -2.467 20.655 -7.375 1.00 0.00 C ATOM 432 C LEU A 31 -2.075 21.909 -6.590 1.00 0.00 C ATOM 433 O LEU A 31 -0.903 22.106 -6.273 1.00 0.00 O ATOM 434 CB LEU A 31 -3.145 19.582 -6.521 1.00 0.00 C ATOM 435 CG LEU A 31 -3.884 18.484 -7.287 1.00 0.00 C ATOM 436 CD1 LEU A 31 -4.120 17.260 -6.400 1.00 0.00 C ATOM 437 CD2 LEU A 31 -5.187 19.016 -7.888 1.00 0.00 C ATOM 0 H LEU A 31 -0.699 19.532 -7.439 1.00 0.00 H new ATOM 0 HA LEU A 31 -3.210 20.958 -8.112 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -2.387 19.113 -5.893 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -3.854 20.072 -5.853 1.00 0.00 H new ATOM 0 HG LEU A 31 -3.254 18.164 -8.117 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -4.647 16.494 -6.969 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.162 16.865 -6.062 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.719 17.547 -5.536 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -5.693 18.215 -8.427 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.834 19.381 -7.090 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -4.964 19.832 -8.576 1.00 0.00 H new ATOM 449 N PRO A 32 -3.105 22.746 -6.292 1.00 0.00 N ATOM 450 CA PRO A 32 -2.880 23.975 -5.550 1.00 0.00 C ATOM 451 C PRO A 32 -2.640 23.684 -4.067 1.00 0.00 C ATOM 452 O PRO A 32 -2.766 22.543 -3.626 1.00 0.00 O ATOM 453 CB PRO A 32 -4.121 24.817 -5.798 1.00 0.00 C ATOM 454 CG PRO A 32 -5.190 23.850 -6.282 1.00 0.00 C ATOM 455 CD PRO A 32 -4.505 22.545 -6.651 1.00 0.00 C ATOM 0 HA PRO A 32 -1.985 24.505 -5.875 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -4.437 25.325 -4.887 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -3.927 25.589 -6.542 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -5.935 23.683 -5.504 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -5.716 24.262 -7.143 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -4.936 21.704 -6.108 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -4.614 22.327 -7.713 1.00 0.00 H new ATOM 463 N PRO A 33 -2.291 24.765 -3.319 1.00 0.00 N ATOM 464 CA PRO A 33 -2.034 24.637 -1.895 1.00 0.00 C ATOM 465 C PRO A 33 -3.339 24.474 -1.113 1.00 0.00 C ATOM 466 O PRO A 33 -3.327 24.400 0.114 1.00 0.00 O ATOM 467 CB PRO A 33 -1.270 25.896 -1.519 1.00 0.00 C ATOM 468 CG PRO A 33 -1.532 26.892 -2.637 1.00 0.00 C ATOM 469 CD PRO A 33 -2.134 26.132 -3.807 1.00 0.00 C ATOM 0 HA PRO A 33 -1.454 23.747 -1.651 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -1.610 26.287 -0.560 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -0.204 25.691 -1.420 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -2.212 27.674 -2.300 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -0.606 27.382 -2.936 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -3.092 26.558 -4.106 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -1.483 26.168 -4.680 1.00 0.00 H new ATOM 477 N ASP A 34 -4.434 24.423 -1.857 1.00 0.00 N ATOM 478 CA ASP A 34 -5.745 24.271 -1.250 1.00 0.00 C ATOM 479 C ASP A 34 -6.189 22.811 -1.364 1.00 0.00 C ATOM 480 O ASP A 34 -6.708 22.239 -0.407 1.00 0.00 O ATOM 481 CB ASP A 34 -6.786 25.138 -1.961 1.00 0.00 C ATOM 482 CG ASP A 34 -6.360 26.586 -2.209 1.00 0.00 C ATOM 483 OD1 ASP A 34 -5.241 26.932 -1.771 1.00 0.00 O ATOM 484 OD2 ASP A 34 -7.162 27.315 -2.831 1.00 0.00 O ATOM 0 H ASP A 34 -4.440 24.484 -2.875 1.00 0.00 H new ATOM 0 HA ASP A 34 -5.671 24.579 -0.207 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -7.028 24.677 -2.919 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -7.701 25.141 -1.368 1.00 0.00 H new ATOM 489 N GLU A 35 -5.968 22.250 -2.544 1.00 0.00 N ATOM 490 CA GLU A 35 -6.339 20.868 -2.796 1.00 0.00 C ATOM 491 C GLU A 35 -5.184 19.933 -2.430 1.00 0.00 C ATOM 492 O GLU A 35 -5.407 18.828 -1.937 1.00 0.00 O ATOM 493 CB GLU A 35 -6.762 20.671 -4.253 1.00 0.00 C ATOM 494 CG GLU A 35 -8.274 20.464 -4.361 1.00 0.00 C ATOM 495 CD GLU A 35 -8.641 18.990 -4.177 1.00 0.00 C ATOM 496 OE1 GLU A 35 -8.877 18.605 -3.011 1.00 0.00 O ATOM 497 OE2 GLU A 35 -8.677 18.280 -5.205 1.00 0.00 O ATOM 0 H GLU A 35 -5.537 22.727 -3.336 1.00 0.00 H new ATOM 0 HA GLU A 35 -7.194 20.621 -2.167 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -6.467 21.540 -4.842 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -6.242 19.810 -4.673 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -8.782 21.066 -3.607 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -8.623 20.811 -5.334 1.00 0.00 H new ATOM 504 N LYS A 36 -3.975 20.411 -2.684 1.00 0.00 N ATOM 505 CA LYS A 36 -2.785 19.632 -2.387 1.00 0.00 C ATOM 506 C LYS A 36 -2.848 19.145 -0.938 1.00 0.00 C ATOM 507 O LYS A 36 -2.811 17.943 -0.681 1.00 0.00 O ATOM 508 CB LYS A 36 -1.524 20.436 -2.711 1.00 0.00 C ATOM 509 CG LYS A 36 -0.263 19.618 -2.422 1.00 0.00 C ATOM 510 CD LYS A 36 0.984 20.328 -2.952 1.00 0.00 C ATOM 511 CE LYS A 36 2.004 20.553 -1.834 1.00 0.00 C ATOM 512 NZ LYS A 36 1.646 21.750 -1.040 1.00 0.00 N ATOM 0 H LYS A 36 -3.794 21.328 -3.092 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.742 18.746 -3.020 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.537 20.733 -3.760 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -1.511 21.352 -2.121 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -0.167 19.459 -1.348 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -0.350 18.634 -2.883 1.00 0.00 H new ATOM 0 HD2 LYS A 36 1.435 19.734 -3.746 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.703 21.285 -3.391 1.00 0.00 H new ATOM 0 HE2 LYS A 36 2.042 19.677 -1.186 1.00 0.00 H new ATOM 0 HE3 LYS A 36 2.999 20.677 -2.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 2.348 21.889 -0.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 1.633 22.586 -1.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 0.705 21.617 -0.617 1.00 0.00 H new ATOM 526 N LYS A 37 -2.941 20.104 -0.029 1.00 0.00 N ATOM 527 CA LYS A 37 -3.010 19.788 1.388 1.00 0.00 C ATOM 528 C LYS A 37 -3.901 18.560 1.590 1.00 0.00 C ATOM 529 O LYS A 37 -3.464 17.557 2.152 1.00 0.00 O ATOM 530 CB LYS A 37 -3.458 21.012 2.189 1.00 0.00 C ATOM 531 CG LYS A 37 -2.433 21.367 3.267 1.00 0.00 C ATOM 532 CD LYS A 37 -2.324 22.883 3.442 1.00 0.00 C ATOM 533 CE LYS A 37 -1.689 23.236 4.789 1.00 0.00 C ATOM 534 NZ LYS A 37 -0.224 23.033 4.740 1.00 0.00 N ATOM 0 H LYS A 37 -2.970 21.100 -0.246 1.00 0.00 H new ATOM 0 HA LYS A 37 -2.022 19.531 1.769 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -3.594 21.860 1.518 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -4.425 20.814 2.652 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -2.721 20.908 4.213 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -1.460 20.958 2.997 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -1.727 23.304 2.633 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -3.315 23.333 3.374 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -1.910 24.273 5.041 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -2.122 22.617 5.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 0.191 23.277 5.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -0.019 22.037 4.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 0.186 23.642 4.003 1.00 0.00 H new ATOM 548 N GLN A 38 -5.134 18.680 1.120 1.00 0.00 N ATOM 549 CA GLN A 38 -6.090 17.593 1.242 1.00 0.00 C ATOM 550 C GLN A 38 -5.516 16.311 0.636 1.00 0.00 C ATOM 551 O GLN A 38 -5.536 15.258 1.270 1.00 0.00 O ATOM 552 CB GLN A 38 -7.424 17.960 0.588 1.00 0.00 C ATOM 553 CG GLN A 38 -8.019 19.218 1.223 1.00 0.00 C ATOM 554 CD GLN A 38 -8.592 18.914 2.609 1.00 0.00 C ATOM 555 OE1 GLN A 38 -9.742 18.538 2.765 1.00 0.00 O ATOM 556 NE2 GLN A 38 -7.728 19.097 3.604 1.00 0.00 N ATOM 0 H GLN A 38 -5.493 19.513 0.654 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.279 17.418 2.301 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -7.277 18.122 -0.480 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -8.124 17.131 0.691 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -7.251 19.987 1.304 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -8.804 19.618 0.581 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -6.779 19.414 3.404 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -8.014 18.921 4.567 1.00 0.00 H new ATOM 565 N MET A 39 -5.019 16.443 -0.585 1.00 0.00 N ATOM 566 CA MET A 39 -4.441 15.308 -1.284 1.00 0.00 C ATOM 567 C MET A 39 -3.293 14.695 -0.479 1.00 0.00 C ATOM 568 O MET A 39 -3.153 13.475 -0.420 1.00 0.00 O ATOM 569 CB MET A 39 -3.922 15.760 -2.651 1.00 0.00 C ATOM 570 CG MET A 39 -3.225 14.610 -3.381 1.00 0.00 C ATOM 571 SD MET A 39 -3.658 14.635 -5.112 1.00 0.00 S ATOM 572 CE MET A 39 -5.438 14.640 -4.987 1.00 0.00 C ATOM 0 H MET A 39 -5.005 17.319 -1.108 1.00 0.00 H new ATOM 0 HA MET A 39 -5.215 14.551 -1.412 1.00 0.00 H new ATOM 0 HB2 MET A 39 -4.751 16.129 -3.255 1.00 0.00 H new ATOM 0 HB3 MET A 39 -3.226 16.589 -2.524 1.00 0.00 H new ATOM 0 HG2 MET A 39 -2.145 14.697 -3.267 1.00 0.00 H new ATOM 0 HG3 MET A 39 -3.516 13.657 -2.938 1.00 0.00 H new ATOM 0 HE1 MET A 39 -5.866 14.171 -5.873 1.00 0.00 H new ATOM 0 HE2 MET A 39 -5.742 14.085 -4.100 1.00 0.00 H new ATOM 0 HE3 MET A 39 -5.795 15.667 -4.912 1.00 0.00 H new ATOM 582 N VAL A 40 -2.500 15.571 0.121 1.00 0.00 N ATOM 583 CA VAL A 40 -1.369 15.131 0.920 1.00 0.00 C ATOM 584 C VAL A 40 -1.881 14.441 2.186 1.00 0.00 C ATOM 585 O VAL A 40 -1.104 13.849 2.933 1.00 0.00 O ATOM 586 CB VAL A 40 -0.446 16.315 1.217 1.00 0.00 C ATOM 587 CG1 VAL A 40 0.645 15.923 2.215 1.00 0.00 C ATOM 588 CG2 VAL A 40 0.163 16.871 -0.072 1.00 0.00 C ATOM 0 H VAL A 40 -2.618 16.583 0.070 1.00 0.00 H new ATOM 0 HA VAL A 40 -0.774 14.402 0.370 1.00 0.00 H new ATOM 0 HB VAL A 40 -1.047 17.103 1.671 1.00 0.00 H new ATOM 0 HG11 VAL A 40 1.287 16.782 2.409 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.185 15.597 3.148 1.00 0.00 H new ATOM 0 HG13 VAL A 40 1.242 15.110 1.801 1.00 0.00 H new ATOM 0 HG21 VAL A 40 0.815 17.711 0.167 1.00 0.00 H new ATOM 0 HG22 VAL A 40 0.742 16.091 -0.566 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -0.634 17.207 -0.736 1.00 0.00 H new ATOM 598 N ALA A 41 -3.187 14.540 2.388 1.00 0.00 N ATOM 599 CA ALA A 41 -3.813 13.933 3.550 1.00 0.00 C ATOM 600 C ALA A 41 -4.558 12.668 3.120 1.00 0.00 C ATOM 601 O ALA A 41 -4.502 11.647 3.805 1.00 0.00 O ATOM 602 CB ALA A 41 -4.734 14.951 4.225 1.00 0.00 C ATOM 0 H ALA A 41 -3.829 15.032 1.766 1.00 0.00 H new ATOM 0 HA ALA A 41 -3.060 13.640 4.282 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -5.203 14.495 5.097 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -4.151 15.817 4.538 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -5.504 15.267 3.522 1.00 0.00 H new ATOM 608 N ASN A 42 -5.238 12.776 1.989 1.00 0.00 N ATOM 609 CA ASN A 42 -5.994 11.653 1.459 1.00 0.00 C ATOM 610 C ASN A 42 -5.049 10.473 1.225 1.00 0.00 C ATOM 611 O ASN A 42 -5.416 9.323 1.459 1.00 0.00 O ATOM 612 CB ASN A 42 -6.646 12.010 0.122 1.00 0.00 C ATOM 613 CG ASN A 42 -7.919 11.192 -0.103 1.00 0.00 C ATOM 614 OD1 ASN A 42 -8.523 10.670 0.820 1.00 0.00 O ATOM 615 ND2 ASN A 42 -8.292 11.109 -1.377 1.00 0.00 N ATOM 0 H ASN A 42 -5.282 13.624 1.424 1.00 0.00 H new ATOM 0 HA ASN A 42 -6.770 11.397 2.181 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -6.885 13.073 0.102 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -5.943 11.826 -0.690 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -9.129 10.584 -1.630 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -7.741 11.570 -2.101 1.00 0.00 H new ATOM 622 N VAL A 43 -3.849 10.799 0.765 1.00 0.00 N ATOM 623 CA VAL A 43 -2.849 9.781 0.496 1.00 0.00 C ATOM 624 C VAL A 43 -2.398 9.153 1.816 1.00 0.00 C ATOM 625 O VAL A 43 -2.194 7.943 1.895 1.00 0.00 O ATOM 626 CB VAL A 43 -1.692 10.382 -0.306 1.00 0.00 C ATOM 627 CG1 VAL A 43 -0.469 9.463 -0.277 1.00 0.00 C ATOM 628 CG2 VAL A 43 -2.119 10.682 -1.744 1.00 0.00 C ATOM 0 H VAL A 43 -3.548 11.754 0.572 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.271 8.984 -0.116 1.00 0.00 H new ATOM 0 HB VAL A 43 -1.413 11.325 0.164 1.00 0.00 H new ATOM 0 HG11 VAL A 43 0.338 9.914 -0.854 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -0.144 9.323 0.754 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.729 8.497 -0.710 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -1.278 11.108 -2.292 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -2.438 9.759 -2.229 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.945 11.393 -1.737 1.00 0.00 H new ATOM 638 N GLU A 44 -2.257 10.005 2.822 1.00 0.00 N ATOM 639 CA GLU A 44 -1.834 9.549 4.135 1.00 0.00 C ATOM 640 C GLU A 44 -2.722 8.396 4.607 1.00 0.00 C ATOM 641 O GLU A 44 -2.268 7.516 5.337 1.00 0.00 O ATOM 642 CB GLU A 44 -1.845 10.698 5.144 1.00 0.00 C ATOM 643 CG GLU A 44 -0.620 11.597 4.964 1.00 0.00 C ATOM 644 CD GLU A 44 0.145 11.751 6.280 1.00 0.00 C ATOM 645 OE1 GLU A 44 -0.371 12.480 7.155 1.00 0.00 O ATOM 646 OE2 GLU A 44 1.229 11.136 6.382 1.00 0.00 O ATOM 0 H GLU A 44 -2.428 11.008 2.754 1.00 0.00 H new ATOM 0 HA GLU A 44 -0.809 9.186 4.060 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -2.754 11.287 5.020 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -1.860 10.297 6.157 1.00 0.00 H new ATOM 0 HG2 GLU A 44 0.037 11.174 4.204 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -0.933 12.577 4.605 1.00 0.00 H new ATOM 653 N LYS A 45 -3.973 8.438 4.172 1.00 0.00 N ATOM 654 CA LYS A 45 -4.929 7.408 4.542 1.00 0.00 C ATOM 655 C LYS A 45 -4.790 6.222 3.585 1.00 0.00 C ATOM 656 O LYS A 45 -4.384 5.135 3.992 1.00 0.00 O ATOM 657 CB LYS A 45 -6.344 7.986 4.603 1.00 0.00 C ATOM 658 CG LYS A 45 -6.983 7.732 5.969 1.00 0.00 C ATOM 659 CD LYS A 45 -6.251 8.504 7.069 1.00 0.00 C ATOM 660 CE LYS A 45 -7.234 9.314 7.917 1.00 0.00 C ATOM 661 NZ LYS A 45 -6.509 10.291 8.760 1.00 0.00 N ATOM 0 H LYS A 45 -4.347 9.169 3.567 1.00 0.00 H new ATOM 0 HA LYS A 45 -4.719 7.036 5.545 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -6.311 9.058 4.407 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -6.958 7.537 3.822 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -8.031 8.031 5.946 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -6.961 6.665 6.192 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -5.704 7.808 7.705 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -5.515 9.172 6.621 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -7.938 9.836 7.269 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -7.818 8.643 8.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -7.191 10.832 9.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -5.855 9.786 9.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -5.971 10.942 8.153 1.00 0.00 H new ATOM 675 N GLN A 46 -5.135 6.472 2.330 1.00 0.00 N ATOM 676 CA GLN A 46 -5.054 5.439 1.312 1.00 0.00 C ATOM 677 C GLN A 46 -3.786 4.604 1.502 1.00 0.00 C ATOM 678 O GLN A 46 -3.777 3.408 1.215 1.00 0.00 O ATOM 679 CB GLN A 46 -5.105 6.046 -0.091 1.00 0.00 C ATOM 680 CG GLN A 46 -6.548 6.319 -0.519 1.00 0.00 C ATOM 681 CD GLN A 46 -7.382 6.831 0.658 1.00 0.00 C ATOM 682 OE1 GLN A 46 -7.364 8.001 1.002 1.00 0.00 O ATOM 683 NE2 GLN A 46 -8.110 5.891 1.254 1.00 0.00 N ATOM 0 H GLN A 46 -5.471 7.375 1.996 1.00 0.00 H new ATOM 0 HA GLN A 46 -5.917 4.783 1.420 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -4.535 6.975 -0.110 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -4.633 5.367 -0.802 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -6.559 7.054 -1.324 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -6.993 5.406 -0.914 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -8.078 4.930 0.915 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -8.700 6.131 2.051 1.00 0.00 H new ATOM 692 N LEU A 47 -2.746 5.268 1.985 1.00 0.00 N ATOM 693 CA LEU A 47 -1.476 4.602 2.217 1.00 0.00 C ATOM 694 C LEU A 47 -1.601 3.683 3.434 1.00 0.00 C ATOM 695 O LEU A 47 -1.392 2.475 3.328 1.00 0.00 O ATOM 696 CB LEU A 47 -0.347 5.628 2.336 1.00 0.00 C ATOM 697 CG LEU A 47 0.166 6.217 1.020 1.00 0.00 C ATOM 698 CD1 LEU A 47 1.004 7.472 1.271 1.00 0.00 C ATOM 699 CD2 LEU A 47 0.932 5.168 0.212 1.00 0.00 C ATOM 0 H LEU A 47 -2.757 6.260 2.222 1.00 0.00 H new ATOM 0 HA LEU A 47 -1.216 3.972 1.366 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.692 6.447 2.967 1.00 0.00 H new ATOM 0 HB3 LEU A 47 0.491 5.159 2.852 1.00 0.00 H new ATOM 0 HG LEU A 47 -0.694 6.519 0.422 1.00 0.00 H new ATOM 0 HD11 LEU A 47 1.356 7.871 0.320 1.00 0.00 H new ATOM 0 HD12 LEU A 47 0.394 8.222 1.775 1.00 0.00 H new ATOM 0 HD13 LEU A 47 1.859 7.219 1.897 1.00 0.00 H new ATOM 0 HD21 LEU A 47 1.286 5.612 -0.718 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.784 4.813 0.792 1.00 0.00 H new ATOM 0 HD23 LEU A 47 0.273 4.330 -0.014 1.00 0.00 H new ATOM 711 N GLU A 48 -1.942 4.289 4.561 1.00 0.00 N ATOM 712 CA GLU A 48 -2.098 3.540 5.797 1.00 0.00 C ATOM 713 C GLU A 48 -3.143 2.437 5.620 1.00 0.00 C ATOM 714 O GLU A 48 -3.117 1.432 6.329 1.00 0.00 O ATOM 715 CB GLU A 48 -2.469 4.466 6.956 1.00 0.00 C ATOM 716 CG GLU A 48 -3.988 4.582 7.101 1.00 0.00 C ATOM 717 CD GLU A 48 -4.359 5.525 8.247 1.00 0.00 C ATOM 718 OE1 GLU A 48 -3.765 6.624 8.293 1.00 0.00 O ATOM 719 OE2 GLU A 48 -5.229 5.126 9.052 1.00 0.00 O ATOM 0 H GLU A 48 -2.115 5.291 4.645 1.00 0.00 H new ATOM 0 HA GLU A 48 -1.143 3.074 6.040 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -2.040 4.085 7.883 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -2.040 5.454 6.789 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -4.419 4.949 6.169 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -4.416 3.596 7.283 1.00 0.00 H new ATOM 726 N GLU A 49 -4.039 2.661 4.670 1.00 0.00 N ATOM 727 CA GLU A 49 -5.091 1.698 4.391 1.00 0.00 C ATOM 728 C GLU A 49 -4.512 0.468 3.690 1.00 0.00 C ATOM 729 O GLU A 49 -4.670 -0.655 4.167 1.00 0.00 O ATOM 730 CB GLU A 49 -6.206 2.331 3.556 1.00 0.00 C ATOM 731 CG GLU A 49 -6.958 3.394 4.360 1.00 0.00 C ATOM 732 CD GLU A 49 -7.316 2.875 5.754 1.00 0.00 C ATOM 733 OE1 GLU A 49 -7.889 1.766 5.816 1.00 0.00 O ATOM 734 OE2 GLU A 49 -7.009 3.599 6.725 1.00 0.00 O ATOM 0 H GLU A 49 -4.058 3.495 4.084 1.00 0.00 H new ATOM 0 HA GLU A 49 -5.527 1.380 5.338 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.782 2.781 2.658 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -6.902 1.559 3.227 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -6.344 4.290 4.448 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -7.866 3.681 3.830 1.00 0.00 H new ATOM 741 N ALA A 50 -3.854 0.720 2.568 1.00 0.00 N ATOM 742 CA ALA A 50 -3.251 -0.353 1.796 1.00 0.00 C ATOM 743 C ALA A 50 -2.181 -1.045 2.643 1.00 0.00 C ATOM 744 O ALA A 50 -1.982 -2.254 2.531 1.00 0.00 O ATOM 745 CB ALA A 50 -2.686 0.211 0.491 1.00 0.00 C ATOM 0 H ALA A 50 -3.725 1.652 2.175 1.00 0.00 H new ATOM 0 HA ALA A 50 -3.998 -1.101 1.531 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -2.234 -0.594 -0.088 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -3.490 0.666 -0.087 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -1.931 0.964 0.717 1.00 0.00 H new ATOM 751 N ARG A 51 -1.521 -0.250 3.471 1.00 0.00 N ATOM 752 CA ARG A 51 -0.477 -0.771 4.337 1.00 0.00 C ATOM 753 C ARG A 51 -0.922 -2.091 4.970 1.00 0.00 C ATOM 754 O ARG A 51 -0.131 -3.026 5.084 1.00 0.00 O ATOM 755 CB ARG A 51 -0.131 0.227 5.444 1.00 0.00 C ATOM 756 CG ARG A 51 0.795 1.327 4.921 1.00 0.00 C ATOM 757 CD ARG A 51 1.966 1.559 5.879 1.00 0.00 C ATOM 758 NE ARG A 51 1.940 2.951 6.382 1.00 0.00 N ATOM 759 CZ ARG A 51 2.984 3.560 6.960 1.00 0.00 C ATOM 760 NH1 ARG A 51 4.142 2.904 7.113 1.00 0.00 N ATOM 761 NH2 ARG A 51 2.869 4.825 7.386 1.00 0.00 N ATOM 0 H ARG A 51 -1.689 0.752 3.561 1.00 0.00 H new ATOM 0 HA ARG A 51 0.409 -0.939 3.725 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -1.045 0.672 5.836 1.00 0.00 H new ATOM 0 HB3 ARG A 51 0.349 -0.295 6.272 1.00 0.00 H new ATOM 0 HG2 ARG A 51 1.174 1.051 3.937 1.00 0.00 H new ATOM 0 HG3 ARG A 51 0.233 2.253 4.797 1.00 0.00 H new ATOM 0 HD2 ARG A 51 1.907 0.861 6.714 1.00 0.00 H new ATOM 0 HD3 ARG A 51 2.909 1.366 5.367 1.00 0.00 H new ATOM 0 HE ARG A 51 1.073 3.479 6.282 1.00 0.00 H new ATOM 0 HH11 ARG A 51 4.229 1.941 6.789 1.00 0.00 H new ATOM 0 HH12 ARG A 51 4.937 3.368 7.553 1.00 0.00 H new ATOM 0 HH21 ARG A 51 1.987 5.324 7.270 1.00 0.00 H new ATOM 0 HH22 ARG A 51 3.664 5.289 7.826 1.00 0.00 H new ATOM 775 N GLU A 52 -2.186 -2.124 5.365 1.00 0.00 N ATOM 776 CA GLU A 52 -2.745 -3.314 5.984 1.00 0.00 C ATOM 777 C GLU A 52 -2.812 -4.458 4.969 1.00 0.00 C ATOM 778 O GLU A 52 -2.498 -5.601 5.296 1.00 0.00 O ATOM 779 CB GLU A 52 -4.126 -3.026 6.577 1.00 0.00 C ATOM 780 CG GLU A 52 -5.230 -3.299 5.554 1.00 0.00 C ATOM 781 CD GLU A 52 -6.595 -2.862 6.092 1.00 0.00 C ATOM 782 OE1 GLU A 52 -6.852 -1.639 6.061 1.00 0.00 O ATOM 783 OE2 GLU A 52 -7.350 -3.761 6.520 1.00 0.00 O ATOM 0 H GLU A 52 -2.839 -1.346 5.269 1.00 0.00 H new ATOM 0 HA GLU A 52 -2.091 -3.617 6.801 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -4.283 -3.645 7.460 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -4.176 -1.987 6.903 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -5.013 -2.767 4.628 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -5.253 -4.362 5.313 1.00 0.00 H new ATOM 790 N LEU A 53 -3.224 -4.110 3.759 1.00 0.00 N ATOM 791 CA LEU A 53 -3.337 -5.093 2.695 1.00 0.00 C ATOM 792 C LEU A 53 -2.048 -5.915 2.628 1.00 0.00 C ATOM 793 O LEU A 53 -2.068 -7.127 2.837 1.00 0.00 O ATOM 794 CB LEU A 53 -3.703 -4.414 1.374 1.00 0.00 C ATOM 795 CG LEU A 53 -5.126 -4.656 0.867 1.00 0.00 C ATOM 796 CD1 LEU A 53 -5.661 -3.427 0.129 1.00 0.00 C ATOM 797 CD2 LEU A 53 -5.193 -5.917 0.004 1.00 0.00 C ATOM 0 H LEU A 53 -3.484 -3.161 3.492 1.00 0.00 H new ATOM 0 HA LEU A 53 -4.149 -5.789 2.904 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -3.557 -3.340 1.488 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -3.004 -4.751 0.609 1.00 0.00 H new ATOM 0 HG LEU A 53 -5.773 -4.821 1.729 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.674 -3.625 -0.221 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -5.672 -2.572 0.806 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -5.019 -3.207 -0.724 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -6.215 -6.066 -0.344 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -4.530 -5.806 -0.854 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -4.881 -6.779 0.594 1.00 0.00 H new ATOM 809 N LEU A 54 -0.957 -5.222 2.335 1.00 0.00 N ATOM 810 CA LEU A 54 0.339 -5.872 2.237 1.00 0.00 C ATOM 811 C LEU A 54 0.517 -6.825 3.421 1.00 0.00 C ATOM 812 O LEU A 54 1.122 -7.887 3.282 1.00 0.00 O ATOM 813 CB LEU A 54 1.453 -4.831 2.112 1.00 0.00 C ATOM 814 CG LEU A 54 1.463 -4.012 0.820 1.00 0.00 C ATOM 815 CD1 LEU A 54 2.894 -3.669 0.400 1.00 0.00 C ATOM 816 CD2 LEU A 54 0.696 -4.731 -0.291 1.00 0.00 C ATOM 0 H LEU A 54 -0.944 -4.217 2.162 1.00 0.00 H new ATOM 0 HA LEU A 54 0.395 -6.475 1.331 1.00 0.00 H new ATOM 0 HB2 LEU A 54 1.377 -4.143 2.954 1.00 0.00 H new ATOM 0 HB3 LEU A 54 2.412 -5.341 2.203 1.00 0.00 H new ATOM 0 HG LEU A 54 0.948 -3.070 1.008 1.00 0.00 H new ATOM 0 HD11 LEU A 54 2.873 -3.087 -0.521 1.00 0.00 H new ATOM 0 HD12 LEU A 54 3.374 -3.087 1.186 1.00 0.00 H new ATOM 0 HD13 LEU A 54 3.455 -4.589 0.235 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.719 -4.127 -1.198 1.00 0.00 H new ATOM 0 HD22 LEU A 54 1.160 -5.698 -0.487 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.338 -4.881 0.019 1.00 0.00 H new ATOM 828 N GLU A 55 -0.021 -6.410 4.559 1.00 0.00 N ATOM 829 CA GLU A 55 0.071 -7.213 5.766 1.00 0.00 C ATOM 830 C GLU A 55 -0.696 -8.525 5.591 1.00 0.00 C ATOM 831 O GLU A 55 -0.097 -9.599 5.553 1.00 0.00 O ATOM 832 CB GLU A 55 -0.440 -6.437 6.981 1.00 0.00 C ATOM 833 CG GLU A 55 0.599 -6.432 8.105 1.00 0.00 C ATOM 834 CD GLU A 55 0.040 -7.085 9.371 1.00 0.00 C ATOM 835 OE1 GLU A 55 -1.134 -6.794 9.689 1.00 0.00 O ATOM 836 OE2 GLU A 55 0.798 -7.860 9.992 1.00 0.00 O ATOM 0 H GLU A 55 -0.522 -5.528 4.670 1.00 0.00 H new ATOM 0 HA GLU A 55 1.120 -7.449 5.942 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -0.672 -5.412 6.691 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -1.367 -6.885 7.340 1.00 0.00 H new ATOM 0 HG2 GLU A 55 1.493 -6.965 7.781 1.00 0.00 H new ATOM 0 HG3 GLU A 55 0.900 -5.407 8.323 1.00 0.00 H new ATOM 843 N GLN A 56 -2.011 -8.395 5.490 1.00 0.00 N ATOM 844 CA GLN A 56 -2.867 -9.557 5.320 1.00 0.00 C ATOM 845 C GLN A 56 -2.361 -10.425 4.165 1.00 0.00 C ATOM 846 O GLN A 56 -2.313 -11.649 4.278 1.00 0.00 O ATOM 847 CB GLN A 56 -4.321 -9.139 5.095 1.00 0.00 C ATOM 848 CG GLN A 56 -4.906 -8.492 6.352 1.00 0.00 C ATOM 849 CD GLN A 56 -5.237 -9.549 7.408 1.00 0.00 C ATOM 850 OE1 GLN A 56 -5.257 -10.740 7.147 1.00 0.00 O ATOM 851 NE2 GLN A 56 -5.496 -9.047 8.612 1.00 0.00 N ATOM 0 H GLN A 56 -2.504 -7.503 5.523 1.00 0.00 H new ATOM 0 HA GLN A 56 -2.831 -10.147 6.236 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -4.377 -8.439 4.262 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -4.915 -10.010 4.820 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -4.195 -7.774 6.761 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -5.807 -7.936 6.094 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -5.462 -8.039 8.762 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -5.729 -9.670 9.385 1.00 0.00 H new ATOM 860 N MET A 57 -1.996 -9.757 3.081 1.00 0.00 N ATOM 861 CA MET A 57 -1.496 -10.451 1.907 1.00 0.00 C ATOM 862 C MET A 57 -0.251 -11.274 2.245 1.00 0.00 C ATOM 863 O MET A 57 -0.109 -12.407 1.789 1.00 0.00 O ATOM 864 CB MET A 57 -1.154 -9.432 0.818 1.00 0.00 C ATOM 865 CG MET A 57 -2.423 -8.809 0.232 1.00 0.00 C ATOM 866 SD MET A 57 -2.124 -8.276 -1.445 1.00 0.00 S ATOM 867 CE MET A 57 -1.589 -6.600 -1.147 1.00 0.00 C ATOM 0 H MET A 57 -2.037 -8.742 2.991 1.00 0.00 H new ATOM 0 HA MET A 57 -2.272 -11.129 1.552 1.00 0.00 H new ATOM 0 HB2 MET A 57 -0.519 -8.650 1.234 1.00 0.00 H new ATOM 0 HB3 MET A 57 -0.584 -9.918 0.026 1.00 0.00 H new ATOM 0 HG2 MET A 57 -3.237 -9.534 0.252 1.00 0.00 H new ATOM 0 HG3 MET A 57 -2.736 -7.961 0.841 1.00 0.00 H new ATOM 0 HE1 MET A 57 -2.368 -5.907 -1.466 1.00 0.00 H new ATOM 0 HE2 MET A 57 -1.395 -6.464 -0.083 1.00 0.00 H new ATOM 0 HE3 MET A 57 -0.676 -6.404 -1.710 1.00 0.00 H new ATOM 877 N ASP A 58 0.619 -10.671 3.042 1.00 0.00 N ATOM 878 CA ASP A 58 1.847 -11.333 3.447 1.00 0.00 C ATOM 879 C ASP A 58 1.527 -12.387 4.510 1.00 0.00 C ATOM 880 O ASP A 58 2.042 -13.502 4.458 1.00 0.00 O ATOM 881 CB ASP A 58 2.836 -10.336 4.054 1.00 0.00 C ATOM 882 CG ASP A 58 4.250 -10.879 4.270 1.00 0.00 C ATOM 883 OD1 ASP A 58 4.426 -12.100 4.072 1.00 0.00 O ATOM 884 OD2 ASP A 58 5.124 -10.060 4.629 1.00 0.00 O ATOM 0 H ASP A 58 0.497 -9.731 3.418 1.00 0.00 H new ATOM 0 HA ASP A 58 2.291 -11.789 2.562 1.00 0.00 H new ATOM 0 HB2 ASP A 58 2.894 -9.463 3.404 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.443 -9.995 5.012 1.00 0.00 H new ATOM 889 N LEU A 59 0.677 -11.995 5.448 1.00 0.00 N ATOM 890 CA LEU A 59 0.282 -12.892 6.521 1.00 0.00 C ATOM 891 C LEU A 59 -0.518 -14.058 5.937 1.00 0.00 C ATOM 892 O LEU A 59 -0.779 -15.044 6.625 1.00 0.00 O ATOM 893 CB LEU A 59 -0.461 -12.124 7.615 1.00 0.00 C ATOM 894 CG LEU A 59 0.415 -11.369 8.617 1.00 0.00 C ATOM 895 CD1 LEU A 59 1.200 -10.252 7.927 1.00 0.00 C ATOM 896 CD2 LEU A 59 -0.419 -10.843 9.788 1.00 0.00 C ATOM 0 H LEU A 59 0.251 -11.069 5.487 1.00 0.00 H new ATOM 0 HA LEU A 59 1.161 -13.318 7.004 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -1.132 -11.409 7.138 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.085 -12.828 8.166 1.00 0.00 H new ATOM 0 HG LEU A 59 1.143 -12.068 9.028 1.00 0.00 H new ATOM 0 HD11 LEU A 59 1.814 -9.731 8.662 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.841 -10.680 7.156 1.00 0.00 H new ATOM 0 HD13 LEU A 59 0.505 -9.547 7.471 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.228 -10.311 10.485 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -1.185 -10.164 9.413 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.894 -11.679 10.301 1.00 0.00 H new ATOM 908 N GLU A 60 -0.886 -13.907 4.673 1.00 0.00 N ATOM 909 CA GLU A 60 -1.651 -14.935 3.988 1.00 0.00 C ATOM 910 C GLU A 60 -0.742 -15.746 3.063 1.00 0.00 C ATOM 911 O GLU A 60 -0.791 -16.975 3.060 1.00 0.00 O ATOM 912 CB GLU A 60 -2.818 -14.323 3.210 1.00 0.00 C ATOM 913 CG GLU A 60 -3.911 -13.829 4.160 1.00 0.00 C ATOM 914 CD GLU A 60 -5.124 -14.761 4.132 1.00 0.00 C ATOM 915 OE1 GLU A 60 -5.469 -15.211 3.018 1.00 0.00 O ATOM 916 OE2 GLU A 60 -5.680 -15.002 5.225 1.00 0.00 O ATOM 0 H GLU A 60 -0.668 -13.088 4.105 1.00 0.00 H new ATOM 0 HA GLU A 60 -2.069 -15.608 4.737 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -2.459 -13.494 2.601 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -3.233 -15.064 2.527 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -3.517 -13.770 5.174 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -4.215 -12.821 3.877 1.00 0.00 H new ATOM 923 N VAL A 61 0.068 -15.026 2.301 1.00 0.00 N ATOM 924 CA VAL A 61 0.987 -15.664 1.374 1.00 0.00 C ATOM 925 C VAL A 61 1.707 -16.811 2.085 1.00 0.00 C ATOM 926 O VAL A 61 2.150 -17.763 1.444 1.00 0.00 O ATOM 927 CB VAL A 61 1.947 -14.625 0.791 1.00 0.00 C ATOM 928 CG1 VAL A 61 3.376 -15.169 0.737 1.00 0.00 C ATOM 929 CG2 VAL A 61 1.483 -14.164 -0.592 1.00 0.00 C ATOM 0 H VAL A 61 0.107 -14.007 2.307 1.00 0.00 H new ATOM 0 HA VAL A 61 0.444 -16.094 0.532 1.00 0.00 H new ATOM 0 HB VAL A 61 1.943 -13.758 1.451 1.00 0.00 H new ATOM 0 HG11 VAL A 61 4.038 -14.411 0.319 1.00 0.00 H new ATOM 0 HG12 VAL A 61 3.707 -15.424 1.744 1.00 0.00 H new ATOM 0 HG13 VAL A 61 3.403 -16.060 0.110 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.183 -13.426 -0.983 1.00 0.00 H new ATOM 0 HG22 VAL A 61 1.443 -15.019 -1.266 1.00 0.00 H new ATOM 0 HG23 VAL A 61 0.492 -13.718 -0.513 1.00 0.00 H new ATOM 939 N ARG A 62 1.802 -16.683 3.400 1.00 0.00 N ATOM 940 CA ARG A 62 2.461 -17.698 4.205 1.00 0.00 C ATOM 941 C ARG A 62 1.813 -19.064 3.971 1.00 0.00 C ATOM 942 O ARG A 62 2.509 -20.059 3.773 1.00 0.00 O ATOM 943 CB ARG A 62 2.385 -17.354 5.694 1.00 0.00 C ATOM 944 CG ARG A 62 3.754 -16.925 6.227 1.00 0.00 C ATOM 945 CD ARG A 62 3.624 -15.726 7.169 1.00 0.00 C ATOM 946 NE ARG A 62 3.847 -16.155 8.568 1.00 0.00 N ATOM 947 CZ ARG A 62 2.895 -16.672 9.357 1.00 0.00 C ATOM 948 NH1 ARG A 62 1.649 -16.828 8.889 1.00 0.00 N ATOM 949 NH2 ARG A 62 3.189 -17.034 10.613 1.00 0.00 N ATOM 0 H ARG A 62 1.434 -15.892 3.928 1.00 0.00 H new ATOM 0 HA ARG A 62 3.508 -17.732 3.904 1.00 0.00 H new ATOM 0 HB2 ARG A 62 1.663 -16.553 5.850 1.00 0.00 H new ATOM 0 HB3 ARG A 62 2.027 -18.219 6.253 1.00 0.00 H new ATOM 0 HG2 ARG A 62 4.220 -17.757 6.754 1.00 0.00 H new ATOM 0 HG3 ARG A 62 4.409 -16.668 5.394 1.00 0.00 H new ATOM 0 HD2 ARG A 62 4.348 -14.958 6.896 1.00 0.00 H new ATOM 0 HD3 ARG A 62 2.634 -15.281 7.070 1.00 0.00 H new ATOM 0 HE ARG A 62 4.784 -16.051 8.956 1.00 0.00 H new ATOM 0 HH11 ARG A 62 1.425 -16.553 7.932 1.00 0.00 H new ATOM 0 HH12 ARG A 62 0.924 -17.221 9.489 1.00 0.00 H new ATOM 0 HH21 ARG A 62 4.138 -16.916 10.969 1.00 0.00 H new ATOM 0 HH22 ARG A 62 2.464 -17.427 11.213 1.00 0.00 H new ATOM 963 N GLU A 63 0.489 -19.069 4.001 1.00 0.00 N ATOM 964 CA GLU A 63 -0.260 -20.297 3.795 1.00 0.00 C ATOM 965 C GLU A 63 -0.069 -20.801 2.363 1.00 0.00 C ATOM 966 O GLU A 63 0.106 -21.998 2.140 1.00 0.00 O ATOM 967 CB GLU A 63 -1.743 -20.094 4.111 1.00 0.00 C ATOM 968 CG GLU A 63 -2.003 -20.206 5.615 1.00 0.00 C ATOM 969 CD GLU A 63 -3.497 -20.369 5.903 1.00 0.00 C ATOM 970 OE1 GLU A 63 -4.032 -21.437 5.537 1.00 0.00 O ATOM 971 OE2 GLU A 63 -4.070 -19.421 6.482 1.00 0.00 O ATOM 0 H GLU A 63 -0.085 -18.242 4.165 1.00 0.00 H new ATOM 0 HA GLU A 63 0.124 -21.053 4.480 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -2.064 -19.115 3.755 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.337 -20.837 3.579 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -1.456 -21.058 6.020 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -1.627 -19.316 6.120 1.00 0.00 H new ATOM 978 N ILE A 64 -0.110 -19.862 1.429 1.00 0.00 N ATOM 979 CA ILE A 64 0.057 -20.196 0.024 1.00 0.00 C ATOM 980 C ILE A 64 1.190 -21.213 -0.122 1.00 0.00 C ATOM 981 O ILE A 64 2.192 -21.139 0.587 1.00 0.00 O ATOM 982 CB ILE A 64 0.258 -18.928 -0.808 1.00 0.00 C ATOM 983 CG1 ILE A 64 -0.973 -18.022 -0.732 1.00 0.00 C ATOM 984 CG2 ILE A 64 0.628 -19.272 -2.252 1.00 0.00 C ATOM 985 CD1 ILE A 64 -1.005 -17.041 -1.905 1.00 0.00 C ATOM 0 H ILE A 64 -0.256 -18.870 1.617 1.00 0.00 H new ATOM 0 HA ILE A 64 -0.846 -20.665 -0.366 1.00 0.00 H new ATOM 0 HB ILE A 64 1.095 -18.371 -0.386 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -1.877 -18.630 -0.737 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -0.965 -17.470 0.208 1.00 0.00 H new ATOM 0 HG21 ILE A 64 0.765 -18.353 -2.821 1.00 0.00 H new ATOM 0 HG22 ILE A 64 1.554 -19.847 -2.263 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -0.171 -19.862 -2.702 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -1.890 -16.409 -1.827 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -0.111 -16.418 -1.883 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -1.037 -17.596 -2.843 1.00 0.00 H new ATOM 997 N PRO A 65 0.988 -22.165 -1.072 1.00 0.00 N ATOM 998 CA PRO A 65 1.981 -23.197 -1.321 1.00 0.00 C ATOM 999 C PRO A 65 3.176 -22.632 -2.092 1.00 0.00 C ATOM 1000 O PRO A 65 3.098 -21.541 -2.654 1.00 0.00 O ATOM 1001 CB PRO A 65 1.239 -24.281 -2.087 1.00 0.00 C ATOM 1002 CG PRO A 65 -0.012 -23.618 -2.641 1.00 0.00 C ATOM 1003 CD PRO A 65 -0.187 -22.285 -1.931 1.00 0.00 C ATOM 0 HA PRO A 65 2.409 -23.599 -0.403 1.00 0.00 H new ATOM 0 HB2 PRO A 65 1.856 -24.684 -2.890 1.00 0.00 H new ATOM 0 HB3 PRO A 65 0.982 -25.115 -1.434 1.00 0.00 H new ATOM 0 HG2 PRO A 65 0.080 -23.468 -3.717 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -0.883 -24.253 -2.481 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -0.243 -21.462 -2.643 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -1.108 -22.265 -1.348 1.00 0.00 H new ATOM 1011 N PRO A 66 4.283 -23.422 -2.094 1.00 0.00 N ATOM 1012 CA PRO A 66 5.493 -23.013 -2.786 1.00 0.00 C ATOM 1013 C PRO A 66 5.338 -23.168 -4.300 1.00 0.00 C ATOM 1014 O PRO A 66 6.268 -22.887 -5.055 1.00 0.00 O ATOM 1015 CB PRO A 66 6.593 -23.889 -2.209 1.00 0.00 C ATOM 1016 CG PRO A 66 5.887 -25.068 -1.558 1.00 0.00 C ATOM 1017 CD PRO A 66 4.412 -24.721 -1.439 1.00 0.00 C ATOM 0 HA PRO A 66 5.725 -21.958 -2.639 1.00 0.00 H new ATOM 0 HB2 PRO A 66 7.275 -24.225 -2.990 1.00 0.00 H new ATOM 0 HB3 PRO A 66 7.189 -23.339 -1.480 1.00 0.00 H new ATOM 0 HG2 PRO A 66 6.020 -25.970 -2.156 1.00 0.00 H new ATOM 0 HG3 PRO A 66 6.312 -25.272 -0.575 1.00 0.00 H new ATOM 0 HD2 PRO A 66 3.788 -25.472 -1.923 1.00 0.00 H new ATOM 0 HD3 PRO A 66 4.100 -24.671 -0.396 1.00 0.00 H new ATOM 1025 N GLN A 67 4.156 -23.615 -4.699 1.00 0.00 N ATOM 1026 CA GLN A 67 3.867 -23.811 -6.109 1.00 0.00 C ATOM 1027 C GLN A 67 3.028 -22.649 -6.646 1.00 0.00 C ATOM 1028 O GLN A 67 3.121 -22.303 -7.823 1.00 0.00 O ATOM 1029 CB GLN A 67 3.163 -25.149 -6.344 1.00 0.00 C ATOM 1030 CG GLN A 67 3.904 -26.289 -5.642 1.00 0.00 C ATOM 1031 CD GLN A 67 4.858 -26.998 -6.605 1.00 0.00 C ATOM 1032 OE1 GLN A 67 4.458 -27.586 -7.596 1.00 0.00 O ATOM 1033 NE2 GLN A 67 6.140 -26.910 -6.260 1.00 0.00 N ATOM 0 H GLN A 67 3.387 -23.847 -4.070 1.00 0.00 H new ATOM 0 HA GLN A 67 4.811 -23.834 -6.653 1.00 0.00 H new ATOM 0 HB2 GLN A 67 2.139 -25.095 -5.975 1.00 0.00 H new ATOM 0 HB3 GLN A 67 3.106 -25.351 -7.414 1.00 0.00 H new ATOM 0 HG2 GLN A 67 4.464 -25.895 -4.794 1.00 0.00 H new ATOM 0 HG3 GLN A 67 3.184 -27.005 -5.245 1.00 0.00 H new ATOM 0 HE21 GLN A 67 6.408 -26.402 -5.417 1.00 0.00 H new ATOM 0 HE22 GLN A 67 6.855 -27.350 -6.839 1.00 0.00 H new ATOM 1042 N SER A 68 2.229 -22.078 -5.757 1.00 0.00 N ATOM 1043 CA SER A 68 1.375 -20.962 -6.126 1.00 0.00 C ATOM 1044 C SER A 68 2.071 -19.640 -5.800 1.00 0.00 C ATOM 1045 O SER A 68 1.899 -18.652 -6.512 1.00 0.00 O ATOM 1046 CB SER A 68 0.024 -21.042 -5.411 1.00 0.00 C ATOM 1047 OG SER A 68 -1.013 -20.413 -6.158 1.00 0.00 O ATOM 0 H SER A 68 2.155 -22.367 -4.782 1.00 0.00 H new ATOM 0 HA SER A 68 1.191 -21.013 -7.199 1.00 0.00 H new ATOM 0 HB2 SER A 68 -0.235 -22.087 -5.241 1.00 0.00 H new ATOM 0 HB3 SER A 68 0.103 -20.569 -4.432 1.00 0.00 H new ATOM 0 HG SER A 68 -1.859 -20.487 -5.669 1.00 0.00 H new ATOM 1053 N ARG A 69 2.842 -19.664 -4.722 1.00 0.00 N ATOM 1054 CA ARG A 69 3.565 -18.479 -4.293 1.00 0.00 C ATOM 1055 C ARG A 69 4.494 -17.991 -5.406 1.00 0.00 C ATOM 1056 O ARG A 69 4.797 -16.802 -5.491 1.00 0.00 O ATOM 1057 CB ARG A 69 4.390 -18.763 -3.036 1.00 0.00 C ATOM 1058 CG ARG A 69 3.762 -18.103 -1.807 1.00 0.00 C ATOM 1059 CD ARG A 69 4.718 -18.147 -0.613 1.00 0.00 C ATOM 1060 NE ARG A 69 5.725 -17.070 -0.731 1.00 0.00 N ATOM 1061 CZ ARG A 69 6.884 -17.047 -0.058 1.00 0.00 C ATOM 1062 NH1 ARG A 69 7.189 -18.044 0.785 1.00 0.00 N ATOM 1063 NH2 ARG A 69 7.738 -16.029 -0.228 1.00 0.00 N ATOM 0 H ARG A 69 2.981 -20.485 -4.133 1.00 0.00 H new ATOM 0 HA ARG A 69 2.830 -17.707 -4.065 1.00 0.00 H new ATOM 0 HB2 ARG A 69 4.461 -19.839 -2.879 1.00 0.00 H new ATOM 0 HB3 ARG A 69 5.406 -18.393 -3.172 1.00 0.00 H new ATOM 0 HG2 ARG A 69 3.507 -17.068 -2.036 1.00 0.00 H new ATOM 0 HG3 ARG A 69 2.832 -18.611 -1.552 1.00 0.00 H new ATOM 0 HD2 ARG A 69 4.159 -18.033 0.316 1.00 0.00 H new ATOM 0 HD3 ARG A 69 5.214 -19.117 -0.569 1.00 0.00 H new ATOM 0 HE ARG A 69 5.525 -16.296 -1.364 1.00 0.00 H new ATOM 0 HH11 ARG A 69 6.539 -18.820 0.914 1.00 0.00 H new ATOM 0 HH12 ARG A 69 8.071 -18.027 1.297 1.00 0.00 H new ATOM 0 HH21 ARG A 69 7.506 -15.271 -0.870 1.00 0.00 H new ATOM 0 HH22 ARG A 69 8.620 -16.012 0.284 1.00 0.00 H new ATOM 1077 N GLY A 70 4.921 -18.935 -6.232 1.00 0.00 N ATOM 1078 CA GLY A 70 5.810 -18.616 -7.337 1.00 0.00 C ATOM 1079 C GLY A 70 5.446 -17.268 -7.962 1.00 0.00 C ATOM 1080 O GLY A 70 6.327 -16.491 -8.327 1.00 0.00 O ATOM 0 H GLY A 70 4.668 -19.920 -6.158 1.00 0.00 H new ATOM 0 HA2 GLY A 70 6.841 -18.590 -6.983 1.00 0.00 H new ATOM 0 HA3 GLY A 70 5.752 -19.399 -8.093 1.00 0.00 H new ATOM 1084 N MET A 71 4.147 -17.031 -8.066 1.00 0.00 N ATOM 1085 CA MET A 71 3.656 -15.791 -8.641 1.00 0.00 C ATOM 1086 C MET A 71 3.350 -14.764 -7.549 1.00 0.00 C ATOM 1087 O MET A 71 3.891 -13.660 -7.560 1.00 0.00 O ATOM 1088 CB MET A 71 2.388 -16.069 -9.450 1.00 0.00 C ATOM 1089 CG MET A 71 2.620 -15.811 -10.940 1.00 0.00 C ATOM 1090 SD MET A 71 2.419 -17.326 -11.861 1.00 0.00 S ATOM 1091 CE MET A 71 1.216 -16.797 -13.069 1.00 0.00 C ATOM 0 H MET A 71 3.419 -17.677 -7.761 1.00 0.00 H new ATOM 0 HA MET A 71 4.430 -15.383 -9.291 1.00 0.00 H new ATOM 0 HB2 MET A 71 2.077 -17.103 -9.301 1.00 0.00 H new ATOM 0 HB3 MET A 71 1.577 -15.436 -9.090 1.00 0.00 H new ATOM 0 HG2 MET A 71 1.917 -15.060 -11.301 1.00 0.00 H new ATOM 0 HG3 MET A 71 3.622 -15.411 -11.096 1.00 0.00 H new ATOM 0 HE1 MET A 71 0.975 -17.629 -13.731 1.00 0.00 H new ATOM 0 HE2 MET A 71 0.311 -16.465 -12.560 1.00 0.00 H new ATOM 0 HE3 MET A 71 1.626 -15.974 -13.654 1.00 0.00 H new ATOM 1101 N TYR A 72 2.482 -15.165 -6.631 1.00 0.00 N ATOM 1102 CA TYR A 72 2.098 -14.293 -5.533 1.00 0.00 C ATOM 1103 C TYR A 72 3.326 -13.646 -4.891 1.00 0.00 C ATOM 1104 O TYR A 72 3.293 -12.472 -4.525 1.00 0.00 O ATOM 1105 CB TYR A 72 1.411 -15.192 -4.502 1.00 0.00 C ATOM 1106 CG TYR A 72 0.243 -14.524 -3.775 1.00 0.00 C ATOM 1107 CD1 TYR A 72 0.459 -13.393 -3.014 1.00 0.00 C ATOM 1108 CD2 TYR A 72 -1.028 -15.052 -3.880 1.00 0.00 C ATOM 1109 CE1 TYR A 72 -0.641 -12.764 -2.330 1.00 0.00 C ATOM 1110 CE2 TYR A 72 -2.128 -14.424 -3.195 1.00 0.00 C ATOM 1111 CZ TYR A 72 -1.880 -13.311 -2.454 1.00 0.00 C ATOM 1112 OH TYR A 72 -2.919 -12.717 -1.808 1.00 0.00 O ATOM 0 H TYR A 72 2.034 -16.081 -6.625 1.00 0.00 H new ATOM 0 HA TYR A 72 1.450 -13.492 -5.888 1.00 0.00 H new ATOM 0 HB2 TYR A 72 1.049 -16.090 -5.002 1.00 0.00 H new ATOM 0 HB3 TYR A 72 2.148 -15.513 -3.766 1.00 0.00 H new ATOM 0 HD1 TYR A 72 1.453 -12.980 -2.932 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -1.198 -15.936 -4.476 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -0.486 -11.878 -1.732 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -3.127 -14.828 -3.268 1.00 0.00 H new ATOM 0 HH TYR A 72 -3.744 -13.215 -1.988 1.00 0.00 H new ATOM 1122 N SER A 73 4.380 -14.440 -4.774 1.00 0.00 N ATOM 1123 CA SER A 73 5.617 -13.958 -4.182 1.00 0.00 C ATOM 1124 C SER A 73 6.270 -12.925 -5.102 1.00 0.00 C ATOM 1125 O SER A 73 6.447 -11.770 -4.717 1.00 0.00 O ATOM 1126 CB SER A 73 6.583 -15.113 -3.910 1.00 0.00 C ATOM 1127 OG SER A 73 7.896 -14.650 -3.605 1.00 0.00 O ATOM 0 H SER A 73 4.403 -15.413 -5.079 1.00 0.00 H new ATOM 0 HA SER A 73 5.379 -13.486 -3.229 1.00 0.00 H new ATOM 0 HB2 SER A 73 6.208 -15.712 -3.080 1.00 0.00 H new ATOM 0 HB3 SER A 73 6.622 -15.766 -4.782 1.00 0.00 H new ATOM 0 HG SER A 73 8.482 -15.417 -3.436 1.00 0.00 H new ATOM 1133 N ASN A 74 6.611 -13.378 -6.299 1.00 0.00 N ATOM 1134 CA ASN A 74 7.241 -12.507 -7.277 1.00 0.00 C ATOM 1135 C ASN A 74 6.546 -11.145 -7.263 1.00 0.00 C ATOM 1136 O ASN A 74 7.165 -10.125 -7.564 1.00 0.00 O ATOM 1137 CB ASN A 74 7.120 -13.085 -8.689 1.00 0.00 C ATOM 1138 CG ASN A 74 8.441 -12.957 -9.449 1.00 0.00 C ATOM 1139 OD1 ASN A 74 9.177 -11.994 -9.308 1.00 0.00 O ATOM 1140 ND2 ASN A 74 8.699 -13.978 -10.261 1.00 0.00 N ATOM 0 H ASN A 74 6.463 -14.337 -6.614 1.00 0.00 H new ATOM 0 HA ASN A 74 8.295 -12.413 -7.015 1.00 0.00 H new ATOM 0 HB2 ASN A 74 6.829 -14.134 -8.633 1.00 0.00 H new ATOM 0 HB3 ASN A 74 6.332 -12.564 -9.233 1.00 0.00 H new ATOM 0 HD21 ASN A 74 9.556 -13.986 -10.813 1.00 0.00 H new ATOM 0 HD22 ASN A 74 8.039 -14.753 -10.331 1.00 0.00 H new ATOM 1147 N ARG A 75 5.269 -11.171 -6.911 1.00 0.00 N ATOM 1148 CA ARG A 75 4.483 -9.950 -6.853 1.00 0.00 C ATOM 1149 C ARG A 75 4.719 -9.229 -5.525 1.00 0.00 C ATOM 1150 O ARG A 75 4.948 -8.021 -5.502 1.00 0.00 O ATOM 1151 CB ARG A 75 2.990 -10.249 -7.006 1.00 0.00 C ATOM 1152 CG ARG A 75 2.562 -10.171 -8.473 1.00 0.00 C ATOM 1153 CD ARG A 75 1.102 -10.595 -8.641 1.00 0.00 C ATOM 1154 NE ARG A 75 0.951 -11.414 -9.864 1.00 0.00 N ATOM 1155 CZ ARG A 75 -0.155 -12.105 -10.174 1.00 0.00 C ATOM 1156 NH1 ARG A 75 -1.213 -12.079 -9.352 1.00 0.00 N ATOM 1157 NH2 ARG A 75 -0.203 -12.821 -11.305 1.00 0.00 N ATOM 0 H ARG A 75 4.759 -12.019 -6.663 1.00 0.00 H new ATOM 0 HA ARG A 75 4.800 -9.312 -7.677 1.00 0.00 H new ATOM 0 HB2 ARG A 75 2.772 -11.242 -6.612 1.00 0.00 H new ATOM 0 HB3 ARG A 75 2.411 -9.538 -6.416 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.693 -9.153 -8.840 1.00 0.00 H new ATOM 0 HG3 ARG A 75 3.203 -10.813 -9.077 1.00 0.00 H new ATOM 0 HD2 ARG A 75 0.777 -11.164 -7.770 1.00 0.00 H new ATOM 0 HD3 ARG A 75 0.463 -9.714 -8.702 1.00 0.00 H new ATOM 0 HE ARG A 75 1.738 -11.455 -10.512 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -1.176 -11.534 -8.491 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -2.055 -12.605 -9.587 1.00 0.00 H new ATOM 0 HH21 ARG A 75 0.602 -12.841 -11.931 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -1.045 -13.347 -11.540 1.00 0.00 H new ATOM 1171 N MET A 76 4.654 -10.001 -4.450 1.00 0.00 N ATOM 1172 CA MET A 76 4.858 -9.450 -3.120 1.00 0.00 C ATOM 1173 C MET A 76 6.154 -8.640 -3.055 1.00 0.00 C ATOM 1174 O MET A 76 6.245 -7.667 -2.309 1.00 0.00 O ATOM 1175 CB MET A 76 4.915 -10.589 -2.100 1.00 0.00 C ATOM 1176 CG MET A 76 3.533 -10.856 -1.498 1.00 0.00 C ATOM 1177 SD MET A 76 3.563 -10.547 0.259 1.00 0.00 S ATOM 1178 CE MET A 76 2.139 -9.481 0.410 1.00 0.00 C ATOM 0 H MET A 76 4.463 -11.003 -4.472 1.00 0.00 H new ATOM 0 HA MET A 76 4.025 -8.785 -2.890 1.00 0.00 H new ATOM 0 HB2 MET A 76 5.287 -11.494 -2.580 1.00 0.00 H new ATOM 0 HB3 MET A 76 5.619 -10.337 -1.307 1.00 0.00 H new ATOM 0 HG2 MET A 76 2.790 -10.217 -1.975 1.00 0.00 H new ATOM 0 HG3 MET A 76 3.237 -11.887 -1.689 1.00 0.00 H new ATOM 0 HE1 MET A 76 2.052 -9.134 1.440 1.00 0.00 H new ATOM 0 HE2 MET A 76 2.254 -8.624 -0.253 1.00 0.00 H new ATOM 0 HE3 MET A 76 1.240 -10.034 0.136 1.00 0.00 H new ATOM 1188 N ARG A 77 7.125 -9.072 -3.846 1.00 0.00 N ATOM 1189 CA ARG A 77 8.412 -8.399 -3.888 1.00 0.00 C ATOM 1190 C ARG A 77 8.259 -6.997 -4.479 1.00 0.00 C ATOM 1191 O ARG A 77 8.901 -6.053 -4.021 1.00 0.00 O ATOM 1192 CB ARG A 77 9.420 -9.190 -4.723 1.00 0.00 C ATOM 1193 CG ARG A 77 10.298 -10.072 -3.833 1.00 0.00 C ATOM 1194 CD ARG A 77 11.755 -9.604 -3.864 1.00 0.00 C ATOM 1195 NE ARG A 77 12.456 -10.207 -5.020 1.00 0.00 N ATOM 1196 CZ ARG A 77 13.707 -9.896 -5.385 1.00 0.00 C ATOM 1197 NH1 ARG A 77 14.402 -8.988 -4.688 1.00 0.00 N ATOM 1198 NH2 ARG A 77 14.262 -10.493 -6.448 1.00 0.00 N ATOM 0 H ARG A 77 7.046 -9.880 -4.463 1.00 0.00 H new ATOM 0 HA ARG A 77 8.782 -8.327 -2.865 1.00 0.00 H new ATOM 0 HB2 ARG A 77 8.891 -9.810 -5.447 1.00 0.00 H new ATOM 0 HB3 ARG A 77 10.047 -8.502 -5.291 1.00 0.00 H new ATOM 0 HG2 ARG A 77 9.926 -10.046 -2.809 1.00 0.00 H new ATOM 0 HG3 ARG A 77 10.238 -11.107 -4.168 1.00 0.00 H new ATOM 0 HD2 ARG A 77 11.795 -8.517 -3.931 1.00 0.00 H new ATOM 0 HD3 ARG A 77 12.256 -9.885 -2.938 1.00 0.00 H new ATOM 0 HE ARG A 77 11.955 -10.903 -5.573 1.00 0.00 H new ATOM 0 HH11 ARG A 77 13.979 -8.533 -3.879 1.00 0.00 H new ATOM 0 HH12 ARG A 77 15.354 -8.751 -4.966 1.00 0.00 H new ATOM 0 HH21 ARG A 77 13.732 -11.184 -6.979 1.00 0.00 H new ATOM 0 HH22 ARG A 77 15.214 -10.257 -6.726 1.00 0.00 H new ATOM 1212 N SER A 78 7.404 -6.904 -5.487 1.00 0.00 N ATOM 1213 CA SER A 78 7.158 -5.633 -6.146 1.00 0.00 C ATOM 1214 C SER A 78 6.320 -4.728 -5.240 1.00 0.00 C ATOM 1215 O SER A 78 6.716 -3.602 -4.943 1.00 0.00 O ATOM 1216 CB SER A 78 6.456 -5.835 -7.490 1.00 0.00 C ATOM 1217 OG SER A 78 7.308 -5.523 -8.589 1.00 0.00 O ATOM 0 H SER A 78 6.873 -7.689 -5.863 1.00 0.00 H new ATOM 0 HA SER A 78 8.119 -5.156 -6.338 1.00 0.00 H new ATOM 0 HB2 SER A 78 6.122 -6.869 -7.573 1.00 0.00 H new ATOM 0 HB3 SER A 78 5.566 -5.208 -7.532 1.00 0.00 H new ATOM 0 HG SER A 78 6.824 -5.666 -9.429 1.00 0.00 H new ATOM 1223 N TYR A 79 5.176 -5.254 -4.827 1.00 0.00 N ATOM 1224 CA TYR A 79 4.279 -4.508 -3.961 1.00 0.00 C ATOM 1225 C TYR A 79 5.061 -3.717 -2.911 1.00 0.00 C ATOM 1226 O TYR A 79 5.001 -2.488 -2.882 1.00 0.00 O ATOM 1227 CB TYR A 79 3.411 -5.551 -3.254 1.00 0.00 C ATOM 1228 CG TYR A 79 2.502 -6.345 -4.195 1.00 0.00 C ATOM 1229 CD1 TYR A 79 2.374 -5.964 -5.515 1.00 0.00 C ATOM 1230 CD2 TYR A 79 1.811 -7.442 -3.723 1.00 0.00 C ATOM 1231 CE1 TYR A 79 1.518 -6.711 -6.400 1.00 0.00 C ATOM 1232 CE2 TYR A 79 0.956 -8.190 -4.608 1.00 0.00 C ATOM 1233 CZ TYR A 79 0.852 -7.787 -5.903 1.00 0.00 C ATOM 1234 OH TYR A 79 0.044 -8.493 -6.739 1.00 0.00 O ATOM 0 H TYR A 79 4.850 -6.188 -5.076 1.00 0.00 H new ATOM 0 HA TYR A 79 3.690 -3.797 -4.540 1.00 0.00 H new ATOM 0 HB2 TYR A 79 4.059 -6.246 -2.719 1.00 0.00 H new ATOM 0 HB3 TYR A 79 2.795 -5.050 -2.507 1.00 0.00 H new ATOM 0 HD1 TYR A 79 2.916 -5.106 -5.884 1.00 0.00 H new ATOM 0 HD2 TYR A 79 1.911 -7.740 -2.690 1.00 0.00 H new ATOM 0 HE1 TYR A 79 1.408 -6.423 -7.435 1.00 0.00 H new ATOM 0 HE2 TYR A 79 0.410 -9.051 -4.252 1.00 0.00 H new ATOM 0 HH TYR A 79 -0.125 -7.969 -7.550 1.00 0.00 H new ATOM 1244 N LYS A 80 5.778 -4.453 -2.075 1.00 0.00 N ATOM 1245 CA LYS A 80 6.571 -3.835 -1.026 1.00 0.00 C ATOM 1246 C LYS A 80 7.408 -2.703 -1.625 1.00 0.00 C ATOM 1247 O LYS A 80 7.407 -1.586 -1.109 1.00 0.00 O ATOM 1248 CB LYS A 80 7.401 -4.890 -0.290 1.00 0.00 C ATOM 1249 CG LYS A 80 6.593 -5.534 0.838 1.00 0.00 C ATOM 1250 CD LYS A 80 6.747 -7.056 0.822 1.00 0.00 C ATOM 1251 CE LYS A 80 5.444 -7.744 1.237 1.00 0.00 C ATOM 1252 NZ LYS A 80 5.263 -7.669 2.704 1.00 0.00 N ATOM 0 H LYS A 80 5.826 -5.471 -2.103 1.00 0.00 H new ATOM 0 HA LYS A 80 5.923 -3.388 -0.272 1.00 0.00 H new ATOM 0 HB2 LYS A 80 7.727 -5.657 -0.993 1.00 0.00 H new ATOM 0 HB3 LYS A 80 8.301 -4.430 0.119 1.00 0.00 H new ATOM 0 HG2 LYS A 80 6.926 -5.141 1.799 1.00 0.00 H new ATOM 0 HG3 LYS A 80 5.541 -5.270 0.733 1.00 0.00 H new ATOM 0 HD2 LYS A 80 7.034 -7.385 -0.177 1.00 0.00 H new ATOM 0 HD3 LYS A 80 7.549 -7.351 1.498 1.00 0.00 H new ATOM 0 HE2 LYS A 80 4.600 -7.270 0.736 1.00 0.00 H new ATOM 0 HE3 LYS A 80 5.459 -8.787 0.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 5.248 -8.630 3.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 6.049 -7.133 3.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 4.365 -7.191 2.919 1.00 0.00 H new ATOM 1266 N GLN A 81 8.102 -3.030 -2.705 1.00 0.00 N ATOM 1267 CA GLN A 81 8.941 -2.054 -3.379 1.00 0.00 C ATOM 1268 C GLN A 81 8.138 -0.789 -3.690 1.00 0.00 C ATOM 1269 O GLN A 81 8.495 0.301 -3.246 1.00 0.00 O ATOM 1270 CB GLN A 81 9.551 -2.643 -4.653 1.00 0.00 C ATOM 1271 CG GLN A 81 10.946 -3.209 -4.381 1.00 0.00 C ATOM 1272 CD GLN A 81 11.026 -4.685 -4.777 1.00 0.00 C ATOM 1273 OE1 GLN A 81 11.302 -5.557 -3.971 1.00 0.00 O ATOM 1274 NE2 GLN A 81 10.769 -4.914 -6.062 1.00 0.00 N ATOM 0 H GLN A 81 8.100 -3.957 -3.130 1.00 0.00 H new ATOM 0 HA GLN A 81 9.761 -1.786 -2.713 1.00 0.00 H new ATOM 0 HB2 GLN A 81 8.904 -3.430 -5.040 1.00 0.00 H new ATOM 0 HB3 GLN A 81 9.611 -1.873 -5.422 1.00 0.00 H new ATOM 0 HG2 GLN A 81 11.689 -2.638 -4.939 1.00 0.00 H new ATOM 0 HG3 GLN A 81 11.187 -3.099 -3.324 1.00 0.00 H new ATOM 0 HE21 GLN A 81 10.544 -4.137 -6.684 1.00 0.00 H new ATOM 0 HE22 GLN A 81 10.797 -5.867 -6.426 1.00 0.00 H new ATOM 1283 N GLU A 82 7.070 -0.976 -4.451 1.00 0.00 N ATOM 1284 CA GLU A 82 6.214 0.136 -4.826 1.00 0.00 C ATOM 1285 C GLU A 82 5.669 0.832 -3.577 1.00 0.00 C ATOM 1286 O GLU A 82 5.920 2.017 -3.363 1.00 0.00 O ATOM 1287 CB GLU A 82 5.075 -0.330 -5.734 1.00 0.00 C ATOM 1288 CG GLU A 82 4.119 0.822 -6.052 1.00 0.00 C ATOM 1289 CD GLU A 82 3.958 1.000 -7.563 1.00 0.00 C ATOM 1290 OE1 GLU A 82 3.093 0.296 -8.128 1.00 0.00 O ATOM 1291 OE2 GLU A 82 4.703 1.835 -8.119 1.00 0.00 O ATOM 0 H GLU A 82 6.778 -1.882 -4.818 1.00 0.00 H new ATOM 0 HA GLU A 82 6.811 0.855 -5.387 1.00 0.00 H new ATOM 0 HB2 GLU A 82 5.485 -0.733 -6.660 1.00 0.00 H new ATOM 0 HB3 GLU A 82 4.527 -1.139 -5.250 1.00 0.00 H new ATOM 0 HG2 GLU A 82 3.147 0.628 -5.600 1.00 0.00 H new ATOM 0 HG3 GLU A 82 4.497 1.745 -5.612 1.00 0.00 H new ATOM 1298 N MET A 83 4.935 0.066 -2.784 1.00 0.00 N ATOM 1299 CA MET A 83 4.353 0.594 -1.562 1.00 0.00 C ATOM 1300 C MET A 83 5.335 1.520 -0.843 1.00 0.00 C ATOM 1301 O MET A 83 5.077 2.714 -0.700 1.00 0.00 O ATOM 1302 CB MET A 83 3.971 -0.563 -0.637 1.00 0.00 C ATOM 1303 CG MET A 83 2.571 -0.360 -0.054 1.00 0.00 C ATOM 1304 SD MET A 83 2.674 0.551 1.478 1.00 0.00 S ATOM 1305 CE MET A 83 1.377 1.748 1.214 1.00 0.00 C ATOM 0 H MET A 83 4.730 -0.917 -2.964 1.00 0.00 H new ATOM 0 HA MET A 83 3.465 1.170 -1.824 1.00 0.00 H new ATOM 0 HB2 MET A 83 4.006 -1.502 -1.190 1.00 0.00 H new ATOM 0 HB3 MET A 83 4.698 -0.642 0.172 1.00 0.00 H new ATOM 0 HG2 MET A 83 1.946 0.179 -0.766 1.00 0.00 H new ATOM 0 HG3 MET A 83 2.096 -1.326 0.119 1.00 0.00 H new ATOM 0 HE1 MET A 83 1.340 2.436 2.058 1.00 0.00 H new ATOM 0 HE2 MET A 83 1.578 2.306 0.300 1.00 0.00 H new ATOM 0 HE3 MET A 83 0.420 1.234 1.122 1.00 0.00 H new ATOM 1315 N GLY A 84 6.442 0.935 -0.408 1.00 0.00 N ATOM 1316 CA GLY A 84 7.464 1.693 0.293 1.00 0.00 C ATOM 1317 C GLY A 84 7.865 2.937 -0.502 1.00 0.00 C ATOM 1318 O GLY A 84 8.176 3.976 0.080 1.00 0.00 O ATOM 0 H GLY A 84 6.653 -0.056 -0.528 1.00 0.00 H new ATOM 0 HA2 GLY A 84 7.094 1.988 1.275 1.00 0.00 H new ATOM 0 HA3 GLY A 84 8.339 1.065 0.458 1.00 0.00 H new ATOM 1322 N LYS A 85 7.846 2.791 -1.818 1.00 0.00 N ATOM 1323 CA LYS A 85 8.203 3.891 -2.698 1.00 0.00 C ATOM 1324 C LYS A 85 7.129 4.977 -2.614 1.00 0.00 C ATOM 1325 O LYS A 85 7.445 6.163 -2.541 1.00 0.00 O ATOM 1326 CB LYS A 85 8.451 3.381 -4.119 1.00 0.00 C ATOM 1327 CG LYS A 85 9.877 3.698 -4.575 1.00 0.00 C ATOM 1328 CD LYS A 85 10.343 2.711 -5.647 1.00 0.00 C ATOM 1329 CE LYS A 85 11.720 2.139 -5.304 1.00 0.00 C ATOM 1330 NZ LYS A 85 12.787 3.084 -5.701 1.00 0.00 N ATOM 0 H LYS A 85 7.589 1.928 -2.297 1.00 0.00 H new ATOM 0 HA LYS A 85 9.141 4.345 -2.378 1.00 0.00 H new ATOM 0 HB2 LYS A 85 8.284 2.305 -4.157 1.00 0.00 H new ATOM 0 HB3 LYS A 85 7.736 3.839 -4.803 1.00 0.00 H new ATOM 0 HG2 LYS A 85 9.919 4.714 -4.968 1.00 0.00 H new ATOM 0 HG3 LYS A 85 10.553 3.658 -3.721 1.00 0.00 H new ATOM 0 HD2 LYS A 85 9.621 1.900 -5.738 1.00 0.00 H new ATOM 0 HD3 LYS A 85 10.384 3.212 -6.614 1.00 0.00 H new ATOM 0 HE2 LYS A 85 11.782 1.940 -4.234 1.00 0.00 H new ATOM 0 HE3 LYS A 85 11.862 1.186 -5.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 13.715 2.680 -5.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 12.737 3.253 -6.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 12.660 3.984 -5.195 1.00 0.00 H new ATOM 1344 N LEU A 86 5.881 4.532 -2.626 1.00 0.00 N ATOM 1345 CA LEU A 86 4.758 5.451 -2.551 1.00 0.00 C ATOM 1346 C LEU A 86 4.955 6.394 -1.362 1.00 0.00 C ATOM 1347 O LEU A 86 4.513 7.541 -1.395 1.00 0.00 O ATOM 1348 CB LEU A 86 3.437 4.681 -2.513 1.00 0.00 C ATOM 1349 CG LEU A 86 2.780 4.409 -3.868 1.00 0.00 C ATOM 1350 CD1 LEU A 86 2.097 3.040 -3.881 1.00 0.00 C ATOM 1351 CD2 LEU A 86 1.816 5.535 -4.246 1.00 0.00 C ATOM 0 H LEU A 86 5.623 3.547 -2.687 1.00 0.00 H new ATOM 0 HA LEU A 86 4.713 6.071 -3.446 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.610 3.726 -2.017 1.00 0.00 H new ATOM 0 HB3 LEU A 86 2.732 5.238 -1.895 1.00 0.00 H new ATOM 0 HG LEU A 86 3.561 4.386 -4.628 1.00 0.00 H new ATOM 0 HD11 LEU A 86 1.638 2.872 -4.855 1.00 0.00 H new ATOM 0 HD12 LEU A 86 2.837 2.263 -3.689 1.00 0.00 H new ATOM 0 HD13 LEU A 86 1.329 3.009 -3.108 1.00 0.00 H new ATOM 0 HD21 LEU A 86 1.363 5.317 -5.213 1.00 0.00 H new ATOM 0 HD22 LEU A 86 1.036 5.615 -3.489 1.00 0.00 H new ATOM 0 HD23 LEU A 86 2.362 6.477 -4.305 1.00 0.00 H new ATOM 1363 N GLU A 87 5.617 5.874 -0.339 1.00 0.00 N ATOM 1364 CA GLU A 87 5.877 6.655 0.858 1.00 0.00 C ATOM 1365 C GLU A 87 6.891 7.762 0.561 1.00 0.00 C ATOM 1366 O GLU A 87 6.878 8.810 1.205 1.00 0.00 O ATOM 1367 CB GLU A 87 6.362 5.761 2.002 1.00 0.00 C ATOM 1368 CG GLU A 87 5.189 5.283 2.859 1.00 0.00 C ATOM 1369 CD GLU A 87 5.354 5.731 4.313 1.00 0.00 C ATOM 1370 OE1 GLU A 87 5.421 6.961 4.524 1.00 0.00 O ATOM 1371 OE2 GLU A 87 5.410 4.833 5.180 1.00 0.00 O ATOM 0 H GLU A 87 5.981 4.921 -0.314 1.00 0.00 H new ATOM 0 HA GLU A 87 4.943 7.120 1.174 1.00 0.00 H new ATOM 0 HB2 GLU A 87 6.894 4.901 1.596 1.00 0.00 H new ATOM 0 HB3 GLU A 87 7.070 6.310 2.622 1.00 0.00 H new ATOM 0 HG2 GLU A 87 4.256 5.677 2.457 1.00 0.00 H new ATOM 0 HG3 GLU A 87 5.121 4.196 2.815 1.00 0.00 H new ATOM 1378 N THR A 88 7.745 7.491 -0.416 1.00 0.00 N ATOM 1379 CA THR A 88 8.763 8.451 -0.807 1.00 0.00 C ATOM 1380 C THR A 88 8.192 9.457 -1.808 1.00 0.00 C ATOM 1381 O THR A 88 8.045 10.637 -1.492 1.00 0.00 O ATOM 1382 CB THR A 88 9.964 7.672 -1.347 1.00 0.00 C ATOM 1383 OG1 THR A 88 10.783 7.457 -0.200 1.00 0.00 O ATOM 1384 CG2 THR A 88 10.840 8.516 -2.276 1.00 0.00 C ATOM 0 H THR A 88 7.752 6.621 -0.948 1.00 0.00 H new ATOM 0 HA THR A 88 9.097 9.043 0.045 1.00 0.00 H new ATOM 0 HB THR A 88 9.613 6.789 -1.881 1.00 0.00 H new ATOM 0 HG1 THR A 88 11.584 6.956 -0.459 1.00 0.00 H new ATOM 0 HG21 THR A 88 11.678 7.916 -2.631 1.00 0.00 H new ATOM 0 HG22 THR A 88 10.248 8.853 -3.127 1.00 0.00 H new ATOM 0 HG23 THR A 88 11.219 9.381 -1.732 1.00 0.00 H new ATOM 1392 N ASP A 89 7.884 8.954 -2.994 1.00 0.00 N ATOM 1393 CA ASP A 89 7.331 9.794 -4.043 1.00 0.00 C ATOM 1394 C ASP A 89 6.289 10.737 -3.439 1.00 0.00 C ATOM 1395 O ASP A 89 6.227 11.912 -3.799 1.00 0.00 O ATOM 1396 CB ASP A 89 6.640 8.951 -5.117 1.00 0.00 C ATOM 1397 CG ASP A 89 7.052 9.272 -6.555 1.00 0.00 C ATOM 1398 OD1 ASP A 89 7.914 10.163 -6.713 1.00 0.00 O ATOM 1399 OD2 ASP A 89 6.495 8.619 -7.464 1.00 0.00 O ATOM 0 H ASP A 89 8.007 7.975 -3.252 1.00 0.00 H new ATOM 0 HA ASP A 89 8.151 10.352 -4.495 1.00 0.00 H new ATOM 0 HB2 ASP A 89 6.848 7.899 -4.922 1.00 0.00 H new ATOM 0 HB3 ASP A 89 5.562 9.085 -5.025 1.00 0.00 H new ATOM 1404 N PHE A 90 5.496 10.188 -2.530 1.00 0.00 N ATOM 1405 CA PHE A 90 4.460 10.966 -1.873 1.00 0.00 C ATOM 1406 C PHE A 90 5.053 12.197 -1.183 1.00 0.00 C ATOM 1407 O PHE A 90 4.492 13.289 -1.265 1.00 0.00 O ATOM 1408 CB PHE A 90 3.824 10.061 -0.817 1.00 0.00 C ATOM 1409 CG PHE A 90 2.955 10.806 0.199 1.00 0.00 C ATOM 1410 CD1 PHE A 90 2.315 11.950 -0.163 1.00 0.00 C ATOM 1411 CD2 PHE A 90 2.821 10.323 1.463 1.00 0.00 C ATOM 1412 CE1 PHE A 90 1.509 12.641 0.779 1.00 0.00 C ATOM 1413 CE2 PHE A 90 2.014 11.014 2.406 1.00 0.00 C ATOM 1414 CZ PHE A 90 1.375 12.159 2.044 1.00 0.00 C ATOM 0 H PHE A 90 5.550 9.214 -2.233 1.00 0.00 H new ATOM 0 HA PHE A 90 3.731 11.310 -2.607 1.00 0.00 H new ATOM 0 HB2 PHE A 90 3.215 9.308 -1.318 1.00 0.00 H new ATOM 0 HB3 PHE A 90 4.613 9.530 -0.285 1.00 0.00 H new ATOM 0 HD1 PHE A 90 2.420 12.333 -1.167 1.00 0.00 H new ATOM 0 HD2 PHE A 90 3.328 9.414 1.750 1.00 0.00 H new ATOM 0 HE1 PHE A 90 1.002 13.550 0.491 1.00 0.00 H new ATOM 0 HE2 PHE A 90 1.908 10.630 3.410 1.00 0.00 H new ATOM 0 HZ PHE A 90 0.762 12.685 2.761 1.00 0.00 H new ATOM 1424 N LYS A 91 6.179 11.979 -0.520 1.00 0.00 N ATOM 1425 CA LYS A 91 6.853 13.056 0.183 1.00 0.00 C ATOM 1426 C LYS A 91 7.643 13.899 -0.820 1.00 0.00 C ATOM 1427 O LYS A 91 7.806 15.104 -0.632 1.00 0.00 O ATOM 1428 CB LYS A 91 7.707 12.500 1.324 1.00 0.00 C ATOM 1429 CG LYS A 91 9.157 12.299 0.877 1.00 0.00 C ATOM 1430 CD LYS A 91 9.862 11.261 1.752 1.00 0.00 C ATOM 1431 CE LYS A 91 10.698 11.938 2.841 1.00 0.00 C ATOM 1432 NZ LYS A 91 12.073 11.390 2.853 1.00 0.00 N ATOM 0 H LYS A 91 6.641 11.072 -0.455 1.00 0.00 H new ATOM 0 HA LYS A 91 6.125 13.717 0.653 1.00 0.00 H new ATOM 0 HB2 LYS A 91 7.676 13.183 2.173 1.00 0.00 H new ATOM 0 HB3 LYS A 91 7.293 11.551 1.664 1.00 0.00 H new ATOM 0 HG2 LYS A 91 9.179 11.977 -0.164 1.00 0.00 H new ATOM 0 HG3 LYS A 91 9.692 13.247 0.929 1.00 0.00 H new ATOM 0 HD2 LYS A 91 9.123 10.605 2.211 1.00 0.00 H new ATOM 0 HD3 LYS A 91 10.504 10.634 1.133 1.00 0.00 H new ATOM 0 HE2 LYS A 91 10.730 13.014 2.667 1.00 0.00 H new ATOM 0 HE3 LYS A 91 10.231 11.786 3.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 12.627 11.860 3.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 12.038 10.368 3.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 12.521 11.557 1.930 1.00 0.00 H new ATOM 1446 N ARG A 92 8.111 13.233 -1.865 1.00 0.00 N ATOM 1447 CA ARG A 92 8.880 13.905 -2.899 1.00 0.00 C ATOM 1448 C ARG A 92 7.949 14.687 -3.828 1.00 0.00 C ATOM 1449 O ARG A 92 8.405 15.329 -4.773 1.00 0.00 O ATOM 1450 CB ARG A 92 9.689 12.903 -3.724 1.00 0.00 C ATOM 1451 CG ARG A 92 11.093 12.722 -3.144 1.00 0.00 C ATOM 1452 CD ARG A 92 11.931 11.786 -4.017 1.00 0.00 C ATOM 1453 NE ARG A 92 12.744 12.575 -4.970 1.00 0.00 N ATOM 1454 CZ ARG A 92 13.334 12.062 -6.058 1.00 0.00 C ATOM 1455 NH1 ARG A 92 13.206 10.757 -6.337 1.00 0.00 N ATOM 1456 NH2 ARG A 92 14.053 12.853 -6.866 1.00 0.00 N ATOM 0 H ARG A 92 7.972 12.234 -2.018 1.00 0.00 H new ATOM 0 HA ARG A 92 9.569 14.591 -2.407 1.00 0.00 H new ATOM 0 HB2 ARG A 92 9.173 11.943 -3.744 1.00 0.00 H new ATOM 0 HB3 ARG A 92 9.759 13.249 -4.755 1.00 0.00 H new ATOM 0 HG2 ARG A 92 11.586 13.691 -3.067 1.00 0.00 H new ATOM 0 HG3 ARG A 92 11.024 12.318 -2.134 1.00 0.00 H new ATOM 0 HD2 ARG A 92 12.581 11.176 -3.390 1.00 0.00 H new ATOM 0 HD3 ARG A 92 11.279 11.102 -4.561 1.00 0.00 H new ATOM 0 HE ARG A 92 12.862 13.571 -4.787 1.00 0.00 H new ATOM 0 HH11 ARG A 92 12.660 10.155 -5.721 1.00 0.00 H new ATOM 0 HH12 ARG A 92 13.655 10.366 -7.165 1.00 0.00 H new ATOM 0 HH21 ARG A 92 14.151 13.846 -6.653 1.00 0.00 H new ATOM 0 HH22 ARG A 92 14.502 12.462 -7.694 1.00 0.00 H new ATOM 1470 N SER A 93 6.661 14.606 -3.528 1.00 0.00 N ATOM 1471 CA SER A 93 5.662 15.298 -4.325 1.00 0.00 C ATOM 1472 C SER A 93 5.097 16.484 -3.541 1.00 0.00 C ATOM 1473 O SER A 93 4.934 17.574 -4.088 1.00 0.00 O ATOM 1474 CB SER A 93 4.535 14.350 -4.739 1.00 0.00 C ATOM 1475 OG SER A 93 3.471 14.339 -3.791 1.00 0.00 O ATOM 0 H SER A 93 6.286 14.072 -2.744 1.00 0.00 H new ATOM 0 HA SER A 93 6.142 15.666 -5.232 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.149 14.649 -5.713 1.00 0.00 H new ATOM 0 HB3 SER A 93 4.932 13.341 -4.850 1.00 0.00 H new ATOM 0 HG SER A 93 3.798 13.987 -2.937 1.00 0.00 H new ATOM 1481 N ARG A 94 4.812 16.232 -2.271 1.00 0.00 N ATOM 1482 CA ARG A 94 4.269 17.266 -1.407 1.00 0.00 C ATOM 1483 C ARG A 94 5.344 18.305 -1.081 1.00 0.00 C ATOM 1484 O ARG A 94 5.049 19.344 -0.493 1.00 0.00 O ATOM 1485 CB ARG A 94 3.735 16.668 -0.103 1.00 0.00 C ATOM 1486 CG ARG A 94 4.881 16.196 0.793 1.00 0.00 C ATOM 1487 CD ARG A 94 4.350 15.417 1.998 1.00 0.00 C ATOM 1488 NE ARG A 94 5.279 15.557 3.142 1.00 0.00 N ATOM 1489 CZ ARG A 94 5.348 16.643 3.924 1.00 0.00 C ATOM 1490 NH1 ARG A 94 4.544 17.689 3.692 1.00 0.00 N ATOM 1491 NH2 ARG A 94 6.222 16.682 4.940 1.00 0.00 N ATOM 0 H ARG A 94 4.947 15.327 -1.820 1.00 0.00 H new ATOM 0 HA ARG A 94 3.447 17.745 -1.939 1.00 0.00 H new ATOM 0 HB2 ARG A 94 3.139 17.412 0.425 1.00 0.00 H new ATOM 0 HB3 ARG A 94 3.075 15.830 -0.327 1.00 0.00 H new ATOM 0 HG2 ARG A 94 5.560 15.566 0.219 1.00 0.00 H new ATOM 0 HG3 ARG A 94 5.457 17.056 1.136 1.00 0.00 H new ATOM 0 HD2 ARG A 94 3.362 15.787 2.274 1.00 0.00 H new ATOM 0 HD3 ARG A 94 4.235 14.364 1.739 1.00 0.00 H new ATOM 0 HE ARG A 94 5.905 14.779 3.348 1.00 0.00 H new ATOM 0 HH11 ARG A 94 3.879 17.659 2.920 1.00 0.00 H new ATOM 0 HH12 ARG A 94 4.597 18.515 4.288 1.00 0.00 H new ATOM 0 HH21 ARG A 94 6.834 15.885 5.117 1.00 0.00 H new ATOM 0 HH22 ARG A 94 6.275 17.508 5.536 1.00 0.00 H new ATOM 1505 N ILE A 95 6.567 17.988 -1.479 1.00 0.00 N ATOM 1506 CA ILE A 95 7.687 18.882 -1.237 1.00 0.00 C ATOM 1507 C ILE A 95 7.807 19.869 -2.399 1.00 0.00 C ATOM 1508 O ILE A 95 8.791 20.600 -2.498 1.00 0.00 O ATOM 1509 CB ILE A 95 8.965 18.081 -0.975 1.00 0.00 C ATOM 1510 CG1 ILE A 95 9.312 17.196 -2.174 1.00 0.00 C ATOM 1511 CG2 ILE A 95 8.850 17.273 0.319 1.00 0.00 C ATOM 1512 CD1 ILE A 95 10.736 16.649 -2.057 1.00 0.00 C ATOM 0 H ILE A 95 6.807 17.125 -1.967 1.00 0.00 H new ATOM 0 HA ILE A 95 7.517 19.471 -0.335 1.00 0.00 H new ATOM 0 HB ILE A 95 9.788 18.784 -0.844 1.00 0.00 H new ATOM 0 HG12 ILE A 95 8.605 16.369 -2.237 1.00 0.00 H new ATOM 0 HG13 ILE A 95 9.214 17.770 -3.095 1.00 0.00 H new ATOM 0 HG21 ILE A 95 9.771 16.713 0.482 1.00 0.00 H new ATOM 0 HG22 ILE A 95 8.684 17.950 1.157 1.00 0.00 H new ATOM 0 HG23 ILE A 95 8.013 16.579 0.242 1.00 0.00 H new ATOM 0 HD11 ILE A 95 10.958 16.023 -2.922 1.00 0.00 H new ATOM 0 HD12 ILE A 95 11.442 17.478 -2.019 1.00 0.00 H new ATOM 0 HD13 ILE A 95 10.824 16.055 -1.147 1.00 0.00 H new ATOM 1524 N ALA A 96 6.792 19.858 -3.250 1.00 0.00 N ATOM 1525 CA ALA A 96 6.771 20.743 -4.402 1.00 0.00 C ATOM 1526 C ALA A 96 6.071 22.050 -4.023 1.00 0.00 C ATOM 1527 O ALA A 96 4.867 22.196 -4.230 1.00 0.00 O ATOM 1528 CB ALA A 96 6.091 20.037 -5.577 1.00 0.00 C ATOM 0 H ALA A 96 5.978 19.250 -3.165 1.00 0.00 H new ATOM 0 HA ALA A 96 7.786 20.991 -4.714 1.00 0.00 H new ATOM 0 HB1 ALA A 96 6.075 20.701 -6.441 1.00 0.00 H new ATOM 0 HB2 ALA A 96 6.643 19.131 -5.826 1.00 0.00 H new ATOM 0 HB3 ALA A 96 5.069 19.775 -5.302 1.00 0.00 H new ATOM 1534 N SER A 97 6.855 22.967 -3.476 1.00 0.00 N ATOM 1535 CA SER A 97 6.326 24.256 -3.066 1.00 0.00 C ATOM 1536 C SER A 97 7.413 25.327 -3.178 1.00 0.00 C ATOM 1537 O SER A 97 8.579 25.066 -2.888 1.00 0.00 O ATOM 1538 CB SER A 97 5.781 24.200 -1.638 1.00 0.00 C ATOM 1539 OG SER A 97 4.630 25.023 -1.472 1.00 0.00 O ATOM 0 H SER A 97 7.853 22.843 -3.307 1.00 0.00 H new ATOM 0 HA SER A 97 5.501 24.513 -3.730 1.00 0.00 H new ATOM 0 HB2 SER A 97 5.529 23.170 -1.387 1.00 0.00 H new ATOM 0 HB3 SER A 97 6.557 24.517 -0.941 1.00 0.00 H new ATOM 0 HG SER A 97 4.312 24.958 -0.547 1.00 0.00 H new ATOM 1545 N GLY A 98 6.991 26.511 -3.598 1.00 0.00 N ATOM 1546 CA GLY A 98 7.914 27.623 -3.751 1.00 0.00 C ATOM 1547 C GLY A 98 7.650 28.379 -5.055 1.00 0.00 C ATOM 1548 O GLY A 98 6.709 28.062 -5.781 1.00 0.00 O ATOM 0 H GLY A 98 6.023 26.724 -3.837 1.00 0.00 H new ATOM 0 HA2 GLY A 98 7.813 28.303 -2.905 1.00 0.00 H new ATOM 0 HA3 GLY A 98 8.939 27.253 -3.742 1.00 0.00 H new ATOM 1552 N PRO A 99 8.521 29.390 -5.319 1.00 0.00 N ATOM 1553 CA PRO A 99 8.391 30.194 -6.523 1.00 0.00 C ATOM 1554 C PRO A 99 8.864 29.418 -7.753 1.00 0.00 C ATOM 1555 O PRO A 99 9.898 29.742 -8.336 1.00 0.00 O ATOM 1556 CB PRO A 99 9.216 31.442 -6.253 1.00 0.00 C ATOM 1557 CG PRO A 99 10.148 31.085 -5.107 1.00 0.00 C ATOM 1558 CD PRO A 99 9.647 29.794 -4.482 1.00 0.00 C ATOM 0 HA PRO A 99 7.357 30.457 -6.745 1.00 0.00 H new ATOM 0 HB2 PRO A 99 9.780 31.736 -7.138 1.00 0.00 H new ATOM 0 HB3 PRO A 99 8.576 32.284 -5.988 1.00 0.00 H new ATOM 0 HG2 PRO A 99 11.169 30.962 -5.469 1.00 0.00 H new ATOM 0 HG3 PRO A 99 10.166 31.885 -4.367 1.00 0.00 H new ATOM 0 HD2 PRO A 99 10.426 29.031 -4.471 1.00 0.00 H new ATOM 0 HD3 PRO A 99 9.337 29.949 -3.449 1.00 0.00 H new ATOM 1566 N SER A 100 8.085 28.409 -8.113 1.00 0.00 N ATOM 1567 CA SER A 100 8.412 27.585 -9.264 1.00 0.00 C ATOM 1568 C SER A 100 7.593 26.293 -9.232 1.00 0.00 C ATOM 1569 O SER A 100 7.926 25.360 -8.504 1.00 0.00 O ATOM 1570 CB SER A 100 9.908 27.263 -9.305 1.00 0.00 C ATOM 1571 OG SER A 100 10.609 28.103 -10.218 1.00 0.00 O ATOM 0 H SER A 100 7.228 28.143 -7.628 1.00 0.00 H new ATOM 0 HA SER A 100 8.163 28.144 -10.166 1.00 0.00 H new ATOM 0 HB2 SER A 100 10.331 27.379 -8.307 1.00 0.00 H new ATOM 0 HB3 SER A 100 10.047 26.220 -9.591 1.00 0.00 H new ATOM 0 HG SER A 100 10.628 29.019 -9.871 1.00 0.00 H new ATOM 1577 N SER A 101 6.536 26.280 -10.031 1.00 0.00 N ATOM 1578 CA SER A 101 5.666 25.119 -10.104 1.00 0.00 C ATOM 1579 C SER A 101 6.220 24.113 -11.115 1.00 0.00 C ATOM 1580 O SER A 101 6.467 22.957 -10.775 1.00 0.00 O ATOM 1581 CB SER A 101 4.239 25.522 -10.482 1.00 0.00 C ATOM 1582 OG SER A 101 3.732 26.548 -9.634 1.00 0.00 O ATOM 0 H SER A 101 6.262 27.056 -10.634 1.00 0.00 H new ATOM 0 HA SER A 101 5.633 24.654 -9.119 1.00 0.00 H new ATOM 0 HB2 SER A 101 4.221 25.865 -11.517 1.00 0.00 H new ATOM 0 HB3 SER A 101 3.588 24.649 -10.424 1.00 0.00 H new ATOM 0 HG SER A 101 2.820 26.778 -9.909 1.00 0.00 H new ATOM 1588 N GLY A 102 6.398 24.590 -12.338 1.00 0.00 N ATOM 1589 CA GLY A 102 6.918 23.747 -13.402 1.00 0.00 C ATOM 1590 C GLY A 102 6.161 23.984 -14.710 1.00 0.00 C ATOM 1591 O GLY A 102 6.224 25.073 -15.278 1.00 0.00 O ATOM 0 H GLY A 102 6.192 25.549 -12.616 1.00 0.00 H new ATOM 0 HA2 GLY A 102 7.978 23.953 -13.549 1.00 0.00 H new ATOM 0 HA3 GLY A 102 6.834 22.699 -13.114 1.00 0.00 H new TER 1595 GLY A 102